#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u7t n VAL 8 N 0.00 0.00 -1.64 -3.33 0.24 -1.26 -4.90 118.33 107.44 1u7t n VAL 8 Ca 0.00 -0.24 -0.50 0.00 -2.04 0.00 0.00 64.34 61.57 1u7t n VAL 8 Cb 0.00 0.61 -0.05 0.00 -1.47 0.00 0.00 33.84 32.93 1u7t n VAL 8 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 1u7t n LYS 9 N 0.02 1.63 0.00 7.34 4.01 -1.25 -1.13 118.16 128.78 1u7t n LYS 9 Ca 0.16 0.59 0.00 0.00 -0.51 0.00 0.00 58.31 58.55 1u7t n LYS 9 Cb 0.38 -2.30 0.00 0.00 -0.51 0.00 0.00 35.03 32.60 1u7t n LYS 9 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1u7t n GLY 10 N 3.11 2.65 3.76 0.72 0.00 -0.01 -4.89 105.19 110.53 1u7t n GLY 10 Ca 0.18 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.87 1u7t n GLY 10 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1u7t s LEU 11 N 0.00 3.44 -0.21 0.99 1.43 -0.28 -4.70 118.68 119.34 1u7t s LEU 11 Ca 0.00 2.13 -0.04 0.00 -1.03 0.00 0.00 54.13 55.19 1u7t s LEU 11 Cb 0.00 -4.57 -0.01 0.00 0.03 0.00 0.00 46.19 41.64 1u7t s LEU 11 CO 0.00 -1.72 -0.05 -0.69 0.23 0.00 0.00 176.35 174.13 1u7t s VAL 12 N -2.14 3.40 -0.08 -1.59 1.01 -1.26 -0.17 120.40 119.57 1u7t s VAL 12 Ca 0.70 -0.49 0.05 0.00 0.00 0.00 0.00 61.98 62.24 1u7t s VAL 12 Cb -0.23 -2.54 -0.00 0.00 0.00 0.00 0.00 36.38 33.61 1u7t s VAL 12 CO 0.40 0.43 -0.24 0.00 0.00 0.00 0.00 175.10 175.69 1u7t s ALA 13 N 1.34 2.14 -0.26 5.51 0.00 -0.37 -0.12 121.76 129.99 1u7t s ALA 13 Ca 0.04 -0.98 -0.12 0.00 0.00 0.00 0.00 51.96 50.90 1u7t s ALA 13 Cb -0.14 -0.75 -0.05 0.00 0.00 0.00 0.00 23.12 22.18 1u7t s ALA 13 CO -0.02 0.33 0.24 0.08 0.00 0.00 0.00 175.76 176.39 1u7t s VAL 14 N 0.16 5.28 -0.28 0.00 1.01 0.63 -0.73 120.40 126.47 1u7t s VAL 14 Ca -0.13 0.32 0.02 0.00 0.00 0.00 0.00 61.98 62.19 1u7t s VAL 14 Cb -0.16 -3.58 0.06 0.00 0.00 0.00 0.00 36.38 32.70 1u7t s VAL 14 CO 0.07 0.26 -0.06 -0.63 0.00 0.00 0.00 175.10 174.74 1u7t s ILE 15 N 1.56 2.36 0.36 2.22 1.01 -0.14 -0.57 121.20 128.00 1u7t s ILE 15 Ca 0.10 -1.69 -0.21 0.00 0.00 0.00 0.00 60.65 58.85 1u7t s ILE 15 Cb -0.15 -2.43 -0.10 0.00 0.01 0.00 0.00 42.46 39.79 1u7t s ILE 15 CO 0.08 -0.13 0.89 0.42 0.00 0.00 0.00 174.94 176.20 1u7t s THR 16 N 1.10 4.42 -1.18 2.92 -4.23 -0.24 -1.23 115.64 117.21 1u7t s THR 16 Ca -0.05 1.45 0.00 0.00 -1.18 0.00 0.00 61.69 61.90 1u7t s THR 16 Cb -0.20 -3.73 0.00 0.00 1.34 0.00 0.00 72.50 69.91 1u7t s THR 16 CO -0.05 -0.13 0.00 0.61 -0.54 0.00 0.00 174.62 174.52 1u7t n GLY 17 N -0.16 0.22 0.00 3.99 0.00 -0.35 -1.45 105.19 107.45 1u7t n GLY 17 Ca 0.04 -0.36 0.13 0.00 0.00 0.00 0.00 46.02 45.83 1u7t n GLY 17 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1u7t n GLY 18 N -1.11 -1.06 0.10 -0.02 0.00 -1.10 -3.01 105.19 98.99 1u7t n GLY 18 Ca -0.15 -0.14 0.13 0.00 0.00 0.00 0.00 46.02 45.87 1u7t n GLY 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u7t n ALA 19 N -1.20 2.92 -3.02 4.61 0.00 -1.26 -3.45 120.51 119.10 1u7t n ALA 19 Ca 0.15 -0.28 -0.09 0.00 0.00 0.00 0.00 53.44 53.21 1u7t n ALA 19 Cb 0.17 -1.27 -0.05 0.00 0.00 0.00 0.00 19.45 18.30 1u7t n ALA 19 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1u7t s SER 20 N -2.67 -0.11 0.00 0.00 0.15 -1.16 -4.76 113.70 105.15 1u7t s SER 20 Ca 0.22 -0.68 0.00 0.00 0.70 0.00 0.00 55.95 56.19 1u7t s SER 20 Cb 0.19 0.51 0.00 0.00 -1.71 0.00 0.00 66.02 65.01 1u7t s SER 20 CO 0.54 -0.98 0.00 0.61 1.20 0.00 0.00 173.24 174.61 1u7t n GLY 21 N -0.28 2.12 0.33 9.45 0.00 -1.26 -1.60 105.19 113.95 1u7t n GLY 21 Ca -0.09 0.15 -0.06 0.00 0.00 0.00 0.00 46.02 46.02 1u7t n GLY 21 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1u7t h LEU 22 N 0.00 1.07 -0.68 0.99 3.38 -1.91 -1.26 115.31 116.90 1u7t h LEU 22 Ca 0.00 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 57.77 1u7t h LEU 22 Cb 0.00 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.44 1u7t h LEU 22 CO 0.00 0.97 0.37 1.23 0.09 0.00 0.00 178.44 181.10 1u7t h GLY 23 N 1.12 1.01 0.99 0.83 0.00 -1.62 -1.42 103.07 103.98 1u7t h GLY 23 Ca 0.25 -0.46 -0.07 0.00 0.00 0.00 0.00 47.33 47.06 1u7t h GLY 23 CO -0.02 0.44 0.03 -2.00 0.00 0.00 0.00 176.54 174.99 1u7t h LEU 24 N 0.93 0.80 -1.16 3.11 5.85 -0.90 -1.17 115.31 122.77 1u7t h LEU 24 Ca 0.24 -0.29 -0.03 0.00 0.84 0.00 0.00 57.88 58.63 1u7t h LEU 24 Cb 0.04 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 40.83 1u7t h LEU 24 CO -0.04 0.89 0.20 0.00 -0.34 0.00 0.00 178.44 179.15 1u7t h ALA 25 N 0.94 1.34 -0.06 1.25 0.00 -1.12 -0.05 119.26 121.56 1u7t h ALA 25 Ca 0.14 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1u7t h ALA 25 Cb 0.46 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 1u7t h ALA 25 CO 0.02 0.49 0.01 1.15 0.00 0.00 0.00 179.25 180.92 1u7t h THR 26 N 0.77 1.19 -0.27 0.00 2.02 -0.99 -2.18 112.91 113.45 1u7t h THR 26 Ca 0.18 -0.58 0.05 0.00 0.77 0.00 0.00 66.41 66.84 1u7t h THR 26 Cb 0.18 1.48 -0.05 0.00 -1.74 0.00 0.00 68.15 68.02 1u7t h THR 26 CO -0.01 0.16 -0.04 0.00 0.37 0.00 0.00 175.52 175.99 1u7t h ALA 27 N 0.79 0.20 -0.18 6.16 0.00 -0.80 -1.50 119.26 123.94 1u7t h ALA 27 Ca 0.02 0.10 0.05 0.00 0.00 0.00 0.00 54.91 55.08 1u7t h ALA 27 Cb 0.24 0.18 -0.07 0.00 0.00 0.00 0.00 17.79 18.15 1u7t h ALA 27 CO 0.00 -0.45 -0.28 0.93 0.00 0.00 0.00 179.25 179.45 1u7t h GLU 28 N 0.03 -0.31 -0.14 0.00 5.08 -0.95 -0.38 114.58 117.90 1u7t h GLU 28 Ca 0.13 0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.51 1u7t h GLU 28 Cb 0.19 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 1u7t h GLU 28 CO -0.26 -0.21 0.08 -0.09 -1.00 0.00 0.00 179.01 177.54 1u7t h ARG 29 N -0.32 0.20 -0.32 2.33 2.43 -1.07 0.17 114.38 117.79 1u7t h ARG 29 Ca 0.12 -0.02 -0.05 0.00 -0.81 0.00 0.00 59.98 59.22 1u7t h ARG 29 Cb 0.50 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.00 1u7t h ARG 29 CO -0.37 0.19 0.02 -0.07 -1.51 0.00 0.00 179.97 178.23 1u7t h LEU 30 N 0.15 0.55 -0.80 3.80 3.38 -1.13 -2.10 115.31 119.15 1u7t h LEU 30 Ca 0.05 -0.30 -0.04 0.00 0.09 0.00 0.00 57.88 57.69 1u7t h LEU 30 Cb 0.05 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 40.62 1u7t h LEU 30 CO -0.01 0.71 0.36 0.58 0.09 0.00 0.00 178.44 180.16 1u7t h VAL 31 N 0.37 1.26 -0.00 1.22 2.07 -1.00 -0.98 116.25 119.19 1u7t h VAL 31 Ca 0.09 -0.77 0.00 0.00 0.82 0.00 0.00 66.70 66.85 1u7t h VAL 31 Cb 0.42 0.27 -0.00 0.00 -1.52 0.00 0.00 31.29 30.45 1u7t h VAL 31 CO 0.01 0.32 0.00 1.23 0.02 0.00 0.00 177.57 179.15 1u7t h GLY 32 N 1.15 0.00 -2.40 2.17 0.00 -0.29 -0.18 103.07 103.53 1u7t h GLY 32 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.60 1u7t h GLY 32 CO -0.03 0.00 0.00 -1.06 0.00 0.00 0.00 176.54 175.45 1u7t n GLN 33 N -3.24 2.51 -0.52 4.80 1.13 -0.47 -4.94 117.38 116.65 1u7t n GLN 33 Ca -0.03 -2.35 0.00 0.00 -1.94 0.00 0.00 57.00 52.68 1u7t n GLN 33 Cb 0.07 -1.51 0.00 0.00 0.11 0.00 0.00 30.24 28.92 1u7t n GLN 33 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1u7t n GLY 34 N 1.54 0.72 3.97 1.08 0.00 -0.08 -3.88 105.19 108.54 1u7t n GLY 34 Ca 0.22 -0.20 -0.23 0.00 0.00 0.00 0.00 46.02 45.81 1u7t n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u7t s ALA 35 N -2.00 3.65 -0.00 4.61 0.00 -0.61 -0.83 121.76 126.58 1u7t s ALA 35 Ca 0.00 -1.33 0.02 0.00 0.00 0.00 0.00 51.96 50.65 1u7t s ALA 35 Cb 0.00 -2.19 -0.03 0.00 0.00 0.00 0.00 23.12 20.89 1u7t s ALA 35 CO 0.00 -1.08 -0.03 -1.12 0.00 0.00 0.00 175.76 173.53 1u7t s SER 36 N -4.53 4.87 0.02 0.00 0.01 0.77 -4.30 113.70 110.53 1u7t s SER 36 Ca 0.60 -0.07 0.07 0.00 1.31 0.00 0.00 55.95 57.86 1u7t s SER 36 Cb -0.09 -1.21 -0.02 0.00 0.21 0.00 0.00 66.02 64.91 1u7t s SER 36 CO 0.41 0.29 -0.21 0.00 0.41 0.00 0.00 173.24 174.14 1u7t s ALA 37 N -1.03 1.74 -0.27 1.44 0.00 0.61 -1.24 121.76 123.01 1u7t s ALA 37 Ca 0.18 -0.98 -0.02 0.00 0.00 0.00 0.00 51.96 51.13 1u7t s ALA 37 Cb -0.11 -0.38 0.03 0.00 0.00 0.00 0.00 23.12 22.65 1u7t s ALA 37 CO 0.08 0.41 -0.02 0.08 0.00 0.00 0.00 175.76 176.31 1u7t s VAL 38 N -0.66 3.07 -0.63 0.00 1.01 0.09 -1.07 120.40 122.20 1u7t s VAL 38 Ca 0.08 -1.08 -0.24 0.00 0.00 0.00 0.00 61.98 60.74 1u7t s VAL 38 Cb -0.08 -2.62 0.05 0.00 0.00 0.00 0.00 36.38 33.73 1u7t s VAL 38 CO 0.01 0.09 1.00 -0.76 0.00 0.00 0.00 175.10 175.44 1u7t s LEU 39 N 1.33 4.12 -0.50 3.92 1.43 0.88 -0.96 118.68 128.90 1u7t s LEU 39 Ca -0.01 -0.69 -0.23 0.00 -1.03 0.00 0.00 54.13 52.16 1u7t s LEU 39 Cb -0.18 -2.58 0.04 0.00 0.03 0.00 0.00 46.19 43.50 1u7t s LEU 39 CO -0.02 -1.42 0.84 -0.22 0.23 0.00 0.00 176.35 175.75 1u7t s LEU 40 N 4.26 4.25 0.24 1.79 0.20 -0.37 -0.99 118.68 128.06 1u7t s LEU 40 Ca 0.27 -0.27 -0.11 0.00 0.69 0.00 0.00 54.13 54.71 1u7t s LEU 40 Cb -0.14 -2.88 -0.01 0.00 -0.43 0.00 0.00 46.19 42.73 1u7t s LEU 40 CO 0.14 -1.04 0.43 -0.62 -0.29 0.00 0.00 176.35 174.97 1u7t s ASP 41 N 2.47 -0.06 0.63 3.68 -1.08 -1.17 -1.21 116.67 119.94 1u7t s ASP 41 Ca 0.29 -0.99 -0.18 0.00 -0.52 0.00 0.00 52.55 51.15 1u7t s ASP 41 Cb -0.13 0.56 -0.02 0.00 -1.46 0.00 0.00 42.92 41.87 1u7t s ASP 41 CO 0.21 -1.10 1.23 -0.76 0.52 0.00 0.00 175.17 175.27 1u7t s LEU 42 N -3.04 3.58 0.48 -1.34 1.43 -1.18 0.46 118.68 119.08 1u7t s LEU 42 Ca 0.25 2.45 0.18 0.00 -1.03 0.00 0.00 54.13 55.97 1u7t s LEU 42 Cb 0.00 -4.60 1.18 0.00 0.03 0.00 0.00 46.19 42.81 1u7t s LEU 42 CO 0.09 -1.82 2.01 -0.65 0.23 0.00 0.00 176.35 176.22 1u7t h PRO 43 N 0.59 0.21 0.00 1.29 0.11 -1.90 -1.55 132.00 130.75 1u7t h PRO 43 Ca -0.50 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1u7t h PRO 43 Cb 1.31 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1u7t h PRO 43 CO 0.54 0.14 0.00 -2.95 -0.21 0.00 0.00 178.00 175.51 1u7t h ASN 44 N 0.21 0.00 -3.27 -2.05 -1.07 -1.99 -3.45 115.58 103.95 1u7t h ASN 44 Ca 0.22 0.00 -0.36 0.00 0.07 0.00 0.00 56.30 56.23 1u7t h ASN 44 Cb 0.60 0.00 0.17 0.00 -2.07 0.00 0.00 38.32 37.02 1u7t h ASN 44 CO -0.04 0.00 0.16 -1.54 0.07 0.00 0.00 177.43 176.08 1u7t n SER 45 N -2.31 -1.53 -2.33 6.14 3.41 -0.58 -4.92 113.62 111.49 1u7t n SER 45 Ca 0.04 -1.17 -0.34 0.00 -0.26 0.00 0.00 58.87 57.14 1u7t n SER 45 Cb 0.35 -0.90 0.07 0.00 -0.26 0.00 0.00 64.21 63.47 1u7t n SER 45 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1u7t n GLY 46 N -3.73 5.68 0.34 5.00 0.00 -1.26 -4.67 105.19 106.56 1u7t n GLY 46 Ca 0.14 -2.21 -0.02 0.00 0.00 0.00 0.00 46.02 43.93 1u7t n GLY 46 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1u7t h GLY 47 N 2.12 1.10 0.98 -0.02 0.00 -1.86 -1.29 103.07 104.10 1u7t h GLY 47 Ca 0.58 -0.51 -0.00 0.00 0.00 0.00 0.00 47.33 47.39 1u7t h GLY 47 CO 1.51 0.49 0.17 -2.09 0.00 0.00 0.00 176.54 176.62 1u7t h GLU 48 N 1.02 0.38 -0.59 4.80 4.57 -1.95 0.57 114.58 123.38 1u7t h GLU 48 Ca 0.25 -0.03 -0.05 0.00 -1.18 0.00 0.00 59.36 58.35 1u7t h GLU 48 Cb 0.08 -0.08 -0.03 0.00 -0.16 0.00 0.00 28.75 28.56 1u7t h GLU 48 CO -0.04 0.30 0.16 0.00 -1.18 0.00 0.00 179.01 178.25 1u7t h ALA 49 N 1.06 1.16 -0.27 2.92 0.00 -1.89 -1.52 119.26 120.73 1u7t h ALA 49 Ca 0.10 -0.21 -0.08 0.00 0.00 0.00 0.00 54.91 54.73 1u7t h ALA 49 Cb 0.01 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 1u7t h ALA 49 CO -0.02 0.57 -0.13 1.96 0.00 0.00 0.00 179.25 181.63 1u7t h GLN 50 N 0.88 0.56 -0.99 0.00 1.08 -0.26 -0.02 115.11 116.36 1u7t h GLN 50 Ca 0.19 -0.25 0.02 0.00 -1.45 0.00 0.00 58.65 57.17 1u7t h GLN 50 Cb 0.30 -0.02 -0.05 0.00 -0.05 0.00 0.00 27.48 27.66 1u7t h GLN 50 CO -0.00 0.81 0.65 0.00 -0.95 0.00 0.00 178.83 179.34 1u7t h ALA 51 N 0.74 1.32 -0.61 3.87 0.00 -0.89 0.71 119.26 124.39 1u7t h ALA 51 Ca 0.06 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1u7t h ALA 51 Cb 0.64 -0.38 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 1u7t h ALA 51 CO 0.04 0.61 0.38 -0.22 0.00 0.00 0.00 179.25 180.06 1u7t h LYS 52 N 1.30 0.83 0.00 0.00 3.11 -1.00 -1.91 116.57 118.90 1u7t h LYS 52 Ca 0.38 -0.07 -0.08 0.00 -2.81 0.00 0.00 60.65 58.07 1u7t h LYS 52 Cb -0.09 -0.18 -0.01 0.00 -1.00 0.00 0.00 32.23 30.96 1u7t h LYS 52 CO -0.10 0.58 -0.36 0.87 -2.81 0.00 0.00 179.45 177.64 1u7t h LYS 53 N 0.83 0.00 -0.00 1.90 1.57 0.07 -3.15 116.57 117.78 1u7t h LYS 53 Ca 0.22 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.00 1u7t h LYS 53 Cb -0.04 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.27 1u7t h LYS 53 CO -0.04 0.36 -0.18 1.28 -0.57 0.00 0.00 179.45 180.30 1u7t n LEU 54 N -3.93 0.57 0.00 2.94 4.77 0.14 -5.02 117.00 116.47 1u7t n LEU 54 Ca -0.02 -0.02 0.00 0.00 -0.03 0.00 0.00 56.01 55.95 1u7t n LEU 54 Cb 0.42 -0.20 0.00 0.00 -2.33 0.00 0.00 43.42 41.31 1u7t n LEU 54 CO 0.38 0.11 0.00 0.61 -1.33 0.00 0.00 177.39 177.16 1u7t n GLY 55 N 1.34 -3.28 0.31 -0.72 0.00 -0.96 -4.59 105.19 97.28 1u7t n GLY 55 Ca 0.12 -2.15 0.21 0.00 0.00 0.00 0.00 46.02 44.20 1u7t n GLY 55 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1u7t h ASN 56 N 0.00 0.00 -0.35 1.61 -0.26 -1.90 -0.46 115.58 114.23 1u7t h ASN 56 Ca 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.74 1u7t h ASN 56 Cb 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.26 1u7t h ASN 56 CO 0.00 0.00 0.00 0.59 -1.06 0.00 0.00 177.43 176.96 1u7t n ASN 57 N -3.08 2.93 -3.82 5.81 5.03 -1.26 -4.83 115.26 116.04 1u7t n ASN 57 Ca -0.01 -2.28 -0.19 0.00 0.87 0.00 0.00 54.58 52.96 1u7t n ASN 57 Cb 0.17 -0.46 -0.17 0.00 -1.02 0.00 0.00 39.78 38.31 1u7t n ASN 57 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1u7t s VAL 59 N 1.20 1.24 -0.19 0.00 -7.23 -0.23 -4.68 120.40 110.52 1u7t s VAL 59 Ca -0.07 -1.69 -0.13 0.00 -1.81 0.00 0.00 61.98 58.28 1u7t s VAL 59 Cb -0.13 -1.49 -0.05 0.00 0.56 0.00 0.00 36.38 35.27 1u7t s VAL 59 CO -0.02 -0.44 0.25 0.12 -0.31 0.00 0.00 175.10 174.70 1u7t s PHE 60 N -2.18 3.42 -0.33 2.82 5.36 -1.26 -0.08 117.98 125.72 1u7t s PHE 60 Ca 0.08 0.48 0.03 0.00 -0.96 0.00 0.00 56.93 56.56 1u7t s PHE 60 Cb -0.05 -2.31 0.09 0.00 -0.34 0.00 0.00 43.02 40.42 1u7t s PHE 60 CO 0.02 0.20 0.03 0.00 -1.46 0.00 0.00 175.22 174.01 1u7t s ALA 61 N 0.62 2.86 0.14 11.12 0.00 -0.16 -4.90 121.76 131.44 1u7t s ALA 61 Ca 0.13 -2.39 -0.31 0.00 0.00 0.00 0.00 51.96 49.39 1u7t s ALA 61 Cb -0.13 -1.93 -0.10 0.00 0.00 0.00 0.00 23.12 20.96 1u7t s ALA 61 CO 0.03 -1.60 1.69 -1.25 0.00 0.00 0.00 175.76 174.62 1u7t s PRO 62 N 0.96 4.17 -0.18 0.00 0.04 -1.26 -3.01 135.00 135.71 1u7t s PRO 62 Ca 0.07 2.47 -0.29 0.00 0.04 0.00 0.00 61.00 63.29 1u7t s PRO 62 Cb -0.19 -3.34 0.13 0.00 0.04 0.00 0.00 34.50 31.13 1u7t s PRO 62 CO -0.07 -0.73 1.01 0.00 0.04 0.00 0.00 177.00 177.25 1u7t s ALA 63 N 1.88 -1.94 -0.23 8.56 0.00 0.17 -4.78 121.76 125.41 1u7t s ALA 63 Ca 0.75 1.63 -0.13 0.00 0.00 0.00 0.00 51.96 54.21 1u7t s ALA 63 Cb -0.45 -0.83 -0.04 0.00 0.00 0.00 0.00 23.12 21.80 1u7t s ALA 63 CO 0.33 -0.30 0.29 0.34 0.00 0.00 0.00 175.76 176.43 1u7t s ASP 64 N -0.89 6.25 0.31 0.00 3.68 -1.26 -3.07 116.67 121.69 1u7t s ASP 64 Ca -0.01 0.28 0.25 0.00 2.13 0.00 0.00 52.55 55.20 1u7t s ASP 64 Cb -0.01 -2.17 1.09 0.00 -1.45 0.00 0.00 42.92 40.38 1u7t s ASP 64 CO 0.00 -0.05 1.75 -0.37 0.13 0.00 0.00 175.17 176.64 1u7t h VAL 65 N 5.12 0.00 -0.01 1.11 -1.51 -1.95 -2.32 116.25 116.70 1u7t h VAL 65 Ca -0.36 -0.22 0.00 0.00 -1.23 0.00 0.00 66.70 64.89 1u7t h VAL 65 Cb 1.17 0.94 0.00 0.00 -2.13 0.00 0.00 31.29 31.27 1u7t h VAL 65 CO 0.67 0.00 -0.06 0.35 -1.23 0.00 0.00 177.57 177.30 1u7t n THR 66 N -2.36 0.00 -4.14 7.19 -2.24 -1.26 -4.46 114.28 107.01 1u7t n THR 66 Ca 0.01 -0.09 -0.35 0.00 -2.27 0.00 0.00 64.05 61.35 1u7t n THR 66 Cb 0.20 -0.04 -0.13 0.00 -2.10 0.00 0.00 70.33 68.26 1u7t n THR 66 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1u7t s SER 67 N -2.23 4.56 0.12 3.42 0.15 -0.87 -4.96 113.70 113.88 1u7t s SER 67 Ca 0.36 -0.27 -0.21 0.00 0.70 0.00 0.00 55.95 56.53 1u7t s SER 67 Cb 0.21 -1.77 -0.05 0.00 -1.71 0.00 0.00 66.02 62.70 1u7t s SER 67 CO 0.41 0.06 1.70 -0.08 1.20 0.00 0.00 173.24 176.53 1u7t h GLU 68 N 7.51 -0.08 -0.66 5.44 4.81 -1.87 -2.58 114.58 127.14 1u7t h GLU 68 Ca -0.36 0.01 0.01 0.00 -0.13 0.00 0.00 59.36 58.88 1u7t h GLU 68 Cb 1.18 0.02 -0.03 0.00 0.63 0.00 0.00 28.75 30.54 1u7t h GLU 68 CO 0.60 -0.05 0.44 0.87 -0.73 0.00 0.00 179.01 180.14 1u7t h LYS 69 N -0.08 0.88 -0.49 1.92 1.57 -1.94 -1.34 116.57 117.08 1u7t h LYS 69 Ca 0.08 -0.05 -0.03 0.00 -1.87 0.00 0.00 60.65 58.78 1u7t h LYS 69 Cb 0.20 -0.20 -0.02 0.00 0.08 0.00 0.00 32.23 32.29 1u7t h LYS 69 CO -0.18 0.58 0.20 -0.44 -0.57 0.00 0.00 179.45 179.05 1u7t h ASP 70 N 0.90 0.66 0.19 0.86 5.19 -1.80 -0.93 116.42 121.50 1u7t h ASP 70 Ca 0.24 -0.16 -0.14 0.00 -0.62 0.00 0.00 57.03 56.36 1u7t h ASP 70 Cb -0.10 -0.17 -0.01 0.00 0.18 0.00 0.00 39.33 39.23 1u7t h ASP 70 CO -0.05 0.64 -0.51 0.58 -3.12 0.00 0.00 179.24 176.77 1u7t h VAL 71 N 0.65 1.34 -0.59 -1.35 2.07 -1.20 -0.60 116.25 116.57 1u7t h VAL 71 Ca 0.16 -1.77 -0.00 0.00 0.82 0.00 0.00 66.70 65.92 1u7t h VAL 71 Cb 0.18 1.81 -0.03 0.00 -1.52 0.00 0.00 31.29 31.72 1u7t h VAL 71 CO -0.02 0.53 0.36 1.56 0.02 0.00 0.00 177.57 180.03 1u7t h GLN 72 N 0.28 0.80 0.08 1.57 4.20 -1.01 0.19 115.11 121.22 1u7t h GLN 72 Ca 0.01 -0.07 -0.00 0.00 0.06 0.00 0.00 58.65 58.65 1u7t h GLN 72 Cb 1.00 -0.17 0.00 0.00 0.30 0.00 0.00 27.48 28.61 1u7t h GLN 72 CO 0.09 0.56 -0.04 1.15 -0.67 0.00 0.00 178.83 179.92 1u7t h THR 73 N 0.80 0.98 -0.61 -0.54 2.02 -0.69 0.04 112.91 114.90 1u7t h THR 73 Ca 0.21 -0.20 -0.04 0.00 0.77 0.00 0.00 66.41 67.15 1u7t h THR 73 Cb -0.04 1.11 -0.03 0.00 -1.74 0.00 0.00 68.15 67.46 1u7t h THR 73 CO -0.04 0.05 0.20 0.00 0.37 0.00 0.00 175.52 176.10 1u7t h ALA 74 N 0.72 1.20 -0.46 6.16 0.00 -0.94 0.10 119.26 126.04 1u7t h ALA 74 Ca -0.01 -0.19 -0.12 0.00 0.00 0.00 0.00 54.91 54.59 1u7t h ALA 74 Cb 0.16 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1u7t h ALA 74 CO 0.02 0.56 -0.19 -0.07 0.00 0.00 0.00 179.25 179.58 1u7t h LEU 75 N 0.90 0.93 -0.67 0.00 3.38 -0.45 -0.43 115.31 118.97 1u7t h LEU 75 Ca 0.20 -0.33 -0.00 0.00 0.09 0.00 0.00 57.88 57.84 1u7t h LEU 75 Cb 0.24 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 1u7t h LEU 75 CO -0.01 1.09 0.40 0.00 0.09 0.00 0.00 178.44 180.01 1u7t h ALA 76 N 0.98 0.85 -0.26 1.53 0.00 -0.61 -0.79 119.26 120.95 1u7t h ALA 76 Ca 0.11 -0.08 0.02 0.00 0.00 0.00 0.00 54.91 54.96 1u7t h ALA 76 Cb 0.73 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 1u7t h ALA 76 CO 0.06 0.32 0.12 1.25 0.00 0.00 0.00 179.25 181.00 1u7t h LEU 77 N 0.91 0.18 -0.59 0.00 6.46 -0.69 0.34 115.31 121.92 1u7t h LEU 77 Ca 0.24 0.01 0.01 0.00 -0.12 0.00 0.00 57.88 58.02 1u7t h LEU 77 Cb -0.03 -0.02 -0.03 0.00 -0.73 0.00 0.00 40.66 39.85 1u7t h LEU 77 CO -0.05 0.14 0.39 0.00 -0.62 0.00 0.00 178.44 178.30 1u7t h ALA 78 N 1.14 0.76 -0.07 1.25 0.00 -0.61 0.93 119.26 122.66 1u7t h ALA 78 Ca 0.11 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1u7t h ALA 78 Cb 0.04 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.60 1u7t h ALA 78 CO -0.08 0.17 0.04 1.57 0.00 0.00 0.00 179.25 180.95 1u7t h LYS 79 N 0.79 0.09 -0.90 0.00 2.10 -0.88 0.06 116.57 117.82 1u7t h LYS 79 Ca 0.22 -0.01 0.02 0.00 -2.00 0.00 0.00 60.65 58.89 1u7t h LYS 79 Cb -0.07 -0.02 -0.05 0.00 -0.90 0.00 0.00 32.23 31.19 1u7t h LYS 79 CO -0.06 0.06 0.59 0.78 -2.00 0.00 0.00 179.45 178.83 1u7t h GLY 80 N 0.08 1.28 0.92 0.07 0.00 -0.31 0.57 103.07 105.68 1u7t h GLY 80 Ca 0.02 -0.46 -0.34 0.00 0.00 0.00 0.00 47.33 46.55 1u7t h GLY 80 CO -0.01 0.43 -1.76 1.70 0.00 0.00 0.00 176.54 176.91 1u7t h LYS 81 N 1.18 0.32 0.00 4.80 1.63 -0.67 -3.40 116.57 120.43 1u7t h LYS 81 Ca 0.34 -0.55 0.00 0.00 -0.85 0.00 0.00 60.65 59.59 1u7t h LYS 81 Cb -0.08 0.21 0.00 0.00 -0.60 0.00 0.00 32.23 31.76 1u7t h LYS 81 CO -0.09 1.22 0.00 1.19 -3.45 0.00 0.00 179.45 178.32 1u7t n PHE 82 N -3.52 0.00 0.00 1.91 3.72 -0.01 -5.01 117.46 114.55 1u7t n PHE 82 Ca -0.24 -0.18 0.00 0.00 -0.05 0.00 0.00 57.45 56.98 1u7t n PHE 82 Cb 1.06 -0.02 0.00 0.00 -0.94 0.00 0.00 39.48 39.59 1u7t n PHE 82 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1u7t n GLY 83 N -0.18 2.33 3.77 1.37 0.00 0.20 -4.90 105.19 107.78 1u7t n GLY 83 Ca 0.00 -0.04 -0.08 0.00 0.00 0.00 0.00 46.02 45.90 1u7t n GLY 83 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1u7t s ARG 84 N 0.00 1.69 -0.18 1.61 1.70 -1.26 -4.85 118.95 117.67 1u7t s ARG 84 Ca 0.00 -0.97 0.01 0.00 -0.47 0.00 0.00 55.73 54.30 1u7t s ARG 84 Cb 0.00 0.59 0.03 0.00 -0.57 0.00 0.00 34.95 35.00 1u7t s ARG 84 CO 0.00 -0.76 -0.15 0.08 -1.08 0.00 0.00 175.30 173.39 1u7t s VAL 85 N -3.91 1.78 -0.15 4.99 1.01 -1.26 -4.70 120.40 118.16 1u7t s VAL 85 Ca 0.11 -0.90 0.17 0.00 0.00 0.00 0.00 61.98 61.36 1u7t s VAL 85 Cb -0.05 -1.72 -0.25 0.00 0.00 0.00 0.00 36.38 34.37 1u7t s VAL 85 CO 0.05 0.37 0.25 0.47 0.00 0.00 0.00 175.10 176.24 1u7t n ASP 86 N 4.68 0.20 -3.85 3.32 9.92 0.82 -4.63 116.55 127.01 1u7t n ASP 86 Ca -0.17 0.09 -0.12 0.00 -0.53 0.00 0.00 54.79 54.06 1u7t n ASP 86 Cb 0.48 0.87 -0.13 0.00 -0.64 0.00 0.00 41.12 41.70 1u7t n ASP 86 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1u7t s VAL 87 N -2.63 0.00 -0.06 2.53 1.01 -0.18 -2.05 120.40 119.03 1u7t s VAL 87 Ca -0.08 -0.03 0.03 0.00 0.00 0.00 0.00 61.98 61.90 1u7t s VAL 87 Cb 0.07 -0.12 0.01 0.00 0.00 0.00 0.00 36.38 36.34 1u7t s VAL 87 CO 0.84 -0.01 -0.14 0.00 0.00 0.00 0.00 175.10 175.78 1u7t s ALA 88 N -0.01 1.34 -0.22 5.51 0.00 -0.54 -0.27 121.76 127.58 1u7t s ALA 88 Ca -0.00 -0.51 0.01 0.00 0.00 0.00 0.00 51.96 51.46 1u7t s ALA 88 Cb -0.01 -0.54 0.05 0.00 0.00 0.00 0.00 23.12 22.62 1u7t s ALA 88 CO 0.00 0.17 -0.10 0.08 0.00 0.00 0.00 175.76 175.91 1u7t s VAL 89 N 0.45 1.75 -0.67 0.00 1.01 0.27 -0.94 120.40 122.28 1u7t s VAL 89 Ca -0.11 -1.18 -0.26 0.00 0.00 0.00 0.00 61.98 60.43 1u7t s VAL 89 Cb -0.14 -1.86 0.04 0.00 0.00 0.00 0.00 36.38 34.42 1u7t s VAL 89 CO 0.03 0.09 1.14 0.20 0.00 0.00 0.00 175.10 176.56 1u7t s ASN 90 N 1.33 6.24 -0.00 3.32 -0.87 0.82 -1.08 114.94 124.70 1u7t s ASN 90 Ca -0.04 -0.47 0.06 0.00 -1.57 0.00 0.00 52.86 50.84 1u7t s ASN 90 Cb -0.17 -2.51 -0.09 0.00 -0.02 0.00 0.00 41.25 38.46 1u7t s ASN 90 CO -0.07 -1.59 0.20 0.00 -2.57 0.00 0.00 177.10 173.07 1u7t n ALA 92 N -1.45 1.48 -3.56 0.00 0.00 -0.81 -4.64 120.51 111.52 1u7t n ALA 92 Ca -0.00 0.40 -0.06 0.00 0.00 0.00 0.00 53.44 53.78 1u7t n ALA 92 Cb 0.14 -2.42 -0.02 0.00 0.00 0.00 0.00 19.45 17.15 1u7t n ALA 92 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1u7t s GLY 93 N 1.70 -0.37 0.12 0.00 0.00 -1.26 -4.73 107.32 102.78 1u7t s GLY 93 Ca 0.81 1.25 0.01 0.00 0.00 0.00 0.00 44.72 46.79 1u7t s GLY 93 CO 0.40 0.41 -0.02 -0.26 0.00 0.00 0.00 173.10 173.63 1u7t s ILE 94 N -2.77 0.51 0.11 0.90 -4.36 -1.26 -5.06 121.20 109.28 1u7t s ILE 94 Ca 0.08 -1.93 0.06 0.00 -0.26 0.00 0.00 60.65 58.60 1u7t s ILE 94 Cb -0.01 -1.86 -0.04 0.00 1.25 0.00 0.00 42.46 41.80 1u7t s ILE 94 CO -0.06 -0.69 -0.15 0.00 0.24 0.00 0.00 174.94 174.28 1u7t s ALA 95 N -3.76 1.47 0.01 2.27 0.00 -1.26 -4.93 121.76 115.57 1u7t s ALA 95 Ca 0.17 -1.23 -0.07 0.00 0.00 0.00 0.00 51.96 50.83 1u7t s ALA 95 Cb 0.06 -0.10 -0.00 0.00 0.00 0.00 0.00 23.12 23.08 1u7t s ALA 95 CO -0.02 0.14 0.13 0.14 0.00 0.00 0.00 175.76 176.16 1u7t s VAL 96 N -1.86 0.09 -0.19 0.00 -7.23 -1.26 -5.11 120.40 104.84 1u7t s VAL 96 Ca 0.06 -0.75 -0.01 0.00 -1.81 0.00 0.00 61.98 59.47 1u7t s VAL 96 Cb -0.06 -0.49 0.00 0.00 0.56 0.00 0.00 36.38 36.39 1u7t s VAL 96 CO 0.03 -0.41 -0.13 0.00 -0.31 0.00 0.00 175.10 174.28 1u7t s ALA 97 N -1.56 2.56 -0.30 1.32 0.00 -1.26 -4.70 121.76 117.84 1u7t s ALA 97 Ca -0.14 -1.15 -0.12 0.00 0.00 0.00 0.00 51.96 50.55 1u7t s ALA 97 Cb -0.07 -1.40 0.14 0.00 0.00 0.00 0.00 23.12 21.79 1u7t s ALA 97 CO 0.01 -0.30 0.79 0.45 0.00 0.00 0.00 175.76 176.71 1u7t s SER 98 N 1.24 -0.90 0.47 0.00 0.15 0.62 -5.02 113.70 110.24 1u7t s SER 98 Ca 0.03 1.26 -0.24 0.00 0.70 0.00 0.00 55.95 57.70 1u7t s SER 98 Cb -0.14 1.96 -0.07 0.00 -1.71 0.00 0.00 66.02 66.06 1u7t s SER 98 CO -0.06 -0.18 1.37 -0.54 1.20 0.00 0.00 173.24 175.03 1u7t s LYS 99 N 2.57 3.60 0.18 5.44 1.02 -1.26 -4.42 119.74 126.88 1u7t s LYS 99 Ca -0.05 2.28 -0.13 0.00 0.02 0.00 0.00 55.97 58.09 1u7t s LYS 99 Cb -0.09 -2.56 0.18 0.00 -0.52 0.00 0.00 37.83 34.85 1u7t s LYS 99 CO -0.18 -0.83 1.73 1.15 -0.92 0.00 0.00 175.35 176.30 1u7t h THR 100 N 2.08 0.78 -2.63 2.17 2.02 -1.93 -3.19 112.91 112.22 1u7t h THR 100 Ca -0.51 -0.10 -0.11 0.00 0.77 0.00 0.00 66.41 66.46 1u7t h THR 100 Cb 1.27 0.45 -0.24 0.00 -1.74 0.00 0.00 68.15 67.89 1u7t h THR 100 CO 0.60 0.06 -0.22 -0.47 0.37 0.00 0.00 175.52 175.86 1u7t s TYR 101 N -6.13 -0.54 -0.32 3.16 6.14 -1.26 -1.89 117.35 116.50 1u7t s TYR 101 Ca -0.13 1.26 -0.00 0.00 0.64 0.00 0.00 57.07 58.84 1u7t s TYR 101 Cb 0.15 0.21 0.07 0.00 0.42 0.00 0.00 41.96 42.82 1u7t s TYR 101 CO 0.73 -0.28 0.03 1.21 0.64 0.00 0.00 175.55 177.88 1u7t s ASN 102 N 0.65 4.87 0.03 4.32 3.84 0.17 -4.98 114.94 123.83 1u7t s ASN 102 Ca -0.03 -1.62 -0.26 0.00 0.21 0.00 0.00 52.86 51.15 1u7t s ASN 102 Cb -0.05 -1.69 -0.17 0.00 -0.55 0.00 0.00 41.25 38.79 1u7t s ASN 102 CO -0.04 -0.33 1.38 0.25 -2.79 0.00 0.00 177.10 175.56 1u7t h LEU 103 N 7.90 -0.38 -0.94 3.21 5.85 -1.96 0.61 115.31 129.60 1u7t h LEU 103 Ca -0.16 -0.12 0.20 0.00 0.84 0.00 0.00 57.88 58.64 1u7t h LEU 103 Cb 1.05 0.10 -0.11 0.00 0.37 0.00 0.00 40.66 42.06 1u7t h LEU 103 CO 0.55 -0.09 0.51 0.11 -0.34 0.00 0.00 178.44 179.18 1u7t h LYS 104 N -0.69 0.57 -0.00 1.25 6.56 -1.98 0.16 116.57 122.45 1u7t h LYS 104 Ca -0.05 -0.03 0.00 0.00 -1.06 0.00 0.00 60.65 59.51 1u7t h LYS 104 Cb 0.48 -0.13 0.00 0.00 -0.57 0.00 0.00 32.23 32.01 1u7t h LYS 104 CO 0.08 0.38 -0.57 1.63 -2.06 0.00 0.00 179.45 178.90 1u7t n LYS 105 N -4.90 0.11 -3.82 3.15 5.02 -1.15 -4.96 118.16 111.62 1u7t n LYS 105 Ca 0.22 -0.07 -0.26 0.00 -2.02 0.00 0.00 58.31 56.18 1u7t n LYS 105 Cb 0.61 -1.50 0.03 0.00 -0.02 0.00 0.00 35.03 34.14 1u7t n LYS 105 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1u7t n GLY 106 N 1.48 -0.39 3.26 0.72 0.00 0.20 -4.97 105.19 105.49 1u7t n GLY 106 Ca 0.06 0.16 -0.29 0.00 0.00 0.00 0.00 46.02 45.95 1u7t n GLY 106 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1u7t s GLN 107 N -6.33 1.98 -0.13 1.61 -0.21 -0.35 -4.96 119.66 111.27 1u7t s GLN 107 Ca 0.33 -0.83 -0.02 0.00 0.02 0.00 0.00 55.36 54.86 1u7t s GLN 107 Cb -0.16 -1.86 -0.02 0.00 1.00 0.00 0.00 33.01 31.96 1u7t s GLN 107 CO 0.83 0.47 -0.07 0.99 -2.12 0.00 0.00 175.29 175.38 1u7t s THR 108 N -0.45 3.63 0.10 -0.19 2.01 -1.26 0.44 115.64 119.91 1u7t s THR 108 Ca 0.06 -0.47 -0.36 0.00 0.31 0.00 0.00 61.69 61.23 1u7t s THR 108 Cb -0.10 -2.55 -0.17 0.00 0.01 0.00 0.00 72.50 69.70 1u7t s THR 108 CO -0.00 0.53 1.32 1.57 -0.69 0.00 0.00 174.62 177.34 1u7t n HIS 109 N 3.20 1.48 -2.55 4.92 -0.00 -0.79 -4.92 115.22 116.57 1u7t n HIS 109 Ca -0.18 0.64 -0.33 0.00 0.46 0.00 0.00 57.72 58.32 1u7t n HIS 109 Cb 0.53 -2.32 -0.04 0.00 -0.12 0.00 0.00 29.99 28.03 1u7t n HIS 109 CO 0.00 0.00 0.00 0.95 0.46 0.00 0.00 176.34 177.75 1u7t s THR 110 N 0.39 4.35 0.14 3.57 -4.23 -1.26 -4.95 115.64 113.66 1u7t s THR 110 Ca 0.83 1.29 -0.15 0.00 -1.18 0.00 0.00 61.69 62.47 1u7t s THR 110 Cb -0.94 -3.62 0.01 0.00 1.34 0.00 0.00 72.50 69.29 1u7t s THR 110 CO 0.47 -0.49 1.71 0.25 -0.54 0.00 0.00 174.62 176.02 1u7t h LEU 111 N 1.33 0.58 -1.38 4.79 5.85 -2.00 -3.03 115.31 121.44 1u7t h LEU 111 Ca -0.48 -0.15 -0.05 0.00 0.84 0.00 0.00 57.88 58.04 1u7t h LEU 111 Cb 1.19 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 42.06 1u7t h LEU 111 CO 0.61 0.56 -0.26 -0.33 -0.34 0.00 0.00 178.44 178.68 1u7t h GLU 112 N 0.56 0.00 -0.53 1.25 4.39 -1.98 -0.13 114.58 118.13 1u7t h GLU 112 Ca 0.15 0.00 -0.07 0.00 0.34 0.00 0.00 59.36 59.77 1u7t h GLU 112 Cb 0.15 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.78 1u7t h GLU 112 CO -0.02 0.26 0.04 -0.44 -1.16 0.00 0.00 179.01 177.69 1u7t h ASP 113 N 0.00 0.83 -0.30 1.42 3.32 -1.93 0.10 116.42 119.86 1u7t h ASP 113 Ca -0.00 -0.19 -0.12 0.00 0.02 0.00 0.00 57.03 56.73 1u7t h ASP 113 Cb 0.62 -0.22 -0.00 0.00 0.22 0.00 0.00 39.33 39.94 1u7t h ASP 113 CO 0.03 0.87 -0.28 0.15 -1.72 0.00 0.00 179.24 178.29 1u7t h PHE 114 N 0.81 0.86 -0.40 4.55 3.04 -1.17 -3.06 116.94 121.57 1u7t h PHE 114 Ca 0.16 -0.25 -0.05 0.00 3.98 0.00 0.00 57.97 61.81 1u7t h PHE 114 Cb 0.43 -0.18 -0.02 0.00 2.56 0.00 0.00 35.95 38.75 1u7t h PHE 114 CO 0.03 1.00 0.06 0.37 -2.02 0.00 0.00 178.31 177.75 1u7t h GLN 115 N 0.47 0.67 -0.20 1.11 5.75 -0.85 -2.36 115.11 119.70 1u7t h GLN 115 Ca 0.05 -0.18 -0.10 0.00 -0.15 0.00 0.00 58.65 58.27 1u7t h GLN 115 Cb 0.85 -0.08 -0.01 0.00 1.07 0.00 0.00 27.48 29.31 1u7t h GLN 115 CO 0.07 0.72 -0.29 0.00 -2.65 0.00 0.00 178.83 176.68 1u7t h ARG 116 N 0.52 0.40 -0.22 1.69 -0.00 -0.86 -0.79 114.38 115.11 1u7t h ARG 116 Ca 0.12 -0.15 -0.20 0.00 -0.50 0.00 0.00 59.98 59.25 1u7t h ARG 116 Cb 0.38 -0.02 0.00 0.00 0.00 0.00 0.00 29.97 30.33 1u7t h ARG 116 CO 0.01 0.65 -0.63 0.28 0.00 0.00 0.00 179.97 180.28 1u7t h VAL 117 N 0.35 1.29 -0.26 2.04 2.07 -1.50 -2.68 116.25 117.55 1u7t h VAL 117 Ca 0.05 -1.84 -0.00 0.00 0.82 0.00 0.00 66.70 65.73 1u7t h VAL 117 Cb 0.69 1.78 -0.01 0.00 -1.52 0.00 0.00 31.29 32.23 1u7t h VAL 117 CO 0.05 0.59 0.16 -0.07 0.02 0.00 0.00 177.57 178.32 1u7t h LEU 118 N 0.58 0.32 0.15 2.57 3.38 -1.18 -2.16 115.31 118.97 1u7t h LEU 118 Ca -0.01 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1u7t h LEU 118 Cb 1.24 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.90 1u7t h LEU 118 CO 0.13 0.28 -0.13 0.44 0.09 0.00 0.00 178.44 179.25 1u7t h ASP 119 N 0.33 -0.35 -0.03 -0.43 3.45 -1.16 -1.27 116.42 116.96 1u7t h ASP 119 Ca 0.09 0.03 -0.03 0.00 0.43 0.00 0.00 57.03 57.56 1u7t h ASP 119 Cb 0.02 0.12 0.00 0.00 -0.56 0.00 0.00 39.33 38.91 1u7t h ASP 119 CO -0.02 -0.21 -0.10 0.58 -1.57 0.00 0.00 179.24 177.92 1u7t h VAL 120 N -0.30 1.47 0.09 -1.35 2.07 -1.49 0.42 116.25 117.15 1u7t h VAL 120 Ca 0.00 -1.54 -0.28 0.00 0.82 0.00 0.00 66.70 65.71 1u7t h VAL 120 Cb 0.28 2.41 0.03 0.00 -1.52 0.00 0.00 31.29 32.49 1u7t h VAL 120 CO -0.03 0.42 -1.15 0.78 0.02 0.00 0.00 177.57 177.61 1u7t h ASN 121 N -0.45 0.85 0.00 0.57 2.35 -1.44 -3.10 115.58 114.37 1u7t h ASN 121 Ca -0.00 -0.81 -0.03 0.00 -0.55 0.00 0.00 56.30 54.91 1u7t h ASN 121 Cb 0.73 -0.27 -0.00 0.00 0.05 0.00 0.00 38.32 38.83 1u7t h ASN 121 CO 0.02 1.57 -1.07 -0.11 -1.65 0.00 0.00 177.43 176.19 1u7t n LEU 122 N -3.85 1.91 -0.23 1.61 7.94 -0.56 -3.66 117.00 120.16 1u7t n LEU 122 Ca -0.13 0.32 -0.07 0.00 -1.11 0.00 0.00 56.01 55.03 1u7t n LEU 122 Cb 0.94 -0.73 0.04 0.00 0.53 0.00 0.00 43.42 44.20 1u7t n LEU 122 CO 0.57 -0.23 1.03 -0.03 -1.11 0.00 0.00 177.39 177.62 1u7t h MET 123 N -0.97 0.95 -0.47 1.96 4.05 -1.32 -0.52 114.93 118.63 1u7t h MET 123 Ca -0.05 -0.15 0.02 0.00 -0.28 0.00 0.00 59.70 59.24 1u7t h MET 123 Cb 1.01 -0.17 -0.03 0.00 -0.80 0.00 0.00 31.60 31.62 1u7t h MET 123 CO -0.03 0.77 0.29 0.78 0.23 0.00 0.00 176.91 178.95 1u7t h GLY 124 N 0.91 0.66 0.88 1.39 0.00 -0.08 0.16 103.07 107.00 1u7t h GLY 124 Ca 0.22 -0.22 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 1u7t h GLY 124 CO -0.02 0.20 0.08 -0.84 0.00 0.00 0.00 176.54 175.95 1u7t h THR 125 N 0.58 1.19 -0.58 4.70 2.02 -1.57 -2.63 112.91 116.63 1u7t h THR 125 Ca 0.18 -0.62 -0.01 0.00 0.77 0.00 0.00 66.41 66.74 1u7t h THR 125 Cb -0.01 1.14 -0.03 0.00 -1.74 0.00 0.00 68.15 67.51 1u7t h THR 125 CO -0.07 0.20 0.34 0.15 0.37 0.00 0.00 175.52 176.51 1u7t h PHE 126 N 0.23 0.76 -0.41 3.16 3.57 -0.81 -1.33 116.94 122.10 1u7t h PHE 126 Ca 0.08 0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.60 1u7t h PHE 126 Cb 0.24 -0.25 -0.03 0.00 2.79 0.00 0.00 35.95 38.70 1u7t h PHE 126 CO 0.00 0.51 0.24 -0.97 -2.23 0.00 0.00 178.31 175.87 1u7t h ASN 127 N 0.79 0.39 -0.64 0.41 -1.24 -0.40 -1.01 115.58 113.88 1u7t h ASN 127 Ca 0.21 0.00 -0.09 0.00 0.71 0.00 0.00 56.30 57.13 1u7t h ASN 127 Cb -0.02 -0.08 -0.02 0.00 0.73 0.00 0.00 38.32 38.93 1u7t h ASN 127 CO -0.04 0.28 0.05 0.58 -1.29 0.00 0.00 177.43 177.01 1u7t h VAL 128 N 0.49 1.27 0.06 2.57 2.07 -1.10 -2.81 116.25 118.80 1u7t h VAL 128 Ca 0.16 -1.11 -0.00 0.00 0.82 0.00 0.00 66.70 66.57 1u7t h VAL 128 Cb 0.01 0.72 0.00 0.00 -1.52 0.00 0.00 31.29 30.50 1u7t h VAL 128 CO -0.08 0.41 -0.03 0.40 0.02 0.00 0.00 177.57 178.30 1u7t h ILE 129 N 1.02 0.95 -0.32 4.57 2.04 -0.70 0.28 117.51 125.35 1u7t h ILE 129 Ca 0.19 -0.03 -0.09 0.00 1.00 0.00 0.00 64.86 65.93 1u7t h ILE 129 Cb 0.52 0.97 -0.02 0.00 -0.74 0.00 0.00 36.82 37.55 1u7t h ILE 129 CO 0.02 0.01 -0.18 0.08 0.00 0.00 0.00 178.15 178.08 1u7t h ARG 130 N -0.09 0.59 0.05 2.37 0.11 -1.22 -0.05 114.38 116.14 1u7t h ARG 130 Ca -0.01 -0.20 -0.15 0.00 0.10 0.00 0.00 59.98 59.72 1u7t h ARG 130 Cb 0.07 -0.05 0.01 0.00 1.11 0.00 0.00 29.97 31.12 1u7t h ARG 130 CO 0.01 0.74 -0.62 -0.07 0.10 0.00 0.00 179.97 180.13 1u7t h LEU 131 N 0.53 0.45 -1.24 0.08 3.38 -1.37 -3.16 115.31 113.98 1u7t h LEU 131 Ca 0.09 -0.85 -0.07 0.00 0.09 0.00 0.00 57.88 57.14 1u7t h LEU 131 Cb 0.60 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.20 1u7t h LEU 131 CO 0.04 1.25 -0.34 1.62 0.09 0.00 0.00 178.44 181.10 1u7t h VAL 132 N -0.28 1.01 -0.63 1.22 3.04 -0.36 -2.65 116.25 117.59 1u7t h VAL 132 Ca -0.09 -1.27 -0.05 0.00 -1.01 0.00 0.00 66.70 64.27 1u7t h VAL 132 Cb 1.39 1.73 -0.03 0.00 -2.01 0.00 0.00 31.29 32.38 1u7t h VAL 132 CO 0.12 0.33 0.18 0.00 -1.01 0.00 0.00 177.57 177.19 1u7t h ALA 133 N 1.66 1.13 -0.34 3.17 0.00 -1.05 0.17 119.26 123.99 1u7t h ALA 133 Ca -0.00 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.67 1u7t h ALA 133 Cb 0.71 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 1u7t h ALA 133 CO 0.04 0.60 0.09 0.78 0.00 0.00 0.00 179.25 180.76 1u7t h GLY 134 N 1.04 0.52 1.02 0.00 0.00 -1.44 0.44 103.07 104.65 1u7t h GLY 134 Ca 0.21 -0.26 -0.19 0.00 0.00 0.00 0.00 47.33 47.09 1u7t h GLY 134 CO -0.01 0.25 -0.69 0.83 0.00 0.00 0.00 176.54 176.92 1u7t h GLU 135 N 0.48 0.64 0.00 4.80 4.39 -0.97 -2.99 114.58 120.94 1u7t h GLU 135 Ca 0.12 -0.56 -0.01 0.00 0.34 0.00 0.00 59.36 59.25 1u7t h GLU 135 Cb 0.17 0.13 -0.00 0.00 -0.10 0.00 0.00 28.75 28.95 1u7t h GLU 135 CO -0.01 1.17 -0.06 0.52 -1.16 0.00 0.00 179.01 179.47 1u7t h MET 136 N 0.29 0.00 0.00 2.33 2.86 -0.50 -2.10 114.93 117.81 1u7t h MET 136 Ca -0.06 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.57 1u7t h MET 136 Cb 1.33 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.99 1u7t h MET 136 CO 0.14 0.06 -0.07 0.78 1.06 0.00 0.00 176.91 178.88 1u7t h GLY 137 N 1.52 0.00 1.07 8.32 0.00 -0.75 -1.77 103.07 111.46 1u7t h GLY 137 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1u7t h GLY 137 CO 0.01 0.00 -0.08 0.61 0.00 0.00 0.00 176.54 177.07 1u7t n GLN 138 N -3.93 0.62 -2.83 4.80 10.64 -0.79 -4.86 117.38 121.03 1u7t n GLN 138 Ca -0.02 -0.17 -0.34 0.00 -1.83 0.00 0.00 57.00 54.63 1u7t n GLN 138 Cb 0.16 -1.50 -0.07 0.00 -0.86 0.00 0.00 30.24 27.98 1u7t n GLN 138 CO 0.00 0.00 0.00 -0.80 -1.83 0.00 0.00 177.06 174.43 1u7t s ASN 139 N -2.49 7.07 0.16 2.61 0.01 -0.67 -5.02 114.94 116.62 1u7t s ASN 139 Ca 0.29 1.71 -0.30 0.00 -0.71 0.00 0.00 52.86 53.85 1u7t s ASN 139 Cb 0.20 -2.54 -0.08 0.00 0.41 0.00 0.00 41.25 39.24 1u7t s ASN 139 CO 0.47 -0.24 1.20 -1.83 -1.51 0.00 0.00 177.10 175.19 1u7t s GLU 140 N -2.75 4.48 0.36 -0.60 -1.05 -1.26 -4.90 118.70 112.98 1u7t s GLU 140 Ca 0.57 1.85 -0.28 0.00 -0.15 0.00 0.00 54.97 56.97 1u7t s GLU 140 Cb -0.13 -3.26 -0.10 0.00 -0.44 0.00 0.00 34.13 30.21 1u7t s GLU 140 CO 0.17 -0.11 1.33 -2.14 0.95 0.00 0.00 175.26 175.46 1u7t s PRO 141 N -0.01 4.21 0.05 -4.83 0.02 -1.26 -4.74 135.00 128.44 1u7t s PRO 141 Ca 0.54 2.25 -0.01 0.00 0.02 0.00 0.00 61.00 63.80 1u7t s PRO 141 Cb -0.32 -2.96 0.01 0.00 0.02 0.00 0.00 34.50 31.25 1u7t s PRO 141 CO 0.35 -0.32 0.05 -0.40 -0.33 0.00 0.00 177.00 176.35 1u7t n ASP 142 N 0.55 -1.00 0.32 2.53 5.68 0.97 -4.73 116.55 120.87 1u7t n ASP 142 Ca 0.01 -0.55 0.20 0.00 -0.50 0.00 0.00 54.79 53.95 1u7t n ASP 142 Cb 0.42 -0.04 1.03 0.00 -1.14 0.00 0.00 41.12 41.38 1u7t n ASP 142 CO 0.00 0.00 0.00 0.06 -1.33 0.00 0.00 177.20 175.93 1u7t h GLN 143 N 0.00 0.00 -0.25 0.11 -0.00 -1.95 -0.62 115.11 112.40 1u7t h GLN 143 Ca -0.02 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.63 1u7t h GLN 143 Cb 0.06 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.54 1u7t h GLN 143 CO 0.01 0.01 0.00 0.41 -0.00 0.00 0.00 178.83 179.26 1u7t n GLY 144 N -0.74 1.14 1.48 0.06 0.00 -1.26 -4.92 105.19 100.94 1u7t n GLY 144 Ca -0.02 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.37 1u7t n GLY 144 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1u7t n GLY 145 N 1.37 0.76 3.79 -0.02 0.00 -0.24 -5.04 105.19 105.80 1u7t n GLY 145 Ca 0.18 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.81 1u7t n GLY 145 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1u7t s GLN 146 N -0.45 4.26 -0.01 1.61 0.74 -1.26 -4.31 119.66 120.24 1u7t s GLN 146 Ca 0.00 0.74 0.09 0.00 0.05 0.00 0.00 55.36 56.24 1u7t s GLN 146 Cb 0.00 -3.29 -0.12 0.00 1.10 0.00 0.00 33.01 30.70 1u7t s GLN 146 CO 0.00 0.51 0.23 0.54 -0.55 0.00 0.00 175.29 176.02 1u7t n ARG 147 N 2.19 1.18 -3.58 1.67 1.74 0.09 -0.02 116.66 119.93 1u7t n ARG 147 Ca -0.09 -0.06 0.02 0.00 -0.77 0.00 0.00 57.85 56.95 1u7t n ARG 147 Cb 0.51 -1.13 -0.01 0.00 -1.02 0.00 0.00 32.46 30.81 1u7t n ARG 147 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1u7t s GLY 148 N -2.71 -0.42 -0.05 -0.13 0.00 -1.15 -4.81 107.32 98.05 1u7t s GLY 148 Ca -0.02 1.16 0.01 0.00 0.00 0.00 0.00 44.72 45.87 1u7t s GLY 148 CO 0.35 0.28 -0.03 0.14 0.00 0.00 0.00 173.10 173.84 1u7t s VAL 149 N -2.09 0.48 -0.11 1.40 1.01 -0.87 -1.75 120.40 118.47 1u7t s VAL 149 Ca 0.14 -0.06 0.04 0.00 0.00 0.00 0.00 61.98 62.09 1u7t s VAL 149 Cb 0.05 -0.53 0.00 0.00 0.00 0.00 0.00 36.38 35.91 1u7t s VAL 149 CO -0.05 0.22 -0.24 -0.63 0.00 0.00 0.00 175.10 174.40 1u7t s ILE 150 N 1.08 2.06 -0.10 2.22 1.01 0.27 -1.46 121.20 126.28 1u7t s ILE 150 Ca -0.09 -1.01 0.02 0.00 0.00 0.00 0.00 60.65 59.57 1u7t s ILE 150 Cb -0.14 -1.79 0.01 0.00 0.01 0.00 0.00 42.46 40.56 1u7t s ILE 150 CO -0.01 0.56 -0.17 -0.63 0.00 0.00 0.00 174.94 174.69 1u7t s ILE 151 N 0.42 1.57 0.29 2.92 1.01 -0.11 -0.71 121.20 126.58 1u7t s ILE 151 Ca -0.17 -0.70 0.09 0.00 0.00 0.00 0.00 60.65 59.87 1u7t s ILE 151 Cb -0.18 -1.41 -0.05 0.00 0.01 0.00 0.00 42.46 40.84 1u7t s ILE 151 CO 0.07 0.45 0.00 0.20 0.00 0.00 0.00 174.94 175.67 1u7t s ASN 152 N 0.79 4.43 -0.26 3.58 -0.87 0.03 -0.12 114.94 122.51 1u7t s ASN 152 Ca -0.11 -0.75 -0.03 0.00 -1.57 0.00 0.00 52.86 50.40 1u7t s ASN 152 Cb -0.16 -0.73 0.02 0.00 -0.02 0.00 0.00 41.25 40.36 1u7t s ASN 152 CO 0.01 -0.08 -0.02 -0.89 -2.57 0.00 0.00 177.10 173.55 1u7t s THR 153 N -2.39 3.19 0.00 1.60 2.01 -0.87 -1.37 115.64 117.81 1u7t s THR 153 Ca 0.33 -0.92 0.00 0.00 0.31 0.00 0.00 61.69 61.41 1u7t s THR 153 Cb -0.05 -2.62 0.00 0.00 0.01 0.00 0.00 72.50 69.84 1u7t s THR 153 CO 0.20 0.17 0.00 0.00 -0.69 0.00 0.00 174.62 174.30 1u7t n ALA 154 N 4.73 0.00 0.00 7.40 0.00 0.05 -4.98 120.51 127.71 1u7t n ALA 154 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.28 1u7t n ALA 154 Cb 0.47 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.92 1u7t n ALA 154 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1u7t n SER 155 N 0.00 0.00 0.15 0.00 2.88 -1.26 -4.47 113.62 110.91 1u7t n SER 155 Ca 0.00 0.00 0.11 0.00 -1.33 0.00 0.00 58.87 57.65 1u7t n SER 155 Cb 0.00 0.00 0.54 0.00 -0.75 0.00 0.00 64.21 64.00 1u7t n SER 155 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 1u7t n VAL 156 N -0.01 0.93 0.26 2.46 0.24 -0.90 -1.52 118.33 119.81 1u7t n VAL 156 Ca 0.00 0.47 0.17 0.00 -2.04 0.00 0.00 64.34 62.94 1u7t n VAL 156 Cb 0.00 -1.43 0.88 0.00 -1.47 0.00 0.00 33.84 31.82 1u7t n VAL 156 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1u7t h ALA 157 N 2.14 1.00 0.00 2.33 0.00 -1.86 0.17 119.26 123.04 1u7t h ALA 157 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1u7t h ALA 157 Cb 0.19 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 1u7t h ALA 157 CO 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 179.25 179.12 1u7t h ALA 158 N 2.02 1.15 0.00 0.00 0.00 -1.52 -2.64 119.26 118.26 1u7t h ALA 158 Ca 0.00 -0.12 -0.11 0.00 0.00 0.00 0.00 54.91 54.68 1u7t h ALA 158 Cb 0.05 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1u7t h ALA 158 CO 0.00 0.16 -1.41 1.19 0.00 0.00 0.00 179.25 179.19 1u7t n PHE 159 N -3.47 0.00 -2.78 0.00 3.01 0.39 -4.71 117.46 109.90 1u7t n PHE 159 Ca -0.01 0.00 -0.19 0.00 1.01 0.00 0.00 57.45 58.26 1u7t n PHE 159 Cb 0.29 -0.29 -0.00 0.00 -0.01 0.00 0.00 39.48 39.47 1u7t n PHE 159 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 1u7t n GLU 160 N -2.43 2.09 -1.74 -1.08 4.71 -0.01 -5.10 120.64 117.09 1u7t n GLU 160 Ca -0.11 -3.91 -0.42 0.00 -0.01 0.00 0.00 57.16 52.71 1u7t n GLU 160 Cb 0.67 -1.79 -0.01 0.00 -1.01 0.00 0.00 31.44 29.30 1u7t n GLU 160 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1u7t n GLY 161 N -0.13 1.04 3.96 0.62 0.00 -0.99 -4.62 105.19 105.07 1u7t n GLY 161 Ca 0.25 0.37 -0.23 0.00 0.00 0.00 0.00 46.02 46.41 1u7t n GLY 161 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1u7t s GLN 162 N -1.45 2.32 0.16 1.61 -0.21 -1.26 -4.90 119.66 115.93 1u7t s GLN 162 Ca 0.58 -0.61 -0.34 0.00 0.02 0.00 0.00 55.36 55.01 1u7t s GLN 162 Cb -0.52 -2.35 -0.14 0.00 1.00 0.00 0.00 33.01 30.99 1u7t s GLN 162 CO 0.58 -0.98 1.52 0.28 -2.12 0.00 0.00 175.29 174.56 1u7t n VAL 163 N -2.61 0.10 -0.09 1.09 0.31 -1.26 -1.12 118.33 114.75 1u7t n VAL 163 Ca 0.09 -0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.39 1u7t n VAL 163 Cb 0.60 -1.40 0.00 0.00 -0.91 0.00 0.00 33.84 32.13 1u7t n VAL 163 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1u7t n GLY 164 N 3.13 0.67 1.20 2.92 0.00 -1.26 -4.90 105.19 106.94 1u7t n GLY 164 Ca 0.17 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.27 1u7t n GLY 164 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1u7t n GLN 165 N -2.00 3.35 -0.08 1.61 6.02 -0.28 -0.28 117.38 125.72 1u7t n GLN 165 Ca 0.00 -2.67 -0.06 0.00 -0.01 0.00 0.00 57.00 54.25 1u7t n GLN 165 Cb 0.00 -1.73 -0.00 0.00 1.02 0.00 0.00 30.24 29.53 1u7t n GLN 165 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1u7t h ALA 166 N 3.07 0.11 -0.19 -1.58 0.00 -1.80 0.22 119.26 119.10 1u7t h ALA 166 Ca 0.00 0.12 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 1u7t h ALA 166 Cb 1.27 0.36 -0.01 0.00 0.00 0.00 0.00 17.79 19.41 1u7t h ALA 166 CO 0.17 -0.53 -0.01 0.00 0.00 0.00 0.00 179.25 178.88 1u7t h ALA 167 N 1.17 0.25 -0.51 0.00 0.00 -1.88 -0.89 119.26 117.40 1u7t h ALA 167 Ca 0.16 -0.22 0.04 0.00 0.00 0.00 0.00 54.91 54.90 1u7t h ALA 167 Cb 0.34 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.02 1u7t h ALA 167 CO -0.38 -0.02 0.27 -0.92 0.00 0.00 0.00 179.25 178.20 1u7t h TYR 168 N 0.08 0.50 -0.85 0.00 3.20 -1.80 -1.50 116.97 116.61 1u7t h TYR 168 Ca 0.05 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.92 1u7t h TYR 168 Cb 0.41 -0.15 -0.04 0.00 1.54 0.00 0.00 36.73 38.49 1u7t h TYR 168 CO 0.04 0.26 0.46 0.77 -1.64 0.00 0.00 178.16 178.05 1u7t h SER 169 N 0.54 1.06 -0.32 -2.11 0.02 -0.37 -0.56 113.55 111.80 1u7t h SER 169 Ca 0.22 -0.09 -0.02 0.00 -0.84 0.00 0.00 61.79 61.05 1u7t h SER 169 Cb 0.10 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.35 1u7t h SER 169 CO -0.14 0.85 0.11 0.00 -1.14 0.00 0.00 176.83 176.52 1u7t h ALA 170 N 1.32 0.42 -0.58 3.77 0.00 -0.56 0.35 119.26 123.97 1u7t h ALA 170 Ca 0.30 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 55.00 1u7t h ALA 170 Cb 0.03 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1u7t h ALA 170 CO -0.05 0.04 0.11 0.66 0.00 0.00 0.00 179.25 180.01 1u7t h SER 171 N 0.36 0.90 1.10 0.00 4.64 -0.84 -0.61 113.55 119.10 1u7t h SER 171 Ca 0.10 -0.25 -0.19 0.00 -0.47 0.00 0.00 61.79 60.99 1u7t h SER 171 Cb 0.22 -0.24 -0.03 0.00 -0.31 0.00 0.00 62.40 62.05 1u7t h SER 171 CO -0.01 0.92 -0.90 0.11 -0.87 0.00 0.00 176.83 176.08 1u7t h LYS 172 N 0.84 0.00 -0.04 4.77 1.79 -0.96 -2.63 116.57 120.34 1u7t h LYS 172 Ca 0.18 0.00 -0.07 0.00 -2.18 0.00 0.00 60.65 58.58 1u7t h LYS 172 Cb 0.39 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.03 1u7t h LYS 172 CO 0.01 0.86 -0.30 0.78 -1.08 0.00 0.00 179.45 179.72 1u7t h GLY 173 N 3.14 0.08 1.17 3.86 0.00 -0.18 -2.14 103.07 109.00 1u7t h GLY 173 Ca -0.02 -0.06 -0.12 0.00 0.00 0.00 0.00 47.33 47.13 1u7t h GLY 173 CO 0.11 0.06 -0.16 -1.33 0.00 0.00 0.00 176.54 175.22 1u7t h GLY 174 N 0.96 1.04 0.96 4.60 0.00 -0.79 -0.96 103.07 108.88 1u7t h GLY 174 Ca 0.01 -0.87 -0.00 0.00 0.00 0.00 0.00 47.33 46.47 1u7t h GLY 174 CO 0.04 0.79 0.13 -2.22 0.00 0.00 0.00 176.54 175.28 1u7t h ILE 175 N 0.84 1.09 -0.09 2.60 1.08 -1.13 -1.59 117.51 120.32 1u7t h ILE 175 Ca 0.12 -0.23 0.01 0.00 -0.39 0.00 0.00 64.86 64.37 1u7t h ILE 175 Cb 0.72 0.86 -0.01 0.00 -3.07 0.00 0.00 36.82 35.32 1u7t h ILE 175 CO 0.06 0.09 0.03 0.58 -0.69 0.00 0.00 178.15 178.21 1u7t h VAL 176 N 0.26 0.98 0.00 1.67 2.07 -1.25 -2.60 116.25 117.38 1u7t h VAL 176 Ca 0.08 -0.03 -0.03 0.00 0.82 0.00 0.00 66.70 67.54 1u7t h VAL 176 Cb 0.03 0.90 -0.00 0.00 -1.52 0.00 0.00 31.29 30.70 1u7t h VAL 176 CO -0.01 0.01 -0.12 1.23 0.02 0.00 0.00 177.57 178.70 1u7t h GLY 177 N 0.08 0.00 -1.05 2.17 0.00 -1.03 -2.64 103.07 100.59 1u7t h GLY 177 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.37 1u7t h GLY 177 CO -0.04 0.00 -0.06 1.15 0.00 0.00 0.00 176.54 177.60 1u7t n MET 178 N -4.37 1.84 0.10 4.80 0.00 -0.61 -4.33 117.12 114.56 1u7t n MET 178 Ca -0.03 -1.33 -0.13 0.00 0.00 0.00 0.00 57.70 56.21 1u7t n MET 178 Cb 0.20 -1.47 -0.08 0.00 0.00 0.00 0.00 33.22 31.86 1u7t n MET 178 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 175.97 177.12 1u7t h THR 179 N 3.24 0.93 0.14 3.17 2.02 -1.09 -2.11 112.91 119.21 1u7t h THR 179 Ca 0.00 -0.34 -0.01 0.00 0.77 0.00 0.00 66.41 66.83 1u7t h THR 179 Cb 0.73 1.14 0.00 0.00 -1.74 0.00 0.00 68.15 68.27 1u7t h THR 179 CO 0.00 0.08 -0.07 0.25 0.37 0.00 0.00 175.52 176.15 1u7t h LEU 180 N -0.37 -0.16 -1.07 2.58 5.85 -1.76 -1.23 115.31 119.15 1u7t h LEU 180 Ca -0.02 -0.16 0.11 0.00 0.84 0.00 0.00 57.88 58.65 1u7t h LEU 180 Cb 0.29 0.04 -0.08 0.00 0.37 0.00 0.00 40.66 41.28 1u7t h LEU 180 CO 0.03 0.07 0.62 1.55 -0.34 0.00 0.00 178.44 180.37 1u7t h PRO 181 N -0.39 0.95 -0.16 5.25 0.13 -1.79 0.30 132.00 136.29 1u7t h PRO 181 Ca -0.02 -0.06 -0.16 0.00 -0.87 0.00 0.00 66.00 64.89 1u7t h PRO 181 Cb 0.31 -0.21 -0.01 0.00 0.13 0.00 0.00 31.00 31.22 1u7t h PRO 181 CO 0.03 0.63 -0.57 0.82 -0.23 0.00 0.00 178.00 178.68 1u7t h ILE 182 N 0.98 1.33 -0.81 -3.56 2.04 -1.23 0.23 117.51 116.49 1u7t h ILE 182 Ca 0.47 -1.83 0.02 0.00 1.00 0.00 0.00 64.86 64.52 1u7t h ILE 182 Cb 0.45 1.82 -0.05 0.00 -0.74 0.00 0.00 36.82 38.30 1u7t h ILE 182 CO -0.23 0.57 0.53 0.00 0.00 0.00 0.00 178.15 179.01 1u7t h ALA 183 N 1.00 1.05 -0.45 1.87 0.00 -0.18 -1.94 119.26 120.61 1u7t h ALA 183 Ca 0.00 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 1u7t h ALA 183 Cb 1.10 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.58 1u7t h ALA 183 CO 0.10 0.38 0.04 0.00 0.00 0.00 0.00 179.25 179.77 1u7t h ARG 184 N 1.04 0.77 -0.40 0.00 3.08 0.17 -1.16 114.38 117.88 1u7t h ARG 184 Ca 0.31 -0.23 0.08 0.00 0.07 0.00 0.00 59.98 60.21 1u7t h ARG 184 Cb -0.04 -0.08 -0.07 0.00 0.08 0.00 0.00 29.97 29.86 1u7t h ARG 184 CO -0.10 0.81 -0.01 -0.44 -1.07 0.00 0.00 179.97 179.16 1u7t h ASP 185 N 0.62 -0.20 0.20 7.04 3.45 -0.20 -2.93 116.42 124.40 1u7t h ASP 185 Ca 0.13 0.10 0.00 0.00 0.43 0.00 0.00 57.03 57.69 1u7t h ASP 185 Cb 0.44 0.18 0.00 0.00 -0.56 0.00 0.00 39.33 39.39 1u7t h ASP 185 CO 0.02 -0.06 -0.25 0.18 -1.57 0.00 0.00 179.24 177.55 1u7t n LEU 186 N -5.21 1.14 -0.22 1.55 4.77 -0.76 -4.32 117.00 113.94 1u7t n LEU 186 Ca 0.03 -0.32 0.00 0.00 -0.03 0.00 0.00 56.01 55.69 1u7t n LEU 186 Cb 0.21 -0.10 0.12 0.00 -2.33 0.00 0.00 43.42 41.32 1u7t n LEU 186 CO 0.19 0.21 1.03 0.00 -1.33 0.00 0.00 177.39 177.48 1u7t h ALA 187 N 3.75 0.87 0.00 -1.18 0.00 -1.01 -0.61 119.26 121.06 1u7t h ALA 187 Ca 0.00 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1u7t h ALA 187 Cb 0.53 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1u7t h ALA 187 CO 0.00 -0.12 0.00 -2.30 0.00 0.00 0.00 179.25 176.83 1u7t n PRO 188 N -4.92 0.16 -0.34 0.00 -0.02 -1.26 -2.10 135.00 126.51 1u7t n PRO 188 Ca 0.09 0.48 0.07 0.00 -2.02 0.00 0.00 63.50 62.13 1u7t n PRO 188 Cb 0.26 -1.86 0.22 0.00 -0.02 0.00 0.00 33.50 32.11 1u7t n PRO 188 CO 0.00 0.00 0.00 0.44 1.98 0.00 0.00 175.50 177.92 1u7t n ILE 189 N -2.16 1.68 -3.16 4.25 -5.35 -0.28 -4.98 119.36 109.37 1u7t n ILE 189 Ca 0.01 -1.44 -0.15 0.00 -0.27 0.00 0.00 62.75 60.90 1u7t n ILE 189 Cb 0.16 0.11 0.05 0.00 -1.74 0.00 0.00 39.64 38.21 1u7t n ILE 189 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1u7t n GLY 190 N 0.05 -0.02 3.26 3.28 0.00 -0.89 -4.27 105.19 106.59 1u7t n GLY 190 Ca 0.17 -0.09 -0.35 0.00 0.00 0.00 0.00 46.02 45.76 1u7t n GLY 190 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1u7t s ILE 191 N -3.18 3.16 0.42 -0.61 1.01 -1.10 -0.73 121.20 120.17 1u7t s ILE 191 Ca 0.36 -0.75 -0.22 0.00 0.00 0.00 0.00 60.65 60.04 1u7t s ILE 191 Cb -0.16 -2.52 -0.11 0.00 0.01 0.00 0.00 42.46 39.68 1u7t s ILE 191 CO 0.44 0.30 0.96 -0.13 0.00 0.00 0.00 174.94 176.51 1u7t s ARG 192 N 1.41 4.26 -0.09 2.79 0.52 -0.72 -4.42 118.95 122.71 1u7t s ARG 192 Ca 0.03 1.17 -0.01 0.00 -0.52 0.00 0.00 55.73 56.41 1u7t s ARG 192 Cb -0.15 -2.28 0.03 0.00 0.52 0.00 0.00 34.95 33.06 1u7t s ARG 192 CO -0.04 -0.00 -0.03 0.08 0.02 0.00 0.00 175.30 175.33 1u7t s VAL 193 N -2.07 0.66 0.10 3.52 1.01 -1.26 -0.56 120.40 121.80 1u7t s VAL 193 Ca 0.60 -0.06 0.04 0.00 0.00 0.00 0.00 61.98 62.57 1u7t s VAL 193 Cb -0.11 -0.76 -0.04 0.00 0.00 0.00 0.00 36.38 35.48 1u7t s VAL 193 CO 0.15 0.31 -0.11 -0.04 0.00 0.00 0.00 175.10 175.42 1u7t s MET 194 N 1.86 0.88 -0.01 2.72 -1.94 0.11 -0.53 119.30 122.39 1u7t s MET 194 Ca 0.05 -1.18 0.03 0.00 -1.71 0.00 0.00 55.69 52.88 1u7t s MET 194 Cb -0.12 -0.59 -0.01 0.00 2.01 0.00 0.00 34.83 36.12 1u7t s MET 194 CO -0.07 0.09 -0.10 0.99 -0.01 0.00 0.00 175.02 175.93 1u7t s THR 195 N -2.42 0.77 -0.11 2.05 2.01 0.26 -0.79 115.64 117.39 1u7t s THR 195 Ca 0.06 -0.42 -0.02 0.00 0.31 0.00 0.00 61.69 61.62 1u7t s THR 195 Cb -0.03 -0.64 -0.03 0.00 0.01 0.00 0.00 72.50 71.81 1u7t s THR 195 CO 0.00 0.21 -0.05 -0.63 -0.69 0.00 0.00 174.62 173.47 1u7t s ILE 196 N -0.24 3.84 -0.56 1.82 1.01 -0.47 -0.72 121.20 125.89 1u7t s ILE 196 Ca 0.04 -0.40 -0.04 0.00 0.00 0.00 0.00 60.65 60.24 1u7t s ILE 196 Cb -0.04 -2.63 0.15 0.00 0.01 0.00 0.00 42.46 39.94 1u7t s ILE 196 CO -0.00 0.55 0.38 0.00 0.00 0.00 0.00 174.94 175.87 1u7t s ALA 197 N -0.22 3.47 0.55 9.38 0.00 0.25 -0.77 121.76 134.42 1u7t s ALA 197 Ca 0.04 -2.97 -0.19 0.00 0.00 0.00 0.00 51.96 48.83 1u7t s ALA 197 Cb -0.13 -2.67 -0.05 0.00 0.00 0.00 0.00 23.12 20.27 1u7t s ALA 197 CO 0.02 -2.01 1.14 -2.14 0.00 0.00 0.00 175.76 172.78 1u7t s PRO 198 N 0.46 3.30 0.00 0.00 0.02 -1.26 -1.36 135.00 136.16 1u7t s PRO 198 Ca 0.13 1.63 0.00 0.00 0.02 0.00 0.00 61.00 62.78 1u7t s PRO 198 Cb -0.21 -2.00 0.00 0.00 0.02 0.00 0.00 34.50 32.31 1u7t s PRO 198 CO -0.04 -0.90 0.00 0.41 -0.33 0.00 0.00 177.00 176.15 1u7t n GLY 199 N 0.18 1.36 3.04 0.52 0.00 -0.26 -2.11 105.19 107.92 1u7t n GLY 199 Ca 0.12 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.83 1u7t n GLY 199 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1u7t s LEU 200 N 0.00 1.76 0.05 0.99 1.43 -1.26 -4.75 118.68 116.90 1u7t s LEU 200 Ca 0.00 -0.51 0.07 0.00 -1.03 0.00 0.00 54.13 52.66 1u7t s LEU 200 Cb 0.00 -1.23 -0.03 0.00 0.03 0.00 0.00 46.19 44.97 1u7t s LEU 200 CO 0.00 -0.04 -0.19 -0.36 0.23 0.00 0.00 176.35 175.99 1u7t s PHE 201 N 1.41 1.65 -1.23 0.29 0.40 -1.26 -0.24 117.98 119.00 1u7t s PHE 201 Ca 0.04 -0.38 -0.20 0.00 -0.60 0.00 0.00 56.93 55.79 1u7t s PHE 201 Cb -0.13 -0.97 0.02 0.00 0.51 0.00 0.00 43.02 42.44 1u7t s PHE 201 CO -0.10 0.09 1.79 0.20 0.70 0.00 0.00 175.22 177.90 1u7t s GLY 202 N -1.28 1.11 0.31 4.36 0.00 -0.82 -4.79 107.32 106.21 1u7t s GLY 202 Ca 0.06 -2.59 0.05 0.00 0.00 0.00 0.00 44.72 42.23 1u7t s GLY 202 CO 0.02 3.01 0.02 -0.51 0.00 0.00 0.00 173.10 175.63 1u7t s THR 203 N 6.57 1.37 -0.49 0.90 -4.23 -1.26 -4.72 115.64 113.79 1u7t s THR 203 Ca 0.58 -2.04 0.12 0.00 -1.18 0.00 0.00 61.69 59.18 1u7t s THR 203 Cb 0.02 -2.68 0.12 0.00 1.34 0.00 0.00 72.50 71.30 1u7t s THR 203 CO 0.08 -0.11 1.35 -2.65 -0.54 0.00 0.00 174.62 172.75 1u7t n PRO 204 N -0.66 0.08 -0.31 3.99 -0.02 -1.26 -2.12 135.00 134.70 1u7t n PRO 204 Ca -0.04 0.57 0.04 0.00 -2.02 0.00 0.00 63.50 62.05 1u7t n PRO 204 Cb 0.66 -1.79 0.23 0.00 -0.02 0.00 0.00 33.50 32.57 1u7t n PRO 204 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1u7t h LEU 205 N 0.00 0.93 -0.81 2.45 5.85 -1.95 -2.10 115.31 119.67 1u7t h LEU 205 Ca 0.00 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.73 1u7t h LEU 205 Cb 0.07 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 40.91 1u7t h LEU 205 CO 0.00 0.60 -0.01 0.18 -0.34 0.00 0.00 178.44 178.86 1u7t n LEU 206 N -4.49 1.27 0.26 2.25 4.77 -0.90 -4.21 117.00 115.95 1u7t n LEU 206 Ca 0.14 -0.42 0.12 0.00 -0.03 0.00 0.00 56.01 55.82 1u7t n LEU 206 Cb 0.19 -0.01 0.69 0.00 -2.33 0.00 0.00 43.42 41.96 1u7t n LEU 206 CO 0.33 0.21 0.95 0.74 -1.33 0.00 0.00 177.39 178.29 1u7t h THR 207 N 1.98 0.55 0.00 -5.08 2.02 -1.50 -2.83 112.91 108.05 1u7t h THR 207 Ca 0.00 -0.62 0.00 0.00 0.77 0.00 0.00 66.41 66.56 1u7t h THR 207 Cb 0.44 1.41 0.00 0.00 -1.74 0.00 0.00 68.15 68.25 1u7t h THR 207 CO 0.00 0.13 0.00 -1.20 0.37 0.00 0.00 175.52 174.82 1u7t n SER 208 N -3.59 0.00 -4.56 4.18 7.64 -1.26 -4.79 113.62 111.24 1u7t n SER 208 Ca -0.01 -0.22 -0.28 0.00 1.01 0.00 0.00 58.87 59.37 1u7t n SER 208 Cb 0.27 -0.14 -0.10 0.00 -1.01 0.00 0.00 64.21 63.24 1u7t n SER 208 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1u7t s LEU 209 N -2.27 2.97 0.20 -3.43 1.43 -1.07 -5.08 118.68 111.43 1u7t s LEU 209 Ca 0.19 -0.53 -0.32 0.00 -1.03 0.00 0.00 54.13 52.44 1u7t s LEU 209 Cb 0.10 -1.69 -0.15 0.00 0.03 0.00 0.00 46.19 44.48 1u7t s LEU 209 CO 0.20 0.13 1.26 -2.65 0.23 0.00 0.00 176.35 175.52 1u7t n PRO 210 N 0.28 1.54 -0.29 1.29 -0.02 -1.26 -4.70 135.00 131.84 1u7t n PRO 210 Ca -0.12 0.55 0.09 0.00 -2.02 0.00 0.00 63.50 61.99 1u7t n PRO 210 Cb 0.54 -2.11 0.24 0.00 -0.02 0.00 0.00 33.50 32.15 1u7t n PRO 210 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1u7t h GLU 211 N 3.70 0.46 0.00 -0.52 4.57 -1.96 1.47 114.58 122.30 1u7t h GLU 211 Ca -0.44 -0.03 -0.01 0.00 -1.18 0.00 0.00 59.36 57.71 1u7t h GLU 211 Cb 1.31 -0.10 -0.00 0.00 -0.16 0.00 0.00 28.75 29.80 1u7t h GLU 211 CO 0.72 0.31 -0.03 0.87 -1.18 0.00 0.00 179.01 179.70 1u7t h LYS 212 N 0.48 0.00 0.25 1.92 1.79 -1.99 -0.62 116.57 118.40 1u7t h LYS 212 Ca 0.48 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.94 1u7t h LYS 212 Cb 0.79 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.44 1u7t h LYS 212 CO -0.44 0.03 -0.12 0.28 -1.08 0.00 0.00 179.45 178.12 1u7t h VAL 213 N 0.00 0.37 -0.20 0.50 2.07 0.17 -2.61 116.25 116.54 1u7t h VAL 213 Ca -0.00 -0.90 0.04 0.00 0.82 0.00 0.00 66.70 66.66 1u7t h VAL 213 Cb 0.08 0.62 -0.07 0.00 -1.52 0.00 0.00 31.29 30.41 1u7t h VAL 213 CO 0.00 0.10 -0.51 0.03 0.02 0.00 0.00 177.57 177.21 1u7t h ARG 214 N -1.01 -0.50 -0.75 1.57 3.08 -1.10 -1.87 114.38 113.79 1u7t h ARG 214 Ca -0.03 0.03 0.10 0.00 0.07 0.00 0.00 59.98 60.15 1u7t h ARG 214 Cb 0.42 0.11 -0.07 0.00 0.08 0.00 0.00 29.97 30.51 1u7t h ARG 214 CO 0.06 -0.33 0.39 -0.91 -1.07 0.00 0.00 179.97 178.11 1u7t h ASN 215 N -0.51 0.53 0.48 7.04 2.35 -1.23 0.39 115.58 124.62 1u7t h ASN 215 Ca 0.06 0.06 -0.01 0.00 -0.55 0.00 0.00 56.30 55.86 1u7t h ASN 215 Cb 0.65 -0.04 -0.02 0.00 0.05 0.00 0.00 38.32 38.96 1u7t h ASN 215 CO -0.47 0.30 -0.48 0.15 -1.65 0.00 0.00 177.43 175.27 1u7t h PHE 216 N 0.66 -1.33 -0.73 1.19 3.57 -1.10 0.17 116.94 119.37 1u7t h PHE 216 Ca 0.37 0.01 0.12 0.00 3.53 0.00 0.00 57.97 62.00 1u7t h PHE 216 Cb 0.39 0.52 -0.13 0.00 2.79 0.00 0.00 35.95 39.51 1u7t h PHE 216 CO -0.09 -0.65 -0.35 -0.07 -2.23 0.00 0.00 178.31 174.92 1u7t h LEU 217 N -0.97 -1.25 -0.78 0.59 3.38 -0.47 0.23 115.31 116.04 1u7t h LEU 217 Ca -0.05 0.26 0.18 0.00 0.09 0.00 0.00 57.88 58.35 1u7t h LEU 217 Cb 0.85 0.64 -0.12 0.00 0.09 0.00 0.00 40.66 42.11 1u7t h LEU 217 CO -0.07 -0.30 0.20 0.00 0.09 0.00 0.00 178.44 178.37 1u7t h ALA 218 N 1.14 1.05 0.00 1.53 0.00 0.35 -0.49 119.26 122.83 1u7t h ALA 218 Ca 0.27 0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.36 1u7t h ALA 218 Cb 0.57 0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.60 1u7t h ALA 218 CO -0.79 -0.36 0.00 -1.13 0.00 0.00 0.00 179.25 176.97 1u7t n SER 219 N -5.16 0.12 0.09 0.00 3.41 0.79 -2.64 113.62 110.23 1u7t n SER 219 Ca 0.16 0.53 0.12 0.00 -0.26 0.00 0.00 58.87 59.43 1u7t n SER 219 Cb 0.51 -0.56 0.24 0.00 -0.26 0.00 0.00 64.21 64.15 1u7t n SER 219 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 1u7t h GLN 220 N 0.00 0.00 -6.24 4.33 1.08 -0.87 -3.46 115.11 109.95 1u7t h GLN 220 Ca 0.00 0.00 -0.56 0.00 -1.45 0.00 0.00 58.65 56.64 1u7t h GLN 220 Cb 0.24 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.65 1u7t h GLN 220 CO 0.00 0.00 1.05 0.08 -0.95 0.00 0.00 178.83 179.01 1u7t s VAL 221 N -3.16 3.78 0.12 -0.54 1.01 -1.08 -4.84 120.40 115.69 1u7t s VAL 221 Ca 0.07 0.93 -0.26 0.00 0.00 0.00 0.00 61.98 62.73 1u7t s VAL 221 Cb 0.12 -3.64 -0.06 0.00 0.00 0.00 0.00 36.38 32.80 1u7t s VAL 221 CO 0.68 -0.12 1.64 -0.65 0.00 0.00 0.00 175.10 176.65 1u7t h PRO 222 N 9.43 -0.39 -1.49 2.72 0.11 -1.83 -3.33 132.00 137.22 1u7t h PRO 222 Ca -0.35 0.03 0.12 0.00 0.11 0.00 0.00 66.00 65.90 1u7t h PRO 222 Cb 1.15 0.09 -0.25 0.00 0.11 0.00 0.00 31.00 32.10 1u7t h PRO 222 CO 0.97 -0.26 0.29 0.12 -0.21 0.00 0.00 178.00 178.91 1u7t s PHE 223 N -6.07 -0.68 0.34 0.65 5.36 -0.93 -4.25 117.98 112.40 1u7t s PHE 223 Ca -0.15 1.30 -0.26 0.00 -0.96 0.00 0.00 56.93 56.86 1u7t s PHE 223 Cb 0.09 0.41 -0.09 0.00 -0.34 0.00 0.00 43.02 43.08 1u7t s PHE 223 CO 0.66 -0.34 1.02 -1.25 -1.46 0.00 0.00 175.22 173.85 1u7t s PRO 224 N 1.68 4.42 -1.29 10.12 0.04 -1.26 -4.53 135.00 144.18 1u7t s PRO 224 Ca -0.08 1.52 -0.18 0.00 0.04 0.00 0.00 61.00 62.31 1u7t s PRO 224 Cb -0.05 -2.79 0.02 0.00 0.04 0.00 0.00 34.50 31.72 1u7t s PRO 224 CO -0.16 0.09 1.94 0.43 0.04 0.00 0.00 177.00 179.34 1u7t n SER 225 N 0.46 4.13 -3.69 6.66 7.64 -1.25 -4.81 113.62 122.76 1u7t n SER 225 Ca 0.02 -2.84 -0.04 0.00 1.01 0.00 0.00 58.87 57.02 1u7t n SER 225 Cb 0.49 -1.66 -0.01 0.00 -1.01 0.00 0.00 64.21 62.01 1u7t n SER 225 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1u7t s ARG 226 N 4.23 1.01 0.60 1.43 1.70 -1.25 -4.85 118.95 121.82 1u7t s ARG 226 Ca 0.54 -0.53 -0.19 0.00 -0.47 0.00 0.00 55.73 55.08 1u7t s ARG 226 Cb 0.08 0.37 -0.03 0.00 -0.57 0.00 0.00 34.95 34.79 1u7t s ARG 226 CO 0.03 -0.46 1.25 -0.51 -1.08 0.00 0.00 175.30 174.53 1u7t s LEU 227 N -2.84 3.67 0.57 -1.89 1.43 -1.26 -4.84 118.68 113.51 1u7t s LEU 227 Ca 0.11 2.49 -0.19 0.00 -1.03 0.00 0.00 54.13 55.52 1u7t s LEU 227 Cb -0.01 -4.56 -0.04 0.00 0.03 0.00 0.00 46.19 41.61 1u7t s LEU 227 CO -0.01 -1.69 1.14 -0.83 0.23 0.00 0.00 176.35 175.19 1u7t s GLY 228 N -1.46 2.58 -0.12 -3.19 0.00 0.66 -4.77 107.32 101.03 1u7t s GLY 228 Ca 0.78 0.82 -0.20 0.00 0.00 0.00 0.00 44.72 46.12 1u7t s GLY 228 CO 0.36 1.18 0.57 -0.35 0.00 0.00 0.00 173.10 174.87 1u7t s ASP 229 N -1.85 6.77 0.46 1.64 3.68 -1.26 -1.95 116.67 124.16 1u7t s ASP 229 Ca 0.73 0.93 0.26 0.00 2.13 0.00 0.00 52.55 56.60 1u7t s ASP 229 Cb -0.25 -2.33 1.30 0.00 -1.45 0.00 0.00 42.92 40.19 1u7t s ASP 229 CO 0.30 -0.08 1.80 -0.65 0.13 0.00 0.00 175.17 176.68 1u7t h PRO 230 N 6.87 0.21 0.00 4.34 0.11 -1.95 0.81 132.00 142.38 1u7t h PRO 230 Ca -0.39 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.69 1u7t h PRO 230 Cb 1.18 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 32.24 1u7t h PRO 230 CO 0.76 0.14 -0.07 0.00 -0.21 0.00 0.00 178.00 178.62 1u7t h ALA 231 N 1.54 1.61 -0.09 -0.75 0.00 -1.92 -0.71 119.26 118.94 1u7t h ALA 231 Ca 0.55 -0.06 -0.16 0.00 0.00 0.00 0.00 54.91 55.25 1u7t h ALA 231 Cb 1.75 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.52 1u7t h ALA 231 CO -0.16 0.09 -0.62 0.93 0.00 0.00 0.00 179.25 179.49 1u7t h GLU 232 N 0.00 0.32 -0.09 0.00 5.08 0.25 -0.22 114.58 119.91 1u7t h GLU 232 Ca -0.00 -0.22 -0.01 0.00 -1.00 0.00 0.00 59.36 58.13 1u7t h GLU 232 Cb 0.15 0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.43 1u7t h GLU 232 CO 0.01 0.84 0.02 -0.92 -1.00 0.00 0.00 179.01 177.95 1u7t h TYR 233 N 0.23 0.16 -0.80 4.33 3.20 -1.10 -2.75 116.97 120.25 1u7t h TYR 233 Ca -0.01 -0.02 0.10 0.00 3.14 0.00 0.00 58.73 61.94 1u7t h TYR 233 Cb 1.14 -0.04 -0.07 0.00 1.54 0.00 0.00 36.73 39.30 1u7t h TYR 233 CO 0.03 0.35 0.44 0.00 -1.64 0.00 0.00 178.16 177.34 1u7t h ALA 234 N 0.79 1.13 -0.80 1.82 0.00 -1.03 -1.43 119.26 119.74 1u7t h ALA 234 Ca 0.03 0.04 0.03 0.00 0.00 0.00 0.00 54.91 55.01 1u7t h ALA 234 Cb 0.28 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 17.91 1u7t h ALA 234 CO 0.00 0.05 0.52 1.25 0.00 0.00 0.00 179.25 181.07 1u7t h HIS 235 N 0.74 0.97 -0.08 0.00 -0.00 -0.96 -1.73 115.15 114.09 1u7t h HIS 235 Ca 0.39 0.03 -0.10 0.00 -0.00 0.00 0.00 60.37 60.68 1u7t h HIS 235 Cb 0.38 -0.32 -0.01 0.00 -0.00 0.00 0.00 27.41 27.45 1u7t h HIS 235 CO -0.07 0.57 -0.42 1.25 -0.00 0.00 0.00 177.93 179.25 1u7t h LEU 236 N 1.02 0.19 -0.36 0.26 5.85 -0.99 -1.93 115.31 119.36 1u7t h LEU 236 Ca 0.32 -0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.95 1u7t h LEU 236 Cb -0.01 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 40.94 1u7t h LEU 236 CO -0.10 0.60 0.19 0.58 -0.34 0.00 0.00 178.44 179.37 1u7t h VAL 237 N 0.16 1.14 -0.38 1.05 2.07 -0.56 -1.82 116.25 117.91 1u7t h VAL 237 Ca 0.01 -0.38 -0.03 0.00 0.82 0.00 0.00 66.70 67.12 1u7t h VAL 237 Cb 0.82 0.74 -0.02 0.00 -1.52 0.00 0.00 31.29 31.31 1u7t h VAL 237 CO 0.06 0.15 0.12 -0.61 0.02 0.00 0.00 177.57 177.31 1u7t h GLN 238 N 0.45 0.59 -0.82 1.57 4.15 -1.12 -0.43 115.11 119.52 1u7t h GLN 238 Ca 0.13 -0.13 0.16 0.00 0.77 0.00 0.00 58.65 59.58 1u7t h GLN 238 Cb 0.06 -0.08 -0.10 0.00 0.21 0.00 0.00 27.48 27.57 1u7t h GLN 238 CO -0.02 0.61 0.36 0.00 -1.93 0.00 0.00 178.83 177.85 1u7t h ALA 239 N 0.96 1.21 -0.14 3.38 0.00 -1.24 0.10 119.26 123.53 1u7t h ALA 239 Ca 0.12 0.12 -0.11 0.00 0.00 0.00 0.00 54.91 55.04 1u7t h ALA 239 Cb 0.26 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1u7t h ALA 239 CO -0.00 -0.21 -0.34 0.82 0.00 0.00 0.00 179.25 179.52 1u7t h ILE 240 N 0.48 1.36 -0.80 0.00 2.04 -0.88 -1.70 117.51 118.02 1u7t h ILE 240 Ca 0.46 -1.62 0.10 0.00 1.00 0.00 0.00 64.86 64.80 1u7t h ILE 240 Cb 0.74 2.04 -0.07 0.00 -0.74 0.00 0.00 36.82 38.79 1u7t h ILE 240 CO -0.43 0.49 0.44 0.40 0.00 0.00 0.00 178.15 179.05 1u7t h ILE 241 N 0.09 0.88 -0.02 -0.67 2.04 -0.46 -2.89 117.51 116.47 1u7t h ILE 241 Ca -0.00 -0.25 -0.18 0.00 1.00 0.00 0.00 64.86 65.42 1u7t h ILE 241 Cb 0.95 0.09 -0.01 0.00 -0.74 0.00 0.00 36.82 37.11 1u7t h ILE 241 CO 0.07 0.13 -0.80 -0.33 0.00 0.00 0.00 178.15 177.23 1u7t h GLU 242 N 0.73 0.24 -5.62 2.37 5.08 -0.63 -3.43 114.58 113.32 1u7t h GLU 242 Ca 0.39 -0.23 -0.63 0.00 -1.00 0.00 0.00 59.36 57.89 1u7t h GLU 242 Cb 0.39 0.06 -0.14 0.00 0.50 0.00 0.00 28.75 29.56 1u7t h GLU 242 CO -0.26 0.92 0.38 1.21 -1.00 0.00 0.00 179.01 180.26 1u7t s ASN 243 N -6.94 6.33 0.19 1.42 3.84 -0.66 -4.92 114.94 114.20 1u7t s ASN 243 Ca -0.04 -0.42 0.19 0.00 0.21 0.00 0.00 52.86 52.81 1u7t s ASN 243 Cb 0.11 -2.39 0.86 0.00 -0.55 0.00 0.00 41.25 39.27 1u7t s ASN 243 CO 0.82 -1.06 1.59 -2.65 -2.79 0.00 0.00 177.10 173.02 1u7t n PRO 244 N 6.94 0.13 -0.14 0.43 -0.02 -1.26 -2.59 135.00 138.49 1u7t n PRO 244 Ca -0.00 0.43 0.11 0.00 -2.02 0.00 0.00 63.50 62.01 1u7t n PRO 244 Cb 0.47 -1.77 0.17 0.00 -0.02 0.00 0.00 33.50 32.35 1u7t n PRO 244 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1u7t n PHE 245 N -2.02 0.36 -2.90 6.00 -0.00 -1.26 -4.88 117.46 112.76 1u7t n PHE 245 Ca 0.02 -0.21 -0.43 0.00 -0.00 0.00 0.00 57.45 56.83 1u7t n PHE 245 Cb 0.17 -0.00 -0.05 0.00 -0.00 0.00 0.00 39.48 39.60 1u7t n PHE 245 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.76 176.25 1u7t s LEU 246 N -1.44 4.12 -0.15 -2.13 1.43 -1.07 -5.01 118.68 114.44 1u7t s LEU 246 Ca 0.33 0.12 -0.20 0.00 -1.03 0.00 0.00 54.13 53.34 1u7t s LEU 246 Cb 0.20 -3.08 0.05 0.00 0.03 0.00 0.00 46.19 43.39 1u7t s LEU 246 CO 0.28 -0.92 0.53 0.21 0.23 0.00 0.00 176.35 176.68 1u7t s ASN 247 N 2.10 -0.53 -0.88 2.29 2.47 -1.26 -4.75 114.94 114.39 1u7t s ASN 247 Ca 0.33 0.88 0.00 0.00 0.42 0.00 0.00 52.86 54.49 1u7t s ASN 247 Cb -0.12 0.90 0.00 0.00 -1.45 0.00 0.00 41.25 40.58 1u7t s ASN 247 CO 0.22 -0.30 0.00 0.61 -3.72 0.00 0.00 177.10 173.92 1u7t n GLY 248 N 2.24 0.97 3.33 1.21 0.00 0.31 -4.98 105.19 108.26 1u7t n GLY 248 Ca -0.16 -0.65 -0.21 0.00 0.00 0.00 0.00 46.02 45.00 1u7t n GLY 248 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1u7t s GLU 249 N -2.81 1.27 -0.15 1.61 2.56 -1.25 -4.46 118.70 115.47 1u7t s GLU 249 Ca 0.00 -1.43 -0.03 0.00 0.00 0.00 0.00 54.97 53.51 1u7t s GLU 249 Cb 0.00 -1.27 -0.03 0.00 2.00 0.00 0.00 34.13 34.83 1u7t s GLU 249 CO 0.00 0.25 -0.04 0.08 -0.56 0.00 0.00 175.26 174.99 1u7t s VAL 250 N -2.20 3.90 -0.17 3.70 1.01 -1.26 -0.58 120.40 124.80 1u7t s VAL 250 Ca 0.16 -0.36 0.01 0.00 0.00 0.00 0.00 61.98 61.80 1u7t s VAL 250 Cb -0.05 -2.70 0.02 0.00 0.00 0.00 0.00 36.38 33.65 1u7t s VAL 250 CO 0.06 0.51 -0.21 -0.63 0.00 0.00 0.00 175.10 174.84 1u7t s ILE 251 N 0.22 2.06 0.03 2.22 1.01 0.11 -4.95 121.20 121.89 1u7t s ILE 251 Ca -0.02 -0.95 -0.30 0.00 0.00 0.00 0.00 60.65 59.37 1u7t s ILE 251 Cb -0.14 -1.85 -0.05 0.00 0.01 0.00 0.00 42.46 40.43 1u7t s ILE 251 CO 0.03 0.54 1.21 -0.13 0.00 0.00 0.00 174.94 176.59 1u7t s ARG 252 N 1.16 4.41 -0.49 2.79 0.52 -1.26 -0.59 118.95 125.49 1u7t s ARG 252 Ca 0.02 1.75 0.04 0.00 -0.52 0.00 0.00 55.73 57.02 1u7t s ARG 252 Cb -0.14 -3.41 0.13 0.00 0.52 0.00 0.00 34.95 32.05 1u7t s ARG 252 CO -0.10 -0.32 0.23 -1.17 0.02 0.00 0.00 175.30 173.97 1u7t s LEU 253 N 1.41 4.23 0.00 2.53 2.96 -0.46 -4.92 118.68 124.43 1u7t s LEU 253 Ca 0.58 -2.88 0.00 0.00 -0.22 0.00 0.00 54.13 51.61 1u7t s LEU 253 Cb -0.28 -1.59 0.00 0.00 0.50 0.00 0.00 46.19 44.82 1u7t s LEU 253 CO 0.27 -0.25 0.34 -0.90 -1.32 0.00 0.00 176.35 174.49 1u7t n ASP 254 N 3.28 0.00 -0.58 3.68 5.68 -1.26 -1.11 116.55 126.24 1u7t n ASP 254 Ca 0.05 -1.08 -0.08 0.00 -0.50 0.00 0.00 54.79 53.19 1u7t n ASP 254 Cb 0.33 -0.02 -0.03 0.00 -1.14 0.00 0.00 41.12 40.27 1u7t n ASP 254 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1u7t n GLY 255 N 0.00 0.82 1.96 6.12 0.00 -1.26 -1.95 105.19 110.88 1u7t n GLY 255 Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.91 1u7t n GLY 255 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u7t n ALA 256 N 1.14 0.00 -1.78 4.61 0.00 -1.26 -2.20 120.51 121.02 1u7t n ALA 256 Ca -0.08 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.01 1u7t n ALA 256 Cb 0.46 -0.24 -0.00 0.00 0.00 0.00 0.00 19.45 19.66 1u7t n ALA 256 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 1u7t s ILE 257 N -2.00 3.22 -0.12 0.00 2.07 -0.82 -4.69 121.20 118.85 1u7t s ILE 257 Ca 0.00 0.78 0.00 0.00 -1.41 0.00 0.00 60.65 60.02 1u7t s ILE 257 Cb 0.00 -3.32 0.02 0.00 0.13 0.00 0.00 42.46 39.29 1u7t s ILE 257 CO 0.00 -0.14 -0.12 -0.13 -1.91 0.00 0.00 174.94 172.64 1u7t s ARG 258 N -3.20 1.95 0.07 3.50 1.81 -1.26 -5.01 118.95 116.80 1u7t s ARG 258 Ca 0.71 -0.43 -0.30 0.00 -1.72 0.00 0.00 55.73 53.99 1u7t s ARG 258 Cb -0.24 -1.82 -0.05 0.00 -0.45 0.00 0.00 34.95 32.39 1u7t s ARG 258 CO 0.27 -0.20 1.02 -1.64 -0.68 0.00 0.00 175.30 174.08 1u7t s MET 259 N 1.41 4.59 0.69 3.54 -1.94 -1.26 -5.04 119.30 121.30 1u7t s MET 259 Ca 0.01 1.52 -0.07 0.00 -1.71 0.00 0.00 55.69 55.44 1u7t s MET 259 Cb -0.13 -3.39 0.05 0.00 2.01 0.00 0.00 34.83 33.36 1u7t s MET 259 CO -0.07 0.03 1.01 -0.65 -0.01 0.00 0.00 175.02 175.33 1u7t s GLN 260 N 0.48 2.40 0.00 2.03 -1.52 -1.26 -4.89 119.66 116.90 1u7t s GLN 260 Ca 0.51 -0.11 0.00 0.00 -1.95 0.00 0.00 55.36 53.81 1u7t s GLN 260 Cb -0.24 -2.17 0.00 0.00 -0.22 0.00 0.00 33.01 30.38 1u7t s GLN 260 CO 0.30 -1.12 0.33 -2.30 -0.25 0.00 0.00 175.29 172.25