#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n1l s PRO 2 N 0.00 4.41 -0.00 0.00 0.04 -1.26 -4.80 135.00 133.39 1n1l s PRO 2 Ca 0.00 1.85 -0.30 0.00 0.04 0.00 0.00 61.00 62.58 1n1l s PRO 2 Cb 0.00 -2.98 -0.06 0.00 0.04 0.00 0.00 34.50 31.50 1n1l s PRO 2 CO 0.00 -0.01 1.44 0.42 0.04 0.00 0.00 177.00 178.89 1n1l s ILE 3 N -1.27 3.65 0.05 0.56 1.01 -1.26 -5.00 121.20 118.93 1n1l s ILE 3 Ca 0.49 1.02 0.01 0.00 0.00 0.00 0.00 60.65 62.17 1n1l s ILE 3 Cb -0.32 -3.65 -0.03 0.00 0.01 0.00 0.00 42.46 38.47 1n1l s ILE 3 CO 0.41 -0.01 -0.05 0.42 0.00 0.00 0.00 174.94 175.70 1n1l s THR 4 N 2.58 0.38 0.01 2.92 -4.23 -1.26 -4.99 115.64 111.05 1n1l s THR 4 Ca 0.65 -1.30 -0.02 0.00 -1.18 0.00 0.00 61.69 59.84 1n1l s THR 4 Cb -0.32 -0.84 -0.01 0.00 1.34 0.00 0.00 72.50 72.67 1n1l s THR 4 CO 0.27 -0.61 0.03 0.00 -0.54 0.00 0.00 174.62 173.77 1n1l s ALA 5 N -2.22 -0.04 0.07 3.99 0.00 -1.26 -5.15 121.76 117.15 1n1l s ALA 5 Ca -0.05 -0.39 0.02 0.00 0.00 0.00 0.00 51.96 51.54 1n1l s ALA 5 Cb -0.04 0.12 -0.03 0.00 0.00 0.00 0.00 23.12 23.16 1n1l s ALA 5 CO -0.03 -0.16 -0.08 1.52 0.00 0.00 0.00 175.76 177.01 1n1l s TYR 6 N -1.32 0.83 -0.00 0.00 1.13 -1.26 -4.85 117.35 111.87 1n1l s TYR 6 Ca -0.14 -0.65 0.02 0.00 -1.41 0.00 0.00 57.07 54.88 1n1l s TYR 6 Cb -0.08 -0.48 -0.03 0.00 -1.10 0.00 0.00 41.96 40.26 1n1l s TYR 6 CO -0.00 -0.08 -0.03 0.00 -2.51 0.00 0.00 175.55 172.93 1n1l s ALA 7 N -2.25 3.17 -0.01 9.51 0.00 -1.26 -4.93 121.76 125.99 1n1l s ALA 7 Ca -0.00 -0.97 0.02 0.00 0.00 0.00 0.00 51.96 51.01 1n1l s ALA 7 Cb -0.04 -1.26 -0.01 0.00 0.00 0.00 0.00 23.12 21.81 1n1l s ALA 7 CO -0.01 0.63 -0.08 -0.65 0.00 0.00 0.00 175.76 175.65 1n1l s GLN 8 N -1.46 0.66 -0.12 0.00 -0.21 -1.26 -5.09 119.66 112.17 1n1l s GLN 8 Ca 0.18 -0.29 -0.13 0.00 0.02 0.00 0.00 55.36 55.14 1n1l s GLN 8 Cb -0.11 -0.64 -0.05 0.00 1.00 0.00 0.00 33.01 33.21 1n1l s GLN 8 CO 0.09 0.17 0.29 -1.14 -2.12 0.00 0.00 175.29 172.58 1n1l s GLN 9 N -0.19 4.03 0.00 2.91 0.74 -1.26 -4.98 119.66 120.92 1n1l s GLN 9 Ca 0.03 0.12 0.04 0.00 0.05 0.00 0.00 55.36 55.60 1n1l s GLN 9 Cb -0.03 -3.34 -0.02 0.00 1.10 0.00 0.00 33.01 30.72 1n1l s GLN 9 CO -0.00 0.44 0.31 0.25 -0.55 0.00 0.00 175.29 175.73 1n1l n THR 10 N 2.89 0.00 -3.70 -0.34 -2.24 -1.26 -5.03 114.28 104.61 1n1l n THR 10 Ca -0.14 -0.44 -0.14 0.00 -2.27 0.00 0.00 64.05 61.06 1n1l n THR 10 Cb 0.53 1.03 -0.09 0.00 -2.10 0.00 0.00 70.33 69.70 1n1l n THR 10 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 1n1l s ARG 11 N -1.05 0.67 0.59 -0.78 3.52 -1.26 -5.10 118.95 115.53 1n1l s ARG 11 Ca 0.03 0.29 0.07 0.00 -0.13 0.00 0.00 55.73 55.99 1n1l s ARG 11 Cb 0.03 0.31 0.09 0.00 -1.56 0.00 0.00 34.95 33.82 1n1l s ARG 11 CO 0.12 -0.15 0.81 0.20 -0.81 0.00 0.00 175.30 175.48 1n1l s GLY 12 N -0.54 1.75 0.24 8.12 0.00 -1.26 -4.91 107.32 110.72 1n1l s GLY 12 Ca -0.07 -2.02 -0.09 0.00 0.00 0.00 0.00 44.72 42.54 1n1l s GLY 12 CO 0.03 -1.56 1.62 -2.00 0.00 0.00 0.00 173.10 171.19 1n1l h LEU 13 N 0.08 -0.54 -0.22 0.66 7.12 -2.02 -0.61 115.31 119.78 1n1l h LEU 13 Ca -0.32 0.21 -0.21 0.00 0.13 0.00 0.00 57.88 57.69 1n1l h LEU 13 Cb 1.28 0.41 0.01 0.00 -0.53 0.00 0.00 40.66 41.83 1n1l h LEU 13 CO 0.41 -0.22 -0.69 0.25 -0.13 0.00 0.00 178.44 178.06 1n1l h LEU 14 N 0.04 0.95 -1.02 2.25 5.85 -2.00 -2.07 115.31 119.32 1n1l h LEU 14 Ca 0.38 -0.58 -0.09 0.00 0.84 0.00 0.00 57.88 58.43 1n1l h LEU 14 Cb 0.64 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.38 1n1l h LEU 14 CO -0.72 1.38 -0.43 1.23 -0.34 0.00 0.00 178.44 179.56 1n1l h GLY 15 N 0.62 0.00 0.68 3.75 0.00 -1.87 -2.12 103.07 104.12 1n1l h GLY 15 Ca -0.03 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.29 1n1l h GLY 15 CO 0.15 0.00 -0.10 0.00 0.00 0.00 0.00 176.54 176.58 1n1l h ILE 17 N -0.61 0.39 -0.55 0.00 2.04 -1.31 0.27 117.51 117.75 1n1l h ILE 17 Ca -0.03 0.00 0.10 0.00 1.00 0.00 0.00 64.86 65.93 1n1l h ILE 17 Cb 0.44 0.39 -0.08 0.00 -0.74 0.00 0.00 36.82 36.84 1n1l h ILE 17 CO 0.05 0.00 0.13 0.40 0.00 0.00 0.00 178.15 178.73 1n1l h ILE 18 N -0.34 0.70 -0.52 -0.67 5.03 -1.41 -1.88 117.51 118.43 1n1l h ILE 18 Ca 0.09 -0.09 -0.06 0.00 -0.12 0.00 0.00 64.86 64.68 1n1l h ILE 18 Cb 0.48 0.41 -0.02 0.00 -3.03 0.00 0.00 36.82 34.65 1n1l h ILE 18 CO -0.30 0.05 0.07 0.74 -0.68 0.00 0.00 178.15 178.03 1n1l h THR 19 N 0.27 1.24 -0.46 -0.27 2.02 -0.64 0.01 112.91 115.07 1n1l h THR 19 Ca 0.28 -0.92 0.05 0.00 0.77 0.00 0.00 66.41 66.60 1n1l h THR 19 Cb 0.39 0.76 -0.05 0.00 -1.74 0.00 0.00 68.15 67.51 1n1l h THR 19 CO -0.35 0.33 0.19 -1.28 0.37 0.00 0.00 175.52 174.78 1n1l h SER 20 N 0.79 0.23 -0.10 4.18 0.87 0.26 0.11 113.55 119.90 1n1l h SER 20 Ca 0.16 0.04 -0.05 0.00 -1.23 0.00 0.00 61.79 60.72 1n1l h SER 20 Cb 0.38 0.01 -0.00 0.00 -0.44 0.00 0.00 62.40 62.35 1n1l h SER 20 CO 0.01 0.17 -0.12 -0.07 -0.53 0.00 0.00 176.83 176.29 1n1l h LEU 21 N 0.38 0.27 -0.87 2.23 3.38 -0.93 -3.23 115.31 116.53 1n1l h LEU 21 Ca 0.21 -0.50 -0.06 0.00 0.09 0.00 0.00 57.88 57.62 1n1l h LEU 21 Cb 0.18 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 1n1l h LEU 21 CO -0.19 0.72 -0.27 0.71 0.09 0.00 0.00 178.44 179.50 1n1l h THR 22 N -0.17 0.61 -1.52 0.22 1.35 -0.95 -3.46 112.91 108.98 1n1l h THR 22 Ca 0.01 -1.33 -0.37 0.00 -0.55 0.00 0.00 66.41 64.17 1n1l h THR 22 Cb 0.65 1.90 -0.12 0.00 -1.73 0.00 0.00 68.15 68.84 1n1l h THR 22 CO 0.03 0.27 -0.36 0.61 -0.25 0.00 0.00 175.52 175.81 1n1l n GLY 23 N 0.37 1.33 3.17 5.82 0.00 0.38 -4.64 105.19 111.62 1n1l n GLY 23 Ca 0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.68 1n1l n GLY 23 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1n1l s ARG 24 N -3.83 2.46 -0.27 1.61 3.52 -1.24 -1.75 118.95 119.46 1n1l s ARG 24 Ca 0.00 -1.24 -0.00 0.00 -0.13 0.00 0.00 55.73 54.36 1n1l s ARG 24 Cb 0.00 -3.14 0.05 0.00 -1.56 0.00 0.00 34.95 30.29 1n1l s ARG 24 CO 0.00 -0.59 -0.05 0.34 -0.81 0.00 0.00 175.30 174.18 1n1l s ASP 25 N 1.25 4.59 0.00 -2.12 3.68 -0.03 -4.81 116.67 119.23 1n1l s ASP 25 Ca -0.05 -1.21 0.25 0.00 2.13 0.00 0.00 52.55 53.67 1n1l s ASP 25 Cb -0.19 -1.65 0.50 0.00 -1.45 0.00 0.00 42.92 40.13 1n1l s ASP 25 CO -0.02 -0.20 1.42 0.29 0.13 0.00 0.00 175.17 176.79 1n1l n LYS 26 N 4.57 1.62 -2.18 4.34 4.76 -1.26 -1.17 118.16 128.83 1n1l n LYS 26 Ca -0.14 -1.18 -0.37 0.00 -2.87 0.00 0.00 58.31 53.74 1n1l n LYS 26 Cb 0.44 -1.48 -0.00 0.00 -1.84 0.00 0.00 35.03 32.15 1n1l n LYS 26 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 1n1l s ASN 27 N -2.20 6.05 0.40 4.39 0.01 -1.26 -5.00 114.94 117.34 1n1l s ASN 27 Ca 0.28 2.38 -0.24 0.00 -0.71 0.00 0.00 52.86 54.57 1n1l s ASN 27 Cb 0.20 -2.61 -0.09 0.00 0.41 0.00 0.00 41.25 39.16 1n1l s ASN 27 CO 0.41 -1.01 1.09 0.00 -1.51 0.00 0.00 177.10 176.08 1n1l s GLN 28 N -2.71 4.10 -0.11 -0.60 1.03 -1.26 -4.97 119.66 115.13 1n1l s GLN 28 Ca 0.64 1.62 -0.05 0.00 0.04 0.00 0.00 55.36 57.62 1n1l s GLN 28 Cb -0.31 -2.57 -0.04 0.00 0.03 0.00 0.00 33.01 30.13 1n1l s GLN 28 CO 0.37 -0.23 0.08 0.08 -2.54 0.00 0.00 175.29 173.05 1n1l s VAL 29 N -1.58 4.95 0.06 3.63 1.01 -1.26 -5.12 120.40 122.10 1n1l s VAL 29 Ca 0.58 -0.00 -0.02 0.00 0.00 0.00 0.00 61.98 62.54 1n1l s VAL 29 Cb -0.25 -3.13 -0.04 0.00 0.00 0.00 0.00 36.38 32.96 1n1l s VAL 29 CO 0.31 0.60 0.00 -1.61 0.00 0.00 0.00 175.10 174.40 1n1l s GLU 30 N -0.86 0.66 0.37 2.72 2.02 -1.26 -3.93 118.70 118.42 1n1l s GLU 30 Ca 0.13 -1.21 0.00 0.00 0.02 0.00 0.00 54.97 53.91 1n1l s GLU 30 Cb -0.12 0.23 0.00 0.00 0.10 0.00 0.00 34.13 34.34 1n1l s GLU 30 CO 0.03 -0.14 0.00 0.41 0.02 0.00 0.00 175.26 175.58 1n1l n GLY 31 N 0.07 -2.41 0.03 -1.39 0.00 -1.26 -4.81 105.19 95.42 1n1l n GLY 31 Ca -0.13 -1.71 -0.02 0.00 0.00 0.00 0.00 46.02 44.16 1n1l n GLY 31 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1n1l n GLU 32 N -0.25 2.28 -4.92 1.61 4.71 -1.26 -1.28 120.64 121.52 1n1l n GLU 32 Ca 0.00 -0.02 -0.33 0.00 -0.01 0.00 0.00 57.16 56.81 1n1l n GLU 32 Cb 0.00 -1.17 -0.15 0.00 -1.01 0.00 0.00 31.44 29.11 1n1l n GLU 32 CO 0.00 0.00 0.00 0.08 0.09 0.00 0.00 177.13 177.30 1n1l s VAL 33 N -2.24 2.79 -0.10 2.62 1.01 -1.26 -0.61 120.40 122.61 1n1l s VAL 33 Ca -0.03 -0.77 -0.01 0.00 0.00 0.00 0.00 61.98 61.16 1n1l s VAL 33 Cb 0.03 -2.13 -0.03 0.00 0.00 0.00 0.00 36.38 34.25 1n1l s VAL 33 CO 0.28 0.55 -0.04 -1.10 0.00 0.00 0.00 175.10 174.79 1n1l s GLN 34 N 0.11 3.09 -0.21 2.72 -1.52 0.66 -4.96 119.66 119.55 1n1l s GLN 34 Ca -0.08 -0.49 -0.22 0.00 -1.95 0.00 0.00 55.36 52.63 1n1l s GLN 34 Cb -0.15 -2.75 -0.02 0.00 -0.22 0.00 0.00 33.01 29.87 1n1l s GLN 34 CO 0.05 0.56 0.67 0.42 -0.25 0.00 0.00 175.29 176.74 1n1l s ILE 35 N -0.50 4.98 0.12 1.08 1.01 -1.26 -1.19 121.20 125.44 1n1l s ILE 35 Ca 0.08 1.26 0.09 0.00 0.00 0.00 0.00 60.65 62.08 1n1l s ILE 35 Cb -0.12 -3.98 -0.04 0.00 0.01 0.00 0.00 42.46 38.33 1n1l s ILE 35 CO 0.02 0.07 -0.21 0.68 0.00 0.00 0.00 174.94 175.50 1n1l s VAL 36 N 2.11 1.80 0.03 2.92 -7.23 0.10 -4.99 120.40 115.14 1n1l s VAL 36 Ca 0.30 -1.64 0.03 0.00 -1.81 0.00 0.00 61.98 58.87 1n1l s VAL 36 Cb -0.16 -1.66 -0.02 0.00 0.56 0.00 0.00 36.38 35.10 1n1l s VAL 36 CO 0.10 -0.08 -0.10 -0.44 -0.31 0.00 0.00 175.10 174.27 1n1l s SER 37 N -2.06 1.15 0.05 4.85 0.01 -1.26 0.01 113.70 116.45 1n1l s SER 37 Ca 0.09 -0.39 0.01 0.00 1.31 0.00 0.00 55.95 56.97 1n1l s SER 37 Cb -0.09 -0.05 0.01 0.00 0.21 0.00 0.00 66.02 66.09 1n1l s SER 37 CO 0.05 -0.03 0.06 0.35 0.41 0.00 0.00 173.24 174.08 1n1l n THR 38 N 2.06 0.00 -0.14 1.44 -2.24 0.26 -4.99 114.28 110.67 1n1l n THR 38 Ca -0.18 -0.20 -0.04 0.00 -2.27 0.00 0.00 64.05 61.37 1n1l n THR 38 Cb 0.56 -0.69 0.05 0.00 -2.10 0.00 0.00 70.33 68.14 1n1l n THR 38 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1n1l h ALA 39 N 0.61 0.54 0.00 6.98 0.00 -1.99 -3.29 119.26 122.11 1n1l h ALA 39 Ca -0.03 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1n1l h ALA 39 Cb 0.12 0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1n1l h ALA 39 CO 0.04 -0.26 -0.95 0.25 0.00 0.00 0.00 179.25 178.33 1n1l n THR 40 N -5.05 0.00 -3.70 0.00 -2.24 -1.26 -5.05 114.28 96.98 1n1l n THR 40 Ca 0.04 -0.05 -0.14 0.00 -2.27 0.00 0.00 64.05 61.63 1n1l n THR 40 Cb 0.20 0.98 -0.08 0.00 -2.10 0.00 0.00 70.33 69.33 1n1l n THR 40 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1n1l s GLN 41 N -2.86 0.79 -0.02 -0.78 -0.21 -1.24 -5.15 119.66 110.18 1n1l s GLN 41 Ca 0.07 -0.17 0.01 0.00 0.02 0.00 0.00 55.36 55.29 1n1l s GLN 41 Cb 0.15 0.36 0.01 0.00 1.00 0.00 0.00 33.01 34.52 1n1l s GLN 41 CO 0.81 -0.24 -0.04 -0.08 -2.12 0.00 0.00 175.29 173.61 1n1l s THR 42 N -1.60 0.43 0.00 -0.19 -1.32 -1.26 0.92 115.64 112.61 1n1l s THR 42 Ca -0.11 -0.16 0.00 0.00 -1.21 0.00 0.00 61.69 60.21 1n1l s THR 42 Cb -0.03 -0.42 0.00 0.00 -1.51 0.00 0.00 72.50 70.54 1n1l s THR 42 CO 0.04 0.16 0.00 2.22 -2.21 0.00 0.00 174.62 174.82 1n1l n PHE 43 N 3.45 -0.08 -4.33 9.09 -1.74 0.10 -4.27 117.46 119.68 1n1l n PHE 43 Ca -0.19 0.00 -0.23 0.00 -0.56 0.00 0.00 57.45 56.47 1n1l n PHE 43 Cb 0.55 0.00 -0.12 0.00 1.52 0.00 0.00 39.48 41.43 1n1l n PHE 43 CO 0.00 0.00 0.00 -0.51 -0.56 0.00 0.00 176.76 175.69 1n1l s LEU 44 N 0.00 2.41 -0.01 5.98 1.43 -0.49 0.00 118.68 128.00 1n1l s LEU 44 Ca 0.00 -0.82 0.02 0.00 -1.03 0.00 0.00 54.13 52.30 1n1l s LEU 44 Cb 0.00 -0.88 -0.01 0.00 0.03 0.00 0.00 46.19 45.33 1n1l s LEU 44 CO 0.00 0.01 -0.08 0.00 0.23 0.00 0.00 176.35 176.51 1n1l s ALA 45 N -1.80 0.66 -0.04 4.21 0.00 -0.33 -3.95 121.76 120.51 1n1l s ALA 45 Ca 0.14 -0.34 0.06 0.00 0.00 0.00 0.00 51.96 51.82 1n1l s ALA 45 Cb -0.07 -0.17 -0.01 0.00 0.00 0.00 0.00 23.12 22.87 1n1l s ALA 45 CO 0.06 0.16 -0.24 0.99 0.00 0.00 0.00 175.76 176.74 1n1l s THR 46 N -0.19 1.94 -0.28 0.00 2.01 0.12 -0.25 115.64 118.99 1n1l s THR 46 Ca 0.03 -1.02 -0.18 0.00 0.31 0.00 0.00 61.69 60.83 1n1l s THR 46 Cb -0.03 -1.63 -0.02 0.00 0.01 0.00 0.00 72.50 70.83 1n1l s THR 46 CO -0.00 0.54 0.52 0.00 -0.69 0.00 0.00 174.62 174.99 1n1l s ILE 48 N 2.35 0.86 -1.37 0.00 1.01 -0.11 -0.37 121.20 123.58 1n1l s ILE 48 Ca 0.21 -0.37 -0.06 0.00 0.00 0.00 0.00 60.65 60.43 1n1l s ILE 48 Cb -0.15 -0.79 0.03 0.00 0.01 0.00 0.00 42.46 41.56 1n1l s ILE 48 CO 0.10 0.28 0.92 0.59 0.00 0.00 0.00 174.94 176.84 1n1l n ASN 49 N 3.53 -3.40 0.00 3.58 5.03 -1.23 -2.12 115.26 120.65 1n1l n ASN 49 Ca -0.21 -0.73 0.00 0.00 0.87 0.00 0.00 54.58 54.52 1n1l n ASN 49 Cb 0.53 -4.35 0.00 0.00 -1.02 0.00 0.00 39.78 34.94 1n1l n ASN 49 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1n1l n GLY 50 N -1.63 0.61 3.26 7.41 0.00 -1.26 -4.99 105.19 108.60 1n1l n GLY 50 Ca -0.13 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.61 1n1l n GLY 50 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1n1l s VAL 51 N -2.77 1.78 -0.26 1.61 1.01 -0.90 -1.42 120.40 119.45 1n1l s VAL 51 Ca 0.00 -1.09 -0.09 0.00 0.00 0.00 0.00 61.98 60.80 1n1l s VAL 51 Cb 0.00 -1.51 -0.03 0.00 0.00 0.00 0.00 36.38 34.84 1n1l s VAL 51 CO 0.00 0.38 0.11 0.00 0.00 0.00 0.00 175.10 175.60 1n1l s TRP 53 N 1.66 2.67 0.21 0.00 0.52 0.55 -1.20 118.94 123.33 1n1l s TRP 53 Ca 0.06 -0.21 -0.16 0.00 0.02 0.00 0.00 56.10 55.82 1n1l s TRP 53 Cb -0.16 -1.27 0.06 0.00 -1.15 0.00 0.00 33.47 30.95 1n1l s TRP 53 CO 0.06 0.54 0.77 -2.37 0.02 0.00 0.00 176.95 175.97 1n1l n THR 54 N -0.20 0.00 -3.02 2.01 5.66 -0.90 0.15 114.28 117.98 1n1l n THR 54 Ca -0.09 -0.57 -0.39 0.00 -3.05 0.00 0.00 64.05 59.94 1n1l n THR 54 Cb 0.56 0.68 -0.06 0.00 -1.55 0.00 0.00 70.33 69.97 1n1l n THR 54 CO 0.00 0.00 0.00 0.68 -3.05 0.00 0.00 175.07 172.70 1n1l s VAL 55 N -2.20 4.56 0.25 1.08 -7.23 -1.26 -0.89 120.40 114.72 1n1l s VAL 55 Ca 0.17 1.61 -0.05 0.00 -1.81 0.00 0.00 61.98 61.90 1n1l s VAL 55 Cb -0.03 -4.10 0.21 0.00 0.56 0.00 0.00 36.38 33.02 1n1l s VAL 55 CO 0.06 0.46 1.87 0.22 -0.31 0.00 0.00 175.10 177.40 1n1l h TYR 56 N 4.89 1.13 0.00 2.82 5.03 -1.61 -1.55 116.97 127.68 1n1l h TYR 56 Ca -0.46 -0.03 0.00 0.00 2.58 0.00 0.00 58.73 60.82 1n1l h TYR 56 Cb 1.21 -0.36 0.00 0.00 1.55 0.00 0.00 36.73 39.13 1n1l h TYR 56 CO 0.65 0.80 0.00 -2.39 -1.32 0.00 0.00 178.16 175.90 1n1l n HIS 57 N -4.33 0.00 -0.08 -3.82 1.44 -1.26 -0.19 115.22 106.97 1n1l n HIS 57 Ca 0.08 0.00 -0.17 0.00 -2.01 0.00 0.00 57.72 55.63 1n1l n HIS 57 Cb 0.11 -0.42 -0.06 0.00 0.12 0.00 0.00 29.99 29.74 1n1l n HIS 57 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1n1l n GLY 58 N -0.59 -0.25 0.12 -1.39 0.00 -0.90 -4.76 105.19 97.42 1n1l n GLY 58 Ca 0.03 -0.08 -0.01 0.00 0.00 0.00 0.00 46.02 45.96 1n1l n GLY 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n1l h ALA 59 N -0.54 0.58 -0.85 4.61 0.00 -1.24 -3.48 119.26 118.34 1n1l h ALA 59 Ca -0.40 -0.60 0.00 0.00 0.00 0.00 0.00 54.91 53.91 1n1l h ALA 59 Cb 1.36 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.05 1n1l h ALA 59 CO -0.24 0.83 0.00 0.41 0.00 0.00 0.00 179.25 180.25 1n1l n GLY 60 N 1.22 3.28 1.12 0.00 0.00 0.73 -2.14 105.19 109.40 1n1l n GLY 60 Ca 0.01 -0.15 0.11 0.00 0.00 0.00 0.00 46.02 45.99 1n1l n GLY 60 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1n1l n THR 61 N 0.00 0.66 -1.68 2.61 -2.24 -1.26 -4.87 114.28 107.50 1n1l n THR 61 Ca 0.00 -0.77 -0.37 0.00 -2.27 0.00 0.00 64.05 60.64 1n1l n THR 61 Cb 0.00 0.64 0.06 0.00 -2.10 0.00 0.00 70.33 68.94 1n1l n THR 61 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1n1l n ARG 62 N 1.34 1.05 -1.69 -0.78 1.74 -0.91 -4.72 116.66 112.70 1n1l n ARG 62 Ca 0.20 0.41 -0.30 0.00 -0.77 0.00 0.00 57.85 57.40 1n1l n ARG 62 Cb 0.55 -2.39 0.09 0.00 -1.02 0.00 0.00 32.46 29.69 1n1l n ARG 62 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 1n1l s THR 63 N -1.43 2.74 -0.09 0.55 -4.23 -1.26 -4.51 115.64 107.40 1n1l s THR 63 Ca 0.80 0.24 -0.01 0.00 -1.18 0.00 0.00 61.69 61.54 1n1l s THR 63 Cb -0.40 -3.09 -0.03 0.00 1.34 0.00 0.00 72.50 70.33 1n1l s THR 63 CO 0.43 -0.31 -0.04 -0.51 -0.54 0.00 0.00 174.62 173.65 1n1l s ILE 64 N -3.30 3.93 0.23 2.99 2.07 -0.27 -4.88 121.20 121.98 1n1l s ILE 64 Ca 0.61 -0.38 -0.30 0.00 -1.41 0.00 0.00 60.65 59.17 1n1l s ILE 64 Cb -0.13 -2.65 -0.09 0.00 0.13 0.00 0.00 42.46 39.72 1n1l s ILE 64 CO 0.53 0.58 1.29 0.00 -1.91 0.00 0.00 174.94 175.42 1n1l s ALA 65 N -0.60 3.51 0.21 1.50 0.00 -1.26 -0.77 121.76 124.35 1n1l s ALA 65 Ca 0.09 1.12 -0.04 0.00 0.00 0.00 0.00 51.96 53.14 1n1l s ALA 65 Cb -0.12 -3.46 -0.03 0.00 0.00 0.00 0.00 23.12 19.51 1n1l s ALA 65 CO 0.02 -0.52 0.20 -1.54 0.00 0.00 0.00 175.76 173.93 1n1l s SER 66 N 0.04 0.10 0.19 0.00 1.04 -1.12 -4.61 113.70 109.34 1n1l s SER 66 Ca 0.54 -1.28 0.11 0.00 0.48 0.00 0.00 55.95 55.79 1n1l s SER 66 Cb -0.37 0.42 0.59 0.00 0.10 0.00 0.00 66.02 66.76 1n1l s SER 66 CO 0.42 -0.90 1.28 -2.65 0.98 0.00 0.00 173.24 172.36 1n1l n PRO 67 N -0.29 0.07 -0.15 4.02 -0.02 -0.32 -0.85 135.00 137.47 1n1l n PRO 67 Ca 0.01 0.54 0.08 0.00 -2.02 0.00 0.00 63.50 62.11 1n1l n PRO 67 Cb 0.65 -1.83 0.15 0.00 -0.02 0.00 0.00 33.50 32.45 1n1l n PRO 67 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1n1l n LYS 68 N -1.87 1.92 0.00 -0.52 5.02 -1.26 -4.80 118.16 116.66 1n1l n LYS 68 Ca -0.01 -2.48 0.00 0.00 -2.02 0.00 0.00 58.31 53.80 1n1l n LYS 68 Cb 0.11 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.62 1n1l n LYS 68 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1n1l n GLY 69 N -1.04 -1.85 3.76 0.72 0.00 -0.85 -4.97 105.19 100.96 1n1l n GLY 69 Ca 0.15 -1.77 -0.38 0.00 0.00 0.00 0.00 46.02 44.02 1n1l n GLY 69 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1n1l s PRO 70 N 0.00 3.46 -0.11 1.61 0.02 -0.72 -2.80 135.00 136.46 1n1l s PRO 70 Ca 0.00 2.05 0.02 0.00 0.02 0.00 0.00 61.00 63.09 1n1l s PRO 70 Cb 0.00 -2.36 0.01 0.00 0.02 0.00 0.00 34.50 32.17 1n1l s PRO 70 CO 0.00 -0.88 -0.17 0.08 -0.33 0.00 0.00 177.00 175.70 1n1l s VAL 71 N -1.40 1.61 0.41 3.83 1.01 0.05 -4.92 120.40 121.00 1n1l s VAL 71 Ca 0.67 -0.71 -0.24 0.00 0.00 0.00 0.00 61.98 61.70 1n1l s VAL 71 Cb -0.36 -1.46 -0.09 0.00 0.00 0.00 0.00 36.38 34.48 1n1l s VAL 71 CO 0.43 0.46 1.07 -0.51 0.00 0.00 0.00 175.10 176.55 1n1l s ILE 72 N 0.90 3.62 0.33 2.22 1.10 -1.26 -1.12 121.20 126.99 1n1l s ILE 72 Ca -0.08 1.22 -0.29 0.00 -0.51 0.00 0.00 60.65 61.00 1n1l s ILE 72 Cb -0.15 -3.62 -0.12 0.00 0.15 0.00 0.00 42.46 38.71 1n1l s ILE 72 CO -0.01 -0.01 1.41 0.00 -2.11 0.00 0.00 174.94 174.23 1n1l n GLN 73 N -0.19 2.36 0.08 3.50 6.02 -1.26 -4.70 117.38 123.19 1n1l n GLN 73 Ca 0.06 0.83 -0.03 0.00 -0.01 0.00 0.00 57.00 57.85 1n1l n GLN 73 Cb 0.49 -2.50 -0.06 0.00 1.02 0.00 0.00 30.24 29.19 1n1l n GLN 73 CO 0.00 0.00 0.00 0.52 -1.01 0.00 0.00 177.06 176.57 1n1l h MET 74 N 3.32 0.00 -3.45 -1.09 2.86 -0.29 -3.48 114.93 112.79 1n1l h MET 74 Ca -0.47 0.00 -0.18 0.00 -2.06 0.00 0.00 59.70 56.98 1n1l h MET 74 Cb 1.26 0.00 -0.25 0.00 0.06 0.00 0.00 31.60 32.67 1n1l h MET 74 CO 0.68 0.72 -0.55 0.71 1.06 0.00 0.00 176.91 179.53 1n1l s TYR 75 N -2.81 -0.09 -0.12 -0.22 2.02 -0.91 -4.99 117.35 110.22 1n1l s TYR 75 Ca 0.01 0.23 -0.05 0.00 -0.37 0.00 0.00 57.07 56.90 1n1l s TYR 75 Cb 0.09 0.02 0.06 0.00 -0.40 0.00 0.00 41.96 41.73 1n1l s TYR 75 CO 0.79 -0.12 0.25 0.99 -1.57 0.00 0.00 175.55 175.89 1n1l s THR 76 N -0.27 -0.39 -0.34 -0.71 2.01 -1.26 -1.70 115.64 112.97 1n1l s THR 76 Ca -0.03 0.29 -0.01 0.00 0.31 0.00 0.00 61.69 62.25 1n1l s THR 76 Cb -0.03 -0.42 0.13 0.00 0.01 0.00 0.00 72.50 72.19 1n1l s THR 76 CO 0.00 0.12 0.19 0.21 -0.69 0.00 0.00 174.62 174.45 1n1l s ASN 77 N 2.40 3.23 0.37 3.53 2.47 -0.57 -5.02 114.94 121.36 1n1l s ASN 77 Ca 0.02 -1.98 0.04 0.00 0.42 0.00 0.00 52.86 51.35 1n1l s ASN 77 Cb -0.12 -0.47 0.70 0.00 -1.45 0.00 0.00 41.25 39.91 1n1l s ASN 77 CO -0.08 -0.34 2.01 0.58 -3.72 0.00 0.00 177.10 175.54 1n1l h VAL 78 N 5.46 1.15 -0.14 -5.21 2.07 -1.96 0.78 116.25 118.39 1n1l h VAL 78 Ca -0.02 -0.33 -0.13 0.00 0.82 0.00 0.00 66.70 67.04 1n1l h VAL 78 Cb 0.98 0.42 0.00 0.00 -1.52 0.00 0.00 31.29 31.17 1n1l h VAL 78 CO 0.34 0.16 -0.42 0.44 0.02 0.00 0.00 177.57 178.10 1n1l h ASP 79 N 0.71 0.60 0.85 0.57 3.32 -1.95 -2.49 116.42 118.03 1n1l h ASP 79 Ca 0.19 -0.60 0.00 0.00 0.02 0.00 0.00 57.03 56.64 1n1l h ASP 79 Cb -0.03 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.35 1n1l h ASP 79 CO -0.04 1.10 0.00 0.00 -1.72 0.00 0.00 179.24 178.58 1n1l n GLN 80 N -4.28 0.15 -3.25 3.56 3.00 -1.07 -4.93 117.38 110.56 1n1l n GLN 80 Ca -0.07 0.31 -0.16 0.00 -0.01 0.00 0.00 57.00 57.06 1n1l n GLN 80 Cb 0.55 -1.75 0.06 0.00 0.00 0.00 0.00 30.24 29.11 1n1l n GLN 80 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.06 173.59 1n1l n ASP 81 N -2.02 -4.16 -3.96 1.08 2.03 0.21 -4.93 116.55 104.79 1n1l n ASP 81 Ca 0.03 -0.43 -0.16 0.00 0.52 0.00 0.00 54.79 54.75 1n1l n ASP 81 Cb 0.26 -3.98 -0.14 0.00 -0.72 0.00 0.00 41.12 36.54 1n1l n ASP 81 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 1n1l s LEU 82 N -5.64 2.00 0.03 -2.67 2.96 -0.86 -1.80 118.68 112.70 1n1l s LEU 82 Ca 0.29 -0.10 -0.01 0.00 -0.22 0.00 0.00 54.13 54.09 1n1l s LEU 82 Cb -0.13 -0.29 -0.02 0.00 0.50 0.00 0.00 46.19 46.25 1n1l s LEU 82 CO 0.56 0.07 -0.01 -0.69 -1.32 0.00 0.00 176.35 174.95 1n1l s VAL 83 N -0.11 0.14 -0.17 1.68 1.01 -0.06 -1.51 120.40 121.38 1n1l s VAL 83 Ca 0.02 -1.14 -0.13 0.00 0.00 0.00 0.00 61.98 60.72 1n1l s VAL 83 Cb -0.02 -0.63 0.05 0.00 0.00 0.00 0.00 36.38 35.77 1n1l s VAL 83 CO -0.00 -0.63 0.43 -0.83 0.00 0.00 0.00 175.10 174.07 1n1l s GLY 84 N -1.87 -0.33 0.31 4.51 0.00 -0.69 -2.11 107.32 107.13 1n1l s GLY 84 Ca -0.09 1.35 0.09 0.00 0.00 0.00 0.00 44.72 46.07 1n1l s GLY 84 CO -0.03 1.28 0.03 -0.98 0.00 0.00 0.00 173.10 173.40 1n1l s TRP 85 N 0.63 2.64 0.42 1.90 0.51 -0.34 0.48 118.94 125.18 1n1l s TRP 85 Ca -0.03 -0.33 -0.27 0.00 -2.12 0.00 0.00 56.10 53.35 1n1l s TRP 85 Cb -0.05 -1.39 -0.09 0.00 -0.81 0.00 0.00 33.47 31.13 1n1l s TRP 85 CO -0.04 0.51 1.45 -2.14 -0.51 0.00 0.00 176.95 176.22 1n1l s PRO 86 N -3.73 3.88 0.22 4.98 0.02 -1.26 -0.88 135.00 138.23 1n1l s PRO 86 Ca 0.34 2.47 -0.30 0.00 0.02 0.00 0.00 61.00 63.53 1n1l s PRO 86 Cb -0.04 -2.80 -0.10 0.00 0.02 0.00 0.00 34.50 31.59 1n1l s PRO 86 CO 0.20 -0.68 1.48 0.00 -0.33 0.00 0.00 177.00 177.68 1n1l s ALA 87 N -1.17 3.68 0.39 -1.55 0.00 -0.51 -4.47 121.76 118.13 1n1l s ALA 87 Ca 0.57 1.35 -0.25 0.00 0.00 0.00 0.00 51.96 53.63 1n1l s ALA 87 Cb -0.45 -3.58 -0.11 0.00 0.00 0.00 0.00 23.12 18.98 1n1l s ALA 87 CO 0.59 -0.76 1.03 -2.30 0.00 0.00 0.00 175.76 174.32 1n1l n PRO 88 N 2.84 1.42 -1.65 0.00 -0.02 -1.26 -4.91 135.00 131.42 1n1l n PRO 88 Ca 0.09 0.51 -0.48 0.00 -2.02 0.00 0.00 63.50 61.60 1n1l n PRO 88 Cb 0.40 -2.03 -0.05 0.00 -0.02 0.00 0.00 33.50 31.80 1n1l n PRO 88 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1n1l n GLN 89 N 0.30 1.92 0.00 -0.52 1.13 -1.26 -2.02 117.38 116.94 1n1l n GLN 89 Ca 0.09 0.69 0.00 0.00 -1.94 0.00 0.00 57.00 55.84 1n1l n GLN 89 Cb 0.37 -2.44 0.00 0.00 0.11 0.00 0.00 30.24 28.28 1n1l n GLN 89 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1n1l n GLY 90 N 3.33 3.03 3.68 1.08 0.00 -1.26 -4.14 105.19 110.90 1n1l n GLY 90 Ca 0.18 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.91 1n1l n GLY 90 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1n1l s SER 91 N -1.18 2.54 -0.01 1.61 1.04 -0.86 -4.11 113.70 112.73 1n1l s SER 91 Ca 0.00 1.14 0.02 0.00 0.48 0.00 0.00 55.95 57.59 1n1l s SER 91 Cb 0.00 -1.80 -0.00 0.00 0.10 0.00 0.00 66.02 64.32 1n1l s SER 91 CO 0.00 -3.18 -0.07 -0.60 0.98 0.00 0.00 173.24 170.38 1n1l s ARG 92 N -4.99 0.62 -0.00 4.02 3.52 -0.41 -4.88 118.95 116.83 1n1l s ARG 92 Ca 0.65 -0.23 -0.07 0.00 -0.13 0.00 0.00 55.73 55.96 1n1l s ARG 92 Cb -0.18 -0.60 -0.05 0.00 -1.56 0.00 0.00 34.95 32.56 1n1l s ARG 92 CO 0.57 0.11 0.26 -1.12 -0.81 0.00 0.00 175.30 174.32 1n1l s SER 93 N 0.01 6.49 0.52 -2.12 0.01 -1.26 -4.07 113.70 113.28 1n1l s SER 93 Ca 0.00 0.55 -0.20 0.00 1.31 0.00 0.00 55.95 57.62 1n1l s SER 93 Cb -0.05 -2.09 -0.07 0.00 0.21 0.00 0.00 66.02 64.03 1n1l s SER 93 CO -0.00 0.27 1.10 -0.76 0.41 0.00 0.00 173.24 174.26 1n1l s LEU 94 N -1.70 3.80 -0.10 2.44 1.43 0.51 -4.87 118.68 120.19 1n1l s LEU 94 Ca 0.27 2.11 -0.20 0.00 -1.03 0.00 0.00 54.13 55.28 1n1l s LEU 94 Cb -0.13 -4.55 -0.04 0.00 0.03 0.00 0.00 46.19 41.50 1n1l s LEU 94 CO 0.15 -1.06 0.54 -0.89 0.23 0.00 0.00 176.35 175.32 1n1l s THR 95 N -1.81 5.14 0.48 5.49 2.01 -1.26 -3.52 115.64 122.17 1n1l s THR 95 Ca 0.70 1.10 -0.24 0.00 0.31 0.00 0.00 61.69 63.56 1n1l s THR 95 Cb -0.22 -3.88 -0.07 0.00 0.01 0.00 0.00 72.50 68.34 1n1l s THR 95 CO 0.25 0.31 1.33 -2.65 -0.69 0.00 0.00 174.62 173.17 1n1l n PRO 96 N 3.65 1.88 -2.40 4.92 -0.02 -1.26 0.16 135.00 141.92 1n1l n PRO 96 Ca -0.06 0.68 -0.41 0.00 -2.02 0.00 0.00 63.50 61.69 1n1l n PRO 96 Cb 0.52 -2.50 -0.04 0.00 -0.02 0.00 0.00 33.50 31.45 1n1l n PRO 96 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1n1l n THR 98 N 2.23 0.74 1.03 0.00 -2.24 -1.26 -4.77 114.28 110.01 1n1l n THR 98 Ca 0.03 -0.76 0.11 0.00 -2.27 0.00 0.00 64.05 61.16 1n1l n THR 98 Cb 0.45 0.61 0.03 0.00 -2.10 0.00 0.00 70.33 69.32 1n1l n THR 98 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1n1l n GLY 100 N 1.45 1.35 3.57 0.00 0.00 -1.26 -4.95 105.19 105.35 1n1l n GLY 100 Ca 0.07 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.74 1n1l n GLY 100 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1n1l n SER 101 N -0.96 -0.11 -0.59 1.61 2.88 -1.26 -4.95 113.62 110.24 1n1l n SER 101 Ca -0.14 0.61 0.07 0.00 -1.33 0.00 0.00 58.87 58.08 1n1l n SER 101 Cb 0.57 -1.35 0.06 0.00 -0.75 0.00 0.00 64.21 62.74 1n1l n SER 101 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1n1l n SER 102 N -1.48 2.24 -4.41 -3.46 7.64 -1.26 -4.87 113.62 108.02 1n1l n SER 102 Ca 0.12 -1.62 -0.44 0.00 1.01 0.00 0.00 58.87 57.94 1n1l n SER 102 Cb 0.50 -0.01 -0.08 0.00 -1.01 0.00 0.00 64.21 63.61 1n1l n SER 102 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 1n1l s ASP 103 N -1.21 6.14 0.27 6.43 -0.00 -1.26 -0.05 116.67 126.99 1n1l s ASP 103 Ca 0.17 -1.19 0.07 0.00 -0.00 0.00 0.00 52.55 51.60 1n1l s ASP 103 Cb 0.12 -2.18 -0.03 0.00 -0.00 0.00 0.00 42.92 40.83 1n1l s ASP 103 CO 0.18 -0.60 0.20 -0.76 -0.00 0.00 0.00 175.17 174.19 1n1l s LEU 104 N 1.69 3.71 -0.14 1.23 1.43 0.11 -3.79 118.68 122.91 1n1l s LEU 104 Ca 0.05 -0.35 -0.03 0.00 -1.03 0.00 0.00 54.13 52.77 1n1l s LEU 104 Cb -0.23 -2.25 0.05 0.00 0.03 0.00 0.00 46.19 43.79 1n1l s LEU 104 CO 0.08 -0.10 0.04 -0.31 0.23 0.00 0.00 176.35 176.28 1n1l s TYR 105 N -2.19 0.66 -0.12 0.29 1.51 0.92 -0.45 117.35 117.98 1n1l s TYR 105 Ca 0.34 -0.46 -0.23 0.00 -1.01 0.00 0.00 57.07 55.71 1n1l s TYR 105 Cb -0.07 -0.85 -0.03 0.00 -0.11 0.00 0.00 41.96 40.90 1n1l s TYR 105 CO 0.25 -0.48 0.70 -1.17 -1.11 0.00 0.00 175.55 173.74 1n1l s LEU 106 N 1.98 4.25 -0.25 -1.29 2.96 -0.28 -0.21 118.68 125.83 1n1l s LEU 106 Ca 0.02 1.09 -0.13 0.00 -0.22 0.00 0.00 54.13 54.89 1n1l s LEU 106 Cb -0.15 -3.06 -0.04 0.00 0.50 0.00 0.00 46.19 43.44 1n1l s LEU 106 CO -0.07 -0.20 0.29 -0.69 -1.32 0.00 0.00 176.35 174.35 1n1l s VAL 107 N 1.31 5.25 0.46 1.68 1.01 -0.79 -0.53 120.40 128.78 1n1l s VAL 107 Ca 0.35 0.42 -0.04 0.00 0.00 0.00 0.00 61.98 62.71 1n1l s VAL 107 Cb -0.17 -3.62 -0.03 0.00 0.00 0.00 0.00 36.38 32.56 1n1l s VAL 107 CO 0.15 0.24 0.73 -0.89 0.00 0.00 0.00 175.10 175.33 1n1l s THR 108 N 1.64 4.84 0.51 3.92 2.01 -0.29 -4.33 115.64 123.93 1n1l s THR 108 Ca 0.12 0.01 0.33 0.00 0.31 0.00 0.00 61.69 62.46 1n1l s THR 108 Cb -0.15 -3.83 0.36 0.00 0.01 0.00 0.00 72.50 68.89 1n1l s THR 108 CO 0.09 -0.74 2.20 0.08 -0.69 0.00 0.00 174.62 175.55 1n1l h ARG 109 N 0.33 0.00 -0.06 4.92 0.11 -1.87 -1.18 114.38 116.64 1n1l h ARG 109 Ca -0.47 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.61 1n1l h ARG 109 Cb 1.21 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.29 1n1l h ARG 109 CO 0.61 0.04 0.00 0.72 0.10 0.00 0.00 179.97 181.45 1n1l n HIS 110 N -3.53 0.07 -2.51 4.08 8.25 -1.26 -4.92 115.22 115.41 1n1l n HIS 110 Ca -0.02 -0.04 -0.13 0.00 -0.26 0.00 0.00 57.72 57.27 1n1l n HIS 110 Cb 0.15 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.27 1n1l n HIS 110 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1n1l n ALA 111 N -0.40 -0.49 -2.76 -1.41 0.00 -0.44 -4.74 120.51 110.26 1n1l n ALA 111 Ca 0.15 0.14 -0.24 0.00 0.00 0.00 0.00 53.44 53.49 1n1l n ALA 111 Cb 0.16 -2.10 -0.02 0.00 0.00 0.00 0.00 19.45 17.49 1n1l n ALA 111 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1n1l s ASP 112 N -2.66 6.33 -0.24 0.00 1.01 -1.26 -4.50 116.67 115.36 1n1l s ASP 112 Ca 0.10 0.35 0.02 0.00 0.71 0.00 0.00 52.55 53.74 1n1l s ASP 112 Cb -0.05 -1.99 0.05 0.00 1.01 0.00 0.00 42.92 41.95 1n1l s ASP 112 CO 0.13 -0.17 -0.14 -0.69 0.21 0.00 0.00 175.17 174.51 1n1l s VAL 113 N -2.11 2.12 -0.06 -1.27 1.01 -1.26 -1.14 120.40 117.70 1n1l s VAL 113 Ca 0.38 -1.42 0.02 0.00 0.00 0.00 0.00 61.98 60.96 1n1l s VAL 113 Cb -0.10 -2.14 -0.03 0.00 0.00 0.00 0.00 36.38 34.11 1n1l s VAL 113 CO 0.32 0.14 -0.11 0.27 0.00 0.00 0.00 175.10 175.72 1n1l s ILE 114 N 1.16 3.33 0.28 2.22 -4.36 0.31 -4.92 121.20 119.22 1n1l s ILE 114 Ca -0.05 -0.62 -0.29 0.00 -0.26 0.00 0.00 60.65 59.43 1n1l s ILE 114 Cb -0.18 -2.33 -0.10 0.00 1.25 0.00 0.00 42.46 41.10 1n1l s ILE 114 CO -0.07 0.59 1.27 -2.16 0.24 0.00 0.00 174.94 174.81 1n1l s PRO 115 N -0.72 4.42 -0.05 0.37 0.04 -1.26 -1.13 135.00 136.67 1n1l s PRO 115 Ca 0.11 2.08 0.02 0.00 0.04 0.00 0.00 61.00 63.25 1n1l s PRO 115 Cb -0.11 -3.13 0.02 0.00 0.04 0.00 0.00 34.50 31.31 1n1l s PRO 115 CO 0.01 -0.13 -0.08 0.08 0.04 0.00 0.00 177.00 176.92 1n1l s VAL 116 N -0.73 0.78 -0.16 -0.36 1.01 0.41 -2.97 120.40 118.38 1n1l s VAL 116 Ca 0.51 -0.28 -0.22 0.00 0.00 0.00 0.00 61.98 61.99 1n1l s VAL 116 Cb -0.37 -0.75 -0.03 0.00 0.00 0.00 0.00 36.38 35.23 1n1l s VAL 116 CO 0.46 0.27 0.67 -0.60 0.00 0.00 0.00 175.10 175.90 1n1l s ARG 117 N 0.75 4.28 0.06 2.72 6.06 0.11 0.05 118.95 132.97 1n1l s ARG 117 Ca -0.12 0.74 -0.31 0.00 -2.50 0.00 0.00 55.73 53.54 1n1l s ARG 117 Cb -0.15 -3.54 -0.07 0.00 0.06 0.00 0.00 34.95 31.25 1n1l s ARG 117 CO 0.02 -0.17 1.42 0.50 -2.50 0.00 0.00 175.30 174.57 1n1l s ARG 118 N 1.64 4.29 -0.32 5.12 6.06 0.92 0.03 118.95 136.69 1n1l s ARG 118 Ca 0.32 2.05 0.13 0.00 -2.50 0.00 0.00 55.73 55.74 1n1l s ARG 118 Cb -0.16 -3.42 0.46 0.00 0.06 0.00 0.00 34.95 31.90 1n1l s ARG 118 CO 0.12 -0.52 1.09 0.54 -2.50 0.00 0.00 175.30 174.04 1n1l n ARG 119 N 4.69 2.48 -1.13 5.12 1.74 -0.33 -4.90 116.66 124.32 1n1l n ARG 119 Ca 0.13 -3.85 0.00 0.00 -0.77 0.00 0.00 57.85 53.35 1n1l n ARG 119 Cb 0.43 -1.85 0.00 0.00 -1.02 0.00 0.00 32.46 30.02 1n1l n ARG 119 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1n1l n GLY 120 N -0.47 0.08 0.31 -0.13 0.00 -1.23 -4.71 105.19 99.03 1n1l n GLY 120 Ca 0.25 -1.75 -0.08 0.00 0.00 0.00 0.00 46.02 44.43 1n1l n GLY 120 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1n1l h ASP 121 N 0.00 1.05 0.00 1.61 5.19 -1.99 -3.38 116.42 118.89 1n1l h ASP 121 Ca 0.00 -0.28 0.00 0.00 -0.62 0.00 0.00 57.03 56.13 1n1l h ASP 121 Cb 0.00 -0.28 0.00 0.00 0.18 0.00 0.00 39.33 39.23 1n1l h ASP 121 CO 0.00 1.07 -0.33 -1.54 -3.12 0.00 0.00 179.24 175.32 1n1l n SER 122 N -4.19 0.18 -4.00 6.45 3.41 -1.26 -4.70 113.62 109.52 1n1l n SER 122 Ca 0.04 -1.80 -0.14 0.00 -0.26 0.00 0.00 58.87 56.71 1n1l n SER 122 Cb 0.32 -0.16 -0.13 0.00 -0.26 0.00 0.00 64.21 63.99 1n1l n SER 122 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 1n1l s ARG 123 N -0.19 0.43 0.04 4.33 3.52 -1.26 -0.79 118.95 125.02 1n1l s ARG 123 Ca 0.02 -0.43 -0.00 0.00 -0.13 0.00 0.00 55.73 55.19 1n1l s ARG 123 Cb 0.02 -0.31 -0.03 0.00 -1.56 0.00 0.00 34.95 33.07 1n1l s ARG 123 CO 0.00 0.07 -0.03 0.20 -0.81 0.00 0.00 175.30 174.73 1n1l s GLY 124 N -0.77 0.36 -0.07 8.12 0.00 -0.19 -1.19 107.32 113.58 1n1l s GLY 124 Ca -0.04 -0.87 -0.00 0.00 0.00 0.00 0.00 44.72 43.81 1n1l s GLY 124 CO 0.00 -0.96 -0.04 -1.35 0.00 0.00 0.00 173.10 170.75 1n1l s SER 125 N -2.11 4.85 0.40 1.64 1.04 0.10 -1.20 113.70 118.43 1n1l s SER 125 Ca -0.06 0.04 -0.26 0.00 0.48 0.00 0.00 55.95 56.15 1n1l s SER 125 Cb -0.02 -1.28 -0.09 0.00 0.10 0.00 0.00 66.02 64.73 1n1l s SER 125 CO -0.05 0.37 1.22 -0.76 0.98 0.00 0.00 173.24 175.00 1n1l s LEU 126 N -0.82 4.22 0.24 2.42 1.43 0.63 0.04 118.68 126.83 1n1l s LEU 126 Ca 0.13 2.47 0.19 0.00 -1.03 0.00 0.00 54.13 55.89 1n1l s LEU 126 Cb -0.11 -3.95 0.06 0.00 0.03 0.00 0.00 46.19 42.22 1n1l s LEU 126 CO 0.02 -0.72 1.24 -0.07 0.23 0.00 0.00 176.35 177.04 1n1l h LEU 127 N 2.71 0.00 -7.05 1.79 3.38 -1.86 -3.41 115.31 110.87 1n1l h LEU 127 Ca -0.49 0.00 -0.55 0.00 0.09 0.00 0.00 57.88 56.93 1n1l h LEU 127 Cb 1.24 0.00 -0.40 0.00 0.09 0.00 0.00 40.66 41.59 1n1l h LEU 127 CO 0.63 0.29 -0.77 -0.44 0.09 0.00 0.00 178.44 178.25 1n1l s SER 128 N -5.99 3.59 0.57 -0.43 0.01 -1.26 -5.13 113.70 105.07 1n1l s SER 128 Ca 0.02 -1.33 -0.18 0.00 1.31 0.00 0.00 55.95 55.77 1n1l s SER 128 Cb 0.08 -0.62 -0.10 0.00 0.21 0.00 0.00 66.02 65.59 1n1l s SER 128 CO 0.76 -0.40 0.37 -0.81 0.41 0.00 0.00 173.24 173.57 1n1l n PRO 129 N 5.04 0.38 -4.12 12.44 -0.04 -1.26 -5.01 135.00 142.43 1n1l n PRO 129 Ca -0.05 0.15 -0.13 0.00 -0.04 0.00 0.00 63.50 63.43 1n1l n PRO 129 Cb 0.43 -1.56 -0.11 0.00 -0.04 0.00 0.00 33.50 32.23 1n1l n PRO 129 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1n1l s ARG 130 N -1.91 0.68 0.23 0.54 0.52 -0.64 -4.95 118.95 113.42 1n1l s ARG 130 Ca 0.66 -0.99 -0.30 0.00 -0.52 0.00 0.00 55.73 54.58 1n1l s ARG 130 Cb -0.45 -0.34 -0.10 0.00 0.52 0.00 0.00 34.95 34.59 1n1l s ARG 130 CO 0.57 0.04 1.46 -1.25 0.02 0.00 0.00 175.30 176.14 1n1l s PRO 131 N -2.39 4.26 0.37 3.54 0.04 -1.26 -0.69 135.00 138.88 1n1l s PRO 131 Ca -0.01 2.30 0.14 0.00 0.04 0.00 0.00 61.00 63.47 1n1l s PRO 131 Cb -0.05 -3.12 0.99 0.00 0.04 0.00 0.00 34.50 32.36 1n1l s PRO 131 CO -0.01 -0.45 1.80 0.97 0.04 0.00 0.00 177.00 179.35 1n1l h ILE 132 N 3.65 0.62 -0.94 0.56 -0.00 -1.64 -1.56 117.51 118.20 1n1l h ILE 132 Ca -0.45 -0.17 0.15 0.00 -0.00 0.00 0.00 64.86 64.39 1n1l h ILE 132 Cb 1.21 0.07 -0.10 0.00 -0.00 0.00 0.00 36.82 38.01 1n1l h ILE 132 CO 0.80 0.09 0.55 0.77 -0.00 0.00 0.00 178.15 180.37 1n1l h SER 133 N 0.51 0.73 -0.14 2.19 4.64 -1.91 -1.66 113.55 117.91 1n1l h SER 133 Ca 0.56 0.08 0.05 0.00 -0.47 0.00 0.00 61.79 62.00 1n1l h SER 133 Cb 1.23 -0.05 -0.07 0.00 -0.31 0.00 0.00 62.40 63.20 1n1l h SER 133 CO -0.29 0.32 -0.36 0.22 -0.87 0.00 0.00 176.83 175.85 1n1l h TYR 134 N 0.78 -0.99 0.00 4.77 5.03 -1.66 -2.89 116.97 122.00 1n1l h TYR 134 Ca 0.51 0.04 0.00 0.00 2.58 0.00 0.00 58.73 61.86 1n1l h TYR 134 Cb 0.69 0.46 0.00 0.00 1.55 0.00 0.00 36.73 39.42 1n1l h TYR 134 CO -0.04 -0.43 0.00 1.28 -1.32 0.00 0.00 178.16 177.66 1n1l n LEU 135 N -5.42 0.00 -4.73 2.82 4.77 -0.66 -4.85 117.00 108.93 1n1l n LEU 135 Ca -0.03 0.27 -0.42 0.00 -0.03 0.00 0.00 56.01 55.79 1n1l n LEU 135 Cb 0.34 -0.27 -0.02 0.00 -2.33 0.00 0.00 43.42 41.14 1n1l n LEU 135 CO 0.14 -0.06 1.25 1.17 -1.33 0.00 0.00 177.39 178.56 1n1l n LYS 136 N -1.27 2.61 -0.98 3.23 4.81 -0.96 -1.29 118.16 124.31 1n1l n LYS 136 Ca 0.12 0.93 0.00 0.00 -0.87 0.00 0.00 58.31 58.49 1n1l n LYS 136 Cb 0.18 -2.72 0.00 0.00 0.02 0.00 0.00 35.03 32.51 1n1l n LYS 136 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1n1l n GLY 137 N 2.70 0.70 0.08 3.14 0.00 -1.26 -4.87 105.19 105.68 1n1l n GLY 137 Ca 0.11 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.25 1n1l n GLY 137 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1n1l n SER 138 N 0.00 0.70 -4.56 1.61 7.64 -0.41 -3.64 113.62 114.95 1n1l n SER 138 Ca 0.00 0.12 -0.51 0.00 1.01 0.00 0.00 58.87 59.50 1n1l n SER 138 Cb 0.00 0.58 -0.05 0.00 -1.01 0.00 0.00 64.21 63.73 1n1l n SER 138 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1n1l n SER 139 N -2.34 1.09 0.00 6.43 7.64 -1.26 -1.19 113.62 123.99 1n1l n SER 139 Ca 0.01 1.14 0.00 0.00 1.01 0.00 0.00 58.87 61.03 1n1l n SER 139 Cb 0.50 -1.16 0.00 0.00 -1.01 0.00 0.00 64.21 62.54 1n1l n SER 139 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1n1l n GLY 140 N 2.07 2.56 3.90 0.23 0.00 0.20 -1.40 105.19 112.75 1n1l n GLY 140 Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.90 1n1l n GLY 140 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1n1l s GLY 141 N -2.59 1.61 0.20 -0.02 0.00 -0.34 -3.57 107.32 102.61 1n1l s GLY 141 Ca 0.00 -0.54 -0.16 0.00 0.00 0.00 0.00 44.72 44.03 1n1l s GLY 141 CO 0.00 -0.12 0.63 2.56 0.00 0.00 0.00 173.10 176.17 1n1l s PRO 142 N -5.42 4.06 -0.25 2.90 0.04 -1.26 -0.47 135.00 134.60 1n1l s PRO 142 Ca 0.60 0.61 -0.12 0.00 0.04 0.00 0.00 61.00 62.14 1n1l s PRO 142 Cb -0.11 -2.84 -0.05 0.00 0.04 0.00 0.00 34.50 31.54 1n1l s PRO 142 CO 0.50 0.40 0.21 -0.51 0.04 0.00 0.00 177.00 177.64 1n1l s LEU 143 N -2.14 4.09 0.14 -3.56 1.02 0.48 -1.89 118.68 116.83 1n1l s LEU 143 Ca 0.42 0.15 0.05 0.00 0.02 0.00 0.00 54.13 54.77 1n1l s LEU 143 Cb -0.15 -2.18 -0.04 0.00 0.02 0.00 0.00 46.19 43.84 1n1l s LEU 143 CO 0.20 0.01 0.11 -0.76 0.02 0.00 0.00 176.35 175.92 1n1l s LEU 144 N 1.31 3.76 0.72 1.79 1.43 0.71 -0.53 118.68 127.87 1n1l s LEU 144 Ca 0.09 -0.12 -0.04 0.00 -1.03 0.00 0.00 54.13 53.03 1n1l s LEU 144 Cb -0.14 -2.39 0.10 0.00 0.03 0.00 0.00 46.19 43.79 1n1l s LEU 144 CO 0.07 0.10 1.01 0.00 0.23 0.00 0.00 176.35 177.75 1n1l h PRO 146 N -0.62 0.02 -0.01 0.00 0.11 -1.91 0.05 132.00 129.64 1n1l h PRO 146 Ca -0.41 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.70 1n1l h PRO 146 Cb 1.28 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 1n1l h PRO 146 CO 0.48 0.01 0.00 0.00 -0.21 0.00 0.00 178.00 178.28 1n1l n ALA 147 N -2.63 2.63 -1.52 -0.75 0.00 -1.26 -4.83 120.51 112.14 1n1l n ALA 147 Ca 0.09 -0.15 -0.02 0.00 0.00 0.00 0.00 53.44 53.36 1n1l n ALA 147 Cb 0.57 -1.35 -0.01 0.00 0.00 0.00 0.00 19.45 18.66 1n1l n ALA 147 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1n1l n GLY 148 N 0.86 0.42 3.80 0.00 0.00 0.00 -4.82 105.19 105.46 1n1l n GLY 148 Ca 0.17 -0.90 -0.24 0.00 0.00 0.00 0.00 46.02 45.04 1n1l n GLY 148 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1n1l s HIS 149 N -2.09 3.12 -0.04 1.61 3.76 -1.26 -4.74 115.29 115.65 1n1l s HIS 149 Ca 0.00 -0.06 -0.27 0.00 -0.15 0.00 0.00 55.06 54.58 1n1l s HIS 149 Cb 0.00 -1.46 -0.03 0.00 1.11 0.00 0.00 32.58 32.20 1n1l s HIS 149 CO 0.00 0.52 0.86 0.00 -0.85 0.00 0.00 174.74 175.27 1n1l s ALA 150 N -1.93 3.27 -0.16 -1.40 0.00 0.12 -1.59 121.76 120.08 1n1l s ALA 150 Ca 0.32 0.33 0.14 0.00 0.00 0.00 0.00 51.96 52.74 1n1l s ALA 150 Cb -0.09 -3.18 -0.20 0.00 0.00 0.00 0.00 23.12 19.65 1n1l s ALA 150 CO 0.24 -0.23 0.05 0.28 0.00 0.00 0.00 175.76 176.09 1n1l n VAL 151 N 3.95 1.11 0.00 0.00 0.31 0.31 -0.17 118.33 123.84 1n1l n VAL 151 Ca 0.03 -0.67 0.00 0.00 -0.01 0.00 0.00 64.34 63.69 1n1l n VAL 151 Cb 0.51 -0.60 0.00 0.00 -0.91 0.00 0.00 33.84 32.84 1n1l n VAL 151 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1n1l n GLY 152 N 2.03 -0.43 3.21 2.92 0.00 -1.14 -0.93 105.19 110.85 1n1l n GLY 152 Ca -0.27 -0.93 -0.32 0.00 0.00 0.00 0.00 46.02 44.50 1n1l n GLY 152 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1n1l s LEU 153 N 0.00 2.08 -0.03 0.99 1.43 -0.18 -0.39 118.68 122.59 1n1l s LEU 153 Ca 0.00 -0.56 -0.32 0.00 -1.03 0.00 0.00 54.13 52.22 1n1l s LEU 153 Cb 0.00 -1.40 -0.10 0.00 0.03 0.00 0.00 46.19 44.71 1n1l s LEU 153 CO 0.00 0.15 1.94 0.33 0.23 0.00 0.00 176.35 179.00 1n1l n PHE 154 N 3.60 2.42 -0.10 0.29 7.35 0.38 -0.71 117.46 130.70 1n1l n PHE 154 Ca -0.19 -0.21 -0.19 0.00 -0.76 0.00 0.00 57.45 56.11 1n1l n PHE 154 Cb 0.53 -2.74 -0.08 0.00 0.35 0.00 0.00 39.48 37.54 1n1l n PHE 154 CO 0.00 0.00 0.00 -2.13 -0.76 0.00 0.00 176.76 173.87 1n1l n ARG 155 N 7.16 0.44 -3.55 -4.13 0.63 -0.02 -0.62 116.66 116.56 1n1l n ARG 155 Ca 0.21 0.16 -0.15 0.00 -0.92 0.00 0.00 57.85 57.15 1n1l n ARG 155 Cb 0.36 -1.27 -0.06 0.00 0.45 0.00 0.00 32.46 31.94 1n1l n ARG 155 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1n1l s ALA 156 N -2.37 -1.48 -0.14 5.13 0.00 -0.64 -4.90 121.76 117.36 1n1l s ALA 156 Ca -0.27 0.85 -0.04 0.00 0.00 0.00 0.00 51.96 52.50 1n1l s ALA 156 Cb 0.09 0.25 -0.03 0.00 0.00 0.00 0.00 23.12 23.43 1n1l s ALA 156 CO 0.38 -0.46 0.01 0.00 0.00 0.00 0.00 175.76 175.70 1n1l s ALA 157 N -1.98 3.24 -0.60 0.00 0.00 -1.26 0.15 121.76 121.31 1n1l s ALA 157 Ca -0.08 -0.79 -0.24 0.00 0.00 0.00 0.00 51.96 50.86 1n1l s ALA 157 Cb -0.01 -1.65 0.05 0.00 0.00 0.00 0.00 23.12 21.51 1n1l s ALA 157 CO 0.02 0.33 0.97 0.08 0.00 0.00 0.00 175.76 177.16 1n1l s VAL 158 N -0.06 4.33 -0.07 0.00 1.01 0.25 -4.97 120.40 120.89 1n1l s VAL 158 Ca 0.04 0.08 0.03 0.00 0.00 0.00 0.00 61.98 62.13 1n1l s VAL 158 Cb -0.13 -4.61 -0.02 0.00 0.00 0.00 0.00 36.38 31.62 1n1l s VAL 158 CO 0.02 -1.27 -0.15 0.00 0.00 0.00 0.00 175.10 173.71 1n1l s THR 160 N -0.46 0.58 -1.34 0.00 2.01 -0.46 -4.79 115.64 111.18 1n1l s THR 160 Ca 0.06 -0.19 0.00 0.00 0.31 0.00 0.00 61.69 61.87 1n1l s THR 160 Cb -0.12 -0.81 0.00 0.00 0.01 0.00 0.00 72.50 71.58 1n1l s THR 160 CO 0.02 0.14 0.00 0.54 -0.69 0.00 0.00 174.62 174.62 1n1l n ARG 161 N 5.07 -1.15 -0.85 4.92 1.74 -1.26 -2.35 116.66 122.78 1n1l n ARG 161 Ca -0.09 0.79 0.00 0.00 -0.77 0.00 0.00 57.85 57.78 1n1l n ARG 161 Cb 0.49 -5.07 0.00 0.00 -1.02 0.00 0.00 32.46 26.86 1n1l n ARG 161 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1n1l n GLY 162 N -1.05 0.60 3.24 -0.13 0.00 -1.26 -5.05 105.19 101.54 1n1l n GLY 162 Ca -0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.53 1n1l n GLY 162 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1n1l s VAL 163 N -2.11 2.22 -0.17 1.61 1.01 -0.99 -1.59 120.40 120.39 1n1l s VAL 163 Ca 0.00 -0.96 -0.12 0.00 0.00 0.00 0.00 61.98 60.90 1n1l s VAL 163 Cb 0.00 -1.86 -0.05 0.00 0.00 0.00 0.00 36.38 34.47 1n1l s VAL 163 CO 0.00 0.55 0.24 -0.89 0.00 0.00 0.00 175.10 175.00 1n1l s THR 164 N 0.37 5.34 0.00 3.92 2.01 0.14 -1.35 115.64 126.06 1n1l s THR 164 Ca -0.17 0.43 0.00 0.00 0.31 0.00 0.00 61.69 62.26 1n1l s THR 164 Cb -0.18 -3.58 0.00 0.00 0.01 0.00 0.00 72.50 68.76 1n1l s THR 164 CO 0.08 0.42 0.00 2.29 -0.69 0.00 0.00 174.62 176.72 1n1l n LYS 165 N 3.43 5.59 -3.67 4.92 2.85 -1.18 -1.62 118.16 128.48 1n1l n LYS 165 Ca -0.14 0.00 -0.15 0.00 -1.05 0.00 0.00 58.31 56.97 1n1l n LYS 165 Cb 0.52 -0.43 -0.08 0.00 -0.65 0.00 0.00 35.03 34.39 1n1l n LYS 165 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1n1l s ALA 166 N -0.86 -1.15 0.04 0.58 0.00 -1.25 -0.27 121.76 118.85 1n1l s ALA 166 Ca 0.00 0.68 0.06 0.00 0.00 0.00 0.00 51.96 52.70 1n1l s ALA 166 Cb 0.00 0.06 -0.02 0.00 0.00 0.00 0.00 23.12 23.16 1n1l s ALA 166 CO 0.00 -0.31 -0.17 0.14 0.00 0.00 0.00 175.76 175.43 1n1l s VAL 167 N -1.31 1.32 -0.10 0.00 -7.23 -0.34 -0.58 120.40 112.15 1n1l s VAL 167 Ca -0.12 -1.06 -0.09 0.00 -1.81 0.00 0.00 61.98 58.89 1n1l s VAL 167 Cb -0.03 -1.17 -0.04 0.00 0.56 0.00 0.00 36.38 35.69 1n1l s VAL 167 CO 0.06 0.08 0.20 -1.81 -0.31 0.00 0.00 175.10 173.32 1n1l s ASP 168 N -1.14 6.47 0.11 4.85 1.01 0.12 -1.02 116.67 127.08 1n1l s ASP 168 Ca 0.04 0.57 0.03 0.00 0.71 0.00 0.00 52.55 53.90 1n1l s ASP 168 Cb -0.08 -2.11 -0.04 0.00 1.01 0.00 0.00 42.92 41.70 1n1l s ASP 168 CO 0.01 0.39 -0.09 0.72 0.21 0.00 0.00 175.17 176.41 1n1l s PHE 169 N -1.00 1.07 -0.33 4.23 -0.12 0.03 -0.84 117.98 121.02 1n1l s PHE 169 Ca 0.17 -0.76 -0.25 0.00 -0.05 0.00 0.00 56.93 56.04 1n1l s PHE 169 Cb -0.13 -0.58 0.01 0.00 -0.63 0.00 0.00 43.02 41.69 1n1l s PHE 169 CO 0.06 -0.02 0.88 0.42 -0.05 0.00 0.00 175.22 176.51 1n1l s ILE 170 N -3.04 4.68 0.49 -4.49 1.01 0.12 -4.65 121.20 115.32 1n1l s ILE 170 Ca 0.11 1.27 -0.23 0.00 0.00 0.00 0.00 60.65 61.80 1n1l s ILE 170 Cb 0.01 -4.25 -0.06 0.00 0.01 0.00 0.00 42.46 38.16 1n1l s ILE 170 CO -0.01 -0.39 1.25 -2.84 0.00 0.00 0.00 174.94 172.95 1n1l s PRO 171 N 3.24 3.51 0.40 2.79 0.02 -1.26 -1.01 135.00 142.69 1n1l s PRO 171 Ca 0.36 1.98 0.16 0.00 0.02 0.00 0.00 61.00 63.52 1n1l s PRO 171 Cb -0.13 -2.36 1.04 0.00 0.02 0.00 0.00 34.50 33.06 1n1l s PRO 171 CO 0.15 -0.81 1.82 -0.39 -0.33 0.00 0.00 177.00 177.44 1n1l h VAL 172 N 1.72 0.64 -0.30 3.83 -1.51 -1.34 -2.01 116.25 117.29 1n1l h VAL 172 Ca -0.50 -0.16 0.05 0.00 -1.23 0.00 0.00 66.70 64.86 1n1l h VAL 172 Cb 1.27 0.14 -0.05 0.00 -2.13 0.00 0.00 31.29 30.52 1n1l h VAL 172 CO 0.59 0.08 -0.01 -0.33 -1.23 0.00 0.00 177.57 176.68 1n1l h GLU 173 N 0.46 0.07 -0.05 5.19 3.07 -1.91 0.21 114.58 121.63 1n1l h GLU 173 Ca 0.52 -0.00 0.01 0.00 -0.50 0.00 0.00 59.36 59.39 1n1l h GLU 173 Cb 1.22 -0.02 -0.00 0.00 -0.84 0.00 0.00 28.75 29.12 1n1l h GLU 173 CO -0.24 0.05 0.20 -0.91 -1.40 0.00 0.00 179.01 176.71 1n1l h ASN 174 N 0.08 0.00 0.06 1.42 4.21 -1.73 0.12 115.58 119.73 1n1l h ASN 174 Ca 0.14 0.00 -0.00 0.00 1.21 0.00 0.00 56.30 57.65 1n1l h ASN 174 Cb 0.20 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.40 1n1l h ASN 174 CO -0.25 0.00 -0.03 -0.07 -1.29 0.00 0.00 177.43 175.79 1n1l h LEU 175 N 0.00 -0.06 -0.90 1.61 3.38 -0.59 -2.02 115.31 116.73 1n1l h LEU 175 Ca 0.02 -0.55 0.01 0.00 0.09 0.00 0.00 57.88 57.45 1n1l h LEU 175 Cb 0.42 0.02 -0.05 0.00 0.09 0.00 0.00 40.66 41.15 1n1l h LEU 175 CO -0.00 0.56 0.60 -0.33 0.09 0.00 0.00 178.44 179.36 1n1l h GLU 176 N -0.74 1.18 -0.69 1.13 5.08 -0.79 0.75 114.58 120.50 1n1l h GLU 176 Ca -0.01 -0.07 0.06 0.00 -1.00 0.00 0.00 59.36 58.34 1n1l h GLU 176 Cb 0.61 -0.27 -0.06 0.00 0.50 0.00 0.00 28.75 29.54 1n1l h GLU 176 CO 0.01 0.78 0.39 1.15 -1.00 0.00 0.00 179.01 180.34 1n1l h THR 177 N 1.21 0.97 -0.26 1.13 2.02 -0.83 -2.07 112.91 115.09 1n1l h THR 177 Ca 0.33 -0.24 -0.08 0.00 0.77 0.00 0.00 66.41 67.18 1n1l h THR 177 Cb -0.13 0.20 -0.01 0.00 -1.74 0.00 0.00 68.15 66.46 1n1l h THR 177 CO -0.07 0.13 -0.20 0.74 0.37 0.00 0.00 175.52 176.48 1n1l h THR 178 N 0.71 1.25 -0.10 3.16 2.02 -0.33 -1.94 112.91 117.68 1n1l h THR 178 Ca 0.31 -1.16 -0.04 0.00 0.77 0.00 0.00 66.41 66.28 1n1l h THR 178 Cb 0.19 1.28 -0.01 0.00 -1.74 0.00 0.00 68.15 67.86 1n1l h THR 178 CO -0.18 0.37 -0.14 0.24 0.37 0.00 0.00 175.52 176.18 1n1l h MET 179 N 0.42 0.16 -0.01 6.66 2.07 -0.27 -3.49 114.93 120.47 1n1l h MET 179 Ca 0.07 -0.03 0.00 0.00 -2.07 0.00 0.00 59.70 57.67 1n1l h MET 179 Cb 0.59 -0.02 0.00 0.00 -1.87 0.00 0.00 31.60 30.30 1n1l h MET 179 CO 0.04 0.30 0.00 0.54 1.07 0.00 0.00 176.91 178.86