#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r1n s ILE 2 N 0.00 0.11 -0.39 0.53 -4.36 -0.88 -4.89 121.20 111.32 1r1n s ILE 2 Ca 0.00 -0.71 -0.05 0.00 -0.26 0.00 0.00 60.65 59.62 1r1n s ILE 2 Cb 0.00 -0.22 0.08 0.00 1.25 0.00 0.00 42.46 43.57 1r1n s ILE 2 CO 0.00 -0.38 0.18 -0.89 0.24 0.00 0.00 174.94 174.09 1r1n s THR 3 N -1.13 3.60 -0.28 8.37 2.01 -1.26 -0.85 115.64 126.10 1r1n s THR 3 Ca -0.12 -1.65 -0.12 0.00 0.31 0.00 0.00 61.69 60.11 1r1n s THR 3 Cb -0.08 -3.27 -0.05 0.00 0.01 0.00 0.00 72.50 69.11 1r1n s THR 3 CO -0.01 -0.49 0.22 -0.69 -0.69 0.00 0.00 174.62 172.96 1r1n s VAL 4 N 1.28 5.29 -0.48 3.82 1.01 0.35 -0.49 120.40 131.17 1r1n s VAL 4 Ca 0.03 0.22 -0.29 0.00 0.00 0.00 0.00 61.98 61.95 1r1n s VAL 4 Cb -0.22 -3.56 0.02 0.00 0.00 0.00 0.00 36.38 32.62 1r1n s VAL 4 CO -0.01 0.22 1.25 -0.31 0.00 0.00 0.00 175.10 176.25 1r1n s TYR 5 N 1.81 2.62 -0.27 5.22 1.51 -0.56 -1.65 117.35 126.04 1r1n s TYR 5 Ca 0.08 0.65 -0.18 0.00 -1.01 0.00 0.00 57.07 56.61 1r1n s TYR 5 Cb -0.16 -4.41 -0.03 0.00 -0.11 0.00 0.00 41.96 37.25 1r1n s TYR 5 CO 0.11 -1.58 0.51 1.21 -1.11 0.00 0.00 175.55 174.70 1r1n s ASN 6 N 3.11 6.43 0.00 2.29 2.47 0.29 -2.00 114.94 127.53 1r1n s ASN 6 Ca 0.52 0.50 0.08 0.00 0.42 0.00 0.00 52.86 54.37 1r1n s ASN 6 Cb -0.09 -2.28 0.07 0.00 -1.45 0.00 0.00 41.25 37.50 1r1n s ASN 6 CO 0.31 -0.30 0.77 0.61 -3.72 0.00 0.00 177.10 174.77 1r1n n GLY 7 N 4.41 -0.56 3.42 1.21 0.00 0.20 0.45 105.19 114.33 1r1n n GLY 7 Ca -0.04 -0.23 -0.21 0.00 0.00 0.00 0.00 46.02 45.54 1r1n n GLY 7 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1r1n n GLN 8 N 0.44 -0.09 -2.45 1.61 -0.06 -1.22 -3.36 117.38 112.26 1r1n n GLN 8 Ca 0.05 -2.37 -0.41 0.00 -2.00 0.00 0.00 57.00 52.27 1r1n n GLN 8 Cb 0.21 -0.62 -0.03 0.00 -4.06 0.00 0.00 30.24 25.73 1r1n n GLN 8 CO 0.00 0.00 0.00 -1.58 -0.20 0.00 0.00 177.06 175.28 1r1n s HIS 9 N -2.75 3.50 0.30 3.69 5.04 -1.26 -4.84 115.29 118.97 1r1n s HIS 9 Ca 0.59 1.45 0.02 0.00 -1.54 0.00 0.00 55.06 55.57 1r1n s HIS 9 Cb -0.03 -3.36 0.74 0.00 0.04 0.00 0.00 32.58 29.96 1r1n s HIS 9 CO 0.39 -0.99 1.58 0.87 -2.34 0.00 0.00 174.74 174.26 1r1n h LYS 10 N 5.78 0.03 -0.12 2.88 1.57 -1.97 0.86 116.57 125.61 1r1n h LYS 10 Ca -0.43 -0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.26 1r1n h LYS 10 Cb 1.21 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.50 1r1n h LYS 10 CO 0.76 0.02 -0.30 1.49 -0.57 0.00 0.00 179.45 180.85 1r1n h GLU 11 N 0.04 0.23 0.00 3.15 4.81 -1.98 0.28 114.58 121.12 1r1n h GLU 11 Ca 0.59 -0.09 -0.19 0.00 -0.13 0.00 0.00 59.36 59.54 1r1n h GLU 11 Cb 1.21 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 30.54 1r1n h GLU 11 CO -0.87 0.52 -0.95 0.00 -0.73 0.00 0.00 179.01 176.98 1r1n h ALA 12 N 1.48 0.47 0.00 2.92 0.00 0.17 -2.26 119.26 122.04 1r1n h ALA 12 Ca 0.03 -0.84 -0.21 0.00 0.00 0.00 0.00 54.91 53.89 1r1n h ALA 12 Cb 0.65 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.32 1r1n h ALA 12 CO 0.05 1.12 -1.39 0.00 0.00 0.00 0.00 179.25 179.03 1r1n h ALA 13 N 1.13 0.67 0.02 0.00 0.00 -0.23 -3.18 119.26 117.66 1r1n h ALA 13 Ca -0.03 -1.03 -0.24 0.00 0.00 0.00 0.00 54.91 53.60 1r1n h ALA 13 Cb 1.69 0.28 -0.03 0.00 0.00 0.00 0.00 17.79 19.73 1r1n h ALA 13 CO 0.11 1.16 -1.21 0.37 0.00 0.00 0.00 179.25 179.68 1r1n h GLN 14 N 0.00 0.04 0.27 0.00 5.75 -0.52 -2.03 115.11 118.62 1r1n h GLN 14 Ca -0.18 -0.06 -0.01 0.00 -0.15 0.00 0.00 58.65 58.25 1r1n h GLN 14 Cb 1.74 0.02 0.00 0.00 1.07 0.00 0.00 27.48 30.31 1r1n h GLN 14 CO 0.07 0.91 -0.13 0.00 -2.65 0.00 0.00 178.83 177.03 1r1n h ALA 15 N 0.93 -0.37 -0.38 3.38 0.00 -1.52 0.25 119.26 121.55 1r1n h ALA 15 Ca -0.10 -0.17 -0.09 0.00 0.00 0.00 0.00 54.91 54.56 1r1n h ALA 15 Cb 1.85 0.14 -0.02 0.00 0.00 0.00 0.00 17.79 19.77 1r1n h ALA 15 CO 0.13 -0.57 -0.13 -0.39 0.00 0.00 0.00 179.25 178.29 1r1n h VAL 16 N -0.65 1.25 -0.42 0.00 -1.51 -1.67 -1.06 116.25 112.18 1r1n h VAL 16 Ca -0.04 -1.14 -0.10 0.00 -1.23 0.00 0.00 66.70 64.19 1r1n h VAL 16 Cb 0.46 1.10 -0.01 0.00 -2.13 0.00 0.00 31.29 30.71 1r1n h VAL 16 CO 0.06 0.38 -0.14 0.00 -1.23 0.00 0.00 177.57 176.64 1r1n h ALA 17 N 1.25 0.59 -0.19 5.19 0.00 -1.29 0.26 119.26 125.07 1r1n h ALA 17 Ca 0.10 -0.35 -0.17 0.00 0.00 0.00 0.00 54.91 54.50 1r1n h ALA 17 Cb 0.57 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 1r1n h ALA 17 CO 0.04 0.50 -0.59 -0.44 0.00 0.00 0.00 179.25 178.76 1r1n h ASP 18 N 0.67 0.68 -0.46 0.00 3.32 -0.39 -1.95 116.42 118.29 1r1n h ASP 18 Ca 0.10 -0.38 -0.11 0.00 0.02 0.00 0.00 57.03 56.66 1r1n h ASP 18 Cb 0.69 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 40.03 1r1n h ASP 18 CO 0.05 1.12 -0.14 0.00 -1.72 0.00 0.00 179.24 178.55 1r1n h ALA 19 N 0.89 0.64 -0.55 3.45 0.00 -1.05 -2.57 119.26 120.07 1r1n h ALA 19 Ca 0.00 -0.35 -0.03 0.00 0.00 0.00 0.00 54.91 54.53 1r1n h ALA 19 Cb 1.15 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.75 1r1n h ALA 19 CO 0.11 0.56 0.22 0.35 0.00 0.00 0.00 179.25 180.49 1r1n h PHE 20 N 0.76 0.85 0.00 0.00 3.57 -0.43 -2.45 116.94 119.22 1r1n h PHE 20 Ca 0.11 -0.07 -0.01 0.00 3.53 0.00 0.00 57.97 61.54 1r1n h PHE 20 Cb 0.69 -0.25 -0.00 0.00 2.79 0.00 0.00 35.95 39.18 1r1n h PHE 20 CO 0.05 0.69 -0.03 1.15 -2.23 0.00 0.00 178.31 177.94 1r1n h THR 21 N 0.76 0.13 0.08 4.41 2.02 -1.21 -2.49 112.91 116.60 1r1n h THR 21 Ca 0.18 -0.34 -0.00 0.00 0.77 0.00 0.00 66.41 67.02 1r1n h THR 21 Cb 0.21 1.30 0.00 0.00 -1.74 0.00 0.00 68.15 67.92 1r1n h THR 21 CO -0.01 0.03 -0.04 0.03 0.37 0.00 0.00 175.52 175.90 1r1n h ARG 22 N 0.00 -0.10 -0.57 6.66 3.08 -1.03 -0.02 114.38 122.40 1r1n h ARG 22 Ca -0.00 0.01 0.05 0.00 0.07 0.00 0.00 59.98 60.10 1r1n h ARG 22 Cb 0.30 0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.34 1r1n h ARG 22 CO 0.00 0.09 0.38 0.00 -1.07 0.00 0.00 179.97 179.37 1r1n h ALA 23 N -0.84 1.77 0.00 0.04 0.00 -1.47 -3.32 119.26 115.44 1r1n h ALA 23 Ca -0.01 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.76 1r1n h ALA 23 Cb 0.23 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1r1n h ALA 23 CO 0.02 0.15 -1.42 0.25 0.00 0.00 0.00 179.25 178.25 1r1n n THR 24 N -4.47 0.42 -0.42 0.00 -2.24 -0.94 -5.03 114.28 101.60 1r1n n THR 24 Ca 0.07 -0.24 0.00 0.00 -2.27 0.00 0.00 64.05 61.62 1r1n n THR 24 Cb 0.19 -0.82 0.00 0.00 -2.10 0.00 0.00 70.33 67.59 1r1n n THR 24 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1r1n n GLY 25 N 2.74 0.77 3.61 3.38 0.00 -0.02 -5.05 105.19 110.62 1r1n n GLY 25 Ca -0.11 -0.25 -0.40 0.00 0.00 0.00 0.00 46.02 45.27 1r1n n GLY 25 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1r1n s ILE 26 N -2.00 5.11 0.37 -0.61 1.01 -1.25 -5.01 121.20 118.82 1r1n s ILE 26 Ca 0.00 0.73 -0.27 0.00 0.00 0.00 0.00 60.65 61.12 1r1n s ILE 26 Cb 0.00 -3.78 -0.09 0.00 0.01 0.00 0.00 42.46 38.60 1r1n s ILE 26 CO 0.00 0.10 1.22 -0.54 0.00 0.00 0.00 174.94 175.71 1r1n s LYS 27 N 2.22 4.16 0.05 2.79 1.02 -1.26 -4.20 119.74 124.53 1r1n s LYS 27 Ca 0.19 1.97 0.09 0.00 0.02 0.00 0.00 55.97 58.24 1r1n s LYS 27 Cb -0.16 -2.83 -0.03 0.00 -0.52 0.00 0.00 37.83 34.30 1r1n s LYS 27 CO 0.10 -0.27 -0.23 0.08 -0.92 0.00 0.00 175.35 174.10 1r1n s VAL 28 N -1.30 2.42 -0.30 3.17 1.01 -1.26 -2.07 120.40 122.07 1r1n s VAL 28 Ca 0.54 -1.35 0.02 0.00 0.00 0.00 0.00 61.98 61.19 1r1n s VAL 28 Cb -0.34 -1.99 0.08 0.00 0.00 0.00 0.00 36.38 34.12 1r1n s VAL 28 CO 0.44 0.32 -0.02 -0.54 0.00 0.00 0.00 175.10 175.29 1r1n s LYS 29 N -1.42 2.00 -1.01 2.72 1.02 -0.03 -4.97 119.74 118.05 1r1n s LYS 29 Ca 0.13 -1.54 -0.15 0.00 0.02 0.00 0.00 55.97 54.43 1r1n s LYS 29 Cb -0.10 -3.08 0.18 0.00 -0.52 0.00 0.00 37.83 34.31 1r1n s LYS 29 CO 0.04 -0.73 1.13 -0.51 -0.92 0.00 0.00 175.35 174.36 1r1n s LEU 30 N 1.06 5.59 -0.66 3.17 1.43 -1.26 -0.50 118.68 127.51 1r1n s LEU 30 Ca -0.01 -2.64 -0.27 0.00 -1.03 0.00 0.00 54.13 50.18 1r1n s LEU 30 Cb -0.20 -2.33 0.01 0.00 0.03 0.00 0.00 46.19 43.70 1r1n s LEU 30 CO -0.05 -0.77 1.51 0.21 0.23 0.00 0.00 176.35 177.47 1r1n s ASN 31 N 2.80 5.85 0.08 2.29 2.47 -0.66 -4.79 114.94 122.99 1r1n s ASN 31 Ca 0.32 -0.02 -0.04 0.00 0.42 0.00 0.00 52.86 53.54 1r1n s ASN 31 Cb -0.06 -2.55 -0.05 0.00 -1.45 0.00 0.00 41.25 37.14 1r1n s ASN 31 CO -0.07 -1.99 0.30 -0.44 -3.72 0.00 0.00 177.10 171.18 1r1n s SER 32 N 5.37 6.46 0.00 -4.21 0.01 -1.26 0.10 113.70 120.18 1r1n s SER 32 Ca 0.50 0.50 0.00 0.00 1.31 0.00 0.00 55.95 58.26 1r1n s SER 32 Cb -0.10 -2.06 0.00 0.00 0.21 0.00 0.00 66.02 64.07 1r1n s SER 32 CO 0.19 0.15 0.00 0.00 0.41 0.00 0.00 173.24 173.99 1r1n n ALA 33 N 0.48 0.00 -2.46 1.44 0.00 0.17 -4.90 120.51 115.23 1r1n n ALA 33 Ca -0.06 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.00 1r1n n ALA 33 Cb 0.52 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.91 1r1n n ALA 33 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1r1n s LYS 34 N 0.64 4.14 0.28 0.00 -0.14 -1.26 -3.90 119.74 119.50 1r1n s LYS 34 Ca 0.00 0.57 -0.01 0.00 -1.36 0.00 0.00 55.97 55.17 1r1n s LYS 34 Cb 0.00 -3.28 0.65 0.00 -1.68 0.00 0.00 37.83 33.52 1r1n s LYS 34 CO 0.00 0.53 1.61 0.78 -0.76 0.00 0.00 175.35 177.51 1r1n h GLY 35 N 5.15 1.17 0.61 -3.33 0.00 -1.86 -2.05 103.07 102.75 1r1n h GLY 35 Ca -0.48 0.09 0.07 0.00 0.00 0.00 0.00 47.33 47.00 1r1n h GLY 35 CO 0.66 -0.41 0.31 -0.55 0.00 0.00 0.00 176.54 176.55 1r1n h ASP 36 N 0.09 0.43 1.19 0.19 5.19 -1.95 -2.76 116.42 118.80 1r1n h ASP 36 Ca 0.53 0.04 -0.16 0.00 -0.62 0.00 0.00 57.03 56.83 1r1n h ASP 36 Cb 1.06 -0.04 -0.02 0.00 0.18 0.00 0.00 39.33 40.51 1r1n h ASP 36 CO -0.77 0.28 -0.75 0.06 -3.12 0.00 0.00 179.24 174.93 1r1n h GLN 37 N 0.57 0.00 -0.29 3.56 3.07 -1.80 -3.24 115.11 116.98 1r1n h GLN 37 Ca 0.29 0.00 -0.05 0.00 0.09 0.00 0.00 58.65 58.98 1r1n h GLN 37 Cb 0.23 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 27.78 1r1n h GLN 37 CO -0.21 0.75 0.00 -0.07 0.09 0.00 0.00 178.83 179.40 1r1n h LEU 38 N 0.00 0.50 -1.34 0.06 3.38 -1.24 0.08 115.31 116.75 1r1n h LEU 38 Ca -0.01 -0.31 0.08 0.00 0.09 0.00 0.00 57.88 57.73 1r1n h LEU 38 Cb 1.55 -0.13 -0.05 0.00 0.09 0.00 0.00 40.66 42.11 1r1n h LEU 38 CO 0.10 0.69 0.51 0.00 0.09 0.00 0.00 178.44 179.82 1r1n h ALA 39 N 0.83 1.70 -0.22 1.53 0.00 -1.59 0.18 119.26 121.70 1r1n h ALA 39 Ca 0.08 -0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.85 1r1n h ALA 39 Cb 0.43 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 1r1n h ALA 39 CO 0.01 0.16 -0.37 0.78 0.00 0.00 0.00 179.25 179.84 1r1n h GLY 40 N 0.78 0.69 2.00 0.00 0.00 -1.51 -0.82 103.07 104.21 1r1n h GLY 40 Ca 0.34 -0.79 -0.01 0.00 0.00 0.00 0.00 47.33 46.87 1r1n h GLY 40 CO -0.12 0.71 -0.05 -1.61 0.00 0.00 0.00 176.54 175.46 1r1n h GLN 41 N 0.32 0.00 0.10 4.80 4.15 0.48 0.13 115.11 125.10 1r1n h GLN 41 Ca 0.02 0.00 -0.24 0.00 0.77 0.00 0.00 58.65 59.20 1r1n h GLN 41 Cb 0.96 0.00 0.02 0.00 0.21 0.00 0.00 27.48 28.67 1r1n h GLN 41 CO 0.08 0.05 -0.99 0.82 -1.93 0.00 0.00 178.83 176.87 1r1n h ILE 42 N 0.00 1.38 -0.72 2.39 2.04 -0.44 -2.74 117.51 119.42 1r1n h ILE 42 Ca -0.00 -2.39 -0.04 0.00 1.00 0.00 0.00 64.86 63.43 1r1n h ILE 42 Cb 0.10 2.82 -0.03 0.00 -0.74 0.00 0.00 36.82 38.97 1r1n h ILE 42 CO 0.01 0.71 0.30 0.11 0.00 0.00 0.00 178.15 179.27 1r1n h LYS 43 N 0.01 1.05 -0.18 2.37 1.57 -0.20 -1.51 116.57 119.68 1r1n h LYS 43 Ca -0.15 -0.17 -0.01 0.00 -1.87 0.00 0.00 60.65 58.45 1r1n h LYS 43 Cb 1.71 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 33.83 1r1n h LYS 43 CO 0.19 0.85 0.09 0.93 -0.57 0.00 0.00 179.45 180.93 1r1n h GLU 44 N 1.03 0.26 0.00 3.15 5.08 -0.82 -2.73 114.58 120.55 1r1n h GLU 44 Ca 0.24 -0.04 -0.06 0.00 -1.00 0.00 0.00 59.36 58.50 1r1n h GLU 44 Cb 0.18 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 1r1n h GLU 44 CO -0.02 0.29 -0.30 0.93 -1.00 0.00 0.00 179.01 178.91 1r1n h GLU 45 N 0.16 0.00 0.00 2.33 5.08 -1.31 -3.48 114.58 117.36 1r1n h GLU 45 Ca 0.06 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1r1n h GLU 45 Cb 0.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.37 1r1n h GLU 45 CO -0.01 0.30 0.00 0.41 -1.00 0.00 0.00 179.01 178.71 1r1n n GLY 46 N -0.41 3.71 0.22 -3.84 0.00 -0.58 0.11 105.19 104.39 1r1n n GLY 46 Ca -0.02 -0.07 0.15 0.00 0.00 0.00 0.00 46.02 46.09 1r1n n GLY 46 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1r1n h SER 47 N 0.00 0.00 -0.76 1.61 4.64 -1.91 -2.86 113.55 114.27 1r1n h SER 47 Ca 0.00 0.00 -0.51 0.00 -0.47 0.00 0.00 61.79 60.81 1r1n h SER 47 Cb 0.00 0.00 -0.22 0.00 -0.31 0.00 0.00 62.40 61.87 1r1n h SER 47 CO 0.00 0.00 0.66 0.54 -0.87 0.00 0.00 176.83 177.16 1r1n n ARG 48 N -2.64 2.27 -3.49 4.77 5.12 0.12 -4.89 116.66 117.92 1r1n n ARG 48 Ca -0.00 -2.49 -0.38 0.00 -1.93 0.00 0.00 57.85 53.04 1r1n n ARG 48 Cb 0.17 -1.98 -0.09 0.00 -1.16 0.00 0.00 32.46 29.40 1r1n n ARG 48 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 1r1n s SER 49 N -0.91 6.21 0.46 0.55 0.15 -1.08 -4.72 113.70 114.36 1r1n s SER 49 Ca 0.49 0.23 0.12 0.00 0.70 0.00 0.00 55.95 57.49 1r1n s SER 49 Cb 0.39 -2.17 1.05 0.00 -1.71 0.00 0.00 66.02 63.58 1r1n s SER 49 CO -0.00 -0.09 2.09 -0.65 1.20 0.00 0.00 173.24 175.79 1r1n h PRO 50 N 7.94 0.23 -6.28 5.44 0.11 -1.93 -3.45 132.00 134.08 1r1n h PRO 50 Ca -0.34 -0.02 -0.68 0.00 0.11 0.00 0.00 66.00 65.07 1r1n h PRO 50 Cb 1.17 -0.05 0.06 0.00 0.11 0.00 0.00 31.00 32.29 1r1n h PRO 50 CO 0.64 0.18 0.44 0.00 -0.21 0.00 0.00 178.00 179.05 1r1n n ALA 51 N -2.51 -0.96 -0.10 -0.75 0.00 -1.26 -4.63 120.51 110.30 1r1n n ALA 51 Ca -0.00 0.51 -0.15 0.00 0.00 0.00 0.00 53.44 53.80 1r1n n ALA 51 Cb 0.10 -2.07 -0.10 0.00 0.00 0.00 0.00 19.45 17.38 1r1n n ALA 51 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1r1n n ASP 52 N 2.49 2.34 -4.21 0.00 9.92 0.35 -4.46 116.55 122.97 1r1n n ASP 52 Ca 0.18 -0.09 -0.19 0.00 -0.53 0.00 0.00 54.79 54.16 1r1n n ASP 52 Cb 0.19 -0.35 -0.12 0.00 -0.64 0.00 0.00 41.12 40.21 1r1n n ASP 52 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1r1n s VAL 53 N -2.42 1.27 -0.19 2.53 1.01 -1.15 -1.41 120.40 120.04 1r1n s VAL 53 Ca -0.28 -1.48 0.01 0.00 0.00 0.00 0.00 61.98 60.23 1r1n s VAL 53 Cb 0.07 -1.30 0.04 0.00 0.00 0.00 0.00 36.38 35.20 1r1n s VAL 53 CO 0.48 -0.26 -0.10 0.12 0.00 0.00 0.00 175.10 175.33 1r1n s PHE 54 N -1.54 2.35 -0.37 5.22 5.36 0.27 -1.50 117.98 127.76 1r1n s PHE 54 Ca 0.03 -1.54 -0.07 0.00 -0.96 0.00 0.00 56.93 54.39 1r1n s PHE 54 Cb -0.08 -1.61 0.06 0.00 -0.34 0.00 0.00 43.02 41.05 1r1n s PHE 54 CO 0.03 -0.73 0.17 -0.47 -1.46 0.00 0.00 175.22 172.75 1r1n s TYR 55 N 1.42 3.32 0.09 10.12 5.04 -0.85 -0.66 117.35 135.83 1r1n s TYR 55 Ca -0.01 -1.58 0.08 0.00 -2.44 0.00 0.00 57.07 53.13 1r1n s TYR 55 Cb -0.16 -2.61 -0.04 0.00 0.35 0.00 0.00 41.96 39.50 1r1n s TYR 55 CO -0.08 -0.80 -0.19 -1.54 -1.34 0.00 0.00 175.55 171.60 1r1n s SER 56 N 1.69 3.75 0.00 4.32 1.04 0.13 0.59 113.70 125.23 1r1n s SER 56 Ca 0.01 -0.53 0.21 0.00 0.48 0.00 0.00 55.95 56.12 1r1n s SER 56 Cb -0.21 -0.52 0.78 0.00 0.10 0.00 0.00 66.02 66.17 1r1n s SER 56 CO 0.02 0.21 1.57 -1.84 0.98 0.00 0.00 173.24 174.18 1r1n n GLU 57 N 1.15 1.72 -4.80 4.02 0.00 -1.21 -0.83 120.64 120.69 1r1n n GLU 57 Ca -0.16 -1.08 -0.25 0.00 0.00 0.00 0.00 57.16 55.67 1r1n n GLU 57 Cb 0.52 -1.40 -0.16 0.00 0.00 0.00 0.00 31.44 30.40 1r1n n GLU 57 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.13 176.48 1r1n s GLN 58 N -1.81 1.62 -0.03 3.44 -1.52 -1.26 -4.56 119.66 115.54 1r1n s GLN 58 Ca 0.33 -0.59 -0.19 0.00 -1.95 0.00 0.00 55.36 52.97 1r1n s GLN 58 Cb 0.18 -1.45 -0.32 0.00 -0.22 0.00 0.00 33.01 31.20 1r1n s GLN 58 CO 0.27 0.26 0.86 0.82 -0.25 0.00 0.00 175.29 177.26 1r1n h ILE 59 N 5.13 1.34 -0.94 1.08 1.08 -1.88 -3.30 117.51 120.03 1r1n h ILE 59 Ca -0.34 -2.56 0.16 0.00 -0.39 0.00 0.00 64.86 61.73 1r1n h ILE 59 Cb 1.17 3.06 -0.10 0.00 -3.07 0.00 0.00 36.82 37.88 1r1n h ILE 59 CO 0.48 0.75 0.54 -0.65 -0.69 0.00 0.00 178.15 178.58 1r1n h PRO 60 N -0.18 0.73 -0.63 2.37 0.11 -1.93 0.13 132.00 132.60 1r1n h PRO 60 Ca -0.21 -0.04 0.05 0.00 0.11 0.00 0.00 66.00 65.91 1r1n h PRO 60 Cb 1.84 -0.16 -0.04 0.00 0.11 0.00 0.00 31.00 32.75 1r1n h PRO 60 CO 0.18 0.48 0.42 0.00 -0.21 0.00 0.00 178.00 178.87 1r1n h ALA 61 N 1.59 1.74 -0.22 -0.75 0.00 -1.92 -1.47 119.26 118.23 1r1n h ALA 61 Ca 0.52 -0.02 -0.17 0.00 0.00 0.00 0.00 54.91 55.23 1r1n h ALA 61 Cb 0.72 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.34 1r1n h ALA 61 CO -0.35 0.17 -0.52 -0.07 0.00 0.00 0.00 179.25 178.47 1r1n h LEU 62 N 0.66 0.84 -0.56 0.00 3.38 -0.86 -3.14 115.31 115.64 1r1n h LEU 62 Ca 0.26 -0.56 0.07 0.00 0.09 0.00 0.00 57.88 57.74 1r1n h LEU 62 Cb 0.21 -0.24 -0.06 0.00 0.09 0.00 0.00 40.66 40.66 1r1n h LEU 62 CO -0.08 1.25 0.24 0.00 0.09 0.00 0.00 178.44 179.94 1r1n h ALA 63 N 0.61 0.71 -0.70 1.53 0.00 -0.29 -1.37 119.26 119.75 1r1n h ALA 63 Ca -0.00 0.05 0.05 0.00 0.00 0.00 0.00 54.91 55.01 1r1n h ALA 63 Cb 1.13 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.86 1r1n h ALA 63 CO 0.11 -0.14 0.42 1.15 0.00 0.00 0.00 179.25 180.79 1r1n h THR 64 N 0.45 1.02 -0.03 0.00 2.02 -1.37 0.45 112.91 115.45 1r1n h THR 64 Ca 0.26 -0.27 -0.11 0.00 0.77 0.00 0.00 66.41 67.07 1r1n h THR 64 Cb 0.25 0.17 -0.01 0.00 -1.74 0.00 0.00 68.15 66.82 1r1n h THR 64 CO -0.23 0.14 -0.49 -0.07 0.37 0.00 0.00 175.52 175.24 1r1n h LEU 65 N 0.78 0.08 -0.09 2.58 3.38 -1.35 -1.50 115.31 119.18 1r1n h LEU 65 Ca 0.31 -0.04 -0.24 0.00 0.09 0.00 0.00 57.88 58.00 1r1n h LEU 65 Cb 0.14 -0.02 0.01 0.00 0.09 0.00 0.00 40.66 40.87 1r1n h LEU 65 CO -0.16 0.56 -1.02 -1.28 0.09 0.00 0.00 178.44 176.63 1r1n h SER 66 N 0.06 0.56 -0.18 -0.43 0.87 -0.38 0.28 113.55 114.33 1r1n h SER 66 Ca -0.00 -0.48 -0.13 0.00 -1.23 0.00 0.00 61.79 59.95 1r1n h SER 66 Cb 0.89 -0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 62.67 1r1n h SER 66 CO 0.07 1.29 -0.33 0.00 -0.53 0.00 0.00 176.83 177.33 1r1n h ALA 67 N 0.66 0.83 -0.03 6.23 0.00 0.02 -1.90 119.26 125.08 1r1n h ALA 67 Ca -0.10 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.40 1r1n h ALA 67 Cb 1.68 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.34 1r1n h ALA 67 CO 0.18 0.64 0.00 0.00 0.00 0.00 0.00 179.25 180.07 1r1n n ALA 68 N -2.51 2.61 -3.09 0.00 0.00 -0.58 -4.96 120.51 111.99 1r1n n ALA 68 Ca -0.01 -0.33 -0.18 0.00 0.00 0.00 0.00 53.44 52.92 1r1n n ALA 68 Cb 0.49 -1.30 0.02 0.00 0.00 0.00 0.00 19.45 18.65 1r1n n ALA 68 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1r1n n ASN 69 N -0.33 -7.11 0.00 0.00 3.02 -0.71 -4.95 115.26 105.17 1r1n n ASN 69 Ca 0.20 0.26 0.00 0.00 -0.03 0.00 0.00 54.58 55.01 1r1n n ASN 69 Cb 0.23 -4.13 0.00 0.00 -0.61 0.00 0.00 39.78 35.27 1r1n n ASN 69 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1r1n n LEU 70 N -0.38 0.10 -4.52 3.41 4.77 0.04 -5.01 117.00 115.41 1r1n n LEU 70 Ca 0.04 -0.10 -0.35 0.00 -0.03 0.00 0.00 56.01 55.57 1r1n n LEU 70 Cb 0.54 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.51 1r1n n LEU 70 CO 0.51 0.03 -0.30 -0.76 -1.33 0.00 0.00 177.39 175.54 1r1n s LEU 71 N -0.02 3.48 0.70 2.23 1.43 -1.24 -1.18 118.68 124.08 1r1n s LEU 71 Ca 0.00 -0.10 -0.14 0.00 -1.03 0.00 0.00 54.13 52.87 1r1n s LEU 71 Cb 0.00 -1.88 0.02 0.00 0.03 0.00 0.00 46.19 44.36 1r1n s LEU 71 CO 0.00 0.10 1.11 -1.61 0.23 0.00 0.00 176.35 176.18 1r1n s GLU 72 N 0.81 2.56 0.15 1.70 0.41 -0.24 -4.75 118.70 119.35 1r1n s GLU 72 Ca 0.02 1.35 -0.30 0.00 -0.41 0.00 0.00 54.97 55.63 1r1n s GLU 72 Cb -0.14 -1.92 -0.07 0.00 -1.78 0.00 0.00 34.13 30.22 1r1n s GLU 72 CO 0.02 -1.43 0.95 -1.25 -0.49 0.00 0.00 175.26 173.06 1r1n s PRO 73 N -4.33 4.75 -0.15 0.39 0.04 -1.26 -4.26 135.00 130.18 1r1n s PRO 73 Ca 0.66 1.45 -0.09 0.00 0.04 0.00 0.00 61.00 63.06 1r1n s PRO 73 Cb -0.20 -3.34 -0.05 0.00 0.04 0.00 0.00 34.50 30.95 1r1n s PRO 73 CO 0.46 0.32 0.17 -0.51 0.04 0.00 0.00 177.00 177.47 1r1n s LEU 74 N -0.39 4.32 0.59 -3.56 1.43 0.28 -4.94 118.68 116.39 1r1n s LEU 74 Ca 0.45 0.41 -0.18 0.00 -1.03 0.00 0.00 54.13 53.78 1r1n s LEU 74 Cb -0.24 -2.13 -0.06 0.00 0.03 0.00 0.00 46.19 43.78 1r1n s LEU 74 CO 0.30 0.29 0.83 -0.81 0.23 0.00 0.00 176.35 177.20 1r1n n PRO 75 N 2.67 0.78 0.25 1.29 -0.04 -1.26 -4.86 135.00 133.83 1r1n n PRO 75 Ca -0.17 0.30 0.14 0.00 -0.04 0.00 0.00 63.50 63.73 1r1n n PRO 75 Cb 0.53 -2.02 0.80 0.00 -0.04 0.00 0.00 33.50 32.78 1r1n n PRO 75 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1r1n h ALA 76 N 0.44 1.79 0.00 0.55 0.00 -1.97 -2.35 119.26 117.72 1r1n h ALA 76 Ca -0.47 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.38 1r1n h ALA 76 Cb 1.37 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.16 1r1n h ALA 76 CO 0.50 -0.10 -0.26 0.66 0.00 0.00 0.00 179.25 180.05 1r1n h SER 77 N 0.00 0.00 0.52 0.00 4.64 -2.01 -1.88 113.55 114.82 1r1n h SER 77 Ca 0.03 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 61.13 1r1n h SER 77 Cb 0.16 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.25 1r1n h SER 77 CO -0.00 0.26 -0.99 0.74 -0.87 0.00 0.00 176.83 175.97 1r1n h THR 78 N 0.00 1.47 0.00 2.95 2.02 -1.77 -3.27 112.91 114.31 1r1n h THR 78 Ca -0.00 -2.68 -0.08 0.00 0.77 0.00 0.00 66.41 64.42 1r1n h THR 78 Cb 0.46 2.57 -0.01 0.00 -1.74 0.00 0.00 68.15 69.43 1r1n h THR 78 CO 0.03 0.79 -0.58 0.40 0.37 0.00 0.00 175.52 176.54 1r1n h ILE 79 N 0.14 0.48 -0.21 3.11 2.04 -1.51 -3.32 117.51 118.24 1r1n h ILE 79 Ca -0.08 -1.73 -0.21 0.00 1.00 0.00 0.00 64.86 63.85 1r1n h ILE 79 Cb 1.65 2.15 0.01 0.00 -0.74 0.00 0.00 36.82 39.88 1r1n h ILE 79 CO 0.16 0.28 -0.68 0.78 0.00 0.00 0.00 178.15 178.69 1r1n h ASN 80 N 0.00 0.96 0.00 1.72 2.35 -1.43 -2.69 115.58 116.50 1r1n h ASN 80 Ca -0.03 -0.58 0.00 0.00 -0.55 0.00 0.00 56.30 55.14 1r1n h ASN 80 Cb 1.27 -0.28 0.00 0.00 0.05 0.00 0.00 38.32 39.36 1r1n h ASN 80 CO 0.04 1.38 0.00 -0.62 -1.65 0.00 0.00 177.43 176.58 1r1n n GLU 81 N -3.97 0.00 0.00 0.81 -0.58 -1.23 -0.90 120.64 114.77 1r1n n GLU 81 Ca -0.06 0.71 0.15 0.00 -0.42 0.00 0.00 57.16 57.54 1r1n n GLU 81 Cb 0.70 -1.11 0.77 0.00 -0.57 0.00 0.00 31.44 31.23 1r1n n GLU 81 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 1r1n n THR 82 N -2.37 0.00 -1.61 2.62 -2.24 -1.26 -4.58 114.28 104.84 1r1n n THR 82 Ca 0.00 -0.01 -0.54 0.00 -2.27 0.00 0.00 64.05 61.23 1r1n n THR 82 Cb 0.00 -0.43 -0.07 0.00 -2.10 0.00 0.00 70.33 67.73 1r1n n THR 82 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 1r1n n ARG 83 N -1.17 1.23 -3.58 -0.78 0.63 -0.08 -4.75 116.66 108.15 1r1n n ARG 83 Ca 0.16 0.42 -0.11 0.00 -0.92 0.00 0.00 57.85 57.40 1r1n n ARG 83 Cb 0.22 -2.26 -0.03 0.00 0.45 0.00 0.00 32.46 30.84 1r1n n ARG 83 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 1r1n s GLY 84 N 4.86 -0.36 0.13 5.14 0.00 -1.26 -5.02 107.32 110.81 1r1n s GLY 84 Ca 1.02 0.11 -0.31 0.00 0.00 0.00 0.00 44.72 45.54 1r1n s GLY 84 CO 0.59 -0.10 1.32 1.25 0.00 0.00 0.00 173.10 176.15 1r1n s LYS 85 N -3.80 4.37 0.00 2.90 2.20 -1.26 -1.73 119.74 122.42 1r1n s LYS 85 Ca 0.04 2.00 0.00 0.00 -0.36 0.00 0.00 55.97 57.65 1r1n s LYS 85 Cb -0.00 -3.25 0.00 0.00 -1.51 0.00 0.00 37.83 33.06 1r1n s LYS 85 CO -0.09 -0.33 0.00 0.41 -0.36 0.00 0.00 175.35 174.98 1r1n n GLY 86 N 3.06 3.01 3.65 5.54 0.00 -1.26 -4.99 105.19 114.19 1r1n n GLY 86 Ca 0.09 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.69 1r1n n GLY 86 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1r1n s VAL 87 N -2.00 3.77 0.32 1.61 1.01 -0.70 -4.93 120.40 119.47 1r1n s VAL 87 Ca 0.00 0.91 -0.27 0.00 0.00 0.00 0.00 61.98 62.62 1r1n s VAL 87 Cb 0.00 -3.64 -0.13 0.00 0.00 0.00 0.00 36.38 32.61 1r1n s VAL 87 CO 0.00 -0.14 0.96 -2.65 0.00 0.00 0.00 175.10 173.27 1r1n n PRO 88 N 7.15 1.26 -4.30 2.72 -0.02 -1.26 -4.70 135.00 135.85 1r1n n PRO 88 Ca 0.17 0.44 -0.24 0.00 -2.02 0.00 0.00 63.50 61.85 1r1n n PRO 88 Cb 0.44 -1.83 -0.13 0.00 -0.02 0.00 0.00 33.50 31.96 1r1n n PRO 88 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1r1n s VAL 89 N -1.13 1.74 -0.26 -1.45 1.01 -1.26 -4.54 120.40 114.51 1r1n s VAL 89 Ca 0.60 -1.54 -0.09 0.00 0.00 0.00 0.00 61.98 60.94 1r1n s VAL 89 Cb -0.67 -1.58 -0.04 0.00 0.00 0.00 0.00 36.38 34.09 1r1n s VAL 89 CO 0.59 -0.05 0.13 0.00 0.00 0.00 0.00 175.10 175.78 1r1n s ALA 90 N -1.15 3.36 0.26 5.51 0.00 -1.26 -4.97 121.76 123.51 1r1n s ALA 90 Ca 0.07 -1.08 -0.02 0.00 0.00 0.00 0.00 51.96 50.92 1r1n s ALA 90 Cb -0.10 -2.27 0.48 0.00 0.00 0.00 0.00 23.12 21.23 1r1n s ALA 90 CO 0.04 -0.47 1.78 0.00 0.00 0.00 0.00 175.76 177.12 1r1n h ALA 91 N 8.19 1.24 0.00 0.00 0.00 -2.00 -0.15 119.26 126.54 1r1n h ALA 91 Ca -0.37 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1r1n h ALA 91 Cb 1.18 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.90 1r1n h ALA 91 CO 0.57 -0.00 0.00 1.63 0.00 0.00 0.00 179.25 181.45 1r1n n LYS 92 N -4.81 0.20 -2.64 0.00 4.76 -1.26 -4.91 118.16 109.50 1r1n n LYS 92 Ca 0.16 0.30 -0.19 0.00 -2.87 0.00 0.00 58.31 55.70 1r1n n LYS 92 Cb 0.37 -1.80 0.01 0.00 -1.84 0.00 0.00 35.03 31.77 1r1n n LYS 92 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 1r1n n LYS 93 N -2.16 -2.93 0.00 1.97 5.02 -0.07 -4.80 118.16 115.19 1r1n n LYS 93 Ca 0.04 0.86 0.10 0.00 -2.02 0.00 0.00 58.31 57.29 1r1n n LYS 93 Cb 0.32 -5.46 -0.09 0.00 -0.02 0.00 0.00 35.03 29.78 1r1n n LYS 93 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 1r1n n ASP 94 N -1.82 1.22 -3.30 4.39 5.68 -1.26 0.98 116.55 122.44 1r1n n ASP 94 Ca -0.16 -1.11 -0.16 0.00 -0.50 0.00 0.00 54.79 52.86 1r1n n ASP 94 Cb 0.64 0.87 -0.05 0.00 -1.14 0.00 0.00 41.12 41.44 1r1n n ASP 94 CO 0.00 0.00 0.00 -1.66 -1.33 0.00 0.00 177.20 174.21 1r1n s TRP 95 N -2.79 1.28 -0.01 2.11 1.48 -1.26 -4.43 118.94 115.32 1r1n s TRP 95 Ca 0.10 -1.41 -0.12 0.00 -1.06 0.00 0.00 56.10 53.61 1r1n s TRP 95 Cb 0.16 -0.29 0.01 0.00 -1.16 0.00 0.00 33.47 32.19 1r1n s TRP 95 CO 0.77 -1.04 0.24 0.14 -4.06 0.00 0.00 176.95 172.99 1r1n s VAL 96 N -3.19 0.07 -0.14 -0.66 -7.23 -1.02 -4.66 120.40 103.56 1r1n s VAL 96 Ca 0.34 -0.56 -0.21 0.00 -1.81 0.00 0.00 61.98 59.74 1r1n s VAL 96 Cb 0.01 -0.54 -0.03 0.00 0.56 0.00 0.00 36.38 36.38 1r1n s VAL 96 CO 0.22 -0.31 0.63 0.00 -0.31 0.00 0.00 175.10 175.33 1r1n s ALA 97 N -1.35 3.47 -0.13 1.32 0.00 -1.26 -2.46 121.76 121.35 1r1n s ALA 97 Ca -0.14 -0.12 0.16 0.00 0.00 0.00 0.00 51.96 51.86 1r1n s ALA 97 Cb -0.06 -2.91 -0.23 0.00 0.00 0.00 0.00 23.12 19.92 1r1n s ALA 97 CO 0.03 -0.30 0.14 1.28 0.00 0.00 0.00 175.76 176.91 1r1n n LEU 98 N 4.38 0.00 -3.92 0.00 4.77 0.19 -4.73 117.00 117.70 1r1n n LEU 98 Ca -0.02 0.00 -0.01 0.00 -0.03 0.00 0.00 56.01 55.94 1r1n n LEU 98 Cb 0.51 0.32 0.02 0.00 -2.33 0.00 0.00 43.42 41.93 1r1n n LEU 98 CO 0.45 0.32 0.90 -0.94 -1.33 0.00 0.00 177.39 176.78 1r1n s SER 99 N -4.84 0.01 -0.03 -1.43 1.04 -1.25 -3.30 113.70 103.90 1r1n s SER 99 Ca -0.08 -0.54 -0.12 0.00 0.48 0.00 0.00 55.95 55.69 1r1n s SER 99 Cb 0.07 0.39 0.02 0.00 0.10 0.00 0.00 66.02 66.60 1r1n s SER 99 CO 0.71 -0.78 0.27 -0.83 0.98 0.00 0.00 173.24 173.58 1r1n s GLY 100 N -3.53 -0.12 0.05 7.32 0.00 -1.05 -0.96 107.32 109.03 1r1n s GLY 100 Ca 0.24 0.31 -0.00 0.00 0.00 0.00 0.00 44.72 45.27 1r1n s GLY 100 CO 0.04 0.14 0.19 0.50 0.00 0.00 0.00 173.10 173.96 1r1n s ARG 101 N -1.07 3.38 -0.03 2.90 3.00 0.33 -2.52 118.95 124.93 1r1n s ARG 101 Ca -0.11 -0.45 0.06 0.00 0.00 0.00 0.00 55.73 55.23 1r1n s ARG 101 Cb -0.05 -3.01 -0.02 0.00 0.00 0.00 0.00 34.95 31.86 1r1n s ARG 101 CO 0.03 0.62 -0.20 0.45 0.00 0.00 0.00 175.30 176.19 1r1n s SER 102 N -2.41 3.51 0.33 0.23 0.15 -1.26 -0.11 113.70 114.15 1r1n s SER 102 Ca 0.33 -0.34 -0.27 0.00 0.70 0.00 0.00 55.95 56.37 1r1n s SER 102 Cb -0.13 -0.58 -0.09 0.00 -1.71 0.00 0.00 66.02 63.51 1r1n s SER 102 CO 0.26 0.33 1.02 -0.13 1.20 0.00 0.00 173.24 175.92 1r1n s ARG 103 N -0.67 4.48 0.16 5.44 1.81 -0.56 -2.16 118.95 127.44 1r1n s ARG 103 Ca 0.11 1.54 -0.12 0.00 -1.72 0.00 0.00 55.73 55.53 1r1n s ARG 103 Cb -0.10 -2.87 0.01 0.00 -0.45 0.00 0.00 34.95 31.54 1r1n s ARG 103 CO -0.00 0.14 0.36 0.14 -0.68 0.00 0.00 175.30 175.25 1r1n s VAL 104 N -1.46 0.06 -0.32 3.52 -7.23 -0.86 -4.76 120.40 109.35 1r1n s VAL 104 Ca 0.50 -1.08 -0.04 0.00 -1.81 0.00 0.00 61.98 59.56 1r1n s VAL 104 Cb -0.24 -1.61 0.05 0.00 0.56 0.00 0.00 36.38 35.14 1r1n s VAL 104 CO 0.31 -0.29 0.05 -0.69 -0.31 0.00 0.00 175.10 174.16 1r1n s VAL 105 N -3.90 3.29 -0.21 1.32 1.01 -1.02 -1.89 120.40 119.00 1r1n s VAL 105 Ca 0.11 -1.32 -0.20 0.00 0.00 0.00 0.00 61.98 60.57 1r1n s VAL 105 Cb 0.02 -2.90 -0.03 0.00 0.00 0.00 0.00 36.38 33.48 1r1n s VAL 105 CO -0.04 -0.16 0.60 0.54 0.00 0.00 0.00 175.10 176.04 1r1n s VAL 106 N 1.30 5.03 0.40 2.92 0.11 0.00 -1.29 120.40 128.87 1r1n s VAL 106 Ca -0.03 1.12 0.07 0.00 -2.93 0.00 0.00 61.98 60.21 1r1n s VAL 106 Cb -0.20 -3.92 -0.08 0.00 -1.53 0.00 0.00 36.38 30.66 1r1n s VAL 106 CO 0.00 0.11 -0.01 -0.72 -3.33 0.00 0.00 175.10 171.15 1r1n s TYR 107 N 1.98 2.49 -0.48 1.54 1.13 0.47 -1.26 117.35 123.22 1r1n s TYR 107 Ca 0.27 -0.64 -0.17 0.00 -1.41 0.00 0.00 57.07 55.12 1r1n s TYR 107 Cb -0.16 -1.70 0.06 0.00 -1.10 0.00 0.00 41.96 39.07 1r1n s TYR 107 CO 0.10 0.47 0.51 0.34 -2.51 0.00 0.00 175.55 174.45 1r1n s ASP 108 N -3.69 6.19 0.58 -0.18 3.68 -0.32 -0.69 116.67 122.24 1r1n s ASP 108 Ca 0.35 -1.08 0.29 0.00 2.13 0.00 0.00 52.55 54.23 1r1n s ASP 108 Cb 0.09 -2.24 1.78 0.00 -1.45 0.00 0.00 42.92 41.10 1r1n s ASP 108 CO 0.18 -0.76 2.25 0.71 0.13 0.00 0.00 175.17 177.68 1r1n h THR 109 N 5.80 0.56 -0.41 1.71 1.35 -1.57 0.18 112.91 120.52 1r1n h THR 109 Ca -0.28 -0.02 0.02 0.00 -0.55 0.00 0.00 66.41 65.58 1r1n h THR 109 Cb 1.10 1.01 -0.03 0.00 -1.73 0.00 0.00 68.15 68.51 1r1n h THR 109 CO 0.91 0.00 0.23 0.03 -0.25 0.00 0.00 175.52 176.45 1r1n h ARG 110 N 0.00 0.46 0.00 4.72 3.08 -1.93 -3.32 114.38 117.39 1r1n h ARG 110 Ca -0.00 -0.03 -0.18 0.00 0.07 0.00 0.00 59.98 59.84 1r1n h ARG 110 Cb 0.01 -0.10 -0.03 0.00 0.08 0.00 0.00 29.97 29.92 1r1n h ARG 110 CO 0.00 0.30 -1.99 1.63 -1.07 0.00 0.00 179.97 178.85 1r1n n LYS 111 N -4.87 1.03 -4.48 0.04 5.02 -1.01 -5.02 118.16 108.87 1r1n n LYS 111 Ca 0.02 -0.07 -0.27 0.00 -2.02 0.00 0.00 58.31 55.96 1r1n n LYS 111 Cb 0.07 -1.42 -0.13 0.00 -0.02 0.00 0.00 35.03 33.53 1r1n n LYS 111 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1r1n s LEU 112 N -4.81 2.27 0.18 -0.35 1.43 0.59 -5.09 118.68 112.90 1r1n s LEU 112 Ca -0.07 -0.68 0.08 0.00 -1.03 0.00 0.00 54.13 52.43 1r1n s LEU 112 Cb 0.07 -1.11 -0.04 0.00 0.03 0.00 0.00 46.19 45.14 1r1n s LEU 112 CO 0.69 0.16 -0.04 -0.55 0.23 0.00 0.00 176.35 176.83 1r1n s SER 113 N -1.77 4.52 0.57 2.29 0.15 -1.26 -3.99 113.70 114.20 1r1n s SER 113 Ca 0.11 -0.49 0.31 0.00 0.70 0.00 0.00 55.95 56.57 1r1n s SER 113 Cb -0.10 -0.87 1.44 0.00 -1.71 0.00 0.00 66.02 64.78 1r1n s SER 113 CO 0.04 0.09 1.82 -0.33 1.20 0.00 0.00 173.24 176.06 1r1n h GLU 114 N 2.76 0.00 0.00 5.44 4.39 -1.98 0.43 114.58 125.61 1r1n h GLU 114 Ca -0.47 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.23 1r1n h GLU 114 Cb 1.21 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.86 1r1n h GLU 114 CO 0.56 0.00 0.00 1.63 -1.16 0.00 0.00 179.01 180.04 1r1n n LYS 115 N -3.86 0.38 -0.06 2.33 4.76 -1.26 -3.55 118.16 116.90 1r1n n LYS 115 Ca 0.15 0.05 -0.10 0.00 -2.87 0.00 0.00 58.31 55.54 1r1n n LYS 115 Cb 0.92 -1.50 -0.15 0.00 -1.84 0.00 0.00 35.03 32.46 1r1n n LYS 115 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 1r1n n ASP 116 N -1.26 0.59 -4.65 4.39 8.00 0.15 -4.99 116.55 118.77 1r1n n ASP 116 Ca 0.12 0.21 -0.30 0.00 0.71 0.00 0.00 54.79 55.53 1r1n n ASP 116 Cb 0.19 0.35 0.17 0.00 -0.02 0.00 0.00 41.12 41.81 1r1n n ASP 116 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1r1n s LEU 117 N -5.89 2.08 0.69 0.64 1.43 -1.23 -5.02 118.68 111.38 1r1n s LEU 117 Ca -0.09 1.70 -0.11 0.00 -1.03 0.00 0.00 54.13 54.61 1r1n s LEU 117 Cb 0.07 -3.99 0.00 0.00 0.03 0.00 0.00 46.19 42.30 1r1n s LEU 117 CO 0.82 -3.15 1.07 -1.61 0.23 0.00 0.00 176.35 173.71 1r1n s GLU 118 N -4.73 3.00 0.24 1.70 0.41 -1.26 -4.99 118.70 113.06 1r1n s GLU 118 Ca 0.65 0.70 0.23 0.00 -0.41 0.00 0.00 54.97 56.14 1r1n s GLU 118 Cb -0.21 -2.02 0.12 0.00 -1.78 0.00 0.00 34.13 30.25 1r1n s GLU 118 CO 0.59 -0.99 1.20 0.87 -0.49 0.00 0.00 175.26 176.44 1r1n h LYS 119 N -0.63 0.00 -3.29 1.61 1.57 -1.96 -3.46 116.57 110.41 1r1n h LYS 119 Ca -0.45 0.00 -0.22 0.00 -1.87 0.00 0.00 60.65 58.11 1r1n h LYS 119 Cb 1.22 0.00 -0.30 0.00 0.08 0.00 0.00 32.23 33.24 1r1n h LYS 119 CO 0.61 0.00 -0.57 0.45 -0.57 0.00 0.00 179.45 179.36 1r1n s SER 120 N -5.34 -0.13 0.56 0.86 0.15 -1.26 -4.89 113.70 103.63 1r1n s SER 120 Ca 0.02 0.31 0.32 0.00 0.70 0.00 0.00 55.95 57.30 1r1n s SER 120 Cb 0.09 0.24 1.47 0.00 -1.71 0.00 0.00 66.02 66.12 1r1n s SER 120 CO 0.76 -0.11 1.85 1.62 1.20 0.00 0.00 173.24 178.55 1r1n h VAL 121 N 5.63 0.45 0.00 4.45 3.04 -1.94 0.20 116.25 128.08 1r1n h VAL 121 Ca -0.36 0.00 -0.02 0.00 -1.01 0.00 0.00 66.70 65.31 1r1n h VAL 121 Cb 1.16 0.51 -0.00 0.00 -2.01 0.00 0.00 31.29 30.95 1r1n h VAL 121 CO 0.42 0.00 -0.09 -0.07 -1.01 0.00 0.00 177.57 176.82 1r1n h LEU 122 N 0.00 0.00 -0.53 3.16 3.38 -1.98 -2.90 115.31 116.44 1r1n h LEU 122 Ca 0.41 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.38 1r1n h LEU 122 Cb 1.76 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.51 1r1n h LEU 122 CO -0.00 0.09 0.00 0.59 0.09 0.00 0.00 178.44 179.21 1r1n n ASN 123 N -3.27 0.69 0.19 -0.43 3.02 0.68 -3.02 115.26 113.12 1r1n n ASN 123 Ca -0.00 0.64 0.07 0.00 -0.03 0.00 0.00 54.58 55.26 1r1n n ASN 123 Cb 0.32 -0.80 0.23 0.00 -0.61 0.00 0.00 39.78 38.92 1r1n n ASN 123 CO 0.00 0.00 0.00 1.88 -2.62 0.00 0.00 177.26 176.52 1r1n h TYR 124 N 0.00 0.00 -0.43 3.10 0.05 -1.66 -3.32 116.97 114.72 1r1n h TYR 124 Ca 0.00 0.00 -0.46 0.00 0.05 0.00 0.00 58.73 58.32 1r1n h TYR 124 Cb 0.45 0.00 -0.08 0.00 1.01 0.00 0.00 36.73 38.11 1r1n h TYR 124 CO 0.00 0.31 1.26 0.00 -1.05 0.00 0.00 178.16 178.68 1r1n n ALA 125 N -2.21 6.76 -2.19 3.88 0.00 -1.17 -4.55 120.51 121.04 1r1n n ALA 125 Ca 0.01 -2.88 -0.11 0.00 0.00 0.00 0.00 53.44 50.46 1r1n n ALA 125 Cb 0.58 -2.61 -0.10 0.00 0.00 0.00 0.00 19.45 17.32 1r1n n ALA 125 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1r1n s THR 126 N 0.19 0.40 0.42 0.00 -4.23 -1.25 -4.56 115.64 106.61 1r1n s THR 126 Ca 0.64 -1.94 0.18 0.00 -1.18 0.00 0.00 61.69 59.39 1r1n s THR 126 Cb 0.28 -2.04 0.38 0.00 1.34 0.00 0.00 72.50 72.46 1r1n s THR 126 CO -0.08 -0.51 1.85 -0.65 -0.54 0.00 0.00 174.62 174.68 1r1n h PRO 127 N 2.80 0.39 -0.66 3.99 0.11 -1.92 -2.06 132.00 134.65 1r1n h PRO 127 Ca -0.36 -0.02 0.05 0.00 0.11 0.00 0.00 66.00 65.78 1r1n h PRO 127 Cb 1.20 -0.09 -0.04 0.00 0.11 0.00 0.00 31.00 32.18 1r1n h PRO 127 CO 0.61 0.26 0.44 -0.22 -0.21 0.00 0.00 178.00 178.88 1r1n h LYS 128 N 0.40 0.68 -1.07 1.05 3.64 -1.93 -2.77 116.57 116.57 1r1n h LYS 128 Ca 0.48 -0.04 -0.58 0.00 -1.27 0.00 0.00 60.65 59.24 1r1n h LYS 128 Cb 1.21 -0.15 -0.27 0.00 -0.41 0.00 0.00 32.23 32.61 1r1n h LYS 128 CO -0.18 0.45 0.74 0.91 -2.27 0.00 0.00 179.45 179.10 1r1n n TRP 129 N -4.47 2.89 -2.08 1.91 7.02 -0.77 -4.91 117.44 117.03 1r1n n TRP 129 Ca 0.09 -2.53 -0.42 0.00 -1.02 0.00 0.00 57.50 53.61 1r1n n TRP 129 Cb 0.20 -1.23 -0.03 0.00 -2.42 0.00 0.00 31.31 27.83 1r1n n TRP 129 CO 0.00 0.00 0.00 0.21 -2.02 0.00 0.00 177.69 175.88 1r1n s LYS 130 N -3.34 4.22 -1.08 -0.99 2.47 -1.05 -2.34 119.74 117.64 1r1n s LYS 130 Ca 0.57 2.12 0.00 0.00 -1.56 0.00 0.00 55.97 57.10 1r1n s LYS 130 Cb 0.45 -3.78 0.00 0.00 -1.46 0.00 0.00 37.83 33.05 1r1n s LYS 130 CO 0.02 -0.74 0.00 0.09 0.16 0.00 0.00 175.35 174.88 1r1n n ASN 131 N 6.30 -5.30 -0.31 1.43 3.02 0.25 -4.80 115.26 115.84 1r1n n ASN 131 Ca 0.16 0.25 0.03 0.00 -0.03 0.00 0.00 54.58 54.99 1r1n n ASN 131 Cb 0.43 -3.93 0.07 0.00 -0.61 0.00 0.00 39.78 35.73 1r1n n ASN 131 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1r1n n ARG 132 N -0.76 2.28 -3.69 3.52 1.74 -0.99 -4.71 116.66 114.06 1r1n n ARG 132 Ca -0.10 -1.59 -0.11 0.00 -0.77 0.00 0.00 57.85 55.27 1r1n n ARG 132 Cb 0.55 -1.14 -0.12 0.00 -1.02 0.00 0.00 32.46 30.74 1r1n n ARG 132 CO 0.00 0.00 0.00 -1.50 -1.52 0.00 0.00 177.63 174.61 1r1n s ILE 133 N -0.89 -0.26 0.34 0.55 1.10 -1.24 -2.69 121.20 118.11 1r1n s ILE 133 Ca 0.11 0.17 0.07 0.00 -0.51 0.00 0.00 60.65 60.49 1r1n s ILE 133 Cb 0.06 -0.51 -0.01 0.00 0.15 0.00 0.00 42.46 42.15 1r1n s ILE 133 CO 0.08 0.07 0.47 -0.83 -2.11 0.00 0.00 174.94 172.62 1r1n s GLY 134 N 1.87 1.65 0.19 1.50 0.00 -0.93 -2.98 107.32 108.62 1r1n s GLY 134 Ca -0.05 -1.50 -0.18 0.00 0.00 0.00 0.00 44.72 42.99 1r1n s GLY 134 CO -0.10 -1.40 0.52 -2.52 0.00 0.00 0.00 173.10 169.59 1r1n s TYR 135 N -2.20 -0.14 -0.61 1.90 1.13 -1.00 -1.74 117.35 114.68 1r1n s TYR 135 Ca 0.46 -0.19 0.04 0.00 -1.41 0.00 0.00 57.07 55.97 1r1n s TYR 135 Cb -0.09 0.39 0.15 0.00 -1.10 0.00 0.00 41.96 41.31 1r1n s TYR 135 CO 0.31 -0.90 0.39 0.08 -2.51 0.00 0.00 175.55 172.92 1r1n s VAL 136 N -3.86 2.66 0.11 -3.49 1.01 -1.26 -0.62 120.40 114.94 1r1n s VAL 136 Ca 0.08 -3.79 0.31 0.00 0.00 0.00 0.00 61.98 58.58 1r1n s VAL 136 Cb -0.01 -2.79 0.32 0.00 0.00 0.00 0.00 36.38 33.90 1r1n s VAL 136 CO -0.04 -0.92 1.95 1.55 0.00 0.00 0.00 175.10 177.64 1r1n h PRO 137 N 5.89 0.00 -0.65 2.72 0.13 -1.94 -1.78 132.00 136.38 1r1n h PRO 137 Ca 0.05 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.18 1r1n h PRO 137 Cb 0.82 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.95 1r1n h PRO 137 CO 0.69 0.00 0.00 0.25 -0.23 0.00 0.00 178.00 178.71 1r1n n THR 138 N -2.62 1.28 -4.00 1.56 -2.24 -1.26 -4.88 114.28 102.12 1r1n n THR 138 Ca -0.01 -0.97 -0.35 0.00 -2.27 0.00 0.00 64.05 60.44 1r1n n THR 138 Cb 0.09 0.24 -0.06 0.00 -2.10 0.00 0.00 70.33 68.50 1r1n n THR 138 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1r1n s SER 139 N -0.92 6.10 0.49 3.42 1.04 -0.67 -4.98 113.70 118.19 1r1n s SER 139 Ca 0.45 0.35 0.23 0.00 0.48 0.00 0.00 55.95 57.46 1r1n s SER 139 Cb 0.26 -1.90 1.28 0.00 0.10 0.00 0.00 66.02 65.77 1r1n s SER 139 CO 0.26 0.36 2.04 1.23 0.98 0.00 0.00 173.24 178.10 1r1n h GLY 140 N 4.69 0.00 1.42 7.32 0.00 -1.91 -2.21 103.07 112.37 1r1n h GLY 140 Ca -0.52 0.00 -0.17 0.00 0.00 0.00 0.00 47.33 46.64 1r1n h GLY 140 CO 0.60 0.00 -0.57 0.00 0.00 0.00 0.00 176.54 176.57 1r1n h ALA 141 N 1.85 0.64 -0.07 3.60 0.00 -1.93 0.20 119.26 123.54 1r1n h ALA 141 Ca -0.00 -0.52 -0.10 0.00 0.00 0.00 0.00 54.91 54.29 1r1n h ALA 141 Cb 0.35 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1r1n h ALA 141 CO 0.02 0.69 -0.42 0.35 0.00 0.00 0.00 179.25 179.89 1r1n h PHE 142 N 0.46 0.18 -0.15 0.00 3.57 -1.66 -1.11 116.94 118.22 1r1n h PHE 142 Ca 0.00 -0.05 -0.12 0.00 3.53 0.00 0.00 57.97 61.34 1r1n h PHE 142 Cb 1.13 -0.04 0.00 0.00 2.79 0.00 0.00 35.95 39.83 1r1n h PHE 142 CO 0.05 0.55 -0.37 1.25 -2.23 0.00 0.00 178.31 177.57 1r1n h LEU 143 N 0.13 0.59 -2.25 0.59 5.85 -1.04 -2.07 115.31 117.11 1r1n h LEU 143 Ca 0.01 -0.57 -0.01 0.00 0.84 0.00 0.00 57.88 58.15 1r1n h LEU 143 Cb 0.80 -0.17 -0.00 0.00 0.37 0.00 0.00 40.66 41.66 1r1n h LEU 143 CO 0.06 1.06 -0.05 -0.33 -0.34 0.00 0.00 178.44 178.84 1r1n h GLU 144 N 0.15 0.00 0.07 1.25 4.39 -0.39 -0.83 114.58 119.22 1r1n h GLU 144 Ca -0.00 0.00 -0.28 0.00 0.34 0.00 0.00 59.36 59.41 1r1n h GLU 144 Cb 0.98 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 29.65 1r1n h GLU 144 CO 0.08 0.05 -1.16 0.37 -1.16 0.00 0.00 179.01 177.19 1r1n h GLN 145 N 0.00 0.63 -0.38 2.33 5.75 -0.88 -3.03 115.11 119.53 1r1n h GLN 145 Ca -0.00 -0.78 -0.08 0.00 -0.15 0.00 0.00 58.65 57.65 1r1n h GLN 145 Cb 0.21 0.24 -0.02 0.00 1.07 0.00 0.00 27.48 28.99 1r1n h GLN 145 CO 0.01 1.34 -0.08 0.82 -2.65 0.00 0.00 178.83 178.27 1r1n h ILE 146 N 0.31 1.24 -0.77 2.39 2.04 -0.50 -2.62 117.51 119.60 1r1n h ILE 146 Ca -0.16 -1.03 -0.05 0.00 1.00 0.00 0.00 64.86 64.62 1r1n h ILE 146 Cb 1.82 1.04 -0.03 0.00 -0.74 0.00 0.00 36.82 38.91 1r1n h ILE 146 CO 0.22 0.35 0.30 0.58 0.00 0.00 0.00 178.15 179.60 1r1n h VAL 147 N 0.59 1.26 -0.01 1.67 2.07 -1.27 -2.95 116.25 117.62 1r1n h VAL 147 Ca 0.11 -0.83 -0.18 0.00 0.82 0.00 0.00 66.70 66.63 1r1n h VAL 147 Cb 0.49 0.34 -0.02 0.00 -1.52 0.00 0.00 31.29 30.59 1r1n h VAL 147 CO 0.03 0.34 -0.80 0.00 0.02 0.00 0.00 177.57 177.15 1r1n h ALA 148 N 1.19 0.63 -0.43 1.67 0.00 -1.35 -3.04 119.26 117.94 1r1n h ALA 148 Ca 0.26 -0.69 -0.14 0.00 0.00 0.00 0.00 54.91 54.33 1r1n h ALA 148 Cb 0.23 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1r1n h ALA 148 CO -0.02 0.91 -0.29 0.82 0.00 0.00 0.00 179.25 180.67 1r1n h ILE 149 N 0.08 1.27 -0.34 0.00 2.04 -1.43 -1.54 117.51 117.59 1r1n h ILE 149 Ca -0.03 -1.46 0.05 0.00 1.00 0.00 0.00 64.86 64.43 1r1n h ILE 149 Cb 1.40 1.24 -0.05 0.00 -0.74 0.00 0.00 36.82 38.68 1r1n h ILE 149 CO 0.12 0.49 0.06 0.58 0.00 0.00 0.00 178.15 179.40 1r1n h VAL 150 N 0.79 0.83 -0.19 1.67 2.07 -1.52 0.95 116.25 120.85 1r1n h VAL 150 Ca 0.09 -0.06 -0.12 0.00 0.82 0.00 0.00 66.70 67.42 1r1n h VAL 150 Cb 0.87 0.63 -0.01 0.00 -1.52 0.00 0.00 31.29 31.26 1r1n h VAL 150 CO 0.08 0.03 -0.41 0.11 0.02 0.00 0.00 177.57 177.40 1r1n h LYS 151 N 0.18 0.45 0.05 1.57 1.57 -1.41 0.42 116.57 119.39 1r1n h LYS 151 Ca 0.16 -0.22 -0.30 0.00 -1.87 0.00 0.00 60.65 58.41 1r1n h LYS 151 Cb 0.18 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.46 1r1n h LYS 151 CO -0.21 0.78 -1.68 -0.07 -0.57 0.00 0.00 179.45 177.70 1r1n h LEU 152 N 0.37 0.16 0.00 2.94 3.38 -0.93 -3.42 115.31 117.81 1r1n h LEU 152 Ca 0.03 -0.31 0.00 0.00 0.09 0.00 0.00 57.88 57.70 1r1n h LEU 152 Cb 0.88 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.58 1r1n h LEU 152 CO 0.07 1.27 -0.91 0.29 0.09 0.00 0.00 178.44 179.26 1r1n n LYS 153 N -3.24 3.51 0.00 1.13 4.76 0.32 -5.08 118.16 119.56 1r1n n LYS 153 Ca -0.19 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.25 1r1n n LYS 153 Cb 1.04 -0.95 0.00 0.00 -1.84 0.00 0.00 35.03 33.28 1r1n n LYS 153 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1r1n n GLY 154 N 2.75 1.98 0.26 0.72 0.00 0.15 -4.60 105.19 106.45 1r1n n GLY 154 Ca 0.00 -2.13 0.06 0.00 0.00 0.00 0.00 46.02 43.95 1r1n n GLY 154 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1r1n h GLU 155 N 0.00 0.15 0.00 1.61 4.81 -1.88 -1.79 114.58 117.48 1r1n h GLU 155 Ca 0.00 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 1r1n h GLU 155 Cb 0.00 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.35 1r1n h GLU 155 CO 0.00 0.15 0.00 0.00 -0.73 0.00 0.00 179.01 178.43 1r1n n ALA 156 N -2.51 -0.22 -0.44 2.92 0.00 -1.26 -1.33 120.51 117.66 1r1n n ALA 156 Ca -0.01 0.00 0.40 0.00 0.00 0.00 0.00 53.44 53.83 1r1n n ALA 156 Cb 0.13 0.00 0.76 0.00 0.00 0.00 0.00 19.45 20.34 1r1n n ALA 156 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1r1n h ALA 157 N -2.00 3.28 0.18 0.00 0.00 -1.80 -0.74 119.26 118.18 1r1n h ALA 157 Ca 0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1r1n h ALA 157 Cb 0.00 0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1r1n h ALA 157 CO 0.00 -1.71 -0.09 0.00 0.00 0.00 0.00 179.25 177.46 1r1n h ALA 158 N 1.31 -0.24 -0.15 0.00 0.00 -1.27 -2.90 119.26 116.01 1r1n h ALA 158 Ca 0.69 -0.21 -0.07 0.00 0.00 0.00 0.00 54.91 55.32 1r1n h ALA 158 Cb 2.69 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 20.56 1r1n h ALA 158 CO -0.05 -0.30 -0.24 1.25 0.00 0.00 0.00 179.25 179.91 1r1n h LEU 159 N -0.91 0.26 -0.87 0.00 5.85 -0.48 -2.66 115.31 116.51 1r1n h LEU 159 Ca -0.02 -0.08 -0.04 0.00 0.84 0.00 0.00 57.88 58.58 1r1n h LEU 159 Cb 0.50 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.42 1r1n h LEU 159 CO 0.04 0.51 0.36 0.11 -0.34 0.00 0.00 178.44 179.13 1r1n h LYS 160 N 0.24 1.18 -0.24 1.25 1.79 -1.26 -2.27 116.57 117.27 1r1n h LYS 160 Ca 0.04 -0.19 -0.09 0.00 -2.18 0.00 0.00 60.65 58.23 1r1n h LYS 160 Cb 0.56 -0.21 -0.01 0.00 -1.58 0.00 0.00 32.23 30.99 1r1n h LYS 160 CO 0.04 0.93 -0.26 2.35 -1.08 0.00 0.00 179.45 181.43 1r1n h TRP 161 N 1.17 0.52 0.00 -1.35 7.01 -1.26 -2.52 115.95 119.51 1r1n h TRP 161 Ca 0.28 -0.11 -0.12 0.00 2.11 0.00 0.00 58.89 61.05 1r1n h TRP 161 Cb 0.16 -0.13 -0.02 0.00 -2.10 0.00 0.00 29.16 27.07 1r1n h TRP 161 CO 0.02 0.68 -0.55 -0.07 -2.79 0.00 0.00 178.44 175.72 1r1n h LEU 162 N 0.41 0.00 0.00 0.65 3.38 -1.20 -2.35 115.31 116.20 1r1n h LEU 162 Ca 0.06 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.91 1r1n h LEU 162 Cb 0.67 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.40 1r1n h LEU 162 CO 0.05 0.55 -0.65 0.11 0.09 0.00 0.00 178.44 178.59 1r1n h LYS 163 N 0.00 0.00 0.29 1.13 1.57 -1.28 -2.98 116.57 115.30 1r1n h LYS 163 Ca -0.01 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.76 1r1n h LYS 163 Cb 1.20 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.52 1r1n h LYS 163 CO 0.07 0.53 -0.14 0.78 -0.57 0.00 0.00 179.45 180.12 1r1n h GLY 164 N 3.47 -0.41 0.25 3.86 0.00 -1.36 -2.47 103.07 106.41 1r1n h GLY 164 Ca -0.02 0.15 0.25 0.00 0.00 0.00 0.00 47.33 47.71 1r1n h GLY 164 CO 0.07 -0.15 0.63 1.41 0.00 0.00 0.00 176.54 178.50 1r1n h LEU 165 N -1.04 0.01 -0.25 3.11 3.38 -1.55 0.59 115.31 119.56 1r1n h LEU 165 Ca -0.04 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.73 1r1n h LEU 165 Cb 0.30 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 1r1n h LEU 165 CO 0.07 0.00 -0.90 0.50 0.09 0.00 0.00 178.44 178.20 1r1n h LYS 166 N 0.01 0.21 0.00 1.13 1.63 -1.56 0.40 116.57 118.38 1r1n h LYS 166 Ca 0.42 -0.23 -0.24 0.00 -0.85 0.00 0.00 60.65 59.74 1r1n h LYS 166 Cb 1.66 0.07 -0.04 0.00 -0.60 0.00 0.00 32.23 33.32 1r1n h LYS 166 CO -0.01 0.97 -1.29 0.93 -3.45 0.00 0.00 179.45 176.61 1r1n h GLU 167 N 0.11 0.00 0.00 1.90 4.39 0.48 -3.40 114.58 118.07 1r1n h GLU 167 Ca -0.05 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.65 1r1n h GLU 167 Cb 1.53 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.18 1r1n h GLU 167 CO 0.14 0.79 -1.08 0.66 -1.16 0.00 0.00 179.01 178.36 1r1n n TYR 168 N -3.22 0.00 -4.11 4.33 4.02 0.80 -4.96 117.16 114.02 1r1n n TYR 168 Ca -0.07 0.00 -0.23 0.00 -0.01 0.00 0.00 57.90 57.59 1r1n n TYR 168 Cb 0.98 -0.07 -0.05 0.00 -0.02 0.00 0.00 39.34 40.19 1r1n n TYR 168 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 176.86 176.05 1r1n s GLY 169 N -2.30 1.49 -0.13 2.72 0.00 0.14 0.84 107.32 110.08 1r1n s GLY 169 Ca -0.01 -1.37 -0.03 0.00 0.00 0.00 0.00 44.72 43.31 1r1n s GLY 169 CO 0.14 -1.40 -0.01 0.54 0.00 0.00 0.00 173.10 172.37 1r1n s LYS 170 N -3.64 3.40 0.61 2.90 1.02 -1.16 -4.56 119.74 118.32 1r1n s LYS 170 Ca 0.32 -0.45 -0.09 0.00 0.02 0.00 0.00 55.97 55.77 1r1n s LYS 170 Cb -0.08 -2.89 -0.01 0.00 -0.52 0.00 0.00 37.83 34.32 1r1n s LYS 170 CO 0.24 0.45 0.97 -1.25 -0.92 0.00 0.00 175.35 174.84 1r1n s PRO 171 N -0.18 3.17 0.01 -1.68 0.04 -1.26 -2.37 135.00 132.72 1r1n s PRO 171 Ca 0.04 0.36 0.01 0.00 0.04 0.00 0.00 61.00 61.45 1r1n s PRO 171 Cb -0.13 -2.17 -0.01 0.00 0.04 0.00 0.00 34.50 32.24 1r1n s PRO 171 CO 0.02 -0.69 -0.04 0.71 0.04 0.00 0.00 177.00 177.04 1r1n s TYR 172 N -3.11 0.38 0.36 0.56 2.02 0.20 -4.85 117.35 112.92 1r1n s TYR 172 Ca 0.54 -0.18 0.08 0.00 -0.37 0.00 0.00 57.07 57.14 1r1n s TYR 172 Cb -0.11 -0.24 0.79 0.00 -0.40 0.00 0.00 41.96 42.00 1r1n s TYR 172 CO 0.49 -0.04 1.91 0.00 -1.57 0.00 0.00 175.55 176.35 1r1n h ALA 173 N 5.65 1.79 -2.91 3.71 0.00 -1.98 -3.41 119.26 122.12 1r1n h ALA 173 Ca -0.29 -0.00 -0.42 0.00 0.00 0.00 0.00 54.91 54.20 1r1n h ALA 173 Cb 1.20 -0.15 -0.12 0.00 0.00 0.00 0.00 17.79 18.72 1r1n h ALA 173 CO 0.48 0.02 -0.41 0.15 0.00 0.00 0.00 179.25 179.48 1r1n s LYS 174 N -5.67 1.79 0.37 0.00 -0.14 -1.26 -4.81 119.74 110.03 1r1n s LYS 174 Ca -0.10 -1.95 0.20 0.00 -1.36 0.00 0.00 55.97 52.76 1r1n s LYS 174 Cb 0.21 0.36 0.43 0.00 -1.68 0.00 0.00 37.83 37.14 1r1n s LYS 174 CO 0.78 -0.68 1.61 -0.91 -0.76 0.00 0.00 175.35 175.39 1r1n h ASN 175 N 2.14 0.00 0.68 2.83 2.35 -1.97 -3.09 115.58 118.52 1r1n h ASN 175 Ca -0.26 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.46 1r1n h ASN 175 Cb 1.23 0.00 0.01 0.00 0.05 0.00 0.00 38.32 39.61 1r1n h ASN 175 CO 0.37 0.29 -0.33 0.28 -1.65 0.00 0.00 177.43 176.40 1r1n h SER 176 N 0.00 -0.77 -0.67 5.81 0.02 -1.98 -2.81 113.55 113.14 1r1n h SER 176 Ca -0.00 0.02 0.12 0.00 -0.84 0.00 0.00 61.79 61.09 1r1n h SER 176 Cb 1.08 0.20 -0.09 0.00 0.14 0.00 0.00 62.40 63.73 1r1n h SER 176 CO 0.04 -0.39 0.22 0.58 -1.14 0.00 0.00 176.83 176.14 1r1n h VAL 177 N -1.24 0.66 -0.82 2.27 2.07 -1.98 -0.70 116.25 116.52 1r1n h VAL 177 Ca -0.09 -0.12 0.06 0.00 0.82 0.00 0.00 66.70 67.37 1r1n h VAL 177 Cb 0.70 0.27 -0.06 0.00 -1.52 0.00 0.00 31.29 30.68 1r1n h VAL 177 CO 0.15 0.07 0.50 0.00 0.02 0.00 0.00 177.57 178.31 1r1n h ALA 178 N 1.50 1.13 -0.17 1.67 0.00 -1.59 0.27 119.26 122.07 1r1n h ALA 178 Ca 0.36 0.00 -0.18 0.00 0.00 0.00 0.00 54.91 55.09 1r1n h ALA 178 Cb 0.53 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 1r1n h ALA 178 CO -0.39 0.22 -0.64 1.25 0.00 0.00 0.00 179.25 179.69 1r1n h LEU 179 N 0.90 0.72 -0.50 0.00 5.85 -1.06 -2.88 115.31 118.34 1r1n h LEU 179 Ca 0.36 -0.42 -0.10 0.00 0.84 0.00 0.00 57.88 58.56 1r1n h LEU 179 Cb 0.20 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.00 1r1n h LEU 179 CO -0.18 1.17 -0.49 1.56 -0.34 0.00 0.00 178.44 180.16 1r1n h GLN 180 N 0.46 0.00 -0.38 1.25 1.08 -0.63 -1.47 115.11 115.42 1r1n h GLN 180 Ca -0.01 0.00 -0.04 0.00 -1.45 0.00 0.00 58.65 57.15 1r1n h GLN 180 Cb 1.22 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 28.63 1r1n h GLN 180 CO 0.12 0.49 0.09 0.00 -0.95 0.00 0.00 178.83 178.57 1r1n h ALA 181 N 1.51 0.50 -0.23 3.87 0.00 -0.38 0.47 119.26 125.00 1r1n h ALA 181 Ca -0.00 -0.19 -0.12 0.00 0.00 0.00 0.00 54.91 54.59 1r1n h ALA 181 Cb 1.16 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.81 1r1n h ALA 181 CO 0.06 0.18 -0.33 0.28 0.00 0.00 0.00 179.25 179.45 1r1n h VAL 182 N 0.46 1.32 -0.72 0.00 2.07 -1.45 0.12 116.25 118.05 1r1n h VAL 182 Ca 0.12 -1.53 0.04 0.00 0.82 0.00 0.00 66.70 66.15 1r1n h VAL 182 Cb 0.32 1.76 -0.04 0.00 -1.52 0.00 0.00 31.29 31.81 1r1n h VAL 182 CO 0.00 0.48 0.48 -0.08 0.02 0.00 0.00 177.57 178.47 1r1n h GLU 183 N 0.32 0.84 -0.00 1.57 4.57 -1.10 -1.75 114.58 119.03 1r1n h GLU 183 Ca 0.02 -0.05 0.00 0.00 -1.18 0.00 0.00 59.36 58.15 1r1n h GLU 183 Cb 0.91 -0.19 0.00 0.00 -0.16 0.00 0.00 28.75 29.31 1r1n h GLU 183 CO 0.08 0.56 -0.12 0.09 -1.18 0.00 0.00 179.01 178.43 1r1n n ASN 184 N -4.46 0.28 0.00 1.04 3.02 0.14 -4.83 115.26 110.45 1r1n n ASN 184 Ca 0.09 -0.19 0.00 0.00 -0.03 0.00 0.00 54.58 54.46 1r1n n ASN 184 Cb 0.13 -0.17 0.00 0.00 -0.61 0.00 0.00 39.78 39.13 1r1n n ASN 184 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1r1n n GLY 185 N 1.37 0.72 0.08 7.41 0.00 -0.66 -4.97 105.19 109.14 1r1n n GLY 185 Ca 0.11 -0.71 0.06 0.00 0.00 0.00 0.00 46.02 45.48 1r1n n GLY 185 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1r1n n GLU 186 N -1.34 0.63 -3.75 1.61 1.02 0.39 -4.95 120.64 114.25 1r1n n GLU 186 Ca 0.00 0.08 -0.13 0.00 -0.02 0.00 0.00 57.16 57.08 1r1n n GLU 186 Cb 0.31 -1.73 -0.10 0.00 -0.02 0.00 0.00 31.44 29.90 1r1n n GLU 186 CO 0.00 0.00 0.00 0.96 1.18 0.00 0.00 177.13 179.27 1r1n s ILE 187 N -3.17 0.02 0.05 -3.67 -4.36 -1.20 -4.98 121.20 103.89 1r1n s ILE 187 Ca -0.04 -0.14 -0.18 0.00 -0.26 0.00 0.00 60.65 60.03 1r1n s ILE 187 Cb 0.10 -0.54 -0.08 0.00 1.25 0.00 0.00 42.46 43.18 1r1n s ILE 187 CO 0.83 -0.08 1.28 0.44 0.24 0.00 0.00 174.94 177.65 1r1n h ASP 188 N 5.04 -0.75 -4.15 4.36 5.19 -1.84 -3.38 116.42 120.88 1r1n h ASP 188 Ca -0.27 0.07 -0.50 0.00 -0.62 0.00 0.00 57.03 55.70 1r1n h ASP 188 Cb 1.18 0.25 -0.13 0.00 0.18 0.00 0.00 39.33 40.81 1r1n h ASP 188 CO 0.32 -0.33 -0.52 0.00 -3.12 0.00 0.00 179.24 175.59 1r1n s ALA 189 N -4.59 2.42 -0.14 3.45 0.00 -1.10 -1.18 121.76 120.63 1r1n s ALA 189 Ca -0.09 -1.57 -0.29 0.00 0.00 0.00 0.00 51.96 50.01 1r1n s ALA 189 Cb 0.02 1.01 0.09 0.00 0.00 0.00 0.00 23.12 24.24 1r1n s ALA 189 CO 0.31 -0.45 0.79 0.00 0.00 0.00 0.00 175.76 176.40 1r1n s ALA 190 N -3.37 -1.83 -0.48 0.00 0.00 -0.39 -2.20 121.76 113.50 1r1n s ALA 190 Ca 0.31 1.56 -0.20 0.00 0.00 0.00 0.00 51.96 53.63 1r1n s ALA 190 Cb 0.03 -0.50 0.04 0.00 0.00 0.00 0.00 23.12 22.69 1r1n s ALA 190 CO 0.18 -0.34 0.63 -0.51 0.00 0.00 0.00 175.76 175.72 1r1n s LEU 191 N -0.76 4.77 0.00 0.00 2.01 -0.71 -0.82 118.68 123.17 1r1n s LEU 191 Ca -0.06 -0.69 0.00 0.00 0.01 0.00 0.00 54.13 53.40 1r1n s LEU 191 Cb -0.01 -2.54 0.00 0.00 0.01 0.00 0.00 46.19 43.64 1r1n s LEU 191 CO 0.05 -0.85 0.00 2.30 1.01 0.00 0.00 176.35 178.86 1r1n n ILE 192 N 5.70 0.00 -4.23 -0.59 -5.35 -0.79 -4.47 119.36 109.64 1r1n n ILE 192 Ca -0.05 0.00 -0.23 0.00 -0.27 0.00 0.00 62.75 62.21 1r1n n ILE 192 Cb 0.46 0.00 -0.06 0.00 -1.74 0.00 0.00 39.64 38.30 1r1n n ILE 192 CO 0.00 0.00 0.00 0.20 -1.76 0.00 0.00 176.55 174.99 1r1n s ASN 193 N 1.00 4.92 0.04 7.28 0.01 -1.26 -2.04 114.94 124.89 1r1n s ASN 193 Ca 0.00 -0.49 -0.17 0.00 -0.71 0.00 0.00 52.86 51.48 1r1n s ASN 193 Cb 0.00 -1.06 -0.22 0.00 0.41 0.00 0.00 41.25 40.38 1r1n s ASN 193 CO 0.00 -0.01 1.16 -0.55 -1.51 0.00 0.00 177.10 176.19 1r1n h ASN 194 N 1.74 0.69 -0.84 -1.22 -1.07 -1.76 -3.29 115.58 109.83 1r1n h ASN 194 Ca -0.46 -0.73 0.21 0.00 0.07 0.00 0.00 56.30 55.40 1r1n h ASN 194 Cb 1.25 -0.21 -0.05 0.00 -2.07 0.00 0.00 38.32 37.24 1r1n h ASN 194 CO 0.60 1.32 0.58 0.10 0.07 0.00 0.00 177.43 180.11 1r1n h TYR 195 N 0.13 0.29 -0.40 4.14 -0.00 -1.86 0.18 116.97 119.44 1r1n h TYR 195 Ca -0.08 0.01 -0.03 0.00 0.00 0.00 0.00 58.73 58.62 1r1n h TYR 195 Cb 1.41 -0.09 -0.02 0.00 0.00 0.00 0.00 36.73 38.03 1r1n h TYR 195 CO 0.12 0.08 0.11 1.88 -0.00 0.00 0.00 178.16 180.36 1r1n h TYR 196 N 0.22 0.59 0.13 0.10 -1.99 -1.97 -2.53 116.97 111.52 1r1n h TYR 196 Ca 0.42 -0.03 -0.01 0.00 2.00 0.00 0.00 58.73 61.11 1r1n h TYR 196 Cb 1.31 -0.18 0.00 0.00 2.00 0.00 0.00 36.73 39.86 1r1n h TYR 196 CO -0.00 0.50 -0.06 2.35 -0.00 0.00 0.00 178.16 180.94 1r1n h TRP 197 N 0.58 -0.17 -0.57 4.88 7.01 -0.82 -3.20 115.95 123.65 1r1n h TRP 197 Ca 0.14 -0.00 0.11 0.00 2.11 0.00 0.00 58.89 61.24 1r1n h TRP 197 Cb 0.19 0.06 -0.09 0.00 -2.10 0.00 0.00 29.16 27.22 1r1n h TRP 197 CO 0.01 0.16 0.07 0.45 -2.79 0.00 0.00 178.44 176.34 1r1n h HIS 198 N -0.98 0.09 -0.64 2.65 3.86 -1.52 0.34 115.15 118.95 1r1n h HIS 198 Ca -0.02 0.04 0.07 0.00 -1.16 0.00 0.00 60.37 59.30 1r1n h HIS 198 Cb 0.40 0.05 -0.04 0.00 1.06 0.00 0.00 27.41 28.89 1r1n h HIS 198 CO 0.07 -0.08 0.42 0.00 0.86 0.00 0.00 177.93 179.20 1r1n h ALA 199 N 1.49 1.84 -0.01 2.45 0.00 -1.60 0.10 119.26 123.53 1r1n h ALA 199 Ca 0.30 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.14 1r1n h ALA 199 Cb 0.46 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1r1n h ALA 199 CO -0.43 0.05 -0.19 0.35 0.00 0.00 0.00 179.25 179.02 1r1n h PHE 200 N 0.58 0.22 0.25 0.00 3.57 -0.81 -1.76 116.94 118.99 1r1n h PHE 200 Ca 0.28 -0.11 -0.01 0.00 3.53 0.00 0.00 57.97 61.66 1r1n h PHE 200 Cb 0.35 -0.03 0.00 0.00 2.79 0.00 0.00 35.95 39.07 1r1n h PHE 200 CO -0.00 0.87 -0.12 0.00 -2.23 0.00 0.00 178.31 176.83 1r1n h ALA 201 N 0.29 -0.34 -0.94 2.41 0.00 0.04 0.31 119.26 121.03 1r1n h ALA 201 Ca -0.02 -0.09 0.13 0.00 0.00 0.00 0.00 54.91 54.94 1r1n h ALA 201 Cb 0.92 0.13 -0.09 0.00 0.00 0.00 0.00 17.79 18.75 1r1n h ALA 201 CO 0.04 -0.67 0.56 -0.09 0.00 0.00 0.00 179.25 179.08 1r1n h ARG 202 N -0.38 0.81 0.81 0.00 2.43 -0.91 0.86 114.38 118.00 1r1n h ARG 202 Ca -0.03 -0.05 -0.04 0.00 -0.81 0.00 0.00 59.98 59.05 1r1n h ARG 202 Cb 0.29 -0.18 0.01 0.00 -0.42 0.00 0.00 29.97 29.66 1r1n h ARG 202 CO 0.06 0.54 -0.39 1.49 -1.51 0.00 0.00 179.97 180.15 1r1n h GLU 203 N 0.83 -1.05 0.00 0.20 4.81 -0.36 -3.31 114.58 115.70 1r1n h GLU 203 Ca 0.49 0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.79 1r1n h GLU 203 Cb 0.58 0.24 0.00 0.00 0.63 0.00 0.00 28.75 30.20 1r1n h GLU 203 CO -0.31 -0.69 -0.76 0.87 -0.73 0.00 0.00 179.01 177.39 1r1n h LYS 204 N -1.14 0.00 -0.06 1.92 1.79 -0.21 -3.50 116.57 115.38 1r1n h LYS 204 Ca -0.11 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.36 1r1n h LYS 204 Cb 0.85 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.50 1r1n h LYS 204 CO 0.18 0.00 0.00 0.41 -1.08 0.00 0.00 179.45 178.96 1r1n n GLY 205 N 1.27 0.97 0.39 3.86 0.00 0.30 -4.69 105.19 107.28 1r1n n GLY 205 Ca 0.02 -1.12 0.17 0.00 0.00 0.00 0.00 46.02 45.08 1r1n n GLY 205 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1r1n h VAL 206 N 0.00 0.73 0.00 1.61 3.04 -1.85 -0.44 116.25 119.33 1r1n h VAL 206 Ca 0.00 -0.17 -0.01 0.00 -1.01 0.00 0.00 66.70 65.51 1r1n h VAL 206 Cb 0.00 0.19 -0.00 0.00 -2.01 0.00 0.00 31.29 29.47 1r1n h VAL 206 CO 0.00 0.09 -0.06 -0.61 -1.01 0.00 0.00 177.57 175.98 1r1n h GLN 207 N 0.49 0.00 -0.24 4.17 5.75 -1.91 0.18 115.11 123.54 1r1n h GLN 207 Ca 0.46 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.96 1r1n h GLN 207 Cb 1.02 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.57 1r1n h GLN 207 CO -0.19 0.06 0.00 0.09 -2.65 0.00 0.00 178.83 176.14 1r1n n ASN 208 N -3.36 2.77 -4.47 -0.69 4.13 -0.19 -4.85 115.26 108.61 1r1n n ASN 208 Ca -0.01 -1.89 -0.37 0.00 1.68 0.00 0.00 54.58 53.99 1r1n n ASN 208 Cb 0.22 -0.15 -0.12 0.00 -1.54 0.00 0.00 39.78 38.19 1r1n n ASN 208 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 1r1n s VAL 209 N -1.69 4.44 -0.46 2.41 1.01 0.05 -4.98 120.40 121.16 1r1n s VAL 209 Ca 0.35 -0.13 0.24 0.00 0.00 0.00 0.00 61.98 62.44 1r1n s VAL 209 Cb 0.21 -3.08 0.20 0.00 0.00 0.00 0.00 36.38 33.71 1r1n s VAL 209 CO 0.30 0.33 1.44 0.45 0.00 0.00 0.00 175.10 177.62 1r1n h HIS 210 N 8.21 0.00 -3.26 5.22 3.86 -1.88 -3.47 115.15 123.83 1r1n h HIS 210 Ca -0.38 0.00 -0.53 0.00 -1.16 0.00 0.00 60.37 58.30 1r1n h HIS 210 Cb 1.18 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.63 1r1n h HIS 210 CO 0.68 0.00 -0.15 -0.08 0.86 0.00 0.00 177.93 179.24 1r1n s THR 211 N -3.23 5.02 0.06 2.45 -1.32 -1.26 -2.19 115.64 115.17 1r1n s THR 211 Ca 0.05 0.16 -0.00 0.00 -1.21 0.00 0.00 61.69 60.69 1r1n s THR 211 Cb 0.09 -3.69 -0.04 0.00 -1.51 0.00 0.00 72.50 67.35 1r1n s THR 211 CO 0.70 -0.22 -0.04 -0.13 -2.21 0.00 0.00 174.62 172.71 1r1n s ARG 212 N -3.28 0.64 -0.11 7.08 1.81 0.13 -4.92 118.95 120.31 1r1n s ARG 212 Ca 0.44 -1.18 -0.06 0.00 -1.72 0.00 0.00 55.73 53.22 1r1n s ARG 212 Cb -0.11 0.07 -0.04 0.00 -0.45 0.00 0.00 34.95 34.43 1r1n s ARG 212 CO 0.27 -0.07 0.13 -0.51 -0.68 0.00 0.00 175.30 174.44 1r1n s LEU 213 N -2.77 4.30 -0.05 2.53 1.43 -1.26 -0.40 118.68 122.46 1r1n s LEU 213 Ca 0.06 0.42 0.06 0.00 -1.03 0.00 0.00 54.13 53.64 1r1n s LEU 213 Cb 0.05 -2.10 -0.01 0.00 0.03 0.00 0.00 46.19 44.16 1r1n s LEU 213 CO -0.07 0.39 -0.25 0.21 0.23 0.00 0.00 176.35 176.86 1r1n s ASN 214 N -1.11 3.08 -0.17 2.29 3.84 -0.41 -4.98 114.94 117.48 1r1n s ASN 214 Ca 0.16 -0.50 -0.00 0.00 0.21 0.00 0.00 52.86 52.72 1r1n s ASN 214 Cb -0.12 -0.76 -0.00 0.00 -0.55 0.00 0.00 41.25 39.81 1r1n s ASN 214 CO 0.05 0.26 -0.14 -0.36 -2.79 0.00 0.00 177.10 174.12 1r1n s PHE 215 N -0.24 2.81 0.13 0.43 0.40 -1.26 -2.44 117.98 117.82 1r1n s PHE 215 Ca -0.01 -1.05 -0.12 0.00 -0.60 0.00 0.00 56.93 55.15 1r1n s PHE 215 Cb -0.13 -1.92 -0.07 0.00 0.51 0.00 0.00 43.02 41.40 1r1n s PHE 215 CO 0.03 -0.49 1.43 -0.39 0.70 0.00 0.00 175.22 176.50 1r1n h VAL 216 N 5.67 1.28 -0.39 -0.44 -1.51 -1.90 -3.49 116.25 115.47 1r1n h VAL 216 Ca -0.35 -1.62 0.00 0.00 -1.23 0.00 0.00 66.70 63.50 1r1n h VAL 216 Cb 1.18 1.53 0.00 0.00 -2.13 0.00 0.00 31.29 31.87 1r1n h VAL 216 CO 0.58 0.53 0.00 0.54 -1.23 0.00 0.00 177.57 178.00 1r1n n ARG 217 N -4.07 0.00 -1.89 5.19 1.74 -1.26 -4.86 116.66 111.51 1r1n n ARG 217 Ca -0.03 0.00 -0.19 0.00 -0.77 0.00 0.00 57.85 56.86 1r1n n ARG 217 Cb 0.57 0.00 -0.05 0.00 -1.02 0.00 0.00 32.46 31.96 1r1n n ARG 217 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 1r1n n HIS 218 N 0.00 -0.51 -1.73 -1.55 8.25 -1.25 -1.36 115.22 117.08 1r1n n HIS 218 Ca 0.00 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.31 1r1n n HIS 218 Cb 0.00 -3.41 -0.05 0.00 1.12 0.00 0.00 29.99 27.65 1r1n n HIS 218 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 1r1n n ARG 219 N -2.53 -1.10 -2.41 -0.41 5.12 0.87 -4.98 116.66 111.21 1r1n n ARG 219 Ca -0.20 0.93 -0.35 0.00 -1.93 0.00 0.00 57.85 56.30 1r1n n ARG 219 Cb 0.64 -5.14 -0.02 0.00 -1.16 0.00 0.00 32.46 26.78 1r1n n ARG 219 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 1r1n s ASP 220 N -2.66 6.10 0.48 0.55 2.15 -0.46 -4.39 116.67 118.43 1r1n s ASP 220 Ca 0.00 2.07 0.19 0.00 0.43 0.00 0.00 52.55 55.24 1r1n s ASP 220 Cb 0.00 -2.57 1.20 0.00 -0.30 0.00 0.00 42.92 41.25 1r1n s ASP 220 CO 0.00 -0.95 1.98 -0.65 -0.17 0.00 0.00 175.17 175.37 1r1n h PRO 221 N 1.51 0.21 0.00 4.34 0.11 -1.93 0.57 132.00 136.80 1r1n h PRO 221 Ca -0.50 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1r1n h PRO 221 Cb 1.24 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1r1n h PRO 221 CO 0.58 0.14 0.00 0.41 -0.21 0.00 0.00 178.00 178.92 1r1n n GLY 222 N -1.57 -0.71 1.41 -0.55 0.00 -1.26 -1.86 105.19 100.63 1r1n n GLY 222 Ca 0.11 -0.10 0.11 0.00 0.00 0.00 0.00 46.02 46.13 1r1n n GLY 222 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r1n n ALA 223 N -1.14 2.63 -1.63 4.61 0.00 0.20 -4.49 120.51 120.69 1r1n n ALA 223 Ca 0.11 -1.35 -0.46 0.00 0.00 0.00 0.00 53.44 51.74 1r1n n ALA 223 Cb 0.10 -0.97 -0.03 0.00 0.00 0.00 0.00 19.45 18.55 1r1n n ALA 223 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1r1n n LEU 224 N 1.43 2.42 -4.00 0.00 7.94 -0.78 -4.36 117.00 119.65 1r1n n LEU 224 Ca 0.24 1.16 -0.28 0.00 -1.11 0.00 0.00 56.01 56.02 1r1n n LEU 224 Cb 0.70 -1.34 -0.17 0.00 0.53 0.00 0.00 43.42 43.14 1r1n n LEU 224 CO 0.19 -0.91 -0.47 -0.69 -1.11 0.00 0.00 177.39 174.40 1r1n s VAL 225 N -0.39 1.37 -0.12 1.96 1.01 -1.25 -1.50 120.40 121.47 1r1n s VAL 225 Ca 0.67 -0.53 -0.14 0.00 0.00 0.00 0.00 61.98 61.98 1r1n s VAL 225 Cb -0.71 -1.29 -0.05 0.00 0.00 0.00 0.00 36.38 34.33 1r1n s VAL 225 CO 0.54 0.42 0.31 -0.89 0.00 0.00 0.00 175.10 175.48 1r1n s THR 226 N 1.35 5.27 0.23 3.92 2.01 0.85 -4.79 115.64 124.47 1r1n s THR 226 Ca 0.00 0.59 0.05 0.00 0.31 0.00 0.00 61.69 62.64 1r1n s THR 226 Cb -0.14 -3.63 -0.03 0.00 0.01 0.00 0.00 72.50 68.71 1r1n s THR 226 CO -0.06 0.44 0.35 -0.31 -0.69 0.00 0.00 174.62 174.35 1r1n s TYR 227 N 0.03 3.45 0.31 4.92 1.51 -1.26 0.12 117.35 126.43 1r1n s TYR 227 Ca 0.18 -0.01 0.09 0.00 -1.01 0.00 0.00 57.07 56.32 1r1n s TYR 227 Cb -0.14 -1.58 -0.06 0.00 -0.11 0.00 0.00 41.96 40.08 1r1n s TYR 227 CO 0.06 0.45 -0.10 -1.54 -1.11 0.00 0.00 175.55 173.30 1r1n s SER 228 N -3.92 3.42 0.20 2.29 1.04 -0.14 -3.73 113.70 112.86 1r1n s SER 228 Ca 0.34 -1.16 -0.23 0.00 0.48 0.00 0.00 55.95 55.37 1r1n s SER 228 Cb -0.09 -0.29 0.05 0.00 0.10 0.00 0.00 66.02 65.79 1r1n s SER 228 CO 0.29 -0.20 0.84 -0.83 0.98 0.00 0.00 173.24 174.32 1r1n s GLY 229 N -3.54 -0.19 0.19 7.32 0.00 -0.01 -0.63 107.32 110.45 1r1n s GLY 229 Ca 0.31 -0.02 0.03 0.00 0.00 0.00 0.00 44.72 45.05 1r1n s GLY 229 CO 0.15 -0.02 -0.03 0.00 0.00 0.00 0.00 173.10 173.19 1r1n s ALA 230 N -3.57 1.60 -0.08 3.20 0.00 -1.03 0.20 121.76 122.08 1r1n s ALA 230 Ca 0.11 -1.64 -0.30 0.00 0.00 0.00 0.00 51.96 50.13 1r1n s ALA 230 Cb -0.03 0.36 0.10 0.00 0.00 0.00 0.00 23.12 23.54 1r1n s ALA 230 CO 0.03 -0.21 0.85 0.00 0.00 0.00 0.00 175.76 176.42 1r1n s ALA 231 N -3.44 -1.84 -0.16 0.00 0.00 0.17 -2.44 121.76 114.05 1r1n s ALA 231 Ca 0.24 1.36 -0.10 0.00 0.00 0.00 0.00 51.96 53.46 1r1n s ALA 231 Cb 0.05 -0.23 -0.05 0.00 0.00 0.00 0.00 23.12 22.89 1r1n s ALA 231 CO 0.05 -0.40 0.18 0.08 0.00 0.00 0.00 175.76 175.67 1r1n s VAL 232 N -1.52 5.39 0.16 0.00 1.01 -1.26 0.94 120.40 125.11 1r1n s VAL 232 Ca -0.04 0.31 -0.30 0.00 0.00 0.00 0.00 61.98 61.95 1r1n s VAL 232 Cb -0.00 -3.50 -0.07 0.00 0.00 0.00 0.00 36.38 32.81 1r1n s VAL 232 CO 0.03 0.49 1.09 -0.76 0.00 0.00 0.00 175.10 175.94 1r1n s LEU 233 N -0.11 4.48 0.44 3.92 2.01 -0.50 -1.08 118.68 127.84 1r1n s LEU 233 Ca 0.13 2.04 0.15 0.00 0.01 0.00 0.00 54.13 56.45 1r1n s LEU 233 Cb -0.12 -3.60 1.06 0.00 0.01 0.00 0.00 46.19 43.54 1r1n s LEU 233 CO 0.02 -0.22 1.98 0.11 1.01 0.00 0.00 176.35 179.25 1r1n h LYS 234 N 5.33 0.36 0.00 1.70 1.57 -1.44 0.05 116.57 124.15 1r1n h LYS 234 Ca -0.44 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.32 1r1n h LYS 234 Cb 1.21 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 33.44 1r1n h LYS 234 CO 0.73 0.24 0.00 -1.13 -0.57 0.00 0.00 179.45 178.72 1r1n n SER 235 N -4.47 0.00 -4.70 0.86 3.41 -1.26 -4.89 113.62 102.57 1r1n n SER 235 Ca 0.10 -0.27 -0.43 0.00 -0.26 0.00 0.00 58.87 58.00 1r1n n SER 235 Cb 0.39 -0.14 -0.02 0.00 -0.26 0.00 0.00 64.21 64.18 1r1n n SER 235 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1r1n n SER 236 N -1.14 3.25 -0.07 4.04 2.88 0.00 -4.90 113.62 117.69 1r1n n SER 236 Ca 0.11 1.14 0.11 0.00 -1.33 0.00 0.00 58.87 58.90 1r1n n SER 236 Cb 0.10 -1.50 0.00 0.00 -0.75 0.00 0.00 64.21 62.07 1r1n n SER 236 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1r1n n GLN 237 N 2.22 0.17 -2.64 -1.46 1.13 -1.26 -4.19 117.38 111.35 1r1n n GLN 237 Ca 0.11 -0.13 -0.23 0.00 -1.94 0.00 0.00 57.00 54.81 1r1n n GLN 237 Cb 0.34 -1.50 -0.00 0.00 0.11 0.00 0.00 30.24 29.18 1r1n n GLN 237 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 1r1n n ASN 238 N -1.30 3.80 -0.06 1.08 4.13 -1.26 -4.96 115.26 116.69 1r1n n ASN 238 Ca 0.05 -3.47 -0.09 0.00 1.68 0.00 0.00 54.58 52.75 1r1n n ASN 238 Cb 0.35 -0.50 -0.06 0.00 -1.54 0.00 0.00 39.78 38.02 1r1n n ASN 238 CO 0.00 0.00 0.00 0.11 0.28 0.00 0.00 177.26 177.65 1r1n h LYS 239 N 2.76 -0.28 -0.34 3.52 1.57 -1.95 -0.63 116.57 121.22 1r1n h LYS 239 Ca 0.18 0.02 0.07 0.00 -1.87 0.00 0.00 60.65 59.05 1r1n h LYS 239 Cb 0.90 0.06 -0.07 0.00 0.08 0.00 0.00 32.23 33.20 1r1n h LYS 239 CO 0.75 -0.19 -0.12 -0.44 -0.57 0.00 0.00 179.45 178.89 1r1n h ASP 240 N -0.29 -0.41 0.17 0.86 3.32 -1.96 0.10 116.42 118.21 1r1n h ASP 240 Ca 0.04 0.11 -0.03 0.00 0.02 0.00 0.00 57.03 57.17 1r1n h ASP 240 Cb 0.40 0.25 -0.00 0.00 0.22 0.00 0.00 39.33 40.19 1r1n h ASP 240 CO -0.35 -0.15 -0.16 -0.33 -1.72 0.00 0.00 179.24 176.54 1r1n h GLU 241 N -0.05 0.00 -0.20 3.56 5.08 -1.92 0.16 114.58 121.22 1r1n h GLU 241 Ca 0.17 0.00 -0.19 0.00 -1.00 0.00 0.00 59.36 58.34 1r1n h GLU 241 Cb 0.30 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.55 1r1n h GLU 241 CO -0.38 0.16 -0.64 0.00 -1.00 0.00 0.00 179.01 177.15 1r1n h ALA 242 N 1.84 0.49 -0.32 3.43 0.00 0.33 -1.66 119.26 123.37 1r1n h ALA 242 Ca -0.00 -0.55 -0.14 0.00 0.00 0.00 0.00 54.91 54.21 1r1n h ALA 242 Cb 0.28 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1r1n h ALA 242 CO 0.02 0.69 -0.38 0.87 0.00 0.00 0.00 179.25 180.46 1r1n h LYS 243 N 0.53 0.75 -0.49 0.00 1.57 -0.19 -2.78 116.57 115.95 1r1n h LYS 243 Ca -0.01 -0.38 0.06 0.00 -1.87 0.00 0.00 60.65 58.45 1r1n h LYS 243 Cb 1.24 0.01 -0.05 0.00 0.08 0.00 0.00 32.23 33.50 1r1n h LYS 243 CO 0.13 1.00 0.21 -0.22 -0.57 0.00 0.00 179.45 180.00 1r1n h LYS 244 N 0.62 0.39 0.05 3.15 1.63 -0.51 -0.88 116.57 121.02 1r1n h LYS 244 Ca 0.06 -0.02 -0.00 0.00 -0.85 0.00 0.00 60.65 59.83 1r1n h LYS 244 Cb 0.92 -0.09 0.00 0.00 -0.60 0.00 0.00 32.23 32.46 1r1n h LYS 244 CO 0.08 0.26 -0.03 0.35 -3.45 0.00 0.00 179.45 176.67 1r1n h PHE 245 N 0.41 -0.07 -0.98 1.91 3.57 -1.15 0.06 116.94 120.69 1r1n h PHE 245 Ca 0.23 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.74 1r1n h PHE 245 Cb 0.20 0.02 -0.05 0.00 2.79 0.00 0.00 35.95 38.92 1r1n h PHE 245 CO -0.14 0.05 0.65 0.28 -2.23 0.00 0.00 178.31 176.92 1r1n h VAL 246 N -0.17 1.24 -0.31 1.41 2.07 -1.29 0.33 116.25 119.52 1r1n h VAL 246 Ca -0.01 -0.45 -0.05 0.00 0.82 0.00 0.00 66.70 67.01 1r1n h VAL 246 Cb 0.15 -0.19 -0.02 0.00 -1.52 0.00 0.00 31.29 29.72 1r1n h VAL 246 CO 0.01 0.24 -0.04 0.00 0.02 0.00 0.00 177.57 177.80 1r1n h ALA 247 N 1.40 1.36 -0.04 1.67 0.00 -0.98 -1.52 119.26 121.15 1r1n h ALA 247 Ca 0.36 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 1r1n h ALA 247 Cb -0.13 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.52 1r1n h ALA 247 CO -0.08 0.44 -0.01 0.35 0.00 0.00 0.00 179.25 179.94 1r1n h PHE 248 N 0.46 0.09 -0.98 0.00 3.57 0.10 -2.43 116.94 117.76 1r1n h PHE 248 Ca 0.10 -0.02 0.20 0.00 3.53 0.00 0.00 57.97 61.78 1r1n h PHE 248 Cb 0.37 -0.02 -0.09 0.00 2.79 0.00 0.00 35.95 38.99 1r1n h PHE 248 CO 0.01 0.44 0.62 -0.07 -2.23 0.00 0.00 178.31 177.08 1r1n h LEU 249 N -0.29 0.67 0.00 0.59 3.38 0.11 -1.57 115.31 118.20 1r1n h LEU 249 Ca 0.01 0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.06 1r1n h LEU 249 Cb 0.42 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.13 1r1n h LEU 249 CO 0.00 0.24 -0.54 0.00 0.09 0.00 0.00 178.44 178.23 1r1n n ALA 250 N -2.39 2.99 -1.59 1.53 0.00 -0.62 -3.85 120.51 116.57 1r1n n ALA 250 Ca 0.22 -0.25 -0.13 0.00 0.00 0.00 0.00 53.44 53.29 1r1n n ALA 250 Cb 0.62 -1.19 0.12 0.00 0.00 0.00 0.00 19.45 19.00 1r1n n ALA 250 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1r1n n GLY 251 N 1.38 -1.24 0.15 0.00 0.00 -0.59 -4.57 105.19 100.31 1r1n n GLY 251 Ca 0.04 -1.71 -0.06 0.00 0.00 0.00 0.00 46.02 44.29 1r1n n GLY 251 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1r1n h LYS 252 N 0.00 -0.35 -0.83 1.61 1.57 -1.91 0.19 116.57 116.85 1r1n h LYS 252 Ca -0.25 0.02 0.22 0.00 -1.87 0.00 0.00 60.65 58.77 1r1n h LYS 252 Cb 0.70 0.08 -0.04 0.00 0.08 0.00 0.00 32.23 33.04 1r1n h LYS 252 CO 0.18 -0.23 0.58 0.93 -0.57 0.00 0.00 179.45 180.34 1r1n h GLU 253 N -0.48 0.14 -0.14 3.15 3.07 -1.96 2.60 114.58 120.97 1r1n h GLU 253 Ca -0.04 -0.01 -0.11 0.00 -0.50 0.00 0.00 59.36 58.70 1r1n h GLU 253 Cb 0.28 -0.03 0.00 0.00 -0.84 0.00 0.00 28.75 28.16 1r1n h GLU 253 CO 0.06 0.09 -0.35 0.78 -1.40 0.00 0.00 179.01 178.20 1r1n h GLY 254 N 0.15 0.53 2.00 -3.84 0.00 -1.53 -2.07 103.07 98.31 1r1n h GLY 254 Ca 0.41 -0.66 -0.11 0.00 0.00 0.00 0.00 47.33 46.97 1r1n h GLY 254 CO -0.07 0.59 -0.54 1.46 0.00 0.00 0.00 176.54 177.99 1r1n h GLN 255 N 0.10 0.00 -0.25 4.80 1.08 0.20 -3.05 115.11 117.99 1r1n h GLN 255 Ca -0.00 0.00 -0.15 0.00 -1.45 0.00 0.00 58.65 57.05 1r1n h GLN 255 Cb 0.96 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.39 1r1n h GLN 255 CO 0.08 0.54 -0.43 0.00 -0.95 0.00 0.00 178.83 178.07 1r1n h ARG 256 N 0.00 0.73 -0.26 1.46 2.47 0.44 -0.30 114.38 118.92 1r1n h ARG 256 Ca -0.01 -0.45 -0.08 0.00 -1.26 0.00 0.00 59.98 58.18 1r1n h ARG 256 Cb 1.39 0.05 -0.01 0.00 -1.65 0.00 0.00 29.97 29.74 1r1n h ARG 256 CO 0.07 1.08 -0.18 0.00 0.56 0.00 0.00 179.97 181.50 1r1n h ALA 257 N 0.65 1.20 0.03 0.04 0.00 -1.42 -2.65 119.26 117.11 1r1n h ALA 257 Ca 0.02 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 54.63 1r1n h ALA 257 Cb 1.03 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.69 1r1n h ALA 257 CO 0.10 0.51 -0.01 1.25 0.00 0.00 0.00 179.25 181.10 1r1n h LEU 258 N 0.42 -0.03 0.00 0.00 5.85 -1.42 -3.19 115.31 116.94 1r1n h LEU 258 Ca 0.07 -0.63 0.00 0.00 0.84 0.00 0.00 57.88 58.16 1r1n h LEU 258 Cb 0.56 0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.60 1r1n h LEU 258 CO 0.04 0.64 0.00 1.07 -0.34 0.00 0.00 178.44 179.85 1r1n n THR 259 N -4.78 0.00 0.01 1.05 5.66 -0.13 -2.36 114.28 113.72 1r1n n THR 259 Ca -0.09 0.00 -0.01 0.00 -3.05 0.00 0.00 64.05 60.90 1r1n n THR 259 Cb 0.33 -0.47 -0.10 0.00 -1.55 0.00 0.00 70.33 68.54 1r1n n THR 259 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1r1n n ALA 260 N -0.76 1.92 0.05 1.79 0.00 -1.00 -2.46 120.51 120.05 1r1n n ALA 260 Ca 0.07 -0.63 0.01 0.00 0.00 0.00 0.00 53.44 52.89 1r1n n ALA 260 Cb 0.03 -0.86 -0.02 0.00 0.00 0.00 0.00 19.45 18.61 1r1n n ALA 260 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1r1n n VAL 261 N -2.84 0.00 -4.34 0.00 0.24 -1.00 -4.94 118.33 105.45 1r1n n VAL 261 Ca -0.12 -0.23 -0.18 0.00 -2.04 0.00 0.00 64.34 61.77 1r1n n VAL 261 Cb 0.87 0.69 -0.15 0.00 -1.47 0.00 0.00 33.84 33.77 1r1n n VAL 261 CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 1r1n s ARG 262 N -1.76 0.72 0.00 7.34 3.52 -1.02 -4.97 118.95 122.78 1r1n s ARG 262 Ca -0.00 -0.30 -0.04 0.00 -0.13 0.00 0.00 55.73 55.26 1r1n s ARG 262 Cb 0.02 -0.69 -0.19 0.00 -1.56 0.00 0.00 34.95 32.52 1r1n s ARG 262 CO 0.10 0.17 2.84 0.00 -0.81 0.00 0.00 175.30 177.60 1r1n n ALA 263 N 2.95 5.09 -2.31 6.12 0.00 -1.26 -4.41 120.51 126.69 1r1n n ALA 263 Ca -0.14 -1.31 -0.38 0.00 0.00 0.00 0.00 53.44 51.62 1r1n n ALA 263 Cb 0.57 -2.20 -0.06 0.00 0.00 0.00 0.00 19.45 17.76 1r1n n ALA 263 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1r1n s GLU 264 N 1.32 4.11 -0.40 0.00 0.41 -1.26 -4.56 118.70 118.32 1r1n s GLU 264 Ca 0.48 0.64 -0.29 0.00 -0.41 0.00 0.00 54.97 55.39 1r1n s GLU 264 Cb 0.23 -3.14 0.02 0.00 -1.78 0.00 0.00 34.13 29.47 1r1n s GLU 264 CO 0.00 0.59 1.10 0.71 -0.49 0.00 0.00 175.26 177.17 1r1n s TYR 265 N -1.22 2.98 0.20 1.61 1.51 -1.05 -4.79 117.35 116.60 1r1n s TYR 265 Ca 0.32 0.95 -0.31 0.00 -1.01 0.00 0.00 57.07 57.02 1r1n s TYR 265 Cb -0.18 -4.06 -0.10 0.00 -0.11 0.00 0.00 41.96 37.51 1r1n s TYR 265 CO 0.19 -1.02 1.55 -1.25 -1.11 0.00 0.00 175.55 173.91 1r1n s PRO 266 N 4.05 4.21 0.00 -1.71 0.04 -1.26 -2.51 135.00 137.81 1r1n s PRO 266 Ca 0.47 2.39 0.27 0.00 0.04 0.00 0.00 61.00 64.17 1r1n s PRO 266 Cb -0.10 -3.12 0.89 0.00 0.04 0.00 0.00 34.50 32.21 1r1n s PRO 266 CO 0.23 -0.58 1.65 1.28 0.04 0.00 0.00 177.00 179.63 1r1n n LEU 267 N 3.37 0.69 -4.48 -3.56 4.77 -1.21 -4.64 117.00 111.94 1r1n n LEU 267 Ca 0.12 -0.08 -0.43 0.00 -0.03 0.00 0.00 56.01 55.58 1r1n n LEU 267 Cb 0.38 -0.19 -0.08 0.00 -2.33 0.00 0.00 43.42 41.21 1r1n n LEU 267 CO 0.62 0.14 0.17 0.21 -1.33 0.00 0.00 177.39 177.20 1r1n s ASN 268 N -2.62 6.22 0.00 -1.43 3.04 -1.26 -4.34 114.94 114.55 1r1n s ASN 268 Ca 0.23 -0.65 0.06 0.00 0.04 0.00 0.00 52.86 52.54 1r1n s ASN 268 Cb 0.19 -2.25 0.29 0.00 -1.54 0.00 0.00 41.25 37.95 1r1n s ASN 268 CO 0.54 -0.64 1.02 -0.81 -3.04 0.00 0.00 177.10 174.17 1r1n n PRO 269 N 5.75 0.08 -0.77 0.43 -0.04 -1.26 -2.72 135.00 136.47 1r1n n PRO 269 Ca -0.06 0.23 0.08 0.00 -0.04 0.00 0.00 63.50 63.70 1r1n n PRO 269 Cb 0.47 -1.50 0.38 0.00 -0.04 0.00 0.00 33.50 32.81 1r1n n PRO 269 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1r1n n HIS 270 N -1.28 1.80 -4.95 0.54 8.25 -1.26 -4.91 115.22 113.41 1r1n n HIS 270 Ca 0.03 -0.69 -0.31 0.00 -0.26 0.00 0.00 57.72 56.48 1r1n n HIS 270 Cb 0.05 -0.40 -0.17 0.00 1.12 0.00 0.00 29.99 30.59 1r1n n HIS 270 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1r1n s VAL 271 N -2.41 1.96 -0.22 1.59 1.01 -1.10 -5.03 120.40 116.20 1r1n s VAL 271 Ca 0.53 -0.94 -0.18 0.00 0.00 0.00 0.00 61.98 61.39 1r1n s VAL 271 Cb 0.38 -1.71 -0.03 0.00 0.00 0.00 0.00 36.38 35.01 1r1n s VAL 271 CO 0.19 0.53 0.50 -0.69 0.00 0.00 0.00 175.10 175.63 1r1n s VAL 272 N 0.56 5.11 0.76 2.92 1.01 -1.26 -4.96 120.40 124.54 1r1n s VAL 272 Ca -0.14 0.89 -0.14 0.00 0.00 0.00 0.00 61.98 62.59 1r1n s VAL 272 Cb -0.17 -3.82 0.06 0.00 0.00 0.00 0.00 36.38 32.45 1r1n s VAL 272 CO 0.04 0.17 1.18 -0.55 0.00 0.00 0.00 175.10 175.94 1r1n s SER 273 N 1.24 4.03 0.18 3.32 0.15 -1.26 -4.94 113.70 116.42 1r1n s SER 273 Ca 0.22 2.26 0.23 0.00 0.70 0.00 0.00 55.95 59.36 1r1n s SER 273 Cb -0.15 -2.58 -0.00 0.00 -1.71 0.00 0.00 66.02 61.57 1r1n s SER 273 CO 0.09 -2.37 1.02 1.07 1.20 0.00 0.00 173.24 174.25 1r1n n THR 274 N -3.05 0.55 -3.86 6.45 5.66 -1.03 -4.84 114.28 114.17 1r1n n THR 274 Ca 0.13 -0.52 -0.21 0.00 -3.05 0.00 0.00 64.05 60.40 1r1n n THR 274 Cb 0.51 -0.28 -0.03 0.00 -1.55 0.00 0.00 70.33 68.98 1r1n n THR 274 CO 0.00 0.00 0.00 -0.36 -3.05 0.00 0.00 175.07 171.66 1r1n s PHE 275 N -3.36 3.12 0.00 1.09 0.40 -1.26 -4.95 117.98 113.02 1r1n s PHE 275 Ca -0.01 -0.17 -0.01 0.00 -0.60 0.00 0.00 56.93 56.14 1r1n s PHE 275 Cb 0.10 -1.68 -0.05 0.00 0.51 0.00 0.00 43.02 41.90 1r1n s PHE 275 CO 0.80 0.29 1.05 0.09 0.70 0.00 0.00 175.22 178.15 1r1n n ASN 276 N -1.38 0.99 -4.77 1.36 3.02 -1.26 -4.83 115.26 108.38 1r1n n ASN 276 Ca -0.05 -1.66 -0.39 0.00 -0.03 0.00 0.00 54.58 52.45 1r1n n ASN 276 Cb 0.58 -0.26 -0.06 0.00 -0.61 0.00 0.00 39.78 39.43 1r1n n ASN 276 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1r1n s LEU 277 N 0.00 4.56 0.31 3.41 1.43 -1.26 -5.06 118.68 122.07 1r1n s LEU 277 Ca 0.12 1.57 -0.05 0.00 -1.03 0.00 0.00 54.13 54.74 1r1n s LEU 277 Cb 0.06 -3.24 -0.05 0.00 0.03 0.00 0.00 46.19 42.98 1r1n s LEU 277 CO 0.00 0.18 0.58 -0.70 0.23 0.00 0.00 176.35 176.64 1r1n s GLU 278 N -0.95 3.62 0.01 1.70 2.12 -1.26 -4.73 118.70 119.21 1r1n s GLU 278 Ca 0.36 0.01 -0.33 0.00 0.36 0.00 0.00 54.97 55.37 1r1n s GLU 278 Cb -0.22 -2.62 -0.11 0.00 0.26 0.00 0.00 34.13 31.44 1r1n s GLU 278 CO 0.25 0.17 1.85 -2.30 -0.54 0.00 0.00 175.26 174.69 1r1n n PRO 279 N -1.12 2.45 -0.17 4.30 -0.02 -1.26 -4.78 135.00 134.40 1r1n n PRO 279 Ca -0.02 0.89 0.28 0.00 -2.02 0.00 0.00 63.50 62.64 1r1n n PRO 279 Cb 0.54 -2.76 0.55 0.00 -0.02 0.00 0.00 33.50 31.81 1r1n n PRO 279 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 1r1n h ILE 280 N 5.10 0.10 -0.48 4.25 2.10 -1.94 0.67 117.51 127.31 1r1n h ILE 280 Ca -0.48 0.00 -0.12 0.00 1.08 0.00 0.00 64.86 65.34 1r1n h ILE 280 Cb 1.25 0.18 -0.02 0.00 -1.09 0.00 0.00 36.82 37.15 1r1n h ILE 280 CO 0.94 0.00 -0.17 0.00 -1.08 0.00 0.00 178.15 177.84 1r1n h ALA 281 N 0.83 0.79 0.00 0.18 0.00 -1.95 -2.69 119.26 116.43 1r1n h ALA 281 Ca 0.45 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1r1n h ALA 281 Cb 2.50 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 20.11 1r1n h ALA 281 CO -0.00 0.66 0.00 0.87 0.00 0.00 0.00 179.25 180.77 1r1n h LYS 282 N 0.83 0.00 0.00 0.00 1.79 0.02 -2.70 116.57 116.51 1r1n h LYS 282 Ca 0.12 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.59 1r1n h LYS 282 Cb 0.72 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.37 1r1n h LYS 282 CO 0.06 0.00 0.00 -0.07 -1.08 0.00 0.00 179.45 178.36 1r1n h LEU 283 N 0.00 0.00 -1.43 2.94 3.38 -1.50 -3.47 115.31 115.24 1r1n h LEU 283 Ca 0.00 0.00 -0.50 0.00 0.09 0.00 0.00 57.88 57.47 1r1n h LEU 283 Cb 0.28 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.96 1r1n h LEU 283 CO 0.00 0.00 -0.83 -0.62 0.09 0.00 0.00 178.44 177.08 1r1n n GLU 284 N -2.56 -4.10 -2.37 1.13 1.02 -1.02 -4.16 120.64 108.59 1r1n n GLU 284 Ca 0.00 0.48 -0.41 0.00 -0.02 0.00 0.00 57.16 57.21 1r1n n GLU 284 Cb 0.18 -5.03 -0.04 0.00 -0.02 0.00 0.00 31.44 26.53 1r1n n GLU 284 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1r1n s ALA 285 N -3.57 3.44 0.75 0.62 0.00 -1.26 -0.09 121.76 121.65 1r1n s ALA 285 Ca 0.37 0.99 -0.11 0.00 0.00 0.00 0.00 51.96 53.21 1r1n s ALA 285 Cb -0.19 -3.39 0.04 0.00 0.00 0.00 0.00 23.12 19.58 1r1n s ALA 285 CO 0.87 -0.33 1.08 -1.25 0.00 0.00 0.00 175.76 176.13 1r1n s PRO 286 N -1.03 2.47 0.07 0.00 0.04 -1.26 -4.81 135.00 130.48 1r1n s PRO 286 Ca 0.49 1.06 -0.26 0.00 0.04 0.00 0.00 61.00 62.33 1r1n s PRO 286 Cb -0.34 -1.93 -0.06 0.00 0.04 0.00 0.00 34.50 32.22 1r1n s PRO 286 CO 0.41 -1.46 0.81 -0.65 0.04 0.00 0.00 177.00 176.15 1r1n s GLN 287 N -4.97 4.55 -0.26 4.56 -1.52 -1.26 -4.87 119.66 115.89 1r1n s GLN 287 Ca 0.60 1.15 -0.18 0.00 -1.95 0.00 0.00 55.36 54.99 1r1n s GLN 287 Cb -0.16 -3.36 0.07 0.00 -0.22 0.00 0.00 33.01 29.35 1r1n s GLN 287 CO 0.56 0.30 0.66 0.08 -0.25 0.00 0.00 175.29 176.63 1r1n s VAL 288 N -0.16 -0.00 0.82 1.09 1.01 -1.26 -4.96 120.40 116.94 1r1n s VAL 288 Ca 0.40 0.01 -0.11 0.00 0.00 0.00 0.00 61.98 62.28 1r1n s VAL 288 Cb -0.21 -0.94 0.09 0.00 0.00 0.00 0.00 36.38 35.31 1r1n s VAL 288 CO 0.25 0.00 1.09 -0.94 0.00 0.00 0.00 175.10 175.50 1r1n s SER 289 N 1.22 4.08 0.72 3.32 1.04 -1.26 -4.98 113.70 117.85 1r1n s SER 289 Ca -0.07 1.72 -0.16 0.00 0.48 0.00 0.00 55.95 57.93 1r1n s SER 289 Cb -0.05 -2.40 0.03 0.00 0.10 0.00 0.00 66.02 63.70 1r1n s SER 289 CO -0.13 -2.29 1.25 0.00 0.98 0.00 0.00 173.24 173.05 1r1n s ALA 290 N -2.90 2.12 0.17 5.32 0.00 -1.26 -4.97 121.76 120.24 1r1n s ALA 290 Ca 0.62 1.02 -0.30 0.00 0.00 0.00 0.00 51.96 53.30 1r1n s ALA 290 Cb -0.18 -3.52 -0.07 0.00 0.00 0.00 0.00 23.12 19.35 1r1n s ALA 290 CO 0.56 -1.93 0.98 0.99 0.00 0.00 0.00 175.76 176.37 1r1n s THR 291 N -1.78 4.20 0.51 0.00 2.01 -1.26 -5.06 115.64 114.26 1r1n s THR 291 Ca 0.78 1.97 0.05 0.00 0.31 0.00 0.00 61.69 64.80 1r1n s THR 291 Cb -0.33 -4.26 0.01 0.00 0.01 0.00 0.00 72.50 67.93 1r1n s THR 291 CO 0.45 0.37 0.30 0.42 -0.69 0.00 0.00 174.62 175.47 1r1n s THR 292 N -0.48 1.77 0.12 -0.82 -4.23 -1.26 -4.68 115.64 106.07 1r1n s THR 292 Ca 0.45 -1.59 -0.17 0.00 -1.18 0.00 0.00 61.69 59.20 1r1n s THR 292 Cb -0.26 -2.37 -0.03 0.00 1.34 0.00 0.00 72.50 71.19 1r1n s THR 292 CO 0.32 0.00 1.68 0.58 -0.54 0.00 0.00 174.62 176.66 1r1n h VAL 293 N 0.99 1.17 -0.14 2.29 2.07 -1.98 -1.01 116.25 119.63 1r1n h VAL 293 Ca -0.39 -0.52 -0.13 0.00 0.82 0.00 0.00 66.70 66.48 1r1n h VAL 293 Cb 1.29 0.89 -0.01 0.00 -1.52 0.00 0.00 31.29 31.94 1r1n h VAL 293 CO 0.62 0.18 -0.48 0.28 0.02 0.00 0.00 177.57 178.20 1r1n h SER 294 N 0.41 0.39 -0.30 0.57 0.02 -1.97 0.34 113.55 113.01 1r1n h SER 294 Ca 0.11 -0.19 -0.14 0.00 -0.84 0.00 0.00 61.79 60.74 1r1n h SER 294 Cb 0.15 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 62.57 1r1n h SER 294 CO -0.01 0.81 -0.31 -0.33 -1.14 0.00 0.00 176.83 175.85 1r1n h GLU 295 N 0.29 0.83 -0.19 3.45 5.08 -1.93 1.17 114.58 123.27 1r1n h GLU 295 Ca 0.02 -0.39 -0.14 0.00 -1.00 0.00 0.00 59.36 57.85 1r1n h GLU 295 Cb 0.95 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.19 1r1n h GLU 295 CO 0.08 1.02 -0.43 0.87 -1.00 0.00 0.00 179.01 179.55 1r1n h LYS 296 N 0.70 0.64 -0.63 2.33 1.57 -1.01 -1.03 116.57 119.13 1r1n h LYS 296 Ca 0.08 -0.42 -0.01 0.00 -1.87 0.00 0.00 60.65 58.42 1r1n h LYS 296 Cb 0.86 0.06 -0.03 0.00 0.08 0.00 0.00 32.23 33.20 1r1n h LYS 296 CO 0.08 1.04 0.36 1.49 -0.57 0.00 0.00 179.45 181.85 1r1n h GLU 297 N 0.32 0.87 0.03 3.15 4.57 -0.03 -0.98 114.58 122.51 1r1n h GLU 297 Ca 0.00 -0.08 -0.00 0.00 -1.18 0.00 0.00 59.36 58.10 1r1n h GLU 297 Cb 1.04 -0.18 0.00 0.00 -0.16 0.00 0.00 28.75 29.45 1r1n h GLU 297 CO 0.10 0.63 -0.02 1.25 -1.18 0.00 0.00 179.01 179.79 1r1n h HIS 298 N 0.88 -0.04 -0.23 0.92 2.76 0.16 -2.94 115.15 116.66 1r1n h HIS 298 Ca 0.23 -0.00 -0.02 0.00 -2.20 0.00 0.00 60.37 58.38 1r1n h HIS 298 Cb 0.00 0.01 -0.01 0.00 1.55 0.00 0.00 27.41 28.96 1r1n h HIS 298 CO 0.00 0.26 0.05 0.00 -1.30 0.00 0.00 177.93 176.95 1r1n h ALA 299 N 0.61 1.68 0.00 5.26 0.00 -0.95 -1.33 119.26 124.54 1r1n h ALA 299 Ca -0.00 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1r1n h ALA 299 Cb 0.32 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1r1n h ALA 299 CO 0.01 0.25 0.00 1.15 0.00 0.00 0.00 179.25 180.66 1r1n h THR 300 N 0.32 0.00 0.09 0.00 2.02 -1.01 -1.22 112.91 113.11 1r1n h THR 300 Ca 0.08 -0.25 -0.33 0.00 0.77 0.00 0.00 66.41 66.68 1r1n h THR 300 Cb 0.13 1.25 -0.02 0.00 -1.74 0.00 0.00 68.15 67.76 1r1n h THR 300 CO -0.00 0.00 -1.80 0.03 0.37 0.00 0.00 175.52 174.12 1r1n h ARG 301 N 0.00 0.20 0.00 6.66 2.47 -1.14 -3.28 114.38 119.29 1r1n h ARG 301 Ca 0.00 -0.34 -0.05 0.00 -1.26 0.00 0.00 59.98 58.34 1r1n h ARG 301 Cb 0.25 0.13 -0.01 0.00 -1.65 0.00 0.00 29.97 28.69 1r1n h ARG 301 CO 0.00 1.00 -0.22 -0.07 0.56 0.00 0.00 179.97 181.24 1r1n h LEU 302 N 0.05 0.00 -0.61 3.04 3.38 -1.07 -0.73 115.31 119.37 1r1n h LEU 302 Ca -0.34 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.48 1r1n h LEU 302 Cb 2.03 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.76 1r1n h LEU 302 CO 0.11 0.22 -0.67 -0.07 0.09 0.00 0.00 178.44 178.12 1r1n h LEU 303 N 0.00 0.14 0.04 1.67 3.38 -1.35 -2.21 115.31 116.97 1r1n h LEU 303 Ca -0.00 -0.09 -0.26 0.00 0.09 0.00 0.00 57.88 57.62 1r1n h LEU 303 Cb 0.50 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.21 1r1n h LEU 303 CO 0.03 0.77 -1.15 -0.33 0.09 0.00 0.00 178.44 177.84 1r1n h GLU 304 N 0.08 0.30 0.00 1.13 5.08 -1.40 -0.35 114.58 119.42 1r1n h GLU 304 Ca -0.01 -0.44 0.00 0.00 -1.00 0.00 0.00 59.36 57.91 1r1n h GLU 304 Cb 1.19 0.16 0.00 0.00 0.50 0.00 0.00 28.75 30.60 1r1n h GLU 304 CO 0.10 1.18 0.00 1.04 -1.00 0.00 0.00 179.01 180.32 1r1n n GLN 305 N -3.59 0.21 -0.02 2.33 6.02 -0.36 -2.05 117.38 119.92 1r1n n GLN 305 Ca -0.08 0.40 0.06 0.00 -0.01 0.00 0.00 57.00 57.37 1r1n n GLN 305 Cb 0.97 -1.87 -0.15 0.00 1.02 0.00 0.00 30.24 30.20 1r1n n GLN 305 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1r1n n ALA 306 N -1.78 2.44 -0.34 -1.58 0.00 -0.84 -4.97 120.51 113.44 1r1n n ALA 306 Ca 0.03 -0.69 0.00 0.00 0.00 0.00 0.00 53.44 52.78 1r1n n ALA 306 Cb 0.26 -0.66 0.00 0.00 0.00 0.00 0.00 19.45 19.05 1r1n n ALA 306 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1r1n n GLY 307 N 1.37 0.81 0.11 0.00 0.00 -0.55 -4.77 105.19 102.15 1r1n n GLY 307 Ca -0.11 -0.21 0.03 0.00 0.00 0.00 0.00 46.02 45.74 1r1n n GLY 307 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1r1n h MET 308 N 1.33 0.00 -0.00 1.61 2.86 -1.37 -3.49 114.93 115.87 1r1n h MET 308 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1r1n h MET 308 Cb 0.00 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.66 1r1n h MET 308 CO 0.00 0.25 0.00 1.17 1.06 0.00 0.00 176.91 179.39