#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2i2t n ARG 2 N 0.00 0.00 -0.24 -1.46 1.74 -1.26 -1.42 116.66 114.02 2i2t n ARG 2 Ca 0.00 0.00 -0.06 0.00 -0.77 0.00 0.00 57.85 57.02 2i2t n ARG 2 Cb 0.00 0.00 0.05 0.00 -1.02 0.00 0.00 32.46 31.49 2i2t n ARG 2 CO 0.00 0.00 0.00 -0.39 -1.52 0.00 0.00 177.63 175.72 2i2t h VAL 3 N 0.00 1.19 0.00 1.55 -1.51 -1.97 0.17 116.25 115.68 2i2t h VAL 3 Ca 0.00 -0.41 0.00 0.00 -1.23 0.00 0.00 66.70 65.06 2i2t h VAL 3 Cb 0.00 0.26 0.00 0.00 -2.13 0.00 0.00 31.29 29.42 2i2t h VAL 3 CO 0.00 0.19 0.00 0.00 -1.23 0.00 0.00 177.57 176.53 2i2t n ALA 4 N -2.31 2.08 0.39 5.19 0.00 -0.51 -0.85 120.51 124.50 2i2t n ALA 4 Ca 0.05 -0.05 0.06 0.00 0.00 0.00 0.00 53.44 53.50 2i2t n ALA 4 Cb 0.05 -1.14 -0.07 0.00 0.00 0.00 0.00 19.45 18.28 2i2t n ALA 4 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2i2t n LYS 5 N -0.76 2.33 -2.14 0.00 4.76 0.54 -4.53 118.16 118.37 2i2t n LYS 5 Ca 0.07 -0.03 -0.43 0.00 -2.87 0.00 0.00 58.31 55.04 2i2t n LYS 5 Cb 0.03 -1.12 -0.02 0.00 -1.84 0.00 0.00 35.03 32.07 2i2t n LYS 5 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2i2t s ALA 6 N -2.32 3.01 0.65 7.82 0.00 -0.03 -4.87 121.76 126.01 2i2t s ALA 6 Ca 0.02 0.16 0.26 0.00 0.00 0.00 0.00 51.96 52.40 2i2t s ALA 6 Cb 0.09 -3.96 1.39 0.00 0.00 0.00 0.00 23.12 20.64 2i2t s ALA 6 CO 0.49 -2.42 1.79 -1.35 0.00 0.00 0.00 175.76 174.27 2i2t h PRO 7 N 11.74 0.00 0.00 0.00 0.11 -1.88 -3.46 132.00 138.51 2i2t h PRO 7 Ca -0.32 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.79 2i2t h PRO 7 Cb 1.14 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.25 2i2t h PRO 7 CO 1.04 0.00 0.00 0.28 -0.21 0.00 0.00 178.00 179.11 2i2t n VAL 8 N -3.03 0.00 -1.59 3.15 0.31 -1.26 -2.17 118.33 113.74 2i2t n VAL 8 Ca 0.01 0.00 -0.01 0.00 -0.01 0.00 0.00 64.34 64.33 2i2t n VAL 8 Cb 0.54 0.00 -0.01 0.00 -0.91 0.00 0.00 33.84 33.46 2i2t n VAL 8 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 2i2t n VAL 9 N 0.00 -5.89 -2.70 2.52 0.31 -1.26 -4.92 118.33 106.38 2i2t n VAL 9 Ca 0.00 0.98 -0.42 0.00 -0.01 0.00 0.00 64.34 64.89 2i2t n VAL 9 Cb 0.00 -4.18 -0.03 0.00 -0.91 0.00 0.00 33.84 28.71 2i2t n VAL 9 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 2i2t s VAL 10 N -0.20 4.15 0.00 2.52 1.01 -1.08 -4.96 120.40 121.84 2i2t s VAL 10 Ca -0.04 0.49 0.00 0.00 0.00 0.00 0.00 61.98 62.44 2i2t s VAL 10 Cb 0.00 -4.67 0.00 0.00 0.00 0.00 0.00 36.38 31.71 2i2t s VAL 10 CO 0.10 -1.33 0.00 -2.65 0.00 0.00 0.00 175.10 171.22 2i2t n PRO 11 N 8.11 1.64 -3.66 2.72 -0.02 -1.26 -4.77 135.00 137.76 2i2t n PRO 11 Ca 0.04 0.00 -0.29 0.00 -2.02 0.00 0.00 63.50 61.23 2i2t n PRO 11 Cb 0.48 0.00 -0.15 0.00 -0.02 0.00 0.00 33.50 33.81 2i2t n PRO 11 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2i2t s ALA 12 N -2.90 1.07 0.00 3.55 0.00 -1.26 -4.79 121.76 117.43 2i2t s ALA 12 Ca 0.00 -1.25 0.00 0.00 0.00 0.00 0.00 51.96 50.71 2i2t s ALA 12 Cb 0.00 -1.45 0.00 0.00 0.00 0.00 0.00 23.12 21.67 2i2t s ALA 12 CO 0.00 -1.57 0.00 0.41 0.00 0.00 0.00 175.76 174.60 2i2t n GLY 13 N 5.05 1.58 3.84 0.00 0.00 -1.26 -5.11 105.19 109.29 2i2t n GLY 13 Ca -0.05 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.63 2i2t n GLY 13 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2i2t s VAL 14 N -1.71 4.78 0.00 1.61 -7.23 -1.26 -4.78 120.40 111.81 2i2t s VAL 14 Ca 0.00 0.88 0.00 0.00 -1.81 0.00 0.00 61.98 61.05 2i2t s VAL 14 Cb 0.00 -3.72 0.00 0.00 0.56 0.00 0.00 36.38 33.22 2i2t s VAL 14 CO 0.00 0.10 0.22 -0.67 -0.31 0.00 0.00 175.10 174.44 2i2t n ASP 15 N 0.41 0.00 -2.36 4.85 2.03 -0.66 -4.96 116.55 115.85 2i2t n ASP 15 Ca -0.02 0.22 -0.05 0.00 0.52 0.00 0.00 54.79 55.46 2i2t n ASP 15 Cb 0.52 0.00 0.01 0.00 -0.72 0.00 0.00 41.12 40.93 2i2t n ASP 15 CO 0.00 0.00 0.00 0.52 -1.92 0.00 0.00 177.20 175.80 2i2t n VAL 16 N -0.25 -7.74 -3.77 5.18 0.31 -1.25 -4.96 118.33 105.86 2i2t n VAL 16 Ca 0.00 0.54 -0.30 0.00 -0.01 0.00 0.00 64.34 64.57 2i2t n VAL 16 Cb 0.00 -6.08 -0.14 0.00 -0.91 0.00 0.00 33.84 26.71 2i2t n VAL 16 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 2i2t s LYS 17 N -2.06 1.29 0.27 5.55 2.47 -1.11 -5.05 119.74 121.10 2i2t s LYS 17 Ca 0.15 -1.92 -0.30 0.00 -1.56 0.00 0.00 55.97 52.35 2i2t s LYS 17 Cb -0.04 -2.46 -0.10 0.00 -1.46 0.00 0.00 37.83 33.77 2i2t s LYS 17 CO 0.49 -1.11 1.34 -1.50 0.16 0.00 0.00 175.35 174.73 2i2t s ILE 18 N 0.52 2.87 -0.59 5.43 2.07 -1.26 -3.85 121.20 126.39 2i2t s ILE 18 Ca 0.16 0.78 0.05 0.00 -1.41 0.00 0.00 60.65 60.23 2i2t s ILE 18 Cb -0.23 -3.50 0.32 0.00 0.13 0.00 0.00 42.46 39.18 2i2t s ILE 18 CO -0.04 0.15 0.90 0.59 -1.91 0.00 0.00 174.94 174.62 2i2t n ASN 19 N 1.80 4.27 0.00 4.50 5.03 0.12 -4.95 115.26 126.04 2i2t n ASN 19 Ca 0.04 -3.62 0.00 0.00 0.87 0.00 0.00 54.58 51.87 2i2t n ASN 19 Cb 0.42 -0.59 0.00 0.00 -1.02 0.00 0.00 39.78 38.59 2i2t n ASN 19 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2i2t n GLY 20 N 0.03 2.11 0.00 7.41 0.00 -1.26 -3.12 105.19 110.36 2i2t n GLY 20 Ca 0.31 -0.29 0.00 0.00 0.00 0.00 0.00 46.02 46.04 2i2t n GLY 20 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2i2t n GLN 21 N 0.00 -0.01 -3.47 1.61 1.13 -1.26 -5.01 117.38 110.37 2i2t n GLN 21 Ca 0.00 -0.00 -0.40 0.00 -1.94 0.00 0.00 57.00 54.66 2i2t n GLN 21 Cb 0.00 -0.49 -0.10 0.00 0.11 0.00 0.00 30.24 29.76 2i2t n GLN 21 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 2i2t s VAL 22 N -0.00 5.22 -0.44 5.09 1.01 -1.18 -3.31 120.40 126.80 2i2t s VAL 22 Ca 0.00 0.09 -0.08 0.00 0.00 0.00 0.00 61.98 62.00 2i2t s VAL 22 Cb 0.00 -3.72 0.10 0.00 0.00 0.00 0.00 36.38 32.76 2i2t s VAL 22 CO 0.00 0.03 0.28 -0.63 0.00 0.00 0.00 175.10 174.78 2i2t s ILE 23 N 1.91 4.01 -0.20 2.22 1.01 0.17 0.10 121.20 130.42 2i2t s ILE 23 Ca 0.10 -1.69 -0.07 0.00 0.00 0.00 0.00 60.65 58.98 2i2t s ILE 23 Cb -0.17 -3.59 -0.04 0.00 0.01 0.00 0.00 42.46 38.68 2i2t s ILE 23 CO 0.11 -0.65 0.06 0.42 0.00 0.00 0.00 174.94 174.89 2i2t s THR 24 N 1.34 4.67 -0.10 2.92 -4.23 -1.25 -2.97 115.64 116.02 2i2t s THR 24 Ca 0.05 -0.07 0.04 0.00 -1.18 0.00 0.00 61.69 60.53 2i2t s THR 24 Cb -0.24 -3.12 0.00 0.00 1.34 0.00 0.00 72.50 70.48 2i2t s THR 24 CO -0.00 0.43 -0.23 -0.63 -0.54 0.00 0.00 174.62 173.65 2i2t s ILE 25 N 0.68 1.97 0.18 2.99 1.09 -0.70 -2.73 121.20 124.68 2i2t s ILE 25 Ca 0.03 -0.96 0.10 0.00 -1.10 0.00 0.00 60.65 58.72 2i2t s ILE 25 Cb -0.13 -1.71 -0.04 0.00 -1.06 0.00 0.00 42.46 39.51 2i2t s ILE 25 CO 0.02 0.54 -0.14 -0.75 -0.10 0.00 0.00 174.94 174.51 2i2t s LYS 26 N 0.45 1.89 -0.01 2.79 2.20 -1.26 -0.23 119.74 125.57 2i2t s LYS 26 Ca -0.17 -1.34 -0.27 0.00 -0.36 0.00 0.00 55.97 53.82 2i2t s LYS 26 Cb -0.17 -2.07 0.09 0.00 -1.51 0.00 0.00 37.83 34.17 2i2t s LYS 26 CO 0.07 0.43 1.25 0.41 -0.36 0.00 0.00 175.35 177.14 2i2t n GLY 27 N 0.12 0.25 3.75 5.54 0.00 -0.43 -1.65 105.19 112.77 2i2t n GLY 27 Ca -0.11 -1.05 -0.41 0.00 0.00 0.00 0.00 46.02 44.44 2i2t n GLY 27 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2i2t s LYS 28 N -2.02 4.16 0.00 1.61 -2.85 -1.13 -2.89 119.74 116.63 2i2t s LYS 28 Ca 0.29 2.51 0.00 0.00 -1.00 0.00 0.00 55.97 57.77 2i2t s LYS 28 Cb -0.01 -3.04 0.00 0.00 -2.06 0.00 0.00 37.83 32.73 2i2t s LYS 28 CO -0.00 -0.56 0.00 -1.71 0.10 0.00 0.00 175.35 173.18 2i2t n ASN 29 N 1.92 0.00 -4.55 0.03 5.15 -1.26 -3.57 115.26 112.98 2i2t n ASN 29 Ca 0.07 0.00 -0.35 0.00 -0.60 0.00 0.00 54.58 53.69 2i2t n ASN 29 Cb 0.38 0.00 -0.03 0.00 -0.53 0.00 0.00 39.78 39.60 2i2t n ASN 29 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 2i2t s GLY 30 N 0.00 -0.42 -1.40 8.20 0.00 -1.14 -4.83 107.32 107.73 2i2t s GLY 30 Ca 0.00 -0.06 -0.12 0.00 0.00 0.00 0.00 44.72 44.54 2i2t s GLY 30 CO 0.00 4.10 2.14 -2.21 0.00 0.00 0.00 173.10 177.13 2i2t n GLU 31 N 9.02 3.24 -1.12 2.90 4.07 -1.26 -1.31 120.64 136.16 2i2t n GLU 31 Ca 0.36 -2.95 0.00 0.00 -0.06 0.00 0.00 57.16 54.51 2i2t n GLU 31 Cb 0.54 -3.11 0.00 0.00 -0.06 0.00 0.00 31.44 28.81 2i2t n GLU 31 CO 0.00 0.00 0.00 1.28 -0.06 0.00 0.00 177.13 178.35 2i2t n LEU 32 N 5.00 -1.23 -3.33 4.31 4.32 -1.25 -5.01 117.00 119.82 2i2t n LEU 32 Ca 0.49 2.04 -0.11 0.00 -0.02 0.00 0.00 56.01 58.41 2i2t n LEU 32 Cb 0.37 -1.95 -0.07 0.00 -1.62 0.00 0.00 43.42 40.14 2i2t n LEU 32 CO 0.86 -0.55 -0.10 0.42 -1.22 0.00 0.00 177.39 176.80 2i2t s THR 33 N -4.94 -0.57 -0.04 -5.08 -4.23 0.68 -4.92 115.64 96.54 2i2t s THR 33 Ca 0.00 -0.35 -0.17 0.00 -1.18 0.00 0.00 61.69 59.99 2i2t s THR 33 Cb 0.00 -0.99 -0.05 0.00 1.34 0.00 0.00 72.50 72.80 2i2t s THR 33 CO 0.00 -0.33 0.46 0.00 -0.54 0.00 0.00 174.62 174.21 2i2t s ARG 34 N 2.49 4.15 -0.09 3.99 3.03 -1.26 -1.71 118.95 129.54 2i2t s ARG 34 Ca 0.10 0.48 -0.28 0.00 2.03 0.00 0.00 55.73 58.05 2i2t s ARG 34 Cb -0.13 -3.32 0.07 0.00 -1.03 0.00 0.00 34.95 30.54 2i2t s ARG 34 CO -0.31 0.45 0.66 0.99 -1.13 0.00 0.00 175.30 175.96 2i2t s THR 35 N -0.35 0.00 0.43 4.99 2.01 -1.16 -5.00 115.64 116.57 2i2t s THR 35 Ca 0.25 -0.03 0.07 0.00 0.31 0.00 0.00 61.69 62.29 2i2t s THR 35 Cb -0.16 -0.97 0.07 0.00 0.01 0.00 0.00 72.50 71.45 2i2t s THR 35 CO 0.13 -0.02 0.55 0.18 -0.69 0.00 0.00 174.62 174.78 2i2t n LEU 36 N 1.33 0.00 0.00 4.42 7.99 -1.26 -0.66 117.00 128.82 2i2t n LEU 36 Ca -0.18 -1.92 0.00 0.00 -0.01 0.00 0.00 56.01 53.90 2i2t n LEU 36 Cb 0.57 -0.27 0.00 0.00 -0.11 0.00 0.00 43.42 43.60 2i2t n LEU 36 CO 0.19 -0.63 0.00 0.59 -1.51 0.00 0.00 177.39 176.03 2i2t n ASN 37 N -2.40 0.00 0.00 -1.43 4.13 -1.21 -4.88 115.26 109.47 2i2t n ASN 37 Ca 0.10 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.36 2i2t n ASN 37 Cb 0.45 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.69 2i2t n ASN 37 CO 0.00 0.00 0.00 -0.90 0.28 0.00 0.00 177.26 176.64 2i2t n ASP 38 N 0.00 0.00 -2.74 6.41 5.75 -1.26 -5.01 116.55 119.70 2i2t n ASP 38 Ca 0.00 0.00 -0.08 0.00 -0.01 0.00 0.00 54.79 54.70 2i2t n ASP 38 Cb 0.00 0.00 0.06 0.00 -1.03 0.00 0.00 41.12 40.15 2i2t n ASP 38 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2i2t n ALA 39 N 0.00 -1.67 -2.87 2.12 0.00 -1.26 -5.11 120.51 111.72 2i2t n ALA 39 Ca 0.00 -1.25 0.00 0.00 0.00 0.00 0.00 53.44 52.19 2i2t n ALA 39 Cb 0.00 -1.60 0.00 0.00 0.00 0.00 0.00 19.45 17.85 2i2t n ALA 39 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2i2t n VAL 40 N 1.51 0.00 0.00 0.00 0.31 -1.26 -4.44 118.33 114.45 2i2t n VAL 40 Ca 0.08 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.41 2i2t n VAL 40 Cb 0.65 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.58 2i2t n VAL 40 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 2i2t n GLU 41 N 0.00 0.00 -1.99 5.55 2.13 0.16 -4.03 120.64 122.46 2i2t n GLU 41 Ca 0.00 0.00 -0.42 0.00 0.66 0.00 0.00 57.16 57.40 2i2t n GLU 41 Cb 0.00 0.00 -0.03 0.00 0.27 0.00 0.00 31.44 31.68 2i2t n GLU 41 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 2i2t s VAL 42 N 0.00 2.78 0.37 6.31 0.11 -1.26 -3.70 120.40 125.01 2i2t s VAL 42 Ca 0.00 0.56 0.08 0.00 -2.93 0.00 0.00 61.98 59.69 2i2t s VAL 42 Cb 0.00 -3.36 -0.06 0.00 -1.53 0.00 0.00 36.38 31.43 2i2t s VAL 42 CO 0.00 0.04 0.04 -0.54 -3.33 0.00 0.00 175.10 171.32 2i2t s LYS 43 N 1.13 2.08 -0.21 1.54 1.02 -0.39 -4.92 119.74 119.99 2i2t s LYS 43 Ca 0.69 -1.83 -0.10 0.00 0.02 0.00 0.00 55.97 54.75 2i2t s LYS 43 Cb -0.42 -1.89 -0.09 0.00 -0.52 0.00 0.00 37.83 34.91 2i2t s LYS 43 CO 0.31 0.05 -0.26 1.58 -0.92 0.00 0.00 175.35 176.11 2i2t n HIS 44 N -1.01 0.00 0.00 3.18 -0.00 -1.26 0.61 115.22 116.74 2i2t n HIS 44 Ca -0.04 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.14 2i2t n HIS 44 Cb 0.64 -0.75 0.00 0.00 -0.12 0.00 0.00 29.99 29.75 2i2t n HIS 44 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 2i2t n ALA 45 N -3.88 0.00 -1.20 1.57 0.00 -1.26 -3.72 120.51 112.02 2i2t n ALA 45 Ca -0.41 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.03 2i2t n ALA 45 Cb 0.80 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.25 2i2t n ALA 45 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2i2t n ASP 46 N 9.56 0.00 -1.73 0.00 10.43 -1.26 -4.84 116.55 128.71 2i2t n ASP 46 Ca 0.00 0.00 -0.12 0.00 2.57 0.00 0.00 54.79 57.24 2i2t n ASP 46 Cb 0.00 0.00 0.04 0.00 1.84 0.00 0.00 41.12 43.00 2i2t n ASP 46 CO 0.00 0.00 0.00 0.59 -1.07 0.00 0.00 177.20 176.72 2i2t n ASN 47 N 0.00 5.61 0.00 -2.24 4.13 -1.26 -4.78 115.26 116.72 2i2t n ASN 47 Ca 0.00 -2.84 0.00 0.00 1.68 0.00 0.00 54.58 53.42 2i2t n ASN 47 Cb 0.00 -0.98 0.00 0.00 -1.54 0.00 0.00 39.78 37.26 2i2t n ASN 47 CO 0.00 0.00 0.00 0.35 0.28 0.00 0.00 177.26 177.89 2i2t n THR 48 N 0.48 0.00 -3.16 3.41 -2.24 -1.24 -2.64 114.28 108.89 2i2t n THR 48 Ca 0.22 0.00 0.04 0.00 -2.27 0.00 0.00 64.05 62.04 2i2t n THR 48 Cb 0.63 0.00 -0.01 0.00 -2.10 0.00 0.00 70.33 68.85 2i2t n THR 48 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 2i2t s LEU 49 N 0.00 -1.33 0.41 3.22 2.96 -0.92 -4.37 118.68 118.64 2i2t s LEU 49 Ca 0.00 0.87 -0.01 0.00 -0.22 0.00 0.00 54.13 54.77 2i2t s LEU 49 Cb 0.00 2.13 -0.03 0.00 0.50 0.00 0.00 46.19 48.79 2i2t s LEU 49 CO 0.00 -0.25 0.65 -0.89 -1.32 0.00 0.00 176.35 174.54 2i2t s THR 50 N 2.87 4.81 -0.13 3.68 2.01 0.20 -4.20 115.64 124.88 2i2t s THR 50 Ca 0.19 -0.27 -0.07 0.00 0.31 0.00 0.00 61.69 61.84 2i2t s THR 50 Cb -0.15 -3.78 0.05 0.00 0.01 0.00 0.00 72.50 68.63 2i2t s THR 50 CO -0.20 -0.60 0.32 -0.36 -0.69 0.00 0.00 174.62 173.08 2i2t s PHE 51 N -2.50 -0.43 -0.30 4.92 0.08 -1.26 -1.26 117.98 117.23 2i2t s PHE 51 Ca 0.44 0.98 -0.29 0.00 0.12 0.00 0.00 56.93 58.18 2i2t s PHE 51 Cb -0.10 0.14 0.20 0.00 -0.57 0.00 0.00 43.02 42.69 2i2t s PHE 51 CO 0.39 -0.27 1.39 0.20 -0.10 0.00 0.00 175.22 176.84 2i2t s GLY 52 N 1.20 0.14 0.13 4.36 0.00 -1.24 -4.80 107.32 107.11 2i2t s GLY 52 Ca -0.08 2.95 -0.01 0.00 0.00 0.00 0.00 44.72 47.58 2i2t s GLY 52 CO -0.09 1.18 0.18 -1.05 0.00 0.00 0.00 173.10 173.31 2i2t n PRO 53 N 0.58 0.28 -1.05 2.90 -0.02 -1.26 0.35 135.00 136.77 2i2t n PRO 53 Ca -0.00 -0.40 0.00 0.00 -2.02 0.00 0.00 63.50 61.07 2i2t n PRO 53 Cb 0.59 -0.14 0.00 0.00 -0.02 0.00 0.00 33.50 33.92 2i2t n PRO 53 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 2i2t n ARG 54 N -1.35 1.38 -1.45 -0.52 0.00 -1.26 -4.75 116.66 108.72 2i2t n ARG 54 Ca 0.03 0.00 -0.30 0.00 -0.00 0.00 0.00 57.85 57.57 2i2t n ARG 54 Cb 0.09 0.00 0.09 0.00 0.00 0.00 0.00 32.46 32.64 2i2t n ARG 54 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 2i2t s ASP 55 N -0.05 4.52 0.00 6.15 1.11 -1.26 -4.11 116.67 123.03 2i2t s ASP 55 Ca 0.00 1.49 0.00 0.00 0.18 0.00 0.00 52.55 54.22 2i2t s ASP 55 Cb 0.00 -2.25 0.00 0.00 1.07 0.00 0.00 42.92 41.74 2i2t s ASP 55 CO 0.00 -1.98 0.00 0.61 1.18 0.00 0.00 175.17 174.98 2i2t n GLY 56 N -1.76 1.32 3.55 0.21 0.00 -1.26 -4.86 105.19 102.39 2i2t n GLY 56 Ca 0.07 -0.02 -0.33 0.00 0.00 0.00 0.00 46.02 45.74 2i2t n GLY 56 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2i2t s TYR 57 N 0.00 1.26 0.05 1.61 1.51 -1.26 -4.79 117.35 115.74 2i2t s TYR 57 Ca 0.00 1.39 -0.13 0.00 -1.01 0.00 0.00 57.07 57.32 2i2t s TYR 57 Cb 0.00 -3.71 -0.30 0.00 -0.11 0.00 0.00 41.96 37.84 2i2t s TYR 57 CO 0.00 -2.32 1.08 0.00 -1.11 0.00 0.00 175.55 173.20 2i2t h ALA 58 N 17.24 -0.03 0.00 3.71 0.00 -1.89 -3.08 119.26 135.21 2i2t h ALA 58 Ca -0.20 -0.83 0.00 0.00 0.00 0.00 0.00 54.91 53.89 2i2t h ALA 58 Cb 1.20 0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.10 2i2t h ALA 58 CO 1.16 0.75 0.00 -0.40 0.00 0.00 0.00 179.25 180.76 2i2t n ASP 59 N -3.71 0.00 -3.07 0.00 5.75 -1.26 -4.74 116.55 109.52 2i2t n ASP 59 Ca -0.14 -0.75 -0.09 0.00 -0.01 0.00 0.00 54.79 53.80 2i2t n ASP 59 Cb 1.03 0.00 0.08 0.00 -1.03 0.00 0.00 41.12 41.21 2i2t n ASP 59 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2i2t n GLY 60 N -0.12 -3.72 5.00 6.12 0.00 -1.17 -3.24 105.19 108.07 2i2t n GLY 60 Ca 0.01 -1.22 0.00 0.00 0.00 0.00 0.00 46.02 44.81 2i2t n GLY 60 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2i2t n TRP 61 N -3.80 0.00 -0.10 1.61 7.02 -1.26 -3.91 117.44 116.99 2i2t n TRP 61 Ca 0.04 0.00 -0.07 0.00 -1.02 0.00 0.00 57.50 56.45 2i2t n TRP 61 Cb 0.17 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.07 2i2t n TRP 61 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2i2t h ALA 62 N 0.00 0.44 0.00 6.99 0.00 -1.93 0.79 119.26 125.55 2i2t h ALA 62 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2i2t h ALA 62 Cb 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.72 2i2t h ALA 62 CO 0.00 -0.18 0.00 0.94 0.00 0.00 0.00 179.25 180.01 2i2t n GLN 63 N -4.92 0.14 -0.11 0.00 -0.06 -1.20 -2.48 117.38 108.74 2i2t n GLN 63 Ca 0.00 0.18 -0.22 0.00 -2.00 0.00 0.00 57.00 54.96 2i2t n GLN 63 Cb 0.07 -1.50 -0.09 0.00 -4.06 0.00 0.00 30.24 24.66 2i2t n GLN 63 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 2i2t n ALA 64 N -1.37 0.91 -0.18 1.69 0.00 0.98 -3.85 120.51 118.71 2i2t n ALA 64 Ca 0.06 -0.74 0.21 0.00 0.00 0.00 0.00 53.44 52.96 2i2t n ALA 64 Cb 0.14 -0.19 0.58 0.00 0.00 0.00 0.00 19.45 19.99 2i2t n ALA 64 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2i2t h GLY 65 N -1.00 0.52 0.36 0.00 0.00 0.53 0.30 103.07 103.78 2i2t h GLY 65 Ca -0.42 -0.12 -0.02 0.00 0.00 0.00 0.00 47.33 46.78 2i2t h GLY 65 CO -0.25 0.01 -0.17 -0.91 0.00 0.00 0.00 176.54 175.21 2i2t h THR 66 N 0.26 0.00 -1.16 4.70 1.35 -1.66 -1.87 112.91 114.52 2i2t h THR 66 Ca 0.41 -0.02 0.33 0.00 -0.55 0.00 0.00 66.41 66.58 2i2t h THR 66 Cb 1.20 0.00 -0.10 0.00 -1.73 0.00 0.00 68.15 67.52 2i2t h THR 66 CO -0.10 0.00 0.76 0.00 -0.25 0.00 0.00 175.52 175.93 2i2t h ALA 67 N -1.76 2.52 -0.16 6.62 0.00 -1.46 1.38 119.26 126.40 2i2t h ALA 67 Ca -0.05 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2i2t h ALA 67 Cb 0.37 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2i2t h ALA 67 CO 0.08 -0.99 0.00 -2.13 0.00 0.00 0.00 179.25 176.21 2i2t n ARG 68 N -4.59 0.00 0.28 0.00 0.00 0.02 0.19 116.66 112.56 2i2t n ARG 68 Ca 0.29 0.59 0.14 0.00 -0.00 0.00 0.00 57.85 58.87 2i2t n ARG 68 Cb 1.11 -1.47 0.83 0.00 0.00 0.00 0.00 32.46 32.93 2i2t n ARG 68 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2i2t h ALA 69 N -1.78 1.42 -0.28 5.13 0.00 -0.42 0.11 119.26 123.44 2i2t h ALA 69 Ca 0.00 -0.05 -0.11 0.00 0.00 0.00 0.00 54.91 54.75 2i2t h ALA 69 Cb 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 2i2t h ALA 69 CO 0.00 0.07 -0.30 1.25 0.00 0.00 0.00 179.25 180.27 2i2t h LEU 70 N 0.00 0.59 0.00 0.00 7.12 0.24 -2.70 115.31 120.57 2i2t h LEU 70 Ca -0.00 -0.23 -0.04 0.00 0.13 0.00 0.00 57.88 57.75 2i2t h LEU 70 Cb 0.15 -0.16 -0.01 0.00 -0.53 0.00 0.00 40.66 40.11 2i2t h LEU 70 CO 0.01 0.86 -0.25 -0.07 -0.13 0.00 0.00 178.44 178.86 2i2t h LEU 71 N 0.49 0.00 -0.79 2.25 -0.00 0.38 -3.18 115.31 114.47 2i2t h LEU 71 Ca 0.06 -0.56 0.00 0.00 -0.00 0.00 0.00 57.88 57.39 2i2t h LEU 71 Cb 0.77 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.43 2i2t h LEU 71 CO 0.06 0.92 0.20 -0.46 -0.00 0.00 0.00 178.44 179.16 2i2t n ASN 72 N -4.63 0.31 -0.00 -0.43 6.94 0.20 -0.04 115.26 117.60 2i2t n ASN 72 Ca -0.11 0.55 -0.19 0.00 -0.02 0.00 0.00 54.58 54.81 2i2t n ASN 72 Cb 0.36 -0.54 -0.14 0.00 -2.36 0.00 0.00 39.78 37.10 2i2t n ASN 72 CO 0.00 0.00 0.00 -1.54 -1.03 0.00 0.00 177.26 174.69 2i2t n SER 73 N -1.93 1.93 -0.17 0.53 3.41 -1.02 -3.80 113.62 112.57 2i2t n SER 73 Ca -0.01 0.22 -0.03 0.00 -0.26 0.00 0.00 58.87 58.80 2i2t n SER 73 Cb 0.22 -0.72 0.07 0.00 -0.26 0.00 0.00 64.21 63.52 2i2t n SER 73 CO 0.00 0.00 0.00 0.24 -0.16 0.00 0.00 175.04 175.12 2i2t h MET 74 N 0.06 0.39 -0.09 4.33 2.86 -0.44 -1.60 114.93 120.45 2i2t h MET 74 Ca -0.41 -0.02 0.04 0.00 -2.06 0.00 0.00 59.70 57.24 2i2t h MET 74 Cb 2.03 -0.09 -0.04 0.00 0.06 0.00 0.00 31.60 33.56 2i2t h MET 74 CO 0.08 0.26 -0.15 0.28 1.06 0.00 0.00 176.91 178.44 2i2t h VAL 75 N 0.41 0.61 -0.59 -2.22 2.07 -1.64 0.15 116.25 115.04 2i2t h VAL 75 Ca 0.25 0.00 0.17 0.00 0.82 0.00 0.00 66.70 67.94 2i2t h VAL 75 Cb 0.26 0.61 -0.02 0.00 -1.52 0.00 0.00 31.29 30.61 2i2t h VAL 75 CO -0.24 0.00 0.42 0.40 0.02 0.00 0.00 177.57 178.17 2i2t h ILE 76 N -0.21 0.71 -0.45 4.57 1.08 -1.49 0.68 117.51 122.40 2i2t h ILE 76 Ca 0.08 -0.00 -0.14 0.00 -0.39 0.00 0.00 64.86 64.40 2i2t h ILE 76 Cb 0.32 0.70 -0.01 0.00 -3.07 0.00 0.00 36.82 34.76 2i2t h ILE 76 CO -0.21 0.00 -0.27 1.23 -0.69 0.00 0.00 178.15 178.22 2i2t h GLY 77 N 0.01 1.05 -3.20 5.37 0.00 0.19 0.64 103.07 107.13 2i2t h GLY 77 Ca 0.28 -0.97 -0.21 0.00 0.00 0.00 0.00 47.33 46.42 2i2t h GLY 77 CO -0.01 0.88 0.27 3.33 0.00 0.00 0.00 176.54 181.02 2i2t n VAL 78 N -4.09 2.35 0.00 4.60 0.24 0.21 -2.90 118.33 118.73 2i2t n VAL 78 Ca -0.01 -1.23 0.00 0.00 -2.04 0.00 0.00 64.34 61.06 2i2t n VAL 78 Cb 0.48 -0.50 0.00 0.00 -1.47 0.00 0.00 33.84 32.36 2i2t n VAL 78 CO 0.00 0.00 0.00 0.41 -2.14 0.00 0.00 176.83 175.10 2i2t n THR 79 N -0.20 0.00 0.77 3.34 -1.04 0.52 -2.83 114.28 114.84 2i2t n THR 79 Ca 0.33 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.34 2i2t n THR 79 Cb 1.18 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.69 2i2t n THR 79 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2i2t n GLU 80 N 0.00 0.39 0.00 -2.82 -0.58 0.05 -4.86 120.64 112.81 2i2t n GLU 80 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 2i2t n GLU 80 Cb 0.00 -1.00 0.00 0.00 -0.57 0.00 0.00 31.44 29.87 2i2t n GLU 80 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2i2t n GLY 81 N -0.11 1.69 3.43 0.62 0.00 0.20 -4.85 105.19 106.17 2i2t n GLY 81 Ca 0.00 -0.49 -0.16 0.00 0.00 0.00 0.00 46.02 45.38 2i2t n GLY 81 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2i2t s PHE 82 N 0.00 -0.50 0.49 1.61 0.08 0.70 -4.07 117.98 116.28 2i2t s PHE 82 Ca 0.00 0.75 -0.08 0.00 0.12 0.00 0.00 56.93 57.72 2i2t s PHE 82 Cb 0.00 0.35 0.11 0.00 -0.57 0.00 0.00 43.02 42.91 2i2t s PHE 82 CO 0.00 -0.60 0.64 0.25 -0.10 0.00 0.00 175.22 175.41 2i2t n THR 83 N 0.75 0.00 0.00 0.64 -2.24 -1.26 -2.64 114.28 109.53 2i2t n THR 83 Ca -0.19 -0.45 0.00 0.00 -2.27 0.00 0.00 64.05 61.14 2i2t n THR 83 Cb 0.58 -1.70 0.00 0.00 -2.10 0.00 0.00 70.33 67.11 2i2t n THR 83 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 2i2t n LYS 84 N -2.44 0.00 -1.85 -0.78 0.00 -1.26 -4.47 118.16 107.35 2i2t n LYS 84 Ca 0.08 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.39 2i2t n LYS 84 Cb 0.28 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.31 2i2t n LYS 84 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.40 177.76 2i2t n LYS 85 N -0.18 -3.68 -3.18 -1.58 0.00 -1.24 -4.90 118.16 103.40 2i2t n LYS 85 Ca 0.00 2.62 0.02 0.00 -0.00 0.00 0.00 58.31 60.96 2i2t n LYS 85 Cb 0.00 -3.04 -0.01 0.00 -0.00 0.00 0.00 35.03 31.99 2i2t n LYS 85 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 2i2t s LEU 86 N -1.07 -1.57 0.00 -5.58 1.02 0.62 -4.42 118.68 107.68 2i2t s LEU 86 Ca 0.00 -0.35 0.00 0.00 0.02 0.00 0.00 54.13 53.80 2i2t s LEU 86 Cb 0.00 1.98 0.00 0.00 0.02 0.00 0.00 46.19 48.19 2i2t s LEU 86 CO 0.00 -0.22 0.00 0.00 0.02 0.00 0.00 176.35 176.15 2i2t n GLN 87 N 4.85 0.59 -3.64 1.70 10.64 0.17 -0.85 117.38 130.84 2i2t n GLN 87 Ca 0.08 0.00 -0.06 0.00 -1.83 0.00 0.00 57.00 55.19 2i2t n GLN 87 Cb 0.56 0.00 -0.07 0.00 -0.86 0.00 0.00 30.24 29.87 2i2t n GLN 87 CO 0.00 0.00 0.00 -0.48 -1.83 0.00 0.00 177.06 174.75 2i2t s LEU 88 N 0.00 -0.50 0.00 2.61 0.05 -1.24 -2.01 118.68 117.59 2i2t s LEU 88 Ca 0.00 0.87 0.00 0.00 0.05 0.00 0.00 54.13 55.05 2i2t s LEU 88 Cb 0.00 1.84 0.00 0.00 -2.05 0.00 0.00 46.19 45.98 2i2t s LEU 88 CO 0.00 -0.14 0.00 0.52 -0.55 0.00 0.00 176.35 176.18 2i2t n VAL 89 N 3.01 0.00 -1.10 1.48 0.31 -1.03 -4.88 118.33 116.12 2i2t n VAL 89 Ca -0.16 0.00 0.13 0.00 -0.01 0.00 0.00 64.34 64.31 2i2t n VAL 89 Cb 0.57 0.00 -0.07 0.00 -0.91 0.00 0.00 33.84 33.43 2i2t n VAL 89 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2i2t n GLY 90 N 5.00 -3.17 0.00 2.92 0.00 -1.26 -4.46 105.19 104.22 2i2t n GLY 90 Ca 0.00 -1.14 0.00 0.00 0.00 0.00 0.00 46.02 44.88 2i2t n GLY 90 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2i2t n VAL 91 N -3.79 0.00 -1.50 1.61 0.24 -1.26 -4.53 118.33 109.10 2i2t n VAL 91 Ca -0.07 0.00 -0.15 0.00 -2.04 0.00 0.00 64.34 62.08 2i2t n VAL 91 Cb 0.52 0.00 -0.12 0.00 -1.47 0.00 0.00 33.84 32.78 2i2t n VAL 91 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2i2t n GLY 92 N 2.02 -0.29 0.00 7.63 0.00 -1.26 -4.45 105.19 108.84 2i2t n GLY 92 Ca 0.00 0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.18 2i2t n GLY 92 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2i2t n TYR 93 N 13.95 0.00 0.00 1.61 0.53 -1.25 -4.40 117.16 127.59 2i2t n TYR 93 Ca 0.48 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 57.36 2i2t n TYR 93 Cb 0.36 0.00 0.00 0.00 -1.03 0.00 0.00 39.34 38.67 2i2t n TYR 93 CO 0.00 0.00 0.00 2.89 -1.02 0.00 0.00 176.86 178.73 2i2t n ARG 94 N -2.24 0.00 0.00 -0.72 1.85 -1.26 -3.57 116.66 110.72 2i2t n ARG 94 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.85 2i2t n ARG 94 Cb 0.50 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.91 2i2t n ARG 94 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2i2t n ALA 95 N 0.69 0.00 -1.00 2.89 0.00 0.56 -4.62 120.51 119.03 2i2t n ALA 95 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2i2t n ALA 95 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2i2t n ALA 95 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2i2t n ALA 96 N -3.00 0.00 -2.15 0.00 0.00 -1.21 -4.62 120.51 109.53 2i2t n ALA 96 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.42 2i2t n ALA 96 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.44 2i2t n ALA 96 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2i2t n VAL 97 N -0.04-10.73 -3.40 0.00 0.31 -1.26 -4.70 118.33 98.50 2i2t n VAL 97 Ca 0.00 2.33 -0.27 0.00 -0.01 0.00 0.00 64.34 66.39 2i2t n VAL 97 Cb 0.00 -5.57 -0.10 0.00 -0.91 0.00 0.00 33.84 27.27 2i2t n VAL 97 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 2i2t n LYS 98 N 1.37 0.34 0.00 5.55 5.02 -1.19 -4.95 118.16 124.30 2i2t n LYS 98 Ca -0.13 -3.26 0.00 0.00 -2.02 0.00 0.00 58.31 52.90 2i2t n LYS 98 Cb 0.20 -1.67 0.00 0.00 -0.02 0.00 0.00 35.03 33.54 2i2t n LYS 98 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2i2t n GLY 99 N 2.65 0.86 0.13 0.72 0.00 -1.26 -4.41 105.19 103.87 2i2t n GLY 99 Ca 0.29 -1.27 -0.08 0.00 0.00 0.00 0.00 46.02 44.95 2i2t n GLY 99 CO 0.00 0.00 0.00 3.45 0.00 0.00 0.00 173.32 176.77 2i2t h ASN 100 N 0.18 -0.18 -3.47 1.61 -0.00 -1.96 -3.46 115.58 108.29 2i2t h ASN 100 Ca 0.00 -0.28 -0.42 0.00 -0.00 0.00 0.00 56.30 55.60 2i2t h ASN 100 Cb 0.00 0.05 0.19 0.00 -0.00 0.00 0.00 38.32 38.56 2i2t h ASN 100 CO 0.00 0.39 0.08 0.68 -0.00 0.00 0.00 177.43 178.58 2i2t s VAL 101 N -2.89 1.70 -0.05 6.14 -7.23 -1.26 -3.60 120.40 113.21 2i2t s VAL 101 Ca -0.10 0.00 -0.02 0.00 -1.81 0.00 0.00 61.98 60.05 2i2t s VAL 101 Cb 0.00 -2.35 0.03 0.00 0.56 0.00 0.00 36.38 34.62 2i2t s VAL 101 CO 0.36 0.00 0.05 -0.63 -0.31 0.00 0.00 175.10 174.56 2i2t s ILE 102 N -2.78 0.02 0.32 -0.62 1.01 -0.21 -3.14 121.20 115.79 2i2t s ILE 102 Ca 0.69 0.34 -0.16 0.00 0.00 0.00 0.00 60.65 61.51 2i2t s ILE 102 Cb -0.15 -0.26 -0.09 0.00 0.01 0.00 0.00 42.46 41.97 2i2t s ILE 102 CO 0.58 0.19 0.76 0.21 0.00 0.00 0.00 174.94 176.68 2i2t s ASN 103 N 2.12 6.84 0.15 3.58 3.84 -1.26 -0.71 114.94 129.50 2i2t s ASN 103 Ca 0.05 1.34 -0.00 0.00 0.21 0.00 0.00 52.86 54.46 2i2t s ASN 103 Cb -0.12 -2.40 0.00 0.00 -0.55 0.00 0.00 41.25 38.18 2i2t s ASN 103 CO -0.04 -0.18 0.21 0.18 -2.79 0.00 0.00 177.10 174.48 2i2t n LEU 104 N -0.21 0.00 -3.19 3.21 4.77 -1.26 -3.31 117.00 117.00 2i2t n LEU 104 Ca 0.03 -1.25 0.05 0.00 -0.03 0.00 0.00 56.01 54.81 2i2t n LEU 104 Cb 0.53 1.08 -0.02 0.00 -2.33 0.00 0.00 43.42 42.67 2i2t n LEU 104 CO 0.41 -0.28 0.61 -0.55 -1.33 0.00 0.00 177.39 176.25 2i2t s SER 105 N -1.95 -0.47 -0.02 -1.43 0.15 -1.23 -3.93 113.70 104.82 2i2t s SER 105 Ca 0.13 0.37 0.03 0.00 0.70 0.00 0.00 55.95 57.18 2i2t s SER 105 Cb -0.00 1.43 0.04 0.00 -1.71 0.00 0.00 66.02 65.77 2i2t s SER 105 CO 0.09 -0.09 0.99 0.18 1.20 0.00 0.00 173.24 175.61 2i2t n LEU 106 N 5.31 1.90 0.00 3.45 4.77 -1.26 -3.87 117.00 127.30 2i2t n LEU 106 Ca -0.07 -2.01 0.00 0.00 -0.03 0.00 0.00 56.01 53.89 2i2t n LEU 106 Cb 0.54 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.57 2i2t n LEU 106 CO -0.09 0.49 0.00 0.61 -1.33 0.00 0.00 177.39 177.08 2i2t n GLY 107 N -0.59 1.58 3.70 -0.72 0.00 -1.26 -5.00 105.19 102.90 2i2t n GLY 107 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 2i2t n GLY 107 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2i2t s PHE 108 N -2.10 2.53 -1.36 1.61 0.40 -1.26 -4.83 117.98 112.97 2i2t s PHE 108 Ca 0.00 0.29 0.00 0.00 -0.60 0.00 0.00 56.93 56.62 2i2t s PHE 108 Cb 0.00 -4.03 0.00 0.00 0.51 0.00 0.00 43.02 39.50 2i2t s PHE 108 CO 0.00 -4.09 0.56 0.45 0.70 0.00 0.00 175.22 172.83 2i2t n SER 109 N 5.11 0.00 -4.09 1.36 2.88 -1.26 -4.54 113.62 113.07 2i2t n SER 109 Ca 0.16 0.12 -0.14 0.00 -1.33 0.00 0.00 58.87 57.68 2i2t n SER 109 Cb 0.39 -0.12 -0.11 0.00 -0.75 0.00 0.00 64.21 63.61 2i2t n SER 109 CO 0.00 0.00 0.00 -1.38 -1.23 0.00 0.00 175.04 172.43 2i2t s HIS 110 N -2.11 0.81 0.83 0.66 -3.43 -1.26 -5.14 115.29 105.64 2i2t s HIS 110 Ca 0.00 -0.51 -0.16 0.00 -0.80 0.00 0.00 55.06 53.59 2i2t s HIS 110 Cb 0.00 -0.47 -0.08 0.00 -1.43 0.00 0.00 32.58 30.60 2i2t s HIS 110 CO 0.00 -0.05 -0.04 -2.30 -2.00 0.00 0.00 174.74 170.35 2i2t n PRO 111 N 1.35 0.02 0.00 -0.38 -0.02 -1.26 -4.98 135.00 129.74 2i2t n PRO 111 Ca -0.22 0.03 0.00 0.00 -2.02 0.00 0.00 63.50 61.29 2i2t n PRO 111 Cb 0.55 -1.43 0.00 0.00 -0.02 0.00 0.00 33.50 32.59 2i2t n PRO 111 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2i2t n VAL 112 N -2.55 0.00 -2.40 -1.45 0.31 -1.25 -5.04 118.33 105.95 2i2t n VAL 112 Ca 0.05 0.00 -0.02 0.00 -0.01 0.00 0.00 64.34 64.36 2i2t n VAL 112 Cb 0.52 -0.36 -0.02 0.00 -0.91 0.00 0.00 33.84 33.07 2i2t n VAL 112 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 2i2t n ASP 113 N 0.00 -5.68 -3.95 4.52 8.00 -1.20 -4.89 116.55 113.35 2i2t n ASP 113 Ca 0.00 1.60 -0.26 0.00 0.71 0.00 0.00 54.79 56.83 2i2t n ASP 113 Cb 0.00 -5.08 -0.17 0.00 -0.02 0.00 0.00 41.12 35.85 2i2t n ASP 113 CO 0.00 0.00 0.00 -2.28 -0.39 0.00 0.00 177.20 174.53 2i2t s HIS 114 N -0.60 1.49 1.08 1.24 5.65 0.11 -4.90 115.29 119.37 2i2t s HIS 114 Ca -0.11 -0.69 -0.17 0.00 0.25 0.00 0.00 55.06 54.34 2i2t s HIS 114 Cb 0.01 -1.19 0.23 0.00 -1.18 0.00 0.00 32.58 30.45 2i2t s HIS 114 CO 0.31 -0.44 1.17 1.14 -0.65 0.00 0.00 174.74 176.26 2i2t s GLN 115 N 1.36 -0.27 -0.07 2.88 0.00 -1.26 -1.05 119.66 121.24 2i2t s GLN 115 Ca -0.01 -0.06 0.05 0.00 -0.00 0.00 0.00 55.36 55.34 2i2t s GLN 115 Cb -0.14 -1.71 -0.01 0.00 0.00 0.00 0.00 33.01 31.16 2i2t s GLN 115 CO -0.04 -3.08 -0.24 -0.51 0.00 0.00 0.00 175.29 171.41 2i2t s LEU 116 N -6.50 2.07 1.14 2.60 1.02 -1.24 -4.81 118.68 112.96 2i2t s LEU 116 Ca 0.70 -0.53 -0.18 0.00 0.02 0.00 0.00 54.13 54.15 2i2t s LEU 116 Cb -0.10 -1.38 0.15 0.00 0.02 0.00 0.00 46.19 44.89 2i2t s LEU 116 CO 0.55 0.21 0.19 -2.65 0.02 0.00 0.00 176.35 174.67 2i2t n PRO 117 N 3.17 -2.03 0.00 1.29 -0.02 -1.26 -4.91 135.00 131.24 2i2t n PRO 117 Ca -0.18 -0.58 0.00 0.00 -2.02 0.00 0.00 63.50 60.72 2i2t n PRO 117 Cb 0.52 -1.73 0.00 0.00 -0.02 0.00 0.00 33.50 32.28 2i2t n PRO 117 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2i2t n ALA 118 N -4.60 0.00 -1.24 3.55 0.00 -1.26 -3.53 120.51 113.44 2i2t n ALA 118 Ca 0.02 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.05 2i2t n ALA 118 Cb 0.58 0.11 -0.04 0.00 0.00 0.00 0.00 19.45 20.09 2i2t n ALA 118 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2i2t n GLY 119 N -0.56 3.05 3.65 0.00 0.00 -1.26 -4.75 105.19 105.31 2i2t n GLY 119 Ca 0.00 -1.31 -0.03 0.00 0.00 0.00 0.00 46.02 44.69 2i2t n GLY 119 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2i2t s ILE 120 N 4.41 0.00 0.07 -0.61 -1.16 -1.23 -4.37 121.20 118.31 2i2t s ILE 120 Ca 0.54 0.00 0.04 0.00 -0.51 0.00 0.00 60.65 60.71 2i2t s ILE 120 Cb 0.14 -1.00 -0.03 0.00 0.61 0.00 0.00 42.46 42.18 2i2t s ILE 120 CO 0.06 0.00 -0.10 0.42 -2.81 0.00 0.00 174.94 172.50 2i2t s THR 121 N 0.65 0.85 0.23 4.00 -4.23 -1.15 -4.65 115.64 111.34 2i2t s THR 121 Ca -0.01 -1.37 -0.03 0.00 -1.18 0.00 0.00 61.69 59.10 2i2t s THR 121 Cb -0.04 -1.04 -0.03 0.00 1.34 0.00 0.00 72.50 72.73 2i2t s THR 121 CO -0.12 -0.41 0.24 0.00 -0.54 0.00 0.00 174.62 173.79 2i2t s ALA 122 N -1.79 0.91 -0.12 3.99 0.00 -1.26 -1.68 121.76 121.81 2i2t s ALA 122 Ca -0.02 -1.55 -0.32 0.00 0.00 0.00 0.00 51.96 50.08 2i2t s ALA 122 Cb -0.07 1.31 0.13 0.00 0.00 0.00 0.00 23.12 24.49 2i2t s ALA 122 CO 0.01 -0.67 1.06 -2.00 0.00 0.00 0.00 175.76 174.16 2i2t s GLU 123 N -3.99 0.54 -0.27 0.00 -6.30 -0.70 -4.94 118.70 103.05 2i2t s GLU 123 Ca 0.35 -0.14 0.03 0.00 -2.50 0.00 0.00 54.97 52.71 2i2t s GLU 123 Cb 0.04 0.25 0.06 0.00 0.00 0.00 0.00 34.13 34.49 2i2t s GLU 123 CO 0.13 -0.22 -0.09 0.00 0.02 0.00 0.00 175.26 175.10 2i2t n PRO 125 N 4.44 0.00 0.00 0.00 -0.02 -1.26 -4.74 135.00 133.42 2i2t n PRO 125 Ca -0.12 0.52 0.00 0.00 -2.02 0.00 0.00 63.50 61.89 2i2t n PRO 125 Cb 0.42 -1.36 0.00 0.00 -0.02 0.00 0.00 33.50 32.54 2i2t n PRO 125 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 2i2t n THR 126 N -1.86 0.00 -0.02 3.45 -1.04 -1.26 -5.01 114.28 108.54 2i2t n THR 126 Ca 0.00 0.00 0.05 0.00 -2.04 0.00 0.00 64.05 62.06 2i2t n THR 126 Cb 0.00 -1.13 -0.15 0.00 -1.82 0.00 0.00 70.33 67.23 2i2t n THR 126 CO 0.00 0.00 0.00 1.67 -0.64 0.00 0.00 175.07 176.10 2i2t n GLN 127 N 0.00 0.66 -3.06 -2.82 -0.06 -1.26 -4.53 117.38 106.30 2i2t n GLN 127 Ca 0.00 -0.09 -0.31 0.00 -2.00 0.00 0.00 57.00 54.60 2i2t n GLN 127 Cb 0.00 -1.57 -0.04 0.00 -4.06 0.00 0.00 30.24 24.57 2i2t n GLN 127 CO 0.00 0.00 0.00 0.25 -0.20 0.00 0.00 177.06 177.11 2i2t n THR 128 N -2.46 3.60 -3.61 1.69 -2.24 -1.26 -0.33 114.28 109.67 2i2t n THR 128 Ca -0.11 -5.58 -0.07 0.00 -2.27 0.00 0.00 64.05 56.02 2i2t n THR 128 Cb 0.73 -1.74 -0.05 0.00 -2.10 0.00 0.00 70.33 67.18 2i2t n THR 128 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 2i2t s GLU 129 N -3.20 0.34 -0.05 -0.78 2.12 -1.26 -3.70 118.70 112.17 2i2t s GLU 129 Ca 0.42 0.12 -0.02 0.00 0.36 0.00 0.00 54.97 55.85 2i2t s GLU 129 Cb 0.19 0.16 0.04 0.00 0.26 0.00 0.00 34.13 34.78 2i2t s GLU 129 CO -0.06 -0.10 0.10 0.42 -0.54 0.00 0.00 175.26 175.07 2i2t s ILE 130 N -0.90 -0.09 -0.27 -3.70 1.01 -0.02 -4.31 121.20 112.92 2i2t s ILE 130 Ca 0.03 0.24 0.01 0.00 0.00 0.00 0.00 60.65 60.93 2i2t s ILE 130 Cb -0.01 -0.18 0.08 0.00 0.01 0.00 0.00 42.46 42.35 2i2t s ILE 130 CO -0.04 0.10 0.02 0.68 0.00 0.00 0.00 174.94 175.70 2i2t s VAL 131 N 1.39 1.41 -0.97 2.92 -7.23 0.60 -0.27 120.40 118.24 2i2t s VAL 131 Ca -0.06 -1.43 -0.07 0.00 -1.81 0.00 0.00 61.98 58.60 2i2t s VAL 131 Cb -0.12 -1.87 0.24 0.00 0.56 0.00 0.00 36.38 35.19 2i2t s VAL 131 CO -0.05 -0.36 0.92 -1.48 -0.31 0.00 0.00 175.10 173.82 2i2t s LEU 132 N 1.40 6.13 0.36 1.32 2.34 -1.26 -1.71 118.68 127.26 2i2t s LEU 132 Ca 0.02 -3.43 -0.28 0.00 0.06 0.00 0.00 54.13 50.50 2i2t s LEU 132 Cb -0.18 -2.10 -0.12 0.00 -0.56 0.00 0.00 46.19 43.23 2i2t s LEU 132 CO -0.12 -0.31 1.34 0.29 -1.06 0.00 0.00 176.35 176.49 2i2t n LYS 133 N 2.86 2.24 -4.06 1.48 5.02 -0.68 -4.57 118.16 120.46 2i2t n LYS 133 Ca 0.20 0.79 -0.10 0.00 -2.02 0.00 0.00 58.31 57.18 2i2t n LYS 133 Cb 0.40 -2.42 -0.07 0.00 -0.02 0.00 0.00 35.03 32.91 2i2t n LYS 133 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 2i2t s GLY 134 N -0.30 0.84 -0.23 0.72 0.00 -1.08 -2.94 107.32 104.33 2i2t s GLY 134 Ca 0.56 -1.18 0.03 0.00 0.00 0.00 0.00 44.72 44.13 2i2t s GLY 134 CO 0.62 -0.97 -0.19 0.00 0.00 0.00 0.00 173.10 172.56 2i2t n ALA 135 N -0.29 1.49 -2.59 3.20 0.00 -1.26 -0.22 120.51 120.84 2i2t n ALA 135 Ca -0.02 -1.03 -0.41 0.00 0.00 0.00 0.00 53.44 51.98 2i2t n ALA 135 Cb 0.64 -0.06 -0.08 0.00 0.00 0.00 0.00 19.45 19.95 2i2t n ALA 135 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2i2t s ASP 136 N -6.24 6.39 0.34 0.00 -1.08 -1.26 -4.10 116.67 110.72 2i2t s ASP 136 Ca -0.31 0.30 0.02 0.00 -0.52 0.00 0.00 52.55 52.05 2i2t s ASP 136 Cb 0.08 -2.28 0.60 0.00 -1.46 0.00 0.00 42.92 39.86 2i2t s ASP 136 CO 0.56 -0.38 1.95 0.50 0.52 0.00 0.00 175.17 178.32 2i2t h LYS 137 N 8.21 0.73 0.42 4.34 3.64 -1.90 -2.65 116.57 129.36 2i2t h LYS 137 Ca -0.28 -0.09 -0.02 0.00 -1.27 0.00 0.00 60.65 58.99 2i2t h LYS 137 Cb 1.13 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.82 2i2t h LYS 137 CO 0.74 0.57 -0.20 0.37 -2.27 0.00 0.00 179.45 178.67 2i2t h GLN 138 N 0.73 -0.54 -0.84 1.90 -0.00 -1.99 -2.58 115.11 111.79 2i2t h GLN 138 Ca 0.18 0.04 0.08 0.00 -0.00 0.00 0.00 58.65 58.95 2i2t h GLN 138 Cb 0.09 0.12 -0.10 0.00 0.00 0.00 0.00 27.48 27.59 2i2t h GLN 138 CO -0.02 -0.36 -0.50 0.28 0.00 0.00 0.00 178.83 178.22 2i2t h VAL 139 N -0.67 0.00 -0.11 2.39 2.07 -1.95 0.73 116.25 118.72 2i2t h VAL 139 Ca -0.06 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.51 2i2t h VAL 139 Cb 0.43 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 30.14 2i2t h VAL 139 CO 0.09 0.00 -0.35 0.16 0.02 0.00 0.00 177.57 177.49 2i2t h ILE 140 N -0.01 0.24 -0.69 4.57 -0.00 -1.57 0.69 117.51 120.75 2i2t h ILE 140 Ca 0.14 0.00 0.16 0.00 -0.00 0.00 0.00 64.86 65.15 2i2t h ILE 140 Cb 0.35 0.24 -0.04 0.00 -0.00 0.00 0.00 36.82 37.37 2i2t h ILE 140 CO -0.80 0.00 0.47 1.23 -0.00 0.00 0.00 178.15 179.06 2i2t h GLY 141 N -0.44 0.44 0.17 0.16 0.00 -0.88 0.74 103.07 103.25 2i2t h GLY 141 Ca 0.08 -0.11 -0.00 0.00 0.00 0.00 0.00 47.33 47.30 2i2t h GLY 141 CO -0.35 0.04 -0.02 -1.61 0.00 0.00 0.00 176.54 174.59 2i2t h GLN 142 N 0.25 -0.07 0.00 4.80 5.75 0.11 -2.93 115.11 123.03 2i2t h GLN 142 Ca 0.34 0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 58.83 2i2t h GLN 142 Cb 0.96 0.02 -0.00 0.00 1.07 0.00 0.00 27.48 29.52 2i2t h GLN 142 CO -0.08 0.54 -0.06 -0.39 -2.65 0.00 0.00 178.83 176.20 2i2t h VAL 143 N -0.90 0.62 -0.04 2.39 -1.51 0.87 -1.79 116.25 115.90 2i2t h VAL 143 Ca -0.01 -0.25 -0.00 0.00 -1.23 0.00 0.00 66.70 65.21 2i2t h VAL 143 Cb 0.64 1.16 -0.00 0.00 -2.13 0.00 0.00 31.29 30.95 2i2t h VAL 143 CO 0.01 0.06 0.01 0.00 -1.23 0.00 0.00 177.57 176.43 2i2t h ALA 144 N 1.94 0.05 0.27 5.19 0.00 0.46 -2.63 119.26 124.54 2i2t h ALA 144 Ca -0.00 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 2i2t h ALA 144 Cb 0.15 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 2i2t h ALA 144 CO 0.01 -0.35 -0.19 0.00 0.00 0.00 0.00 179.25 178.71 2i2t h ALA 145 N 0.83 -0.44 -1.12 0.00 0.00 -1.15 -1.34 119.26 116.03 2i2t h ALA 145 Ca 0.01 -0.08 0.33 0.00 0.00 0.00 0.00 54.91 55.17 2i2t h ALA 145 Cb 0.19 0.25 -0.04 0.00 0.00 0.00 0.00 17.79 18.18 2i2t h ALA 145 CO -0.00 -0.77 0.90 -0.44 0.00 0.00 0.00 179.25 178.94 2i2t h ASP 146 N -0.46 0.00 0.00 0.00 3.32 -1.37 0.37 116.42 118.28 2i2t h ASP 146 Ca -0.02 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.03 2i2t h ASP 146 Cb 0.40 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.95 2i2t h ASP 146 CO 0.00 0.00 0.00 0.18 -1.72 0.00 0.00 179.24 177.70 2i2t n LEU 147 N -3.94 1.03 0.04 1.55 4.77 -0.54 -3.63 117.00 116.28 2i2t n LEU 147 Ca 0.24 0.41 0.21 0.00 -0.03 0.00 0.00 56.01 56.85 2i2t n LEU 147 Cb 1.27 -0.21 0.60 0.00 -2.33 0.00 0.00 43.42 42.75 2i2t n LEU 147 CO 0.36 -0.21 1.19 0.08 -1.33 0.00 0.00 177.39 177.48 2i2t h ARG 148 N 0.00 0.00 0.00 3.23 -0.00 -1.08 0.32 114.38 116.85 2i2t h ARG 148 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.98 59.98 2i2t h ARG 148 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 29.97 2i2t h ARG 148 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 179.97 179.97 2i2t n ALA 149 N -2.19 1.75 0.28 0.08 0.00 0.13 -0.30 120.51 120.27 2i2t n ALA 149 Ca 0.11 -0.04 0.11 0.00 0.00 0.00 0.00 53.44 53.62 2i2t n ALA 149 Cb 0.91 -1.10 -0.02 0.00 0.00 0.00 0.00 19.45 19.25 2i2t n ALA 149 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2i2t n TYR 150 N -0.94 0.48 0.13 0.00 0.53 0.11 -4.83 117.16 112.64 2i2t n TYR 150 Ca 0.05 0.14 0.00 0.00 -1.02 0.00 0.00 57.90 57.06 2i2t n TYR 150 Cb 0.02 -0.65 0.00 0.00 -1.03 0.00 0.00 39.34 37.68 2i2t n TYR 150 CO 0.00 0.00 0.00 -2.13 -1.02 0.00 0.00 176.86 173.71 2i2t n ARG 151 N -2.29 0.00 -1.70 -0.72 3.00 -0.41 -5.01 116.66 109.53 2i2t n ARG 151 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 2i2t n ARG 151 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.96 2i2t n ARG 151 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.63 175.50 2i2t n ARG 152 N -3.14 -4.87 -1.53 -0.14 3.00 0.59 -4.78 116.66 105.79 2i2t n ARG 152 Ca 0.00 3.61 -0.51 0.00 -0.00 0.00 0.00 57.85 60.95 2i2t n ARG 152 Cb 0.00 -4.05 -0.05 0.00 0.00 0.00 0.00 32.46 28.36 2i2t n ARG 152 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.63 175.33 2i2t n PRO 153 N -0.68 0.73 -3.61 -0.14 -0.02 -1.24 -4.52 135.00 125.53 2i2t n PRO 153 Ca 0.00 0.26 -0.39 0.00 -2.02 0.00 0.00 63.50 61.35 2i2t n PRO 153 Cb 0.00 -1.67 -0.08 0.00 -0.02 0.00 0.00 33.50 31.73 2i2t n PRO 153 CO 0.00 0.00 0.00 -1.83 1.98 0.00 0.00 175.50 175.65 2i2t s GLU 154 N -0.41 2.72 -0.11 -0.52 1.03 -0.68 -4.97 118.70 115.76 2i2t s GLU 154 Ca 0.75 -2.34 -0.09 0.00 0.03 0.00 0.00 54.97 53.33 2i2t s GLU 154 Cb -0.95 -3.90 -0.10 0.00 -0.80 0.00 0.00 34.13 28.38 2i2t s GLU 154 CO 0.54 -1.19 0.99 -2.30 -1.33 0.00 0.00 175.26 171.96 2i2t n PRO 155 N 3.91 0.01 0.00 -4.83 -0.02 -1.26 -1.49 135.00 131.32 2i2t n PRO 155 Ca 0.06 -0.36 0.00 0.00 -2.02 0.00 0.00 63.50 61.18 2i2t n PRO 155 Cb 0.40 -1.58 0.00 0.00 -0.02 0.00 0.00 33.50 32.31 2i2t n PRO 155 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2i2t n TYR 156 N 6.42 0.00 -0.23 6.00 0.53 -1.26 -3.73 117.16 124.89 2i2t n TYR 156 Ca 0.13 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 57.01 2i2t n TYR 156 Cb 0.36 0.00 0.00 0.00 -1.03 0.00 0.00 39.34 38.67 2i2t n TYR 156 CO 0.00 0.00 0.00 1.17 -1.02 0.00 0.00 176.86 177.01 2i2t n LYS 157 N -0.05 1.63 -0.17 -0.72 4.81 -0.56 -4.85 118.16 118.24 2i2t n LYS 157 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 2i2t n LYS 157 Cb 0.00 -0.14 0.00 0.00 0.02 0.00 0.00 35.03 34.91 2i2t n LYS 157 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2i2t n GLY 158 N 0.00 2.25 3.26 3.14 0.00 -0.99 -4.95 105.19 107.90 2i2t n GLY 158 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 2i2t n GLY 158 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2i2t n LYS 159 N -2.00 -0.85 0.00 1.61 5.02 -1.26 -4.38 118.16 116.30 2i2t n LYS 159 Ca 0.00 -0.23 0.00 0.00 -2.02 0.00 0.00 58.31 56.06 2i2t n LYS 159 Cb 0.00 -1.60 0.00 0.00 -0.02 0.00 0.00 35.03 33.41 2i2t n LYS 159 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2i2t n GLY 160 N 2.18 1.89 3.63 0.72 0.00 -1.26 -1.69 105.19 110.66 2i2t n GLY 160 Ca 0.02 -1.96 -0.43 0.00 0.00 0.00 0.00 46.02 43.65 2i2t n GLY 160 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2i2t s VAL 161 N -2.50 3.41 0.11 1.61 1.01 -1.26 -2.47 120.40 120.31 2i2t s VAL 161 Ca 0.00 0.47 0.04 0.00 0.00 0.00 0.00 61.98 62.49 2i2t s VAL 161 Cb 0.00 -3.40 -0.04 0.00 0.00 0.00 0.00 36.38 32.94 2i2t s VAL 161 CO 0.00 -0.15 -0.11 -0.60 0.00 0.00 0.00 175.10 174.24 2i2t s ARG 162 N 4.85 0.92 0.03 2.72 3.52 -0.85 -3.87 118.95 126.27 2i2t s ARG 162 Ca 0.81 -1.23 0.04 0.00 -0.13 0.00 0.00 55.73 55.21 2i2t s ARG 162 Cb -0.31 -0.61 -0.02 0.00 -1.56 0.00 0.00 34.95 32.45 2i2t s ARG 162 CO 0.33 0.10 -0.12 1.52 -0.81 0.00 0.00 175.30 176.31 2i2t s TYR 163 N -2.58 1.08 0.33 5.12 -0.00 -1.26 0.45 117.35 120.49 2i2t s TYR 163 Ca 0.08 -0.32 0.29 0.00 -0.00 0.00 0.00 57.07 57.13 2i2t s TYR 163 Cb -0.02 -0.65 1.06 0.00 -0.00 0.00 0.00 41.96 42.35 2i2t s TYR 163 CO 0.01 0.01 0.99 0.00 -0.00 0.00 0.00 175.55 176.56 2i2t n ALA 164 N 2.09 1.12 -0.92 9.51 0.00 -1.26 0.93 120.51 131.98 2i2t n ALA 164 Ca -0.17 0.45 -0.21 0.00 0.00 0.00 0.00 53.44 53.50 2i2t n ALA 164 Cb 0.55 -0.71 0.06 0.00 0.00 0.00 0.00 19.45 19.35 2i2t n ALA 164 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2i2t n ASP 165 N -3.40 6.26 -0.43 0.00 2.03 -1.26 -4.89 116.55 114.85 2i2t n ASP 165 Ca 0.28 -3.25 0.00 0.00 0.52 0.00 0.00 54.79 52.34 2i2t n ASP 165 Cb 1.21 -0.98 0.00 0.00 -0.72 0.00 0.00 41.12 40.64 2i2t n ASP 165 CO 0.00 0.00 0.00 -1.84 -1.92 0.00 0.00 177.20 173.44 2i2t n GLU 166 N -0.15 3.50 0.00 -0.67 0.00 0.26 -5.11 120.64 118.47 2i2t n GLU 166 Ca 0.40 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.56 2i2t n GLU 166 Cb 0.72 0.00 0.00 0.00 0.00 0.00 0.00 31.44 32.16 2i2t n GLU 166 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.13 178.46 2i2t n VAL 167 N 0.00 0.00 -2.80 3.84 0.24 -1.26 -5.10 118.33 113.25 2i2t n VAL 167 Ca 0.00 0.00 -0.01 0.00 -2.04 0.00 0.00 64.34 62.29 2i2t n VAL 167 Cb 0.00 0.00 0.01 0.00 -1.47 0.00 0.00 33.84 32.38 2i2t n VAL 167 CO 0.00 0.00 0.00 0.52 -2.14 0.00 0.00 176.83 175.21 2i2t n VAL 168 N -1.52 -8.50 -0.12 3.34 0.31 -1.26 -4.95 118.33 105.62 2i2t n VAL 168 Ca 0.00 -0.28 -0.09 0.00 -0.01 0.00 0.00 64.34 63.96 2i2t n VAL 168 Cb 0.00 -6.30 -0.01 0.00 -0.91 0.00 0.00 33.84 26.62 2i2t n VAL 168 CO 0.00 0.00 0.00 0.03 -1.32 0.00 0.00 176.83 175.54 2i2t h ARG 169 N 0.27 0.54 -3.37 5.55 2.47 -1.99 -3.49 114.38 114.35 2i2t h ARG 169 Ca -0.04 -0.07 0.36 0.00 -1.26 0.00 0.00 59.98 58.97 2i2t h ARG 169 Cb 1.02 -0.10 -0.16 0.00 -1.65 0.00 0.00 29.97 29.08 2i2t h ARG 169 CO 0.26 0.45 -1.00 0.25 0.56 0.00 0.00 179.97 180.49 2i2t n THR 170 N -4.74 -0.26 -3.67 2.04 -2.24 -1.26 -5.02 114.28 99.15 2i2t n THR 170 Ca -0.00 0.61 -0.15 0.00 -2.27 0.00 0.00 64.05 62.24 2i2t n THR 170 Cb 0.09 -1.09 -0.08 0.00 -2.10 0.00 0.00 70.33 67.15 2i2t n THR 170 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 2i2t s LYS 171 N -3.54 0.75 0.42 -0.78 2.36 -1.24 -4.91 119.74 112.80 2i2t s LYS 171 Ca 0.00 0.38 -0.26 0.00 -2.55 0.00 0.00 55.97 53.54 2i2t s LYS 171 Cb 0.00 0.35 -0.10 0.00 -1.05 0.00 0.00 37.83 37.04 2i2t s LYS 171 CO 0.00 -0.17 1.35 -0.85 1.55 0.00 0.00 175.35 177.23 2i2t n GLU 172 N 1.93 2.14 -0.42 4.03 0.28 -1.26 -4.51 120.64 122.82 2i2t n GLU 172 Ca -0.17 0.76 -0.29 0.00 -0.16 0.00 0.00 57.16 57.30 2i2t n GLU 172 Cb 0.56 -2.49 0.27 0.00 1.43 0.00 0.00 31.44 31.21 2i2t n GLU 172 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2i2t n ALA 173 N -0.10 -3.58 -1.90 -1.84 0.00 -1.26 -4.95 120.51 106.88 2i2t n ALA 173 Ca 0.05 -1.39 -0.38 0.00 0.00 0.00 0.00 53.44 51.72 2i2t n ALA 173 Cb 0.40 -1.87 -0.06 0.00 0.00 0.00 0.00 19.45 17.92 2i2t n ALA 173 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 2i2t s LYS 174 N -4.44 4.56 -0.23 0.00 2.36 -1.26 -5.03 119.74 115.71 2i2t s LYS 174 Ca 0.68 1.21 -0.23 0.00 -2.55 0.00 0.00 55.97 55.08 2i2t s LYS 174 Cb -0.22 -3.04 -0.01 0.00 -1.05 0.00 0.00 37.83 33.50 2i2t s LYS 174 CO 0.64 0.43 0.76 0.15 1.55 0.00 0.00 175.35 178.88 2i2t s LYS 175 N -1.61 4.19 0.00 4.03 -0.14 -1.26 -5.33 119.74 119.62 2i2t s LYS 175 Ca 0.43 0.83 0.00 0.00 -1.36 0.00 0.00 55.97 55.86 2i2t s LYS 175 Cb -0.21 -3.62 0.00 0.00 -1.68 0.00 0.00 37.83 32.32 2i2t s LYS 175 CO 0.25 -0.42 0.35 0.36 -0.76 0.00 0.00 175.35 175.14