#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i1t n ARG 2 N 0.00 -0.11 0.00 -1.46 0.00 -1.26 -3.87 116.66 109.96 3i1t n ARG 2 Ca 0.00 0.03 0.00 0.00 -0.00 0.00 0.00 57.85 57.88 3i1t n ARG 2 Cb 0.00 -4.40 0.00 0.00 0.00 0.00 0.00 32.46 28.06 3i1t n ARG 2 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.63 178.96 3i1t n VAL 3 N -1.89 0.00 1.02 5.15 0.24 -1.26 -4.82 118.33 116.77 3i1t n VAL 3 Ca 0.00 0.00 0.08 0.00 -2.04 0.00 0.00 64.34 62.38 3i1t n VAL 3 Cb 0.03 0.16 0.48 0.00 -1.47 0.00 0.00 33.84 33.04 3i1t n VAL 3 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3i1t n ALA 4 N 0.00 2.11 0.00 2.33 0.00 -1.25 -2.73 120.51 120.97 3i1t n ALA 4 Ca 0.00 -0.10 -0.17 0.00 0.00 0.00 0.00 53.44 53.17 3i1t n ALA 4 Cb 0.00 -1.26 -0.14 0.00 0.00 0.00 0.00 19.45 18.05 3i1t n ALA 4 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 3i1t h LYS 5 N 0.00 0.19 -6.01 0.00 1.79 -1.87 -3.33 116.57 107.33 3i1t h LYS 5 Ca 0.00 -0.32 -0.69 0.00 -2.18 0.00 0.00 60.65 57.46 3i1t h LYS 5 Cb 0.00 0.12 -0.02 0.00 -1.58 0.00 0.00 32.23 30.75 3i1t h LYS 5 CO 0.00 0.99 1.34 0.00 -1.08 0.00 0.00 179.45 180.70 3i1t n ALA 6 N -2.83 0.81 1.41 3.86 0.00 -1.10 -4.77 120.51 117.89 3i1t n ALA 6 Ca -0.26 0.04 0.03 0.00 0.00 0.00 0.00 53.44 53.24 3i1t n ALA 6 Cb 1.05 -2.44 0.16 0.00 0.00 0.00 0.00 19.45 18.22 3i1t n ALA 6 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3i1t n PRO 7 N 7.76 0.71 0.00 0.00 -0.02 -1.26 -4.75 135.00 137.44 3i1t n PRO 7 Ca 0.41 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.89 3i1t n PRO 7 Cb 0.18 -1.12 0.00 0.00 -0.02 0.00 0.00 33.50 32.54 3i1t n PRO 7 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 3i1t n VAL 8 N -0.62 0.00 -1.26 -1.45 0.31 -1.25 -0.42 118.33 113.64 3i1t n VAL 8 Ca 0.04 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.37 3i1t n VAL 8 Cb 0.02 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.95 3i1t n VAL 8 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 3i1t n VAL 9 N 0.00 -5.94 -3.82 2.52 0.31 -1.26 -5.03 118.33 105.11 3i1t n VAL 9 Ca 0.00 1.80 -0.12 0.00 -0.01 0.00 0.00 64.34 66.01 3i1t n VAL 9 Cb 0.00 -3.15 -0.13 0.00 -0.91 0.00 0.00 33.84 29.65 3i1t n VAL 9 CO 0.00 0.00 0.00 0.68 -1.32 0.00 0.00 176.83 176.19 3i1t s VAL 10 N -1.09 -0.00 0.00 2.52 -7.23 -1.26 -5.02 120.40 108.31 3i1t s VAL 10 Ca 0.00 0.01 0.00 0.00 -1.81 0.00 0.00 61.98 60.18 3i1t s VAL 10 Cb 0.00 -0.20 0.00 0.00 0.56 0.00 0.00 36.38 36.74 3i1t s VAL 10 CO 0.00 0.00 0.00 -0.81 -0.31 0.00 0.00 175.10 173.98 3i1t n PRO 11 N 3.06 3.19 -1.93 4.82 -0.04 -1.26 -4.90 135.00 137.94 3i1t n PRO 11 Ca -0.13 0.00 -0.29 0.00 -0.04 0.00 0.00 63.50 63.04 3i1t n PRO 11 Cb 0.59 0.00 0.06 0.00 -0.04 0.00 0.00 33.50 34.11 3i1t n PRO 11 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3i1t s ALA 12 N -3.10 2.85 0.00 0.55 0.00 -1.26 -4.15 121.76 116.65 3i1t s ALA 12 Ca 0.00 -0.48 0.00 0.00 0.00 0.00 0.00 51.96 51.48 3i1t s ALA 12 Cb 0.00 -2.97 0.00 0.00 0.00 0.00 0.00 23.12 20.15 3i1t s ALA 12 CO 0.00 -1.30 0.00 0.41 0.00 0.00 0.00 175.76 174.87 3i1t n GLY 13 N -3.08 1.73 3.54 0.00 0.00 -1.26 -4.97 105.19 101.14 3i1t n GLY 13 Ca 0.07 -0.15 -0.45 0.00 0.00 0.00 0.00 46.02 45.49 3i1t n GLY 13 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3i1t n VAL 14 N 0.00 1.99 -0.03 1.61 0.24 -1.25 -4.64 118.33 116.25 3i1t n VAL 14 Ca 0.00 -0.50 -0.02 0.00 -2.04 0.00 0.00 64.34 61.78 3i1t n VAL 14 Cb 0.00 -0.75 -0.01 0.00 -1.47 0.00 0.00 33.84 31.61 3i1t n VAL 14 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 3i1t n ASP 15 N 1.34 0.66 -2.99 -1.34 2.03 -1.06 -4.92 116.55 110.28 3i1t n ASP 15 Ca 0.11 0.35 -0.00 0.00 0.52 0.00 0.00 54.79 55.77 3i1t n ASP 15 Cb 0.32 -0.63 0.00 0.00 -0.72 0.00 0.00 41.12 40.09 3i1t n ASP 15 CO 0.00 0.00 0.00 0.52 -1.92 0.00 0.00 177.20 175.80 3i1t n VAL 16 N -3.12 -9.76 -4.02 5.18 0.31 -1.25 -4.95 118.33 100.73 3i1t n VAL 16 Ca -0.03 -0.22 -0.32 0.00 -0.01 0.00 0.00 64.34 63.75 3i1t n VAL 16 Cb 0.11 -6.78 -0.15 0.00 -0.91 0.00 0.00 33.84 26.11 3i1t n VAL 16 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 3i1t s LYS 17 N -3.00 1.98 -0.43 5.55 2.47 -1.16 -5.06 119.74 120.10 3i1t s LYS 17 Ca 0.00 -1.56 -0.20 0.00 -1.56 0.00 0.00 55.97 52.66 3i1t s LYS 17 Cb -0.00 -3.08 0.02 0.00 -1.46 0.00 0.00 37.83 33.31 3i1t s LYS 17 CO 0.71 -0.74 0.60 -1.50 0.16 0.00 0.00 175.35 174.58 3i1t s ILE 18 N 1.05 4.89 0.16 5.43 2.07 -1.26 -3.47 121.20 130.06 3i1t s ILE 18 Ca -0.00 0.06 -0.03 0.00 -1.41 0.00 0.00 60.65 59.27 3i1t s ILE 18 Cb -0.20 -4.16 -0.12 0.00 0.13 0.00 0.00 42.46 38.11 3i1t s ILE 18 CO -0.06 -0.53 1.40 0.78 -1.91 0.00 0.00 174.94 174.62 3i1t h ASN 19 N 8.81 0.54 0.00 4.50 -0.26 -1.94 -3.49 115.58 123.74 3i1t h ASN 19 Ca -0.26 -0.37 0.00 0.00 -0.56 0.00 0.00 56.30 55.11 3i1t h ASN 19 Cb 1.10 -0.16 0.00 0.00 -1.06 0.00 0.00 38.32 38.20 3i1t h ASN 19 CO 0.87 1.12 0.00 0.61 -1.06 0.00 0.00 177.43 178.97 3i1t n GLY 20 N 0.64 1.73 0.13 2.83 0.00 -1.26 -4.89 105.19 104.38 3i1t n GLY 20 Ca -0.05 -0.21 -0.21 0.00 0.00 0.00 0.00 46.02 45.56 3i1t n GLY 20 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 3i1t n GLN 21 N 0.00 0.66 -3.31 1.61 0.00 -1.26 -4.98 117.38 110.10 3i1t n GLN 21 Ca 0.00 0.21 -0.19 0.00 -0.00 0.00 0.00 57.00 57.02 3i1t n GLN 21 Cb 0.00 -1.57 0.00 0.00 0.00 0.00 0.00 30.24 28.67 3i1t n GLN 21 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.06 177.14 3i1t s VAL 22 N -2.52 3.82 -0.02 1.69 1.01 -1.26 -0.92 120.40 122.20 3i1t s VAL 22 Ca -0.33 -0.94 -0.07 0.00 0.00 0.00 0.00 61.98 60.65 3i1t s VAL 22 Cb 0.09 -3.33 0.01 0.00 0.00 0.00 0.00 36.38 33.15 3i1t s VAL 22 CO 0.62 -0.14 0.14 -0.63 0.00 0.00 0.00 175.10 175.10 3i1t s ILE 23 N -2.26 0.05 -0.11 2.22 1.01 -0.45 -2.83 121.20 118.82 3i1t s ILE 23 Ca 0.48 -0.44 -0.04 0.00 0.00 0.00 0.00 60.65 60.64 3i1t s ILE 23 Cb -0.10 -0.36 0.06 0.00 0.01 0.00 0.00 42.46 42.07 3i1t s ILE 23 CO 0.32 -0.24 0.23 0.42 0.00 0.00 0.00 174.94 175.67 3i1t s THR 24 N -0.85 -0.31 -0.33 2.92 -4.23 -1.23 -1.59 115.64 110.03 3i1t s THR 24 Ca -0.09 0.28 -0.05 0.00 -1.18 0.00 0.00 61.69 60.65 3i1t s THR 24 Cb -0.05 -0.39 0.05 0.00 1.34 0.00 0.00 72.50 73.45 3i1t s THR 24 CO 0.01 0.12 0.08 -0.63 -0.54 0.00 0.00 174.62 173.66 3i1t s ILE 25 N 2.17 3.49 -0.02 2.99 1.09 -1.23 -2.99 121.20 126.70 3i1t s ILE 25 Ca -0.00 -1.29 -0.24 0.00 -1.10 0.00 0.00 60.65 58.02 3i1t s ILE 25 Cb -0.12 -3.02 -0.04 0.00 -1.06 0.00 0.00 42.46 38.22 3i1t s ILE 25 CO -0.08 -0.20 0.71 -0.75 -0.10 0.00 0.00 174.94 174.52 3i1t s LYS 26 N 1.33 4.44 0.00 2.79 2.36 -1.26 -3.66 119.74 125.74 3i1t s LYS 26 Ca -0.02 0.92 0.00 0.00 -2.55 0.00 0.00 55.97 54.32 3i1t s LYS 26 Cb -0.20 -3.41 0.00 0.00 -1.05 0.00 0.00 37.83 33.17 3i1t s LYS 26 CO 0.01 0.18 0.00 0.41 1.55 0.00 0.00 175.35 177.49 3i1t n GLY 27 N 2.79 5.08 0.76 5.54 0.00 -1.16 -2.57 105.19 115.63 3i1t n GLY 27 Ca -0.02 -1.71 0.12 0.00 0.00 0.00 0.00 46.02 44.40 3i1t n GLY 27 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3i1t n LYS 28 N 0.00 2.02 0.00 1.61 5.02 -0.89 -4.35 118.16 121.57 3i1t n LYS 28 Ca 0.00 -1.51 0.00 0.00 -2.02 0.00 0.00 58.31 54.78 3i1t n LYS 28 Cb 0.00 -1.46 0.00 0.00 -0.02 0.00 0.00 35.03 33.55 3i1t n LYS 28 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 3i1t n ASN 29 N 0.77 0.00 -4.37 4.39 5.15 0.37 -4.97 115.26 116.60 3i1t n ASN 29 Ca 0.17 0.00 -0.46 0.00 -0.60 0.00 0.00 54.58 53.69 3i1t n ASN 29 Cb 0.46 0.00 -0.02 0.00 -0.53 0.00 0.00 39.78 39.69 3i1t n ASN 29 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 3i1t s GLY 30 N -0.59 2.60 -1.07 8.20 0.00 0.54 -4.84 107.32 112.17 3i1t s GLY 30 Ca 0.00 -3.31 -0.23 0.00 0.00 0.00 0.00 44.72 41.18 3i1t s GLY 30 CO 0.00 1.49 1.87 1.85 0.00 0.00 0.00 173.10 178.30 3i1t s GLU 31 N 0.51 2.80 -0.18 2.90 2.12 -1.26 -2.96 118.70 122.63 3i1t s GLU 31 Ca 0.25 -0.92 -0.02 0.00 0.36 0.00 0.00 54.97 54.64 3i1t s GLU 31 Cb -0.08 -5.22 0.00 0.00 0.26 0.00 0.00 34.13 29.09 3i1t s GLU 31 CO -0.08 -3.37 0.08 1.28 -0.54 0.00 0.00 175.26 172.62 3i1t n LEU 32 N 12.98 -5.18 -4.38 2.70 4.32 -1.26 -4.97 117.00 121.21 3i1t n LEU 32 Ca 0.42 0.64 -0.45 0.00 -0.02 0.00 0.00 56.01 56.60 3i1t n LEU 32 Cb 0.47 -2.25 -0.03 0.00 -1.62 0.00 0.00 43.42 39.99 3i1t n LEU 32 CO 0.65 -1.59 0.57 0.42 -1.22 0.00 0.00 177.39 176.22 3i1t s THR 33 N -1.11 4.98 0.32 -5.08 -4.23 -1.24 -4.99 115.64 104.28 3i1t s THR 33 Ca 0.03 -1.49 -0.27 0.00 -1.18 0.00 0.00 61.69 58.78 3i1t s THR 33 Cb -0.01 -4.57 -0.09 0.00 1.34 0.00 0.00 72.50 69.17 3i1t s THR 33 CO 0.41 -1.21 1.00 -0.13 -0.54 0.00 0.00 174.62 174.15 3i1t s ARG 34 N 2.11 4.56 -0.27 3.99 1.81 -1.26 -3.51 118.95 126.37 3i1t s ARG 34 Ca 0.19 1.49 -0.07 0.00 -1.72 0.00 0.00 55.73 55.62 3i1t s ARG 34 Cb -0.16 -2.91 0.13 0.00 -0.45 0.00 0.00 34.95 31.56 3i1t s ARG 34 CO -0.02 0.22 0.56 0.95 -0.68 0.00 0.00 175.30 176.34 3i1t s THR 35 N -1.45 -0.88 0.52 0.02 -4.23 -0.62 -4.99 115.64 104.00 3i1t s THR 35 Ca 0.49 0.04 -0.13 0.00 -1.18 0.00 0.00 61.69 60.91 3i1t s THR 35 Cb -0.23 -0.90 -0.06 0.00 1.34 0.00 0.00 72.50 72.64 3i1t s THR 35 CO 0.30 0.01 0.94 -0.76 -0.54 0.00 0.00 174.62 174.57 3i1t s LEU 36 N 2.79 3.57 0.00 4.79 1.02 -1.26 -1.35 118.68 128.24 3i1t s LEU 36 Ca 0.01 1.40 0.03 0.00 0.02 0.00 0.00 54.13 55.59 3i1t s LEU 36 Cb -0.13 -4.36 0.03 0.00 0.02 0.00 0.00 46.19 41.75 3i1t s LEU 36 CO -0.17 -0.62 0.25 0.59 0.02 0.00 0.00 176.35 176.42 3i1t n ASN 37 N -1.85 2.40 0.00 2.29 4.13 -0.10 -4.95 115.26 117.17 3i1t n ASN 37 Ca 0.05 -2.41 0.00 0.00 1.68 0.00 0.00 54.58 53.90 3i1t n ASN 37 Cb 0.54 0.02 0.00 0.00 -1.54 0.00 0.00 39.78 38.80 3i1t n ASN 37 CO 0.00 0.00 0.00 -0.90 0.28 0.00 0.00 177.26 176.64 3i1t n ASP 38 N -1.77 1.17 -3.15 6.41 5.75 -1.26 -4.97 116.55 118.73 3i1t n ASP 38 Ca -0.04 0.00 0.05 0.00 -0.01 0.00 0.00 54.79 54.80 3i1t n ASP 38 Cb 0.46 0.00 -0.01 0.00 -1.03 0.00 0.00 41.12 40.54 3i1t n ASP 38 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3i1t s ALA 39 N -1.85 -3.84 0.00 2.12 0.00 -1.26 -5.16 121.76 111.76 3i1t s ALA 39 Ca 0.00 1.37 0.00 0.00 0.00 0.00 0.00 51.96 53.33 3i1t s ALA 39 Cb 0.00 -2.73 0.00 0.00 0.00 0.00 0.00 23.12 20.39 3i1t s ALA 39 CO 0.00 -1.89 0.00 1.33 0.00 0.00 0.00 175.76 175.20 3i1t n VAL 40 N 5.24 0.00 -3.18 0.00 0.24 -1.26 -4.76 118.33 114.61 3i1t n VAL 40 Ca 0.04 0.00 -0.21 0.00 -2.04 0.00 0.00 64.34 62.13 3i1t n VAL 40 Cb 0.56 0.00 -0.05 0.00 -1.47 0.00 0.00 33.84 32.88 3i1t n VAL 40 CO 0.00 0.00 0.00 1.21 -2.14 0.00 0.00 176.83 175.90 3i1t n GLU 41 N 0.00 0.81 -1.80 7.34 4.07 0.16 -4.83 120.64 126.39 3i1t n GLU 41 Ca 0.00 -3.24 -0.42 0.00 -0.06 0.00 0.00 57.16 53.44 3i1t n GLU 41 Cb 0.00 -1.40 -0.03 0.00 -0.06 0.00 0.00 31.44 29.95 3i1t n GLU 41 CO 0.00 0.00 0.00 0.54 -0.06 0.00 0.00 177.13 177.61 3i1t s VAL 42 N -1.60 3.24 0.10 6.31 0.11 -1.26 -2.15 120.40 125.16 3i1t s VAL 42 Ca 0.37 0.29 0.06 0.00 -2.93 0.00 0.00 61.98 59.77 3i1t s VAL 42 Cb 0.24 -3.20 -0.03 0.00 -1.53 0.00 0.00 36.38 31.86 3i1t s VAL 42 CO -0.10 -0.04 -0.15 -0.54 -3.33 0.00 0.00 175.10 170.94 3i1t s LYS 43 N 4.44 0.97 -0.00 1.54 1.02 -1.17 -5.00 119.74 121.54 3i1t s LYS 43 Ca 0.83 -1.14 0.06 0.00 0.02 0.00 0.00 55.97 55.73 3i1t s LYS 43 Cb -0.38 -0.93 -0.06 0.00 -0.52 0.00 0.00 37.83 35.94 3i1t s LYS 43 CO 0.36 0.19 0.23 1.58 -0.92 0.00 0.00 175.35 176.80 3i1t n HIS 44 N 0.82 0.00 0.00 3.18 -0.00 -1.26 -2.13 115.22 115.82 3i1t n HIS 44 Ca -0.18 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.54 3i1t n HIS 44 Cb 0.56 -0.01 0.00 0.00 -0.00 0.00 0.00 29.99 30.54 3i1t n HIS 44 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 3i1t n ALA 45 N -1.16 0.00 0.00 1.57 0.00 -1.26 -2.63 120.51 117.03 3i1t n ALA 45 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 3i1t n ALA 45 Cb 0.09 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.54 3i1t n ALA 45 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3i1t n ASP 46 N 2.01 0.00 -0.39 0.00 10.43 -1.26 -4.96 116.55 122.38 3i1t n ASP 46 Ca 0.00 0.00 0.02 0.00 2.57 0.00 0.00 54.79 57.38 3i1t n ASP 46 Cb 0.00 0.09 0.02 0.00 1.84 0.00 0.00 41.12 43.07 3i1t n ASP 46 CO 0.00 0.00 0.00 0.59 -1.07 0.00 0.00 177.20 176.72 3i1t n ASN 47 N -1.49 0.44 0.00 -2.24 3.02 -1.23 -5.05 115.26 108.70 3i1t n ASN 47 Ca 0.00 -2.13 0.00 0.00 -0.03 0.00 0.00 54.58 52.42 3i1t n ASN 47 Cb 0.00 -0.22 0.00 0.00 -0.61 0.00 0.00 39.78 38.95 3i1t n ASN 47 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 3i1t n THR 48 N -0.26 0.00 0.00 3.41 -2.24 -1.08 -4.44 114.28 109.67 3i1t n THR 48 Ca 0.03 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.81 3i1t n THR 48 Cb 0.67 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.90 3i1t n THR 48 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 3i1t n LEU 49 N 0.00 0.00 -4.39 3.22 7.94 0.44 -4.44 117.00 119.76 3i1t n LEU 49 Ca 0.00 0.00 -0.32 0.00 -1.11 0.00 0.00 56.01 54.58 3i1t n LEU 49 Cb 0.00 0.00 -0.15 0.00 0.53 0.00 0.00 43.42 43.80 3i1t n LEU 49 CO 0.00 0.00 -0.52 -0.89 -1.11 0.00 0.00 177.39 174.87 3i1t s THR 50 N 0.00 2.52 0.52 1.96 2.01 -0.91 -3.79 115.64 117.95 3i1t s THR 50 Ca 0.00 -0.97 0.05 0.00 0.31 0.00 0.00 61.69 61.08 3i1t s THR 50 Cb 0.00 -1.94 0.02 0.00 0.01 0.00 0.00 72.50 70.58 3i1t s THR 50 CO 0.00 0.56 0.28 -0.36 -0.69 0.00 0.00 174.62 174.41 3i1t s PHE 51 N -0.69 1.81 0.32 4.92 0.08 -1.25 -3.04 117.98 120.13 3i1t s PHE 51 Ca 0.11 -0.84 -0.10 0.00 0.12 0.00 0.00 56.93 56.23 3i1t s PHE 51 Cb -0.10 -1.85 0.02 0.00 -0.57 0.00 0.00 43.02 40.51 3i1t s PHE 51 CO 0.00 -0.23 0.57 0.20 -0.10 0.00 0.00 175.22 175.66 3i1t s GLY 52 N -4.14 0.86 0.00 4.36 0.00 -0.91 -4.81 107.32 102.68 3i1t s GLY 52 Ca 0.28 -1.09 0.00 0.00 0.00 0.00 0.00 44.72 43.91 3i1t s GLY 52 CO 0.17 -0.68 0.00 -1.55 0.00 0.00 0.00 173.10 171.04 3i1t n PRO 53 N -0.50 1.00 -4.12 2.90 -0.04 -1.26 0.39 135.00 133.37 3i1t n PRO 53 Ca -0.02 0.00 -0.08 0.00 -0.04 0.00 0.00 63.50 63.35 3i1t n PRO 53 Cb 0.61 0.00 -0.10 0.00 -0.04 0.00 0.00 33.50 33.97 3i1t n PRO 53 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 3i1t s ARG 54 N -0.37 0.78 -0.33 0.54 0.52 -1.26 -4.14 118.95 114.69 3i1t s ARG 54 Ca 0.00 -1.33 -0.32 0.00 -0.52 0.00 0.00 55.73 53.56 3i1t s ARG 54 Cb 0.00 0.23 -0.09 0.00 0.52 0.00 0.00 34.95 35.61 3i1t s ARG 54 CO 0.00 -0.19 2.23 -3.47 0.02 0.00 0.00 175.30 173.89 3i1t n ASP 55 N -0.00 2.52 -3.74 0.23 -0.08 -1.26 -3.29 116.55 110.93 3i1t n ASP 55 Ca -0.09 0.25 -0.23 0.00 -1.51 0.00 0.00 54.79 53.21 3i1t n ASP 55 Cb 0.62 -1.39 0.02 0.00 2.34 0.00 0.00 41.12 42.72 3i1t n ASP 55 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 3i1t n GLY 56 N 6.22 -0.36 1.84 0.27 0.00 -1.26 -4.99 105.19 106.92 3i1t n GLY 56 Ca 0.37 0.17 -0.16 0.00 0.00 0.00 0.00 46.02 46.40 3i1t n GLY 56 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3i1t n TYR 57 N -4.26 0.53 -1.73 1.61 0.53 -1.21 -5.10 117.16 107.54 3i1t n TYR 57 Ca -0.28 -1.29 -0.42 0.00 -1.02 0.00 0.00 57.90 54.89 3i1t n TYR 57 Cb 0.67 -0.15 -0.01 0.00 -1.03 0.00 0.00 39.34 38.82 3i1t n TYR 57 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 3i1t n ALA 58 N -2.15 2.06 -1.51 -0.72 0.00 -1.26 -3.91 120.51 113.02 3i1t n ALA 58 Ca -0.10 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.71 3i1t n ALA 58 Cb 0.33 -2.39 0.00 0.00 0.00 0.00 0.00 19.45 17.39 3i1t n ALA 58 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 3i1t n ASP 59 N 1.60 0.00 -4.41 0.00 5.68 -1.26 -4.84 116.55 113.32 3i1t n ASP 59 Ca 0.07 0.00 -0.29 0.00 -0.50 0.00 0.00 54.79 54.07 3i1t n ASP 59 Cb 0.36 0.00 0.22 0.00 -1.14 0.00 0.00 41.12 40.56 3i1t n ASP 59 CO 0.00 0.00 0.00 -0.83 -1.33 0.00 0.00 177.20 175.04 3i1t s GLY 60 N -1.53 1.54 0.00 6.12 0.00 -1.25 -1.75 107.32 110.45 3i1t s GLY 60 Ca 0.00 -0.43 0.00 0.00 0.00 0.00 0.00 44.72 44.29 3i1t s GLY 60 CO 0.00 0.30 0.00 0.79 0.00 0.00 0.00 173.10 174.19 3i1t n TRP 61 N -4.64 0.00 0.28 1.90 7.02 -1.26 -3.93 117.44 116.81 3i1t n TRP 61 Ca 0.06 0.00 0.15 0.00 -1.02 0.00 0.00 57.50 56.69 3i1t n TRP 61 Cb 0.57 0.00 0.83 0.00 -2.42 0.00 0.00 31.31 30.29 3i1t n TRP 61 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 3i1t h ALA 62 N 0.00 1.27 0.00 6.99 0.00 -1.93 0.29 119.26 125.89 3i1t h ALA 62 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.84 3i1t h ALA 62 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 3i1t h ALA 62 CO 0.00 0.09 -0.29 0.37 0.00 0.00 0.00 179.25 179.42 3i1t h GLN 63 N 0.00 0.00 0.05 0.00 5.75 -1.46 -3.26 115.11 116.18 3i1t h GLN 63 Ca -0.00 0.00 -0.32 0.00 -0.15 0.00 0.00 58.65 58.18 3i1t h GLN 63 Cb 0.24 0.00 -0.04 0.00 1.07 0.00 0.00 27.48 28.75 3i1t h GLN 63 CO 0.01 0.00 -1.78 0.00 -2.65 0.00 0.00 178.83 174.41 3i1t n ALA 64 N -2.11 0.92 -0.29 3.38 0.00 -0.00 -3.07 120.51 119.34 3i1t n ALA 64 Ca 0.03 -0.65 0.10 0.00 0.00 0.00 0.00 53.44 52.92 3i1t n ALA 64 Cb 0.53 -0.48 0.26 0.00 0.00 0.00 0.00 19.45 19.76 3i1t n ALA 64 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3i1t h GLY 65 N -0.00 1.38 1.00 0.00 0.00 -0.66 0.94 103.07 105.72 3i1t h GLY 65 Ca -0.44 -0.15 -0.01 0.00 0.00 0.00 0.00 47.33 46.73 3i1t h GLY 65 CO -0.12 -0.21 -0.12 -0.91 0.00 0.00 0.00 176.54 175.18 3i1t h THR 66 N 0.40 0.77 -0.85 4.70 1.35 -1.70 -0.05 112.91 117.53 3i1t h THR 66 Ca 0.51 -0.02 0.08 0.00 -0.55 0.00 0.00 66.41 66.43 3i1t h THR 66 Cb 0.91 0.78 -0.06 0.00 -1.73 0.00 0.00 68.15 68.05 3i1t h THR 66 CO -0.50 0.00 0.55 0.00 -0.25 0.00 0.00 175.52 175.33 3i1t h ALA 67 N 0.43 1.64 0.21 6.62 0.00 -0.55 -0.90 119.26 126.70 3i1t h ALA 67 Ca -0.03 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 3i1t h ALA 67 Cb 0.26 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.84 3i1t h ALA 67 CO 0.05 0.21 -0.10 -0.09 0.00 0.00 0.00 179.25 179.32 3i1t h ARG 68 N 0.87 -0.27 -0.87 0.00 1.12 0.12 0.20 114.38 115.56 3i1t h ARG 68 Ca 0.38 0.02 0.09 0.00 -1.11 0.00 0.00 59.98 59.36 3i1t h ARG 68 Cb 0.33 0.06 -0.06 0.00 -0.01 0.00 0.00 29.97 30.29 3i1t h ARG 68 CO -0.15 0.03 0.56 0.00 -3.11 0.00 0.00 179.97 177.31 3i1t h ALA 69 N 0.12 1.66 0.18 2.80 0.00 -0.25 0.49 119.26 124.26 3i1t h ALA 69 Ca -0.03 -0.01 -0.35 0.00 0.00 0.00 0.00 54.91 54.53 3i1t h ALA 69 Cb 0.43 -0.20 0.01 0.00 0.00 0.00 0.00 17.79 18.03 3i1t h ALA 69 CO 0.05 0.16 -1.75 1.37 0.00 0.00 0.00 179.25 179.08 3i1t h LEU 70 N 0.85 0.60 -0.35 0.00 8.10 -1.16 -2.92 115.31 120.44 3i1t h LEU 70 Ca 0.40 -0.94 -0.11 0.00 0.11 0.00 0.00 57.88 57.34 3i1t h LEU 70 Cb 0.41 -0.20 -0.01 0.00 -0.44 0.00 0.00 40.66 40.42 3i1t h LEU 70 CO -0.17 1.79 -0.23 0.25 -4.11 0.00 0.00 178.44 175.97 3i1t h LEU 71 N 0.08 0.81 -0.27 0.17 7.12 -0.27 0.31 115.31 123.25 3i1t h LEU 71 Ca -0.35 -0.43 -0.19 0.00 0.13 0.00 0.00 57.88 57.04 3i1t h LEU 71 Cb 2.08 -0.23 0.00 0.00 -0.53 0.00 0.00 40.66 41.99 3i1t h LEU 71 CO 0.17 1.07 -0.58 -0.55 -0.13 0.00 0.00 178.44 178.41 3i1t h ASN 72 N 0.56 0.98 0.70 1.25 -1.07 -0.18 -0.74 115.58 117.08 3i1t h ASN 72 Ca 0.07 -0.54 -0.04 0.00 0.07 0.00 0.00 56.30 55.86 3i1t h ASN 72 Cb 0.79 -0.28 -0.01 0.00 -2.07 0.00 0.00 38.32 36.75 3i1t h ASN 72 CO 0.06 1.35 -0.17 0.77 0.07 0.00 0.00 177.43 179.51 3i1t h SER 73 N 0.66 0.00 0.15 6.14 4.64 -1.54 0.31 113.55 123.91 3i1t h SER 73 Ca 0.00 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.19 3i1t h SER 73 Cb 1.20 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.28 3i1t h SER 73 CO 0.13 0.17 -0.49 -0.03 -0.87 0.00 0.00 176.83 175.74 3i1t h MET 74 N 0.00 0.39 0.03 4.77 4.05 -0.21 -2.51 114.93 121.45 3i1t h MET 74 Ca -0.00 -0.22 -0.21 0.00 -0.28 0.00 0.00 59.70 58.98 3i1t h MET 74 Cb 0.57 0.02 -0.01 0.00 -0.80 0.00 0.00 31.60 31.37 3i1t h MET 74 CO 0.02 0.80 -0.98 0.28 0.23 0.00 0.00 176.91 177.26 3i1t h VAL 75 N 0.31 1.57 0.00 -5.77 2.07 -0.13 -1.69 116.25 112.61 3i1t h VAL 75 Ca 0.02 -2.96 0.00 0.00 0.82 0.00 0.00 66.70 64.57 3i1t h VAL 75 Cb 0.97 2.68 0.00 0.00 -1.52 0.00 0.00 31.29 33.43 3i1t h VAL 75 CO 0.08 0.86 0.00 -0.38 0.02 0.00 0.00 177.57 178.15 3i1t n ILE 76 N -3.54 0.83 -0.05 4.57 2.08 0.00 -3.25 119.36 120.01 3i1t n ILE 76 Ca -0.03 0.20 -0.00 0.00 0.56 0.00 0.00 62.75 63.47 3i1t n ILE 76 Cb 0.89 -1.09 -0.13 0.00 -0.75 0.00 0.00 39.64 38.56 3i1t n ILE 76 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 3i1t n GLY 77 N 0.11 -0.79 0.19 7.39 0.00 -0.96 -3.67 105.19 107.45 3i1t n GLY 77 Ca 0.03 -0.33 -0.01 0.00 0.00 0.00 0.00 46.02 45.71 3i1t n GLY 77 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 3i1t h VAL 78 N 0.00 1.31 -1.31 1.61 -1.51 -1.29 -2.79 116.25 112.27 3i1t h VAL 78 Ca -0.24 -1.52 -0.51 0.00 -1.23 0.00 0.00 66.70 63.21 3i1t h VAL 78 Cb 1.44 1.74 -0.41 0.00 -2.13 0.00 0.00 31.29 31.92 3i1t h VAL 78 CO 0.01 0.45 -0.90 0.35 -1.23 0.00 0.00 177.57 176.25 3i1t n THR 79 N -4.02 1.88 0.02 7.19 -2.24 -1.24 -0.34 114.28 115.54 3i1t n THR 79 Ca -0.02 -4.24 0.00 0.00 -2.27 0.00 0.00 64.05 57.52 3i1t n THR 79 Cb 0.47 -0.56 0.00 0.00 -2.10 0.00 0.00 70.33 68.14 3i1t n THR 79 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 3i1t n GLU 80 N -0.34 0.00 0.00 -0.78 0.00 -1.24 -4.92 120.64 113.36 3i1t n GLU 80 Ca 0.28 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.44 3i1t n GLU 80 Cb 0.72 0.00 0.00 0.00 0.00 0.00 0.00 31.44 32.16 3i1t n GLU 80 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3i1t n GLY 81 N -1.09 1.11 3.59 8.31 0.00 -1.05 -5.02 105.19 111.03 3i1t n GLY 81 Ca 0.00 -2.08 -0.27 0.00 0.00 0.00 0.00 46.02 43.67 3i1t n GLY 81 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3i1t s PHE 82 N -1.60 2.42 0.00 1.61 0.08 -1.14 -4.68 117.98 114.68 3i1t s PHE 82 Ca 0.00 -0.71 0.00 0.00 0.12 0.00 0.00 56.93 56.34 3i1t s PHE 82 Cb 0.00 -1.68 0.00 0.00 -0.57 0.00 0.00 43.02 40.77 3i1t s PHE 82 CO 0.00 0.39 0.00 0.25 -0.10 0.00 0.00 175.22 175.76 3i1t n THR 83 N -0.91 0.00 0.00 0.64 -2.24 -1.26 -4.48 114.28 106.02 3i1t n THR 83 Ca -0.05 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.73 3i1t n THR 83 Cb 0.67 -0.18 0.00 0.00 -2.10 0.00 0.00 70.33 68.72 3i1t n THR 83 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 3i1t n LYS 84 N -0.10 0.00 0.00 -0.78 0.00 -1.26 -4.57 118.16 111.44 3i1t n LYS 84 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 3i1t n LYS 84 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.03 3i1t n LYS 84 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.40 177.76 3i1t n LYS 85 N -0.26 0.00 -2.66 -1.58 2.85 -1.21 -4.89 118.16 110.42 3i1t n LYS 85 Ca 0.00 0.00 -0.03 0.00 -1.05 0.00 0.00 58.31 57.23 3i1t n LYS 85 Cb 0.00 0.00 0.05 0.00 -0.65 0.00 0.00 35.03 34.43 3i1t n LYS 85 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63 3i1t n LEU 86 N 0.00 -1.09 -4.72 -5.58 4.77 -0.76 -4.81 117.00 104.80 3i1t n LEU 86 Ca 0.00 -1.67 -0.34 0.00 -0.03 0.00 0.00 56.01 53.97 3i1t n LEU 86 Cb 0.00 0.96 0.10 0.00 -2.33 0.00 0.00 43.42 42.15 3i1t n LEU 86 CO 0.00 1.34 0.78 0.00 -1.33 0.00 0.00 177.39 178.17 3i1t s GLN 87 N 0.02 2.10 0.01 3.23 -2.07 -1.22 -3.01 119.66 118.71 3i1t s GLN 87 Ca 0.12 1.68 -0.11 0.00 -1.82 0.00 0.00 55.36 55.23 3i1t s GLN 87 Cb 0.18 -1.84 0.01 0.00 -1.09 0.00 0.00 33.01 30.27 3i1t s GLN 87 CO -0.12 -1.85 0.21 -0.48 -1.32 0.00 0.00 175.29 171.73 3i1t s LEU 88 N -5.29 1.25 0.01 2.60 0.05 0.41 -2.82 118.68 114.88 3i1t s LEU 88 Ca 0.72 -0.17 0.07 0.00 0.05 0.00 0.00 54.13 54.81 3i1t s LEU 88 Cb -0.27 0.97 -0.02 0.00 -2.05 0.00 0.00 46.19 44.82 3i1t s LEU 88 CO 0.46 -0.46 -0.21 -0.69 -0.55 0.00 0.00 176.35 174.90 3i1t s VAL 89 N -1.77 1.69 0.00 1.48 1.01 -0.62 -4.86 120.40 117.32 3i1t s VAL 89 Ca -0.11 -1.02 0.00 0.00 0.00 0.00 0.00 61.98 60.85 3i1t s VAL 89 Cb -0.05 -1.42 0.00 0.00 0.00 0.00 0.00 36.38 34.91 3i1t s VAL 89 CO 0.01 0.38 0.00 0.61 0.00 0.00 0.00 175.10 176.09 3i1t n GLY 90 N 2.28 -0.23 0.00 4.51 0.00 -1.26 -3.29 105.19 107.20 3i1t n GLY 90 Ca -0.16 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.81 3i1t n GLY 90 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3i1t n VAL 91 N 0.00 0.00 0.29 1.61 0.24 -1.26 -4.93 118.33 114.28 3i1t n VAL 91 Ca 0.00 0.00 0.06 0.00 -2.04 0.00 0.00 64.34 62.36 3i1t n VAL 91 Cb 0.00 0.00 0.30 0.00 -1.47 0.00 0.00 33.84 32.67 3i1t n VAL 91 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 3i1t h GLY 92 N 0.00 0.00 -0.43 7.63 0.00 -2.00 -3.43 103.07 104.84 3i1t h GLY 92 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.30 3i1t h GLY 92 CO 0.00 0.00 0.11 -1.72 0.00 0.00 0.00 176.54 174.93 3i1t n TYR 93 N -2.49 0.02 -2.15 5.60 0.53 0.15 -4.50 117.16 114.33 3i1t n TYR 93 Ca -0.01 0.01 0.00 0.00 -1.02 0.00 0.00 57.90 56.89 3i1t n TYR 93 Cb 0.70 -0.10 0.00 0.00 -1.03 0.00 0.00 39.34 38.91 3i1t n TYR 93 CO 0.00 0.00 0.00 2.89 -1.02 0.00 0.00 176.86 178.73 3i1t n ARG 94 N 0.45 3.24 0.00 -0.72 1.85 -1.26 -4.61 116.66 115.61 3i1t n ARG 94 Ca 0.04 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.89 3i1t n ARG 94 Cb 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.41 3i1t n ARG 94 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 3i1t n ALA 95 N -3.00 0.00 0.10 2.89 0.00 -1.22 -4.64 120.51 114.64 3i1t n ALA 95 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.41 3i1t n ALA 95 Cb 0.00 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.47 3i1t n ALA 95 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3i1t h ALA 96 N 0.00 0.63 -6.81 0.00 0.00 -1.87 -3.44 119.26 107.77 3i1t h ALA 96 Ca 0.00 -0.71 -0.44 0.00 0.00 0.00 0.00 54.91 53.75 3i1t h ALA 96 Cb 0.00 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 3i1t h ALA 96 CO 0.00 0.98 -0.83 1.33 0.00 0.00 0.00 179.25 180.73 3i1t n VAL 97 N -3.50 -2.23 -1.99 0.00 0.24 -1.21 -4.81 118.33 104.83 3i1t n VAL 97 Ca -0.00 -0.28 -0.42 0.00 -2.04 0.00 0.00 64.34 61.59 3i1t n VAL 97 Cb 0.78 -1.93 0.00 0.00 -1.47 0.00 0.00 33.84 31.22 3i1t n VAL 97 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 3i1t n LYS 98 N -3.41 3.20 0.00 7.34 5.02 -0.04 -4.79 118.16 125.48 3i1t n LYS 98 Ca -0.15 -3.00 0.00 0.00 -2.02 0.00 0.00 58.31 53.13 3i1t n LYS 98 Cb 0.48 -3.12 0.00 0.00 -0.02 0.00 0.00 35.03 32.37 3i1t n LYS 98 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3i1t n GLY 99 N 3.51 2.31 0.00 0.72 0.00 -1.26 -2.50 105.19 107.97 3i1t n GLY 99 Ca 0.47 0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.50 3i1t n GLY 99 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3i1t n ASN 100 N 4.49 3.14 -4.66 1.61 6.94 -1.26 -4.54 115.26 120.99 3i1t n ASN 100 Ca 0.00 -0.16 -0.43 0.00 -0.02 0.00 0.00 54.58 53.98 3i1t n ASN 100 Cb 0.00 0.94 -0.02 0.00 -2.36 0.00 0.00 39.78 38.34 3i1t n ASN 100 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 3i1t s VAL 101 N -1.57 4.24 -0.20 3.53 1.01 -1.04 -3.30 120.40 123.07 3i1t s VAL 101 Ca 0.00 1.50 0.01 0.00 0.00 0.00 0.00 61.98 63.49 3i1t s VAL 101 Cb 0.00 -3.97 0.03 0.00 0.00 0.00 0.00 36.38 32.44 3i1t s VAL 101 CO 0.00 -0.13 -0.16 -0.63 0.00 0.00 0.00 175.10 174.18 3i1t s ILE 102 N 3.52 2.23 0.00 2.22 1.01 -1.24 -0.86 121.20 128.08 3i1t s ILE 102 Ca 0.56 -1.05 0.03 0.00 0.00 0.00 0.00 60.65 60.18 3i1t s ILE 102 Cb -0.22 -2.03 -0.01 0.00 0.01 0.00 0.00 42.46 40.21 3i1t s ILE 102 CO 0.15 0.40 -0.08 0.20 0.00 0.00 0.00 174.94 175.61 3i1t s ASN 103 N 1.27 0.94 0.06 3.58 -0.87 -1.26 -3.34 114.94 115.32 3i1t s ASN 103 Ca 0.02 -0.21 0.03 0.00 -1.57 0.00 0.00 52.86 51.13 3i1t s ASN 103 Cb -0.15 -0.08 -0.03 0.00 -0.02 0.00 0.00 41.25 40.97 3i1t s ASN 103 CO -0.10 0.05 -0.09 -0.76 -2.57 0.00 0.00 177.10 173.63 3i1t s LEU 104 N -0.42 2.30 -0.65 0.60 1.43 -1.26 -3.43 118.68 117.26 3i1t s LEU 104 Ca 0.01 -0.64 0.01 0.00 -1.03 0.00 0.00 54.13 52.49 3i1t s LEU 104 Cb -0.04 -0.24 0.16 0.00 0.03 0.00 0.00 46.19 46.10 3i1t s LEU 104 CO -0.00 -0.21 0.44 -0.55 0.23 0.00 0.00 176.35 176.26 3i1t s SER 105 N -1.86 4.94 -0.46 2.29 0.15 -1.26 -3.70 113.70 113.80 3i1t s SER 105 Ca -0.04 -3.27 0.04 0.00 0.70 0.00 0.00 55.95 53.38 3i1t s SER 105 Cb -0.08 -1.74 0.43 0.00 -1.71 0.00 0.00 66.02 62.93 3i1t s SER 105 CO 0.00 -0.23 1.40 0.18 1.20 0.00 0.00 173.24 175.80 3i1t n LEU 106 N 2.84 5.63 -0.05 3.45 4.77 -1.26 0.31 117.00 132.69 3i1t n LEU 106 Ca 0.12 -4.82 0.00 0.00 -0.03 0.00 0.00 56.01 51.28 3i1t n LEU 106 Cb 0.35 -0.56 0.00 0.00 -2.33 0.00 0.00 43.42 40.88 3i1t n LEU 106 CO 0.33 2.00 0.00 0.61 -1.33 0.00 0.00 177.39 179.00 3i1t n GLY 107 N -0.66 0.71 0.00 -0.72 0.00 -1.26 -4.96 105.19 98.29 3i1t n GLY 107 Ca 0.47 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.79 3i1t n GLY 107 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3i1t n PHE 108 N -3.26 -0.08 -0.07 1.61 3.01 -1.26 -5.10 117.46 112.31 3i1t n PHE 108 Ca 0.00 0.00 -0.13 0.00 1.01 0.00 0.00 57.45 58.33 3i1t n PHE 108 Cb 0.41 0.00 -0.06 0.00 -0.01 0.00 0.00 39.48 39.82 3i1t n PHE 108 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 3i1t n SER 109 N -0.69 1.84 -4.87 4.37 3.41 -1.26 -5.02 113.62 111.40 3i1t n SER 109 Ca 0.00 0.07 -0.31 0.00 -0.26 0.00 0.00 58.87 58.37 3i1t n SER 109 Cb 0.00 -0.33 0.01 0.00 -0.26 0.00 0.00 64.21 63.63 3i1t n SER 109 CO 0.00 0.00 0.00 -1.38 -0.16 0.00 0.00 175.04 173.50 3i1t s HIS 110 N -2.26 3.61 0.01 7.33 0.00 -1.26 -5.10 115.29 117.61 3i1t s HIS 110 Ca -0.19 1.23 0.00 0.00 -3.00 0.00 0.00 55.06 53.10 3i1t s HIS 110 Cb 0.06 -2.66 0.00 0.00 -4.00 0.00 0.00 32.58 25.98 3i1t s HIS 110 CO 0.27 -0.61 0.01 -0.35 -1.00 0.00 0.00 174.74 173.07 3i1t n PRO 111 N -2.60 0.82 0.40 -0.38 -0.04 -1.26 -4.90 135.00 127.04 3i1t n PRO 111 Ca 0.05 -0.04 -0.18 0.00 -0.04 0.00 0.00 63.50 63.30 3i1t n PRO 111 Cb 0.54 -0.01 -0.09 0.00 -0.04 0.00 0.00 33.50 33.91 3i1t n PRO 111 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 3i1t h VAL 112 N -0.17 0.20 0.00 0.52 2.07 -1.79 -3.47 116.25 113.61 3i1t h VAL 112 Ca -0.00 -0.13 0.00 0.00 0.82 0.00 0.00 66.70 67.38 3i1t h VAL 112 Cb 0.02 0.23 0.00 0.00 -1.52 0.00 0.00 31.29 30.02 3i1t h VAL 112 CO 0.00 0.01 0.00 0.47 0.02 0.00 0.00 177.57 178.08 3i1t n ASP 113 N -5.48 -2.15 -4.46 0.57 8.00 -1.21 -4.96 116.55 106.85 3i1t n ASP 113 Ca -0.14 0.00 -0.37 0.00 0.71 0.00 0.00 54.79 54.99 3i1t n ASP 113 Cb 0.41 -1.61 -0.12 0.00 -0.02 0.00 0.00 41.12 39.78 3i1t n ASP 113 CO 0.00 0.00 0.00 -2.28 -0.39 0.00 0.00 177.20 174.53 3i1t s HIS 114 N -2.02 3.14 0.00 1.24 5.65 -1.24 -4.97 115.29 117.10 3i1t s HIS 114 Ca 0.00 -0.43 0.00 0.00 0.25 0.00 0.00 55.06 54.88 3i1t s HIS 114 Cb 0.00 -2.30 0.00 0.00 -1.18 0.00 0.00 32.58 29.10 3i1t s HIS 114 CO 0.00 -0.38 0.00 0.00 -0.65 0.00 0.00 174.74 173.71 3i1t n GLN 115 N 4.96 3.52 -4.95 2.88 0.00 -1.26 -3.62 117.38 118.91 3i1t n GLN 115 Ca -0.15 0.00 -0.29 0.00 0.00 0.00 0.00 57.00 56.56 3i1t n GLN 115 Cb 0.50 0.00 -0.15 0.00 0.00 0.00 0.00 30.24 30.60 3i1t n GLN 115 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 3i1t s LEU 116 N 0.00 2.13 0.00 2.61 1.43 -1.21 -4.86 118.68 118.78 3i1t s LEU 116 Ca 0.00 -0.53 0.00 0.00 -1.03 0.00 0.00 54.13 52.57 3i1t s LEU 116 Cb 0.00 -1.21 0.00 0.00 0.03 0.00 0.00 46.19 45.01 3i1t s LEU 116 CO 0.00 0.25 0.00 -2.65 0.23 0.00 0.00 176.35 174.18 3i1t n PRO 117 N 2.01 3.12 -0.37 1.29 -0.02 -1.26 -4.78 135.00 134.98 3i1t n PRO 117 Ca -0.17 0.00 0.32 0.00 -2.02 0.00 0.00 63.50 61.63 3i1t n PRO 117 Cb 0.52 0.00 0.58 0.00 -0.02 0.00 0.00 33.50 34.58 3i1t n PRO 117 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3i1t h ALA 118 N -2.00 2.34 0.00 3.55 0.00 -2.03 -3.36 119.26 117.76 3i1t h ALA 118 Ca 0.00 0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.10 3i1t h ALA 118 Cb 0.00 0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.02 3i1t h ALA 118 CO 0.00 -1.02 0.00 0.41 0.00 0.00 0.00 179.25 178.64 3i1t n GLY 119 N -1.37 -1.53 2.72 0.00 0.00 -1.26 -5.09 105.19 98.66 3i1t n GLY 119 Ca 0.36 0.61 -0.29 0.00 0.00 0.00 0.00 46.02 46.69 3i1t n GLY 119 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3i1t s ILE 120 N 0.00 1.54 0.74 -0.61 -1.16 -1.26 -4.22 121.20 116.23 3i1t s ILE 120 Ca 0.00 -2.76 -0.12 0.00 -0.51 0.00 0.00 60.65 57.27 3i1t s ILE 120 Cb 0.00 -2.07 0.04 0.00 0.61 0.00 0.00 42.46 41.04 3i1t s ILE 120 CO 0.00 -0.92 1.12 0.42 -2.81 0.00 0.00 174.94 172.75 3i1t s THR 121 N 0.14 2.99 0.05 4.00 -4.23 -0.84 -4.62 115.64 113.13 3i1t s THR 121 Ca 0.19 0.32 -0.25 0.00 -1.18 0.00 0.00 61.69 60.77 3i1t s THR 121 Cb -0.21 -3.32 0.06 0.00 1.34 0.00 0.00 72.50 70.38 3i1t s THR 121 CO -0.02 -0.42 0.58 0.00 -0.54 0.00 0.00 174.62 174.22 3i1t s ALA 122 N -3.43 -1.52 -0.30 3.99 0.00 -1.26 -0.51 121.76 118.73 3i1t s ALA 122 Ca 0.59 0.77 -0.15 0.00 0.00 0.00 0.00 51.96 53.18 3i1t s ALA 122 Cb -0.11 0.41 0.18 0.00 0.00 0.00 0.00 23.12 23.59 3i1t s ALA 122 CO 0.51 -0.53 1.11 -2.00 0.00 0.00 0.00 175.76 174.84 3i1t s GLU 123 N -2.43 0.14 0.11 0.00 -6.30 -0.89 -4.77 118.70 104.56 3i1t s GLU 123 Ca -0.05 0.26 -0.06 0.00 -2.50 0.00 0.00 54.97 52.61 3i1t s GLU 123 Cb -0.01 0.15 -0.06 0.00 0.00 0.00 0.00 34.13 34.22 3i1t s GLU 123 CO -0.01 -0.14 0.38 0.00 0.02 0.00 0.00 175.26 175.50 3i1t n PRO 125 N 0.40 0.00 0.00 0.00 -0.02 -1.26 -4.81 135.00 129.31 3i1t n PRO 125 Ca -0.05 0.32 0.00 0.00 -2.02 0.00 0.00 63.50 61.75 3i1t n PRO 125 Cb 0.52 -1.14 0.00 0.00 -0.02 0.00 0.00 33.50 32.86 3i1t n PRO 125 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 3i1t n THR 126 N -1.15 0.00 -0.56 3.45 -1.04 -1.26 -5.01 114.28 108.70 3i1t n THR 126 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 3i1t n THR 126 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 3i1t n THR 126 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3i1t n GLN 127 N 0.00 0.28 0.03 -2.82 3.00 -1.26 -4.70 117.38 111.92 3i1t n GLN 127 Ca 0.00 -0.52 0.11 0.00 -0.01 0.00 0.00 57.00 56.59 3i1t n GLN 127 Cb 0.00 -0.72 0.07 0.00 0.00 0.00 0.00 30.24 29.59 3i1t n GLN 127 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.06 177.31 3i1t n THR 128 N -0.09 0.20 -4.46 5.09 -2.24 -1.26 -4.04 114.28 107.48 3i1t n THR 128 Ca 0.00 -0.23 -0.23 0.00 -2.27 0.00 0.00 64.05 61.32 3i1t n THR 128 Cb 0.24 0.15 -0.09 0.00 -2.10 0.00 0.00 70.33 68.53 3i1t n THR 128 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 3i1t s GLU 129 N -3.18 1.77 -0.13 -0.78 -1.05 -1.26 0.15 118.70 114.23 3i1t s GLU 129 Ca 0.05 -2.04 -0.09 0.00 -0.15 0.00 0.00 54.97 52.73 3i1t s GLU 129 Cb 0.14 -0.59 0.04 0.00 -0.44 0.00 0.00 34.13 33.29 3i1t s GLU 129 CO 0.78 -0.38 0.32 0.42 0.95 0.00 0.00 175.26 177.35 3i1t s ILE 130 N -3.33 -0.01 -0.21 1.83 1.01 -1.16 -4.73 121.20 114.60 3i1t s ILE 130 Ca 0.30 0.05 -0.00 0.00 0.00 0.00 0.00 60.65 61.00 3i1t s ILE 130 Cb 0.05 -0.47 0.02 0.00 0.01 0.00 0.00 42.46 42.07 3i1t s ILE 130 CO 0.15 0.02 -0.13 0.68 0.00 0.00 0.00 174.94 175.66 3i1t s VAL 131 N 0.67 2.49 -0.23 2.92 -7.23 -1.26 -1.82 120.40 115.94 3i1t s VAL 131 Ca -0.04 -0.91 -0.04 0.00 -1.81 0.00 0.00 61.98 59.18 3i1t s VAL 131 Cb -0.05 -2.14 0.00 0.00 0.56 0.00 0.00 36.38 34.75 3i1t s VAL 131 CO -0.04 0.41 -0.04 -0.76 -0.31 0.00 0.00 175.10 174.36 3i1t s LEU 132 N 1.32 3.03 -0.13 1.32 1.02 -1.26 -2.10 118.68 121.88 3i1t s LEU 132 Ca 0.03 -0.53 -0.00 0.00 0.02 0.00 0.00 54.13 53.66 3i1t s LEU 132 Cb -0.14 -1.73 -0.01 0.00 0.02 0.00 0.00 46.19 44.32 3i1t s LEU 132 CO -0.09 -0.06 -0.13 -0.54 0.02 0.00 0.00 176.35 175.55 3i1t s LYS 133 N 1.45 3.38 0.33 1.70 1.02 0.33 -4.26 119.74 123.69 3i1t s LYS 133 Ca 0.04 -0.69 -0.06 0.00 0.02 0.00 0.00 55.97 55.29 3i1t s LYS 133 Cb -0.15 -2.62 0.01 0.00 -0.52 0.00 0.00 37.83 34.55 3i1t s LYS 133 CO -0.03 0.22 0.52 0.20 -0.92 0.00 0.00 175.35 175.33 3i1t s GLY 134 N 0.34 1.20 -0.37 -3.33 0.00 -1.26 -1.98 107.32 101.92 3i1t s GLY 134 Ca -0.11 -1.32 0.06 0.00 0.00 0.00 0.00 44.72 43.34 3i1t s GLY 134 CO 0.06 -0.86 1.51 0.00 0.00 0.00 0.00 173.10 173.81 3i1t n ALA 135 N -0.53 4.94 -3.15 3.20 0.00 -1.26 -2.87 120.51 120.84 3i1t n ALA 135 Ca -0.01 -3.38 0.05 0.00 0.00 0.00 0.00 53.44 50.11 3i1t n ALA 135 Cb 0.61 -0.84 -0.01 0.00 0.00 0.00 0.00 19.45 19.22 3i1t n ALA 135 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3i1t s ASP 136 N -2.66 -0.45 0.50 0.00 3.68 -1.26 -4.75 116.67 111.74 3i1t s ASP 136 Ca 0.50 0.12 0.26 0.00 2.13 0.00 0.00 52.55 55.57 3i1t s ASP 136 Cb 0.43 1.31 1.35 0.00 -1.45 0.00 0.00 42.92 44.56 3i1t s ASP 136 CO 0.01 -0.08 1.91 0.50 0.13 0.00 0.00 175.17 177.63 3i1t h LYS 137 N 7.51 0.11 -0.15 4.34 3.64 -1.90 -1.61 116.57 128.51 3i1t h LYS 137 Ca -0.10 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.27 3i1t h LYS 137 Cb 1.18 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.97 3i1t h LYS 137 CO -0.10 0.07 0.00 0.94 -2.27 0.00 0.00 179.45 178.10 3i1t n GLN 138 N -4.36 0.59 0.00 1.90 7.27 -1.26 -2.72 117.38 118.80 3i1t n GLN 138 Ca 0.17 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.24 3i1t n GLN 138 Cb 0.81 -1.08 0.00 0.00 2.41 0.00 0.00 30.24 32.38 3i1t n GLN 138 CO 0.00 0.00 0.00 0.28 0.07 0.00 0.00 177.06 177.41 3i1t n VAL 139 N -0.32 0.00 0.50 1.69 0.31 -0.61 -4.27 118.33 115.63 3i1t n VAL 139 Ca 0.00 0.00 0.05 0.00 -0.01 0.00 0.00 64.34 64.38 3i1t n VAL 139 Cb 0.04 -0.23 0.27 0.00 -0.91 0.00 0.00 33.84 33.01 3i1t n VAL 139 CO 0.00 0.00 0.00 2.30 -1.32 0.00 0.00 176.83 177.81 3i1t n ILE 140 N -1.78 0.75 -0.05 2.52 -5.35 -1.10 0.14 119.36 114.50 3i1t n ILE 140 Ca 0.00 0.19 0.00 0.00 -0.27 0.00 0.00 62.75 62.67 3i1t n ILE 140 Cb 0.20 -1.01 -0.13 0.00 -1.74 0.00 0.00 39.64 36.95 3i1t n ILE 140 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3i1t n GLY 141 N -0.38 -0.81 0.09 3.28 0.00 -1.13 -3.91 105.19 102.34 3i1t n GLY 141 Ca 0.05 -0.34 -0.15 0.00 0.00 0.00 0.00 46.02 45.57 3i1t n GLY 141 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 3i1t h GLN 142 N 0.00 0.16 0.00 1.61 5.75 0.78 -0.84 115.11 122.56 3i1t h GLN 142 Ca -0.23 -0.17 -0.04 0.00 -0.15 0.00 0.00 58.65 58.06 3i1t h GLN 142 Cb 1.43 0.05 -0.01 0.00 1.07 0.00 0.00 27.48 30.02 3i1t h GLN 142 CO 0.01 0.91 -0.19 -0.39 -2.65 0.00 0.00 178.83 176.52 3i1t h VAL 143 N -0.53 0.42 -0.52 2.39 -1.51 0.90 -2.40 116.25 115.01 3i1t h VAL 143 Ca -0.03 -1.14 -0.10 0.00 -1.23 0.00 0.00 66.70 64.20 3i1t h VAL 143 Cb 0.99 1.84 -0.02 0.00 -2.13 0.00 0.00 31.29 31.97 3i1t h VAL 143 CO 0.04 0.19 -0.08 0.00 -1.23 0.00 0.00 177.57 176.49 3i1t h ALA 144 N 1.81 0.87 0.00 5.19 0.00 -1.66 -2.39 119.26 123.08 3i1t h ALA 144 Ca -0.00 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.58 3i1t h ALA 144 Cb 0.83 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.42 3i1t h ALA 144 CO 0.02 0.65 0.00 0.00 0.00 0.00 0.00 179.25 179.92 3i1t n ALA 145 N -2.49 1.59 -0.08 0.00 0.00 -0.33 0.61 120.51 119.81 3i1t n ALA 145 Ca 0.02 -0.04 -0.06 0.00 0.00 0.00 0.00 53.44 53.35 3i1t n ALA 145 Cb 0.38 -1.18 -0.14 0.00 0.00 0.00 0.00 19.45 18.50 3i1t n ALA 145 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3i1t n ASP 146 N -1.42 0.60 -0.04 0.00 8.00 -0.96 -3.25 116.55 119.49 3i1t n ASP 146 Ca 0.04 0.00 -0.16 0.00 0.71 0.00 0.00 54.79 55.37 3i1t n ASP 146 Cb 0.12 1.06 -0.13 0.00 -0.02 0.00 0.00 41.12 42.15 3i1t n ASP 146 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 3i1t h LEU 147 N 0.00 0.13 -1.43 0.64 3.38 -0.85 -3.31 115.31 113.88 3i1t h LEU 147 Ca -0.42 -0.94 0.04 0.00 0.09 0.00 0.00 57.88 56.64 3i1t h LEU 147 Cb 1.94 -0.04 -0.04 0.00 0.09 0.00 0.00 40.66 42.61 3i1t h LEU 147 CO 0.02 1.16 0.42 0.08 0.09 0.00 0.00 178.44 180.22 3i1t h ARG 148 N -0.81 0.71 0.00 1.13 0.11 -0.03 -3.40 114.38 112.09 3i1t h ARG 148 Ca -0.08 -0.04 0.00 0.00 0.10 0.00 0.00 59.98 59.96 3i1t h ARG 148 Cb 1.22 -0.16 0.00 0.00 1.11 0.00 0.00 29.97 32.14 3i1t h ARG 148 CO 0.02 0.47 0.00 0.00 0.10 0.00 0.00 179.97 180.57 3i1t n ALA 149 N -2.45 0.00 -0.41 0.08 0.00 -1.20 -2.60 120.51 113.92 3i1t n ALA 149 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.52 3i1t n ALA 149 Cb 0.15 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.60 3i1t n ALA 149 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3i1t n TYR 150 N 0.00 0.00 0.00 0.00 0.53 -1.26 -2.48 117.16 113.96 3i1t n TYR 150 Ca 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.88 3i1t n TYR 150 Cb 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 39.34 38.31 3i1t n TYR 150 CO 0.00 0.00 0.00 -2.13 -1.02 0.00 0.00 176.86 173.71 3i1t n ARG 151 N 0.00 0.00 -1.21 -0.72 3.00 -1.26 -5.10 116.66 111.36 3i1t n ARG 151 Ca 0.00 0.38 0.00 0.00 -0.00 0.00 0.00 57.85 58.23 3i1t n ARG 151 Cb 0.00 -0.88 0.00 0.00 0.00 0.00 0.00 32.46 31.58 3i1t n ARG 151 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.63 175.50 3i1t n ARG 152 N -1.70 -3.42 -1.70 -0.14 3.00 -1.03 -4.82 116.66 106.85 3i1t n ARG 152 Ca 0.00 2.48 -0.55 0.00 -0.00 0.00 0.00 57.85 59.78 3i1t n ARG 152 Cb 0.00 -2.75 -0.07 0.00 0.00 0.00 0.00 32.46 29.65 3i1t n ARG 152 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.63 175.33 3i1t n PRO 153 N -0.05 1.37 -2.19 -0.14 -0.02 -1.26 -4.60 135.00 128.10 3i1t n PRO 153 Ca 0.00 0.50 -0.43 0.00 -2.02 0.00 0.00 63.50 61.56 3i1t n PRO 153 Cb 0.00 -2.22 -0.02 0.00 -0.02 0.00 0.00 33.50 31.24 3i1t n PRO 153 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 3i1t s GLU 154 N 3.49 4.04 0.00 -0.52 0.41 -1.26 -4.85 118.70 120.01 3i1t s GLU 154 Ca 0.96 1.79 0.00 0.00 -0.41 0.00 0.00 54.97 57.31 3i1t s GLU 154 Cb -0.99 -3.94 0.00 0.00 -1.78 0.00 0.00 34.13 27.43 3i1t s GLU 154 CO 0.62 -0.99 0.64 -0.35 -0.49 0.00 0.00 175.26 174.69 3i1t n PRO 155 N 7.19 0.00 -0.09 0.39 -0.04 -1.26 -0.19 135.00 141.00 3i1t n PRO 155 Ca 0.17 0.15 -0.14 0.00 -0.04 0.00 0.00 63.50 63.64 3i1t n PRO 155 Cb 0.44 -1.83 -0.07 0.00 -0.04 0.00 0.00 33.50 32.00 3i1t n PRO 155 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 3i1t n TYR 156 N -1.14 0.98 0.58 0.54 4.02 -1.26 -4.26 117.16 116.61 3i1t n TYR 156 Ca 0.00 0.42 0.06 0.00 -0.01 0.00 0.00 57.90 58.37 3i1t n TYR 156 Cb 0.33 -0.95 -0.07 0.00 -0.02 0.00 0.00 39.34 38.63 3i1t n TYR 156 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 176.86 177.48 3i1t n LYS 157 N -4.51 2.72 -0.93 -0.72 5.02 -0.79 -4.80 118.16 114.14 3i1t n LYS 157 Ca -0.21 -0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.07 3i1t n LYS 157 Cb 0.50 -1.11 0.00 0.00 -0.02 0.00 0.00 35.03 34.40 3i1t n LYS 157 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3i1t n GLY 158 N 1.32 0.33 3.54 0.72 0.00 0.73 -4.89 105.19 106.94 3i1t n GLY 158 Ca 0.02 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.76 3i1t n GLY 158 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3i1t n LYS 159 N -1.33 1.45 0.00 1.61 4.81 -1.26 -4.57 118.16 118.86 3i1t n LYS 159 Ca 0.00 -2.34 0.00 0.00 -0.87 0.00 0.00 58.31 55.10 3i1t n LYS 159 Cb 0.17 -3.67 0.00 0.00 0.02 0.00 0.00 35.03 31.55 3i1t n LYS 159 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3i1t n GLY 160 N 5.70 4.17 2.80 3.14 0.00 -1.21 -4.02 105.19 115.77 3i1t n GLY 160 Ca 0.45 -0.54 -0.30 0.00 0.00 0.00 0.00 46.02 45.63 3i1t n GLY 160 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3i1t n VAL 161 N 0.00 2.37 -0.25 1.61 0.31 -1.26 -1.59 118.33 119.52 3i1t n VAL 161 Ca 0.00 -5.10 0.00 0.00 -0.01 0.00 0.00 64.34 59.23 3i1t n VAL 161 Cb 0.00 -2.19 0.00 0.00 -0.91 0.00 0.00 33.84 30.74 3i1t n VAL 161 CO 0.00 0.00 0.00 -2.11 -1.32 0.00 0.00 176.83 173.40 3i1t n ARG 162 N 1.63 1.37 -3.15 5.55 0.00 -1.13 -4.46 116.66 116.47 3i1t n ARG 162 Ca 0.24 0.00 0.05 0.00 -0.00 0.00 0.00 57.85 58.14 3i1t n ARG 162 Cb 0.37 0.00 -0.01 0.00 -0.00 0.00 0.00 32.46 32.82 3i1t n ARG 162 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.63 179.15 3i1t s TYR 163 N 0.27 -1.09 0.00 2.89 -0.00 -1.26 -3.46 117.35 114.70 3i1t s TYR 163 Ca 0.00 1.06 0.00 0.00 -0.00 0.00 0.00 57.07 58.13 3i1t s TYR 163 Cb 0.00 0.35 0.00 0.00 -0.00 0.00 0.00 41.96 42.31 3i1t s TYR 163 CO 0.00 -0.61 0.00 0.00 -0.00 0.00 0.00 175.55 174.94 3i1t n ALA 164 N 5.42 -0.37 0.00 9.51 0.00 -1.26 -2.49 120.51 131.32 3i1t n ALA 164 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.42 3i1t n ALA 164 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.98 3i1t n ALA 164 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3i1t n ASP 165 N 0.28 0.00 -4.10 0.00 2.03 -1.26 -5.04 116.55 108.46 3i1t n ASP 165 Ca 0.00 0.00 -0.36 0.00 0.52 0.00 0.00 54.79 54.95 3i1t n ASP 165 Cb 0.00 0.00 0.07 0.00 -0.72 0.00 0.00 41.12 40.47 3i1t n ASP 165 CO 0.00 0.00 0.00 -1.84 -1.92 0.00 0.00 177.20 173.44 3i1t n GLU 166 N 0.00 -0.21 -0.04 -0.67 0.00 -1.04 -5.01 120.64 113.67 3i1t n GLU 166 Ca 0.00 -0.05 -0.05 0.00 0.00 0.00 0.00 57.16 57.06 3i1t n GLU 166 Cb 0.00 -1.22 -0.02 0.00 0.00 0.00 0.00 31.44 30.20 3i1t n GLU 166 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.13 178.46 3i1t n VAL 167 N -3.14 0.84 -3.46 3.84 0.24 -1.26 -5.02 118.33 110.38 3i1t n VAL 167 Ca -0.00 0.29 -0.18 0.00 -2.04 0.00 0.00 64.34 62.41 3i1t n VAL 167 Cb 0.61 -1.91 0.09 0.00 -1.47 0.00 0.00 33.84 31.16 3i1t n VAL 167 CO 0.00 0.00 0.00 0.52 -2.14 0.00 0.00 176.83 175.21 3i1t n VAL 168 N -3.56 -5.72 0.00 3.34 0.31 -1.26 -4.95 118.33 106.49 3i1t n VAL 168 Ca -0.07 -0.47 0.00 0.00 -0.01 0.00 0.00 64.34 63.79 3i1t n VAL 168 Cb 0.26 -4.86 0.00 0.00 -0.91 0.00 0.00 33.84 28.33 3i1t n VAL 168 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 3i1t n ARG 169 N -4.19 0.00 -0.21 5.55 1.74 -1.26 -4.95 116.66 113.34 3i1t n ARG 169 Ca -0.27 0.41 0.00 0.00 -0.77 0.00 0.00 57.85 57.22 3i1t n ARG 169 Cb 0.66 -1.11 0.00 0.00 -1.02 0.00 0.00 32.46 31.00 3i1t n ARG 169 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 3i1t n THR 170 N -1.20 -1.52 -3.76 0.55 -1.04 -1.26 -5.09 114.28 100.96 3i1t n THR 170 Ca 0.00 0.09 -0.21 0.00 -2.04 0.00 0.00 64.05 61.89 3i1t n THR 170 Cb 0.00 -1.39 0.00 0.00 -1.82 0.00 0.00 70.33 67.12 3i1t n THR 170 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 3i1t n LYS 171 N -0.31 0.83 -2.37 -2.82 4.76 -1.26 -5.11 118.16 111.88 3i1t n LYS 171 Ca 0.00 -2.73 -0.25 0.00 -2.87 0.00 0.00 58.31 52.45 3i1t n LYS 171 Cb 0.00 0.26 0.05 0.00 -1.84 0.00 0.00 35.03 33.50 3i1t n LYS 171 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 3i1t s GLU 172 N -3.82 2.60 -0.15 1.97 2.02 -1.26 -4.90 118.70 115.16 3i1t s GLU 172 Ca 0.26 -0.21 -0.29 0.00 0.02 0.00 0.00 54.97 54.75 3i1t s GLU 172 Cb -0.02 -2.27 -0.03 0.00 0.10 0.00 0.00 34.13 31.91 3i1t s GLU 172 CO 0.17 -0.89 1.46 0.00 0.02 0.00 0.00 175.26 176.02 3i1t s ALA 173 N -3.05 3.56 -0.46 5.21 0.00 -1.26 -4.87 121.76 120.89 3i1t s ALA 173 Ca 0.56 0.60 -0.43 0.00 0.00 0.00 0.00 51.96 52.69 3i1t s ALA 173 Cb -0.11 -3.72 -0.18 0.00 0.00 0.00 0.00 23.12 19.12 3i1t s ALA 173 CO 0.44 -1.43 2.01 1.17 0.00 0.00 0.00 175.76 177.95 3i1t n LYS 174 N 7.03 0.23 -1.78 0.00 4.81 -1.26 -4.83 118.16 122.35 3i1t n LYS 174 Ca 0.16 0.07 -0.42 0.00 -0.87 0.00 0.00 58.31 57.24 3i1t n LYS 174 Cb 0.44 -1.67 -0.03 0.00 0.02 0.00 0.00 35.03 33.79 3i1t n LYS 174 CO 0.00 0.00 0.00 0.21 1.17 0.00 0.00 177.40 178.78 3i1t s LYS 175 N 5.26 3.78 0.00 1.64 2.36 -1.26 -5.34 119.74 126.17 3i1t s LYS 175 Ca 1.14 2.19 0.32 0.00 -2.55 0.00 0.00 55.97 57.07 3i1t s LYS 175 Cb -1.38 -4.18 1.81 0.00 -1.05 0.00 0.00 37.83 33.03 3i1t s LYS 175 CO 0.67 -1.35 2.17 0.36 1.55 0.00 0.00 175.35 178.76