#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 -1.67 -3.33 0.24 -1.26 -4.92 118.33 107.39 1u7t n VAL 8 Ca 0.00 -0.08 -0.55 0.00 -2.04 0.00 0.00 64.34 61.67 1u7t n VAL 8 Cb 0.00 -0.02 -0.06 0.00 -1.47 0.00 0.00 33.84 32.29 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 -0.84 1.26 0.00 7.34 4.01 -1.25 -0.40 118.16 128.29 1u7t n LYS 9 Ca 0.15 0.46 0.00 0.00 -0.51 0.00 0.00 58.31 58.41 1u7t n LYS 9 Cb 0.28 -2.14 0.00 0.00 -0.51 0.00 0.00 35.03 32.66 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 3.62 2.25 3.78 0.72 0.00 -0.83 -4.93 105.19 109.80 1u7t n GLY 10 Ca 0.23 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.90 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 3.82 -0.28 0.99 1.43 0.47 -4.75 118.68 120.36 1u7t s LEU 11 Ca 0.00 2.08 -0.07 0.00 -1.03 0.00 0.00 54.13 55.11 1u7t s LEU 11 Cb 0.00 -4.53 0.00 0.00 0.03 0.00 0.00 46.19 41.69 1u7t s LEU 11 CO 0.00 -0.99 0.07 -0.69 0.23 0.00 0.00 176.35 174.97 1u7t s VAL 12 N -1.83 4.01 -0.13 -1.59 1.01 -1.26 -0.70 120.40 119.91 1u7t s VAL 12 Ca 0.69 -0.57 0.01 0.00 0.00 0.00 0.00 61.98 62.11 1u7t s VAL 12 Cb -0.21 -3.02 -0.01 0.00 0.00 0.00 0.00 36.38 33.14 1u7t s VAL 12 CO 0.25 0.15 -0.16 0.00 0.00 0.00 0.00 175.10 175.34 1u7t s ALA 13 N 1.52 2.49 -0.29 5.51 0.00 -0.47 -0.58 121.76 129.95 1u7t s ALA 13 Ca 0.04 -0.94 -0.16 0.00 0.00 0.00 0.00 51.96 50.89 1u7t s ALA 13 Cb -0.17 -1.13 -0.02 0.00 0.00 0.00 0.00 23.12 21.80 1u7t s ALA 13 CO 0.02 0.19 0.44 0.08 0.00 0.00 0.00 175.76 176.49 1u7t s VAL 14 N 0.46 5.11 -0.33 0.00 1.01 -0.03 -1.08 120.40 125.53 1u7t s VAL 14 Ca -0.11 0.53 -0.02 0.00 0.00 0.00 0.00 61.98 62.37 1u7t s VAL 14 Cb -0.16 -3.80 0.07 0.00 0.00 0.00 0.00 36.38 32.48 1u7t s VAL 14 CO 0.05 0.03 0.06 -0.63 0.00 0.00 0.00 175.10 174.61 1u7t s ILE 15 N 2.19 3.09 0.42 2.22 1.01 -0.36 -1.67 121.20 128.10 1u7t s ILE 15 Ca 0.17 -1.57 -0.22 0.00 0.00 0.00 0.00 60.65 59.03 1u7t s ILE 15 Cb -0.16 -2.88 -0.10 0.00 0.01 0.00 0.00 42.46 39.33 1u7t s ILE 15 CO 0.11 -0.28 0.98 0.42 0.00 0.00 0.00 174.94 176.17 1u7t s THR 16 N 1.22 4.18 -0.75 2.92 -4.23 -0.46 -0.68 115.64 117.84 1u7t s THR 16 Ca -0.01 1.44 0.00 0.00 -1.18 0.00 0.00 61.69 61.94 1u7t s THR 16 Cb -0.20 -3.63 0.00 0.00 1.34 0.00 0.00 72.50 70.00 1u7t s THR 16 CO -0.02 -0.21 0.00 0.61 -0.54 0.00 0.00 174.62 174.46 1u7t n GLY 17 N -0.30 0.88 0.00 3.99 0.00 0.12 -1.65 105.19 108.23 1u7t n GLY 17 Ca 0.07 -0.37 0.07 0.00 0.00 0.00 0.00 46.02 45.78 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 -1.47 -0.74 0.00 -0.02 0.00 -1.08 -2.87 105.19 99.02 1u7t n GLY 18 Ca -0.07 -0.06 0.13 0.00 0.00 0.00 0.00 46.02 46.02 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 -1.29 2.85 -2.62 4.61 0.00 -1.26 -3.19 120.51 119.61 1u7t n ALA 19 Ca 0.06 -0.20 -0.09 0.00 0.00 0.00 0.00 53.44 53.21 1u7t n ALA 19 Cb 0.11 -1.32 -0.07 0.00 0.00 0.00 0.00 19.45 18.17 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 -3.06 0.09 0.20 0.00 0.15 -1.14 -4.77 113.70 105.17 1u7t s SER 20 Ca 0.13 -0.90 0.00 0.00 0.70 0.00 0.00 55.95 55.88 1u7t s SER 20 Cb 0.18 0.40 0.00 0.00 -1.71 0.00 0.00 66.02 64.90 1u7t s SER 20 CO 0.61 -0.85 0.00 0.61 1.20 0.00 0.00 173.24 174.80 1u7t n GLY 21 N -0.18 2.33 0.28 9.45 0.00 -1.26 -1.01 105.19 114.81 1u7t n GLY 21 Ca -0.08 0.30 -0.11 0.00 0.00 0.00 0.00 46.02 46.13 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 1.02 -0.51 0.99 3.38 -1.90 -1.81 115.31 116.49 1u7t h LEU 22 Ca 0.00 -0.38 -0.02 0.00 0.09 0.00 0.00 57.88 57.57 1u7t h LEU 22 Cb 0.00 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.45 1u7t h LEU 22 CO 0.00 1.17 0.23 1.23 0.09 0.00 0.00 178.44 181.16 1u7t h GLY 23 N 0.86 0.79 1.00 0.83 0.00 -1.60 -1.03 103.07 103.92 1u7t h GLY 23 Ca 0.12 -0.41 -0.01 0.00 0.00 0.00 0.00 47.33 47.03 1u7t h GLY 23 CO 0.06 0.38 0.35 -2.00 0.00 0.00 0.00 176.54 175.34 1u7t h LEU 24 N 0.68 0.80 -0.92 3.11 5.85 -0.90 -1.46 115.31 122.47 1u7t h LEU 24 Ca 0.17 -0.10 -0.10 0.00 0.84 0.00 0.00 57.88 58.70 1u7t h LEU 24 Cb 0.14 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 40.95 1u7t h LEU 24 CO -0.02 0.67 -0.26 0.00 -0.34 0.00 0.00 178.44 178.49 1u7t h ALA 25 N 1.17 1.09 -0.45 1.25 0.00 -1.10 0.14 119.26 121.35 1u7t h ALA 25 Ca 0.23 -0.35 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 1u7t h ALA 25 Cb 0.04 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1u7t h ALA 25 CO -0.04 0.56 0.22 1.15 0.00 0.00 0.00 179.25 181.15 1u7t h THR 26 N 0.43 1.18 -0.39 0.00 2.02 -0.87 -0.14 112.91 115.14 1u7t h THR 26 Ca 0.06 -0.51 -0.00 0.00 0.77 0.00 0.00 66.41 66.73 1u7t h THR 26 Cb 0.68 0.69 -0.02 0.00 -1.74 0.00 0.00 68.15 67.76 1u7t h THR 26 CO 0.05 0.20 0.23 0.00 0.37 0.00 0.00 175.52 176.37 1u7t h ALA 27 N 1.06 0.50 -0.00 6.16 0.00 -0.81 -0.79 119.26 125.39 1u7t h ALA 27 Ca 0.15 -0.06 0.02 0.00 0.00 0.00 0.00 54.91 55.02 1u7t h ALA 27 Cb 0.11 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1u7t h ALA 27 CO -0.02 0.00 -0.10 0.93 0.00 0.00 0.00 179.25 180.07 1u7t h GLU 28 N 0.51 -0.16 -0.24 0.00 5.08 -0.43 -0.34 114.58 119.00 1u7t h GLU 28 Ca 0.14 0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.51 1u7t h GLU 28 Cb 0.02 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 1u7t h GLU 28 CO -0.02 -0.10 0.15 -0.09 -1.00 0.00 0.00 179.01 177.94 1u7t h ARG 29 N -0.16 0.32 -0.14 2.33 2.43 -0.88 0.63 114.38 118.91 1u7t h ARG 29 Ca 0.04 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.16 1u7t h ARG 29 Cb 0.21 -0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 29.69 1u7t h ARG 29 CO -0.10 0.24 -0.00 -0.07 -1.51 0.00 0.00 179.97 178.53 1u7t h LEU 30 N 0.31 0.25 -1.03 3.80 3.38 -1.02 0.30 115.31 121.30 1u7t h LEU 30 Ca 0.09 -0.32 0.04 0.00 0.09 0.00 0.00 57.88 57.79 1u7t h LEU 30 Cb -0.00 -0.07 -0.06 0.00 0.09 0.00 0.00 40.66 40.62 1u7t h LEU 30 CO -0.02 0.50 0.65 0.58 0.09 0.00 0.00 178.44 180.24 1u7t h VAL 31 N -0.02 1.15 0.00 1.22 2.07 -1.02 0.32 116.25 119.98 1u7t h VAL 31 Ca 0.04 -0.42 -0.01 0.00 0.82 0.00 0.00 66.70 67.12 1u7t h VAL 31 Cb 0.38 -0.19 -0.00 0.00 -1.52 0.00 0.00 31.29 29.96 1u7t h VAL 31 CO 0.01 0.22 -0.07 1.23 0.02 0.00 0.00 177.57 178.98 1u7t h GLY 32 N 1.23 0.00 -3.33 2.17 0.00 -0.27 -2.27 103.07 100.60 1u7t h GLY 32 Ca 0.40 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.70 1u7t h GLY 32 CO -0.13 0.00 0.04 -1.06 0.00 0.00 0.00 176.54 175.39 1u7t n GLN 33 N -3.90 4.35 -0.53 4.80 1.13 0.10 -4.91 117.38 118.42 1u7t n GLN 33 Ca -0.02 -2.82 0.00 0.00 -1.94 0.00 0.00 57.00 52.22 1u7t n GLN 33 Cb 0.16 -2.18 0.00 0.00 0.11 0.00 0.00 30.24 28.33 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 0.46 0.76 3.95 1.08 0.00 -0.85 -3.82 105.19 106.76 1u7t n GLY 34 Ca 0.27 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.05 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 -2.73 3.59 -0.01 4.61 0.00 -0.18 -1.97 121.76 125.07 1u7t s ALA 35 Ca 0.00 -1.08 -0.00 0.00 0.00 0.00 0.00 51.96 50.88 1u7t s ALA 35 Cb 0.00 -2.31 -0.04 0.00 0.00 0.00 0.00 23.12 20.78 1u7t s ALA 35 CO 0.00 -0.85 0.04 -1.12 0.00 0.00 0.00 175.76 173.84 1u7t s SER 36 N -4.40 5.44 0.01 0.00 0.01 0.12 -4.02 113.70 110.86 1u7t s SER 36 Ca 0.56 0.10 0.05 0.00 1.31 0.00 0.00 55.95 57.97 1u7t s SER 36 Cb -0.10 -1.51 -0.02 0.00 0.21 0.00 0.00 66.02 64.60 1u7t s SER 36 CO 0.41 0.29 -0.16 0.00 0.41 0.00 0.00 173.24 174.19 1u7t s ALA 37 N -1.12 1.31 -0.31 1.44 0.00 0.10 -1.36 121.76 121.82 1u7t s ALA 37 Ca 0.20 -0.78 -0.06 0.00 0.00 0.00 0.00 51.96 51.33 1u7t s ALA 37 Cb -0.12 -0.28 0.02 0.00 0.00 0.00 0.00 23.12 22.75 1u7t s ALA 37 CO 0.11 0.29 0.08 0.08 0.00 0.00 0.00 175.76 176.32 1u7t s VAL 38 N -0.59 3.82 -0.63 0.00 1.01 -0.25 -0.93 120.40 122.82 1u7t s VAL 38 Ca 0.05 -0.87 -0.25 0.00 0.00 0.00 0.00 61.98 60.90 1u7t s VAL 38 Cb -0.07 -3.04 0.04 0.00 0.00 0.00 0.00 36.38 33.32 1u7t s VAL 38 CO 0.00 -0.00 1.08 -0.76 0.00 0.00 0.00 175.10 175.43 1u7t s LEU 39 N 1.45 3.80 -0.37 3.92 1.43 0.14 -1.23 118.68 127.84 1u7t s LEU 39 Ca 0.01 -0.46 -0.20 0.00 -1.03 0.00 0.00 54.13 52.45 1u7t s LEU 39 Cb -0.18 -2.71 0.00 0.00 0.03 0.00 0.00 46.19 43.33 1u7t s LEU 39 CO 0.02 -1.49 0.61 -0.22 0.23 0.00 0.00 176.35 175.50 1u7t s LEU 40 N 4.64 4.31 0.27 1.79 0.20 0.14 -1.61 118.68 128.43 1u7t s LEU 40 Ca 0.32 0.04 -0.21 0.00 0.69 0.00 0.00 54.13 54.97 1u7t s LEU 40 Cb -0.11 -2.73 0.02 0.00 -0.43 0.00 0.00 46.19 42.94 1u7t s LEU 40 CO 0.17 -0.59 0.70 -0.62 -0.29 0.00 0.00 176.35 175.72 1u7t s ASP 41 N 1.81 -0.27 0.75 3.68 -1.08 -1.15 0.12 116.67 120.53 1u7t s ASP 41 Ca 0.23 -0.58 -0.14 0.00 -0.52 0.00 0.00 52.55 51.54 1u7t s ASP 41 Cb -0.15 0.71 0.05 0.00 -1.46 0.00 0.00 42.92 42.08 1u7t s ASP 41 CO 0.15 -1.31 1.18 -0.76 0.52 0.00 0.00 175.17 174.95 1u7t s LEU 42 N -2.91 3.24 0.32 -1.34 1.43 -1.21 -1.01 118.68 117.20 1u7t s LEU 42 Ca 0.11 2.26 0.01 0.00 -1.03 0.00 0.00 54.13 55.47 1u7t s LEU 42 Cb -0.05 -4.58 0.54 0.00 0.03 0.00 0.00 46.19 42.13 1u7t s LEU 42 CO 0.06 -2.29 1.95 -0.65 0.23 0.00 0.00 176.35 175.65 1u7t h PRO 43 N -0.53 0.97 0.00 1.29 0.11 -1.92 -1.59 132.00 130.34 1u7t h PRO 43 Ca -0.47 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.59 1u7t h PRO 43 Cb 1.28 -0.22 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1u7t h PRO 43 CO 0.49 0.64 0.00 0.27 -0.21 0.00 0.00 178.00 179.19 1u7t n ASN 44 N -4.45 0.00 -4.58 -2.05 6.94 -1.26 -4.77 115.26 105.09 1u7t n ASN 44 Ca 0.11 0.08 -0.29 0.00 -0.02 0.00 0.00 54.58 54.45 1u7t n ASN 44 Cb 0.12 -0.35 0.15 0.00 -2.36 0.00 0.00 39.78 37.35 1u7t n ASN 44 CO 0.00 0.00 0.00 -0.94 -1.03 0.00 0.00 177.26 175.29 1u7t s SER 45 N -2.70 3.15 -0.35 0.53 1.04 -0.60 -4.93 113.70 109.83 1u7t s SER 45 Ca 0.22 0.83 0.01 0.00 0.48 0.00 0.00 55.95 57.49 1u7t s SER 45 Cb 0.18 -1.29 0.40 0.00 0.10 0.00 0.00 66.02 65.41 1u7t s SER 45 CO 0.43 -2.76 1.76 0.61 0.98 0.00 0.00 173.24 174.26 1u7t n GLY 46 N -2.27 4.06 0.27 7.32 0.00 -1.26 -4.59 105.19 108.71 1u7t n GLY 46 Ca 0.08 -1.01 0.00 0.00 0.00 0.00 0.00 46.02 45.09 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 2.09 1.05 0.72 -0.02 0.00 -1.86 -1.42 103.07 103.63 1u7t h GLY 47 Ca 0.43 -0.24 0.04 0.00 0.00 0.00 0.00 47.33 47.55 1u7t h GLY 47 CO 0.86 0.11 0.17 -2.09 0.00 0.00 0.00 176.54 175.59 1u7t h GLU 48 N 0.65 0.35 -0.60 4.80 4.57 -1.95 0.74 114.58 123.15 1u7t h GLU 48 Ca 0.33 -0.02 -0.07 0.00 -1.18 0.00 0.00 59.36 58.42 1u7t h GLU 48 Cb 0.29 -0.08 -0.02 0.00 -0.16 0.00 0.00 28.75 28.78 1u7t h GLU 48 CO -0.23 0.23 0.08 0.00 -1.18 0.00 0.00 179.01 177.91 1u7t h ALA 49 N 1.24 1.02 -0.14 2.92 0.00 -1.86 -1.99 119.26 120.44 1u7t h ALA 49 Ca 0.18 -0.26 -0.14 0.00 0.00 0.00 0.00 54.91 54.69 1u7t h ALA 49 Cb 0.12 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1u7t h ALA 49 CO -0.15 0.62 -0.51 1.96 0.00 0.00 0.00 179.25 181.17 1u7t h GLN 50 N 0.92 0.37 -0.43 0.00 1.08 0.07 -1.87 115.11 115.25 1u7t h GLN 50 Ca 0.18 -0.22 -0.08 0.00 -1.45 0.00 0.00 58.65 57.09 1u7t h GLN 50 Cb 0.42 0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 27.85 1u7t h GLN 50 CO 0.01 0.79 -0.07 0.00 -0.95 0.00 0.00 178.83 178.61 1u7t h ALA 51 N 1.17 1.07 -0.39 3.87 0.00 0.59 -2.53 119.26 123.03 1u7t h ALA 51 Ca 0.01 -0.29 -0.09 0.00 0.00 0.00 0.00 54.91 54.55 1u7t h ALA 51 Cb 0.99 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 1u7t h ALA 51 CO 0.09 0.57 -0.09 1.57 0.00 0.00 0.00 179.25 181.39 1u7t h LYS 52 N 0.68 0.76 -0.47 0.00 5.09 -1.08 -2.96 116.57 118.58 1u7t h LYS 52 Ca 0.12 -0.29 0.05 0.00 0.09 0.00 0.00 60.65 60.63 1u7t h LYS 52 Cb 0.52 -0.04 -0.03 0.00 0.10 0.00 0.00 32.23 32.78 1u7t h LYS 52 CO 0.03 0.89 0.32 0.87 -2.09 0.00 0.00 179.45 179.47 1u7t h LYS 53 N 0.57 0.44 0.00 0.07 1.57 -1.19 -2.88 116.57 115.14 1u7t h LYS 53 Ca 0.10 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 1u7t h LYS 53 Cb 0.60 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.82 1u7t h LYS 53 CO 0.04 0.29 -0.29 -0.07 -0.57 0.00 0.00 179.45 178.85 1u7t h LEU 54 N 0.45 0.00 0.00 2.94 3.38 -1.28 -3.50 115.31 117.30 1u7t h LEU 54 Ca 0.20 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.12 1u7t h LEU 54 Cb 0.23 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.98 1u7t h LEU 54 CO -0.05 0.03 0.00 0.61 0.09 0.00 0.00 178.44 179.12 1u7t n GLY 55 N 1.25 -0.64 0.26 0.83 0.00 -1.09 -4.65 105.19 101.16 1u7t n GLY 55 Ca 0.04 -2.18 0.12 0.00 0.00 0.00 0.00 46.02 44.01 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 -0.45 1.61 -0.26 -1.89 -2.96 115.58 111.63 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 0.12 0.00 0.59 -1.06 0.00 0.00 177.43 177.08 1u7t n ASN 57 N -3.66 4.72 -3.74 5.81 5.03 -1.26 -4.82 115.26 117.34 1u7t n ASN 57 Ca -0.02 -2.73 -0.15 0.00 0.87 0.00 0.00 54.58 52.55 1u7t n ASN 57 Cb 0.24 -0.65 -0.15 0.00 -1.02 0.00 0.00 39.78 38.19 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 1.35 1.39 -0.20 0.00 -7.23 -0.11 -4.69 120.40 110.91 1u7t s VAL 59 Ca -0.07 -2.11 -0.07 0.00 -1.81 0.00 0.00 61.98 57.92 1u7t s VAL 59 Cb -0.12 -2.19 -0.04 0.00 0.56 0.00 0.00 36.38 34.58 1u7t s VAL 59 CO -0.05 -0.47 0.07 0.12 -0.31 0.00 0.00 175.10 174.46 1u7t s PHE 60 N -3.19 3.22 -0.30 2.82 5.36 -1.26 0.28 117.98 124.91 1u7t s PHE 60 Ca 0.25 -0.01 -0.00 0.00 -0.96 0.00 0.00 56.93 56.21 1u7t s PHE 60 Cb 0.03 -2.12 0.06 0.00 -0.34 0.00 0.00 43.02 40.66 1u7t s PHE 60 CO 0.07 0.05 -0.01 0.00 -1.46 0.00 0.00 175.22 173.88 1u7t s ALA 61 N 0.64 2.78 0.08 11.12 0.00 -0.63 -4.92 121.76 130.83 1u7t s ALA 61 Ca 0.03 -1.89 -0.31 0.00 0.00 0.00 0.00 51.96 49.80 1u7t s ALA 61 Cb -0.13 -1.88 -0.07 0.00 0.00 0.00 0.00 23.12 21.04 1u7t s ALA 61 CO 0.01 -1.33 1.41 -1.25 0.00 0.00 0.00 175.76 174.61 1u7t s PRO 62 N 1.17 4.30 -0.25 0.00 0.04 -1.26 -2.91 135.00 136.08 1u7t s PRO 62 Ca -0.04 2.06 -0.27 0.00 0.04 0.00 0.00 61.00 62.79 1u7t s PRO 62 Cb -0.20 -3.36 0.16 0.00 0.04 0.00 0.00 34.50 31.13 1u7t s PRO 62 CO -0.03 -0.49 1.20 0.00 0.04 0.00 0.00 177.00 177.72 1u7t s ALA 63 N 1.57 -2.06 -0.26 8.56 0.00 -0.18 -4.75 121.76 124.64 1u7t s ALA 63 Ca 0.65 1.75 -0.14 0.00 0.00 0.00 0.00 51.96 54.22 1u7t s ALA 63 Cb -0.35 -1.35 -0.04 0.00 0.00 0.00 0.00 23.12 21.37 1u7t s ALA 63 CO 0.29 -0.22 0.34 0.34 0.00 0.00 0.00 175.76 176.51 1u7t s ASP 64 N -0.47 6.24 0.11 0.00 3.68 -1.26 -3.35 116.67 121.61 1u7t s ASP 64 Ca 0.04 0.27 0.18 0.00 2.13 0.00 0.00 52.55 55.17 1u7t s ASP 64 Cb -0.03 -2.19 0.76 0.00 -1.45 0.00 0.00 42.92 40.00 1u7t s ASP 64 CO -0.07 -0.13 1.55 1.33 0.13 0.00 0.00 175.17 177.98 1u7t n VAL 65 N 4.94 0.95 1.71 1.11 0.24 -1.26 -1.63 118.33 124.39 1u7t n VAL 65 Ca -0.10 0.25 0.15 0.00 -2.04 0.00 0.00 64.34 62.61 1u7t n VAL 65 Cb 0.51 -1.08 0.73 0.00 -1.47 0.00 0.00 33.84 32.53 1u7t n VAL 65 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 1u7t n THR 66 N -1.80 0.00 -4.05 3.34 -2.24 -1.26 -4.42 114.28 103.84 1u7t n THR 66 Ca 0.03 -0.10 -0.35 0.00 -2.27 0.00 0.00 64.05 61.36 1u7t n THR 66 Cb 0.19 -0.07 -0.13 0.00 -2.10 0.00 0.00 70.33 68.21 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 -2.10 4.62 0.11 3.42 0.15 -0.65 -4.98 113.70 114.28 1u7t s SER 67 Ca 0.41 -0.27 -0.26 0.00 0.70 0.00 0.00 55.95 56.52 1u7t s SER 67 Cb 0.21 -1.79 -0.09 0.00 -1.71 0.00 0.00 66.02 62.64 1u7t s SER 67 CO 0.38 0.04 1.66 -0.08 1.20 0.00 0.00 173.24 176.44 1u7t h GLU 68 N 7.67 -0.38 -0.68 5.44 4.81 -1.87 -2.40 114.58 127.17 1u7t h GLU 68 Ca -0.37 0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 58.86 1u7t h GLU 68 Cb 1.17 0.09 -0.03 0.00 0.63 0.00 0.00 28.75 30.61 1u7t h GLU 68 CO 0.60 -0.25 0.33 0.87 -0.73 0.00 0.00 179.01 179.83 1u7t h LYS 69 N -0.39 0.98 -0.41 1.92 1.57 -1.95 -0.36 116.57 117.93 1u7t h LYS 69 Ca 0.02 -0.14 0.01 0.00 -1.87 0.00 0.00 60.65 58.67 1u7t h LYS 69 Cb 0.41 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.52 1u7t h LYS 69 CO -0.10 0.77 0.27 -0.44 -0.57 0.00 0.00 179.45 179.37 1u7t h ASP 70 N 0.94 0.46 -0.58 0.86 5.19 -1.83 0.48 116.42 121.94 1u7t h ASP 70 Ca 0.23 -0.01 -0.10 0.00 -0.62 0.00 0.00 57.03 56.53 1u7t h ASP 70 Cb 0.11 -0.11 -0.02 0.00 0.18 0.00 0.00 39.33 39.48 1u7t h ASP 70 CO -0.03 0.33 -0.04 0.58 -3.12 0.00 0.00 179.24 176.96 1u7t h VAL 71 N 0.55 1.27 -0.52 -1.35 2.07 -1.14 0.23 116.25 117.36 1u7t h VAL 71 Ca 0.15 -1.20 0.06 0.00 0.82 0.00 0.00 66.70 66.54 1u7t h VAL 71 Cb -0.05 0.85 -0.05 0.00 -1.52 0.00 0.00 31.29 30.51 1u7t h VAL 71 CO -0.04 0.43 0.22 1.56 0.02 0.00 0.00 177.57 179.77 1u7t h GLN 72 N 0.96 0.42 -0.66 1.57 4.20 -0.59 0.43 115.11 121.44 1u7t h GLN 72 Ca 0.16 -0.03 -0.04 0.00 0.06 0.00 0.00 58.65 58.80 1u7t h GLN 72 Cb 0.60 -0.10 -0.03 0.00 0.30 0.00 0.00 27.48 28.26 1u7t h GLN 72 CO 0.04 0.28 0.25 1.15 -0.67 0.00 0.00 178.83 179.87 1u7t h THR 73 N 0.43 1.24 -0.02 -0.54 2.02 0.87 -2.38 112.91 114.54 1u7t h THR 73 Ca 0.24 -0.79 -0.10 0.00 0.77 0.00 0.00 66.41 66.54 1u7t h THR 73 Cb 0.21 0.51 -0.01 0.00 -1.74 0.00 0.00 68.15 67.12 1u7t h THR 73 CO -0.21 0.31 -0.44 0.00 0.37 0.00 0.00 175.52 175.56 1u7t h ALA 74 N 1.10 1.24 -0.09 6.16 0.00 -0.14 -1.06 119.26 126.48 1u7t h ALA 74 Ca 0.22 -0.40 -0.22 0.00 0.00 0.00 0.00 54.91 54.50 1u7t h ALA 74 Cb 0.24 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 17.96 1u7t h ALA 74 CO -0.01 0.56 -0.83 -0.07 0.00 0.00 0.00 179.25 178.90 1u7t h LEU 75 N 0.04 0.76 -0.96 0.00 3.38 -0.58 -1.40 115.31 116.55 1u7t h LEU 75 Ca -0.00 -0.53 -0.03 0.00 0.09 0.00 0.00 57.88 57.41 1u7t h LEU 75 Cb 0.79 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 41.27 1u7t h LEU 75 CO 0.06 1.31 0.38 0.00 0.09 0.00 0.00 178.44 180.29 1u7t h ALA 76 N 0.66 1.19 -0.48 1.53 0.00 -1.35 0.77 119.26 121.58 1u7t h ALA 76 Ca -0.06 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1u7t h ALA 76 Cb 1.45 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 18.90 1u7t h ALA 76 CO 0.16 0.62 0.32 1.25 0.00 0.00 0.00 179.25 181.60 1u7t h LEU 77 N 1.12 0.55 -0.59 0.00 6.46 -1.01 -1.54 115.31 120.31 1u7t h LEU 77 Ca 0.27 -0.01 -0.06 0.00 -0.12 0.00 0.00 57.88 57.95 1u7t h LEU 77 Cb 0.10 -0.14 -0.02 0.00 -0.73 0.00 0.00 40.66 39.87 1u7t h LEU 77 CO -0.04 0.40 0.11 0.00 -0.62 0.00 0.00 178.44 178.30 1u7t h ALA 78 N 1.18 0.77 0.42 1.25 0.00 -0.31 -0.51 119.26 122.07 1u7t h ALA 78 Ca 0.18 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 1u7t h ALA 78 Cb -0.08 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.50 1u7t h ALA 78 CO -0.04 0.51 -0.20 1.57 0.00 0.00 0.00 179.25 181.09 1u7t h LYS 79 N 0.86 -0.55 -0.91 0.00 2.10 -0.75 0.72 116.57 118.04 1u7t h LYS 79 Ca 0.18 0.04 0.18 0.00 -2.00 0.00 0.00 60.65 59.05 1u7t h LYS 79 Cb 0.39 0.12 -0.07 0.00 -0.90 0.00 0.00 32.23 31.77 1u7t h LYS 79 CO 0.01 -0.26 0.59 0.78 -2.00 0.00 0.00 179.45 178.57 1u7t h GLY 80 N -0.81 1.14 1.04 0.07 0.00 -1.23 1.14 103.07 104.42 1u7t h GLY 80 Ca -0.06 -0.26 -0.35 0.00 0.00 0.00 0.00 47.33 46.67 1u7t h GLY 80 CO 0.10 0.02 -1.67 1.70 0.00 0.00 0.00 176.54 176.69 1u7t h LYS 81 N 0.57 0.44 -0.00 4.80 1.63 -0.93 -3.40 116.57 119.67 1u7t h LYS 81 Ca 0.48 -0.75 0.00 0.00 -0.85 0.00 0.00 60.65 59.53 1u7t h LYS 81 Cb 0.96 0.28 0.00 0.00 -0.60 0.00 0.00 32.23 32.87 1u7t h LYS 81 CO -0.22 1.35 -0.01 1.19 -3.45 0.00 0.00 179.45 178.32 1u7t n PHE 82 N -3.63 0.00 0.00 1.91 3.72 0.23 -5.03 117.46 114.67 1u7t n PHE 82 Ca -0.22 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.18 1u7t n PHE 82 Cb 1.09 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.63 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 2.96 3.73 1.37 0.00 0.39 -4.96 105.19 108.86 1u7t n GLY 83 Ca 0.01 -0.81 -0.10 0.00 0.00 0.00 0.00 46.02 45.11 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 2.09 -0.12 1.61 1.70 -1.26 -4.86 118.95 118.11 1u7t s ARG 84 Ca 0.00 -1.46 0.01 0.00 -0.47 0.00 0.00 55.73 53.81 1u7t s ARG 84 Cb 0.00 0.57 0.02 0.00 -0.57 0.00 0.00 34.95 34.97 1u7t s ARG 84 CO 0.00 -0.95 -0.16 0.08 -1.08 0.00 0.00 175.30 173.20 1u7t s VAL 85 N -2.72 1.56 -0.08 4.99 1.01 -1.26 -4.70 120.40 119.19 1u7t s VAL 85 Ca 0.19 -0.67 0.09 0.00 0.00 0.00 0.00 61.98 61.59 1u7t s VAL 85 Cb -0.04 -1.43 -0.13 0.00 0.00 0.00 0.00 36.38 34.79 1u7t s VAL 85 CO 0.13 0.45 0.06 0.47 0.00 0.00 0.00 175.10 176.21 1u7t n ASP 86 N 4.31 2.60 -3.96 3.32 9.92 0.25 -4.62 116.55 128.37 1u7t n ASP 86 Ca -0.19 0.00 -0.15 0.00 -0.53 0.00 0.00 54.79 53.92 1u7t n ASP 86 Cb 0.51 0.84 -0.14 0.00 -0.64 0.00 0.00 41.12 41.69 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 -2.30 0.40 -0.03 2.53 1.01 -0.43 -1.74 120.40 119.83 1u7t s VAL 87 Ca -0.05 -0.29 0.03 0.00 0.00 0.00 0.00 61.98 61.67 1u7t s VAL 87 Cb 0.03 -0.35 0.00 0.00 0.00 0.00 0.00 36.38 36.06 1u7t s VAL 87 CO 0.40 0.06 -0.13 0.00 0.00 0.00 0.00 175.10 175.44 1u7t s ALA 88 N -0.24 1.17 -0.16 5.51 0.00 -0.14 -0.85 121.76 127.05 1u7t s ALA 88 Ca 0.01 -0.49 0.00 0.00 0.00 0.00 0.00 51.96 51.47 1u7t s ALA 88 Cb -0.03 -0.41 0.03 0.00 0.00 0.00 0.00 23.12 22.72 1u7t s ALA 88 CO -0.00 0.20 -0.09 0.08 0.00 0.00 0.00 175.76 175.95 1u7t s VAL 89 N 0.14 1.34 -0.57 0.00 1.01 -0.67 -0.13 120.40 121.52 1u7t s VAL 89 Ca -0.04 -0.66 -0.20 0.00 0.00 0.00 0.00 61.98 61.08 1u7t s VAL 89 Cb -0.10 -1.39 0.07 0.00 0.00 0.00 0.00 36.38 34.96 1u7t s VAL 89 CO 0.01 0.27 0.74 0.20 0.00 0.00 0.00 175.10 176.32 1u7t s ASN 90 N 1.55 6.21 -0.00 3.32 -0.87 0.42 -1.36 114.94 124.22 1u7t s ASN 90 Ca 0.02 -1.04 0.07 0.00 -1.57 0.00 0.00 52.86 50.34 1u7t s ASN 90 Cb -0.14 -2.33 -0.09 0.00 -0.02 0.00 0.00 41.25 38.67 1u7t s ASN 90 CO -0.09 -1.10 0.22 0.00 -2.57 0.00 0.00 177.10 173.57 1u7t n ALA 92 N -1.45 0.84 -3.57 0.00 0.00 -0.97 -4.70 120.51 110.67 1u7t n ALA 92 Ca 0.00 0.45 -0.06 0.00 0.00 0.00 0.00 53.44 53.82 1u7t n ALA 92 Cb 0.14 -2.30 -0.03 0.00 0.00 0.00 0.00 19.45 17.26 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 1.08 -0.30 0.17 0.00 0.00 -1.26 -4.75 107.32 102.26 1u7t s GLY 93 Ca 0.81 1.64 0.05 0.00 0.00 0.00 0.00 44.72 47.22 1u7t s GLY 93 CO 0.41 0.63 -0.10 -0.26 0.00 0.00 0.00 173.10 173.78 1u7t s ILE 94 N -2.23 1.27 0.10 0.90 -4.36 -1.26 -5.04 121.20 110.58 1u7t s ILE 94 Ca 0.06 -2.09 0.09 0.00 -0.26 0.00 0.00 60.65 58.46 1u7t s ILE 94 Cb -0.01 -1.95 -0.04 0.00 1.25 0.00 0.00 42.46 41.72 1u7t s ILE 94 CO -0.05 -0.67 -0.24 0.00 0.24 0.00 0.00 174.94 174.22 1u7t s ALA 95 N -3.26 2.10 0.02 2.27 0.00 -1.26 -4.94 121.76 116.68 1u7t s ALA 95 Ca 0.19 -1.33 -0.06 0.00 0.00 0.00 0.00 51.96 50.76 1u7t s ALA 95 Cb 0.02 -0.34 -0.01 0.00 0.00 0.00 0.00 23.12 22.80 1u7t s ALA 95 CO 0.03 0.46 0.11 0.14 0.00 0.00 0.00 175.76 176.50 1u7t s VAL 96 N -1.04 0.11 -0.21 0.00 -7.23 -1.26 -5.12 120.40 105.65 1u7t s VAL 96 Ca 0.10 -0.89 0.02 0.00 -1.81 0.00 0.00 61.98 59.40 1u7t s VAL 96 Cb -0.10 -0.64 0.04 0.00 0.56 0.00 0.00 36.38 36.24 1u7t s VAL 96 CO 0.04 -0.49 -0.15 0.00 -0.31 0.00 0.00 175.10 174.19 1u7t s ALA 97 N -1.96 2.35 -0.27 1.32 0.00 -1.26 -4.72 121.76 117.22 1u7t s ALA 97 Ca -0.10 -1.40 -0.13 0.00 0.00 0.00 0.00 51.96 50.33 1u7t s ALA 97 Cb -0.05 -1.33 0.10 0.00 0.00 0.00 0.00 23.12 21.84 1u7t s ALA 97 CO -0.01 -0.71 0.64 0.45 0.00 0.00 0.00 175.76 176.12 1u7t s SER 98 N 1.24 -0.95 0.46 0.00 0.15 0.46 -5.03 113.70 110.04 1u7t s SER 98 Ca -0.01 1.46 -0.22 0.00 0.70 0.00 0.00 55.95 57.88 1u7t s SER 98 Cb -0.16 1.68 -0.08 0.00 -1.71 0.00 0.00 66.02 65.76 1u7t s SER 98 CO -0.09 -0.23 1.11 -0.54 1.20 0.00 0.00 173.24 174.69 1u7t s LYS 99 N 2.15 3.81 0.17 5.44 1.02 -1.26 -4.34 119.74 126.74 1u7t s LYS 99 Ca -0.08 1.62 -0.16 0.00 0.02 0.00 0.00 55.97 57.37 1u7t s LYS 99 Cb -0.08 -2.33 0.13 0.00 -0.52 0.00 0.00 37.83 35.02 1u7t s LYS 99 CO -0.19 -0.47 1.68 1.15 -0.92 0.00 0.00 175.35 176.60 1u7t h THR 100 N 1.81 0.62 -2.30 2.17 2.02 -1.93 -3.17 112.91 112.13 1u7t h THR 100 Ca -0.49 -0.02 -0.07 0.00 0.77 0.00 0.00 66.41 66.60 1u7t h THR 100 Cb 1.24 0.56 -0.22 0.00 -1.74 0.00 0.00 68.15 67.99 1u7t h THR 100 CO 0.60 0.01 -0.01 -0.47 0.37 0.00 0.00 175.52 176.02 1u7t s TYR 101 N -6.20 -0.65 -0.28 3.16 6.14 -1.26 -1.53 117.35 116.74 1u7t s TYR 101 Ca -0.14 1.57 0.01 0.00 0.64 0.00 0.00 57.07 59.16 1u7t s TYR 101 Cb 0.15 0.23 0.08 0.00 0.42 0.00 0.00 41.96 42.83 1u7t s TYR 101 CO 0.71 -0.32 0.01 1.21 0.64 0.00 0.00 175.55 177.80 1u7t s ASN 102 N 0.27 4.13 0.09 4.32 3.84 0.16 -4.99 114.94 122.76 1u7t s ASN 102 Ca -0.00 -1.53 -0.24 0.00 0.21 0.00 0.00 52.86 51.30 1u7t s ASN 102 Cb -0.04 -1.22 -0.14 0.00 -0.55 0.00 0.00 41.25 39.30 1u7t s ASN 102 CO 0.01 -0.31 1.72 0.25 -2.79 0.00 0.00 177.10 175.98 1u7t h LEU 103 N 7.90 -0.11 -0.78 3.21 5.85 -1.96 0.33 115.31 129.74 1u7t h LEU 103 Ca -0.13 0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.56 1u7t h LEU 103 Cb 1.05 0.04 -0.03 0.00 0.37 0.00 0.00 40.66 42.08 1u7t h LEU 103 CO 0.45 -0.07 0.33 0.11 -0.34 0.00 0.00 178.44 178.93 1u7t h LYS 104 N -0.10 1.16 0.00 1.25 1.79 -1.97 -1.94 116.57 116.76 1u7t h LYS 104 Ca 0.00 -0.20 0.00 0.00 -2.18 0.00 0.00 60.65 58.27 1u7t h LYS 104 Cb 0.10 -0.19 0.00 0.00 -1.58 0.00 0.00 32.23 30.55 1u7t h LYS 104 CO -0.01 0.93 -0.30 1.63 -1.08 0.00 0.00 179.45 180.61 1u7t n LYS 105 N -4.32 0.11 -3.46 3.15 5.02 -1.15 -4.95 118.16 112.55 1u7t n LYS 105 Ca 0.07 0.05 -0.19 0.00 -2.02 0.00 0.00 58.31 56.22 1u7t n LYS 105 Cb 0.17 -1.59 0.09 0.00 -0.02 0.00 0.00 35.03 33.68 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 1.43 -0.40 3.13 0.72 0.00 0.11 -5.00 105.19 105.17 1u7t n GLY 106 Ca 0.05 0.14 -0.26 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 -5.65 1.84 -0.11 1.61 -0.21 -0.59 -4.98 119.66 111.57 1u7t s GLN 107 Ca 0.19 -0.60 0.02 0.00 0.02 0.00 0.00 55.36 54.99 1u7t s GLN 107 Cb -0.08 -1.57 -0.01 0.00 1.00 0.00 0.00 33.01 32.34 1u7t s GLN 107 CO 0.72 0.21 -0.17 0.99 -2.12 0.00 0.00 175.29 174.91 1u7t s THR 108 N 0.13 2.67 0.12 -0.19 2.01 -1.26 0.37 115.64 119.49 1u7t s THR 108 Ca -0.06 -0.81 -0.35 0.00 0.31 0.00 0.00 61.69 60.78 1u7t s THR 108 Cb -0.12 -2.08 -0.16 0.00 0.01 0.00 0.00 72.50 70.15 1u7t s THR 108 CO 0.03 0.54 1.28 1.57 -0.69 0.00 0.00 174.62 177.35 1u7t n HIS 109 N 3.36 1.45 -2.34 4.92 -0.00 -0.58 -4.94 115.22 117.09 1u7t n HIS 109 Ca -0.18 0.65 -0.32 0.00 0.46 0.00 0.00 57.72 58.32 1u7t n HIS 109 Cb 0.53 -2.32 -0.03 0.00 -0.12 0.00 0.00 29.99 28.05 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 0.25 4.44 0.17 3.57 -4.23 -1.26 -4.96 115.64 113.62 1u7t s THR 110 Ca 0.80 1.17 -0.10 0.00 -1.18 0.00 0.00 61.69 62.38 1u7t s THR 110 Cb -0.91 -3.68 0.04 0.00 1.34 0.00 0.00 72.50 69.29 1u7t s THR 110 CO 0.49 -0.67 1.60 0.25 -0.54 0.00 0.00 174.62 175.75 1u7t h LEU 111 N 0.84 1.04 -1.10 4.79 5.85 -2.00 -2.96 115.31 121.76 1u7t h LEU 111 Ca -0.47 -0.34 -0.04 0.00 0.84 0.00 0.00 57.88 57.87 1u7t h LEU 111 Cb 1.19 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.93 1u7t h LEU 111 CO 0.61 1.13 -0.19 -0.33 -0.34 0.00 0.00 178.44 179.31 1u7t h GLU 112 N 0.92 0.00 -0.29 1.25 4.39 -1.98 0.22 114.58 119.10 1u7t h GLU 112 Ca 0.15 0.00 -0.16 0.00 0.34 0.00 0.00 59.36 59.69 1u7t h GLU 112 Cb 0.64 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.29 1u7t h GLU 112 CO 0.04 0.19 -0.45 -0.44 -1.16 0.00 0.00 179.01 177.20 1u7t h ASP 113 N 0.00 0.80 -0.47 1.42 3.32 -1.93 -0.76 116.42 118.80 1u7t h ASP 113 Ca -0.00 -0.39 -0.08 0.00 0.02 0.00 0.00 57.03 56.58 1u7t h ASP 113 Cb 0.74 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 40.04 1u7t h ASP 113 CO 0.03 1.13 -0.01 0.15 -1.72 0.00 0.00 179.24 178.82 1u7t h PHE 114 N 0.60 0.92 -0.15 4.55 3.04 -1.20 -2.97 116.94 121.72 1u7t h PHE 114 Ca 0.04 -0.16 -0.04 0.00 3.98 0.00 0.00 57.97 61.78 1u7t h PHE 114 Cb 1.01 -0.24 -0.00 0.00 2.56 0.00 0.00 35.95 39.28 1u7t h PHE 114 CO 0.05 0.88 -0.07 0.37 -2.02 0.00 0.00 178.31 177.52 1u7t h GLN 115 N 0.69 0.32 -0.84 1.11 5.75 -0.93 -2.09 115.11 119.11 1u7t h GLN 115 Ca 0.13 -0.14 0.02 0.00 -0.15 0.00 0.00 58.65 58.52 1u7t h GLN 115 Cb 0.52 -0.01 -0.04 0.00 1.07 0.00 0.00 27.48 29.01 1u7t h GLN 115 CO 0.03 0.63 0.56 0.00 -2.65 0.00 0.00 178.83 177.39 1u7t h ARG 116 N -0.01 1.08 -0.33 1.69 -0.00 -1.18 0.24 114.38 115.87 1u7t h ARG 116 Ca 0.04 -0.06 -0.11 0.00 -0.50 0.00 0.00 59.98 59.34 1u7t h ARG 116 Cb 0.53 -0.24 -0.01 0.00 0.00 0.00 0.00 29.97 30.25 1u7t h ARG 116 CO 0.02 0.71 -0.23 0.28 0.00 0.00 0.00 179.97 180.76 1u7t h VAL 117 N 1.11 1.29 0.09 2.04 2.07 -1.45 -1.86 116.25 119.54 1u7t h VAL 117 Ca 0.32 -1.37 -0.00 0.00 0.82 0.00 0.00 66.70 66.46 1u7t h VAL 117 Cb -0.07 1.45 0.00 0.00 -1.52 0.00 0.00 31.29 31.15 1u7t h VAL 117 CO -0.08 0.45 -0.04 -0.07 0.02 0.00 0.00 177.57 177.84 1u7t h LEU 118 N 0.51 -0.10 -0.02 2.57 3.38 -0.93 -1.85 115.31 118.87 1u7t h LEU 118 Ca 0.07 -0.02 0.01 0.00 0.09 0.00 0.00 57.88 58.02 1u7t h LEU 118 Cb 0.78 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.55 1u7t h LEU 118 CO 0.06 -0.05 -0.02 0.44 0.09 0.00 0.00 178.44 178.96 1u7t h ASP 119 N -0.15 -0.07 0.11 -0.43 3.45 -0.45 0.45 116.42 119.34 1u7t h ASP 119 Ca -0.01 0.01 -0.01 0.00 0.43 0.00 0.00 57.03 57.46 1u7t h ASP 119 Cb 0.12 0.03 0.00 0.00 -0.56 0.00 0.00 39.33 38.92 1u7t h ASP 119 CO 0.02 -0.03 -0.05 0.58 -1.57 0.00 0.00 179.24 178.19 1u7t h VAL 120 N -0.03 1.10 -0.16 -1.35 2.07 -1.39 0.30 116.25 116.79 1u7t h VAL 120 Ca 0.02 -1.09 -0.18 0.00 0.82 0.00 0.00 66.70 66.27 1u7t h VAL 120 Cb 0.05 1.76 0.01 0.00 -1.52 0.00 0.00 31.29 31.59 1u7t h VAL 120 CO -0.04 0.25 -0.60 0.78 0.02 0.00 0.00 177.57 177.99 1u7t h ASN 121 N -0.68 0.81 0.00 0.57 4.21 -1.32 -3.04 115.58 116.14 1u7t h ASN 121 Ca -0.01 -0.61 0.00 0.00 1.21 0.00 0.00 56.30 56.89 1u7t h ASN 121 Cb 0.52 -0.24 0.00 0.00 -1.12 0.00 0.00 38.32 37.48 1u7t h ASN 121 CO 0.02 1.28 -0.77 -0.11 -1.29 0.00 0.00 177.43 176.56 1u7t n LEU 122 N -4.09 1.59 -0.28 1.61 7.94 0.05 -3.90 117.00 119.91 1u7t n LEU 122 Ca -0.07 0.27 -0.03 0.00 -1.11 0.00 0.00 56.01 55.07 1u7t n LEU 122 Cb 0.65 -0.67 0.09 0.00 0.53 0.00 0.00 43.42 44.03 1u7t n LEU 122 CO 0.49 -0.34 1.18 -0.03 -1.11 0.00 0.00 177.39 177.59 1u7t h MET 123 N -0.77 0.96 -0.74 1.96 4.05 -1.23 -1.32 114.93 117.84 1u7t h MET 123 Ca 0.00 -0.06 0.05 0.00 -0.28 0.00 0.00 59.70 59.41 1u7t h MET 123 Cb 0.77 -0.22 -0.05 0.00 -0.80 0.00 0.00 31.60 31.30 1u7t h MET 123 CO 0.00 0.63 0.44 0.78 0.23 0.00 0.00 176.91 179.00 1u7t h GLY 124 N 0.99 1.08 1.03 1.39 0.00 -0.28 0.20 103.07 107.49 1u7t h GLY 124 Ca 0.31 -0.32 -0.11 0.00 0.00 0.00 0.00 47.33 47.21 1u7t h GLY 124 CO -0.11 0.24 -0.15 -0.84 0.00 0.00 0.00 176.54 175.68 1u7t h THR 125 N 0.84 1.28 -0.22 4.70 2.02 -1.54 -2.15 112.91 117.83 1u7t h THR 125 Ca 0.31 -1.28 -0.11 0.00 0.77 0.00 0.00 66.41 66.10 1u7t h THR 125 Cb 0.12 1.20 -0.01 0.00 -1.74 0.00 0.00 68.15 67.72 1u7t h THR 125 CO -0.15 0.44 -0.33 0.15 0.37 0.00 0.00 175.52 175.99 1u7t h PHE 126 N 0.69 0.54 -0.48 3.16 3.57 -0.66 -0.84 116.94 122.93 1u7t h PHE 126 Ca 0.10 -0.14 0.03 0.00 3.53 0.00 0.00 57.97 61.49 1u7t h PHE 126 Cb 0.71 -0.12 -0.03 0.00 2.79 0.00 0.00 35.95 39.29 1u7t h PHE 126 CO 0.05 0.75 0.27 -0.97 -2.23 0.00 0.00 178.31 176.19 1u7t h ASN 127 N 0.40 0.43 -0.61 0.41 -1.24 -0.47 0.05 115.58 114.55 1u7t h ASN 127 Ca 0.05 0.01 -0.06 0.00 0.71 0.00 0.00 56.30 57.01 1u7t h ASN 127 Cb 0.78 -0.08 -0.03 0.00 0.73 0.00 0.00 38.32 39.72 1u7t h ASN 127 CO 0.06 0.31 0.15 0.58 -1.29 0.00 0.00 177.43 177.24 1u7t h VAL 128 N 0.55 1.25 -0.18 2.57 2.07 -1.15 -2.88 116.25 118.49 1u7t h VAL 128 Ca 0.20 -0.91 -0.00 0.00 0.82 0.00 0.00 66.70 66.80 1u7t h VAL 128 Cb 0.04 0.67 -0.01 0.00 -1.52 0.00 0.00 31.29 30.47 1u7t h VAL 128 CO -0.10 0.34 0.10 0.40 0.02 0.00 0.00 177.57 178.33 1u7t h ILE 129 N 0.89 1.10 -0.19 4.57 2.04 -0.67 -0.32 117.51 124.94 1u7t h ILE 129 Ca 0.19 -0.29 -0.10 0.00 1.00 0.00 0.00 64.86 65.67 1u7t h ILE 129 Cb 0.35 0.98 -0.01 0.00 -0.74 0.00 0.00 36.82 37.39 1u7t h ILE 129 CO 0.00 0.10 -0.32 0.08 0.00 0.00 0.00 178.15 178.01 1u7t h ARG 130 N 0.18 0.38 0.12 2.37 0.11 -0.97 -0.53 114.38 116.04 1u7t h ARG 130 Ca 0.06 -0.15 -0.19 0.00 0.10 0.00 0.00 59.98 59.80 1u7t h ARG 130 Cb 0.07 -0.02 0.02 0.00 1.11 0.00 0.00 29.97 31.16 1u7t h ARG 130 CO -0.01 0.66 -0.80 -0.07 0.10 0.00 0.00 179.97 179.85 1u7t h LEU 131 N 0.33 0.49 -1.16 0.08 3.38 -1.42 -3.25 115.31 113.75 1u7t h LEU 131 Ca 0.04 -0.93 -0.08 0.00 0.09 0.00 0.00 57.88 57.00 1u7t h LEU 131 Cb 0.72 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 1u7t h LEU 131 CO 0.06 1.38 -0.39 1.62 0.09 0.00 0.00 178.44 181.20 1u7t h VAL 132 N -0.32 1.10 -0.76 1.22 3.04 -0.99 -2.58 116.25 116.97 1u7t h VAL 132 Ca -0.14 -1.41 0.03 0.00 -1.01 0.00 0.00 66.70 64.18 1u7t h VAL 132 Cb 1.61 1.80 -0.04 0.00 -2.01 0.00 0.00 31.29 32.64 1u7t h VAL 132 CO 0.15 0.38 0.48 0.00 -1.01 0.00 0.00 177.57 177.57 1u7t h ALA 133 N 1.61 0.99 0.00 3.17 0.00 -1.17 -0.17 119.26 123.69 1u7t h ALA 133 Ca -0.00 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.82 1u7t h ALA 133 Cb 0.76 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 1u7t h ALA 133 CO 0.05 0.30 -0.27 0.78 0.00 0.00 0.00 179.25 180.11 1u7t h GLY 134 N 0.95 0.00 0.90 0.00 0.00 -1.50 0.02 103.07 103.44 1u7t h GLY 134 Ca 0.30 0.00 -0.13 0.00 0.00 0.00 0.00 47.33 47.50 1u7t h GLY 134 CO -0.10 0.00 -0.40 0.83 0.00 0.00 0.00 176.54 176.87 1u7t h GLU 135 N 0.00 0.57 -0.06 4.80 4.39 -1.16 -3.21 114.58 119.91 1u7t h GLU 135 Ca -0.00 -0.39 -0.09 0.00 0.34 0.00 0.00 59.36 59.21 1u7t h GLU 135 Cb 0.49 0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 29.18 1u7t h GLU 135 CO 0.04 1.00 -0.40 0.52 -1.16 0.00 0.00 179.01 179.01 1u7t h MET 136 N 0.23 0.12 0.00 2.33 2.86 -0.68 -2.77 114.93 117.01 1u7t h MET 136 Ca -0.00 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.58 1u7t h MET 136 Cb 1.01 -0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.67 1u7t h MET 136 CO 0.09 0.51 0.00 0.78 1.06 0.00 0.00 176.91 179.35 1u7t h GLY 137 N 1.22 0.00 1.54 8.32 0.00 -1.00 0.45 103.07 113.60 1u7t h GLY 137 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.34 1u7t h GLY 137 CO 0.06 0.00 -0.14 0.61 0.00 0.00 0.00 176.54 177.07 1u7t n GLN 138 N -2.90 0.16 -2.47 4.80 10.64 -1.05 -4.85 117.38 121.71 1u7t n GLN 138 Ca -0.02 -0.04 -0.37 0.00 -1.83 0.00 0.00 57.00 54.74 1u7t n GLN 138 Cb 0.13 -1.50 -0.04 0.00 -0.86 0.00 0.00 30.24 27.97 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 -2.87 6.76 0.17 2.61 0.01 0.16 -5.00 114.94 116.78 1u7t s ASN 139 Ca 0.17 2.15 -0.30 0.00 -0.71 0.00 0.00 52.86 54.17 1u7t s ASN 139 Cb 0.19 -2.60 -0.07 0.00 0.41 0.00 0.00 41.25 39.18 1u7t s ASN 139 CO 0.55 -0.49 1.10 -1.83 -1.51 0.00 0.00 177.10 174.92 1u7t s GLU 140 N -2.29 4.59 0.54 -0.60 -1.05 -1.26 -4.90 118.70 113.72 1u7t s GLU 140 Ca 0.56 1.72 -0.22 0.00 -0.15 0.00 0.00 54.97 56.88 1u7t s GLU 140 Cb -0.26 -3.28 -0.05 0.00 -0.44 0.00 0.00 34.13 30.10 1u7t s GLU 140 CO 0.32 0.06 1.34 -2.14 0.95 0.00 0.00 175.26 175.79 1u7t s PRO 141 N -0.29 3.18 0.71 -4.83 0.02 -1.26 -4.81 135.00 127.72 1u7t s PRO 141 Ca 0.50 2.18 -0.12 0.00 0.02 0.00 0.00 61.00 63.58 1u7t s PRO 141 Cb -0.29 -2.26 0.18 0.00 0.02 0.00 0.00 34.50 32.15 1u7t s PRO 141 CO 0.35 -1.14 0.69 -0.40 -0.33 0.00 0.00 177.00 176.17 1u7t n ASP 142 N -1.01 -1.32 0.33 2.53 5.68 0.05 -4.79 116.55 118.02 1u7t n ASP 142 Ca 0.10 -0.98 0.20 0.00 -0.50 0.00 0.00 54.79 53.62 1u7t n ASP 142 Cb 0.45 -0.61 1.10 0.00 -1.14 0.00 0.00 41.12 40.92 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 -0.67 0.11 -0.00 -1.95 -0.42 115.11 112.18 1u7t h GLN 143 Ca -0.25 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.40 1u7t h GLN 143 Cb 0.75 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.23 1u7t h GLN 143 CO 0.17 0.00 0.00 0.41 -0.00 0.00 0.00 178.83 179.41 1u7t n GLY 144 N -1.15 2.24 2.34 0.06 0.00 -1.26 -4.92 105.19 102.51 1u7t n GLY 144 Ca -0.03 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.25 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 1.47 0.85 3.81 -0.02 0.00 -0.16 -5.02 105.19 106.11 1u7t n GLY 145 Ca 0.23 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.87 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 -0.16 4.06 -0.03 1.61 0.74 -1.26 -4.28 119.66 120.34 1u7t s GLN 146 Ca 0.00 0.48 0.09 0.00 0.05 0.00 0.00 55.36 55.98 1u7t s GLN 146 Cb 0.00 -3.27 -0.14 0.00 1.10 0.00 0.00 33.01 30.70 1u7t s GLN 146 CO 0.00 0.57 0.17 0.54 -0.55 0.00 0.00 175.29 176.02 1u7t n ARG 147 N 2.19 0.73 -3.58 1.67 1.74 -0.08 -0.77 116.66 118.56 1u7t n ARG 147 Ca -0.12 -0.07 -0.05 0.00 -0.77 0.00 0.00 57.85 56.84 1u7t n ARG 147 Cb 0.52 -1.22 -0.02 0.00 -1.02 0.00 0.00 32.46 30.72 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 -3.28 -0.37 -0.04 -0.13 0.00 -1.18 -4.80 107.32 97.52 1u7t s GLY 148 Ca -0.04 1.10 0.02 0.00 0.00 0.00 0.00 44.72 45.80 1u7t s GLY 148 CO 0.39 0.35 -0.08 0.14 0.00 0.00 0.00 173.10 173.89 1u7t s VAL 149 N -2.81 0.76 -0.10 1.40 1.01 -0.71 -2.03 120.40 117.92 1u7t s VAL 149 Ca 0.08 -0.28 0.04 0.00 0.00 0.00 0.00 61.98 61.82 1u7t s VAL 149 Cb -0.00 -0.72 0.00 0.00 0.00 0.00 0.00 36.38 35.66 1u7t s VAL 149 CO -0.06 0.26 -0.23 -0.63 0.00 0.00 0.00 175.10 174.45 1u7t s ILE 150 N 0.63 1.95 -0.12 2.22 1.01 -0.05 -0.97 121.20 125.87 1u7t s ILE 150 Ca -0.10 -0.96 0.00 0.00 0.00 0.00 0.00 60.65 59.60 1u7t s ILE 150 Cb -0.13 -1.70 0.02 0.00 0.01 0.00 0.00 42.46 40.66 1u7t s ILE 150 CO 0.01 0.54 -0.11 -0.63 0.00 0.00 0.00 174.94 174.75 1u7t s ILE 151 N 0.40 1.26 0.29 2.92 1.01 0.81 -0.80 121.20 127.10 1u7t s ILE 151 Ca -0.18 -0.46 0.07 0.00 0.00 0.00 0.00 60.65 60.09 1u7t s ILE 151 Cb -0.18 -1.21 -0.03 0.00 0.01 0.00 0.00 42.46 41.05 1u7t s ILE 151 CO 0.08 0.40 0.25 0.20 0.00 0.00 0.00 174.94 175.87 1u7t s ASN 152 N 1.44 5.42 -0.23 3.58 -0.87 0.47 -0.44 114.94 124.31 1u7t s ASN 152 Ca 0.01 -0.37 -0.01 0.00 -1.57 0.00 0.00 52.86 50.93 1u7t s ASN 152 Cb -0.13 -1.19 0.02 0.00 -0.02 0.00 0.00 41.25 39.93 1u7t s ASN 152 CO -0.07 -0.20 -0.10 -0.89 -2.57 0.00 0.00 177.10 173.27 1u7t s THR 153 N -2.22 2.66 0.00 1.60 2.01 -0.95 -0.82 115.64 117.92 1u7t s THR 153 Ca 0.37 -0.98 0.00 0.00 0.31 0.00 0.00 61.69 61.38 1u7t s THR 153 Cb -0.07 -2.29 0.00 0.00 0.01 0.00 0.00 72.50 70.15 1u7t s THR 153 CO 0.26 0.30 0.00 0.00 -0.69 0.00 0.00 174.62 174.49 1u7t n ALA 154 N 4.65 0.00 0.00 7.40 0.00 -0.15 -4.97 120.51 127.44 1u7t n ALA 154 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.26 1u7t n ALA 154 Cb 0.48 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.93 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 0.02 0.00 2.88 -1.26 -4.56 113.62 110.70 1u7t n SER 155 Ca 0.00 0.00 0.07 0.00 -1.33 0.00 0.00 58.87 57.61 1u7t n SER 155 Cb 0.00 0.00 0.30 0.00 -0.75 0.00 0.00 64.21 63.76 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 -0.12 1.11 0.36 2.46 0.24 -0.98 -1.61 118.33 119.78 1u7t n VAL 156 Ca 0.00 0.29 0.10 0.00 -2.04 0.00 0.00 64.34 62.69 1u7t n VAL 156 Cb 0.00 -1.11 0.44 0.00 -1.47 0.00 0.00 33.84 31.70 1u7t n VAL 156 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1u7t n ALA 157 N -1.54 1.53 0.27 2.33 0.00 -1.26 -0.82 120.51 121.01 1u7t n ALA 157 Ca 0.03 0.07 0.15 0.00 0.00 0.00 0.00 53.44 53.69 1u7t n ALA 157 Cb 0.15 -1.32 0.75 0.00 0.00 0.00 0.00 19.45 19.03 1u7t n ALA 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1u7t h ALA 158 N 2.26 1.10 0.00 0.00 0.00 -1.54 -3.04 119.26 118.03 1u7t h ALA 158 Ca 0.00 -0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.78 1u7t h ALA 158 Cb 0.26 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1u7t h ALA 158 CO 0.00 0.10 -1.20 1.19 0.00 0.00 0.00 179.25 179.34 1u7t n PHE 159 N -3.33 0.00 -2.92 0.00 3.01 -0.41 -4.74 117.46 109.07 1u7t n PHE 159 Ca -0.01 0.00 -0.18 0.00 1.01 0.00 0.00 57.45 58.27 1u7t n PHE 159 Cb 0.26 -0.14 -0.01 0.00 -0.01 0.00 0.00 39.48 39.58 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 -2.18 1.61 -1.63 -1.08 4.71 -0.00 -5.09 120.64 116.98 1u7t n GLU 160 Ca -0.05 -3.68 -0.47 0.00 -0.01 0.00 0.00 57.16 52.94 1u7t n GLU 160 Cb 0.59 -1.71 -0.04 0.00 -1.01 0.00 0.00 31.44 29.28 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 0.02 0.52 3.96 0.62 0.00 -1.15 -4.62 105.19 104.54 1u7t n GLY 161 Ca 0.23 0.56 -0.23 0.00 0.00 0.00 0.00 46.02 46.58 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 -0.06 2.47 0.14 1.61 -0.21 -1.26 -4.87 119.66 117.48 1u7t s GLN 162 Ca 0.74 -0.57 -0.34 0.00 0.02 0.00 0.00 55.36 55.21 1u7t s GLN 162 Cb -0.77 -2.38 -0.14 0.00 1.00 0.00 0.00 33.01 30.72 1u7t s GLN 162 CO 0.48 -0.86 1.62 0.28 -2.12 0.00 0.00 175.29 174.69 1u7t n VAL 163 N -2.53 0.06 -0.08 1.09 0.31 -1.26 -1.11 118.33 114.81 1u7t n VAL 163 Ca 0.08 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.39 1u7t n VAL 163 Cb 0.60 -1.60 0.00 0.00 -0.91 0.00 0.00 33.84 31.93 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 3.55 0.89 1.29 2.92 0.00 -1.26 -4.90 105.19 107.68 1u7t n GLY 164 Ca 0.17 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.26 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 3.59 -0.04 1.61 6.02 -0.27 -0.40 117.38 125.90 1u7t n GLN 165 Ca 0.00 -2.98 -0.08 0.00 -0.01 0.00 0.00 57.00 53.93 1u7t n GLN 165 Cb 0.00 -2.01 -0.03 0.00 1.02 0.00 0.00 30.24 29.22 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 2.55 0.12 -0.32 -1.58 0.00 -1.79 0.26 119.26 118.50 1u7t h ALA 166 Ca 0.02 0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 1u7t h ALA 166 Cb 1.68 0.16 -0.01 0.00 0.00 0.00 0.00 17.79 19.62 1u7t h ALA 166 CO 0.35 -0.48 0.10 0.00 0.00 0.00 0.00 179.25 179.21 1u7t h ALA 167 N 1.18 0.42 -0.37 0.00 0.00 -1.87 -0.58 119.26 118.03 1u7t h ALA 167 Ca 0.10 -0.16 0.03 0.00 0.00 0.00 0.00 54.91 54.88 1u7t h ALA 167 Cb 0.15 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 1u7t h ALA 167 CO -0.21 0.06 0.17 -0.92 0.00 0.00 0.00 179.25 178.35 1u7t h TYR 168 N 0.36 0.31 -0.55 0.00 3.20 -1.79 -1.79 116.97 116.70 1u7t h TYR 168 Ca 0.10 0.02 -0.05 0.00 3.14 0.00 0.00 58.73 61.94 1u7t h TYR 168 Cb 0.26 -0.08 -0.03 0.00 1.54 0.00 0.00 36.73 38.42 1u7t h TYR 168 CO 0.01 0.15 0.13 0.77 -1.64 0.00 0.00 178.16 177.58 1u7t h SER 169 N 0.35 0.80 -0.25 -2.11 0.02 -0.32 -0.53 113.55 111.51 1u7t h SER 169 Ca 0.16 -0.15 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 1u7t h SER 169 Cb 0.09 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.41 1u7t h SER 169 CO -0.13 0.78 0.16 0.00 -1.14 0.00 0.00 176.83 176.50 1u7t h ALA 170 N 1.32 0.31 -0.47 3.77 0.00 -0.79 0.37 119.26 123.77 1u7t h ALA 170 Ca 0.18 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.95 1u7t h ALA 170 Cb 0.31 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 1u7t h ALA 170 CO -0.00 -0.20 -0.15 0.66 0.00 0.00 0.00 179.25 179.56 1u7t h SER 171 N 0.32 0.90 0.67 0.00 4.64 -0.75 -1.66 113.55 117.68 1u7t h SER 171 Ca 0.09 -0.30 -0.27 0.00 -0.47 0.00 0.00 61.79 60.84 1u7t h SER 171 Cb -0.01 -0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 61.82 1u7t h SER 171 CO -0.02 1.05 -1.25 0.11 -0.87 0.00 0.00 176.83 175.85 1u7t h LYS 172 N 0.79 0.21 -0.34 4.77 1.79 -0.99 -2.82 116.57 119.98 1u7t h LYS 172 Ca 0.12 -0.36 -0.03 0.00 -2.18 0.00 0.00 60.65 58.20 1u7t h LYS 172 Cb 0.69 0.13 -0.02 0.00 -1.58 0.00 0.00 32.23 31.45 1u7t h LYS 172 CO 0.05 1.14 0.08 0.78 -1.08 0.00 0.00 179.45 180.43 1u7t h GLY 173 N 1.92 0.54 0.78 3.86 0.00 -0.24 -0.85 103.07 109.08 1u7t h GLY 173 Ca -0.13 -0.28 0.03 0.00 0.00 0.00 0.00 47.33 46.96 1u7t h GLY 173 CO 0.18 0.26 0.15 -1.33 0.00 0.00 0.00 176.54 175.80 1u7t h GLY 174 N 0.73 0.46 0.99 4.60 0.00 -1.24 0.11 103.07 108.72 1u7t h GLY 174 Ca 0.12 -0.10 -0.01 0.00 0.00 0.00 0.00 47.33 47.34 1u7t h GLY 174 CO -0.00 0.06 0.32 -2.22 0.00 0.00 0.00 176.54 174.70 1u7t h ILE 175 N 0.32 1.19 0.15 2.60 1.08 -1.09 -1.23 117.51 120.53 1u7t h ILE 175 Ca 0.15 -0.47 -0.01 0.00 -0.39 0.00 0.00 64.86 64.14 1u7t h ILE 175 Cb 0.09 0.45 0.00 0.00 -3.07 0.00 0.00 36.82 34.29 1u7t h ILE 175 CO -0.13 0.20 -0.07 0.58 -0.69 0.00 0.00 178.15 178.04 1u7t h VAL 176 N 0.78 0.86 -0.27 1.67 2.07 -0.90 -2.72 116.25 117.74 1u7t h VAL 176 Ca 0.20 -0.05 -0.02 0.00 0.82 0.00 0.00 66.70 67.65 1u7t h VAL 176 Cb 0.04 0.90 -0.01 0.00 -1.52 0.00 0.00 31.29 30.69 1u7t h VAL 176 CO -0.03 0.01 0.10 1.23 0.02 0.00 0.00 177.57 178.90 1u7t h GLY 177 N -0.23 0.41 -0.26 2.17 0.00 -0.38 -2.30 103.07 102.48 1u7t h GLY 177 Ca -0.02 -0.18 0.00 0.00 0.00 0.00 0.00 47.33 47.13 1u7t h GLY 177 CO 0.03 0.18 -0.05 1.15 0.00 0.00 0.00 176.54 177.85 1u7t n MET 178 N -4.41 1.47 0.09 4.80 0.00 -0.50 -4.22 117.12 114.36 1u7t n MET 178 Ca 0.01 -0.83 -0.12 0.00 0.00 0.00 0.00 57.70 56.75 1u7t n MET 178 Cb 0.14 -1.48 -0.06 0.00 0.00 0.00 0.00 33.22 31.81 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 2.03 0.76 0.02 3.17 2.02 -1.09 -2.29 112.91 117.54 1u7t h THR 179 Ca 0.00 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.18 1u7t h THR 179 Cb 0.48 0.76 0.00 0.00 -1.74 0.00 0.00 68.15 67.65 1u7t h THR 179 CO 0.00 0.00 -0.01 0.25 0.37 0.00 0.00 175.52 176.13 1u7t h LEU 180 N -0.23 -0.03 -0.87 2.58 5.85 -1.77 -1.69 115.31 119.16 1u7t h LEU 180 Ca 0.01 -0.39 0.09 0.00 0.84 0.00 0.00 57.88 58.43 1u7t h LEU 180 Cb 0.22 0.01 -0.07 0.00 0.37 0.00 0.00 40.66 41.19 1u7t h LEU 180 CO -0.03 0.38 0.52 1.55 -0.34 0.00 0.00 178.44 180.51 1u7t h PRO 181 N -0.44 0.86 -0.41 5.25 0.13 -1.79 0.40 132.00 136.01 1u7t h PRO 181 Ca -0.00 -0.05 -0.05 0.00 -0.87 0.00 0.00 66.00 65.02 1u7t h PRO 181 Cb 0.41 -0.20 -0.02 0.00 0.13 0.00 0.00 31.00 31.33 1u7t h PRO 181 CO 0.01 0.57 0.06 0.82 -0.23 0.00 0.00 178.00 179.23 1u7t h ILE 182 N 0.89 1.24 -0.76 -3.56 2.04 -1.38 0.60 117.51 116.58 1u7t h ILE 182 Ca 0.40 -0.89 0.08 0.00 1.00 0.00 0.00 64.86 65.46 1u7t h ILE 182 Cb 0.31 1.03 -0.07 0.00 -0.74 0.00 0.00 36.82 37.35 1u7t h ILE 182 CO -0.22 0.31 0.43 0.00 0.00 0.00 0.00 178.15 178.66 1u7t h ALA 183 N 0.93 1.06 -0.51 1.87 0.00 -0.61 0.05 119.26 122.05 1u7t h ALA 183 Ca 0.12 0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.99 1u7t h ALA 183 Cb 0.38 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 1u7t h ALA 183 CO 0.01 0.07 0.06 0.00 0.00 0.00 0.00 179.25 179.39 1u7t h ARG 184 N 0.74 0.87 -0.45 0.00 3.08 0.48 -0.56 114.38 118.54 1u7t h ARG 184 Ca 0.36 -0.25 0.08 0.00 0.07 0.00 0.00 59.98 60.24 1u7t h ARG 184 Cb 0.30 -0.09 -0.07 0.00 0.08 0.00 0.00 29.97 30.19 1u7t h ARG 184 CO -0.23 0.87 0.06 -0.44 -1.07 0.00 0.00 179.97 179.17 1u7t h ASP 185 N 0.74 -0.06 0.18 7.04 3.45 0.12 -3.08 116.42 124.80 1u7t h ASP 185 Ca 0.15 0.09 0.00 0.00 0.43 0.00 0.00 57.03 57.70 1u7t h ASP 185 Cb 0.44 0.13 0.00 0.00 -0.56 0.00 0.00 39.33 39.35 1u7t h ASP 185 CO 0.02 0.00 -0.43 0.18 -1.57 0.00 0.00 179.24 177.44 1u7t n LEU 186 N -5.14 1.24 -0.31 1.55 4.77 -0.09 -4.34 117.00 114.68 1u7t n LEU 186 Ca 0.04 -0.39 0.03 0.00 -0.03 0.00 0.00 56.01 55.66 1u7t n LEU 186 Cb 0.23 -0.09 0.17 0.00 -2.33 0.00 0.00 43.42 41.40 1u7t n LEU 186 CO 0.20 0.24 1.17 0.00 -1.33 0.00 0.00 177.39 177.67 1u7t h ALA 187 N 3.58 1.23 0.00 -1.18 0.00 -1.01 0.36 119.26 122.24 1u7t h ALA 187 Ca 0.00 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1u7t h ALA 187 Cb 0.58 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1u7t h ALA 187 CO 0.00 0.17 0.06 -1.35 0.00 0.00 0.00 179.25 178.13 1u7t h PRO 188 N 0.88 0.00 -0.14 0.00 0.11 -1.78 -1.98 132.00 129.08 1u7t h PRO 188 Ca 0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.52 1u7t h PRO 188 Cb 0.33 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.44 1u7t h PRO 188 CO -0.23 0.00 0.00 0.44 -0.21 0.00 0.00 178.00 178.00 1u7t n ILE 189 N -2.65 1.91 -3.01 4.15 -5.35 0.09 -4.98 119.36 109.52 1u7t n ILE 189 Ca -0.02 -1.89 -0.14 0.00 -0.27 0.00 0.00 62.75 60.43 1u7t n ILE 189 Cb 0.11 -0.12 0.04 0.00 -1.74 0.00 0.00 39.64 37.93 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 -0.80 0.05 3.23 3.28 0.00 -0.75 -4.29 105.19 105.91 1u7t n GLY 190 Ca 0.17 -0.17 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 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 -3.10 3.11 0.38 -0.61 1.01 -1.14 -0.90 121.20 119.96 1u7t s ILE 191 Ca 0.29 -0.93 -0.23 0.00 0.00 0.00 0.00 60.65 59.77 1u7t s ILE 191 Cb -0.13 -2.58 -0.10 0.00 0.01 0.00 0.00 42.46 39.66 1u7t s ILE 191 CO 0.36 0.19 0.95 -0.13 0.00 0.00 0.00 174.94 176.31 1u7t s ARG 192 N 1.37 4.39 -0.10 2.79 0.52 -0.86 -4.30 118.95 122.75 1u7t s ARG 192 Ca 0.01 1.23 -0.01 0.00 -0.52 0.00 0.00 55.73 56.44 1u7t s ARG 192 Cb -0.17 -2.48 0.03 0.00 0.52 0.00 0.00 34.95 32.85 1u7t s ARG 192 CO -0.03 0.11 -0.04 0.08 0.02 0.00 0.00 175.30 175.43 1u7t s VAL 193 N -1.90 0.78 0.14 3.52 1.01 -1.26 -0.87 120.40 121.81 1u7t s VAL 193 Ca 0.56 -0.14 0.05 0.00 0.00 0.00 0.00 61.98 62.46 1u7t s VAL 193 Cb -0.14 -0.86 -0.04 0.00 0.00 0.00 0.00 36.38 35.35 1u7t s VAL 193 CO 0.18 0.32 -0.13 -0.04 0.00 0.00 0.00 175.10 175.43 1u7t s MET 194 N 1.81 1.05 -0.01 2.72 -1.94 0.02 0.00 119.30 122.96 1u7t s MET 194 Ca 0.05 -1.34 0.02 0.00 -1.71 0.00 0.00 55.69 52.71 1u7t s MET 194 Cb -0.13 -0.81 -0.00 0.00 2.01 0.00 0.00 34.83 35.90 1u7t s MET 194 CO -0.07 0.14 -0.07 0.99 -0.01 0.00 0.00 175.02 175.99 1u7t s THR 195 N -2.63 0.61 -0.13 2.05 2.01 -0.48 -0.40 115.64 116.68 1u7t s THR 195 Ca 0.13 -0.31 -0.04 0.00 0.31 0.00 0.00 61.69 61.78 1u7t s THR 195 Cb -0.02 -0.52 -0.03 0.00 0.01 0.00 0.00 72.50 71.93 1u7t s THR 195 CO 0.02 0.18 0.02 -0.63 -0.69 0.00 0.00 174.62 173.53 1u7t s ILE 196 N -0.06 4.46 -0.61 1.82 1.01 -0.00 -0.58 121.20 127.24 1u7t s ILE 196 Ca 0.01 -0.17 -0.06 0.00 0.00 0.00 0.00 60.65 60.42 1u7t s ILE 196 Cb -0.04 -2.93 0.16 0.00 0.01 0.00 0.00 42.46 39.65 1u7t s ILE 196 CO -0.00 0.55 0.46 0.00 0.00 0.00 0.00 174.94 175.94 1u7t s ALA 197 N -0.34 3.59 0.50 9.38 0.00 0.14 -0.97 121.76 134.06 1u7t s ALA 197 Ca 0.07 -3.05 -0.21 0.00 0.00 0.00 0.00 51.96 48.77 1u7t s ALA 197 Cb -0.12 -2.83 -0.07 0.00 0.00 0.00 0.00 23.12 20.10 1u7t s ALA 197 CO 0.02 -2.06 1.15 -2.14 0.00 0.00 0.00 175.76 172.73 1u7t s PRO 198 N 0.40 3.58 0.00 0.00 0.02 -1.26 -0.54 135.00 137.20 1u7t s PRO 198 Ca 0.14 1.71 0.00 0.00 0.02 0.00 0.00 61.00 62.87 1u7t s PRO 198 Cb -0.20 -2.23 0.00 0.00 0.02 0.00 0.00 34.50 32.09 1u7t s PRO 198 CO -0.04 -0.69 0.00 0.41 -0.33 0.00 0.00 177.00 176.35 1u7t n GLY 199 N 0.33 1.29 2.98 0.52 0.00 0.08 -2.33 105.19 108.07 1u7t n GLY 199 Ca 0.09 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.84 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 1.48 0.08 0.99 1.43 -1.26 -4.76 118.68 116.64 1u7t s LEU 200 Ca 0.00 -0.34 0.08 0.00 -1.03 0.00 0.00 54.13 52.83 1u7t s LEU 200 Cb 0.00 -0.92 -0.03 0.00 0.03 0.00 0.00 46.19 45.27 1u7t s LEU 200 CO 0.00 -0.04 -0.21 -0.36 0.23 0.00 0.00 176.35 175.97 1u7t s PHE 201 N 1.22 1.79 -1.21 0.29 0.40 -1.26 0.47 117.98 119.68 1u7t s PHE 201 Ca -0.03 -0.40 -0.19 0.00 -0.60 0.00 0.00 56.93 55.71 1u7t s PHE 201 Cb -0.14 -1.02 0.07 0.00 0.51 0.00 0.00 43.02 42.45 1u7t s PHE 201 CO -0.04 0.15 1.63 0.20 0.70 0.00 0.00 175.22 177.87 1u7t s GLY 202 N -1.59 1.58 0.29 4.36 0.00 -0.80 -4.79 107.32 106.37 1u7t s GLY 202 Ca 0.07 -2.75 0.05 0.00 0.00 0.00 0.00 44.72 42.09 1u7t s GLY 202 CO 0.03 2.67 -0.01 -0.51 0.00 0.00 0.00 173.10 175.28 1u7t s THR 203 N 4.27 1.43 0.15 0.90 -4.23 -1.26 -4.70 115.64 112.19 1u7t s THR 203 Ca 0.51 -2.06 0.24 0.00 -1.18 0.00 0.00 61.69 59.20 1u7t s THR 203 Cb 0.02 -2.57 0.24 0.00 1.34 0.00 0.00 72.50 71.53 1u7t s THR 203 CO 0.02 -0.19 1.72 -0.65 -0.54 0.00 0.00 174.62 174.97 1u7t h PRO 204 N 2.23 0.00 -0.78 3.99 0.11 -1.98 -2.24 132.00 133.33 1u7t h PRO 204 Ca -0.40 0.00 0.10 0.00 0.11 0.00 0.00 66.00 65.81 1u7t h PRO 204 Cb 1.24 0.00 -0.07 0.00 0.11 0.00 0.00 31.00 32.27 1u7t h PRO 204 CO 0.68 0.00 0.42 1.25 -0.21 0.00 0.00 178.00 180.14 1u7t h LEU 205 N 0.00 0.57 -0.56 2.35 5.85 -1.95 -2.73 115.31 118.85 1u7t h LEU 205 Ca 0.00 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.78 1u7t h LEU 205 Cb 0.29 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.27 1u7t h LEU 205 CO 0.00 0.32 -0.00 0.18 -0.34 0.00 0.00 178.44 178.60 1u7t n LEU 206 N -4.80 0.86 -0.07 2.25 4.77 -0.84 -4.21 117.00 114.96 1u7t n LEU 206 Ca 0.13 -0.29 -0.06 0.00 -0.03 0.00 0.00 56.01 55.76 1u7t n LEU 206 Cb 0.29 -0.00 0.14 0.00 -2.33 0.00 0.00 43.42 41.52 1u7t n LEU 206 CO 0.25 0.14 0.76 0.74 -1.33 0.00 0.00 177.39 177.96 1u7t h THR 207 N 1.36 1.26 -0.90 -5.08 2.02 -1.63 -2.25 112.91 107.69 1u7t h THR 207 Ca 0.00 -1.22 0.16 0.00 0.77 0.00 0.00 66.41 66.12 1u7t h THR 207 Cb 0.29 1.14 -0.07 0.00 -1.74 0.00 0.00 68.15 67.77 1u7t h THR 207 CO 0.00 0.41 0.58 0.28 0.37 0.00 0.00 175.52 177.16 1u7t h SER 208 N 0.64 0.62 -3.99 4.18 0.02 -1.78 -3.42 113.55 109.82 1u7t h SER 208 Ca 0.10 0.05 -0.54 0.00 -0.84 0.00 0.00 61.79 60.55 1u7t h SER 208 Cb 0.63 -0.08 0.12 0.00 0.14 0.00 0.00 62.40 63.22 1u7t h SER 208 CO 0.04 0.30 0.71 -0.76 -1.14 0.00 0.00 176.83 175.98 1u7t s LEU 209 N -9.79 4.12 0.33 5.07 1.43 -0.85 -4.95 118.68 114.04 1u7t s LEU 209 Ca -0.10 2.94 -0.28 0.00 -1.03 0.00 0.00 54.13 55.66 1u7t s LEU 209 Cb 0.22 -3.93 -0.12 0.00 0.03 0.00 0.00 46.19 42.39 1u7t s LEU 209 CO 0.79 -1.18 1.32 -2.65 0.23 0.00 0.00 176.35 174.85 1u7t n PRO 210 N -0.19 2.16 -0.26 1.29 -0.02 -1.26 -4.82 135.00 131.90 1u7t n PRO 210 Ca 0.05 0.76 0.06 0.00 -2.02 0.00 0.00 63.50 62.35 1u7t n PRO 210 Cb 0.42 -2.36 0.19 0.00 -0.02 0.00 0.00 33.50 31.73 1u7t n PRO 210 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1u7t h GLU 211 N 2.74 0.36 -0.82 -0.52 5.08 -1.92 0.67 114.58 120.17 1u7t h GLU 211 Ca -0.46 -0.02 0.13 0.00 -1.00 0.00 0.00 59.36 58.01 1u7t h GLU 211 Cb 1.28 -0.08 -0.09 0.00 0.50 0.00 0.00 28.75 30.36 1u7t h GLU 211 CO 0.64 0.24 0.41 0.87 -1.00 0.00 0.00 179.01 180.17 1u7t h LYS 212 N 0.37 0.60 -0.10 2.33 1.57 -1.99 0.83 116.57 120.17 1u7t h LYS 212 Ca 0.43 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 59.14 1u7t h LYS 212 Cb 0.70 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 32.87 1u7t h LYS 212 CO -0.46 0.39 -0.03 0.28 -0.57 0.00 0.00 179.45 179.07 1u7t h VAL 213 N 0.61 1.30 -0.56 0.50 2.07 -1.24 -0.68 116.25 118.25 1u7t h VAL 213 Ca 0.44 -1.00 0.11 0.00 0.82 0.00 0.00 66.70 67.07 1u7t h VAL 213 Cb 0.58 1.76 -0.08 0.00 -1.52 0.00 0.00 31.29 32.03 1u7t h VAL 213 CO -0.34 0.28 0.09 0.03 0.02 0.00 0.00 177.57 177.64 1u7t h ARG 214 N -0.13 0.21 -0.68 1.57 3.08 -0.86 0.16 114.38 117.72 1u7t h ARG 214 Ca 0.02 -0.01 -0.07 0.00 0.07 0.00 0.00 59.98 59.99 1u7t h ARG 214 Cb 0.46 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.44 1u7t h ARG 214 CO 0.01 0.14 0.14 -0.91 -1.07 0.00 0.00 179.97 178.28 1u7t h ASN 215 N 0.21 1.05 -0.31 7.04 2.35 -0.74 -0.97 115.58 124.21 1u7t h ASN 215 Ca 0.29 -0.24 -0.01 0.00 -0.55 0.00 0.00 56.30 55.79 1u7t h ASN 215 Cb 0.43 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.51 1u7t h ASN 215 CO -0.40 1.02 0.15 0.15 -1.65 0.00 0.00 177.43 176.69 1u7t h PHE 216 N 1.03 0.46 -0.70 1.19 3.57 0.10 -0.53 116.94 122.05 1u7t h PHE 216 Ca 0.21 -0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.74 1u7t h PHE 216 Cb 0.40 -0.14 -0.05 0.00 2.79 0.00 0.00 35.95 38.94 1u7t h PHE 216 CO 0.03 0.41 0.41 -0.07 -2.23 0.00 0.00 178.31 176.86 1u7t h LEU 217 N 0.37 0.63 -0.95 0.59 3.38 -0.61 -1.56 115.31 117.17 1u7t h LEU 217 Ca 0.11 0.02 0.05 0.00 0.09 0.00 0.00 57.88 58.15 1u7t h LEU 217 Cb 0.13 -0.11 -0.06 0.00 0.09 0.00 0.00 40.66 40.71 1u7t h LEU 217 CO -0.01 0.42 0.61 0.00 0.09 0.00 0.00 178.44 179.55 1u7t h ALA 218 N 1.34 1.28 0.00 1.53 0.00 -0.70 -1.65 119.26 121.06 1u7t h ALA 218 Ca 0.30 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.18 1u7t h ALA 218 Cb 0.14 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.62 1u7t h ALA 218 CO -0.16 0.44 0.00 0.66 0.00 0.00 0.00 179.25 180.19 1u7t h SER 219 N 1.15 0.00 0.21 0.00 4.64 -0.06 -2.92 113.55 116.56 1u7t h SER 219 Ca 0.39 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.71 1u7t h SER 219 Cb 0.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.17 1u7t h SER 219 CO -0.14 0.00 -0.43 0.00 -0.87 0.00 0.00 176.83 175.39 1u7t n GLN 220 N -2.39 0.68 -2.34 4.77 1.13 -0.62 -4.83 117.38 113.77 1u7t n GLN 220 Ca 0.01 -0.46 -0.43 0.00 -1.94 0.00 0.00 57.00 54.17 1u7t n GLN 220 Cb 0.18 -1.49 -0.02 0.00 0.11 0.00 0.00 30.24 29.01 1u7t n GLN 220 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 1u7t s VAL 221 N -2.64 4.08 0.11 5.09 1.01 -1.10 -4.87 120.40 122.08 1u7t s VAL 221 Ca 0.19 1.26 -0.31 0.00 0.00 0.00 0.00 61.98 63.12 1u7t s VAL 221 Cb 0.18 -3.98 -0.10 0.00 0.00 0.00 0.00 36.38 32.49 1u7t s VAL 221 CO 0.60 -0.29 1.58 -0.65 0.00 0.00 0.00 175.10 176.34 1u7t h PRO 222 N 9.14 -0.62 -1.78 2.72 0.11 -1.85 -3.31 132.00 136.41 1u7t h PRO 222 Ca -0.28 0.04 0.07 0.00 0.11 0.00 0.00 66.00 65.94 1u7t h PRO 222 Cb 1.11 0.14 -0.23 0.00 0.11 0.00 0.00 31.00 32.14 1u7t h PRO 222 CO 1.00 -0.41 0.11 0.12 -0.21 0.00 0.00 178.00 178.60 1u7t s PHE 223 N -5.88 -0.96 0.42 0.65 5.36 -1.06 -4.13 117.98 112.38 1u7t s PHE 223 Ca -0.16 1.82 -0.23 0.00 -0.96 0.00 0.00 56.93 57.40 1u7t s PHE 223 Cb 0.08 0.57 -0.09 0.00 -0.34 0.00 0.00 43.02 43.24 1u7t s PHE 223 CO 0.63 -0.47 1.05 -1.25 -1.46 0.00 0.00 175.22 173.71 1u7t s PRO 224 N 1.90 4.08 -1.34 10.12 0.04 -1.26 -4.48 135.00 144.06 1u7t s PRO 224 Ca -0.08 1.49 -0.17 0.00 0.04 0.00 0.00 61.00 62.28 1u7t s PRO 224 Cb -0.06 -2.45 0.07 0.00 0.04 0.00 0.00 34.50 32.10 1u7t s PRO 224 CO -0.18 -0.21 1.87 0.43 0.04 0.00 0.00 177.00 178.95 1u7t n SER 225 N -0.26 4.65 -3.61 6.66 7.64 -1.25 -4.79 113.62 122.67 1u7t n SER 225 Ca 0.06 -2.90 -0.03 0.00 1.01 0.00 0.00 58.87 57.00 1u7t n SER 225 Cb 0.50 -1.71 -0.01 0.00 -1.01 0.00 0.00 64.21 61.97 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 3.76 0.53 0.73 1.43 1.70 -1.24 -4.87 118.95 120.99 1u7t s ARG 226 Ca 0.51 -0.25 -0.15 0.00 -0.47 0.00 0.00 55.73 55.37 1u7t s ARG 226 Cb 0.07 0.21 0.04 0.00 -0.57 0.00 0.00 34.95 34.70 1u7t s ARG 226 CO 0.03 -0.24 1.23 -0.51 -1.08 0.00 0.00 175.30 174.73 1u7t s LEU 227 N -2.56 3.34 0.56 -1.89 1.43 -1.26 -4.81 118.68 113.48 1u7t s LEU 227 Ca 0.10 2.44 -0.18 0.00 -1.03 0.00 0.00 54.13 55.47 1u7t s LEU 227 Cb 0.01 -4.60 -0.05 0.00 0.03 0.00 0.00 46.19 41.58 1u7t s LEU 227 CO -0.04 -2.31 1.09 -0.83 0.23 0.00 0.00 176.35 174.49 1u7t s GLY 228 N -1.87 2.42 -0.05 -3.19 0.00 0.18 -4.77 107.32 100.03 1u7t s GLY 228 Ca 0.77 0.64 -0.18 0.00 0.00 0.00 0.00 44.72 45.95 1u7t s GLY 228 CO 0.45 0.98 0.49 -0.35 0.00 0.00 0.00 173.10 174.67 1u7t s ASP 229 N -2.16 6.80 0.59 1.64 2.15 -1.26 -1.91 116.67 122.51 1u7t s ASP 229 Ca 0.69 0.95 0.29 0.00 0.43 0.00 0.00 52.55 54.90 1u7t s ASP 229 Cb -0.20 -2.30 1.51 0.00 -0.30 0.00 0.00 42.92 41.63 1u7t s ASP 229 CO 0.30 0.12 1.94 -0.65 -0.17 0.00 0.00 175.17 176.70 1u7t h PRO 230 N 5.85 0.00 0.00 4.34 0.11 -1.93 0.45 132.00 140.82 1u7t h PRO 230 Ca -0.45 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.60 1u7t h PRO 230 Cb 1.20 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.30 1u7t h PRO 230 CO 0.70 0.00 -0.27 0.00 -0.21 0.00 0.00 178.00 178.22 1u7t h ALA 231 N 1.52 1.16 -0.40 -0.75 0.00 -1.93 -2.48 119.26 116.38 1u7t h ALA 231 Ca 0.19 -0.24 -0.09 0.00 0.00 0.00 0.00 54.91 54.77 1u7t h ALA 231 Cb 1.05 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.78 1u7t h ALA 231 CO -0.00 0.34 -0.12 0.93 0.00 0.00 0.00 179.25 180.40 1u7t h GLU 232 N 0.00 0.72 -0.26 0.00 5.08 -0.49 -0.58 114.58 119.05 1u7t h GLU 232 Ca -0.00 -0.24 -0.01 0.00 -1.00 0.00 0.00 59.36 58.11 1u7t h GLU 232 Cb 0.65 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.83 1u7t h GLU 232 CO 0.03 0.81 0.13 -0.92 -1.00 0.00 0.00 179.01 178.07 1u7t h TYR 233 N 0.66 0.36 -0.81 4.33 3.20 -1.50 -2.75 116.97 120.46 1u7t h TYR 233 Ca 0.11 -0.01 0.07 0.00 3.14 0.00 0.00 58.73 62.04 1u7t h TYR 233 Cb 0.58 -0.11 -0.06 0.00 1.54 0.00 0.00 36.73 38.67 1u7t h TYR 233 CO 0.03 0.33 0.48 0.00 -1.64 0.00 0.00 178.16 177.36 1u7t h ALA 234 N 1.00 1.12 -0.83 1.82 0.00 -1.07 -1.38 119.26 119.93 1u7t h ALA 234 Ca 0.09 0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.02 1u7t h ALA 234 Cb 0.10 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.67 1u7t h ALA 234 CO -0.01 0.17 0.55 1.25 0.00 0.00 0.00 179.25 181.20 1u7t h HIS 235 N 0.85 1.05 -0.47 0.00 -0.00 -1.01 -2.01 115.15 113.56 1u7t h HIS 235 Ca 0.37 0.02 -0.13 0.00 -0.00 0.00 0.00 60.37 60.63 1u7t h HIS 235 Cb 0.25 -0.35 -0.01 0.00 -0.00 0.00 0.00 27.41 27.29 1u7t h HIS 235 CO -0.05 0.66 -0.22 1.25 -0.00 0.00 0.00 177.93 179.57 1u7t h LEU 236 N 1.12 0.98 -0.62 0.26 5.85 -0.98 -1.58 115.31 120.34 1u7t h LEU 236 Ca 0.30 -0.37 0.05 0.00 0.84 0.00 0.00 57.88 58.70 1u7t h LEU 236 Cb -0.13 -0.27 -0.05 0.00 0.37 0.00 0.00 40.66 40.59 1u7t h LEU 236 CO -0.06 1.15 0.35 0.58 -0.34 0.00 0.00 178.44 180.11 1u7t h VAL 237 N 0.82 0.98 -0.68 1.05 2.07 -1.11 -1.16 116.25 118.23 1u7t h VAL 237 Ca 0.11 -0.22 -0.06 0.00 0.82 0.00 0.00 66.70 67.34 1u7t h VAL 237 Cb 0.79 0.27 -0.03 0.00 -1.52 0.00 0.00 31.29 30.80 1u7t h VAL 237 CO 0.07 0.12 0.19 -0.61 0.02 0.00 0.00 177.57 177.36 1u7t h GLN 238 N 0.65 1.07 -0.98 1.57 4.15 -1.04 -0.15 115.11 120.38 1u7t h GLN 238 Ca 0.27 -0.24 0.01 0.00 0.77 0.00 0.00 58.65 59.46 1u7t h GLN 238 Cb 0.15 -0.15 -0.05 0.00 0.21 0.00 0.00 27.48 27.64 1u7t h GLN 238 CO -0.16 0.94 0.65 0.00 -1.93 0.00 0.00 178.83 178.33 1u7t h ALA 239 N 1.08 1.31 -0.30 3.38 0.00 -0.78 0.79 119.26 124.74 1u7t h ALA 239 Ca 0.22 -0.07 -0.10 0.00 0.00 0.00 0.00 54.91 54.96 1u7t h ALA 239 Cb 0.33 -0.40 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1u7t h ALA 239 CO -0.00 0.64 -0.22 0.82 0.00 0.00 0.00 179.25 180.50 1u7t h ILE 240 N 1.32 1.30 -0.81 0.00 2.04 -0.95 -1.35 117.51 119.06 1u7t h ILE 240 Ca 0.36 -1.36 0.06 0.00 1.00 0.00 0.00 64.86 64.93 1u7t h ILE 240 Cb -0.15 1.51 -0.06 0.00 -0.74 0.00 0.00 36.82 37.38 1u7t h ILE 240 CO -0.08 0.44 0.49 0.40 0.00 0.00 0.00 178.15 179.40 1u7t h ILE 241 N 0.43 1.02 0.03 -0.67 2.04 -0.43 -3.06 117.51 116.87 1u7t h ILE 241 Ca 0.06 -0.31 -0.22 0.00 1.00 0.00 0.00 64.86 65.40 1u7t h ILE 241 Cb 0.77 0.05 -0.01 0.00 -0.74 0.00 0.00 36.82 36.88 1u7t h ILE 241 CO 0.06 0.16 -0.98 -0.33 0.00 0.00 0.00 178.15 177.06 1u7t h GLU 242 N 0.89 0.18 -6.06 2.37 5.08 -0.73 -3.43 114.58 112.88 1u7t h GLU 242 Ca 0.36 -0.23 -0.60 0.00 -1.00 0.00 0.00 59.36 57.88 1u7t h GLU 242 Cb 0.18 0.08 -0.11 0.00 0.50 0.00 0.00 28.75 29.40 1u7t h GLU 242 CO -0.18 1.02 0.54 1.21 -1.00 0.00 0.00 179.01 180.60 1u7t s ASN 243 N -6.94 6.53 0.47 1.42 3.84 -0.52 -4.92 114.94 114.82 1u7t s ASN 243 Ca -0.02 0.21 0.32 0.00 0.21 0.00 0.00 52.86 53.58 1u7t s ASN 243 Cb 0.09 -2.44 1.49 0.00 -0.55 0.00 0.00 41.25 39.85 1u7t s ASN 243 CO 0.84 -0.96 1.96 -0.65 -2.79 0.00 0.00 177.10 175.50 1u7t h PRO 244 N 8.88 0.00 -0.19 0.43 0.11 -1.84 -3.12 132.00 136.27 1u7t h PRO 244 Ca -0.24 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.87 1u7t h PRO 244 Cb 1.08 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1u7t h PRO 244 CO 1.00 0.00 0.00 0.34 -0.21 0.00 0.00 178.00 179.13 1u7t n PHE 245 N -2.74 0.22 -2.83 0.65 -0.00 -1.26 -4.86 117.46 106.65 1u7t n PHE 245 Ca -0.00 -0.11 -0.43 0.00 -0.00 0.00 0.00 57.45 56.91 1u7t n PHE 245 Cb 0.19 0.00 -0.04 0.00 -0.00 0.00 0.00 39.48 39.63 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 -1.78 4.01 -0.10 -2.13 1.43 -1.18 -5.01 118.68 113.93 1u7t s LEU 246 Ca 0.33 0.39 -0.21 0.00 -1.03 0.00 0.00 54.13 53.62 1u7t s LEU 246 Cb 0.21 -3.21 0.05 0.00 0.03 0.00 0.00 46.19 43.27 1u7t s LEU 246 CO 0.31 -0.91 0.50 0.21 0.23 0.00 0.00 176.35 176.69 1u7t s ASN 247 N 2.01 -0.47 -1.56 2.29 2.47 -1.26 -4.76 114.94 113.66 1u7t s ASN 247 Ca 0.37 0.67 0.00 0.00 0.42 0.00 0.00 52.86 54.31 1u7t s ASN 247 Cb -0.11 0.69 0.00 0.00 -1.45 0.00 0.00 41.25 40.38 1u7t s ASN 247 CO 0.21 -0.38 0.00 0.61 -3.72 0.00 0.00 177.10 173.82 1u7t n GLY 248 N 1.82 0.55 3.34 1.21 0.00 0.10 -4.98 105.19 107.23 1u7t n GLY 248 Ca -0.17 -0.21 -0.20 0.00 0.00 0.00 0.00 46.02 45.43 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 -4.20 1.29 -0.14 1.61 2.56 -1.26 -4.54 118.70 114.03 1u7t s GLU 249 Ca 0.00 -1.48 -0.01 0.00 0.00 0.00 0.00 54.97 53.48 1u7t s GLU 249 Cb 0.00 -1.23 -0.01 0.00 2.00 0.00 0.00 34.13 34.88 1u7t s GLU 249 CO 0.00 0.23 -0.12 0.08 -0.56 0.00 0.00 175.26 174.89 1u7t s VAL 250 N -2.44 3.10 -0.20 3.70 1.01 -1.26 -1.38 120.40 122.94 1u7t s VAL 250 Ca 0.18 -0.64 -0.00 0.00 0.00 0.00 0.00 61.98 61.52 1u7t s VAL 250 Cb -0.04 -2.32 0.01 0.00 0.00 0.00 0.00 36.38 34.04 1u7t s VAL 250 CO 0.07 0.52 -0.15 -0.63 0.00 0.00 0.00 175.10 174.90 1u7t s ILE 251 N 0.45 2.42 -0.03 2.22 1.01 0.25 -4.94 121.20 122.60 1u7t s ILE 251 Ca -0.09 -0.86 -0.30 0.00 0.00 0.00 0.00 60.65 59.40 1u7t s ILE 251 Cb -0.16 -2.06 -0.04 0.00 0.01 0.00 0.00 42.46 40.21 1u7t s ILE 251 CO 0.04 0.48 1.26 -0.13 0.00 0.00 0.00 174.94 176.59 1u7t s ARG 252 N 1.33 4.34 -0.49 2.79 0.52 -1.26 0.26 118.95 126.44 1u7t s ARG 252 Ca 0.05 1.77 0.04 0.00 -0.52 0.00 0.00 55.73 57.06 1u7t s ARG 252 Cb -0.14 -3.54 0.13 0.00 0.52 0.00 0.00 34.95 31.92 1u7t s ARG 252 CO -0.10 -0.47 0.23 -1.17 0.02 0.00 0.00 175.30 173.81 1u7t s LEU 253 N 2.14 4.17 0.00 2.53 2.96 0.30 -4.91 118.68 125.87 1u7t s LEU 253 Ca 0.59 -2.86 0.00 0.00 -0.22 0.00 0.00 54.13 51.64 1u7t s LEU 253 Cb -0.27 -1.57 0.00 0.00 0.50 0.00 0.00 46.19 44.85 1u7t s LEU 253 CO 0.24 -0.25 0.17 -0.90 -1.32 0.00 0.00 176.35 174.28 1u7t n ASP 254 N 3.31 0.00 -1.59 3.68 5.68 -1.26 -0.74 116.55 125.63 1u7t n ASP 254 Ca 0.05 -1.01 -0.16 0.00 -0.50 0.00 0.00 54.79 53.16 1u7t n ASP 254 Cb 0.34 -0.00 -0.03 0.00 -1.14 0.00 0.00 41.12 40.28 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 0.52 2.29 6.12 0.00 -1.26 -2.13 105.19 110.73 1u7t n GLY 255 Ca 0.00 -0.22 -0.03 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.47 -0.05 -1.67 4.61 0.00 -1.26 -2.56 120.51 119.11 1u7t n ALA 256 Ca -0.18 0.05 -0.33 0.00 0.00 0.00 0.00 53.44 52.98 1u7t n ALA 256 Cb 0.60 -0.73 0.01 0.00 0.00 0.00 0.00 19.45 19.32 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 -1.91 3.59 -0.12 0.00 2.07 -0.91 -4.75 121.20 119.18 1u7t s ILE 257 Ca 0.00 0.82 -0.00 0.00 -1.41 0.00 0.00 60.65 60.06 1u7t s ILE 257 Cb 0.00 -3.32 0.03 0.00 0.13 0.00 0.00 42.46 39.30 1u7t s ILE 257 CO 0.00 -0.38 -0.08 -0.13 -1.91 0.00 0.00 174.94 172.45 1u7t s ARG 258 N -3.82 1.54 0.18 3.50 1.81 -1.26 -5.01 118.95 115.89 1u7t s ARG 258 Ca 0.66 -0.28 -0.30 0.00 -1.72 0.00 0.00 55.73 54.09 1u7t s ARG 258 Cb -0.18 -1.63 -0.08 0.00 -0.45 0.00 0.00 34.95 32.61 1u7t s ARG 258 CO 0.34 -0.28 1.15 -1.64 -0.68 0.00 0.00 175.30 174.19 1u7t s MET 259 N 1.70 4.54 0.63 3.54 -1.94 -1.26 -5.04 119.30 121.47 1u7t s MET 259 Ca 0.05 1.80 -0.00 0.00 -1.71 0.00 0.00 55.69 55.82 1u7t s MET 259 Cb -0.13 -3.26 0.07 0.00 2.01 0.00 0.00 34.83 33.52 1u7t s MET 259 CO -0.08 -0.02 0.88 -0.65 -0.01 0.00 0.00 175.02 175.14 1u7t s GLN 260 N -0.26 2.17 0.00 2.03 -1.52 -1.26 -4.89 119.66 115.92 1u7t s GLN 260 Ca 0.51 -0.87 0.00 0.00 -1.95 0.00 0.00 55.36 53.06 1u7t s GLN 260 Cb -0.31 -2.40 0.00 0.00 -0.22 0.00 0.00 33.01 30.08 1u7t s GLN 260 CO 0.36 -1.06 0.30 -2.30 -0.25 0.00 0.00 175.29 172.34