#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i1n n LYS 2 N 0.00 0.00 -0.28 0.00 3.00 -1.26 -3.47 118.16 116.16 3i1n n LYS 2 Ca 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 58.31 58.27 3i1n n LYS 2 Cb 0.00 0.00 0.12 0.00 0.00 0.00 0.00 35.03 35.15 3i1n n LYS 2 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.40 177.33 3i1n h LEU 3 N 0.00 1.04 -0.10 3.14 -0.00 -1.98 0.62 115.31 118.03 3i1n h LEU 3 Ca 0.00 -0.12 0.03 0.00 -0.00 0.00 0.00 57.88 57.79 3i1n h LEU 3 Cb 0.00 -0.27 -0.03 0.00 -0.00 0.00 0.00 40.66 40.36 3i1n h LEU 3 CO 0.00 0.87 -0.09 -0.74 -0.00 0.00 0.00 178.44 178.48 3i1n h HIS 4 N 1.14 -0.23 0.00 1.13 2.76 -1.90 0.35 115.15 118.41 3i1n h HIS 4 Ca 0.28 0.01 0.01 0.00 -2.20 0.00 0.00 60.37 58.47 3i1n h HIS 4 Cb 0.11 0.12 -0.01 0.00 1.55 0.00 0.00 27.41 29.17 3i1n h HIS 4 CO 0.01 -0.14 -0.04 -0.44 -1.30 0.00 0.00 177.93 176.02 3i1n h ASP 5 N -0.11 -0.12 -0.73 3.26 3.45 -1.61 -1.21 116.42 119.35 3i1n h ASP 5 Ca 0.07 0.02 0.15 0.00 0.43 0.00 0.00 57.03 57.70 3i1n h ASP 5 Cb 0.21 0.05 -0.05 0.00 -0.56 0.00 0.00 39.33 38.99 3i1n h ASP 5 CO -0.17 -0.06 0.49 0.22 -1.57 0.00 0.00 179.24 178.14 3i1n h TYR 6 N -0.08 0.44 -0.83 4.55 3.20 0.72 0.29 116.97 125.26 3i1n h TYR 6 Ca 0.02 0.01 0.02 0.00 3.14 0.00 0.00 58.73 61.91 3i1n h TYR 6 Cb 0.10 -0.14 -0.04 0.00 1.54 0.00 0.00 36.73 38.18 3i1n h TYR 6 CO -0.11 0.17 0.55 -0.92 -1.64 0.00 0.00 178.16 176.20 3i1n h TYR 7 N 0.38 1.03 0.00 -3.82 5.03 0.91 -3.36 116.97 117.14 3i1n h TYR 7 Ca 0.35 0.03 0.00 0.00 2.58 0.00 0.00 58.73 61.69 3i1n h TYR 7 Cb 0.85 -0.35 0.00 0.00 1.55 0.00 0.00 36.73 38.78 3i1n h TYR 7 CO -0.00 0.63 0.00 1.63 -1.32 0.00 0.00 178.16 179.10 3i1n n LYS 8 N -4.52 0.00 -1.42 1.82 4.76 0.10 -1.95 118.16 116.95 3i1n n LYS 8 Ca 0.09 0.00 -0.50 0.00 -2.87 0.00 0.00 58.31 55.03 3i1n n LYS 8 Cb 0.04 -0.04 -0.09 0.00 -1.84 0.00 0.00 35.03 33.10 3i1n n LYS 8 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 3i1n n ASP 9 N 0.00 1.50 0.00 4.39 5.68 -1.18 -3.90 116.55 123.04 3i1n n ASP 9 Ca 0.00 0.34 0.00 0.00 -0.50 0.00 0.00 54.79 54.63 3i1n n ASP 9 Cb 0.00 -1.15 0.00 0.00 -1.14 0.00 0.00 41.12 38.83 3i1n n ASP 9 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 3i1n n GLU 10 N 8.17 0.00 0.00 0.11 1.02 -1.26 -4.53 120.64 124.16 3i1n n GLU 10 Ca 0.48 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.62 3i1n n GLU 10 Cb 0.16 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.58 3i1n n GLU 10 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 3i1n n VAL 11 N -1.07 0.00 0.28 2.62 0.31 -1.25 -3.98 118.33 115.23 3i1n n VAL 11 Ca 0.00 0.00 -0.16 0.00 -0.01 0.00 0.00 64.34 64.17 3i1n n VAL 11 Cb 0.00 0.00 -0.08 0.00 -0.91 0.00 0.00 33.84 32.85 3i1n n VAL 11 CO 0.00 0.00 0.00 1.62 -1.32 0.00 0.00 176.83 177.13 3i1n h VAL 12 N 0.00 0.50 -0.95 2.52 3.04 -1.51 1.13 116.25 120.99 3i1n h VAL 12 Ca 0.00 0.00 0.19 0.00 -1.01 0.00 0.00 66.70 65.88 3i1n h VAL 12 Cb 0.00 0.50 -0.18 0.00 -2.01 0.00 0.00 31.29 29.60 3i1n h VAL 12 CO 0.00 0.00 -0.24 0.50 -1.01 0.00 0.00 177.57 176.82 3i1n h LYS 13 N -0.67 -0.00 0.37 4.17 1.63 -1.78 0.62 116.57 120.91 3i1n h LYS 13 Ca -0.06 0.00 -0.02 0.00 -0.85 0.00 0.00 60.65 59.72 3i1n h LYS 13 Cb 0.52 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.15 3i1n h LYS 13 CO 0.10 -0.00 -0.18 -0.22 -3.45 0.00 0.00 179.45 175.70 3i1n h LYS 14 N -0.00 -0.48 -0.63 1.90 3.11 -1.33 -2.99 116.57 116.14 3i1n h LYS 14 Ca 0.45 0.03 -0.07 0.00 -2.81 0.00 0.00 60.65 58.25 3i1n h LYS 14 Cb 0.69 0.11 -0.03 0.00 -1.00 0.00 0.00 32.23 32.00 3i1n h LYS 14 CO -0.97 -0.31 0.12 -0.07 -2.81 0.00 0.00 179.45 175.41 3i1n h LEU 15 N -0.52 0.97 -1.35 5.20 3.38 0.25 -2.91 115.31 120.34 3i1n h LEU 15 Ca -0.05 -0.22 0.24 0.00 0.09 0.00 0.00 57.88 57.95 3i1n h LEU 15 Cb 0.39 -0.26 -0.09 0.00 0.09 0.00 0.00 40.66 40.80 3i1n h LEU 15 CO 0.08 0.96 0.65 0.24 0.09 0.00 0.00 178.44 180.46 3i1n h MET 16 N 0.97 0.43 0.09 1.13 2.86 0.35 0.13 114.93 120.88 3i1n h MET 16 Ca 0.20 -0.03 -0.30 0.00 -2.06 0.00 0.00 59.70 57.51 3i1n h MET 16 Cb 0.40 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 31.94 3i1n h MET 16 CO 0.01 0.29 -1.55 1.79 1.06 0.00 0.00 176.91 178.50 3i1n h THR 17 N 0.45 1.10 -0.85 2.22 1.35 -1.56 -0.91 112.91 114.71 3i1n h THR 17 Ca 0.56 -2.80 0.19 0.00 -0.55 0.00 0.00 66.41 63.82 3i1n h THR 17 Cb 1.35 2.68 -0.06 0.00 -1.73 0.00 0.00 68.15 70.39 3i1n h THR 17 CO -0.28 0.78 0.57 -0.33 -0.25 0.00 0.00 175.52 176.01 3i1n h GLU 18 N 0.05 0.34 0.00 4.72 5.08 -0.58 -3.08 114.58 121.11 3i1n h GLU 18 Ca -0.24 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.10 3i1n h GLU 18 Cb 1.99 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 31.17 3i1n h GLU 18 CO 0.14 0.22 0.00 1.19 -1.00 0.00 0.00 179.01 179.56 3i1n n PHE 19 N -4.47 0.00 -2.73 4.33 3.01 -0.87 -5.04 117.46 111.69 3i1n n PHE 19 Ca 0.18 -0.14 -0.09 0.00 1.01 0.00 0.00 57.45 58.41 3i1n n PHE 19 Cb 0.68 -0.01 0.00 0.00 -0.01 0.00 0.00 39.48 40.14 3i1n n PHE 19 CO 0.00 0.00 0.00 0.27 1.01 0.00 0.00 176.76 178.04 3i1n n ASN 20 N -0.14 -1.56 -4.70 4.37 0.23 -0.35 -4.92 115.26 108.19 3i1n n ASN 20 Ca 0.00 -0.27 -0.30 0.00 -0.53 0.00 0.00 54.58 53.48 3i1n n ASN 20 Cb 0.24 -0.51 0.14 0.00 -2.08 0.00 0.00 39.78 37.58 3i1n n ASN 20 CO 0.00 0.00 0.00 -0.31 -0.93 0.00 0.00 177.26 176.02 3i1n s TYR 21 N -2.00 2.23 -0.18 -2.53 2.02 -1.19 -5.01 117.35 110.69 3i1n s TYR 21 Ca 0.02 1.30 -0.19 0.00 -0.37 0.00 0.00 57.07 57.83 3i1n s TYR 21 Cb -0.00 -3.16 -0.16 0.00 -0.40 0.00 0.00 41.96 38.24 3i1n s TYR 21 CO 0.29 -2.48 0.21 -0.91 -1.57 0.00 0.00 175.55 171.08 3i1n h ASN 22 N -1.62 0.00 -3.32 2.29 -0.26 -1.94 -3.47 115.58 107.26 3i1n h ASN 22 Ca -0.50 -0.45 -0.67 0.00 -0.56 0.00 0.00 56.30 54.13 3i1n h ASN 22 Cb 1.28 0.00 -0.16 0.00 -1.06 0.00 0.00 38.32 38.38 3i1n h ASN 22 CO 0.53 1.18 -0.63 -0.55 -1.06 0.00 0.00 177.43 176.91 3i1n s SER 23 N -6.42 5.18 0.53 5.81 0.15 -1.26 -4.98 113.70 112.72 3i1n s SER 23 Ca -0.22 0.08 0.21 0.00 0.70 0.00 0.00 55.95 56.73 3i1n s SER 23 Cb 0.03 -1.57 1.37 0.00 -1.71 0.00 0.00 66.02 64.14 3i1n s SER 23 CO 0.49 0.32 2.09 -0.37 1.20 0.00 0.00 173.24 176.96 3i1n h VAL 24 N 4.41 0.83 -0.17 4.45 -1.51 -1.99 0.53 116.25 122.81 3i1n h VAL 24 Ca -0.46 0.00 0.05 0.00 -1.23 0.00 0.00 66.70 65.06 3i1n h VAL 24 Cb 1.19 0.88 -0.01 0.00 -2.13 0.00 0.00 31.29 31.22 3i1n h VAL 24 CO 0.57 0.00 0.19 0.24 -1.23 0.00 0.00 177.57 177.34 3i1n h MET 25 N 0.00 0.00 0.00 5.19 2.86 -2.02 0.35 114.93 121.31 3i1n h MET 25 Ca 0.11 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.75 3i1n h MET 25 Cb 0.45 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.11 3i1n h MET 25 CO -0.00 0.00 0.00 0.94 1.06 0.00 0.00 176.91 178.91 3i1n n GLN 26 N -3.84 0.17 -2.50 1.72 7.27 0.19 -4.80 117.38 115.59 3i1n n GLN 26 Ca 0.01 0.08 -0.42 0.00 0.07 0.00 0.00 57.00 56.74 3i1n n GLN 26 Cb 0.31 -1.50 -0.03 0.00 2.41 0.00 0.00 30.24 31.43 3i1n n GLN 26 CO 0.00 0.00 0.00 0.54 0.07 0.00 0.00 177.06 177.67 3i1n s VAL 27 N -2.79 4.18 0.30 1.69 0.11 0.12 -4.98 120.40 119.04 3i1n s VAL 27 Ca 0.17 1.61 -0.28 0.00 -2.93 0.00 0.00 61.98 60.55 3i1n s VAL 27 Cb 0.16 -4.03 -0.14 0.00 -1.53 0.00 0.00 36.38 30.84 3i1n s VAL 27 CO 0.40 0.15 1.02 -2.65 -3.33 0.00 0.00 175.10 170.70 3i1n n PRO 28 N 3.64 1.40 -3.93 1.54 -0.02 -1.26 -4.91 135.00 131.46 3i1n n PRO 28 Ca 0.07 0.49 -0.10 0.00 -2.02 0.00 0.00 63.50 61.94 3i1n n PRO 28 Cb 0.47 -1.89 -0.12 0.00 -0.02 0.00 0.00 33.50 31.95 3i1n n PRO 28 CO 0.00 0.00 0.00 -0.98 1.98 0.00 0.00 175.50 176.50 3i1n s ARG 29 N -1.61 0.22 -0.23 -0.52 1.70 -1.26 -4.92 118.95 112.32 3i1n s ARG 29 Ca 0.59 -0.37 -0.29 0.00 -0.47 0.00 0.00 55.73 55.18 3i1n s ARG 29 Cb -0.68 0.08 -0.02 0.00 -0.57 0.00 0.00 34.95 33.76 3i1n s ARG 29 CO 0.60 -0.04 1.56 0.54 -1.08 0.00 0.00 175.30 176.88 3i1n s VAL 30 N -0.93 3.77 -0.13 4.99 0.11 -1.26 -1.80 120.40 125.15 3i1n s VAL 30 Ca -0.10 0.87 -0.05 0.00 -2.93 0.00 0.00 61.98 59.77 3i1n s VAL 30 Cb -0.06 -3.78 -0.25 0.00 -1.53 0.00 0.00 36.38 30.76 3i1n s VAL 30 CO -0.00 -0.31 0.33 1.21 -3.33 0.00 0.00 175.10 172.99 3i1n n GLU 31 N 7.57 0.75 -3.54 1.54 2.13 0.07 -4.98 120.64 124.18 3i1n n GLU 31 Ca 0.18 0.25 -0.13 0.00 0.66 0.00 0.00 57.16 58.13 3i1n n GLU 31 Cb 0.45 -1.70 -0.05 0.00 0.27 0.00 0.00 31.44 30.42 3i1n n GLU 31 CO 0.00 0.00 0.00 -1.59 -0.41 0.00 0.00 177.13 175.13 3i1n s LYS 32 N -2.56 0.81 -0.20 5.31 -2.85 -0.97 -4.85 119.74 114.44 3i1n s LYS 32 Ca -0.23 0.08 0.01 0.00 -1.00 0.00 0.00 55.97 54.83 3i1n s LYS 32 Cb 0.07 0.38 0.04 0.00 -2.06 0.00 0.00 37.83 36.26 3i1n s LYS 32 CO 0.76 -0.28 -0.14 0.42 0.10 0.00 0.00 175.35 176.21 3i1n s ILE 33 N -1.60 1.90 -0.27 3.79 1.01 -0.41 -0.92 121.20 124.69 3i1n s ILE 33 Ca -0.03 -1.11 -0.10 0.00 0.00 0.00 0.00 60.65 59.41 3i1n s ILE 33 Cb -0.00 -1.88 -0.05 0.00 0.01 0.00 0.00 42.46 40.54 3i1n s ILE 33 CO 0.02 0.27 0.16 0.42 0.00 0.00 0.00 174.94 175.81 3i1n s THR 34 N 1.30 5.11 -0.17 2.92 -4.23 -0.96 0.72 115.64 120.33 3i1n s THR 34 Ca -0.01 0.10 -0.05 0.00 -1.18 0.00 0.00 61.69 60.56 3i1n s THR 34 Cb -0.16 -3.43 -0.03 0.00 1.34 0.00 0.00 72.50 70.23 3i1n s THR 34 CO -0.09 0.27 -0.01 -1.48 -0.54 0.00 0.00 174.62 172.77 3i1n s LEU 35 N 1.71 3.35 0.17 4.79 0.05 0.52 -2.03 118.68 127.24 3i1n s LEU 35 Ca 0.07 -0.11 0.07 0.00 0.05 0.00 0.00 54.13 54.21 3i1n s LEU 35 Cb -0.16 -1.82 -0.04 0.00 -2.05 0.00 0.00 46.19 42.12 3i1n s LEU 35 CO 0.09 0.15 -0.15 0.21 -0.55 0.00 0.00 176.35 176.10 3i1n s ASN 36 N 0.51 2.37 0.00 1.48 2.47 -1.03 -0.37 114.94 120.36 3i1n s ASN 36 Ca -0.02 -0.94 0.00 0.00 0.42 0.00 0.00 52.86 52.32 3i1n s ASN 36 Cb -0.14 -0.11 0.00 0.00 -1.45 0.00 0.00 41.25 39.55 3i1n s ASN 36 CO 0.02 -0.16 0.00 0.23 -3.72 0.00 0.00 177.10 173.48 3i1n n MET 37 N -0.01 0.00 -1.34 0.43 2.81 0.05 -1.66 117.12 117.41 3i1n n MET 37 Ca -0.11 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.78 3i1n n MET 37 Cb 0.59 -0.11 0.00 0.00 -0.71 0.00 0.00 33.22 32.99 3i1n n MET 37 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3i1n n GLY 38 N 3.08 -0.74 0.21 3.03 0.00 -1.25 -4.83 105.19 104.69 3i1n n GLY 38 Ca 0.00 -0.18 -0.02 0.00 0.00 0.00 0.00 46.02 45.82 3i1n n GLY 38 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 3i1n h VAL 39 N 0.00 0.79 0.00 1.61 3.04 -1.90 -3.45 116.25 116.34 3i1n h VAL 39 Ca 0.00 -0.12 0.00 0.00 -1.01 0.00 0.00 66.70 65.57 3i1n h VAL 39 Cb 0.00 0.42 0.00 0.00 -2.01 0.00 0.00 31.29 29.70 3i1n h VAL 39 CO 0.00 0.06 0.00 0.61 -1.01 0.00 0.00 177.57 177.23 3i1n n GLY 40 N -1.28 0.87 0.47 3.17 0.00 -1.25 -4.43 105.19 102.74 3i1n n GLY 40 Ca 0.06 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.20 3i1n n GLY 40 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3i1n n GLU 41 N 0.00 1.23 0.32 1.61 -0.58 -1.26 -4.09 120.64 117.86 3i1n n GLU 41 Ca 0.00 -0.95 0.20 0.00 -0.42 0.00 0.00 57.16 55.99 3i1n n GLU 41 Cb 0.00 -1.48 1.05 0.00 -0.57 0.00 0.00 31.44 30.44 3i1n n GLU 41 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3i1n h ALA 42 N 3.92 1.09 -0.97 0.62 0.00 -1.78 0.76 119.26 122.90 3i1n h ALA 42 Ca 0.00 -0.01 0.26 0.00 0.00 0.00 0.00 54.91 55.16 3i1n h ALA 42 Cb 0.71 -0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.44 3i1n h ALA 42 CO 0.00 0.02 0.67 -0.84 0.00 0.00 0.00 179.25 179.10 3i1n h ILE 43 N 0.00 0.55 0.00 0.00 3.07 -1.86 -2.77 117.51 116.50 3i1n h ILE 43 Ca -0.00 -0.06 0.00 0.00 1.55 0.00 0.00 64.86 66.35 3i1n h ILE 43 Cb 0.12 0.37 0.00 0.00 -0.27 0.00 0.00 36.82 37.04 3i1n h ILE 43 CO 0.00 0.03 0.00 0.00 -1.05 0.00 0.00 178.15 177.13 3i1n n ALA 44 N -2.63 0.00 -2.69 0.16 0.00 0.14 -4.82 120.51 110.66 3i1n n ALA 44 Ca 0.21 -0.22 -0.42 0.00 0.00 0.00 0.00 53.44 53.01 3i1n n ALA 44 Cb 0.94 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.36 3i1n n ALA 44 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3i1n s ASP 45 N -3.71 6.59 0.45 0.00 -0.00 -0.49 -4.81 116.67 114.70 3i1n s ASP 45 Ca 0.00 -1.77 0.18 0.00 -0.00 0.00 0.00 52.55 50.96 3i1n s ASP 45 Cb 0.00 -2.51 1.14 0.00 -0.00 0.00 0.00 42.92 41.55 3i1n s ASP 45 CO 0.00 -1.31 1.94 0.07 -0.00 0.00 0.00 175.17 175.87 3i1n h LYS 46 N 9.23 0.30 0.00 8.23 -0.00 -1.76 0.30 116.57 132.88 3i1n h LYS 46 Ca 0.21 -0.02 -0.06 0.00 -0.00 0.00 0.00 60.65 60.78 3i1n h LYS 46 Cb 1.00 -0.07 -0.01 0.00 -0.00 0.00 0.00 32.23 33.15 3i1n h LYS 46 CO 1.32 0.20 -0.29 -0.22 -0.00 0.00 0.00 179.45 180.47 3i1n h LYS 47 N 0.31 0.00 -0.53 0.07 3.64 -1.87 -3.18 116.57 115.01 3i1n h LYS 47 Ca 0.34 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.72 3i1n h LYS 47 Cb 0.88 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.67 3i1n h LYS 47 CO -0.09 0.29 0.35 1.25 -2.27 0.00 0.00 179.45 178.98 3i1n h LEU 48 N 0.00 0.61 -0.22 5.20 5.85 -1.30 -2.80 115.31 122.65 3i1n h LEU 48 Ca -0.00 -0.02 0.04 0.00 0.84 0.00 0.00 57.88 58.74 3i1n h LEU 48 Cb 0.96 -0.15 -0.04 0.00 0.37 0.00 0.00 40.66 41.80 3i1n h LEU 48 CO 0.04 0.44 -0.03 0.25 -0.34 0.00 0.00 178.44 178.80 3i1n h LEU 49 N 0.71 -0.14 -1.07 2.25 5.85 -1.58 -2.45 115.31 118.88 3i1n h LEU 49 Ca 0.19 0.06 0.28 0.00 0.84 0.00 0.00 57.88 59.25 3i1n h LEU 49 Cb -0.08 0.11 -0.13 0.00 0.37 0.00 0.00 40.66 40.94 3i1n h LEU 49 CO -0.04 -0.04 0.61 0.44 -0.34 0.00 0.00 178.44 179.06 3i1n h ASP 50 N 0.03 0.57 0.01 1.25 5.19 -1.60 0.26 116.42 122.13 3i1n h ASP 50 Ca 0.11 0.15 -0.00 0.00 -0.62 0.00 0.00 57.03 56.66 3i1n h ASP 50 Cb 0.15 0.07 0.00 0.00 0.18 0.00 0.00 39.33 39.73 3i1n h ASP 50 CO -0.20 0.01 -0.01 0.78 -3.12 0.00 0.00 179.24 176.70 3i1n h ASN 51 N 0.45 -0.02 -0.87 6.45 2.35 -1.42 -1.11 115.58 121.42 3i1n h ASN 51 Ca 0.68 -0.42 0.19 0.00 -0.55 0.00 0.00 56.30 56.20 3i1n h ASN 51 Cb 1.48 0.00 -0.11 0.00 0.05 0.00 0.00 38.32 39.74 3i1n h ASN 51 CO -0.49 0.41 0.39 0.00 -1.65 0.00 0.00 177.43 176.08 3i1n h ALA 52 N 0.53 1.35 0.43 -0.83 0.00 -0.69 0.35 119.26 120.39 3i1n h ALA 52 Ca -0.00 0.14 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 3i1n h ALA 52 Cb 0.43 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.33 3i1n h ALA 52 CO 0.00 -0.27 -0.21 0.00 0.00 0.00 0.00 179.25 178.78 3i1n h ALA 53 N 1.65 -0.58 0.00 0.00 0.00 -1.05 -2.05 119.26 117.24 3i1n h ALA 53 Ca 0.52 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.28 3i1n h ALA 53 Cb 0.91 0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.92 3i1n h ALA 53 CO -0.48 -0.56 0.24 0.00 0.00 0.00 0.00 179.25 178.46 3i1n h ALA 54 N -1.04 1.17 0.21 0.00 0.00 -0.94 0.24 119.26 118.91 3i1n h ALA 54 Ca -0.06 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 3i1n h ALA 54 Cb 0.49 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.28 3i1n h ALA 54 CO 0.10 -0.17 -0.10 -0.44 0.00 0.00 0.00 179.25 178.64 3i1n h ASP 55 N 0.00 -0.24 -0.75 0.00 3.45 -0.05 -3.20 116.42 115.62 3i1n h ASP 55 Ca 0.00 -0.12 0.13 0.00 0.43 0.00 0.00 57.03 57.47 3i1n h ASP 55 Cb 0.48 0.06 -0.05 0.00 -0.56 0.00 0.00 39.33 39.26 3i1n h ASP 55 CO 0.00 0.27 0.50 -0.07 -1.57 0.00 0.00 179.24 178.37 3i1n h LEU 56 N -1.03 0.45 -0.47 1.55 3.38 -0.35 -1.49 115.31 117.35 3i1n h LEU 56 Ca -0.03 0.02 0.10 0.00 0.09 0.00 0.00 57.88 58.06 3i1n h LEU 56 Cb 0.35 -0.07 -0.10 0.00 0.09 0.00 0.00 40.66 40.93 3i1n h LEU 56 CO 0.05 0.24 -0.20 0.00 0.09 0.00 0.00 178.44 178.63 3i1n h ALA 57 N 1.64 0.17 -0.06 1.53 0.00 -0.68 0.22 119.26 122.09 3i1n h ALA 57 Ca 0.37 0.17 -0.24 0.00 0.00 0.00 0.00 54.91 55.20 3i1n h ALA 57 Cb 0.74 0.50 0.01 0.00 0.00 0.00 0.00 17.79 19.04 3i1n h ALA 57 CO -0.13 -0.53 -0.93 0.00 0.00 0.00 0.00 179.25 177.66 3i1n h ALA 58 N 1.26 0.24 -0.40 0.00 0.00 -1.30 -3.29 119.26 115.77 3i1n h ALA 58 Ca 0.22 -0.66 -0.04 0.00 0.00 0.00 0.00 54.91 54.43 3i1n h ALA 58 Cb 0.44 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 3i1n h ALA 58 CO -0.53 0.70 0.06 0.82 0.00 0.00 0.00 179.25 180.30 3i1n h ILE 59 N 0.43 1.20 -3.97 0.00 2.04 -0.78 -3.41 117.51 113.01 3i1n h ILE 59 Ca -0.09 -0.73 -0.64 0.00 1.00 0.00 0.00 64.86 64.40 3i1n h ILE 59 Cb 1.57 0.83 -0.31 0.00 -0.74 0.00 0.00 36.82 38.16 3i1n h ILE 59 CO 0.18 0.26 -0.86 -0.94 0.00 0.00 0.00 178.15 176.79 3i1n s SER 60 N -6.69 2.68 0.00 1.72 1.04 0.02 -4.98 113.70 107.49 3i1n s SER 60 Ca -0.08 -0.44 0.00 0.00 0.48 0.00 0.00 55.95 55.90 3i1n s SER 60 Cb 0.16 -0.74 0.00 0.00 0.10 0.00 0.00 66.02 65.54 3i1n s SER 60 CO 0.77 0.21 0.00 0.61 0.98 0.00 0.00 173.24 175.81 3i1n n GLY 61 N 3.03 0.00 0.00 7.32 0.00 -1.26 -4.57 105.19 109.71 3i1n n GLY 61 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.84 3i1n n GLY 61 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3i1n n GLN 62 N -2.71 0.00 -2.20 1.61 1.13 -1.26 -4.93 117.38 109.01 3i1n n GLN 62 Ca 0.00 0.00 -0.43 0.00 -1.94 0.00 0.00 57.00 54.63 3i1n n GLN 62 Cb 0.00 0.00 -0.02 0.00 0.11 0.00 0.00 30.24 30.33 3i1n n GLN 62 CO 0.00 0.00 0.00 0.21 -1.44 0.00 0.00 177.06 175.83 3i1n s LYS 63 N -0.56 3.50 0.28 -1.09 2.20 -1.26 -4.37 119.74 118.44 3i1n s LYS 63 Ca 0.00 1.17 -0.29 0.00 -0.36 0.00 0.00 55.97 56.49 3i1n s LYS 63 Cb 0.00 -4.09 -0.14 0.00 -1.51 0.00 0.00 37.83 32.09 3i1n s LYS 63 CO 0.00 -1.65 1.15 -2.30 -0.36 0.00 0.00 175.35 172.19 3i1n n PRO 64 N 8.17 1.59 -3.45 4.03 -0.02 -1.26 -4.99 135.00 139.07 3i1n n PRO 64 Ca 0.19 0.56 -0.37 0.00 -2.02 0.00 0.00 63.50 61.85 3i1n n PRO 64 Cb 0.47 -2.03 -0.08 0.00 -0.02 0.00 0.00 33.50 31.84 3i1n n PRO 64 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 3i1n s LEU 65 N 0.12 4.18 0.35 2.45 2.96 -0.32 -4.91 118.68 123.52 3i1n s LEU 65 Ca 0.61 0.48 -0.25 0.00 -0.22 0.00 0.00 54.13 54.76 3i1n s LEU 65 Cb -0.69 -2.44 -0.10 0.00 0.50 0.00 0.00 46.19 43.46 3i1n s LEU 65 CO 0.58 -0.01 0.97 0.27 -1.32 0.00 0.00 176.35 176.84 3i1n s ILE 66 N 1.04 4.10 -0.23 6.68 -4.36 -1.26 -0.77 121.20 126.40 3i1n s ILE 66 Ca 0.17 1.66 0.02 0.00 -0.26 0.00 0.00 60.65 62.25 3i1n s ILE 66 Cb -0.14 -3.88 0.05 0.00 1.25 0.00 0.00 42.46 39.73 3i1n s ILE 66 CO 0.07 0.06 -0.13 0.42 0.24 0.00 0.00 174.94 175.59 3i1n s THR 67 N -1.68 2.06 1.10 8.37 -4.23 0.50 -4.93 115.64 116.82 3i1n s THR 67 Ca 0.53 -1.35 -0.13 0.00 -1.18 0.00 0.00 61.69 59.56 3i1n s THR 67 Cb -0.18 -2.08 0.24 0.00 1.34 0.00 0.00 72.50 71.82 3i1n s THR 67 CO 0.24 0.15 1.06 -0.54 -0.54 0.00 0.00 174.62 174.99 3i1n s LYS 68 N 1.20 -0.36 -0.04 3.99 3.01 -1.26 -2.10 119.74 124.17 3i1n s LYS 68 Ca -0.04 0.59 -0.30 0.00 -1.01 0.00 0.00 55.97 55.21 3i1n s LYS 68 Cb -0.18 -1.64 -0.04 0.00 -1.01 0.00 0.00 37.83 34.97 3i1n s LYS 68 CO -0.08 -3.28 1.22 0.00 0.51 0.00 0.00 175.35 173.72 3i1n s ALA 69 N -2.74 3.50 0.34 5.17 0.00 0.28 -4.68 121.76 123.63 3i1n s ALA 69 Ca 0.67 0.66 0.06 0.00 0.00 0.00 0.00 51.96 53.35 3i1n s ALA 69 Cb -0.21 -3.52 0.73 0.00 0.00 0.00 0.00 23.12 20.12 3i1n s ALA 69 CO 0.61 -0.76 1.90 -0.09 0.00 0.00 0.00 175.76 177.42 3i1n h ARG 70 N 7.46 0.77 -1.99 0.00 2.43 -1.92 -2.73 114.38 118.39 3i1n h ARG 70 Ca -0.35 -0.05 -0.04 0.00 -0.81 0.00 0.00 59.98 58.74 3i1n h ARG 70 Cb 1.17 -0.17 -0.21 0.00 -0.42 0.00 0.00 29.97 30.33 3i1n h ARG 70 CO 0.88 0.51 0.14 0.21 -1.51 0.00 0.00 179.97 180.20 3i1n s LYS 71 N -5.74 0.84 0.12 0.20 2.47 -1.26 -4.82 119.74 111.55 3i1n s LYS 71 Ca -0.10 0.97 -0.31 0.00 -1.56 0.00 0.00 55.97 54.97 3i1n s LYS 71 Cb 0.21 0.41 -0.08 0.00 -1.46 0.00 0.00 37.83 36.90 3i1n s LYS 71 CO 0.79 -0.11 1.45 0.45 0.16 0.00 0.00 175.35 178.09 3i1n s SER 72 N 0.33 6.75 -0.10 1.43 0.15 -1.26 -4.73 113.70 116.28 3i1n s SER 72 Ca -0.00 2.40 -0.06 0.00 0.70 0.00 0.00 55.95 58.98 3i1n s SER 72 Cb -0.05 -2.59 0.04 0.00 -1.71 0.00 0.00 66.02 61.72 3i1n s SER 72 CO 0.01 -0.71 0.25 0.68 1.20 0.00 0.00 173.24 174.66 3i1n s VAL 73 N 1.28 -0.03 0.14 4.45 -7.23 -0.92 -4.86 120.40 113.22 3i1n s VAL 73 Ca 0.66 0.10 0.22 0.00 -1.81 0.00 0.00 61.98 61.16 3i1n s VAL 73 Cb -0.38 -0.37 0.20 0.00 0.56 0.00 0.00 36.38 36.39 3i1n s VAL 73 CO 0.30 0.04 1.79 0.00 -0.31 0.00 0.00 175.10 176.93 3i1n h ALA 74 N 6.78 1.01 -1.08 1.32 0.00 -1.95 -3.22 119.26 122.12 3i1n h ALA 74 Ca -0.36 -0.24 0.29 0.00 0.00 0.00 0.00 54.91 54.60 3i1n h ALA 74 Cb 1.17 -0.04 -0.10 0.00 0.00 0.00 0.00 17.79 18.81 3i1n h ALA 74 CO 0.37 0.34 0.69 0.78 0.00 0.00 0.00 179.25 181.43 3i1n h GLY 75 N 2.10 1.26 -0.13 0.00 0.00 -1.97 -2.42 103.07 101.90 3i1n h GLY 75 Ca -0.00 -0.19 0.00 0.00 0.00 0.00 0.00 47.33 47.13 3i1n h GLY 75 CO 0.03 -0.19 0.00 0.69 0.00 0.00 0.00 176.54 177.08 3i1n n PHE 76 N -4.65 0.03 -2.18 5.60 3.01 -1.23 -5.01 117.46 113.03 3i1n n PHE 76 Ca 0.27 -0.29 -0.07 0.00 1.01 0.00 0.00 57.45 58.38 3i1n n PHE 76 Cb 0.96 -0.03 -0.00 0.00 -0.01 0.00 0.00 39.48 40.40 3i1n n PHE 76 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 3i1n n LYS 77 N -0.19 -0.68 -4.01 -1.08 5.02 -0.91 -5.03 118.16 111.27 3i1n n LYS 77 Ca 0.01 0.33 -0.35 0.00 -2.02 0.00 0.00 58.31 56.28 3i1n n LYS 77 Cb 0.17 -4.17 -0.13 0.00 -0.02 0.00 0.00 35.03 30.88 3i1n n LYS 77 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 3i1n s ILE 78 N -2.39 3.76 0.58 -0.18 -4.36 -1.22 -5.02 121.20 112.37 3i1n s ILE 78 Ca 0.01 -0.37 -0.14 0.00 -0.26 0.00 0.00 60.65 59.89 3i1n s ILE 78 Cb -0.01 -2.71 -0.05 0.00 1.25 0.00 0.00 42.46 40.94 3i1n s ILE 78 CO 0.02 0.42 1.02 -0.60 0.24 0.00 0.00 174.94 176.03 3i1n s ARG 79 N 1.20 3.67 0.40 0.37 3.52 -1.26 -2.18 118.95 124.67 3i1n s ARG 79 Ca 0.03 0.91 -0.26 0.00 -0.13 0.00 0.00 55.73 56.28 3i1n s ARG 79 Cb -0.15 -2.09 -0.09 0.00 -1.56 0.00 0.00 34.95 31.07 3i1n s ARG 79 CO 0.01 -0.51 1.22 -1.14 -0.81 0.00 0.00 175.30 174.06 3i1n s GLN 80 N -4.55 4.04 -0.04 5.12 -0.44 -1.26 -2.69 119.66 119.83 3i1n s GLN 80 Ca 0.58 1.96 0.00 0.00 -2.50 0.00 0.00 55.36 55.40 3i1n s GLN 80 Cb -0.11 -2.73 0.00 0.00 -1.64 0.00 0.00 33.01 28.53 3i1n s GLN 80 CO 0.42 -0.37 0.00 0.41 0.50 0.00 0.00 175.29 176.25 3i1n n GLY 81 N 0.67 0.47 3.56 2.59 0.00 -1.03 -4.91 105.19 106.55 3i1n n GLY 81 Ca 0.04 -0.27 -0.42 0.00 0.00 0.00 0.00 46.02 45.37 3i1n n GLY 81 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3i1n s TYR 82 N -1.96 3.07 -0.74 1.61 6.04 -1.10 -4.55 117.35 119.72 3i1n s TYR 82 Ca 0.00 0.29 -0.26 0.00 0.04 0.00 0.00 57.07 57.14 3i1n s TYR 82 Cb 0.00 -3.43 -0.15 0.00 -1.04 0.00 0.00 41.96 37.33 3i1n s TYR 82 CO 0.00 -0.82 2.50 -0.35 -1.54 0.00 0.00 175.55 175.34 3i1n n PRO 83 N 6.43 0.54 -2.53 4.97 -0.04 -1.26 -0.55 135.00 142.56 3i1n n PRO 83 Ca 0.01 -0.09 -0.17 0.00 -0.04 0.00 0.00 63.50 63.22 3i1n n PRO 83 Cb 0.48 -2.59 0.02 0.00 -0.04 0.00 0.00 33.50 31.37 3i1n n PRO 83 CO 0.00 0.00 0.00 1.51 -0.04 0.00 0.00 175.50 176.97 3i1n n ILE 84 N 7.71 1.76 0.00 0.52 0.13 -0.89 -4.76 119.36 123.83 3i1n n ILE 84 Ca 0.51 -3.91 0.00 0.00 -1.10 0.00 0.00 62.75 58.25 3i1n n ILE 84 Cb 0.32 -0.23 0.00 0.00 -0.84 0.00 0.00 39.64 38.89 3i1n n ILE 84 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 3i1n n GLY 85 N -0.38 4.48 3.21 4.50 0.00 -1.23 -3.90 105.19 111.88 3i1n n GLY 85 Ca 0.25 -1.34 -0.16 0.00 0.00 0.00 0.00 46.02 44.76 3i1n n GLY 85 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i1n s LYS 87 N -2.67 1.82 -0.26 0.00 -2.85 0.05 -0.77 119.74 115.06 3i1n s LYS 87 Ca 0.07 -1.73 -0.12 0.00 -1.00 0.00 0.00 55.97 53.18 3i1n s LYS 87 Cb -0.04 0.42 0.10 0.00 -2.06 0.00 0.00 37.83 36.24 3i1n s LYS 87 CO 0.02 -0.74 0.60 0.08 0.10 0.00 0.00 175.35 175.41 3i1n s VAL 88 N -3.25 -0.42 -0.22 1.79 1.01 0.50 -1.17 120.40 118.64 3i1n s VAL 88 Ca 0.31 0.03 -0.14 0.00 0.00 0.00 0.00 61.98 62.19 3i1n s VAL 88 Cb 0.00 -0.90 -0.04 0.00 0.00 0.00 0.00 36.38 35.44 3i1n s VAL 88 CO 0.20 0.01 0.30 -0.89 0.00 0.00 0.00 175.10 174.72 3i1n s THR 89 N 2.15 5.27 -0.17 3.92 2.01 -1.26 -0.35 115.64 127.21 3i1n s THR 89 Ca -0.08 0.48 -0.06 0.00 0.31 0.00 0.00 61.69 62.34 3i1n s THR 89 Cb -0.09 -3.63 -0.04 0.00 0.01 0.00 0.00 72.50 68.76 3i1n s THR 89 CO -0.18 0.29 0.03 -0.76 -0.69 0.00 0.00 174.62 173.31 3i1n s LEU 90 N 1.24 3.63 0.00 4.42 2.01 0.22 -4.97 118.68 125.24 3i1n s LEU 90 Ca 0.14 0.03 0.00 0.00 0.01 0.00 0.00 54.13 54.30 3i1n s LEU 90 Cb -0.14 -1.90 0.00 0.00 0.01 0.00 0.00 46.19 44.16 3i1n s LEU 90 CO 0.07 0.19 0.00 0.54 1.01 0.00 0.00 176.35 178.15 3i1n n ARG 91 N 3.43 0.68 0.00 1.70 1.74 -1.26 -1.29 116.66 121.65 3i1n n ARG 91 Ca -0.17 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.91 3i1n n ARG 91 Cb 0.52 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.96 3i1n n ARG 91 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3i1n n GLY 92 N 1.32 0.76 0.26 -0.13 0.00 -1.26 0.68 105.19 106.82 3i1n n GLY 92 Ca 0.00 -0.08 -0.15 0.00 0.00 0.00 0.00 46.02 45.79 3i1n n GLY 92 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3i1n h GLU 93 N 0.00 -0.54 -0.76 1.61 4.57 -2.00 -2.92 114.58 114.53 3i1n h GLU 93 Ca 0.00 0.04 0.17 0.00 -1.18 0.00 0.00 59.36 58.39 3i1n h GLU 93 Cb 0.00 0.12 -0.11 0.00 -0.16 0.00 0.00 28.75 28.60 3i1n h GLU 93 CO 0.00 -0.36 0.20 0.00 -1.18 0.00 0.00 179.01 177.67 3i1n h ARG 94 N -0.56 0.27 0.07 1.92 3.08 -1.96 -0.43 114.38 116.77 3i1n h ARG 94 Ca -0.04 -0.02 0.03 0.00 0.07 0.00 0.00 59.98 60.02 3i1n h ARG 94 Cb 0.46 -0.06 -0.04 0.00 0.08 0.00 0.00 29.97 30.40 3i1n h ARG 94 CO 0.05 0.18 -0.32 1.98 -1.07 0.00 0.00 179.97 180.78 3i1n h MET 95 N 0.28 -0.50 -0.81 0.04 4.05 0.44 -0.78 114.93 117.65 3i1n h MET 95 Ca 0.44 0.03 0.02 0.00 -0.28 0.00 0.00 59.70 59.91 3i1n h MET 95 Cb 0.77 0.11 -0.04 0.00 -0.80 0.00 0.00 31.60 31.63 3i1n h MET 95 CO -0.53 -0.33 0.52 -1.49 0.23 0.00 0.00 176.91 175.32 3i1n h TRP 96 N -0.52 0.99 -0.34 1.39 4.06 -1.07 0.21 115.95 120.68 3i1n h TRP 96 Ca 0.04 0.02 -0.01 0.00 2.06 0.00 0.00 58.89 61.01 3i1n h TRP 96 Cb 0.57 -0.33 -0.02 0.00 -1.00 0.00 0.00 29.16 28.39 3i1n h TRP 96 CO -0.31 0.59 0.16 0.93 -3.56 0.00 0.00 178.44 176.25 3i1n h GLU 97 N 1.04 0.48 0.23 0.49 5.08 -0.82 -0.51 114.58 120.58 3i1n h GLU 97 Ca 0.31 -0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.59 3i1n h GLU 97 Cb -0.05 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.11 3i1n h GLU 97 CO -0.09 0.44 -0.11 0.35 -1.00 0.00 0.00 179.01 178.60 3i1n h PHE 98 N 0.41 -0.29 -1.04 4.33 3.57 -0.84 -2.57 116.94 120.52 3i1n h PHE 98 Ca 0.12 -0.01 0.33 0.00 3.53 0.00 0.00 57.97 61.94 3i1n h PHE 98 Cb 0.11 0.09 -0.14 0.00 2.79 0.00 0.00 35.95 38.81 3i1n h PHE 98 CO -0.02 -0.16 0.61 0.35 -2.23 0.00 0.00 178.31 176.86 3i1n h PHE 99 N -0.34 0.88 0.42 0.41 3.57 -0.14 0.71 116.94 122.45 3i1n h PHE 99 Ca -0.03 0.04 -0.02 0.00 3.53 0.00 0.00 57.97 61.48 3i1n h PHE 99 Cb 0.26 -0.23 0.00 0.00 2.79 0.00 0.00 35.95 38.77 3i1n h PHE 99 CO -0.05 -0.15 -0.20 1.49 -2.23 0.00 0.00 178.31 177.16 3i1n h GLU 100 N 0.32 -0.54 0.00 1.11 4.81 -0.76 -2.49 114.58 117.02 3i1n h GLU 100 Ca 0.73 0.04 0.00 0.00 -0.13 0.00 0.00 59.36 60.00 3i1n h GLU 100 Cb 1.73 0.12 0.00 0.00 0.63 0.00 0.00 28.75 31.24 3i1n h GLU 100 CO -0.56 -0.36 0.09 0.07 -0.73 0.00 0.00 179.01 177.52 3i1n h ARG 101 N -0.91 0.00 0.11 1.92 0.11 -0.93 1.34 114.38 116.03 3i1n h ARG 101 Ca -0.06 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 60.02 3i1n h ARG 101 Cb 0.43 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.51 3i1n h ARG 101 CO 0.09 0.00 -0.06 1.25 0.10 0.00 0.00 179.97 181.36 3i1n h LEU 102 N 0.00 -0.13 -0.61 0.08 7.12 0.54 -0.99 115.31 121.32 3i1n h LEU 102 Ca 0.00 -0.34 0.00 0.00 0.13 0.00 0.00 57.88 57.67 3i1n h LEU 102 Cb 0.19 0.03 0.00 0.00 -0.53 0.00 0.00 40.66 40.35 3i1n h LEU 102 CO 0.00 0.29 -0.42 2.30 -0.13 0.00 0.00 178.44 180.47 3i1n n ILE 103 N -4.97 0.00 -0.10 4.05 -5.35 0.11 -1.06 119.36 112.04 3i1n n ILE 103 Ca -0.09 -0.16 -0.23 0.00 -0.27 0.00 0.00 62.75 62.01 3i1n n ILE 103 Cb 0.24 0.77 -0.12 0.00 -1.74 0.00 0.00 39.64 38.79 3i1n n ILE 103 CO 0.00 0.00 0.00 0.41 -1.76 0.00 0.00 176.55 175.20 3i1n n THR 104 N -0.54 1.57 0.00 7.28 -1.04 0.44 -4.80 114.28 117.19 3i1n n THR 104 Ca 0.10 -0.43 0.00 0.00 -2.04 0.00 0.00 64.05 61.67 3i1n n THR 104 Cb 0.39 -1.74 0.00 0.00 -1.82 0.00 0.00 70.33 67.16 3i1n n THR 104 CO 0.00 0.00 0.00 2.30 -0.64 0.00 0.00 175.07 176.73 3i1n n ILE 105 N -3.82 0.00 -0.05 12.58 -5.35 -1.13 -4.81 119.36 116.78 3i1n n ILE 105 Ca -0.43 -0.01 -0.03 0.00 -0.27 0.00 0.00 62.75 62.01 3i1n n ILE 105 Cb 0.92 0.31 -0.01 0.00 -1.74 0.00 0.00 39.64 39.12 3i1n n ILE 105 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3i1n h ALA 106 N 0.00 0.00 -1.07 -1.28 0.00 -1.29 -3.32 119.26 112.30 3i1n h ALA 106 Ca 0.00 -0.39 0.29 0.00 0.00 0.00 0.00 54.91 54.81 3i1n h ALA 106 Cb 0.00 0.35 -0.11 0.00 0.00 0.00 0.00 17.79 18.03 3i1n h ALA 106 CO 0.00 0.35 0.68 0.28 0.00 0.00 0.00 179.25 180.55 3i1n h VAL 107 N -0.81 0.45 -0.49 0.00 2.07 -1.30 0.32 116.25 116.49 3i1n h VAL 107 Ca 0.00 -0.13 0.07 0.00 0.82 0.00 0.00 66.70 67.47 3i1n h VAL 107 Cb 0.35 0.05 -0.06 0.00 -1.52 0.00 0.00 31.29 30.10 3i1n h VAL 107 CO 0.00 0.07 0.14 -0.65 0.02 0.00 0.00 177.57 177.15 3i1n h PRO 108 N 0.37 0.29 0.00 1.57 0.11 -1.81 -2.58 132.00 129.95 3i1n h PRO 108 Ca 0.64 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.74 3i1n h PRO 108 Cb 1.62 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.67 3i1n h PRO 108 CO -0.36 0.19 0.00 0.54 -0.21 0.00 0.00 178.00 178.16 3i1n n ARG 109 N -5.05 0.32 -2.28 1.05 3.00 0.11 -4.75 116.66 109.07 3i1n n ARG 109 Ca 0.05 0.00 -0.42 0.00 -0.01 0.00 0.00 57.85 57.47 3i1n n ARG 109 Cb 0.22 -1.20 -0.03 0.00 0.00 0.00 0.00 32.46 31.45 3i1n n ARG 109 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.63 178.05 3i1n s ILE 110 N -2.00 3.88 0.00 0.55 1.01 -0.97 -4.68 121.20 118.98 3i1n s ILE 110 Ca 0.06 1.21 0.00 0.00 0.00 0.00 0.00 60.65 61.93 3i1n s ILE 110 Cb 0.03 -3.78 0.00 0.00 0.01 0.00 0.00 42.46 38.72 3i1n s ILE 110 CO 0.05 -0.02 0.00 0.54 0.00 0.00 0.00 174.94 175.50 3i1n n ARG 111 N 5.65 0.00 0.12 2.79 5.12 -1.26 -1.35 116.66 127.72 3i1n n ARG 111 Ca 0.13 0.00 -0.23 0.00 -1.93 0.00 0.00 57.85 55.82 3i1n n ARG 111 Cb 0.44 0.00 -0.15 0.00 -1.16 0.00 0.00 32.46 31.59 3i1n n ARG 111 CO 0.00 0.00 0.00 0.38 -1.93 0.00 0.00 177.63 176.08 3i1n h ASP 112 N 0.00 0.81 -3.95 0.55 2.03 -1.92 -3.51 116.42 110.43 3i1n h ASP 112 Ca 0.00 -0.89 0.00 0.00 -0.73 0.00 0.00 57.03 55.41 3i1n h ASP 112 Cb 0.00 -0.26 0.00 0.00 -0.83 0.00 0.00 39.33 38.24 3i1n h ASP 112 CO 0.00 1.64 -0.63 0.33 -1.03 0.00 0.00 179.24 179.55 3i1n n PHE 113 N -3.81 -3.28 -0.37 4.15 7.35 -0.45 -5.02 117.46 116.03 3i1n n PHE 113 Ca -0.15 1.97 0.00 0.00 -0.76 0.00 0.00 57.45 58.51 3i1n n PHE 113 Cb 1.03 -3.13 0.00 0.00 0.35 0.00 0.00 39.48 37.73 3i1n n PHE 113 CO 0.00 0.00 0.00 2.89 -0.76 0.00 0.00 176.76 178.89 3i1n n ARG 114 N 1.25 0.12 0.00 -4.13 -4.01 -1.26 -5.10 116.66 103.54 3i1n n ARG 114 Ca 0.00 -0.56 0.00 0.00 -1.04 0.00 0.00 57.85 56.25 3i1n n ARG 114 Cb 0.00 -0.81 0.00 0.00 -3.04 0.00 0.00 32.46 28.61 3i1n n ARG 114 CO 0.00 0.00 0.00 0.41 -3.04 0.00 0.00 177.63 175.00 3i1n n GLY 115 N -0.09 2.91 3.91 2.89 0.00 -1.26 -4.79 105.19 108.76 3i1n n GLY 115 Ca 0.00 -1.82 -0.28 0.00 0.00 0.00 0.00 46.02 43.93 3i1n n GLY 115 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3i1n s LEU 116 N 0.00 2.62 -0.03 0.99 2.01 -1.24 -4.74 118.68 118.28 3i1n s LEU 116 Ca 0.00 0.64 -0.17 0.00 0.01 0.00 0.00 54.13 54.61 3i1n s LEU 116 Cb 0.00 -3.17 -0.05 0.00 0.01 0.00 0.00 46.19 42.98 3i1n s LEU 116 CO 0.00 -1.83 0.47 -0.55 1.01 0.00 0.00 176.35 175.44 3i1n s SER 117 N -4.57 6.81 -0.15 2.29 0.15 -1.26 -1.58 113.70 115.38 3i1n s SER 117 Ca 0.62 0.96 0.14 0.00 0.70 0.00 0.00 55.95 58.37 3i1n s SER 117 Cb -0.11 -2.29 0.67 0.00 -1.71 0.00 0.00 66.02 62.59 3i1n s SER 117 CO 0.48 0.18 1.55 0.00 1.20 0.00 0.00 173.24 176.65 3i1n n ALA 118 N 2.56 3.33 0.26 5.45 0.00 -1.26 -3.81 120.51 127.04 3i1n n ALA 118 Ca -0.10 -1.50 0.09 0.00 0.00 0.00 0.00 53.44 51.92 3i1n n ALA 118 Cb 0.52 -1.06 -0.13 0.00 0.00 0.00 0.00 19.45 18.78 3i1n n ALA 118 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3i1n n LYS 119 N 0.78 0.78 -1.76 0.00 5.02 -1.26 -4.76 118.16 116.95 3i1n n LYS 119 Ca 0.23 -0.11 -0.37 0.00 -2.02 0.00 0.00 58.31 56.04 3i1n n LYS 119 Cb 0.92 -1.39 -0.05 0.00 -0.02 0.00 0.00 35.03 34.49 3i1n n LYS 119 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 3i1n n SER 120 N -1.89 3.16 -3.82 4.39 7.64 -1.25 -4.84 113.62 117.01 3i1n n SER 120 Ca -0.01 -2.73 -0.13 0.00 1.01 0.00 0.00 58.87 57.00 3i1n n SER 120 Cb 0.40 -1.50 -0.15 0.00 -1.01 0.00 0.00 64.21 61.95 3i1n n SER 120 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 3i1n s PHE 121 N 7.36 -0.00 -1.92 1.43 0.08 -1.26 -4.33 117.98 119.34 3i1n s PHE 121 Ca 0.61 0.11 0.15 0.00 0.12 0.00 0.00 56.93 57.92 3i1n s PHE 121 Cb 0.07 -0.11 0.88 0.00 -0.57 0.00 0.00 43.02 43.29 3i1n s PHE 121 CO 0.11 -0.05 1.33 -0.40 -0.10 0.00 0.00 175.22 176.10 3i1n n ASP 122 N 3.64 0.00 0.00 1.36 5.75 -0.72 -4.75 116.55 121.82 3i1n n ASP 122 Ca -0.20 -0.40 0.00 0.00 -0.01 0.00 0.00 54.79 54.18 3i1n n ASP 122 Cb 0.55 -0.04 0.00 0.00 -1.03 0.00 0.00 41.12 40.60 3i1n n ASP 122 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3i1n n GLY 123 N -0.05 0.66 1.78 6.12 0.00 -1.26 -4.92 105.19 107.52 3i1n n GLY 123 Ca 0.11 -0.40 -0.01 0.00 0.00 0.00 0.00 46.02 45.72 3i1n n GLY 123 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3i1n n ARG 124 N -2.60 0.54 -2.52 1.61 1.74 -1.26 -4.37 116.66 109.80 3i1n n ARG 124 Ca 0.00 -1.83 -0.07 0.00 -0.77 0.00 0.00 57.85 55.19 3i1n n ARG 124 Cb 0.00 -0.06 0.01 0.00 -1.02 0.00 0.00 32.46 31.39 3i1n n ARG 124 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3i1n n GLY 125 N -0.20 0.34 3.10 -0.13 0.00 -1.25 -4.57 105.19 102.47 3i1n n GLY 125 Ca -0.09 -0.50 -0.18 0.00 0.00 0.00 0.00 46.02 45.26 3i1n n GLY 125 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3i1n s ASN 126 N -2.93 1.33 0.00 1.61 0.01 -1.26 -3.09 114.94 110.61 3i1n s ASN 126 Ca 0.10 -0.44 0.00 0.00 -0.71 0.00 0.00 52.86 51.81 3i1n s ASN 126 Cb -0.04 -0.06 0.00 0.00 0.41 0.00 0.00 41.25 41.55 3i1n s ASN 126 CO 0.12 -0.03 0.00 0.00 -1.51 0.00 0.00 177.10 175.69 3i1n n TYR 127 N 1.89 0.00 -0.80 2.20 9.36 0.01 -1.76 117.16 128.06 3i1n n TYR 127 Ca -0.19 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.03 3i1n n TYR 127 Cb 0.55 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.26 3i1n n TYR 127 CO 0.00 0.00 0.00 0.43 0.22 0.00 0.00 176.86 177.51 3i1n n SER 128 N -0.32 -3.17 -3.81 2.98 7.64 -1.26 -4.05 113.62 111.63 3i1n n SER 128 Ca 0.00 0.24 -0.11 0.00 1.01 0.00 0.00 58.87 60.00 3i1n n SER 128 Cb 0.00 -1.68 -0.08 0.00 -1.01 0.00 0.00 64.21 61.43 3i1n n SER 128 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3i1n s MET 129 N -2.53 0.69 0.20 1.43 0.23 0.12 -4.83 119.30 114.61 3i1n s MET 129 Ca 0.00 -0.47 0.02 0.00 -1.03 0.00 0.00 55.69 54.20 3i1n s MET 129 Cb 0.00 0.29 -0.04 0.00 -1.53 0.00 0.00 34.83 33.56 3i1n s MET 129 CO 0.00 -0.20 0.36 0.20 -2.03 0.00 0.00 175.02 173.35 3i1n s GLY 130 N -1.83 1.60 0.00 3.16 0.00 -1.26 -1.85 107.32 107.15 3i1n s GLY 130 Ca -0.08 -0.99 0.00 0.00 0.00 0.00 0.00 44.72 43.65 3i1n s GLY 130 CO -0.01 -0.98 0.08 3.33 0.00 0.00 0.00 173.10 175.52 3i1n n VAL 131 N -0.87 0.00 -3.36 1.40 0.24 -0.47 -4.96 118.33 110.31 3i1n n VAL 131 Ca -0.06 -0.50 -0.25 0.00 -2.04 0.00 0.00 64.34 61.48 3i1n n VAL 131 Cb 0.55 1.00 0.01 0.00 -1.47 0.00 0.00 33.84 33.93 3i1n n VAL 131 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 3i1n n ARG 132 N -0.86 -1.39 -0.35 7.34 1.74 -1.25 -4.46 116.66 117.42 3i1n n ARG 132 Ca 0.00 0.83 0.00 0.00 -0.77 0.00 0.00 57.85 57.91 3i1n n ARG 132 Cb 0.00 -1.73 0.00 0.00 -1.02 0.00 0.00 32.46 29.71 3i1n n ARG 132 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 3i1n n GLU 133 N -1.40 0.00 0.00 5.56 2.13 -1.25 -4.84 120.64 120.84 3i1n n GLU 133 Ca -0.19 0.15 0.00 0.00 0.66 0.00 0.00 57.16 57.78 3i1n n GLU 133 Cb 0.57 -0.21 0.00 0.00 0.27 0.00 0.00 31.44 32.07 3i1n n GLU 133 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3i1n n GLN 134 N 1.53 0.00 0.00 5.31 0.00 -1.17 -4.39 117.38 118.66 3i1n n GLN 134 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.00 57.00 3i1n n GLN 134 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.24 3i1n n GLN 134 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.06 176.17 3i1n n ILE 135 N 0.00 0.00 -0.06 -0.39 5.41 -1.26 -4.30 119.36 118.76 3i1n n ILE 135 Ca 0.00 0.00 0.25 0.00 1.00 0.00 0.00 62.75 64.00 3i1n n ILE 135 Cb 0.00 0.00 0.70 0.00 -0.71 0.00 0.00 39.64 39.63 3i1n n ILE 135 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 176.55 176.71 3i1n h ILE 136 N 0.00 0.36 -3.21 1.39 3.07 -1.84 -3.34 117.51 113.95 3i1n h ILE 136 Ca 0.00 0.00 -0.58 0.00 1.55 0.00 0.00 64.86 65.83 3i1n h ILE 136 Cb 0.00 0.51 -0.07 0.00 -0.27 0.00 0.00 36.82 36.99 3i1n h ILE 136 CO 0.00 0.00 0.60 -0.36 -1.05 0.00 0.00 178.15 177.34 3i1n s PHE 137 N -4.70 3.37 0.48 0.16 0.08 -1.26 -4.22 117.98 111.88 3i1n s PHE 137 Ca -0.04 1.34 0.13 0.00 0.12 0.00 0.00 56.93 58.48 3i1n s PHE 137 Cb 0.17 -3.14 1.12 0.00 -0.57 0.00 0.00 43.02 40.60 3i1n s PHE 137 CO 0.61 -0.38 2.12 -1.35 -0.10 0.00 0.00 175.22 176.12 3i1n h PRO 138 N 7.45 0.19 0.00 0.24 0.11 -1.92 -2.70 132.00 135.36 3i1n h PRO 138 Ca -0.24 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.83 3i1n h PRO 138 Cb 1.09 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 32.16 3i1n h PRO 138 CO 0.91 0.13 -0.16 0.93 -0.21 0.00 0.00 178.00 179.60 3i1n h GLU 139 N 0.19 0.00 -6.27 1.05 3.07 -1.92 -3.40 114.58 107.30 3i1n h GLU 139 Ca 0.05 0.00 -0.56 0.00 -0.50 0.00 0.00 59.36 58.35 3i1n h GLU 139 Cb -0.02 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 27.87 3i1n h GLU 139 CO -0.01 0.16 1.08 0.42 -1.40 0.00 0.00 179.01 179.26 3i1n s ILE 140 N -4.41 3.79 -0.73 3.13 1.09 -1.02 -4.95 121.20 118.10 3i1n s ILE 140 Ca -0.03 0.91 -0.27 0.00 -1.10 0.00 0.00 60.65 60.16 3i1n s ILE 140 Cb 0.14 -3.76 0.02 0.00 -1.06 0.00 0.00 42.46 37.81 3i1n s ILE 140 CO 0.64 -0.27 1.41 -0.62 -0.10 0.00 0.00 174.94 176.00 3i1n s ASP 141 N 3.72 5.99 0.58 3.58 2.15 -1.26 -4.88 116.67 126.54 3i1n s ASP 141 Ca 0.68 -0.36 0.31 0.00 0.43 0.00 0.00 52.55 53.61 3i1n s ASP 141 Cb -0.25 -2.55 1.42 0.00 -0.30 0.00 0.00 42.92 41.24 3i1n s ASP 141 CO 0.27 -1.94 1.79 0.22 -0.17 0.00 0.00 175.17 175.34 3i1n h TYR 142 N 10.99 0.00 -0.00 -5.34 3.20 -1.92 1.49 116.97 125.39 3i1n h TYR 142 Ca -0.24 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.63 3i1n h TYR 142 Cb 1.07 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.34 3i1n h TYR 142 CO 1.12 0.00 -0.08 -0.25 -1.64 0.00 0.00 178.16 177.32 3i1n n ASP 143 N -3.81 0.23 -0.35 -2.11 8.00 -1.26 -3.25 116.55 114.00 3i1n n ASP 143 Ca 0.16 -0.27 0.04 0.00 0.71 0.00 0.00 54.79 55.43 3i1n n ASP 143 Cb 0.97 -0.18 0.06 0.00 -0.02 0.00 0.00 41.12 41.95 3i1n n ASP 143 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3i1n n LYS 144 N -1.18 1.13 -0.44 -1.24 4.76 0.51 -5.03 118.16 116.67 3i1n n LYS 144 Ca 0.13 -1.30 -0.28 0.00 -2.87 0.00 0.00 58.31 53.99 3i1n n LYS 144 Cb 0.27 -1.16 0.27 0.00 -1.84 0.00 0.00 35.03 32.57 3i1n n LYS 144 CO 0.00 0.00 0.00 1.33 -1.37 0.00 0.00 177.40 177.36 3i1n n VAL 145 N 0.34 0.00 -1.54 -0.18 0.24 -1.10 -4.98 118.33 111.11 3i1n n VAL 145 Ca 0.06 -0.44 0.00 0.00 -2.04 0.00 0.00 64.34 61.91 3i1n n VAL 145 Cb 0.26 -0.98 0.00 0.00 -1.47 0.00 0.00 33.84 31.65 3i1n n VAL 145 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 3i1n n ASP 146 N -5.01 0.00 0.00 -1.34 9.92 -1.26 -5.10 116.55 113.75 3i1n n ASP 146 Ca 0.03 -1.00 0.00 0.00 -0.53 0.00 0.00 54.79 53.29 3i1n n ASP 146 Cb 0.55 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 41.03 3i1n n ASP 146 CO 0.00 0.00 0.00 -1.14 0.13 0.00 0.00 177.20 176.19 3i1n n ARG 147 N 0.00 0.00 0.12 -1.24 3.00 -1.26 -5.00 116.66 112.28 3i1n n ARG 147 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 3i1n n ARG 147 Cb 0.47 0.00 0.30 0.00 0.00 0.00 0.00 32.46 33.24 3i1n n ARG 147 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.63 177.24 3i1n h VAL 148 N 4.02 1.26 0.00 5.15 -1.51 -2.01 -3.46 116.25 119.71 3i1n h VAL 148 Ca 0.00 -1.23 0.00 0.00 -1.23 0.00 0.00 66.70 64.24 3i1n h VAL 148 Cb 0.00 1.53 0.00 0.00 -2.13 0.00 0.00 31.29 30.69 3i1n h VAL 148 CO 0.00 0.37 0.00 -1.14 -1.23 0.00 0.00 177.57 175.57 3i1n n ARG 149 N -4.12 0.00 -1.19 5.19 0.63 -1.26 -3.06 116.66 112.85 3i1n n ARG 149 Ca -0.01 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.92 3i1n n ARG 149 Cb 0.40 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.31 3i1n n ARG 149 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3i1n n GLY 150 N 0.00 -3.96 1.14 5.14 0.00 -1.26 -4.57 105.19 101.68 3i1n n GLY 150 Ca 0.00 -0.90 -0.08 0.00 0.00 0.00 0.00 46.02 45.03 3i1n n GLY 150 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 3i1n n LEU 151 N -1.74 0.00 -3.58 0.99 -0.00 -1.26 -4.74 117.00 106.67 3i1n n LEU 151 Ca 0.00 -1.07 -0.09 0.00 -0.00 0.00 0.00 56.01 54.85 3i1n n LEU 151 Cb 0.21 0.37 -0.10 0.00 -0.00 0.00 0.00 43.42 43.91 3i1n n LEU 151 CO 0.00 -0.17 -0.01 1.51 -0.00 0.00 0.00 177.39 178.72 3i1n s ASP 152 N -1.85 -0.05 0.19 1.45 3.84 -0.66 -1.37 116.67 118.21 3i1n s ASP 152 Ca 0.08 0.74 -0.01 0.00 -0.00 0.00 0.00 52.55 53.36 3i1n s ASP 152 Cb 0.00 1.21 -0.04 0.00 -1.38 0.00 0.00 42.92 42.71 3i1n s ASP 152 CO 0.05 -0.25 0.38 0.27 -0.00 0.00 0.00 175.17 175.62 3i1n s ILE 153 N 2.57 5.21 -0.06 2.11 -5.25 -0.77 -2.47 121.20 122.54 3i1n s ILE 153 Ca 0.02 -0.34 -0.05 0.00 -0.99 0.00 0.00 60.65 59.29 3i1n s ILE 153 Cb -0.13 -3.72 0.02 0.00 2.95 0.00 0.00 42.46 41.58 3i1n s ILE 153 CO -0.13 -0.14 0.16 0.42 -1.79 0.00 0.00 174.94 173.46 3i1n s THR 154 N -1.83 -0.01 -0.21 8.37 -4.23 -0.86 0.15 115.64 117.02 3i1n s THR 154 Ca 0.38 0.03 -0.06 0.00 -1.18 0.00 0.00 61.69 60.86 3i1n s THR 154 Cb -0.11 -0.23 -0.03 0.00 1.34 0.00 0.00 72.50 73.47 3i1n s THR 154 CO 0.29 0.01 0.04 -0.63 -0.54 0.00 0.00 174.62 173.79 3i1n s ILE 155 N 0.28 4.28 -0.29 2.99 1.01 -1.26 -2.26 121.20 125.93 3i1n s ILE 155 Ca -0.02 -0.20 -0.09 0.00 0.00 0.00 0.00 60.65 60.34 3i1n s ILE 155 Cb -0.03 -2.96 -0.01 0.00 0.01 0.00 0.00 42.46 39.47 3i1n s ILE 155 CO -0.01 0.40 0.13 -0.89 0.00 0.00 0.00 174.94 174.58 3i1n s THR 156 N 1.08 4.57 0.29 2.92 2.01 -0.10 -0.81 115.64 125.60 3i1n s THR 156 Ca 0.03 -0.33 0.07 0.00 0.31 0.00 0.00 61.69 61.78 3i1n s THR 156 Cb -0.14 -3.27 -0.06 0.00 0.01 0.00 0.00 72.50 69.03 3i1n s THR 156 CO 0.03 0.14 -0.07 0.42 -0.69 0.00 0.00 174.62 174.44 3i1n s THR 157 N 1.62 1.77 -2.19 -0.82 -4.23 -1.18 -0.75 115.64 109.86 3i1n s THR 157 Ca 0.05 -2.15 0.30 0.00 -1.18 0.00 0.00 61.69 58.71 3i1n s THR 157 Cb -0.17 -2.46 0.77 0.00 1.34 0.00 0.00 72.50 71.99 3i1n s THR 157 CO 0.06 -0.30 2.04 0.35 -0.54 0.00 0.00 174.62 176.23 3i1n n THR 158 N -0.61 0.00 -1.57 3.99 -2.24 -0.75 -4.75 114.28 108.35 3i1n n THR 158 Ca -0.05 -0.10 -0.42 0.00 -2.27 0.00 0.00 64.05 61.21 3i1n n THR 158 Cb 0.63 -0.12 0.01 0.00 -2.10 0.00 0.00 70.33 68.75 3i1n n THR 158 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3i1n n ALA 159 N -0.55 -0.28 -0.07 6.98 0.00 -1.26 -4.82 120.51 120.51 3i1n n ALA 159 Ca 0.22 0.25 -0.07 0.00 0.00 0.00 0.00 53.44 53.83 3i1n n ALA 159 Cb 0.20 -2.00 -0.04 0.00 0.00 0.00 0.00 19.45 17.61 3i1n n ALA 159 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 3i1n h LYS 160 N 1.44 0.00 -6.26 0.00 6.56 -1.89 -3.39 116.57 113.03 3i1n h LYS 160 Ca -0.42 0.00 -0.55 0.00 -1.06 0.00 0.00 60.65 58.61 3i1n h LYS 160 Cb 1.35 0.00 -0.02 0.00 -0.57 0.00 0.00 32.23 32.99 3i1n h LYS 160 CO 0.56 0.29 -0.28 -1.54 -2.06 0.00 0.00 179.45 176.42 3i1n s SER 161 N -5.93 6.45 0.44 0.86 1.04 -1.26 -4.17 113.70 111.13 3i1n s SER 161 Ca -0.13 0.56 0.28 0.00 0.48 0.00 0.00 55.95 57.14 3i1n s SER 161 Cb 0.01 -2.08 0.85 0.00 0.10 0.00 0.00 66.02 64.91 3i1n s SER 161 CO 0.27 -0.03 1.78 -2.24 0.98 0.00 0.00 173.24 174.00 3i1n h ASP 162 N 2.31 0.00 -0.90 7.02 3.04 -1.85 -1.00 116.42 125.05 3i1n h ASP 162 Ca -0.47 0.00 0.16 0.00 -3.24 0.00 0.00 57.03 53.48 3i1n h ASP 162 Cb 1.18 0.00 -0.16 0.00 -1.04 0.00 0.00 39.33 39.31 3i1n h ASP 162 CO 0.70 0.00 -0.33 -0.08 -2.04 0.00 0.00 179.24 177.49 3i1n h GLU 163 N 0.00 -0.03 -0.01 4.15 4.57 -1.94 0.64 114.58 121.96 3i1n h GLU 163 Ca 0.00 0.00 -0.03 0.00 -1.18 0.00 0.00 59.36 58.15 3i1n h GLU 163 Cb 0.72 0.01 0.00 0.00 -0.16 0.00 0.00 28.75 29.32 3i1n h GLU 163 CO 0.00 -0.02 -0.13 0.93 -1.18 0.00 0.00 179.01 178.61 3i1n h GLU 164 N -0.03 0.10 -0.96 1.92 5.08 -1.77 -3.16 114.58 115.76 3i1n h GLU 164 Ca 0.36 -0.10 0.16 0.00 -1.00 0.00 0.00 59.36 58.78 3i1n h GLU 164 Cb 0.62 0.03 -0.09 0.00 0.50 0.00 0.00 28.75 29.81 3i1n h GLU 164 CO -0.92 0.83 0.61 0.78 -1.00 0.00 0.00 179.01 179.30 3i1n h GLY 165 N -0.59 1.47 0.93 -3.84 0.00 -0.57 0.24 103.07 100.71 3i1n h GLY 165 Ca -0.01 -0.34 -0.00 0.00 0.00 0.00 0.00 47.33 46.97 3i1n h GLY 165 CO 0.03 0.05 0.00 -0.09 0.00 0.00 0.00 176.54 176.53 3i1n h ARG 166 N 0.77 0.00 -0.98 4.80 2.43 0.17 -2.01 114.38 119.57 3i1n h ARG 166 Ca 0.51 -0.00 0.20 0.00 -0.81 0.00 0.00 59.98 59.88 3i1n h ARG 166 Cb 0.76 -0.00 -0.09 0.00 -0.42 0.00 0.00 29.97 30.22 3i1n h ARG 166 CO -0.27 0.07 0.62 0.00 -1.51 0.00 0.00 179.97 178.88 3i1n h ALA 167 N 0.93 1.90 0.39 2.80 0.00 -0.57 0.23 119.26 124.93 3i1n h ALA 167 Ca 0.00 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 3i1n h ALA 167 Cb 0.07 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.81 3i1n h ALA 167 CO -0.00 -0.25 -0.19 1.25 0.00 0.00 0.00 179.25 180.07 3i1n h LEU 168 N 0.62 -0.44 -1.13 0.00 5.85 -0.48 -1.65 115.31 118.08 3i1n h LEU 168 Ca 0.55 -0.12 0.08 0.00 0.84 0.00 0.00 57.88 59.22 3i1n h LEU 168 Cb 1.04 0.11 -0.06 0.00 0.37 0.00 0.00 40.66 42.12 3i1n h LEU 168 CO -0.31 -0.02 0.60 -0.07 -0.34 0.00 0.00 178.44 178.30 3i1n h LEU 169 N -0.97 0.90 -2.02 2.25 4.07 -1.15 -1.43 115.31 116.96 3i1n h LEU 169 Ca -0.05 0.01 0.05 0.00 0.08 0.00 0.00 57.88 57.97 3i1n h LEU 169 Cb 0.54 -0.18 -0.01 0.00 1.08 0.00 0.00 40.66 42.09 3i1n h LEU 169 CO 0.09 0.56 0.13 0.00 -1.08 0.00 0.00 178.44 178.14 3i1n h ALA 170 N 1.51 2.14 0.00 1.53 0.00 -0.36 -1.80 119.26 122.29 3i1n h ALA 170 Ca 0.41 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 55.24 3i1n h ALA 170 Cb 0.27 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 3i1n h ALA 170 CO -0.17 -0.22 -0.35 0.00 0.00 0.00 0.00 179.25 178.51 3i1n h ALA 171 N 1.90 0.95 -2.26 0.00 0.00 -0.27 -3.41 119.26 116.18 3i1n h ALA 171 Ca 0.09 -0.32 -0.48 0.00 0.00 0.00 0.00 54.91 54.19 3i1n h ALA 171 Cb 0.35 -0.06 0.04 0.00 0.00 0.00 0.00 17.79 18.12 3i1n h ALA 171 CO -0.00 0.44 0.09 -0.06 0.00 0.00 0.00 179.25 179.72 3i1n s PHE 172 N -3.52 3.41 0.33 0.00 0.40 -0.68 -4.91 117.98 113.02 3i1n s PHE 172 Ca 0.01 0.65 0.11 0.00 -0.60 0.00 0.00 56.93 57.10 3i1n s PHE 172 Cb 0.10 -2.43 1.02 0.00 0.51 0.00 0.00 43.02 42.22 3i1n s PHE 172 CO 0.68 -0.46 1.62 -0.44 0.70 0.00 0.00 175.22 177.33 3i1n h ASP 173 N 0.13 0.20 0.00 1.36 3.32 -1.79 -3.46 116.42 116.19 3i1n h ASP 173 Ca -0.46 0.22 0.00 0.00 0.02 0.00 0.00 57.03 56.81 3i1n h ASP 173 Cb 1.23 0.25 0.00 0.00 0.22 0.00 0.00 39.33 41.03 3i1n h ASP 173 CO 0.61 -0.25 0.00 0.33 -1.72 0.00 0.00 179.24 178.21 3i1n n PHE 174 N -5.21 0.00 0.00 4.55 -0.00 -1.26 -4.83 117.46 110.71 3i1n n PHE 174 Ca 0.30 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.75 3i1n n PHE 174 Cb 0.96 0.00 0.00 0.00 -0.00 0.00 0.00 39.48 40.44 3i1n n PHE 174 CO 0.00 0.00 0.00 -2.30 -0.00 0.00 0.00 176.76 174.46 3i1n n PRO 175 N 0.25 0.00 -1.09 -7.13 -0.02 -1.26 -4.80 135.00 120.94 3i1n n PRO 175 Ca 0.00 0.21 0.15 0.00 -2.02 0.00 0.00 63.50 61.84 3i1n n PRO 175 Cb 0.00 -0.64 -0.04 0.00 -0.02 0.00 0.00 33.50 32.80 3i1n n PRO 175 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 3i1n n PHE 176 N -0.45 -2.75 0.25 6.00 0.99 -1.23 -4.76 117.46 115.51 3i1n n PHE 176 Ca 0.00 1.38 0.02 0.00 -0.00 0.00 0.00 57.45 58.85 3i1n n PHE 176 Cb 0.00 -2.50 0.12 0.00 -1.00 0.00 0.00 39.48 36.10 3i1n n PHE 176 CO 0.00 0.00 0.00 -2.13 -0.00 0.00 0.00 176.76 174.63