#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2i76 n LEU 3 N 0.00 1.64 -4.45 7.52 4.77 -1.26 -3.46 117.00 121.76 2i76 n LEU 3 Ca 0.00 0.96 -0.34 0.00 -0.03 0.00 0.00 56.01 56.61 2i76 n LEU 3 Cb 0.00 -1.02 -0.13 0.00 -2.33 0.00 0.00 43.42 39.94 2i76 n LEU 3 CO 0.00 -0.67 -0.38 0.20 -1.33 0.00 0.00 177.39 175.21 2i76 s ASN 4 N 4.28 4.52 -0.14 -1.43 0.01 -0.16 -1.15 114.94 120.87 2i76 s ASN 4 Ca 1.06 -0.21 0.01 0.00 -0.71 0.00 0.00 52.86 53.01 2i76 s ASN 4 Cb -1.28 -1.73 -0.01 0.00 0.41 0.00 0.00 41.25 38.65 2i76 s ASN 4 CO 0.70 0.16 -0.16 -0.36 -1.51 0.00 0.00 177.10 175.93 2i76 s PHE 5 N 0.43 2.76 -1.80 2.20 0.40 -0.46 0.16 117.98 121.68 2i76 s PHE 5 Ca -0.06 -0.90 0.20 0.00 -0.60 0.00 0.00 56.93 55.58 2i76 s PHE 5 Cb -0.15 -1.85 0.55 0.00 0.51 0.00 0.00 43.02 42.08 2i76 s PHE 5 CO 0.04 -0.37 1.46 0.28 0.70 0.00 0.00 175.22 177.33 2i76 n VAL 6 N 3.80 0.94 -5.02 -0.44 0.31 0.30 -0.76 118.33 117.46 2i76 n VAL 6 Ca -0.19 -0.97 -0.28 0.00 -0.01 0.00 0.00 64.34 62.89 2i76 n VAL 6 Cb 0.52 0.55 -0.16 0.00 -0.91 0.00 0.00 33.84 33.84 2i76 n VAL 6 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 2i76 s GLY 7 N -1.04 1.09 -0.55 2.92 0.00 -1.17 -4.40 107.32 104.17 2i76 s GLY 7 Ca 0.43 -0.85 -0.12 0.00 0.00 0.00 0.00 44.72 44.17 2i76 s GLY 7 CO 0.29 -0.49 0.46 -1.59 0.00 0.00 0.00 173.10 171.77 2i76 s THR 8 N -0.06 4.76 0.00 0.90 2.01 -1.25 -4.71 115.64 117.28 2i76 s THR 8 Ca -0.03 -1.79 0.00 0.00 0.31 0.00 0.00 61.69 60.17 2i76 s THR 8 Cb -0.12 -4.07 0.00 0.00 0.01 0.00 0.00 72.50 68.31 2i76 s THR 8 CO 0.03 -0.85 0.00 0.61 -0.69 0.00 0.00 174.62 173.72 2i76 n GLY 9 N 4.89 3.37 2.89 4.40 0.00 -1.26 -5.09 105.19 114.40 2i76 n GLY 9 Ca -0.07 -0.33 -0.48 0.00 0.00 0.00 0.00 46.02 45.14 2i76 n GLY 9 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2i76 n THR 10 N -0.85 0.08 0.00 2.61 -1.04 -1.26 -2.99 114.28 110.84 2i76 n THR 10 Ca 0.00 -0.02 0.00 0.00 -2.04 0.00 0.00 64.05 61.99 2i76 n THR 10 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 2i76 n THR 10 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 2i76 n LEU 11 N 1.26 0.00 0.08 -4.42 7.94 -1.26 -4.74 117.00 115.86 2i76 n LEU 11 Ca 0.16 0.00 -0.15 0.00 -1.11 0.00 0.00 56.01 54.92 2i76 n LEU 11 Cb 0.07 0.00 -0.08 0.00 0.53 0.00 0.00 43.42 43.95 2i76 n LEU 11 CO 0.50 0.00 0.10 0.71 -1.11 0.00 0.00 177.39 177.59 2i76 h THR 12 N 0.00 1.42 -0.56 1.96 1.35 -1.82 -0.91 112.91 114.35 2i76 h THR 12 Ca 0.00 -2.63 0.04 0.00 -0.55 0.00 0.00 66.41 63.27 2i76 h THR 12 Cb 0.00 2.60 -0.03 0.00 -1.73 0.00 0.00 68.15 68.98 2i76 h THR 12 CO 0.00 0.78 0.37 0.03 -0.25 0.00 0.00 175.52 176.45 2i76 h ARG 13 N 0.19 0.61 0.57 4.72 3.08 -1.85 0.76 114.38 122.45 2i76 h ARG 13 Ca -0.10 -0.04 -0.03 0.00 0.07 0.00 0.00 59.98 59.88 2i76 h ARG 13 Cb 1.72 -0.14 0.01 0.00 0.08 0.00 0.00 29.97 31.64 2i76 h ARG 13 CO 0.18 0.40 -0.27 0.35 -1.07 0.00 0.00 179.97 179.56 2i76 h PHE 14 N 0.63 -0.71 -0.59 3.04 3.57 -1.78 -2.12 116.94 118.97 2i76 h PHE 14 Ca 0.23 -0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.75 2i76 h PHE 14 Cb 0.13 0.24 -0.04 0.00 2.79 0.00 0.00 35.95 39.06 2i76 h PHE 14 CO -0.00 -0.38 0.34 0.74 -2.23 0.00 0.00 178.31 176.77 2i76 h PHE 15 N -1.07 0.63 0.12 0.41 0.04 -0.58 -2.43 116.94 114.05 2i76 h PHE 15 Ca -0.08 0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.71 2i76 h PHE 15 Cb 0.65 -0.20 -0.02 0.00 2.20 0.00 0.00 35.95 38.58 2i76 h PHE 15 CO 0.01 0.33 -0.23 -0.07 -0.60 0.00 0.00 178.31 177.75 2i76 h LEU 16 N 0.65 -0.67 -0.88 1.54 3.38 0.49 0.22 115.31 120.04 2i76 h LEU 16 Ca 0.25 0.06 0.11 0.00 0.09 0.00 0.00 57.88 58.39 2i76 h LEU 16 Cb 0.09 0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 2i76 h LEU 16 CO -0.13 -0.27 0.90 -0.08 0.09 0.00 0.00 178.44 178.95 2i76 h GLU 17 N -0.38 0.00 0.00 1.13 4.57 -1.18 -2.10 114.58 116.62 2i76 h GLU 17 Ca -0.01 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.17 2i76 h GLU 17 Cb 0.36 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.95 2i76 h GLU 17 CO -0.09 0.00 0.00 0.00 -1.18 0.00 0.00 179.01 177.74 2i76 n LEU 19 N -1.41 0.99 -4.59 0.00 4.32 0.61 -5.10 117.00 111.82 2i76 n LEU 19 Ca 0.00 -0.46 -0.43 0.00 -0.02 0.00 0.00 56.01 55.10 2i76 n LEU 19 Cb 0.00 -0.20 -0.02 0.00 -1.62 0.00 0.00 43.42 41.58 2i76 n LEU 19 CO 0.00 0.18 1.37 -0.54 -1.22 0.00 0.00 177.39 177.18 2i76 s LYS 20 N 1.23 3.41 0.00 3.23 1.02 -0.81 -4.93 119.74 122.89 2i76 s LYS 20 Ca 0.00 1.06 0.00 0.00 0.02 0.00 0.00 55.97 57.05 2i76 s LYS 20 Cb 0.00 -4.12 0.00 0.00 -0.52 0.00 0.00 37.83 33.19 2i76 s LYS 20 CO 0.00 -1.77 0.00 -0.89 -0.92 0.00 0.00 175.35 171.77 2i76 n ILE 25 N 7.20 0.00 0.00 2.17 5.41 -1.26 -5.12 119.36 127.76 2i76 n ILE 25 Ca 0.19 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.94 2i76 n ILE 25 Cb 0.48 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.41 2i76 n ILE 25 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2i76 n GLY 26 N 0.00 0.61 3.89 7.39 0.00 -0.30 -4.70 105.19 112.08 2i76 n GLY 26 Ca 0.00 -0.03 -0.24 0.00 0.00 0.00 0.00 46.02 45.76 2i76 n GLY 26 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2i76 s TYR 27 N 0.00 3.30 -0.21 1.61 1.51 -1.26 -3.85 117.35 118.44 2i76 s TYR 27 Ca 0.00 -0.01 0.00 0.00 -1.01 0.00 0.00 57.07 56.05 2i76 s TYR 27 Cb 0.00 -1.54 0.05 0.00 -0.11 0.00 0.00 41.96 40.37 2i76 s TYR 27 CO 0.00 0.50 -0.05 0.42 -1.11 0.00 0.00 175.55 175.30 2i76 s ILE 28 N -1.91 1.41 0.05 2.71 1.01 -1.26 -1.36 121.20 121.86 2i76 s ILE 28 Ca 0.33 -1.04 0.03 0.00 0.00 0.00 0.00 60.65 59.97 2i76 s ILE 28 Cb -0.09 -1.64 -0.04 0.00 0.01 0.00 0.00 42.46 40.69 2i76 s ILE 28 CO 0.26 -0.03 0.01 -0.76 0.00 0.00 0.00 174.94 174.43 2i76 s LEU 29 N 1.47 3.52 0.01 2.97 1.02 0.06 -3.18 118.68 124.54 2i76 s LEU 29 Ca -0.04 -0.09 -0.22 0.00 0.02 0.00 0.00 54.13 53.81 2i76 s LEU 29 Cb -0.18 -2.15 0.05 0.00 0.02 0.00 0.00 46.19 43.93 2i76 s LEU 29 CO -0.07 0.22 0.48 -0.94 0.02 0.00 0.00 176.35 176.07 2i76 s SER 30 N -1.99 -0.40 0.00 2.29 1.04 -1.26 -3.05 113.70 110.33 2i76 s SER 30 Ca 0.23 0.26 0.00 0.00 0.48 0.00 0.00 55.95 56.92 2i76 s SER 30 Cb -0.12 0.44 0.00 0.00 0.10 0.00 0.00 66.02 66.45 2i76 s SER 30 CO 0.15 -0.61 0.30 -2.11 0.98 0.00 0.00 173.24 171.95 2i76 n ARG 31 N 0.78 0.00 -3.21 4.02 0.00 -1.26 -2.86 116.66 114.13 2i76 n ARG 31 Ca -0.19 0.00 -0.00 0.00 -0.00 0.00 0.00 57.85 57.65 2i76 n ARG 31 Cb 0.58 -1.30 -0.03 0.00 -0.00 0.00 0.00 32.46 31.71 2i76 n ARG 31 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.63 176.09 2i76 s SER 32 N -1.99 -0.85 0.41 2.89 1.04 -1.26 -4.89 113.70 109.04 2i76 s SER 32 Ca 0.00 0.53 0.24 0.00 0.48 0.00 0.00 55.95 57.19 2i76 s SER 32 Cb 0.00 1.79 1.28 0.00 0.10 0.00 0.00 66.02 69.19 2i76 s SER 32 CO 0.00 -0.28 1.66 0.16 0.98 0.00 0.00 173.24 175.76 2i76 h ILE 33 N 6.06 0.24 -0.95 -1.02 3.07 -1.98 -0.90 117.51 122.03 2i76 h ILE 33 Ca -0.18 -0.07 0.17 0.00 1.55 0.00 0.00 64.86 66.33 2i76 h ILE 33 Cb 1.16 0.03 -0.17 0.00 -0.27 0.00 0.00 36.82 37.57 2i76 h ILE 33 CO 0.25 0.04 -0.31 0.47 -1.05 0.00 0.00 178.15 177.55 2i76 n ASP 34 N -4.78 -0.48 0.07 2.16 8.00 -1.26 0.16 116.55 120.41 2i76 n ASP 34 Ca 0.33 1.65 -0.21 0.00 0.71 0.00 0.00 54.79 57.28 2i76 n ASP 34 Cb 1.20 -0.44 -0.11 0.00 -0.02 0.00 0.00 41.12 41.75 2i76 n ASP 34 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 2i76 h ARG 35 N 0.00 0.65 0.41 -1.24 3.08 -1.57 -2.16 114.38 113.55 2i76 h ARG 35 Ca 0.39 -0.77 -0.01 0.00 0.07 0.00 0.00 59.98 59.66 2i76 h ARG 35 Cb 0.63 0.24 -0.02 0.00 0.08 0.00 0.00 29.97 30.90 2i76 h ARG 35 CO -0.97 1.34 -0.45 0.00 -1.07 0.00 0.00 179.97 178.83 2i76 h ALA 36 N 0.37 -1.09 -0.08 0.04 0.00 -0.21 -2.29 119.26 116.00 2i76 h ALA 36 Ca -0.15 -0.16 0.03 0.00 0.00 0.00 0.00 54.91 54.62 2i76 h ALA 36 Cb 1.79 0.70 -0.06 0.00 0.00 0.00 0.00 17.79 20.22 2i76 h ALA 36 CO 0.22 -1.13 -0.54 0.00 0.00 0.00 0.00 179.25 177.80 2i76 h ARG 37 N -0.87 -0.59 -1.08 0.00 3.08 0.14 -1.63 114.38 113.43 2i76 h ARG 37 Ca -0.05 0.04 0.41 0.00 0.07 0.00 0.00 59.98 60.45 2i76 h ARG 37 Cb 0.76 0.13 -0.15 0.00 0.08 0.00 0.00 29.97 30.80 2i76 h ARG 37 CO -0.08 -0.39 0.65 -1.71 -1.07 0.00 0.00 179.97 177.37 2i76 n ASN 38 N -5.40 0.26 -0.03 7.04 2.85 -0.81 -0.83 115.26 118.33 2i76 n ASN 38 Ca -0.07 1.39 -0.19 0.00 -0.11 0.00 0.00 54.58 55.61 2i76 n ASN 38 Cb 0.38 -0.68 -0.13 0.00 1.24 0.00 0.00 39.78 40.59 2i76 n ASN 38 CO 0.00 0.00 0.00 -0.07 -2.11 0.00 0.00 177.26 175.08 2i76 h LEU 39 N 0.00 0.21 0.00 1.20 3.38 -0.75 -3.31 115.31 116.03 2i76 h LEU 39 Ca 0.79 -0.84 0.00 0.00 0.09 0.00 0.00 57.88 57.92 2i76 h LEU 39 Cb 2.31 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 43.00 2i76 h LEU 39 CO -0.57 1.38 0.00 0.00 0.09 0.00 0.00 178.44 179.34 2i76 n ALA 40 N -2.91 1.88 -0.39 1.53 0.00 -0.01 -0.26 120.51 120.34 2i76 n ALA 40 Ca -0.20 -0.04 0.05 0.00 0.00 0.00 0.00 53.44 53.25 2i76 n ALA 40 Cb 0.72 -1.10 0.13 0.00 0.00 0.00 0.00 19.45 19.20 2i76 n ALA 40 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2i76 n GLU 41 N -0.79 2.74 0.00 0.00 0.00 -0.53 -2.19 120.64 119.88 2i76 n GLU 41 Ca 0.05 -2.13 0.00 0.00 0.00 0.00 0.00 57.16 55.08 2i76 n GLU 41 Cb 0.02 -1.34 0.00 0.00 0.00 0.00 0.00 31.44 30.12 2i76 n GLU 41 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.13 177.41 2i76 n VAL 42 N -0.16 0.00 0.00 6.31 0.31 0.64 -4.83 118.33 120.59 2i76 n VAL 42 Ca 0.11 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.44 2i76 n VAL 42 Cb 0.50 -0.40 0.00 0.00 -0.91 0.00 0.00 33.84 33.03 2i76 n VAL 42 CO 0.00 0.00 0.00 -1.22 -1.32 0.00 0.00 176.83 174.29 2i76 n TYR 43 N -1.37 0.00 -0.03 3.52 4.02 -0.93 -5.08 117.16 117.29 2i76 n TYR 43 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.89 2i76 n TYR 43 Cb 0.24 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.56 2i76 n TYR 43 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2i76 n GLY 44 N 2.14 0.69 0.00 2.72 0.00 -0.93 -5.04 105.19 104.78 2i76 n GLY 44 Ca 0.00 -1.01 0.00 0.00 0.00 0.00 0.00 46.02 45.01 2i76 n GLY 44 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2i76 n GLY 45 N 2.90 -1.01 0.00 -0.02 0.00 -0.94 -4.75 105.19 101.37 2i76 n GLY 45 Ca 0.00 0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.14 2i76 n GLY 45 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2i76 n LYS 46 N 0.00 0.00 -3.20 1.61 4.01 -1.25 -4.92 118.16 114.42 2i76 n LYS 46 Ca 0.00 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.80 2i76 n LYS 46 Cb 0.00 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 34.52 2i76 n LYS 46 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2i76 n ALA 47 N -3.00 0.00 -0.68 7.82 0.00 -1.19 -3.90 120.51 119.56 2i76 n ALA 47 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2i76 n ALA 47 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2i76 n ALA 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2i76 n ALA 48 N 0.00 -2.75 1.88 0.00 0.00 -1.26 -4.51 120.51 113.87 2i76 n ALA 48 Ca 0.00 0.12 0.05 0.00 0.00 0.00 0.00 53.44 53.61 2i76 n ALA 48 Cb 0.00 -0.75 0.24 0.00 0.00 0.00 0.00 19.45 18.95 2i76 n ALA 48 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2i76 n THR 49 N 0.11 0.04 -2.59 0.00 -1.04 -1.13 -1.57 114.28 108.09 2i76 n THR 49 Ca 0.00 -0.05 -0.14 0.00 -2.04 0.00 0.00 64.05 61.82 2i76 n THR 49 Cb 0.00 -0.08 0.02 0.00 -1.82 0.00 0.00 70.33 68.46 2i76 n THR 49 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 2i76 n LEU 50 N -0.50 2.57 0.00 -4.42 4.77 -1.26 -5.03 117.00 113.13 2i76 n LEU 50 Ca 0.07 -4.14 0.00 0.00 -0.03 0.00 0.00 56.01 51.91 2i76 n LEU 50 Cb 0.06 0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.29 2i76 n LEU 50 CO 0.05 1.74 0.00 -1.84 -1.33 0.00 0.00 177.39 176.01 2i76 n GLU 51 N -0.26 0.88 0.00 3.23 0.00 -0.61 -5.13 120.64 118.75 2i76 n GLU 51 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.35 2i76 n GLU 51 Cb 0.78 0.00 0.00 0.00 0.00 0.00 0.00 31.44 32.22 2i76 n GLU 51 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 2i76 n LYS 52 N -0.38 3.09 -3.99 3.44 4.76 -1.26 -5.04 118.16 118.78 2i76 n LYS 52 Ca 0.00 0.00 -0.31 0.00 -2.87 0.00 0.00 58.31 55.13 2i76 n LYS 52 Cb 0.00 0.00 -0.15 0.00 -1.84 0.00 0.00 35.03 33.04 2i76 n LYS 52 CO 0.00 0.00 0.00 -1.58 -1.37 0.00 0.00 177.40 174.45 2i76 s HIS 53 N 0.00 2.85 0.44 2.13 5.65 -1.26 -5.03 115.29 120.08 2i76 s HIS 53 Ca 0.00 -2.11 0.04 0.00 0.25 0.00 0.00 55.06 53.24 2i76 s HIS 53 Cb 0.00 -1.87 0.01 0.00 -1.18 0.00 0.00 32.58 29.54 2i76 s HIS 53 CO 0.00 -0.84 0.62 -2.14 -0.65 0.00 0.00 174.74 171.73 2i76 s PRO 54 N 1.24 2.86 0.00 2.88 0.02 -1.26 -4.85 135.00 135.88 2i76 s PRO 54 Ca -0.04 -0.92 0.00 0.00 0.02 0.00 0.00 61.00 60.05 2i76 s PRO 54 Cb -0.19 -2.66 0.00 0.00 0.02 0.00 0.00 34.50 31.67 2i76 s PRO 54 CO -0.07 -0.32 0.00 -0.85 -0.33 0.00 0.00 177.00 175.44 2i76 n GLU 55 N -1.98 0.00 -1.30 5.54 0.00 -1.26 -3.58 120.64 118.06 2i76 n GLU 55 Ca 0.05 0.00 -0.47 0.00 0.00 0.00 0.00 57.16 56.74 2i76 n GLU 55 Cb 0.59 0.00 -0.04 0.00 0.00 0.00 0.00 31.44 31.99 2i76 n GLU 55 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.13 178.46 2i76 n VAL 59 N 0.00 1.23 -4.11 3.84 0.24 -1.26 -4.57 118.33 113.70 2i76 n VAL 59 Ca 0.00 -0.31 -0.28 0.00 -2.04 0.00 0.00 64.34 61.71 2i76 n VAL 59 Cb 0.00 0.00 -0.17 0.00 -1.47 0.00 0.00 33.84 32.20 2i76 n VAL 59 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 2i76 s VAL 60 N -0.62 1.32 -0.35 3.34 1.01 -0.81 -0.99 120.40 123.30 2i76 s VAL 60 Ca 0.66 -0.49 -0.16 0.00 0.00 0.00 0.00 61.98 61.98 2i76 s VAL 60 Cb -0.94 -1.26 -0.01 0.00 0.00 0.00 0.00 36.38 34.18 2i76 s VAL 60 CO 0.51 0.41 0.42 -0.36 0.00 0.00 0.00 175.10 176.08 2i76 s PHE 61 N 1.40 3.20 -1.14 5.22 0.08 0.44 -1.84 117.98 125.34 2i76 s PHE 61 Ca 0.01 0.02 -0.10 0.00 0.12 0.00 0.00 56.93 56.98 2i76 s PHE 61 Cb -0.13 -2.78 0.26 0.00 -0.57 0.00 0.00 43.02 39.79 2i76 s PHE 61 CO -0.07 -0.49 1.18 0.14 -0.10 0.00 0.00 175.22 175.88 2i76 s VAL 62 N 2.16 5.81 -1.24 -0.44 -7.23 -0.88 0.11 120.40 118.68 2i76 s VAL 62 Ca 0.14 -3.27 -0.09 0.00 -1.81 0.00 0.00 61.98 56.96 2i76 s VAL 62 Cb -0.16 -4.67 0.19 0.00 0.56 0.00 0.00 36.38 32.30 2i76 s VAL 62 CO 0.12 -1.28 1.78 -0.38 -0.31 0.00 0.00 175.10 175.04 2i76 n ILE 63 N 3.09 4.50 -4.29 -0.62 5.41 -1.26 -4.57 119.36 121.62 2i76 n ILE 63 Ca 0.27 -4.66 -0.16 0.00 1.00 0.00 0.00 62.75 59.20 2i76 n ILE 63 Cb 0.40 -2.32 -0.10 0.00 -0.71 0.00 0.00 39.64 36.90 2i76 n ILE 63 CO 0.00 0.00 0.00 0.68 0.00 0.00 0.00 176.55 177.23 2i76 s VAL 64 N -0.05 0.97 0.36 1.39 -7.23 -1.26 -4.25 120.40 110.33 2i76 s VAL 64 Ca 0.38 -2.03 -0.19 0.00 -1.81 0.00 0.00 61.98 58.33 2i76 s VAL 64 Cb 0.08 -2.20 -0.14 0.00 0.56 0.00 0.00 36.38 34.68 2i76 s VAL 64 CO 0.02 -0.43 0.09 -2.65 -0.31 0.00 0.00 175.10 171.81 2i76 n PRO 65 N -0.34 0.00 0.06 4.82 -0.02 -1.26 -4.36 135.00 133.90 2i76 n PRO 65 Ca -0.06 0.00 -0.16 0.00 -2.02 0.00 0.00 63.50 61.26 2i76 n PRO 65 Cb 0.63 -0.91 -0.10 0.00 -0.02 0.00 0.00 33.50 33.10 2i76 n PRO 65 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 2i76 h ASP 66 N 0.31 -1.66 0.00 2.55 3.32 -1.99 -1.14 116.42 117.80 2i76 h ASP 66 Ca -0.33 0.18 0.00 0.00 0.02 0.00 0.00 57.03 56.90 2i76 h ASP 66 Cb 1.32 0.63 0.00 0.00 0.22 0.00 0.00 39.33 41.50 2i76 h ASP 66 CO 0.43 -0.53 0.20 -2.11 -1.72 0.00 0.00 179.24 175.51 2i76 n ARG 67 N -5.45 0.03 -0.12 3.56 1.85 -1.26 -2.09 116.66 113.19 2i76 n ARG 67 Ca -0.07 0.42 -0.23 0.00 -1.00 0.00 0.00 57.85 56.97 2i76 n ARG 67 Cb 0.40 -1.81 -0.08 0.00 -1.05 0.00 0.00 32.46 29.92 2i76 n ARG 67 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 177.63 178.28 2i76 n TYR 68 N -1.59 0.00 0.00 2.89 0.53 -0.54 -4.69 117.16 113.76 2i76 n TYR 68 Ca -0.00 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.88 2i76 n TYR 68 Cb 0.21 -0.80 0.00 0.00 -1.03 0.00 0.00 39.34 37.71 2i76 n TYR 68 CO 0.00 0.00 0.00 -0.89 -1.02 0.00 0.00 176.86 174.95 2i76 n ILE 69 N -4.20 0.00 0.44 -0.72 5.41 -0.57 0.99 119.36 120.71 2i76 n ILE 69 Ca -0.41 0.00 -0.18 0.00 1.00 0.00 0.00 62.75 63.16 2i76 n ILE 69 Cb 0.76 0.00 -0.08 0.00 -0.71 0.00 0.00 39.64 39.61 2i76 n ILE 69 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 176.55 177.05 2i76 h LYS 70 N 0.00 -1.10 0.15 0.38 3.11 -1.84 -3.07 116.57 114.19 2i76 h LYS 70 Ca 0.00 0.08 0.01 0.00 -2.81 0.00 0.00 60.65 57.93 2i76 h LYS 70 Cb 0.00 0.25 -0.05 0.00 -1.00 0.00 0.00 32.23 31.43 2i76 h LYS 70 CO 0.00 -0.73 -0.53 1.15 -2.81 0.00 0.00 179.45 176.52 2i76 h THR 71 N -1.25 0.00 -0.98 1.00 2.02 0.36 -2.40 112.91 111.65 2i76 h THR 71 Ca -0.12 0.00 0.34 0.00 0.77 0.00 0.00 66.41 67.40 2i76 h THR 71 Cb 0.88 0.00 -0.17 0.00 -1.74 0.00 0.00 68.15 67.12 2i76 h THR 71 CO 0.19 0.00 0.41 1.62 0.37 0.00 0.00 175.52 178.12 2i76 h VAL 72 N -0.78 0.14 0.43 3.16 3.04 -1.50 -1.95 116.25 118.79 2i76 h VAL 72 Ca -0.01 -0.04 -0.02 0.00 -1.01 0.00 0.00 66.70 65.62 2i76 h VAL 72 Cb 0.77 -0.00 0.00 0.00 -2.01 0.00 0.00 31.29 30.05 2i76 h VAL 72 CO -0.28 0.02 -0.21 0.00 -1.01 0.00 0.00 177.57 176.10 2i76 h ALA 73 N 1.92 -0.85 0.00 3.17 0.00 -1.34 -3.23 119.26 118.93 2i76 h ALA 73 Ca 0.73 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 55.46 2i76 h ALA 73 Cb 1.74 0.22 -0.02 0.00 0.00 0.00 0.00 17.79 19.74 2i76 h ALA 73 CO -0.73 -0.81 0.36 0.09 0.00 0.00 0.00 179.25 178.16 2i76 n ASN 74 N -4.08 1.33 0.00 0.00 4.13 -0.73 -1.09 115.26 114.82 2i76 n ASN 74 Ca -0.07 -1.76 0.00 0.00 1.68 0.00 0.00 54.58 54.43 2i76 n ASN 74 Cb 0.23 -0.37 0.00 0.00 -1.54 0.00 0.00 39.78 38.10 2i76 n ASN 74 CO 0.00 0.00 0.00 1.57 0.28 0.00 0.00 177.26 179.11 2i76 n HIS 75 N 2.97 0.00 -0.09 3.10 -0.00 -1.22 -4.86 115.22 115.12 2i76 n HIS 75 Ca 0.11 0.00 -0.13 0.00 0.46 0.00 0.00 57.72 58.16 2i76 n HIS 75 Cb 0.22 0.00 -0.14 0.00 -0.12 0.00 0.00 29.99 29.94 2i76 n HIS 75 CO 0.00 0.00 0.00 1.28 0.46 0.00 0.00 176.34 178.08 2i76 n LEU 76 N 0.00 1.23 -1.98 0.27 4.77 -0.25 -5.00 117.00 116.05 2i76 n LEU 76 Ca 0.00 0.03 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 2i76 n LEU 76 Cb 0.00 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 40.99 2i76 n LEU 76 CO 0.00 0.65 0.00 -0.46 -1.33 0.00 0.00 177.39 176.25 2i76 n ASN 77 N -3.00 0.00 -3.82 -1.43 0.23 -1.15 -4.90 115.26 101.20 2i76 n ASN 77 Ca -0.35 0.00 -0.10 0.00 -0.53 0.00 0.00 54.58 53.60 2i76 n ASN 77 Cb 1.09 0.00 -0.08 0.00 -2.08 0.00 0.00 39.78 38.71 2i76 n ASN 77 CO 0.00 0.00 0.00 -1.48 -0.93 0.00 0.00 177.26 174.85 2i76 s LEU 78 N -2.32 1.22 0.10 -4.53 2.34 -1.26 -5.10 118.68 109.13 2i76 s LEU 78 Ca 0.00 -0.42 0.00 0.00 0.06 0.00 0.00 54.13 53.77 2i76 s LEU 78 Cb 0.00 1.12 0.00 0.00 -0.56 0.00 0.00 46.19 46.75 2i76 s LEU 78 CO 0.00 -0.64 0.00 0.61 -1.06 0.00 0.00 176.35 175.26 2i76 n GLY 79 N 0.37 -3.02 3.52 -3.48 0.00 -1.23 -4.29 105.19 97.05 2i76 n GLY 79 Ca -0.17 -0.08 -0.38 0.00 0.00 0.00 0.00 46.02 45.39 2i76 n GLY 79 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2i76 n ASP 80 N 1.80 1.06 -2.72 1.61 -0.08 -1.26 -4.14 116.55 112.82 2i76 n ASP 80 Ca 0.00 -0.14 -0.13 0.00 -1.51 0.00 0.00 54.79 53.02 2i76 n ASP 80 Cb 0.00 -1.18 -0.03 0.00 2.34 0.00 0.00 41.12 42.24 2i76 n ASP 80 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2i76 n ALA 81 N 12.66 0.27 -3.82 -1.67 0.00 -1.26 -4.57 120.51 122.11 2i76 n ALA 81 Ca 0.54 -1.02 -0.34 0.00 0.00 0.00 0.00 53.44 52.62 2i76 n ALA 81 Cb 0.24 0.67 -0.14 0.00 0.00 0.00 0.00 19.45 20.22 2i76 n ALA 81 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2i76 s VAL 82 N -2.24 2.71 0.14 0.00 1.01 -1.26 -4.85 120.40 115.91 2i76 s VAL 82 Ca 0.09 -1.63 -0.31 0.00 0.00 0.00 0.00 61.98 60.12 2i76 s VAL 82 Cb 0.00 -2.64 -0.09 0.00 0.00 0.00 0.00 36.38 33.65 2i76 s VAL 82 CO 0.06 -0.20 1.51 -0.76 0.00 0.00 0.00 175.10 175.71 2i76 s LEU 83 N 1.16 4.37 0.06 3.92 1.02 -0.60 -1.92 118.68 126.69 2i76 s LEU 83 Ca -0.03 2.51 -0.07 0.00 0.02 0.00 0.00 54.13 56.55 2i76 s LEU 83 Cb -0.20 -3.59 -0.01 0.00 0.02 0.00 0.00 46.19 42.41 2i76 s LEU 83 CO -0.03 -0.77 0.15 0.54 0.02 0.00 0.00 176.35 176.26 2i76 s VAL 84 N 1.17 0.14 0.13 -1.59 0.11 -0.77 -0.28 120.40 119.31 2i76 s VAL 84 Ca 0.68 -1.15 -0.15 0.00 -2.93 0.00 0.00 61.98 58.43 2i76 s VAL 84 Cb -0.41 -1.16 0.03 0.00 -1.53 0.00 0.00 36.38 33.30 2i76 s VAL 84 CO 0.31 -0.64 0.38 -1.38 -3.33 0.00 0.00 175.10 170.44 2i76 s HIS 85 N -3.28 -0.10 -2.27 1.54 -3.43 -1.19 -2.07 115.29 104.48 2i76 s HIS 85 Ca 0.01 -0.24 0.22 0.00 -0.80 0.00 0.00 55.06 54.25 2i76 s HIS 85 Cb 0.02 0.21 0.53 0.00 -1.43 0.00 0.00 32.58 31.91 2i76 s HIS 85 CO -0.08 -0.71 1.46 0.00 -2.00 0.00 0.00 174.74 173.42 2i76 s SER 87 N -1.29 6.97 0.00 0.00 0.15 -1.26 -4.27 113.70 113.99 2i76 s SER 87 Ca 0.42 1.93 0.29 0.00 0.70 0.00 0.00 55.95 59.29 2i76 s SER 87 Cb 0.23 -2.56 1.26 0.00 -1.71 0.00 0.00 66.02 63.25 2i76 s SER 87 CO 0.32 -0.64 1.88 0.61 1.20 0.00 0.00 173.24 176.61 2i76 n GLY 88 N 3.48 -1.02 0.10 9.45 0.00 -1.26 -3.72 105.19 112.21 2i76 n GLY 88 Ca 0.12 -0.24 -0.10 0.00 0.00 0.00 0.00 46.02 45.79 2i76 n GLY 88 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2i76 n PHE 89 N -1.04 0.44 -4.06 1.61 7.35 -1.26 -4.27 117.46 116.22 2i76 n PHE 89 Ca 0.14 0.15 -0.29 0.00 -0.76 0.00 0.00 57.45 56.69 2i76 n PHE 89 Cb 0.27 -1.08 -0.06 0.00 0.35 0.00 0.00 39.48 38.96 2i76 n PHE 89 CO 0.00 0.00 0.00 -0.51 -0.76 0.00 0.00 176.76 175.49 2i76 s LEU 90 N -5.84 3.77 0.00 -2.13 1.43 -1.24 -4.49 118.68 110.17 2i76 s LEU 90 Ca -0.10 -0.05 -0.05 0.00 -1.03 0.00 0.00 54.13 52.90 2i76 s LEU 90 Cb 0.07 -2.44 0.13 0.00 0.03 0.00 0.00 46.19 43.97 2i76 s LEU 90 CO 0.81 0.15 0.81 -1.20 0.23 0.00 0.00 176.35 177.15 2i76 n SER 91 N 0.26 0.63 0.06 2.29 7.64 -1.26 -4.79 113.62 118.45 2i76 n SER 91 Ca -0.09 -1.64 -0.03 0.00 1.01 0.00 0.00 58.87 58.13 2i76 n SER 91 Cb 0.52 -0.56 -0.07 0.00 -1.01 0.00 0.00 64.21 63.08 2i76 n SER 91 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 2i76 h SER 92 N -0.74 0.00 0.00 6.43 4.64 -1.89 -3.31 113.55 118.68 2i76 h SER 92 Ca -0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.06 2i76 h SER 92 Cb 0.87 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.96 2i76 h SER 92 CO 0.24 0.74 0.05 -0.62 -0.87 0.00 0.00 176.83 176.37 2i76 n GLU 93 N -3.11 0.00 -0.03 4.77 1.02 -1.26 -0.58 120.64 121.44 2i76 n GLU 93 Ca -0.06 0.07 -0.16 0.00 -0.02 0.00 0.00 57.16 56.99 2i76 n GLU 93 Cb 0.88 -1.55 -0.08 0.00 -0.02 0.00 0.00 31.44 30.67 2i76 n GLU 93 CO 0.00 0.00 0.00 -0.84 1.18 0.00 0.00 177.13 177.47 2i76 h ILE 94 N 0.00 1.34 -0.82 -3.67 3.07 -1.98 -3.10 117.51 112.36 2i76 h ILE 94 Ca 0.00 -1.84 0.10 0.00 1.55 0.00 0.00 64.86 64.66 2i76 h ILE 94 Cb 0.09 2.13 -0.07 0.00 -0.27 0.00 0.00 36.82 38.70 2i76 h ILE 94 CO 0.00 0.56 0.46 -0.26 -1.05 0.00 0.00 178.15 177.86 2i76 h PHE 95 N 0.22 0.84 -5.21 0.16 0.05 -1.15 -3.47 116.94 108.38 2i76 h PHE 95 Ca -0.04 0.03 -0.14 0.00 3.82 0.00 0.00 57.97 61.64 2i76 h PHE 95 Cb 1.19 -0.25 0.11 0.00 2.00 0.00 0.00 35.95 39.00 2i76 h PHE 95 CO 0.11 0.33 -0.49 1.63 -0.18 0.00 0.00 178.31 179.71 2i76 n LYS 96 N -4.76 -1.73 -3.42 1.51 5.02 -1.17 -5.00 118.16 108.61 2i76 n LYS 96 Ca 0.14 1.03 -0.03 0.00 -2.02 0.00 0.00 58.31 57.43 2i76 n LYS 96 Cb 0.29 -5.44 0.02 0.00 -0.02 0.00 0.00 35.03 29.87 2i76 n LYS 96 CO 0.00 0.00 0.00 0.36 -0.52 0.00 0.00 177.40 177.24 2i76 n LYS 97 N -2.56 0.55 -1.20 1.97 -0.00 -1.26 -5.16 118.16 110.50 2i76 n LYS 97 Ca -0.04 -1.24 -0.35 0.00 -0.00 0.00 0.00 58.31 56.68 2i76 n LYS 97 Cb 0.57 1.67 0.10 0.00 -0.00 0.00 0.00 35.03 37.37 2i76 n LYS 97 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 2i76 n SER 98 N -1.18 -0.14 -1.63 -5.58 2.88 -1.26 -4.33 113.62 102.38 2i76 n SER 98 Ca -0.02 0.59 0.00 0.00 -1.33 0.00 0.00 58.87 58.11 2i76 n SER 98 Cb 0.48 -1.36 0.00 0.00 -0.75 0.00 0.00 64.21 62.58 2i76 n SER 98 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2i76 n GLY 99 N 1.15 0.00 3.19 0.46 0.00 -1.26 -4.47 105.19 104.27 2i76 n GLY 99 Ca 0.12 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.85 2i76 n GLY 99 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2i76 s ARG 100 N -0.38 2.30 0.27 1.61 1.70 -1.26 -1.56 118.95 121.63 2i76 s ARG 100 Ca 0.00 -0.75 0.02 0.00 -0.47 0.00 0.00 55.73 54.53 2i76 s ARG 100 Cb 0.00 -1.91 -0.04 0.00 -0.57 0.00 0.00 34.95 32.44 2i76 s ARG 100 CO 0.00 0.26 0.16 0.00 -1.08 0.00 0.00 175.30 174.64 2i76 s ALA 101 N 0.07 1.65 -0.20 7.88 0.00 0.61 -2.36 121.76 129.42 2i76 s ALA 101 Ca -0.07 -1.80 -0.06 0.00 0.00 0.00 0.00 51.96 50.03 2i76 s ALA 101 Cb -0.14 1.27 0.10 0.00 0.00 0.00 0.00 23.12 24.35 2i76 s ALA 101 CO 0.04 -0.55 0.38 0.45 0.00 0.00 0.00 175.76 176.08 2i76 s SER 102 N -3.29 -0.02 -0.33 0.00 0.15 -0.42 -3.14 113.70 106.65 2i76 s SER 102 Ca 0.38 0.74 0.04 0.00 0.70 0.00 0.00 55.95 57.80 2i76 s SER 102 Cb 0.06 1.18 0.09 0.00 -1.71 0.00 0.00 66.02 65.64 2i76 s SER 102 CO 0.17 -0.25 0.03 -0.51 1.20 0.00 0.00 173.24 173.88 2i76 s ILE 103 N 2.56 2.21 -0.33 6.45 2.07 0.09 -3.02 121.20 131.23 2i76 s ILE 103 Ca 0.02 -2.21 -0.17 0.00 -1.41 0.00 0.00 60.65 56.89 2i76 s ILE 103 Cb -0.13 -2.59 -0.01 0.00 0.13 0.00 0.00 42.46 39.86 2i76 s ILE 103 CO -0.13 -0.52 0.45 -2.28 -1.91 0.00 0.00 174.94 170.55 2i76 s HIS 104 N 0.96 3.21 -0.82 3.50 5.65 -0.56 -4.19 115.29 123.04 2i76 s HIS 104 Ca 0.08 0.20 -0.21 0.00 0.25 0.00 0.00 55.06 55.38 2i76 s HIS 104 Cb -0.19 -2.77 0.09 0.00 -1.18 0.00 0.00 32.58 28.53 2i76 s HIS 104 CO -0.08 -0.43 1.09 -1.25 -0.65 0.00 0.00 174.74 173.42 2i76 s PRO 105 N 2.22 3.37 -0.91 2.88 0.04 -1.26 -1.13 135.00 140.21 2i76 s PRO 105 Ca 0.16 -1.26 -0.25 0.00 0.04 0.00 0.00 61.00 59.70 2i76 s PRO 105 Cb -0.16 -4.64 -0.19 0.00 0.04 0.00 0.00 34.50 29.55 2i76 s PRO 105 CO 0.12 -1.84 2.20 0.09 0.04 0.00 0.00 177.00 177.60 2i76 n ASN 106 N 7.35 1.27 -3.57 6.66 5.03 -0.95 -4.71 115.26 126.35 2i76 n ASN 106 Ca 0.12 -1.96 -0.05 0.00 0.87 0.00 0.00 54.58 53.56 2i76 n ASN 106 Cb 0.48 -1.61 -0.02 0.00 -1.02 0.00 0.00 39.78 37.60 2i76 n ASN 106 CO 0.00 0.00 0.00 0.12 -1.83 0.00 0.00 177.26 175.55 2i76 s PHE 107 N 15.02 -0.19 -0.17 3.10 5.36 -1.26 -4.53 117.98 135.31 2i76 s PHE 107 Ca 0.85 0.11 -0.04 0.00 -0.96 0.00 0.00 56.93 56.89 2i76 s PHE 107 Cb -0.11 0.52 -0.03 0.00 -0.34 0.00 0.00 43.02 43.07 2i76 s PHE 107 CO 0.15 -0.31 -0.02 0.45 -1.46 0.00 0.00 175.22 174.03 2i76 s SER 108 N -2.29 4.82 -0.18 6.13 0.15 -1.26 -5.14 113.70 115.93 2i76 s SER 108 Ca 0.08 -0.15 -0.01 0.00 0.70 0.00 0.00 55.95 56.57 2i76 s SER 108 Cb -0.01 -1.80 -0.00 0.00 -1.71 0.00 0.00 66.02 62.50 2i76 s SER 108 CO -0.06 0.13 -0.12 -0.36 1.20 0.00 0.00 173.24 174.04 2i76 s PHE 109 N 0.58 2.86 0.00 3.44 0.40 -1.26 -4.84 117.98 119.15 2i76 s PHE 109 Ca -0.02 -1.09 0.00 0.00 -0.60 0.00 0.00 56.93 55.22 2i76 s PHE 109 Cb -0.14 -1.98 0.00 0.00 0.51 0.00 0.00 43.02 41.41 2i76 s PHE 109 CO 0.02 -0.55 0.00 -0.11 0.70 0.00 0.00 175.22 175.28 2i76 n LEU 112 N 4.43 0.00 0.23 -0.37 7.94 -1.26 -5.08 117.00 122.89 2i76 n LEU 112 Ca -0.19 0.00 0.14 0.00 -1.11 0.00 0.00 56.01 54.85 2i76 n LEU 112 Cb 0.51 0.00 0.75 0.00 0.53 0.00 0.00 43.42 45.21 2i76 n LEU 112 CO 0.28 0.00 0.96 -0.08 -1.11 0.00 0.00 177.39 177.44 2i76 h GLU 113 N 0.00 0.00 0.05 1.96 4.81 -1.99 -1.57 114.58 117.84 2i76 h GLU 113 Ca 0.00 0.00 -0.11 0.00 -0.13 0.00 0.00 59.36 59.12 2i76 h GLU 113 Cb 0.00 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.39 2i76 h GLU 113 CO 0.00 0.00 -0.46 -0.22 -0.73 0.00 0.00 179.01 177.60 2i76 h LYS 114 N 0.00 0.23 0.00 1.92 1.63 -1.99 -3.30 116.57 115.05 2i76 h LYS 114 Ca 0.00 -0.31 -0.02 0.00 -0.85 0.00 0.00 60.65 59.48 2i76 h LYS 114 Cb 0.20 0.10 -0.00 0.00 -0.60 0.00 0.00 32.23 31.93 2i76 h LYS 114 CO 0.00 1.08 -0.08 0.00 -3.45 0.00 0.00 179.45 176.99 2i76 h ALA 115 N 0.17 1.28 -0.06 5.00 0.00 -1.70 -1.06 119.26 122.88 2i76 h ALA 115 Ca -0.07 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2i76 h ALA 115 Cb 1.27 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.05 2i76 h ALA 115 CO 0.09 0.10 0.00 1.47 0.00 0.00 0.00 179.25 180.91 2i76 n LEU 116 N -3.59 0.66 -3.61 0.00 -0.00 -1.11 -4.83 117.00 104.53 2i76 n LEU 116 Ca -0.02 -0.27 -0.41 0.00 -0.00 0.00 0.00 56.01 55.31 2i76 n LEU 116 Cb 0.20 -0.04 -0.04 0.00 -0.00 0.00 0.00 43.42 43.54 2i76 n LEU 116 CO 0.28 0.14 2.31 -0.62 -0.00 0.00 0.00 177.39 179.50 2i76 n GLU 117 N -0.36 1.93 0.00 1.47 -0.58 -0.41 -4.95 120.64 117.75 2i76 n GLU 117 Ca 0.16 -2.02 0.00 0.00 -0.42 0.00 0.00 57.16 54.88 2i76 n GLU 117 Cb 0.17 -2.98 0.00 0.00 -0.57 0.00 0.00 31.44 28.07 2i76 n GLU 117 CO 0.00 0.00 0.00 0.36 -0.48 0.00 0.00 177.13 177.01 2i76 n LYS 119 N 6.50 0.00 0.00 3.49 0.00 -1.26 -5.07 118.16 121.81 2i76 n LYS 119 Ca 0.50 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.81 2i76 n LYS 119 Cb 0.38 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.41 2i76 n LYS 119 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.40 177.00 2i76 n ASP 120 N 0.00 0.00 -0.01 -5.58 5.75 -1.25 0.14 116.55 115.60 2i76 n ASP 120 Ca 0.00 0.17 0.07 0.00 -0.01 0.00 0.00 54.79 55.02 2i76 n ASP 120 Cb 0.00 -0.17 -0.15 0.00 -1.03 0.00 0.00 41.12 39.78 2i76 n ASP 120 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2i76 n GLN 121 N -1.10 0.66 -2.35 0.11 6.02 -1.26 -4.21 117.38 115.25 2i76 n GLN 121 Ca 0.00 -0.11 -0.42 0.00 -0.01 0.00 0.00 57.00 56.46 2i76 n GLN 121 Cb 0.19 -1.57 -0.03 0.00 1.02 0.00 0.00 30.24 29.85 2i76 n GLN 121 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 2i76 s ILE 122 N -3.31 3.76 0.06 5.09 1.01 0.37 -5.05 121.20 123.14 2i76 s ILE 122 Ca -0.07 1.31 0.00 0.00 0.00 0.00 0.00 60.65 61.89 2i76 s ILE 122 Cb 0.12 -3.84 -0.04 0.00 0.01 0.00 0.00 42.46 38.71 2i76 s ILE 122 CO 0.88 0.13 0.19 -0.69 0.00 0.00 0.00 174.94 175.45 2i76 s VAL 123 N 0.80 5.29 -0.00 2.92 1.01 -1.26 -4.68 120.40 124.47 2i76 s VAL 123 Ca 0.59 -0.41 0.08 0.00 0.00 0.00 0.00 61.98 62.23 2i76 s VAL 123 Cb -0.32 -3.57 -0.02 0.00 0.00 0.00 0.00 36.38 32.47 2i76 s VAL 123 CO 0.31 0.15 -0.23 -0.36 0.00 0.00 0.00 175.10 174.97 2i76 s PHE 124 N -1.48 2.41 -0.37 5.22 0.40 -1.23 -2.23 117.98 120.70 2i76 s PHE 124 Ca 0.34 -0.37 -0.15 0.00 -0.60 0.00 0.00 56.93 56.15 2i76 s PHE 124 Cb -0.13 -1.49 -0.00 0.00 0.51 0.00 0.00 43.02 41.91 2i76 s PHE 124 CO 0.27 0.07 0.34 0.20 0.70 0.00 0.00 175.22 176.79 2i76 s GLY 125 N -0.87 1.93 -0.00 4.36 0.00 -0.29 0.24 107.32 112.69 2i76 s GLY 125 Ca 0.11 -1.40 0.05 0.00 0.00 0.00 0.00 44.72 43.48 2i76 s GLY 125 CO 0.01 0.97 -0.16 1.08 0.00 0.00 0.00 173.10 174.99 2i76 s LEU 126 N 1.92 2.67 -0.05 0.66 1.43 0.33 -1.50 118.68 124.13 2i76 s LEU 126 Ca 0.09 -0.31 -0.30 0.00 -1.03 0.00 0.00 54.13 52.58 2i76 s LEU 126 Cb -0.17 -1.55 0.08 0.00 0.03 0.00 0.00 46.19 44.57 2i76 s LEU 126 CO 0.12 0.30 0.71 -1.83 0.23 0.00 0.00 176.35 175.87 2i76 s GLU 127 N -1.10 1.02 0.00 1.70 4.04 -1.17 -2.12 118.70 121.08 2i76 s GLU 127 Ca 0.13 0.20 0.00 0.00 0.04 0.00 0.00 54.97 55.34 2i76 s GLU 127 Cb -0.11 0.48 0.00 0.00 0.02 0.00 0.00 34.13 34.53 2i76 s GLU 127 CO 0.03 -0.33 0.00 0.41 -1.84 0.00 0.00 175.26 173.53 2i76 n GLY 128 N 0.80 1.55 0.00 -3.83 0.00 -1.26 -1.29 105.19 101.15 2i76 n GLY 128 Ca -0.18 0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.89 2i76 n GLY 128 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2i76 n ASP 129 N 0.00 0.00 0.00 1.61 5.75 -0.99 -4.77 116.55 118.14 2i76 n ASP 129 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.78 2i76 n ASP 129 Cb 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.09 2i76 n ASP 129 CO 0.00 0.00 0.00 -1.84 -0.11 0.00 0.00 177.20 175.25 2i76 n GLU 130 N 0.00 0.00 0.10 0.11 -0.00 -1.26 -2.56 120.64 117.02 2i76 n GLU 130 Ca 0.00 0.42 -0.05 0.00 -0.00 0.00 0.00 57.16 57.53 2i76 n GLU 130 Cb 0.00 -0.87 0.03 0.00 -0.00 0.00 0.00 31.44 30.60 2i76 n GLU 130 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2i76 h ARG 131 N 0.00 0.06 0.72 3.44 2.47 -1.94 -3.40 114.38 115.73 2i76 h ARG 131 Ca 0.00 -0.07 -0.04 0.00 -1.26 0.00 0.00 59.98 58.62 2i76 h ARG 131 Cb 0.00 0.02 0.01 0.00 -1.65 0.00 0.00 29.97 28.35 2i76 h ARG 131 CO 0.00 0.84 -0.35 0.78 0.56 0.00 0.00 179.97 181.80 2i76 h GLY 132 N 2.20 -1.01 -0.66 0.04 0.00 -1.74 -3.34 103.07 98.55 2i76 h GLY 132 Ca -0.02 0.37 0.07 0.00 0.00 0.00 0.00 47.33 47.75 2i76 h GLY 132 CO 0.11 -0.37 -0.57 -2.00 0.00 0.00 0.00 176.54 173.72 2i76 h LEU 133 N -1.20 -1.99 -1.98 3.11 6.46 -1.68 0.43 115.31 118.47 2i76 h LEU 133 Ca -0.10 0.28 0.23 0.00 -0.12 0.00 0.00 57.88 58.17 2i76 h LEU 133 Cb 0.74 0.84 -0.03 0.00 -0.73 0.00 0.00 40.66 41.48 2i76 h LEU 133 CO 0.16 -0.33 0.61 1.55 -0.62 0.00 0.00 178.44 179.81 2i76 h PRO 134 N -0.23 0.00 0.16 5.25 0.13 -1.81 -1.78 132.00 133.72 2i76 h PRO 134 Ca 0.11 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.23 2i76 h PRO 134 Cb 0.51 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.65 2i76 h PRO 134 CO -0.74 0.00 -0.08 0.82 -0.23 0.00 0.00 178.00 177.77 2i76 h ILE 135 N 0.00 0.96 0.00 -3.56 2.04 -1.03 -1.90 117.51 114.01 2i76 h ILE 135 Ca 0.38 -0.59 -0.01 0.00 1.00 0.00 0.00 64.86 65.64 2i76 h ILE 135 Cb 1.59 1.32 -0.00 0.00 -0.74 0.00 0.00 36.82 38.98 2i76 h ILE 135 CO -0.00 0.14 -0.04 -0.37 0.00 0.00 0.00 178.15 177.88 2i76 h VAL 136 N -0.51 0.10 -0.20 1.67 -1.51 -1.34 -0.28 116.25 114.18 2i76 h VAL 136 Ca -0.02 -0.55 -0.19 0.00 -1.23 0.00 0.00 66.70 64.71 2i76 h VAL 136 Cb 0.39 1.50 -0.00 0.00 -2.13 0.00 0.00 31.29 31.05 2i76 h VAL 136 CO 0.04 0.04 -0.62 0.11 -1.23 0.00 0.00 177.57 175.91 2i76 h LYS 137 N 0.00 0.70 -0.02 5.19 1.57 -1.14 0.39 116.57 123.27 2i76 h LYS 137 Ca -0.00 -0.48 -0.13 0.00 -1.87 0.00 0.00 60.65 58.17 2i76 h LYS 137 Cb 0.49 0.07 0.01 0.00 0.08 0.00 0.00 32.23 32.88 2i76 h LYS 137 CO 0.00 1.10 -0.48 0.87 -0.57 0.00 0.00 179.45 180.38 2i76 h LYS 138 N 0.52 0.36 0.04 3.15 1.57 -0.85 0.13 116.57 121.48 2i76 h LYS 138 Ca -0.01 -0.36 0.00 0.00 -1.87 0.00 0.00 60.65 58.42 2i76 h LYS 138 Cb 1.20 0.10 -0.01 0.00 0.08 0.00 0.00 32.23 33.60 2i76 h LYS 138 CO 0.12 1.03 -0.06 0.82 -0.57 0.00 0.00 179.45 180.80 2i76 h ILE 139 N -0.17 0.86 -0.27 1.86 2.04 -1.05 0.50 117.51 121.28 2i76 h ILE 139 Ca -0.05 0.00 0.06 0.00 1.00 0.00 0.00 64.86 65.87 2i76 h ILE 139 Cb 1.18 0.86 -0.06 0.00 -0.74 0.00 0.00 36.82 38.06 2i76 h ILE 139 CO 0.10 0.00 -0.14 0.00 0.00 0.00 0.00 178.15 178.10 2i76 h ALA 140 N 0.84 0.07 -0.17 1.87 0.00 -0.22 -0.91 119.26 120.73 2i76 h ALA 140 Ca 0.01 0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 2i76 h ALA 140 Cb 0.13 0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 2i76 h ALA 140 CO -0.03 -0.55 0.10 0.93 0.00 0.00 0.00 179.25 179.70 2i76 h GLU 141 N -0.11 0.23 0.00 0.00 4.39 -0.04 -2.04 114.58 117.01 2i76 h GLU 141 Ca 0.14 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.83 2i76 h GLU 141 Cb 0.33 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 28.93 2i76 h GLU 141 CO -0.34 0.17 0.00 1.49 -1.16 0.00 0.00 179.01 179.17 2i76 h GLU 142 N 0.24 0.00 0.00 2.33 4.57 0.14 -3.36 114.58 118.50 2i76 h GLU 142 Ca 0.06 0.00 -0.24 0.00 -1.18 0.00 0.00 59.36 58.01 2i76 h GLU 142 Cb 0.00 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 28.55 2i76 h GLU 142 CO -0.01 0.00 -1.81 -0.89 -1.18 0.00 0.00 179.01 175.12 2i76 n ILE 143 N -2.32 0.80 -4.29 2.32 5.41 -0.85 -4.99 119.36 115.44 2i76 n ILE 143 Ca 0.03 -0.22 -0.13 0.00 1.00 0.00 0.00 62.75 63.42 2i76 n ILE 143 Cb 0.29 -1.55 -0.03 0.00 -0.71 0.00 0.00 39.64 37.64 2i76 n ILE 143 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 2i76 n SER 144 N -3.50 1.85 0.19 4.38 3.41 -0.83 -3.95 113.62 115.17 2i76 n SER 144 Ca -0.28 -2.01 -0.08 0.00 -0.26 0.00 0.00 58.87 56.24 2i76 n SER 144 Cb 0.72 0.32 -0.04 0.00 -0.26 0.00 0.00 64.21 64.95 2i76 n SER 144 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 2i76 h GLY 145 N 0.66 -0.57 0.00 5.00 0.00 -1.83 -3.38 103.07 102.94 2i76 h GLY 145 Ca -0.17 0.21 0.00 0.00 0.00 0.00 0.00 47.33 47.37 2i76 h GLY 145 CO 0.28 -0.21 0.00 1.17 0.00 0.00 0.00 176.54 177.78 2i76 n LYS 146 N -4.97 0.05 0.00 4.80 4.81 -1.26 -4.72 118.16 116.87 2i76 n LYS 146 Ca -0.07 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.37 2i76 n LYS 146 Cb 0.22 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.27 2i76 n LYS 146 CO 0.00 0.00 0.00 2.48 1.17 0.00 0.00 177.40 181.05 2i76 n TYR 147 N 0.00 0.00 -3.72 5.64 0.18 -1.26 -3.52 117.16 114.48 2i76 n TYR 147 Ca 0.00 0.00 -0.14 0.00 1.88 0.00 0.00 57.90 59.64 2i76 n TYR 147 Cb 0.00 0.00 -0.09 0.00 -0.38 0.00 0.00 39.34 38.87 2i76 n TYR 147 CO 0.00 0.00 0.00 0.12 -2.08 0.00 0.00 176.86 174.90 2i76 s PHE 148 N -2.68 -0.32 -0.09 -3.48 5.36 0.14 -4.84 117.98 112.08 2i76 s PHE 148 Ca 0.00 0.60 -0.01 0.00 -0.96 0.00 0.00 56.93 56.56 2i76 s PHE 148 Cb 0.00 0.15 -0.03 0.00 -0.34 0.00 0.00 43.02 42.80 2i76 s PHE 148 CO 0.00 -0.37 -0.04 0.14 -1.46 0.00 0.00 175.22 173.49 2i76 s VAL 149 N -0.90 3.96 0.00 3.12 -7.23 -1.26 0.12 120.40 118.21 2i76 s VAL 149 Ca -0.10 -0.38 0.00 0.00 -1.81 0.00 0.00 61.98 59.70 2i76 s VAL 149 Cb -0.04 -2.65 0.00 0.00 0.56 0.00 0.00 36.38 34.25 2i76 s VAL 149 CO 0.04 0.59 0.00 -0.38 -0.31 0.00 0.00 175.10 175.04 2i76 n ILE 150 N 2.35 0.00 0.00 -0.62 -0.00 -0.90 -4.93 119.36 115.26 2i76 n ILE 150 Ca -0.18 0.00 0.00 0.00 -0.00 0.00 0.00 62.75 62.57 2i76 n ILE 150 Cb 0.53 -0.19 0.00 0.00 -0.00 0.00 0.00 39.64 39.98 2i76 n ILE 150 CO 0.00 0.00 0.00 -1.84 -0.00 0.00 0.00 176.55 174.71 2i76 n GLU 153 N 0.00 0.00 -0.20 0.38 0.28 -1.26 -4.71 120.64 115.13 2i76 n GLU 153 Ca 0.00 0.00 0.08 0.00 -0.16 0.00 0.00 57.16 57.08 2i76 n GLU 153 Cb 0.00 -1.60 0.21 0.00 1.43 0.00 0.00 31.44 31.48 2i76 n GLU 153 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 2i76 n LYS 154 N 0.00 1.98 -0.25 3.44 5.02 -1.26 -4.36 118.16 122.73 2i76 n LYS 154 Ca 0.00 -1.52 0.05 0.00 -2.02 0.00 0.00 58.31 54.82 2i76 n LYS 154 Cb 0.00 -1.35 0.16 0.00 -0.02 0.00 0.00 35.03 33.82 2i76 n LYS 154 CO 0.00 0.00 0.00 -0.22 -0.52 0.00 0.00 177.40 176.66 2i76 h LYS 155 N 2.55 0.12 0.02 1.97 1.63 -1.86 0.17 116.57 121.17 2i76 h LYS 155 Ca 0.00 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.79 2i76 h LYS 155 Cb 0.58 -0.03 -0.00 0.00 -0.60 0.00 0.00 32.23 32.18 2i76 h LYS 155 CO 0.00 0.08 -0.05 0.87 -3.45 0.00 0.00 179.45 176.90 2i76 h LYS 156 N 0.13 -0.07 -0.11 1.90 1.57 -1.79 0.51 116.57 118.70 2i76 h LYS 156 Ca 0.41 0.00 0.04 0.00 -1.87 0.00 0.00 60.65 59.24 2i76 h LYS 156 Cb 0.72 0.02 -0.05 0.00 0.08 0.00 0.00 32.23 33.00 2i76 h LYS 156 CO -0.63 -0.05 -0.19 0.00 -0.57 0.00 0.00 179.45 178.01 2i76 h ALA 157 N -1.54 -0.14 -0.82 3.86 0.00 -1.79 0.20 119.26 119.03 2i76 h ALA 157 Ca -0.00 0.04 0.19 0.00 0.00 0.00 0.00 54.91 55.14 2i76 h ALA 157 Cb 0.07 0.36 -0.12 0.00 0.00 0.00 0.00 17.79 18.10 2i76 h ALA 157 CO -0.02 -0.64 0.27 -0.92 0.00 0.00 0.00 179.25 177.94 2i76 h TYR 158 N -0.24 0.43 0.02 0.00 3.20 -0.61 -0.38 116.97 119.40 2i76 h TYR 158 Ca 0.09 0.04 -0.21 0.00 3.14 0.00 0.00 58.73 61.79 2i76 h TYR 158 Cb 0.38 -0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.58 2i76 h TYR 158 CO -0.29 -0.09 -0.95 1.25 -1.64 0.00 0.00 178.16 176.44 2i76 h HIS 159 N 0.31 0.30 -0.81 -3.82 2.76 -0.11 -3.14 115.15 110.64 2i76 h HIS 159 Ca 0.49 -0.18 0.06 0.00 -2.20 0.00 0.00 60.37 58.54 2i76 h HIS 159 Cb 0.90 -0.03 -0.06 0.00 1.55 0.00 0.00 27.41 29.78 2i76 h HIS 159 CO -0.22 1.03 0.49 1.25 -1.30 0.00 0.00 177.93 179.19 2i76 h LEU 160 N 0.09 0.78 -1.51 0.26 5.85 0.93 -0.75 115.31 120.95 2i76 h LEU 160 Ca -0.06 0.02 0.01 0.00 0.84 0.00 0.00 57.88 58.69 2i76 h LEU 160 Cb 1.62 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 42.48 2i76 h LEU 160 CO 0.15 0.50 0.34 0.00 -0.34 0.00 0.00 178.44 179.09 2i76 h ALA 161 N 1.38 1.67 -0.04 1.25 0.00 -1.13 -0.68 119.26 121.69 2i76 h ALA 161 Ca 0.35 -0.03 -0.14 0.00 0.00 0.00 0.00 54.91 55.09 2i76 h ALA 161 Cb 0.15 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2i76 h ALA 161 CO -0.16 0.30 -0.59 0.00 0.00 0.00 0.00 179.25 178.79 2i76 h ALA 162 N 1.69 0.93 -0.10 0.00 0.00 -1.13 -3.07 119.26 117.58 2i76 h ALA 162 Ca 0.19 -0.53 -0.10 0.00 0.00 0.00 0.00 54.91 54.47 2i76 h ALA 162 Cb -0.03 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.68 2i76 h ALA 162 CO -0.05 0.72 -0.34 0.28 0.00 0.00 0.00 179.25 179.87 2i76 h VAL 163 N 0.11 1.40 -0.11 0.00 2.07 -0.48 -1.51 116.25 117.72 2i76 h VAL 163 Ca -0.00 -1.68 -0.06 0.00 0.82 0.00 0.00 66.70 65.78 2i76 h VAL 163 Cb 1.07 2.20 -0.03 0.00 -1.52 0.00 0.00 31.29 33.01 2i76 h VAL 163 CO 0.09 0.49 0.07 2.30 0.02 0.00 0.00 177.57 180.54 2i76 n ILE 164 N -4.39 1.15 0.00 4.57 -5.35 -0.38 -0.79 119.36 114.17 2i76 n ILE 164 Ca -0.08 -0.22 0.00 0.00 -0.27 0.00 0.00 62.75 62.18 2i76 n ILE 164 Cb 0.50 -0.88 0.00 0.00 -1.74 0.00 0.00 39.64 37.52 2i76 n ILE 164 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2i76 n ALA 165 N 0.27 0.74 -0.11 -1.28 0.00 -1.15 -4.80 120.51 114.18 2i76 n ALA 165 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.51 2i76 n ALA 165 Cb 0.61 0.01 0.00 0.00 0.00 0.00 0.00 19.45 20.07 2i76 n ALA 165 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2i76 n SER 166 N -0.44 0.10 -0.03 0.00 3.41 -0.58 -4.75 113.62 111.32 2i76 n SER 166 Ca 0.00 -0.41 -0.04 0.00 -0.26 0.00 0.00 58.87 58.16 2i76 n SER 166 Cb 0.03 0.38 -0.01 0.00 -0.26 0.00 0.00 64.21 64.34 2i76 n SER 166 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2i76 n ASN 167 N -0.38 1.22 -0.31 4.04 3.02 0.03 -4.71 115.26 118.17 2i76 n ASN 167 Ca 0.00 0.20 0.16 0.00 -0.03 0.00 0.00 54.58 54.91 2i76 n ASN 167 Cb 0.03 -0.54 0.34 0.00 -0.61 0.00 0.00 39.78 39.00 2i76 n ASN 167 CO 0.00 0.00 0.00 -0.26 -2.62 0.00 0.00 177.26 174.38 2i76 h PHE 168 N -0.50 0.52 -0.83 3.10 0.05 -1.55 -0.74 116.94 117.00 2i76 h PHE 168 Ca 0.00 0.05 0.24 0.00 3.82 0.00 0.00 57.97 62.08 2i76 h PHE 168 Cb 0.50 -0.08 -0.03 0.00 2.00 0.00 0.00 35.95 38.33 2i76 h PHE 168 CO -0.21 -0.20 0.69 -1.35 -0.18 0.00 0.00 178.31 177.05 2i76 h PRO 169 N 0.24 0.00 -0.14 1.51 0.11 -1.84 0.54 132.00 132.42 2i76 h PRO 169 Ca 0.61 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 66.62 2i76 h PRO 169 Cb 1.28 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.38 2i76 h PRO 169 CO -0.65 0.00 -0.35 0.28 -0.21 0.00 0.00 178.00 177.07 2i76 h VAL 170 N 0.00 1.29 0.00 3.15 2.07 -1.42 -1.03 116.25 120.31 2i76 h VAL 170 Ca 0.39 -1.39 -0.01 0.00 0.82 0.00 0.00 66.70 66.51 2i76 h VAL 170 Cb 1.77 1.57 -0.00 0.00 -1.52 0.00 0.00 31.29 33.10 2i76 h VAL 170 CO -0.00 0.42 -0.04 0.00 0.02 0.00 0.00 177.57 177.97 2i76 h ALA 171 N 1.39 1.47 0.00 1.67 0.00 -0.05 0.59 119.26 124.33 2i76 h ALA 171 Ca 0.03 -0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.80 2i76 h ALA 171 Cb 0.74 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 2i76 h ALA 171 CO 0.06 0.05 -0.59 -0.07 0.00 0.00 0.00 179.25 178.70 2i76 h LEU 172 N 0.00 0.00 -0.98 0.00 4.07 -1.41 -2.39 115.31 114.59 2i76 h LEU 172 Ca -0.00 -0.65 0.17 0.00 0.08 0.00 0.00 57.88 57.48 2i76 h LEU 172 Cb 0.11 0.00 -0.10 0.00 1.08 0.00 0.00 40.66 41.75 2i76 h LEU 172 CO 0.01 1.16 0.59 0.00 -1.08 0.00 0.00 178.44 179.12 2i76 h ALA 173 N -0.35 1.58 0.84 1.53 0.00 -0.85 0.19 119.26 122.20 2i76 h ALA 173 Ca -0.15 0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.78 2i76 h ALA 173 Cb 1.03 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.72 2i76 h ALA 173 CO -0.09 0.02 -0.41 -0.92 0.00 0.00 0.00 179.25 177.85 2i76 h TYR 174 N 0.81 -1.05 -0.86 0.00 3.20 0.07 0.74 116.97 119.87 2i76 h TYR 174 Ca 0.54 -0.02 0.22 0.00 3.14 0.00 0.00 58.73 62.61 2i76 h TYR 174 Cb 0.76 0.35 -0.13 0.00 1.54 0.00 0.00 36.73 39.25 2i76 h TYR 174 CO -0.02 -0.65 0.28 -0.07 -1.64 0.00 0.00 178.16 176.06 2i76 h LEU 175 N -1.21 0.12 -0.79 2.82 3.38 -0.71 0.44 115.31 119.35 2i76 h LEU 175 Ca -0.12 0.17 -0.11 0.00 0.09 0.00 0.00 57.88 57.92 2i76 h LEU 175 Cb 0.87 0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.82 2i76 h LEU 175 CO 0.19 -0.09 -0.30 -1.28 0.09 0.00 0.00 178.44 177.05 2i76 h SER 176 N 0.28 0.58 -0.34 -0.43 0.87 -0.53 -3.07 113.55 110.91 2i76 h SER 176 Ca 0.53 -0.22 -0.02 0.00 -1.23 0.00 0.00 61.79 60.85 2i76 h SER 176 Cb 1.04 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 62.82 2i76 h SER 176 CO -0.59 0.85 0.12 0.50 -0.53 0.00 0.00 176.83 177.18 2i76 h LYS 177 N 0.48 0.51 0.16 2.24 3.64 0.23 -2.21 116.57 121.63 2i76 h LYS 177 Ca 0.06 -0.10 0.01 0.00 -1.27 0.00 0.00 60.65 59.35 2i76 h LYS 177 Cb 0.77 -0.08 -0.05 0.00 -0.41 0.00 0.00 32.23 32.46 2i76 h LYS 177 CO 0.06 0.53 -0.52 0.00 -2.27 0.00 0.00 179.45 177.24 2i76 h ARG 178 N 0.40 -0.75 -0.31 1.90 3.08 -1.01 0.21 114.38 117.89 2i76 h ARG 178 Ca 0.11 0.05 -0.00 0.00 0.07 0.00 0.00 59.98 60.21 2i76 h ARG 178 Cb 0.21 0.17 -0.02 0.00 0.08 0.00 0.00 29.97 30.42 2i76 h ARG 178 CO -0.01 -0.50 0.18 0.97 -1.07 0.00 0.00 179.97 179.54 2i76 h ILE 179 N -0.78 1.10 -0.14 2.04 2.10 -1.58 -0.31 117.51 119.94 2i76 h ILE 179 Ca -0.01 -0.23 -0.12 0.00 1.08 0.00 0.00 64.86 65.58 2i76 h ILE 179 Cb 0.77 0.66 0.00 0.00 -1.09 0.00 0.00 36.82 37.17 2i76 h ILE 179 CO -0.26 0.10 -0.38 1.88 -1.08 0.00 0.00 178.15 178.40 2i76 h TYR 180 N 0.43 0.65 -0.03 2.19 0.99 -1.01 -2.27 116.97 117.93 2i76 h TYR 180 Ca 0.11 -0.26 0.03 0.00 2.00 0.00 0.00 58.73 60.62 2i76 h TYR 180 Cb -0.00 -0.11 -0.06 0.00 1.00 0.00 0.00 36.73 37.56 2i76 h TYR 180 CO 0.00 1.00 -0.41 1.15 -0.00 0.00 0.00 178.16 179.90 2i76 h THR 181 N 0.12 0.16 -0.04 -2.88 2.02 0.19 0.23 112.91 112.70 2i76 h THR 181 Ca -0.01 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.18 2i76 h THR 181 Cb 1.00 0.16 -0.00 0.00 -1.74 0.00 0.00 68.15 67.57 2i76 h THR 181 CO 0.08 0.00 0.12 0.25 0.37 0.00 0.00 175.52 176.35 2i76 h LEU 182 N -0.55 0.00 -1.27 2.58 6.46 -1.09 -0.33 115.31 121.11 2i76 h LEU 182 Ca 0.05 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.81 2i76 h LEU 182 Cb 0.64 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.57 2i76 h LEU 182 CO -0.33 0.00 0.00 -0.11 -0.62 0.00 0.00 178.44 177.38 2i76 n LEU 183 N -3.27 1.88 0.00 2.25 7.94 0.78 -4.93 117.00 121.64 2i76 n LEU 183 Ca -0.02 -0.86 0.00 0.00 -1.11 0.00 0.00 56.01 54.02 2i76 n LEU 183 Cb 0.20 -0.18 0.00 0.00 0.53 0.00 0.00 43.42 43.97 2i76 n LEU 183 CO 0.21 0.43 0.00 0.61 -1.11 0.00 0.00 177.39 177.53 2i76 n GLY 184 N 1.12 3.08 3.59 -3.96 0.00 -0.14 -5.01 105.19 103.88 2i76 n GLY 184 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 2i76 n GLY 184 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2i76 s LEU 185 N 0.00 3.45 0.13 0.99 0.20 -1.09 -4.83 118.68 117.52 2i76 s LEU 185 Ca 0.00 1.64 -0.13 0.00 0.69 0.00 0.00 54.13 56.33 2i76 s LEU 185 Cb 0.00 -3.41 -0.03 0.00 -0.43 0.00 0.00 46.19 42.32 2i76 s LEU 185 CO 0.00 -1.99 1.52 -2.24 -0.29 0.00 0.00 176.35 173.35 2i76 h ASP 186 N 14.91 0.84 -3.78 3.68 3.04 -1.87 -3.36 116.42 129.89 2i76 h ASP 186 Ca -0.37 -0.39 -0.63 0.00 -3.24 0.00 0.00 57.03 52.40 2i76 h ASP 186 Cb 1.22 -0.23 -0.41 0.00 -1.04 0.00 0.00 39.33 38.87 2i76 h ASP 186 CO 1.00 1.04 -0.66 -0.70 -2.04 0.00 0.00 179.24 177.88 2i76 s GLU 187 N -4.69 1.85 0.33 4.15 -6.30 -1.26 -4.96 118.70 107.82 2i76 s GLU 187 Ca -0.12 -2.59 0.21 0.00 -2.50 0.00 0.00 54.97 49.97 2i76 s GLU 187 Cb 0.10 -2.99 0.18 0.00 0.00 0.00 0.00 34.13 31.43 2i76 s GLU 187 CO 0.83 -1.17 1.39 -1.00 0.02 0.00 0.00 175.26 175.32 2i76 h PRO 188 N 6.29 0.00 -0.76 4.30 0.13 -1.95 -3.39 132.00 136.61 2i76 h PRO 188 Ca 0.00 0.00 0.18 0.00 -0.87 0.00 0.00 66.00 65.31 2i76 h PRO 188 Cb 0.87 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 31.86 2i76 h PRO 188 CO 0.62 0.09 -0.09 0.39 -0.23 0.00 0.00 178.00 178.78 2i76 n GLU 189 N -2.99 -0.06 -0.34 0.86 4.71 -1.26 0.53 120.64 122.08 2i76 n GLU 189 Ca 0.02 1.16 -0.03 0.00 -0.01 0.00 0.00 57.16 58.30 2i76 n GLU 189 Cb 0.58 -1.79 0.09 0.00 -1.01 0.00 0.00 31.44 29.32 2i76 n GLU 189 CO 0.00 0.00 0.00 -0.07 0.09 0.00 0.00 177.13 177.15 2i76 h LEU 190 N 0.00 1.12 0.27 -4.62 3.38 -2.00 -0.21 115.31 113.25 2i76 h LEU 190 Ca 0.41 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.29 2i76 h LEU 190 Cb 0.74 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.21 2i76 h LEU 190 CO -0.75 0.87 -0.13 0.25 0.09 0.00 0.00 178.44 178.77 2i76 h LEU 191 N 1.28 -0.31 -0.96 1.67 5.85 -0.20 -2.82 115.31 119.82 2i76 h LEU 191 Ca 0.33 -0.21 0.19 0.00 0.84 0.00 0.00 57.88 59.03 2i76 h LEU 191 Cb -0.04 0.08 -0.11 0.00 0.37 0.00 0.00 40.66 40.96 2i76 h LEU 191 CO -0.06 0.17 0.54 0.40 -0.34 0.00 0.00 178.44 179.15 2i76 h ILE 192 N -0.91 0.65 0.13 4.05 2.04 -1.19 -1.62 117.51 120.66 2i76 h ILE 192 Ca -0.04 -0.23 -0.01 0.00 1.00 0.00 0.00 64.86 65.59 2i76 h ILE 192 Cb 0.50 -0.06 0.00 0.00 -0.74 0.00 0.00 36.82 36.52 2i76 h ILE 192 CO 0.06 0.12 -0.06 -0.74 0.00 0.00 0.00 178.15 177.53 2i76 h HIS 193 N 0.66 -0.16 -0.78 1.37 -0.00 -1.08 -3.11 115.15 112.05 2i76 h HIS 193 Ca 0.56 -0.00 0.18 0.00 -0.00 0.00 0.00 60.37 61.11 2i76 h HIS 193 Cb 0.92 0.05 -0.12 0.00 -0.00 0.00 0.00 27.41 28.26 2i76 h HIS 193 CO -0.04 0.05 0.19 1.15 -0.00 0.00 0.00 177.93 179.27 2i76 h THR 194 N -0.34 0.46 0.00 6.26 2.02 -1.04 0.87 112.91 121.14 2i76 h THR 194 Ca -0.02 -0.09 0.00 0.00 0.77 0.00 0.00 66.41 67.08 2i76 h THR 194 Cb 0.28 0.18 0.00 0.00 -1.74 0.00 0.00 68.15 66.87 2i76 h THR 194 CO 0.03 0.05 0.00 0.18 0.37 0.00 0.00 175.52 176.14 2i76 n LEU 195 N -5.18 0.19 0.00 2.58 4.77 -0.99 -2.10 117.00 116.27 2i76 n LEU 195 Ca 0.16 -0.10 0.00 0.00 -0.03 0.00 0.00 56.01 56.04 2i76 n LEU 195 Cb 0.51 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.51 2i76 n LEU 195 CO 0.11 0.05 0.00 1.17 -1.33 0.00 0.00 177.39 177.38 2i76 n LYS 197 N -0.12 0.00 0.08 3.23 4.81 0.30 -1.67 118.16 124.79 2i76 n LYS 197 Ca 0.00 0.00 -0.12 0.00 -0.87 0.00 0.00 58.31 57.32 2i76 n LYS 197 Cb 0.05 0.00 -0.05 0.00 0.02 0.00 0.00 35.03 35.05 2i76 n LYS 197 CO 0.00 0.00 0.00 0.78 1.17 0.00 0.00 177.40 179.35 2i76 h GLY 198 N 0.00 -0.53 0.12 3.14 0.00 -1.61 -1.18 103.07 103.01 2i76 h GLY 198 Ca 0.00 0.37 0.09 0.00 0.00 0.00 0.00 47.33 47.79 2i76 h GLY 198 CO 0.00 -0.23 -0.09 -2.08 0.00 0.00 0.00 176.54 174.14 2i76 h VAL 199 N -0.48 0.56 -0.18 4.60 2.07 -1.61 0.41 116.25 121.63 2i76 h VAL 199 Ca 0.05 -0.01 0.02 0.00 0.82 0.00 0.00 66.70 67.59 2i76 h VAL 199 Cb 0.55 0.54 -0.04 0.00 -1.52 0.00 0.00 31.29 30.81 2i76 h VAL 199 CO -0.24 0.00 -0.32 0.00 0.02 0.00 0.00 177.57 177.04 2i76 h ALA 200 N 1.45 -0.62 -0.49 1.67 0.00 -1.66 0.89 119.26 120.49 2i76 h ALA 200 Ca 0.22 -0.01 0.07 0.00 0.00 0.00 0.00 54.91 55.19 2i76 h ALA 200 Cb 0.34 0.91 -0.06 0.00 0.00 0.00 0.00 17.79 18.98 2i76 h ALA 200 CO -0.45 -0.76 0.15 -0.44 0.00 0.00 0.00 179.25 177.74 2i76 h ASP 201 N -0.27 0.11 0.12 0.00 3.32 -0.57 0.54 116.42 119.68 2i76 h ASP 201 Ca 0.03 0.07 -0.02 0.00 0.02 0.00 0.00 57.03 57.13 2i76 h ASP 201 Cb 0.36 0.07 -0.00 0.00 0.22 0.00 0.00 39.33 39.98 2i76 h ASP 201 CO -0.31 0.09 -0.09 -1.13 -1.72 0.00 0.00 179.24 176.08 2i76 h ASN 202 N 0.31 0.00 0.53 6.45 -0.00 0.76 0.27 115.58 123.89 2i76 h ASN 202 Ca 0.24 0.00 -0.03 0.00 -0.00 0.00 0.00 56.30 56.51 2i76 h ASN 202 Cb 0.28 0.00 -0.00 0.00 -0.00 0.00 0.00 38.32 38.60 2i76 h ASN 202 CO -0.27 0.09 -0.16 0.40 -0.00 0.00 0.00 177.43 177.49 2i76 h ILE 203 N 0.00 0.57 0.00 2.57 5.03 0.31 -3.29 117.51 122.70 2i76 h ILE 203 Ca -0.00 -0.73 0.00 0.00 -0.12 0.00 0.00 64.86 64.01 2i76 h ILE 203 Cb 0.18 1.48 0.00 0.00 -3.03 0.00 0.00 36.82 35.45 2i76 h ILE 203 CO 0.01 0.15 0.00 1.17 -0.68 0.00 0.00 178.15 178.81 2i76 n LYS 204 N -3.57 0.00 0.00 2.37 4.81 0.83 -4.10 118.16 118.50 2i76 n LYS 204 Ca -0.01 0.34 0.00 0.00 -0.87 0.00 0.00 58.31 57.77 2i76 n LYS 204 Cb 0.30 -0.82 0.00 0.00 0.02 0.00 0.00 35.03 34.53 2i76 n LYS 204 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 2i76 n LYS 205 N -1.80 0.00 -4.24 1.64 5.02 -0.48 -4.92 118.16 113.38 2i76 n LYS 205 Ca 0.00 0.00 -0.23 0.00 -2.02 0.00 0.00 58.31 56.06 2i76 n LYS 205 Cb 0.00 -0.74 -0.07 0.00 -0.02 0.00 0.00 35.03 34.20 2i76 n LYS 205 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 2i76 s ARG 207 N 0.00 2.40 0.24 1.97 1.70 -1.26 -5.10 118.95 118.91 2i76 s ARG 207 Ca 0.00 -1.38 -0.14 0.00 -0.47 0.00 0.00 55.73 53.74 2i76 s ARG 207 Cb 0.00 -2.22 0.31 0.00 -0.57 0.00 0.00 34.95 32.47 2i76 s ARG 207 CO 0.00 0.33 1.57 0.28 -1.08 0.00 0.00 175.30 176.40 2i76 h VAL 208 N 1.77 0.05 0.00 4.99 2.07 -1.91 -1.37 116.25 121.86 2i76 h VAL 208 Ca -0.45 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.07 2i76 h VAL 208 Cb 1.25 0.05 0.00 0.00 -1.52 0.00 0.00 31.29 31.07 2i76 h VAL 208 CO 0.61 0.00 0.10 -0.33 0.02 0.00 0.00 177.57 177.97 2i76 h GLU 209 N -0.02 0.00 -0.00 1.57 3.07 -1.96 -2.06 114.58 115.18 2i76 h GLU 209 Ca 0.38 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.24 2i76 h GLU 209 Cb 0.63 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.54 2i76 h GLU 209 CO -0.94 0.00 -0.25 0.00 -1.40 0.00 0.00 179.01 176.42 2i76 n SER 211 N -0.58 0.69 -4.78 0.00 2.88 -0.77 -4.94 113.62 106.12 2i76 n SER 211 Ca 0.03 0.56 -0.37 0.00 -1.33 0.00 0.00 58.87 57.76 2i76 n SER 211 Cb 0.17 -0.75 -0.05 0.00 -0.75 0.00 0.00 64.21 62.83 2i76 n SER 211 CO 0.00 0.00 0.00 -0.22 -1.23 0.00 0.00 175.04 173.59 2i76 s LEU 212 N -4.29 4.29 0.00 2.46 2.96 -1.25 -4.91 118.68 117.94 2i76 s LEU 212 Ca 0.11 2.03 -0.04 0.00 -0.22 0.00 0.00 54.13 56.01 2i76 s LEU 212 Cb 0.13 -4.01 0.01 0.00 0.50 0.00 0.00 46.19 42.83 2i76 s LEU 212 CO 0.59 -0.29 0.36 0.35 -1.32 0.00 0.00 176.35 176.04 2i76 n THR 213 N 0.39 0.00 0.00 3.68 -2.24 -1.26 -4.99 114.28 109.86 2i76 n THR 213 Ca 0.03 -0.95 0.00 0.00 -2.27 0.00 0.00 64.05 60.86 2i76 n THR 213 Cb 0.49 0.66 0.00 0.00 -2.10 0.00 0.00 70.33 69.37 2i76 n THR 213 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2i76 n GLY 214 N -0.35 -2.92 0.20 3.38 0.00 -1.26 -4.47 105.19 99.78 2i76 n GLY 214 Ca -0.01 -2.13 -0.07 0.00 0.00 0.00 0.00 46.02 43.81 2i76 n GLY 214 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2i76 h PRO 215 N 1.24 -0.26 -0.36 1.61 0.11 -1.91 -2.93 132.00 129.50 2i76 h PRO 215 Ca 0.00 0.02 0.08 0.00 0.11 0.00 0.00 66.00 66.20 2i76 h PRO 215 Cb 0.00 0.06 -0.08 0.00 0.11 0.00 0.00 31.00 31.09 2i76 h PRO 215 CO 0.00 -0.17 -0.15 -0.39 -0.21 0.00 0.00 178.00 177.08 2i76 h VAL 216 N -0.26 0.52 -0.96 3.15 -1.51 -1.83 -2.42 116.25 112.93 2i76 h VAL 216 Ca 0.01 0.00 0.26 0.00 -1.23 0.00 0.00 66.70 65.74 2i76 h VAL 216 Cb 0.30 0.52 -0.18 0.00 -2.13 0.00 0.00 31.29 29.80 2i76 h VAL 216 CO -0.17 0.00 0.00 1.17 -1.23 0.00 0.00 177.57 177.34 2i76 n LYS 217 N -5.34 -0.08 -0.35 5.19 3.00 -1.12 -1.60 118.16 117.87 2i76 n LYS 217 Ca 0.02 1.44 0.11 0.00 -0.00 0.00 0.00 58.31 59.87 2i76 n LYS 217 Cb 0.25 -2.27 0.30 0.00 0.00 0.00 0.00 35.03 33.31 2i76 n LYS 217 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.40 180.29 2i76 n ARG 218 N -5.43 2.73 0.00 1.64 1.85 -0.94 -5.03 116.66 111.49 2i76 n ARG 218 Ca 0.22 -2.60 0.00 0.00 -1.00 0.00 0.00 57.85 54.47 2i76 n ARG 218 Cb 0.72 -1.54 0.00 0.00 -1.05 0.00 0.00 32.46 30.59 2i76 n ARG 218 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2i76 n GLY 219 N 1.55 0.95 4.14 2.89 0.00 -0.63 -4.95 105.19 109.15 2i76 n GLY 219 Ca 0.23 -0.91 -0.30 0.00 0.00 0.00 0.00 46.02 45.05 2i76 n GLY 219 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2i76 n ASP 220 N 0.00 0.45 0.12 1.61 9.92 -1.26 -4.11 116.55 123.28 2i76 n ASP 220 Ca 0.00 -1.17 0.12 0.00 -0.53 0.00 0.00 54.79 53.22 2i76 n ASP 220 Cb 0.00 -1.44 0.47 0.00 -0.64 0.00 0.00 41.12 39.50 2i76 n ASP 220 CO 0.00 0.00 0.00 -2.67 0.13 0.00 0.00 177.20 174.66 2i76 n TRP 221 N -4.30 0.82 0.22 1.24 2.14 -1.26 -1.72 117.44 114.57 2i76 n TRP 221 Ca -0.28 0.30 0.12 0.00 2.07 0.00 0.00 57.50 59.70 2i76 n TRP 221 Cb 0.62 -0.98 0.22 0.00 -0.81 0.00 0.00 31.31 30.36 2i76 n TRP 221 CO 0.00 0.00 0.00 0.37 2.07 0.00 0.00 177.69 180.13 2i76 h GLN 222 N 0.00 0.00 0.20 -2.67 4.15 -1.99 -0.93 115.11 113.88 2i76 h GLN 222 Ca 0.00 0.00 -0.30 0.00 0.77 0.00 0.00 58.65 59.12 2i76 h GLN 222 Cb 0.46 0.00 0.02 0.00 0.21 0.00 0.00 27.48 28.18 2i76 h GLN 222 CO 0.00 0.06 -1.36 0.28 -1.93 0.00 0.00 178.83 175.88 2i76 h VAL 223 N 0.00 1.25 -0.54 2.39 2.07 -1.68 -2.18 116.25 117.56 2i76 h VAL 223 Ca -0.00 -2.59 -0.05 0.00 0.82 0.00 0.00 66.70 64.88 2i76 h VAL 223 Cb 0.98 3.00 -0.02 0.00 -1.52 0.00 0.00 31.29 33.72 2i76 h VAL 223 CO 0.01 0.78 0.15 0.58 0.02 0.00 0.00 177.57 179.11 2i76 h VAL 224 N -0.04 1.24 -0.18 2.57 2.07 -1.32 -1.32 116.25 119.27 2i76 h VAL 224 Ca -0.25 -0.83 -0.05 0.00 0.82 0.00 0.00 66.70 66.40 2i76 h VAL 224 Cb 1.98 0.75 -0.00 0.00 -1.52 0.00 0.00 31.29 32.50 2i76 h VAL 224 CO 0.20 0.30 -0.07 -0.08 0.02 0.00 0.00 177.57 177.95 2i76 h GLU 225 N 0.75 0.36 -0.16 1.57 4.57 -1.27 -1.93 114.58 118.47 2i76 h GLU 225 Ca 0.17 -0.15 -0.04 0.00 -1.18 0.00 0.00 59.36 58.16 2i76 h GLU 225 Cb 0.31 -0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 28.87 2i76 h GLU 225 CO -0.00 0.66 -0.09 0.93 -1.18 0.00 0.00 179.01 179.32 2i76 h GLU 226 N 0.05 0.25 0.00 1.92 5.08 -1.34 -1.03 114.58 119.51 2i76 h GLU 226 Ca 0.04 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2i76 h GLU 226 Cb 0.54 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.75 2i76 h GLU 226 CO 0.02 0.36 0.00 0.39 -1.00 0.00 0.00 179.01 178.78 2i76 n GLU 227 N -4.30 0.13 0.05 2.33 1.02 -0.50 -2.35 120.64 117.02 2i76 n GLU 227 Ca -0.01 0.13 -0.15 0.00 -0.02 0.00 0.00 57.16 57.12 2i76 n GLU 227 Cb 0.24 -1.66 -0.05 0.00 -0.02 0.00 0.00 31.44 29.95 2i76 n GLU 227 CO 0.00 0.00 0.00 -0.09 1.18 0.00 0.00 177.13 178.22 2i76 h ARG 228 N 0.00 0.49 -0.11 3.49 2.43 -0.36 0.94 114.38 121.25 2i76 h ARG 228 Ca 0.00 -0.51 -0.14 0.00 -0.81 0.00 0.00 59.98 58.52 2i76 h ARG 228 Cb 0.59 0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 30.26 2i76 h ARG 228 CO 0.00 1.15 -0.54 0.00 -1.51 0.00 0.00 179.97 179.06 2i76 h ARG 229 N 0.29 0.32 0.00 0.20 3.08 -1.36 -0.30 114.38 116.61 2i76 h ARG 229 Ca -0.08 -0.20 -0.14 0.00 0.07 0.00 0.00 59.98 59.63 2i76 h ARG 229 Cb 1.56 0.02 -0.02 0.00 0.08 0.00 0.00 29.97 31.61 2i76 h ARG 229 CO 0.17 0.79 -0.64 1.49 -1.07 0.00 0.00 179.97 180.70 2i76 h GLU 230 N 0.25 0.00 0.03 0.04 4.57 -1.38 0.54 114.58 118.64 2i76 h GLU 230 Ca 0.00 0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 58.18 2i76 h GLU 230 Cb 1.04 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.63 2i76 h GLU 230 CO 0.09 0.64 -0.02 -0.92 -1.18 0.00 0.00 179.01 177.63 2i76 h TYR 231 N 0.00 -0.04 -0.55 0.92 3.20 -0.49 -2.78 116.97 117.24 2i76 h TYR 231 Ca -0.01 -0.00 0.04 0.00 3.14 0.00 0.00 58.73 61.90 2i76 h TYR 231 Cb 1.22 0.01 -0.04 0.00 1.54 0.00 0.00 36.73 39.46 2i76 h TYR 231 CO 0.00 0.53 0.30 1.49 -1.64 0.00 0.00 178.16 178.84 2i76 h GLU 232 N -0.65 0.57 -0.79 1.82 4.81 -0.93 -0.36 114.58 119.06 2i76 h GLU 232 Ca -0.00 -0.03 0.03 0.00 -0.13 0.00 0.00 59.36 59.22 2i76 h GLU 232 Cb 0.59 -0.13 -0.05 0.00 0.63 0.00 0.00 28.75 29.80 2i76 h GLU 232 CO 0.01 0.38 0.51 0.87 -0.73 0.00 0.00 179.01 180.04 2i76 h LYS 233 N 0.59 0.97 -0.01 1.92 1.57 -0.95 -3.04 116.57 117.63 2i76 h LYS 233 Ca 0.23 -0.06 -0.24 0.00 -1.87 0.00 0.00 60.65 58.72 2i76 h LYS 233 Cb 0.09 -0.22 0.01 0.00 0.08 0.00 0.00 32.23 32.19 2i76 h LYS 233 CO -0.14 0.64 -0.96 0.82 -0.57 0.00 0.00 179.45 179.25 2i76 h ILE 234 N 1.00 1.35 -1.52 1.86 2.04 -1.15 -3.46 117.51 117.64 2i76 h ILE 234 Ca 0.31 -2.34 0.00 0.00 1.00 0.00 0.00 64.86 63.83 2i76 h ILE 234 Cb -0.03 2.37 0.00 0.00 -0.74 0.00 0.00 36.82 38.42 2i76 h ILE 234 CO -0.10 0.71 0.00 0.49 0.00 0.00 0.00 178.15 179.25 2i76 n PHE 235 N -3.80 0.00 0.31 1.37 3.01 -0.19 -5.05 117.46 113.11 2i76 n PHE 235 Ca -0.08 0.00 0.04 0.00 1.01 0.00 0.00 57.45 58.42 2i76 n PHE 235 Cb 0.84 0.00 0.04 0.00 -0.01 0.00 0.00 39.48 40.35 2i76 n PHE 235 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2i76 n GLY 236 N 5.00 -0.48 1.28 1.37 0.00 -1.25 -4.78 105.19 106.32 2i76 n GLY 236 Ca 0.00 -0.23 -0.02 0.00 0.00 0.00 0.00 46.02 45.77 2i76 n GLY 236 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2i76 n ASN 237 N 0.44 -0.66 -0.13 1.61 6.94 -1.26 -5.03 115.26 117.17 2i76 n ASN 237 Ca 0.05 -1.40 0.05 0.00 -0.02 0.00 0.00 54.58 53.26 2i76 n ASN 237 Cb 0.21 1.08 0.07 0.00 -2.36 0.00 0.00 39.78 38.78 2i76 n ASN 237 CO 0.00 0.00 0.00 0.35 -1.03 0.00 0.00 177.26 176.58 2i76 n THR 238 N -0.22 1.18 0.35 5.53 -2.24 -1.26 -3.98 114.28 113.63 2i76 n THR 238 Ca -0.02 -1.37 -0.19 0.00 -2.27 0.00 0.00 64.05 60.20 2i76 n THR 238 Cb 0.20 0.16 -0.10 0.00 -2.10 0.00 0.00 70.33 68.49 2i76 n THR 238 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 2i76 h VAL 239 N 1.61 0.00 -0.37 2.28 2.07 -1.98 0.73 116.25 120.58 2i76 h VAL 239 Ca 0.00 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.54 2i76 h VAL 239 Cb 0.97 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 30.71 2i76 h VAL 239 CO 0.00 0.00 0.19 0.25 0.02 0.00 0.00 177.57 178.03 2i76 h LEU 240 N -1.08 0.29 -0.12 2.57 5.85 -1.99 -0.78 115.31 120.04 2i76 h LEU 240 Ca -0.08 0.01 0.05 0.00 0.84 0.00 0.00 57.88 58.70 2i76 h LEU 240 Cb 0.91 -0.04 -0.06 0.00 0.37 0.00 0.00 40.66 41.84 2i76 h LEU 240 CO 0.00 0.21 -0.27 0.22 -0.34 0.00 0.00 178.44 178.27 2i76 h TYR 241 N 0.39 -0.73 0.00 1.25 3.20 -1.90 0.17 116.97 119.35 2i76 h TYR 241 Ca 0.15 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 62.04 2i76 h TYR 241 Cb 0.05 0.34 -0.00 0.00 1.54 0.00 0.00 36.73 38.65 2i76 h TYR 241 CO -0.09 -0.35 -0.09 -0.44 -1.64 0.00 0.00 178.16 175.55 2i76 h ASP 242 N -0.35 0.00 -0.03 -2.11 5.19 -0.51 -1.77 116.42 116.85 2i76 h ASP 242 Ca 0.10 0.00 -0.03 0.00 -0.62 0.00 0.00 57.03 56.48 2i76 h ASP 242 Cb 0.49 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.00 2i76 h ASP 242 CO -0.31 0.09 -0.08 -0.08 -3.12 0.00 0.00 179.24 175.73 2i76 h GLU 243 N 0.00 0.11 -0.15 3.56 4.57 0.44 -2.37 114.58 120.74 2i76 h GLU 243 Ca -0.00 -0.08 -0.04 0.00 -1.18 0.00 0.00 59.36 58.06 2i76 h GLU 243 Cb 0.19 0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 28.78 2i76 h GLU 243 CO 0.01 0.69 -0.11 0.82 -1.18 0.00 0.00 179.01 179.24 2i76 h ILE 244 N -0.46 1.16 -0.14 2.32 1.08 -0.38 -1.14 117.51 119.95 2i76 h ILE 244 Ca -0.00 -0.71 -0.07 0.00 -0.39 0.00 0.00 64.86 63.68 2i76 h ILE 244 Cb 0.70 1.18 -0.00 0.00 -3.07 0.00 0.00 36.82 35.62 2i76 h ILE 244 CO 0.02 0.22 -0.20 0.58 -0.69 0.00 0.00 178.15 178.08 2i76 h VAL 245 N 0.22 1.36 -0.41 1.67 2.07 -1.35 0.48 116.25 120.28 2i76 h VAL 245 Ca 0.05 -1.41 0.07 0.00 0.82 0.00 0.00 66.70 66.22 2i76 h VAL 245 Cb 0.33 1.95 -0.02 0.00 -1.52 0.00 0.00 31.29 32.03 2i76 h VAL 245 CO 0.02 0.42 0.28 0.50 0.02 0.00 0.00 177.57 178.81 2i76 h LYS 246 N -0.00 0.24 0.16 1.57 3.64 -1.10 -1.04 116.57 120.04 2i76 h LYS 246 Ca 0.02 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.37 2i76 h LYS 246 Cb 0.76 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.53 2i76 h LYS 246 CO 0.05 0.16 -0.08 -0.07 -2.27 0.00 0.00 179.45 177.24 2i76 h LEU 247 N 0.24 -0.18 -0.99 5.20 3.38 -0.73 -3.12 115.31 119.12 2i76 h LEU 247 Ca 0.19 -0.33 0.27 0.00 0.09 0.00 0.00 57.88 58.10 2i76 h LEU 247 Cb 0.43 0.05 -0.13 0.00 0.09 0.00 0.00 40.66 41.09 2i76 h LEU 247 CO -0.04 0.39 0.55 -0.07 0.09 0.00 0.00 178.44 179.36 2i76 h LEU 248 N -0.92 0.55 -0.36 1.67 3.38 0.65 0.47 115.31 120.75 2i76 h LEU 248 Ca -0.02 0.16 -0.02 0.00 0.09 0.00 0.00 57.88 58.08 2i76 h LEU 248 Cb 0.50 0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.32 2i76 h LEU 248 CO 0.04 -0.00 0.13 0.03 0.09 0.00 0.00 178.44 178.73 2i76 h ARG 249 N 0.46 0.54 -0.88 1.13 3.08 -1.31 1.53 114.38 118.94 2i76 h ARG 249 Ca 0.66 -0.10 0.14 0.00 0.07 0.00 0.00 59.98 60.75 2i76 h ARG 249 Cb 1.36 -0.09 -0.09 0.00 0.08 0.00 0.00 29.97 31.23 2i76 h ARG 249 CO -0.53 0.54 0.48 0.93 -1.07 0.00 0.00 179.97 180.32 2i76 h GLU 250 N 0.43 0.69 0.39 0.04 5.08 -0.07 0.83 114.58 121.98 2i76 h GLU 250 Ca 0.12 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.42 2i76 h GLU 250 Cb 0.21 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.30 2i76 h GLU 250 CO -0.01 0.46 -0.19 0.28 -1.00 0.00 0.00 179.01 178.55 2i76 h VAL 251 N 0.71 0.00 -1.06 3.13 2.07 0.04 -3.25 116.25 117.89 2i76 h VAL 251 Ca 0.47 -0.21 0.40 0.00 0.82 0.00 0.00 66.70 68.17 2i76 h VAL 251 Cb 0.60 0.00 -0.16 0.00 -1.52 0.00 0.00 31.29 30.21 2i76 h VAL 251 CO -0.33 0.00 0.61 0.00 0.02 0.00 0.00 177.57 177.87 2i76 h ALA 252 N -1.55 2.23 -0.42 1.67 0.00 0.30 -1.73 119.26 119.76 2i76 h ALA 252 Ca -0.05 0.22 -0.48 0.00 0.00 0.00 0.00 54.91 54.60 2i76 h ALA 252 Cb 0.40 0.27 -0.14 0.00 0.00 0.00 0.00 17.79 18.32 2i76 h ALA 252 CO 0.09 -0.95 0.69 0.39 0.00 0.00 0.00 179.25 179.47 2i76 n GLU 253 N -5.11 2.71 0.00 0.00 1.02 0.28 -5.05 120.64 114.50 2i76 n GLU 253 Ca 0.36 -2.24 0.00 0.00 -0.02 0.00 0.00 57.16 55.27 2i76 n GLU 253 Cb 1.25 -2.22 0.00 0.00 -0.02 0.00 0.00 31.44 30.45 2i76 n GLU 253 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74