#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 -1.69 2.46 0.24 -1.26 -4.93 118.33 113.15 1u7t n VAL 8 Ca 0.00 -0.35 -0.44 0.00 -2.04 0.00 0.00 64.34 61.51 1u7t n VAL 8 Cb 0.00 0.94 -0.04 0.00 -1.47 0.00 0.00 33.84 33.27 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 0.62 2.55 0.00 7.34 5.02 -1.24 -1.37 118.16 131.08 1u7t n LYS 9 Ca 0.16 0.93 0.00 0.00 -2.02 0.00 0.00 58.31 57.38 1u7t n LYS 9 Cb 0.46 -2.77 0.00 0.00 -0.02 0.00 0.00 35.03 32.70 1u7t n LYS 9 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1u7t n GLY 10 N 3.97 1.91 3.80 0.72 0.00 -0.71 -4.89 105.19 109.98 1u7t n GLY 10 Ca 0.18 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.86 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 -4.75 118.68 119.42 1u7t s LEU 11 Ca 0.00 1.86 -0.08 0.00 -1.03 0.00 0.00 54.13 54.88 1u7t s LEU 11 Cb 0.00 -4.55 -0.02 0.00 0.03 0.00 0.00 46.19 41.65 1u7t s LEU 11 CO 0.00 -0.73 0.10 -0.69 0.23 0.00 0.00 176.35 175.26 1u7t s VAL 12 N -2.09 4.38 -0.13 -1.59 1.01 -1.26 0.20 120.40 120.92 1u7t s VAL 12 Ca 0.66 -0.31 -0.00 0.00 0.00 0.00 0.00 61.98 62.33 1u7t s VAL 12 Cb -0.15 -3.14 -0.01 0.00 0.00 0.00 0.00 36.38 33.08 1u7t s VAL 12 CO 0.21 0.22 -0.13 0.00 0.00 0.00 0.00 175.10 175.39 1u7t s ALA 13 N 1.60 2.61 -0.26 5.51 0.00 0.28 -0.58 121.76 130.92 1u7t s ALA 13 Ca 0.05 -0.90 -0.13 0.00 0.00 0.00 0.00 51.96 50.99 1u7t s ALA 13 Cb -0.16 -1.21 -0.04 0.00 0.00 0.00 0.00 23.12 21.71 1u7t s ALA 13 CO 0.04 0.23 0.26 0.08 0.00 0.00 0.00 175.76 176.38 1u7t s VAL 14 N 0.38 5.27 -0.31 0.00 1.01 0.54 -1.28 120.40 126.01 1u7t s VAL 14 Ca -0.11 0.35 0.03 0.00 0.00 0.00 0.00 61.98 62.26 1u7t s VAL 14 Cb -0.16 -3.59 0.08 0.00 0.00 0.00 0.00 36.38 32.71 1u7t s VAL 14 CO 0.06 0.25 -0.01 -0.63 0.00 0.00 0.00 175.10 174.76 1u7t s ILE 15 N 1.60 2.25 0.48 2.22 1.01 -0.50 -0.49 121.20 127.77 1u7t s ILE 15 Ca 0.11 -2.05 -0.20 0.00 0.00 0.00 0.00 60.65 58.51 1u7t s ILE 15 Cb -0.15 -2.53 -0.09 0.00 0.01 0.00 0.00 42.46 39.71 1u7t s ILE 15 CO 0.09 -0.36 1.02 0.42 0.00 0.00 0.00 174.94 176.10 1u7t s THR 16 N 0.99 3.95 -1.43 2.92 -4.23 0.23 -1.62 115.64 116.45 1u7t s THR 16 Ca 0.03 1.19 0.00 0.00 -1.18 0.00 0.00 61.69 61.72 1u7t s THR 16 Cb -0.19 -3.49 0.00 0.00 1.34 0.00 0.00 72.50 70.16 1u7t s THR 16 CO -0.07 -0.29 0.00 0.61 -0.54 0.00 0.00 174.62 174.34 1u7t n GLY 17 N -0.42 0.63 0.14 3.99 0.00 0.16 -1.87 105.19 107.82 1u7t n GLY 17 Ca 0.09 -0.29 0.12 0.00 0.00 0.00 0.00 46.02 45.94 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 -1.08 -1.20 0.05 -0.02 0.00 -1.00 -2.94 105.19 98.99 1u7t n GLY 18 Ca -0.16 0.12 0.12 0.00 0.00 0.00 0.00 46.02 46.10 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 -1.79 2.13 -2.97 4.61 0.00 -1.26 -3.15 120.51 118.08 1u7t n ALA 19 Ca 0.01 -0.05 -0.09 0.00 0.00 0.00 0.00 53.44 53.31 1u7t n ALA 19 Cb 0.19 -1.43 -0.06 0.00 0.00 0.00 0.00 19.45 18.16 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 -3.64 -0.07 0.00 0.00 0.15 -1.15 -4.75 113.70 104.24 1u7t s SER 20 Ca 0.11 -0.76 0.00 0.00 0.70 0.00 0.00 55.95 55.99 1u7t s SER 20 Cb 0.14 0.50 0.00 0.00 -1.71 0.00 0.00 66.02 64.96 1u7t s SER 20 CO 0.50 -0.98 0.00 0.61 1.20 0.00 0.00 173.24 174.56 1u7t n GLY 21 N -0.28 2.23 0.23 9.45 0.00 -1.26 -1.37 105.19 114.19 1u7t n GLY 21 Ca -0.07 0.22 -0.08 0.00 0.00 0.00 0.00 46.02 46.09 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 0.68 -0.44 0.99 3.38 -1.90 -0.79 115.31 117.23 1u7t h LEU 22 Ca 0.00 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 57.81 1u7t h LEU 22 Cb 0.00 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.55 1u7t h LEU 22 CO 0.00 0.65 0.25 1.23 0.09 0.00 0.00 178.44 180.66 1u7t h GLY 23 N 0.67 0.64 0.99 0.83 0.00 -1.60 -0.15 103.07 104.45 1u7t h GLY 23 Ca 0.17 -0.28 0.00 0.00 0.00 0.00 0.00 47.33 47.22 1u7t h GLY 23 CO -0.02 0.27 0.24 -2.00 0.00 0.00 0.00 176.54 175.03 1u7t h LEU 24 N 0.57 0.44 -1.27 3.11 5.85 -0.94 -1.04 115.31 122.03 1u7t h LEU 24 Ca 0.15 -0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.82 1u7t h LEU 24 Cb 0.03 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 40.92 1u7t h LEU 24 CO -0.03 0.33 0.23 0.00 -0.34 0.00 0.00 178.44 178.63 1u7t h ALA 25 N 1.12 1.43 -0.23 1.25 0.00 -0.86 0.99 119.26 122.96 1u7t h ALA 25 Ca 0.14 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1u7t h ALA 25 Cb -0.03 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 1u7t h ALA 25 CO -0.03 0.44 0.11 1.15 0.00 0.00 0.00 179.25 180.92 1u7t h THR 26 N 0.73 1.15 -0.29 0.00 2.02 -0.54 -1.19 112.91 114.78 1u7t h THR 26 Ca 0.18 -0.43 0.01 0.00 0.77 0.00 0.00 66.41 66.94 1u7t h THR 26 Cb 0.11 1.01 -0.02 0.00 -1.74 0.00 0.00 68.15 67.51 1u7t h THR 26 CO -0.02 0.15 0.16 0.00 0.37 0.00 0.00 175.52 176.18 1u7t h ALA 27 N 0.96 0.36 -0.61 6.16 0.00 -0.34 -0.29 119.26 125.50 1u7t h ALA 27 Ca 0.08 -0.00 0.10 0.00 0.00 0.00 0.00 54.91 55.09 1u7t h ALA 27 Cb 0.14 -0.07 -0.08 0.00 0.00 0.00 0.00 17.79 17.78 1u7t h ALA 27 CO -0.01 -0.22 0.19 0.93 0.00 0.00 0.00 179.25 180.14 1u7t h GLU 28 N 0.33 0.34 -0.12 0.00 5.08 -0.71 0.51 114.58 120.01 1u7t h GLU 28 Ca 0.12 -0.02 -0.09 0.00 -1.00 0.00 0.00 59.36 58.37 1u7t h GLU 28 Cb 0.01 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.19 1u7t h GLU 28 CO -0.06 0.22 -0.27 -0.09 -1.00 0.00 0.00 179.01 177.81 1u7t h ARG 29 N 0.35 0.39 -0.33 2.33 2.43 -0.61 -1.20 114.38 117.73 1u7t h ARG 29 Ca 0.31 -0.26 -0.06 0.00 -0.81 0.00 0.00 59.98 59.16 1u7t h ARG 29 Cb 0.42 0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.00 1u7t h ARG 29 CO -0.35 0.87 -0.02 -0.07 -1.51 0.00 0.00 179.97 178.90 1u7t h LEU 30 N -0.03 0.59 -0.66 3.80 3.38 -0.85 -0.54 115.31 121.00 1u7t h LEU 30 Ca 0.00 -0.32 0.01 0.00 0.09 0.00 0.00 57.88 57.66 1u7t h LEU 30 Cb 0.87 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 41.42 1u7t h LEU 30 CO 0.06 0.77 0.43 0.58 0.09 0.00 0.00 178.44 180.37 1u7t h VAL 31 N 0.40 1.15 -0.38 1.22 2.07 -0.94 0.14 116.25 119.90 1u7t h VAL 31 Ca 0.09 -0.30 0.11 0.00 0.82 0.00 0.00 66.70 67.43 1u7t h VAL 31 Cb 0.48 0.20 -0.02 0.00 -1.52 0.00 0.00 31.29 30.43 1u7t h VAL 31 CO 0.02 0.16 0.28 1.23 0.02 0.00 0.00 177.57 179.28 1u7t h GLY 32 N 0.87 0.00 -1.64 2.17 0.00 -0.80 -0.11 103.07 103.55 1u7t h GLY 32 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.58 1u7t h GLY 32 CO -0.07 0.00 0.00 -1.06 0.00 0.00 0.00 176.54 175.41 1u7t n GLN 33 N -4.39 2.08 -0.07 4.80 1.13 0.29 -4.91 117.38 116.31 1u7t n GLN 33 Ca 0.06 -1.66 0.00 0.00 -1.94 0.00 0.00 57.00 53.46 1u7t n GLN 33 Cb 0.47 -1.39 0.00 0.00 0.11 0.00 0.00 30.24 29.43 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 1.26 0.62 3.93 1.08 0.00 -0.05 -3.70 105.19 108.32 1u7t n GLY 34 Ca 0.16 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.92 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 -2.10 3.08 -0.02 4.61 0.00 0.03 -1.74 121.76 125.61 1u7t s ALA 35 Ca 0.00 -0.92 -0.01 0.00 0.00 0.00 0.00 51.96 51.04 1u7t s ALA 35 Cb 0.00 -2.64 -0.04 0.00 0.00 0.00 0.00 23.12 20.45 1u7t s ALA 35 CO 0.00 -1.39 0.05 -1.12 0.00 0.00 0.00 175.76 173.31 1u7t s SER 36 N -4.54 5.51 0.03 0.00 0.01 0.13 -4.27 113.70 110.58 1u7t s SER 36 Ca 0.61 0.13 0.04 0.00 1.31 0.00 0.00 55.95 58.04 1u7t s SER 36 Cb -0.10 -1.56 -0.02 0.00 0.21 0.00 0.00 66.02 64.55 1u7t s SER 36 CO 0.45 0.30 -0.12 0.00 0.41 0.00 0.00 173.24 174.28 1u7t s ALA 37 N -1.11 1.01 -0.26 1.44 0.00 -0.24 -0.56 121.76 122.04 1u7t s ALA 37 Ca 0.20 -0.72 -0.04 0.00 0.00 0.00 0.00 51.96 51.39 1u7t s ALA 37 Cb -0.12 -0.16 0.01 0.00 0.00 0.00 0.00 23.12 22.86 1u7t s ALA 37 CO 0.11 0.18 0.01 0.08 0.00 0.00 0.00 175.76 176.14 1u7t s VAL 38 N -0.78 3.49 -0.51 0.00 1.01 -0.40 -0.99 120.40 122.22 1u7t s VAL 38 Ca 0.01 -0.74 -0.26 0.00 0.00 0.00 0.00 61.98 60.99 1u7t s VAL 38 Cb -0.07 -2.74 0.03 0.00 0.00 0.00 0.00 36.38 33.60 1u7t s VAL 38 CO 0.01 0.20 0.99 -0.76 0.00 0.00 0.00 175.10 175.54 1u7t s LEU 39 N 1.44 3.91 -0.36 3.92 1.43 0.10 -1.41 118.68 127.71 1u7t s LEU 39 Ca 0.03 0.00 -0.14 0.00 -1.03 0.00 0.00 54.13 52.99 1u7t s LEU 39 Cb -0.16 -3.11 -0.01 0.00 0.03 0.00 0.00 46.19 42.94 1u7t s LEU 39 CO -0.01 -1.20 0.27 -0.22 0.23 0.00 0.00 176.35 175.43 1u7t s LEU 40 N 4.08 4.66 0.28 1.79 0.20 -0.64 0.07 118.68 129.12 1u7t s LEU 40 Ca 0.37 -0.52 -0.21 0.00 0.69 0.00 0.00 54.13 54.46 1u7t s LEU 40 Cb -0.10 -2.17 0.03 0.00 -0.43 0.00 0.00 46.19 43.51 1u7t s LEU 40 CO 0.25 -0.31 0.74 -0.62 -0.29 0.00 0.00 176.35 176.12 1u7t s ASP 41 N 1.72 -0.23 0.74 3.68 -1.08 -1.13 -0.67 116.67 119.70 1u7t s ASP 41 Ca 0.07 -0.65 -0.13 0.00 -0.52 0.00 0.00 52.55 51.32 1u7t s ASP 41 Cb -0.18 0.73 0.04 0.00 -1.46 0.00 0.00 42.92 42.05 1u7t s ASP 41 CO 0.11 -1.36 1.13 -0.76 0.52 0.00 0.00 175.17 174.81 1u7t s LEU 42 N -2.94 3.20 0.27 -1.34 1.43 -1.23 -0.67 118.68 117.41 1u7t s LEU 42 Ca 0.11 2.06 -0.02 0.00 -1.03 0.00 0.00 54.13 55.26 1u7t s LEU 42 Cb -0.06 -4.55 0.37 0.00 0.03 0.00 0.00 46.19 41.98 1u7t s LEU 42 CO 0.07 -2.09 1.80 1.55 0.23 0.00 0.00 176.35 177.91 1u7t h PRO 43 N -0.61 0.82 -0.03 1.29 0.14 -1.92 -1.84 132.00 129.86 1u7t h PRO 43 Ca -0.46 -0.19 0.00 0.00 0.14 0.00 0.00 66.00 65.50 1u7t h PRO 43 Cb 1.26 -0.11 0.00 0.00 0.14 0.00 0.00 31.00 32.28 1u7t h PRO 43 CO 0.51 0.77 0.00 0.27 0.14 0.00 0.00 178.00 179.69 1u7t n ASN 44 N -4.25 0.52 -4.84 1.44 6.94 -1.26 -4.79 115.26 109.02 1u7t n ASN 44 Ca 0.03 -1.34 -0.29 0.00 -0.02 0.00 0.00 54.58 52.96 1u7t n ASN 44 Cb 0.26 -0.02 0.09 0.00 -2.36 0.00 0.00 39.78 37.75 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 -1.78 4.39 -0.40 0.53 1.04 -0.69 -4.95 113.70 111.84 1u7t s SER 45 Ca 0.37 1.03 0.00 0.00 0.48 0.00 0.00 55.95 57.83 1u7t s SER 45 Cb 0.18 -1.66 0.37 0.00 0.10 0.00 0.00 66.02 65.01 1u7t s SER 45 CO 0.29 -2.00 1.87 0.61 0.98 0.00 0.00 173.24 174.99 1u7t n GLY 46 N -2.64 4.37 0.24 7.32 0.00 -1.26 -4.61 105.19 108.61 1u7t n GLY 46 Ca 0.07 -1.24 -0.06 0.00 0.00 0.00 0.00 46.02 44.78 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 2.16 0.85 0.20 -0.02 0.00 -1.85 -1.60 103.07 102.81 1u7t h GLY 47 Ca 0.43 -0.35 0.08 0.00 0.00 0.00 0.00 47.33 47.49 1u7t h GLY 47 CO 0.96 0.34 -0.08 -2.09 0.00 0.00 0.00 176.54 175.67 1u7t h GLU 48 N 0.79 0.02 -0.27 4.80 4.57 -1.94 0.44 114.58 122.99 1u7t h GLU 48 Ca 0.21 -0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.38 1u7t h GLU 48 Cb -0.02 -0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.55 1u7t h GLU 48 CO -0.04 0.01 0.11 0.00 -1.18 0.00 0.00 179.01 177.91 1u7t h ALA 49 N 1.41 1.69 -0.01 2.92 0.00 -1.81 0.20 119.26 123.66 1u7t h ALA 49 Ca 0.20 -0.08 -0.24 0.00 0.00 0.00 0.00 54.91 54.80 1u7t h ALA 49 Cb 0.31 -0.12 0.02 0.00 0.00 0.00 0.00 17.79 18.00 1u7t h ALA 49 CO -0.41 0.25 -0.92 1.96 0.00 0.00 0.00 179.25 180.13 1u7t h GLN 50 N 0.38 0.64 -0.48 0.00 1.08 0.05 -2.36 115.11 114.43 1u7t h GLN 50 Ca 0.10 -0.68 0.00 0.00 -1.45 0.00 0.00 58.65 56.62 1u7t h GLN 50 Cb 0.08 0.19 -0.02 0.00 -0.05 0.00 0.00 27.48 27.68 1u7t h GLN 50 CO -0.01 1.27 0.30 0.00 -0.95 0.00 0.00 178.83 179.45 1u7t h ALA 51 N 0.39 0.61 -0.73 3.87 0.00 0.23 -1.71 119.26 121.91 1u7t h ALA 51 Ca -0.11 -0.05 0.03 0.00 0.00 0.00 0.00 54.91 54.78 1u7t h ALA 51 Cb 1.59 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 19.14 1u7t h ALA 51 CO 0.18 0.07 0.46 -0.22 0.00 0.00 0.00 179.25 179.74 1u7t h LYS 52 N 0.64 0.87 0.00 0.00 3.64 -0.61 -0.36 116.57 120.75 1u7t h LYS 52 Ca 0.17 -0.05 -0.03 0.00 -1.27 0.00 0.00 60.65 59.47 1u7t h LYS 52 Cb -0.04 -0.20 -0.00 0.00 -0.41 0.00 0.00 32.23 31.58 1u7t h LYS 52 CO -0.04 0.57 -0.13 0.87 -2.27 0.00 0.00 179.45 178.45 1u7t h LYS 53 N 0.89 0.00 -0.01 1.90 1.57 -1.10 -2.98 116.57 116.85 1u7t h LYS 53 Ca 0.30 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.08 1u7t h LYS 53 Cb 0.03 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.34 1u7t h LYS 53 CO -0.12 0.13 -0.13 1.28 -0.57 0.00 0.00 179.45 180.05 1u7t n LEU 54 N -4.22 0.79 0.00 2.94 4.77 -0.16 -5.03 117.00 116.09 1u7t n LEU 54 Ca -0.02 -0.16 0.00 0.00 -0.03 0.00 0.00 56.01 55.79 1u7t n LEU 54 Cb 0.21 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.18 1u7t n LEU 54 CO 0.34 0.14 0.00 0.61 -1.33 0.00 0.00 177.39 177.16 1u7t n GLY 55 N 1.27 -3.06 0.37 -0.72 0.00 -1.12 -4.52 105.19 97.41 1u7t n GLY 55 Ca 0.15 -2.06 0.20 0.00 0.00 0.00 0.00 46.02 44.31 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 -0.55 1.61 -0.26 -1.89 -2.45 115.58 112.04 1u7t h ASN 56 Ca 0.00 0.00 -0.05 0.00 -0.56 0.00 0.00 56.30 55.69 1u7t h ASN 56 Cb 0.00 0.00 -0.03 0.00 -1.06 0.00 0.00 38.32 37.23 1u7t h ASN 56 CO 0.00 0.00 0.06 0.59 -1.06 0.00 0.00 177.43 177.02 1u7t n ASN 57 N -3.87 5.09 -3.71 5.81 5.03 -1.26 -4.79 115.26 117.57 1u7t n ASN 57 Ca 0.07 -2.90 -0.16 0.00 0.87 0.00 0.00 54.58 52.46 1u7t n ASN 57 Cb 0.55 -0.68 -0.16 0.00 -1.02 0.00 0.00 39.78 38.47 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 1.77 1.50 -0.15 0.00 -7.23 -0.16 -4.62 120.40 111.51 1u7t s VAL 59 Ca -0.02 -2.15 -0.07 0.00 -1.81 0.00 0.00 61.98 57.94 1u7t s VAL 59 Cb -0.12 -1.96 -0.04 0.00 0.56 0.00 0.00 36.38 34.82 1u7t s VAL 59 CO -0.05 -0.66 0.08 0.12 -0.31 0.00 0.00 175.10 174.29 1u7t s PHE 60 N -3.11 3.35 -0.30 2.82 5.36 -1.26 0.01 117.98 124.85 1u7t s PHE 60 Ca 0.20 0.25 0.03 0.00 -0.96 0.00 0.00 56.93 56.44 1u7t s PHE 60 Cb 0.01 -2.01 0.08 0.00 -0.34 0.00 0.00 43.02 40.75 1u7t s PHE 60 CO 0.04 0.37 -0.02 0.00 -1.46 0.00 0.00 175.22 174.15 1u7t s ALA 61 N -0.17 2.75 0.04 11.12 0.00 0.11 -4.90 121.76 130.71 1u7t s ALA 61 Ca 0.08 -2.10 -0.30 0.00 0.00 0.00 0.00 51.96 49.64 1u7t s ALA 61 Cb -0.12 -1.81 -0.07 0.00 0.00 0.00 0.00 23.12 21.12 1u7t s ALA 61 CO 0.01 -1.43 1.56 -1.25 0.00 0.00 0.00 175.76 174.65 1u7t s PRO 62 N 1.04 4.23 -0.22 0.00 0.04 -1.26 -2.83 135.00 135.99 1u7t s PRO 62 Ca -0.00 2.19 -0.29 0.00 0.04 0.00 0.00 61.00 62.94 1u7t s PRO 62 Cb -0.20 -3.61 0.16 0.00 0.04 0.00 0.00 34.50 30.88 1u7t s PRO 62 CO -0.06 -0.68 1.17 0.00 0.04 0.00 0.00 177.00 177.47 1u7t s ALA 63 N 2.64 -2.03 -0.31 8.56 0.00 0.15 -4.79 121.76 125.99 1u7t s ALA 63 Ca 0.70 1.73 -0.15 0.00 0.00 0.00 0.00 51.96 54.25 1u7t s ALA 63 Cb -0.36 -1.14 -0.03 0.00 0.00 0.00 0.00 23.12 21.59 1u7t s ALA 63 CO 0.30 -0.26 0.35 0.34 0.00 0.00 0.00 175.76 176.49 1u7t s ASP 64 N -0.92 6.19 0.31 0.00 3.68 -1.26 -3.47 116.67 121.20 1u7t s ASP 64 Ca 0.03 0.00 0.23 0.00 2.13 0.00 0.00 52.55 54.95 1u7t s ASP 64 Cb -0.01 -2.20 1.13 0.00 -1.45 0.00 0.00 42.92 40.39 1u7t s ASP 64 CO -0.04 -0.25 1.71 -0.37 0.13 0.00 0.00 175.17 176.35 1u7t h VAL 65 N 5.47 0.00 0.00 1.11 -1.51 -1.95 -0.13 116.25 119.24 1u7t h VAL 65 Ca -0.31 -0.12 0.00 0.00 -1.23 0.00 0.00 66.70 65.04 1u7t h VAL 65 Cb 1.16 0.74 0.00 0.00 -2.13 0.00 0.00 31.29 31.05 1u7t h VAL 65 CO 0.66 0.00 0.00 0.35 -1.23 0.00 0.00 177.57 177.35 1u7t n THR 66 N -2.30 0.00 -4.34 7.19 -2.24 -1.26 -4.42 114.28 106.91 1u7t n THR 66 Ca 0.00 0.00 -0.34 0.00 -2.27 0.00 0.00 64.05 61.44 1u7t n THR 66 Cb 0.13 -0.40 -0.15 0.00 -2.10 0.00 0.00 70.33 67.81 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 -1.77 3.87 0.10 3.42 0.15 -0.06 -4.96 113.70 114.44 1u7t s SER 67 Ca 0.34 -0.44 -0.24 0.00 0.70 0.00 0.00 55.95 56.32 1u7t s SER 67 Cb 0.16 -1.62 -0.12 0.00 -1.71 0.00 0.00 66.02 62.73 1u7t s SER 67 CO 0.26 0.06 1.71 -0.08 1.20 0.00 0.00 173.24 176.39 1u7t h GLU 68 N 7.49 -0.15 -0.23 5.44 4.81 -1.86 -1.74 114.58 128.33 1u7t h GLU 68 Ca -0.35 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.89 1u7t h GLU 68 Cb 1.18 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.58 1u7t h GLU 68 CO 0.59 -0.10 0.15 0.87 -0.73 0.00 0.00 179.01 179.78 1u7t h LYS 69 N -0.16 0.29 -0.82 1.92 1.57 -1.94 0.19 116.57 117.62 1u7t h LYS 69 Ca 0.01 -0.02 0.03 0.00 -1.87 0.00 0.00 60.65 58.80 1u7t h LYS 69 Cb 0.17 -0.07 -0.05 0.00 0.08 0.00 0.00 32.23 32.37 1u7t h LYS 69 CO -0.04 0.19 0.53 -0.44 -0.57 0.00 0.00 179.45 179.12 1u7t h ASP 70 N 0.30 0.89 -0.22 0.86 5.19 -1.83 0.23 116.42 121.83 1u7t h ASP 70 Ca 0.08 -0.01 -0.17 0.00 -0.62 0.00 0.00 57.03 56.31 1u7t h ASP 70 Cb -0.03 -0.20 -0.00 0.00 0.18 0.00 0.00 39.33 39.27 1u7t h ASP 70 CO -0.02 0.62 -0.52 0.58 -3.12 0.00 0.00 179.24 176.78 1u7t h VAL 71 N 1.05 1.28 -0.45 -1.35 2.07 -0.88 0.67 116.25 118.64 1u7t h VAL 71 Ca 0.32 -1.71 0.03 0.00 0.82 0.00 0.00 66.70 66.16 1u7t h VAL 71 Cb -0.03 1.61 -0.03 0.00 -1.52 0.00 0.00 31.29 31.32 1u7t h VAL 71 CO -0.10 0.55 0.25 1.56 0.02 0.00 0.00 177.57 179.85 1u7t h GLN 72 N 0.62 0.49 -0.02 1.57 4.20 -0.11 0.15 115.11 122.01 1u7t h GLN 72 Ca 0.02 -0.03 0.01 0.00 0.06 0.00 0.00 58.65 58.71 1u7t h GLN 72 Cb 1.10 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.76 1u7t h GLN 72 CO 0.11 0.32 -0.04 1.15 -0.67 0.00 0.00 178.83 179.71 1u7t h THR 73 N 0.50 0.90 -0.22 -0.54 2.02 -0.30 -0.82 112.91 114.45 1u7t h THR 73 Ca 0.18 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.31 1u7t h THR 73 Cb 0.04 0.90 -0.01 0.00 -1.74 0.00 0.00 68.15 67.34 1u7t h THR 73 CO -0.10 0.00 -0.09 0.00 0.37 0.00 0.00 175.52 175.70 1u7t h ALA 74 N 0.96 1.45 -0.31 6.16 0.00 -0.43 -0.11 119.26 126.99 1u7t h ALA 74 Ca 0.02 -0.21 -0.16 0.00 0.00 0.00 0.00 54.91 54.56 1u7t h ALA 74 Cb 0.08 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 1u7t h ALA 74 CO -0.05 0.39 -0.44 -0.07 0.00 0.00 0.00 179.25 179.08 1u7t h LEU 75 N 0.33 0.92 -1.03 0.00 3.38 -0.28 -1.64 115.31 116.99 1u7t h LEU 75 Ca 0.07 -0.50 -0.02 0.00 0.09 0.00 0.00 57.88 57.52 1u7t h LEU 75 Cb 0.36 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.81 1u7t h LEU 75 CO 0.02 1.24 0.44 0.00 0.09 0.00 0.00 178.44 180.23 1u7t h ALA 76 N 0.70 1.26 -0.75 1.53 0.00 -0.71 0.79 119.26 122.08 1u7t h ALA 76 Ca 0.03 -0.12 0.07 0.00 0.00 0.00 0.00 54.91 54.90 1u7t h ALA 76 Cb 1.03 -0.32 -0.06 0.00 0.00 0.00 0.00 17.79 18.44 1u7t h ALA 76 CO 0.10 0.60 0.42 1.25 0.00 0.00 0.00 179.25 181.63 1u7t h LEU 77 N 1.12 0.62 -0.35 0.00 6.46 -0.87 -0.90 115.31 121.40 1u7t h LEU 77 Ca 0.28 0.04 -0.03 0.00 -0.12 0.00 0.00 57.88 58.05 1u7t h LEU 77 Cb 0.03 -0.08 -0.01 0.00 -0.73 0.00 0.00 40.66 39.86 1u7t h LEU 77 CO -0.05 0.38 0.09 0.00 -0.62 0.00 0.00 178.44 178.25 1u7t h ALA 78 N 1.40 0.45 -0.25 1.25 0.00 -0.09 -1.05 119.26 120.97 1u7t h ALA 78 Ca 0.35 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 55.09 1u7t h ALA 78 Cb 0.26 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 1u7t h ALA 78 CO -0.21 0.11 0.15 1.57 0.00 0.00 0.00 179.25 180.87 1u7t h LYS 79 N 0.40 0.30 -0.07 0.00 2.10 -0.43 0.32 116.57 119.19 1u7t h LYS 79 Ca 0.11 -0.02 -0.04 0.00 -2.00 0.00 0.00 60.65 58.70 1u7t h LYS 79 Cb 0.28 -0.07 -0.01 0.00 -0.90 0.00 0.00 32.23 31.53 1u7t h LYS 79 CO -0.00 0.20 -0.13 0.78 -2.00 0.00 0.00 179.45 178.29 1u7t h GLY 80 N 0.31 0.12 0.93 0.07 0.00 -1.06 1.44 103.07 104.88 1u7t h GLY 80 Ca 0.10 -0.07 -0.32 0.00 0.00 0.00 0.00 47.33 47.04 1u7t h GLY 80 CO -0.04 0.06 -1.75 1.70 0.00 0.00 0.00 176.54 176.51 1u7t h LYS 81 N 0.11 0.13 0.00 4.80 1.63 -0.70 -3.41 116.57 119.13 1u7t h LYS 81 Ca 0.02 -0.23 0.00 0.00 -0.85 0.00 0.00 60.65 59.59 1u7t h LYS 81 Cb 0.30 0.08 0.00 0.00 -0.60 0.00 0.00 32.23 32.02 1u7t h LYS 81 CO 0.02 0.86 0.00 1.19 -3.45 0.00 0.00 179.45 178.07 1u7t n PHE 82 N -3.27 0.00 0.00 1.91 3.72 0.06 -5.02 117.46 114.85 1u7t n PHE 82 Ca -0.21 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.19 1u7t n PHE 82 Cb 1.05 0.00 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 0.07 3.01 3.84 1.37 0.00 0.49 -4.93 105.19 109.04 1u7t n GLY 83 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.96 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 -0.14 1.69 -0.13 1.61 1.70 -1.26 -4.88 118.95 117.53 1u7t s ARG 84 Ca 0.00 -0.95 -0.00 0.00 -0.47 0.00 0.00 55.73 54.31 1u7t s ARG 84 Cb 0.00 0.57 0.03 0.00 -0.57 0.00 0.00 34.95 34.98 1u7t s ARG 84 CO 0.00 -0.77 -0.07 0.08 -1.08 0.00 0.00 175.30 173.46 1u7t s VAL 85 N -3.68 1.06 -0.17 4.99 1.01 -1.26 -4.72 120.40 117.61 1u7t s VAL 85 Ca 0.12 -0.42 0.17 0.00 0.00 0.00 0.00 61.98 61.85 1u7t s VAL 85 Cb -0.05 -1.14 -0.24 0.00 0.00 0.00 0.00 36.38 34.95 1u7t s VAL 85 CO 0.06 0.27 0.10 0.47 0.00 0.00 0.00 175.10 176.01 1u7t n ASP 86 N 4.92 0.30 -3.86 3.32 9.92 0.25 -4.39 116.55 127.02 1u7t n ASP 86 Ca -0.12 0.00 -0.13 0.00 -0.53 0.00 0.00 54.79 54.01 1u7t n ASP 86 Cb 0.49 1.06 -0.15 0.00 -0.64 0.00 0.00 41.12 41.89 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 -2.55 0.03 -0.06 2.53 1.01 -0.43 -1.63 120.40 119.31 1u7t s VAL 87 Ca -0.09 0.03 0.06 0.00 0.00 0.00 0.00 61.98 61.97 1u7t s VAL 87 Cb 0.06 -0.07 -0.01 0.00 0.00 0.00 0.00 36.38 36.37 1u7t s VAL 87 CO 0.79 0.03 -0.24 0.00 0.00 0.00 0.00 175.10 175.68 1u7t s ALA 88 N 0.25 2.10 -0.18 5.51 0.00 0.34 -0.34 121.76 129.44 1u7t s ALA 88 Ca -0.02 -1.01 -0.00 0.00 0.00 0.00 0.00 51.96 50.92 1u7t s ALA 88 Cb -0.03 -0.66 0.04 0.00 0.00 0.00 0.00 23.12 22.47 1u7t s ALA 88 CO -0.01 0.40 -0.06 0.08 0.00 0.00 0.00 175.76 176.18 1u7t s VAL 89 N -0.14 1.25 -0.44 0.00 1.01 0.36 -0.21 120.40 122.22 1u7t s VAL 89 Ca -0.04 -0.77 -0.21 0.00 0.00 0.00 0.00 61.98 60.96 1u7t s VAL 89 Cb -0.14 -1.43 0.02 0.00 0.00 0.00 0.00 36.38 34.84 1u7t s VAL 89 CO 0.04 0.10 0.68 0.20 0.00 0.00 0.00 175.10 176.11 1u7t s ASN 90 N 1.56 6.35 0.00 3.32 -0.87 -0.12 -0.60 114.94 124.58 1u7t s ASN 90 Ca -0.00 -0.28 0.00 0.00 -1.57 0.00 0.00 52.86 51.00 1u7t s ASN 90 Cb -0.16 -2.34 0.00 0.00 -0.02 0.00 0.00 41.25 38.74 1u7t s ASN 90 CO -0.08 -0.81 0.00 0.00 -2.57 0.00 0.00 177.10 173.64 1u7t n ALA 92 N -1.12 0.55 -3.60 0.00 0.00 -1.11 -4.69 120.51 110.54 1u7t n ALA 92 Ca 0.00 0.44 -0.05 0.00 0.00 0.00 0.00 53.44 53.83 1u7t n ALA 92 Cb 0.00 -2.28 -0.03 0.00 0.00 0.00 0.00 19.45 17.14 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 1.35 -0.22 0.24 0.00 0.00 -1.26 -4.74 107.32 102.68 1u7t s GLY 93 Ca 0.83 1.89 0.04 0.00 0.00 0.00 0.00 44.72 47.48 1u7t s GLY 93 CO 0.44 0.73 -0.01 -0.26 0.00 0.00 0.00 173.10 174.00 1u7t s ILE 94 N -1.95 1.10 0.06 0.90 -4.36 -1.26 -5.05 121.20 110.64 1u7t s ILE 94 Ca 0.07 -2.04 0.06 0.00 -0.26 0.00 0.00 60.65 58.48 1u7t s ILE 94 Cb -0.01 -2.36 -0.03 0.00 1.25 0.00 0.00 42.46 41.32 1u7t s ILE 94 CO -0.05 -0.32 -0.17 0.00 0.24 0.00 0.00 174.94 174.64 1u7t s ALA 95 N -3.38 1.45 0.02 2.27 0.00 -1.26 -4.94 121.76 115.92 1u7t s ALA 95 Ca 0.29 -1.02 -0.03 0.00 0.00 0.00 0.00 51.96 51.20 1u7t s ALA 95 Cb 0.05 -0.21 -0.01 0.00 0.00 0.00 0.00 23.12 22.95 1u7t s ALA 95 CO 0.09 0.28 0.04 0.14 0.00 0.00 0.00 175.76 176.31 1u7t s VAL 96 N -1.01 0.11 -0.21 0.00 -7.23 -1.26 -5.12 120.40 105.68 1u7t s VAL 96 Ca 0.03 -0.91 0.02 0.00 -1.81 0.00 0.00 61.98 59.30 1u7t s VAL 96 Cb -0.09 -0.47 0.04 0.00 0.56 0.00 0.00 36.38 36.41 1u7t s VAL 96 CO 0.02 -0.50 -0.16 0.00 -0.31 0.00 0.00 175.10 174.15 1u7t s ALA 97 N -1.73 2.37 -0.30 1.32 0.00 -1.26 -4.73 121.76 117.43 1u7t s ALA 97 Ca -0.13 -1.41 -0.13 0.00 0.00 0.00 0.00 51.96 50.29 1u7t s ALA 97 Cb -0.07 -1.34 0.14 0.00 0.00 0.00 0.00 23.12 21.85 1u7t s ALA 97 CO -0.01 -0.71 0.80 0.45 0.00 0.00 0.00 175.76 176.29 1u7t s SER 98 N 1.24 -0.89 0.43 0.00 0.15 -0.29 -5.04 113.70 109.30 1u7t s SER 98 Ca -0.01 1.24 -0.25 0.00 0.70 0.00 0.00 55.95 57.63 1u7t s SER 98 Cb -0.16 1.95 -0.08 0.00 -1.71 0.00 0.00 66.02 66.02 1u7t s SER 98 CO -0.10 -0.18 1.31 -0.54 1.20 0.00 0.00 173.24 174.94 1u7t s LYS 99 N 2.57 3.81 0.17 5.44 1.02 -1.26 -4.51 119.74 126.97 1u7t s LYS 99 Ca -0.05 2.16 -0.14 0.00 0.02 0.00 0.00 55.97 57.95 1u7t s LYS 99 Cb -0.09 -2.65 0.14 0.00 -0.52 0.00 0.00 37.83 34.71 1u7t s LYS 99 CO -0.18 -0.62 1.73 1.15 -0.92 0.00 0.00 175.35 176.50 1u7t h THR 100 N 2.26 0.79 -2.75 2.17 2.02 -1.93 -3.15 112.91 112.33 1u7t h THR 100 Ca -0.50 -0.09 -0.13 0.00 0.77 0.00 0.00 66.41 66.47 1u7t h THR 100 Cb 1.25 0.52 -0.26 0.00 -1.74 0.00 0.00 68.15 67.93 1u7t h THR 100 CO 0.61 0.05 -0.30 -0.47 0.37 0.00 0.00 175.52 175.78 1u7t s TYR 101 N -6.15 -0.50 -0.35 3.16 6.14 -1.26 -1.52 117.35 116.88 1u7t s TYR 101 Ca -0.13 1.13 0.03 0.00 0.64 0.00 0.00 57.07 58.74 1u7t s TYR 101 Cb 0.14 0.19 0.10 0.00 0.42 0.00 0.00 41.96 42.81 1u7t s TYR 101 CO 0.72 -0.27 0.06 1.21 0.64 0.00 0.00 175.55 177.91 1u7t s ASN 102 N 0.84 4.83 0.21 4.32 3.84 0.49 -4.97 114.94 124.50 1u7t s ASN 102 Ca -0.05 -2.09 -0.08 0.00 0.21 0.00 0.00 52.86 50.85 1u7t s ASN 102 Cb -0.06 -1.66 0.14 0.00 -0.55 0.00 0.00 41.25 39.12 1u7t s ASN 102 CO -0.06 -0.39 1.75 0.25 -2.79 0.00 0.00 177.10 175.86 1u7t h LEU 103 N 7.69 1.09 -0.69 3.21 5.85 -1.94 0.68 115.31 131.20 1u7t h LEU 103 Ca -0.06 -0.20 0.10 0.00 0.84 0.00 0.00 57.88 58.56 1u7t h LEU 103 Cb 1.03 -0.29 -0.07 0.00 0.37 0.00 0.00 40.66 41.70 1u7t h LEU 103 CO 0.54 1.00 0.32 0.11 -0.34 0.00 0.00 178.44 180.07 1u7t h LYS 104 N 1.13 0.53 -0.01 1.25 6.56 -1.95 -0.34 116.57 123.74 1u7t h LYS 104 Ca 0.25 -0.03 0.00 0.00 -1.06 0.00 0.00 60.65 59.81 1u7t h LYS 104 Cb 0.28 -0.12 0.00 0.00 -0.57 0.00 0.00 32.23 31.82 1u7t h LYS 104 CO -0.01 0.35 -0.42 1.63 -2.06 0.00 0.00 179.45 178.94 1u7t n LYS 105 N -4.90 0.93 -3.43 3.15 5.02 -1.13 -4.96 118.16 112.84 1u7t n LYS 105 Ca 0.11 -0.69 -0.24 0.00 -2.02 0.00 0.00 58.31 55.47 1u7t n LYS 105 Cb 0.29 -1.49 0.05 0.00 -0.02 0.00 0.00 35.03 33.86 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 1.40 -0.53 3.41 0.72 0.00 0.21 -4.97 105.19 105.41 1u7t n GLY 106 Ca 0.10 0.20 -0.31 0.00 0.00 0.00 0.00 46.02 46.01 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 -6.13 2.10 -0.10 1.61 -0.21 0.56 -4.94 119.66 112.55 1u7t s GLN 107 Ca 0.49 -0.95 0.03 0.00 0.02 0.00 0.00 55.36 54.96 1u7t s GLN 107 Cb -0.22 -2.15 -0.01 0.00 1.00 0.00 0.00 33.01 31.63 1u7t s GLN 107 CO 0.61 0.55 -0.19 0.99 -2.12 0.00 0.00 175.29 175.13 1u7t s THR 108 N -0.80 2.50 0.14 -0.19 2.01 -1.26 0.18 115.64 118.22 1u7t s THR 108 Ca 0.12 -0.88 -0.35 0.00 0.31 0.00 0.00 61.69 60.90 1u7t s THR 108 Cb -0.10 -1.99 -0.15 0.00 0.01 0.00 0.00 72.50 70.27 1u7t s THR 108 CO 0.02 0.55 1.42 1.57 -0.69 0.00 0.00 174.62 177.49 1u7t n HIS 109 N 3.26 1.83 -2.73 4.92 -0.00 -0.57 -4.93 115.22 116.99 1u7t n HIS 109 Ca -0.18 0.49 -0.34 0.00 0.46 0.00 0.00 57.72 58.15 1u7t n HIS 109 Cb 0.53 -2.42 -0.06 0.00 -0.12 0.00 0.00 29.99 27.92 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 0.53 4.18 0.21 3.57 -4.23 -1.26 -4.94 115.64 113.69 1u7t s THR 110 Ca 0.80 1.40 -0.09 0.00 -1.18 0.00 0.00 61.69 62.62 1u7t s THR 110 Cb -0.82 -3.59 0.16 0.00 1.34 0.00 0.00 72.50 69.59 1u7t s THR 110 CO 0.44 -0.25 1.83 0.25 -0.54 0.00 0.00 174.62 176.35 1u7t h LEU 111 N 1.93 0.98 -1.05 4.79 5.85 -2.00 -2.84 115.31 122.97 1u7t h LEU 111 Ca -0.49 -0.10 -0.10 0.00 0.84 0.00 0.00 57.88 58.03 1u7t h LEU 111 Cb 1.19 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.96 1u7t h LEU 111 CO 0.61 0.80 -0.46 -0.33 -0.34 0.00 0.00 178.44 178.71 1u7t h GLU 112 N 1.08 0.00 -0.58 1.25 4.39 -1.99 -0.10 114.58 118.64 1u7t h GLU 112 Ca 0.27 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.96 1u7t h GLU 112 Cb 0.04 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.66 1u7t h GLU 112 CO -0.04 0.46 0.28 -0.44 -1.16 0.00 0.00 179.01 178.12 1u7t h ASP 113 N 0.00 0.72 -0.12 1.42 5.19 -1.90 -0.48 116.42 121.25 1u7t h ASP 113 Ca -0.00 -0.07 -0.08 0.00 -0.62 0.00 0.00 57.03 56.26 1u7t h ASP 113 Cb 0.84 -0.18 0.00 0.00 0.18 0.00 0.00 39.33 40.17 1u7t h ASP 113 CO 0.06 0.61 -0.24 0.15 -3.12 0.00 0.00 179.24 176.70 1u7t h PHE 114 N 0.81 0.47 -0.74 4.55 3.04 -1.16 -3.16 116.94 120.75 1u7t h PHE 114 Ca 0.20 -0.17 -0.04 0.00 3.98 0.00 0.00 57.97 61.94 1u7t h PHE 114 Cb 0.07 -0.09 -0.03 0.00 2.56 0.00 0.00 35.95 38.46 1u7t h PHE 114 CO 0.01 0.85 0.30 0.37 -2.02 0.00 0.00 178.31 177.82 1u7t h GLN 115 N -0.05 1.10 -0.61 1.11 5.75 -0.81 -2.58 115.11 119.01 1u7t h GLN 115 Ca 0.00 -0.19 -0.04 0.00 -0.15 0.00 0.00 58.65 58.27 1u7t h GLN 115 Cb 0.83 -0.18 -0.03 0.00 1.07 0.00 0.00 27.48 29.17 1u7t h GLN 115 CO 0.05 0.89 0.22 0.00 -2.65 0.00 0.00 178.83 177.34 1u7t h ARG 116 N 1.06 0.93 -0.31 1.69 -0.00 -1.17 -0.72 114.38 115.86 1u7t h ARG 116 Ca 0.25 -0.18 -0.13 0.00 -0.50 0.00 0.00 59.98 59.41 1u7t h ARG 116 Cb 0.20 -0.14 -0.01 0.00 0.00 0.00 0.00 29.97 30.01 1u7t h ARG 116 CO -0.02 0.81 -0.35 0.28 0.00 0.00 0.00 179.97 180.68 1u7t h VAL 117 N 0.86 1.29 -0.16 2.04 2.07 -1.49 -1.65 116.25 119.21 1u7t h VAL 117 Ca 0.20 -1.51 -0.01 0.00 0.82 0.00 0.00 66.70 66.21 1u7t h VAL 117 Cb 0.25 1.43 -0.01 0.00 -1.52 0.00 0.00 31.29 31.43 1u7t h VAL 117 CO -0.01 0.49 0.07 -0.07 0.02 0.00 0.00 177.57 178.07 1u7t h LEU 118 N 0.59 0.22 -0.07 2.57 3.38 -1.31 -1.18 115.31 119.49 1u7t h LEU 118 Ca 0.06 -0.15 -0.00 0.00 0.09 0.00 0.00 57.88 57.87 1u7t h LEU 118 Cb 0.88 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.57 1u7t h LEU 118 CO 0.08 0.31 0.04 0.44 0.09 0.00 0.00 178.44 179.40 1u7t h ASP 119 N 0.12 0.10 0.08 -0.43 3.45 -0.99 0.11 116.42 118.85 1u7t h ASP 119 Ca 0.05 -0.12 -0.00 0.00 0.43 0.00 0.00 57.03 57.40 1u7t h ASP 119 Cb 0.16 -0.02 0.00 0.00 -0.56 0.00 0.00 39.33 38.90 1u7t h ASP 119 CO -0.01 0.18 -0.04 0.58 -1.57 0.00 0.00 179.24 178.39 1u7t h VAL 120 N 0.00 1.18 -0.15 -1.35 2.07 -1.35 0.14 116.25 116.79 1u7t h VAL 120 Ca 0.03 -1.32 -0.18 0.00 0.82 0.00 0.00 66.70 66.05 1u7t h VAL 120 Cb 0.11 1.99 0.01 0.00 -1.52 0.00 0.00 31.29 31.88 1u7t h VAL 120 CO -0.00 0.31 -0.62 0.78 0.02 0.00 0.00 177.57 178.05 1u7t h ASN 121 N -0.75 0.81 0.00 0.57 2.35 -1.25 -3.22 115.58 114.09 1u7t h ASN 121 Ca -0.01 -0.62 -0.06 0.00 -0.55 0.00 0.00 56.30 55.07 1u7t h ASN 121 Cb 0.58 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.71 1u7t h ASN 121 CO 0.02 1.30 -1.10 -0.11 -1.65 0.00 0.00 177.43 175.89 1u7t n LEU 122 N -4.08 1.84 -0.12 1.61 7.94 0.21 -3.81 117.00 120.60 1u7t n LEU 122 Ca -0.07 0.31 -0.09 0.00 -1.11 0.00 0.00 56.01 55.05 1u7t n LEU 122 Cb 0.66 -0.70 -0.01 0.00 0.53 0.00 0.00 43.42 43.90 1u7t n LEU 122 CO 0.50 -0.21 0.94 -0.03 -1.11 0.00 0.00 177.39 177.48 1u7t h MET 123 N -0.90 0.53 -0.77 1.96 4.05 -1.04 -1.31 114.93 117.45 1u7t h MET 123 Ca -0.08 -0.08 0.09 0.00 -0.28 0.00 0.00 59.70 59.35 1u7t h MET 123 Cb 0.99 -0.09 -0.07 0.00 -0.80 0.00 0.00 31.60 31.62 1u7t h MET 123 CO -0.05 0.47 0.43 0.78 0.23 0.00 0.00 176.91 178.77 1u7t h GLY 124 N 0.45 1.18 0.90 1.39 0.00 -0.73 0.55 103.07 106.82 1u7t h GLY 124 Ca 0.13 -0.28 -0.03 0.00 0.00 0.00 0.00 47.33 47.14 1u7t h GLY 124 CO -0.02 0.12 0.07 -0.84 0.00 0.00 0.00 176.54 175.87 1u7t h THR 125 N 0.73 1.23 -0.70 4.70 2.02 -1.57 -1.99 112.91 117.33 1u7t h THR 125 Ca 0.37 -0.78 -0.02 0.00 0.77 0.00 0.00 66.41 66.75 1u7t h THR 125 Cb 0.33 1.11 -0.03 0.00 -1.74 0.00 0.00 68.15 67.82 1u7t h THR 125 CO -0.24 0.26 0.34 0.15 0.37 0.00 0.00 175.52 176.40 1u7t h PHE 126 N 0.37 0.98 0.00 3.16 3.57 -0.46 -1.62 116.94 122.94 1u7t h PHE 126 Ca 0.10 -0.03 0.02 0.00 3.53 0.00 0.00 57.97 61.59 1u7t h PHE 126 Cb 0.32 -0.31 -0.03 0.00 2.79 0.00 0.00 35.95 38.72 1u7t h PHE 126 CO 0.02 0.71 -0.14 -0.97 -2.23 0.00 0.00 178.31 175.70 1u7t h ASN 127 N 0.99 -0.39 -0.21 0.41 -1.24 0.46 -0.53 115.58 115.06 1u7t h ASN 127 Ca 0.24 0.06 0.00 0.00 0.71 0.00 0.00 56.30 57.31 1u7t h ASN 127 Cb 0.09 0.17 -0.01 0.00 0.73 0.00 0.00 38.32 39.30 1u7t h ASN 127 CO -0.03 -0.19 0.13 0.58 -1.29 0.00 0.00 177.43 176.63 1u7t h VAL 128 N -0.23 1.07 -0.43 2.57 2.07 -1.19 -2.67 116.25 117.44 1u7t h VAL 128 Ca 0.05 -0.15 0.05 0.00 0.82 0.00 0.00 66.70 67.47 1u7t h VAL 128 Cb 0.29 0.79 -0.05 0.00 -1.52 0.00 0.00 31.29 30.80 1u7t h VAL 128 CO -0.13 0.07 0.17 0.40 0.02 0.00 0.00 177.57 178.09 1u7t h ILE 129 N 0.27 0.89 -0.41 4.57 2.04 -0.99 0.17 117.51 124.04 1u7t h ILE 129 Ca 0.08 -0.12 -0.09 0.00 1.00 0.00 0.00 64.86 65.72 1u7t h ILE 129 Cb -0.01 0.51 -0.02 0.00 -0.74 0.00 0.00 36.82 36.57 1u7t h ILE 129 CO -0.02 0.06 -0.13 0.08 0.00 0.00 0.00 178.15 178.15 1u7t h ARG 130 N 0.34 0.74 0.04 2.37 0.11 -1.02 -0.33 114.38 116.63 1u7t h ARG 130 Ca 0.20 -0.25 -0.15 0.00 0.10 0.00 0.00 59.98 59.89 1u7t h ARG 130 Cb 0.17 -0.06 0.01 0.00 1.11 0.00 0.00 29.97 31.21 1u7t h ARG 130 CO -0.19 0.83 -0.60 -0.07 0.10 0.00 0.00 179.97 180.04 1u7t h LEU 131 N 0.67 0.46 -1.43 0.08 3.38 -1.12 -3.22 115.31 114.13 1u7t h LEU 131 Ca 0.11 -0.82 -0.06 0.00 0.09 0.00 0.00 57.88 57.20 1u7t h LEU 131 Cb 0.59 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 1u7t h LEU 131 CO 0.04 1.23 -0.28 1.62 0.09 0.00 0.00 178.44 181.14 1u7t h VAL 132 N -0.25 0.97 -0.27 1.22 3.04 -0.62 -1.27 116.25 119.08 1u7t h VAL 132 Ca -0.09 -1.04 -0.01 0.00 -1.01 0.00 0.00 66.70 64.56 1u7t h VAL 132 Cb 1.36 1.60 -0.01 0.00 -2.01 0.00 0.00 31.29 32.22 1u7t h VAL 132 CO 0.12 0.27 0.14 0.00 -1.01 0.00 0.00 177.57 177.09 1u7t h ALA 133 N 1.72 1.73 -0.30 3.17 0.00 -1.09 -0.50 119.26 124.00 1u7t h ALA 133 Ca -0.00 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 54.78 1u7t h ALA 133 Cb 0.57 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 1u7t h ALA 133 CO 0.04 0.23 -0.15 0.78 0.00 0.00 0.00 179.25 180.14 1u7t h GLY 134 N 0.46 0.56 1.44 0.00 0.00 -1.25 -1.63 103.07 102.65 1u7t h GLY 134 Ca 0.10 -0.41 -0.28 0.00 0.00 0.00 0.00 47.33 46.74 1u7t h GLY 134 CO -0.02 0.38 -1.19 0.83 0.00 0.00 0.00 176.54 176.54 1u7t h GLU 135 N 0.48 0.46 0.00 4.80 4.39 -0.96 -3.20 114.58 120.54 1u7t h GLU 135 Ca 0.08 -0.63 -0.08 0.00 0.34 0.00 0.00 59.36 59.07 1u7t h GLU 135 Cb 0.54 0.21 -0.01 0.00 -0.10 0.00 0.00 28.75 29.39 1u7t h GLU 135 CO 0.03 1.27 -0.37 0.52 -1.16 0.00 0.00 179.01 179.30 1u7t h MET 136 N 0.19 0.00 0.00 2.33 2.86 -1.18 -2.74 114.93 116.39 1u7t h MET 136 Ca -0.15 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.48 1u7t h MET 136 Cb 1.87 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 33.53 1u7t h MET 136 CO 0.21 0.37 -0.02 0.78 1.06 0.00 0.00 176.91 179.31 1u7t h GLY 137 N 1.57 0.00 2.00 8.32 0.00 -1.29 -1.17 103.07 112.50 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 0.05 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.20 1u7t n GLN 138 N -4.19 0.20 -2.71 4.80 10.64 -1.03 -4.78 117.38 120.31 1u7t n GLN 138 Ca -0.03 0.30 -0.38 0.00 -1.83 0.00 0.00 57.00 55.06 1u7t n GLN 138 Cb 0.11 -1.80 -0.06 0.00 -0.86 0.00 0.00 30.24 27.63 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 -4.21 7.35 0.28 2.61 0.01 -0.44 -5.02 114.94 115.51 1u7t s ASN 139 Ca 0.08 1.94 -0.29 0.00 -0.71 0.00 0.00 52.86 53.88 1u7t s ASN 139 Cb 0.11 -2.59 -0.10 0.00 0.41 0.00 0.00 41.25 39.08 1u7t s ASN 139 CO 0.48 -0.06 1.23 -1.83 -1.51 0.00 0.00 177.10 175.41 1u7t s GLU 140 N -1.78 4.47 0.52 -0.60 -1.05 -1.26 -4.91 118.70 114.09 1u7t s GLU 140 Ca 0.48 2.02 -0.23 0.00 -0.15 0.00 0.00 54.97 57.09 1u7t s GLU 140 Cb -0.23 -3.15 -0.06 0.00 -0.44 0.00 0.00 34.13 30.25 1u7t s GLU 140 CO 0.29 -0.06 1.32 -2.30 0.95 0.00 0.00 175.26 175.46 1u7t n PRO 141 N 1.44 1.73 -0.03 -4.83 -0.02 -1.26 -4.85 135.00 127.18 1u7t n PRO 141 Ca 0.01 0.63 -0.00 0.00 -2.02 0.00 0.00 63.50 62.12 1u7t n PRO 141 Cb 0.43 -2.51 0.00 0.00 -0.02 0.00 0.00 33.50 31.40 1u7t n PRO 141 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1u7t n ASP 142 N -0.66 -0.28 0.07 2.55 5.68 -0.38 -4.78 116.55 118.75 1u7t n ASP 142 Ca 0.09 -0.87 0.17 0.00 -0.50 0.00 0.00 54.79 53.68 1u7t n ASP 142 Cb 0.43 -0.02 0.67 0.00 -1.14 0.00 0.00 41.12 41.07 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 0.01 -0.65 0.11 -0.00 -1.95 0.24 115.11 112.87 1u7t h GLN 143 Ca -0.01 -0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.64 1u7t h GLN 143 Cb 0.02 -0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.50 1u7t h GLN 143 CO 0.00 0.01 0.00 0.41 -0.00 0.00 0.00 178.83 179.25 1u7t n GLY 144 N -1.61 2.58 2.32 0.06 0.00 -1.26 -4.91 105.19 102.36 1u7t n GLY 144 Ca 0.06 -0.81 -0.00 0.00 0.00 0.00 0.00 46.02 45.27 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 1.11 0.34 3.74 -0.02 0.00 0.07 -5.00 105.19 105.44 1u7t n GLY 145 Ca 0.25 -0.00 -0.40 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 -0.64 4.53 -0.01 1.61 0.74 -1.26 -4.29 119.66 120.35 1u7t s GLN 146 Ca 0.00 1.13 0.13 0.00 0.05 0.00 0.00 55.36 56.67 1u7t s GLN 146 Cb 0.00 -3.36 -0.18 0.00 1.10 0.00 0.00 33.01 30.57 1u7t s GLN 146 CO 0.00 0.29 0.35 0.54 -0.55 0.00 0.00 175.29 175.92 1u7t n ARG 147 N 2.74 1.04 0.00 1.67 1.74 0.31 -1.25 116.66 122.92 1u7t n ARG 147 Ca -0.02 -0.09 0.00 0.00 -0.77 0.00 0.00 57.85 56.97 1u7t n ARG 147 Cb 0.50 -1.25 0.00 0.00 -1.02 0.00 0.00 32.46 30.69 1u7t n ARG 147 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1u7t n GLY 148 N 1.64 0.80 3.00 -0.13 0.00 -1.17 -4.80 105.19 104.53 1u7t n GLY 148 Ca -0.01 -0.94 -0.23 0.00 0.00 0.00 0.00 46.02 44.84 1u7t n GLY 148 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1u7t s VAL 149 N -2.00 0.98 -0.15 1.61 1.01 -0.64 -1.45 120.40 119.76 1u7t s VAL 149 Ca 0.00 -0.40 0.01 0.00 0.00 0.00 0.00 61.98 61.59 1u7t s VAL 149 Cb 0.00 -0.90 -0.00 0.00 0.00 0.00 0.00 36.38 35.48 1u7t s VAL 149 CO 0.00 0.32 -0.16 -0.63 0.00 0.00 0.00 175.10 174.62 1u7t s ILE 150 N 0.62 2.57 -0.14 2.22 1.01 0.65 -0.50 121.20 127.62 1u7t s ILE 150 Ca -0.12 -0.81 0.01 0.00 0.00 0.00 0.00 60.65 59.73 1u7t s ILE 150 Cb -0.14 -2.07 0.02 0.00 0.01 0.00 0.00 42.46 40.27 1u7t s ILE 150 CO 0.03 0.52 -0.15 -0.63 0.00 0.00 0.00 174.94 174.71 1u7t s ILE 151 N 0.80 1.59 0.28 2.92 1.01 0.70 -0.16 121.20 128.35 1u7t s ILE 151 Ca -0.06 -0.66 0.07 0.00 0.00 0.00 0.00 60.65 60.00 1u7t s ILE 151 Cb -0.15 -1.48 -0.03 0.00 0.01 0.00 0.00 42.46 40.81 1u7t s ILE 151 CO -0.00 0.46 0.27 0.20 0.00 0.00 0.00 174.94 175.87 1u7t s ASN 152 N 1.32 5.63 -0.27 3.58 -0.87 0.10 -0.94 114.94 123.49 1u7t s ASN 152 Ca 0.01 -0.26 -0.00 0.00 -1.57 0.00 0.00 52.86 51.04 1u7t s ASN 152 Cb -0.13 -1.34 0.04 0.00 -0.02 0.00 0.00 41.25 39.80 1u7t s ASN 152 CO -0.08 -0.17 -0.06 -0.89 -2.57 0.00 0.00 177.10 173.34 1u7t s THR 153 N -2.16 2.70 0.00 1.60 2.01 -1.04 -1.21 115.64 117.53 1u7t s THR 153 Ca 0.36 -1.33 0.00 0.00 0.31 0.00 0.00 61.69 61.03 1u7t s THR 153 Cb -0.08 -2.49 0.00 0.00 0.01 0.00 0.00 72.50 69.94 1u7t s THR 153 CO 0.27 0.03 0.00 0.00 -0.69 0.00 0.00 174.62 174.22 1u7t n ALA 154 N 4.58 0.00 -3.64 7.40 0.00 0.03 -4.97 120.51 123.91 1u7t n ALA 154 Ca -0.15 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.28 1u7t n ALA 154 Cb 0.44 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.86 1u7t n ALA 154 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1u7t s SER 155 N -1.00 -0.02 0.39 0.00 0.15 -1.26 -4.49 113.70 107.46 1u7t s SER 155 Ca 0.00 0.02 0.27 0.00 0.70 0.00 0.00 55.95 56.94 1u7t s SER 155 Cb 0.00 0.02 1.36 0.00 -1.71 0.00 0.00 66.02 65.69 1u7t s SER 155 CO 0.00 -0.02 1.82 -0.37 1.20 0.00 0.00 173.24 175.87 1u7t h VAL 156 N 2.03 0.00 -0.03 4.45 -1.51 -1.64 -0.07 116.25 119.48 1u7t h VAL 156 Ca -0.06 -0.10 0.01 0.00 -1.23 0.00 0.00 66.70 65.32 1u7t h VAL 156 Cb 1.17 0.77 -0.00 0.00 -2.13 0.00 0.00 31.29 31.10 1u7t h VAL 156 CO 0.21 0.00 0.25 0.00 -1.23 0.00 0.00 177.57 176.79 1u7t h ALA 157 N 2.06 1.32 0.00 5.19 0.00 -1.86 0.12 119.26 126.09 1u7t h ALA 157 Ca 0.00 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 1u7t h ALA 157 Cb 0.13 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 1u7t h ALA 157 CO 0.00 -0.26 -0.07 0.00 0.00 0.00 0.00 179.25 178.92 1u7t h ALA 158 N 1.54 1.57 0.00 0.00 0.00 -1.25 -2.89 119.26 118.23 1u7t h ALA 158 Ca 0.01 -0.07 -0.17 0.00 0.00 0.00 0.00 54.91 54.69 1u7t h ALA 158 Cb 0.51 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.25 1u7t h ALA 158 CO -0.00 0.09 -1.62 1.19 0.00 0.00 0.00 179.25 178.91 1u7t n PHE 159 N -4.01 0.00 -2.95 0.00 3.01 0.31 -4.73 117.46 109.10 1u7t n PHE 159 Ca -0.03 0.00 -0.18 0.00 1.01 0.00 0.00 57.45 58.25 1u7t n PHE 159 Cb 0.16 -0.43 -0.01 0.00 -0.01 0.00 0.00 39.48 39.18 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 -2.58 1.62 -1.64 -1.08 4.71 -0.59 -5.11 120.64 115.98 1u7t n GLU 160 Ca -0.17 -3.70 -0.46 0.00 -0.01 0.00 0.00 57.16 52.82 1u7t n GLU 160 Cb 0.75 -1.73 -0.03 0.00 -1.01 0.00 0.00 31.44 29.42 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 0.03 0.58 3.92 0.62 0.00 -1.09 -4.63 105.19 104.62 1u7t n GLY 161 Ca 0.23 0.52 -0.26 0.00 0.00 0.00 0.00 46.02 46.51 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 -0.31 2.25 0.19 1.61 -0.21 -1.26 -4.91 119.66 117.02 1u7t s GLN 162 Ca 0.70 -0.15 -0.33 0.00 0.02 0.00 0.00 55.36 55.60 1u7t s GLN 162 Cb -0.72 -2.14 -0.13 0.00 1.00 0.00 0.00 33.01 31.02 1u7t s GLN 162 CO 0.50 -1.23 1.57 0.28 -2.12 0.00 0.00 175.29 174.28 1u7t n VAL 163 N -2.95 0.25 -0.08 1.09 0.31 -1.26 -1.23 118.33 114.45 1u7t n VAL 163 Ca 0.08 -0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.34 1u7t n VAL 163 Cb 0.60 -1.61 0.00 0.00 -0.91 0.00 0.00 33.84 31.92 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 3.16 1.10 1.46 2.92 0.00 -1.26 -4.94 105.19 107.63 1u7t n GLY 164 Ca 0.15 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.25 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 3.87 -0.01 1.61 6.02 -0.37 -1.14 117.38 125.37 1u7t n GLN 165 Ca 0.00 -2.91 -0.09 0.00 -0.01 0.00 0.00 57.00 53.99 1u7t n GLN 165 Cb 0.00 -1.95 -0.03 0.00 1.02 0.00 0.00 30.24 29.28 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 3.40 -0.04 -0.06 -1.58 0.00 -1.80 0.21 119.26 119.38 1u7t h ALA 166 Ca 0.00 0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1u7t h ALA 166 Cb 1.57 0.28 -0.00 0.00 0.00 0.00 0.00 17.79 19.64 1u7t h ALA 166 CO 0.30 -0.58 0.02 0.00 0.00 0.00 0.00 179.25 178.98 1u7t h ALA 167 N 0.92 0.08 -0.51 0.00 0.00 -1.87 -0.73 119.26 117.14 1u7t h ALA 167 Ca 0.09 -0.11 0.07 0.00 0.00 0.00 0.00 54.91 54.96 1u7t h ALA 167 Cb 0.30 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.01 1u7t h ALA 167 CO -0.23 -0.32 0.18 -0.92 0.00 0.00 0.00 179.25 177.96 1u7t h TYR 168 N -0.10 0.32 -0.90 0.00 3.20 -1.84 -0.91 116.97 116.74 1u7t h TYR 168 Ca 0.02 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 61.91 1u7t h TYR 168 Cb 0.21 -0.07 -0.04 0.00 1.54 0.00 0.00 36.73 38.37 1u7t h TYR 168 CO -0.00 0.10 0.54 0.77 -1.64 0.00 0.00 178.16 177.93 1u7t h SER 169 N 0.36 1.08 -0.53 -2.11 0.02 -0.36 -0.87 113.55 111.13 1u7t h SER 169 Ca 0.25 -0.06 -0.02 0.00 -0.84 0.00 0.00 61.79 61.11 1u7t h SER 169 Cb 0.26 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 62.51 1u7t h SER 169 CO -0.25 0.83 0.26 0.00 -1.14 0.00 0.00 176.83 176.52 1u7t h ALA 170 N 1.36 0.69 -0.46 3.77 0.00 -0.33 0.15 119.26 124.44 1u7t h ALA 170 Ca 0.32 -0.13 -0.12 0.00 0.00 0.00 0.00 54.91 54.98 1u7t h ALA 170 Cb -0.05 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 1u7t h ALA 170 CO -0.06 0.25 -0.20 0.66 0.00 0.00 0.00 179.25 179.90 1u7t h SER 171 N 0.72 0.94 1.12 0.00 4.64 -0.58 -1.88 113.55 118.50 1u7t h SER 171 Ca 0.18 -0.34 -0.18 0.00 -0.47 0.00 0.00 61.79 60.98 1u7t h SER 171 Cb 0.12 -0.26 -0.03 0.00 -0.31 0.00 0.00 62.40 61.93 1u7t h SER 171 CO -0.02 1.11 -0.90 0.11 -0.87 0.00 0.00 176.83 176.25 1u7t h LYS 172 N 0.80 0.00 -0.33 4.77 1.79 -0.98 -2.67 116.57 119.95 1u7t h LYS 172 Ca 0.11 0.00 -0.07 0.00 -2.18 0.00 0.00 60.65 58.51 1u7t h LYS 172 Cb 0.76 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.39 1u7t h LYS 172 CO 0.06 0.74 -0.09 0.78 -1.08 0.00 0.00 179.45 179.86 1u7t h GLY 173 N 3.26 0.60 0.96 3.86 0.00 -0.65 -1.06 103.07 110.04 1u7t h GLY 173 Ca -0.04 -0.41 -0.01 0.00 0.00 0.00 0.00 47.33 46.87 1u7t h GLY 173 CO 0.10 0.38 0.21 -1.33 0.00 0.00 0.00 176.54 175.90 1u7t h GLY 174 N 0.92 0.63 0.74 4.60 0.00 -1.23 0.16 103.07 108.90 1u7t h GLY 174 Ca 0.10 -0.30 0.02 0.00 0.00 0.00 0.00 47.33 47.15 1u7t h GLY 174 CO 0.03 0.29 -0.08 -2.22 0.00 0.00 0.00 176.54 174.55 1u7t h ILE 175 N 0.54 0.78 -0.09 2.60 1.08 -1.09 -1.12 117.51 120.20 1u7t h ILE 175 Ca 0.15 0.00 0.03 0.00 -0.39 0.00 0.00 64.86 64.64 1u7t h ILE 175 Cb 0.09 0.78 -0.03 0.00 -3.07 0.00 0.00 36.82 34.59 1u7t h ILE 175 CO -0.02 0.00 -0.08 0.58 -0.69 0.00 0.00 178.15 177.94 1u7t h VAL 176 N -0.12 0.76 -0.51 1.67 2.07 -0.97 -2.58 116.25 116.56 1u7t h VAL 176 Ca 0.05 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.65 1u7t h VAL 176 Cb 0.19 0.76 -0.07 0.00 -1.52 0.00 0.00 31.29 30.64 1u7t h VAL 176 CO -0.11 0.00 0.12 1.23 0.02 0.00 0.00 177.57 178.82 1u7t h GLY 177 N -0.10 0.64 0.57 2.17 0.00 -0.29 -2.38 103.07 103.67 1u7t h GLY 177 Ca 0.07 -0.04 0.00 0.00 0.00 0.00 0.00 47.33 47.36 1u7t h GLY 177 CO -0.16 -0.06 -0.03 1.15 0.00 0.00 0.00 176.54 177.45 1u7t n MET 178 N -5.10 1.10 -0.08 4.80 0.00 -0.46 -3.95 117.12 113.44 1u7t n MET 178 Ca 0.06 -0.34 -0.08 0.00 0.00 0.00 0.00 57.70 57.35 1u7t n MET 178 Cb 0.25 -1.49 -0.01 0.00 0.00 0.00 0.00 33.22 31.97 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 0.82 0.97 0.09 3.17 2.02 -1.04 -2.26 112.91 116.69 1u7t h THR 179 Ca 0.00 -0.10 -0.00 0.00 0.77 0.00 0.00 66.41 67.08 1u7t h THR 179 Cb 0.24 0.66 0.00 0.00 -1.74 0.00 0.00 68.15 67.31 1u7t h THR 179 CO 0.00 0.05 -0.04 0.25 0.37 0.00 0.00 175.52 176.15 1u7t h LEU 180 N 0.28 -0.11 -0.99 2.58 5.85 -1.77 -1.98 115.31 119.18 1u7t h LEU 180 Ca 0.12 -0.46 0.14 0.00 0.84 0.00 0.00 57.88 58.52 1u7t h LEU 180 Cb 0.06 0.03 -0.09 0.00 0.37 0.00 0.00 40.66 41.03 1u7t h LEU 180 CO -0.10 0.46 0.61 1.55 -0.34 0.00 0.00 178.44 180.62 1u7t h PRO 181 N -0.73 0.90 -0.29 5.25 0.13 -1.78 0.25 132.00 135.73 1u7t h PRO 181 Ca -0.01 -0.05 -0.08 0.00 -0.87 0.00 0.00 66.00 64.98 1u7t h PRO 181 Cb 0.56 -0.20 -0.01 0.00 0.13 0.00 0.00 31.00 31.48 1u7t h PRO 181 CO 0.02 0.59 -0.13 0.82 -0.23 0.00 0.00 178.00 179.08 1u7t h ILE 182 N 0.92 1.29 -0.66 -3.56 2.04 -1.40 0.34 117.51 116.49 1u7t h ILE 182 Ca 0.51 -1.21 0.12 0.00 1.00 0.00 0.00 64.86 65.28 1u7t h ILE 182 Cb 0.58 1.47 -0.09 0.00 -0.74 0.00 0.00 36.82 38.04 1u7t h ILE 182 CO -0.30 0.39 0.21 0.00 0.00 0.00 0.00 178.15 178.45 1u7t h ALA 183 N 0.76 0.86 -0.40 1.87 0.00 -0.54 -0.95 119.26 120.86 1u7t h ALA 183 Ca 0.07 0.11 -0.12 0.00 0.00 0.00 0.00 54.91 54.97 1u7t h ALA 183 Cb 0.64 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 1u7t h ALA 183 CO 0.04 -0.24 -0.24 0.00 0.00 0.00 0.00 179.25 178.81 1u7t h ARG 184 N 0.36 0.81 -0.38 0.00 3.08 0.03 0.14 114.38 118.42 1u7t h ARG 184 Ca 0.35 -0.34 0.06 0.00 0.07 0.00 0.00 59.98 60.12 1u7t h ARG 184 Cb 0.51 -0.03 -0.05 0.00 0.08 0.00 0.00 29.97 30.47 1u7t h ARG 184 CO -0.38 0.96 0.06 -0.44 -1.07 0.00 0.00 179.97 179.10 1u7t h ASP 185 N 0.70 -0.03 0.13 7.04 3.45 0.53 -3.00 116.42 125.24 1u7t h ASP 185 Ca 0.09 0.07 0.00 0.00 0.43 0.00 0.00 57.03 57.62 1u7t h ASP 185 Cb 0.76 0.10 0.00 0.00 -0.56 0.00 0.00 39.33 39.64 1u7t h ASP 185 CO 0.06 0.02 -0.37 0.18 -1.57 0.00 0.00 179.24 177.56 1u7t n LEU 186 N -5.12 1.44 -0.18 1.55 4.77 -0.44 -4.38 117.00 114.63 1u7t n LEU 186 Ca 0.02 -0.47 -0.01 0.00 -0.03 0.00 0.00 56.01 55.52 1u7t n LEU 186 Cb 0.18 -0.07 0.09 0.00 -2.33 0.00 0.00 43.42 41.29 1u7t n LEU 186 CO 0.23 0.27 0.90 0.00 -1.33 0.00 0.00 177.39 177.46 1u7t h ALA 187 N 3.74 0.62 0.00 -1.18 0.00 -0.56 -0.77 119.26 121.11 1u7t h ALA 187 Ca 0.00 0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1u7t h ALA 187 Cb 0.61 0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.59 1u7t h ALA 187 CO 0.00 -0.33 0.00 -2.30 0.00 0.00 0.00 179.25 176.62 1u7t n PRO 188 N -5.15 0.04 -0.10 0.00 -0.02 -1.26 -2.01 135.00 126.49 1u7t n PRO 188 Ca 0.07 0.31 0.04 0.00 -2.02 0.00 0.00 63.50 61.90 1u7t n PRO 188 Cb 0.29 -1.50 0.09 0.00 -0.02 0.00 0.00 33.50 32.36 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 -1.44 0.83 -1.84 4.25 -5.35 -0.33 -4.99 119.36 110.48 1u7t n ILE 189 Ca 0.03 -0.91 0.00 0.00 -0.27 0.00 0.00 62.75 61.59 1u7t n ILE 189 Cb 0.09 0.62 0.00 0.00 -1.74 0.00 0.00 39.64 38.61 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 0.24 0.43 3.37 3.28 0.00 -0.85 -4.20 105.19 107.45 1u7t n GLY 190 Ca 0.07 -0.88 -0.36 0.00 0.00 0.00 0.00 46.02 44.86 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 -2.00 3.89 0.35 -0.61 1.01 -1.07 -0.53 121.20 122.24 1u7t s ILE 191 Ca 0.00 -0.46 -0.23 0.00 0.00 0.00 0.00 60.65 59.96 1u7t s ILE 191 Cb 0.00 -2.87 -0.10 0.00 0.01 0.00 0.00 42.46 39.50 1u7t s ILE 191 CO 0.00 0.27 0.92 -0.13 0.00 0.00 0.00 174.94 176.00 1u7t s ARG 192 N 1.53 4.41 -0.13 2.79 0.52 -0.53 -4.36 118.95 123.18 1u7t s ARG 192 Ca 0.05 1.19 0.01 0.00 -0.52 0.00 0.00 55.73 56.46 1u7t s ARG 192 Cb -0.16 -2.57 0.02 0.00 0.52 0.00 0.00 34.95 32.76 1u7t s ARG 192 CO 0.01 0.17 -0.13 0.08 0.02 0.00 0.00 175.30 175.45 1u7t s VAL 193 N -1.82 1.44 0.13 3.52 1.01 -1.26 -0.25 120.40 123.16 1u7t s VAL 193 Ca 0.54 -0.57 0.04 0.00 0.00 0.00 0.00 61.98 61.98 1u7t s VAL 193 Cb -0.15 -1.36 -0.04 0.00 0.00 0.00 0.00 36.38 34.83 1u7t s VAL 193 CO 0.19 0.43 -0.09 -0.04 0.00 0.00 0.00 175.10 175.60 1u7t s MET 194 N 1.34 0.97 -0.01 2.72 -1.94 0.77 -0.85 119.30 122.31 1u7t s MET 194 Ca 0.01 -1.37 -0.00 0.00 -1.71 0.00 0.00 55.69 52.62 1u7t s MET 194 Cb -0.13 -0.51 0.01 0.00 2.01 0.00 0.00 34.83 36.20 1u7t s MET 194 CO -0.07 0.06 0.01 0.99 -0.01 0.00 0.00 175.02 176.00 1u7t s THR 195 N -3.21 -0.01 -0.12 2.05 2.01 -0.75 0.03 115.64 115.65 1u7t s THR 195 Ca 0.13 0.05 -0.01 0.00 0.31 0.00 0.00 61.69 62.17 1u7t s THR 195 Cb 0.02 -0.03 -0.03 0.00 0.01 0.00 0.00 72.50 72.47 1u7t s THR 195 CO -0.01 0.02 -0.06 -0.63 -0.69 0.00 0.00 174.62 173.25 1u7t s ILE 196 N 0.25 3.74 -0.58 1.82 1.01 -0.35 -0.57 121.20 126.51 1u7t s ILE 196 Ca -0.02 -0.43 -0.04 0.00 0.00 0.00 0.00 60.65 60.15 1u7t s ILE 196 Cb -0.03 -2.59 0.15 0.00 0.01 0.00 0.00 42.46 40.01 1u7t s ILE 196 CO -0.01 0.54 0.41 0.00 0.00 0.00 0.00 174.94 175.89 1u7t s ALA 197 N -0.13 3.52 0.47 9.38 0.00 0.95 -0.79 121.76 135.16 1u7t s ALA 197 Ca 0.02 -3.06 -0.21 0.00 0.00 0.00 0.00 51.96 48.71 1u7t s ALA 197 Cb -0.13 -2.70 -0.08 0.00 0.00 0.00 0.00 23.12 20.21 1u7t s ALA 197 CO 0.03 -2.04 1.08 -2.14 0.00 0.00 0.00 175.76 172.69 1u7t s PRO 198 N 0.33 3.78 0.00 0.00 0.02 -1.26 -1.94 135.00 135.93 1u7t s PRO 198 Ca 0.14 1.51 0.00 0.00 0.02 0.00 0.00 61.00 62.67 1u7t s PRO 198 Cb -0.20 -2.22 0.00 0.00 0.02 0.00 0.00 34.50 32.09 1u7t s PRO 198 CO -0.04 -0.47 0.00 0.41 -0.33 0.00 0.00 177.00 176.57 1u7t n GLY 199 N 0.08 1.62 3.07 0.52 0.00 -0.46 -2.28 105.19 107.74 1u7t n GLY 199 Ca 0.08 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.81 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 1.81 0.02 0.99 1.43 -1.26 -4.77 118.68 116.90 1u7t s LEU 200 Ca 0.00 -0.49 0.04 0.00 -1.03 0.00 0.00 54.13 52.65 1u7t s LEU 200 Cb 0.00 -1.21 -0.02 0.00 0.03 0.00 0.00 46.19 45.00 1u7t s LEU 200 CO 0.00 0.01 -0.12 -0.36 0.23 0.00 0.00 176.35 176.11 1u7t s PHE 201 N 1.11 1.03 -1.05 0.29 0.40 -1.26 0.34 117.98 118.84 1u7t s PHE 201 Ca -0.03 -0.29 -0.23 0.00 -0.60 0.00 0.00 56.93 55.78 1u7t s PHE 201 Cb -0.14 -0.63 -0.04 0.00 0.51 0.00 0.00 43.02 42.72 1u7t s PHE 201 CO -0.05 0.00 1.85 0.20 0.70 0.00 0.00 175.22 177.93 1u7t s GLY 202 N -0.81 0.46 0.28 4.36 0.00 -0.55 -4.83 107.32 106.23 1u7t s GLY 202 Ca 0.01 -1.96 0.02 0.00 0.00 0.00 0.00 44.72 42.79 1u7t s GLY 202 CO 0.00 3.33 0.09 -0.51 0.00 0.00 0.00 173.10 176.01 1u7t s THR 203 N 9.13 0.72 -0.59 0.90 -4.23 -1.26 -4.65 115.64 115.65 1u7t s THR 203 Ca 0.65 -2.00 0.13 0.00 -1.18 0.00 0.00 61.69 59.29 1u7t s THR 203 Cb -0.03 -2.68 0.13 0.00 1.34 0.00 0.00 72.50 71.26 1u7t s THR 203 CO 0.03 0.00 1.40 -2.65 -0.54 0.00 0.00 174.62 172.87 1u7t n PRO 204 N -0.52 0.08 -0.34 3.99 -0.02 -1.26 -2.85 135.00 134.08 1u7t n PRO 204 Ca -0.01 0.53 0.07 0.00 -2.02 0.00 0.00 63.50 62.08 1u7t n PRO 204 Cb 0.66 -1.74 0.24 0.00 -0.02 0.00 0.00 33.50 32.64 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 0.81 -0.32 2.45 5.85 -1.95 -2.06 115.31 120.09 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 0.06 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 40.99 1u7t h LEU 205 CO 0.00 0.40 -0.18 0.18 -0.34 0.00 0.00 178.44 178.51 1u7t n LEU 206 N -4.70 0.67 -0.18 2.25 4.77 -1.13 -4.34 117.00 114.33 1u7t n LEU 206 Ca 0.18 -0.08 -0.02 0.00 -0.03 0.00 0.00 56.01 56.06 1u7t n LEU 206 Cb 0.38 -0.17 0.08 0.00 -2.33 0.00 0.00 43.42 41.38 1u7t n LEU 206 CO 0.25 0.13 1.01 0.74 -1.33 0.00 0.00 177.39 178.19 1u7t h THR 207 N 0.78 0.88 0.00 -5.08 2.02 -1.50 -1.34 112.91 108.67 1u7t h THR 207 Ca 0.00 -0.16 0.00 0.00 0.77 0.00 0.00 66.41 67.02 1u7t h THR 207 Cb 0.42 0.37 0.00 0.00 -1.74 0.00 0.00 68.15 67.20 1u7t h THR 207 CO 0.00 0.08 0.00 -1.54 0.37 0.00 0.00 175.52 174.43 1u7t n SER 208 N -4.93 0.00 -4.88 4.18 3.41 -1.26 -4.70 113.62 105.45 1u7t n SER 208 Ca 0.06 -0.46 -0.30 0.00 -0.26 0.00 0.00 58.87 57.91 1u7t n SER 208 Cb 0.20 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.11 1u7t n SER 208 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1u7t s LEU 209 N -1.80 3.95 0.32 1.04 1.43 -0.51 -5.02 118.68 118.09 1u7t s LEU 209 Ca 0.15 1.04 -0.29 0.00 -1.03 0.00 0.00 54.13 54.00 1u7t s LEU 209 Cb 0.07 -3.88 -0.11 0.00 0.03 0.00 0.00 46.19 42.29 1u7t s LEU 209 CO 0.11 -0.29 1.52 -2.84 0.23 0.00 0.00 176.35 175.08 1u7t s PRO 210 N -3.56 4.14 0.44 1.29 0.02 -1.26 -4.86 135.00 131.22 1u7t s PRO 210 Ca 0.50 2.53 0.26 0.00 0.02 0.00 0.00 61.00 64.31 1u7t s PRO 210 Cb -0.10 -3.01 1.30 0.00 0.02 0.00 0.00 34.50 32.70 1u7t s PRO 210 CO 0.28 -0.55 1.73 1.49 -0.33 0.00 0.00 177.00 179.61 1u7t h GLU 211 N 4.07 0.22 0.27 5.54 4.57 -1.94 -1.17 114.58 126.13 1u7t h GLU 211 Ca -0.48 -0.01 -0.01 0.00 -1.18 0.00 0.00 59.36 57.67 1u7t h GLU 211 Cb 1.23 -0.05 0.00 0.00 -0.16 0.00 0.00 28.75 29.77 1u7t h GLU 211 CO 0.73 0.14 -0.13 0.87 -1.18 0.00 0.00 179.01 179.44 1u7t h LYS 212 N 0.22 -0.34 -0.48 1.92 1.79 -1.99 -1.00 116.57 116.68 1u7t h LYS 212 Ca 0.67 0.02 0.10 0.00 -2.18 0.00 0.00 60.65 59.26 1u7t h LYS 212 Cb 2.03 0.08 -0.09 0.00 -1.58 0.00 0.00 32.23 32.66 1u7t h LYS 212 CO -0.28 -0.08 -0.15 0.28 -1.08 0.00 0.00 179.45 178.15 1u7t h VAL 213 N -0.59 0.47 -0.11 0.50 2.07 -1.60 0.22 116.25 117.22 1u7t h VAL 213 Ca -0.04 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.53 1u7t h VAL 213 Cb 0.43 0.47 -0.06 0.00 -1.52 0.00 0.00 31.29 30.60 1u7t h VAL 213 CO 0.06 0.00 -0.33 -0.09 0.02 0.00 0.00 177.57 177.23 1u7t h ARG 214 N -0.03 -0.40 -0.49 1.57 2.43 -1.32 0.57 114.38 116.71 1u7t h ARG 214 Ca 0.23 0.03 -0.06 0.00 -0.81 0.00 0.00 59.98 59.37 1u7t h ARG 214 Cb 0.39 0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 30.01 1u7t h ARG 214 CO -0.51 -0.27 0.07 -0.91 -1.51 0.00 0.00 179.97 176.84 1u7t h ASN 215 N -0.42 0.72 -0.55 -3.80 2.35 -0.51 -0.06 115.58 113.32 1u7t h ASN 215 Ca 0.09 -0.14 -0.08 0.00 -0.55 0.00 0.00 56.30 55.61 1u7t h ASN 215 Cb 0.56 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.71 1u7t h ASN 215 CO -0.34 0.75 0.04 0.15 -1.65 0.00 0.00 177.43 176.38 1u7t h PHE 216 N 0.73 1.04 -0.14 1.19 3.57 0.13 -0.89 116.94 122.58 1u7t h PHE 216 Ca 0.16 -0.15 -0.01 0.00 3.53 0.00 0.00 57.97 61.49 1u7t h PHE 216 Cb 0.34 -0.28 -0.01 0.00 2.79 0.00 0.00 35.95 38.80 1u7t h PHE 216 CO 0.02 0.91 0.04 -0.07 -2.23 0.00 0.00 178.31 176.98 1u7t h LEU 217 N 0.91 0.20 -0.96 0.59 3.38 0.80 -2.61 115.31 117.61 1u7t h LEU 217 Ca 0.17 -0.20 0.14 0.00 0.09 0.00 0.00 57.88 58.09 1u7t h LEU 217 Cb 0.47 -0.05 -0.09 0.00 0.09 0.00 0.00 40.66 41.08 1u7t h LEU 217 CO 0.02 0.34 0.58 0.00 0.09 0.00 0.00 178.44 179.47 1u7t h ALA 218 N 0.86 1.49 0.00 1.53 0.00 -0.89 -1.55 119.26 120.70 1u7t h ALA 218 Ca 0.04 0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1u7t h ALA 218 Cb 0.21 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1u7t h ALA 218 CO -0.00 0.09 0.00 0.66 0.00 0.00 0.00 179.25 180.00 1u7t h SER 219 N 0.86 0.00 -0.11 0.00 4.64 -0.77 -2.63 113.55 115.53 1u7t h SER 219 Ca 0.51 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.83 1u7t h SER 219 Cb 0.62 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.71 1u7t h SER 219 CO -0.31 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.65 1u7t n GLN 220 N -2.51 1.83 -2.35 4.77 1.13 -0.58 -4.84 117.38 114.83 1u7t n GLN 220 Ca 0.01 -1.23 -0.43 0.00 -1.94 0.00 0.00 57.00 53.41 1u7t n GLN 220 Cb 0.21 -1.45 -0.02 0.00 0.11 0.00 0.00 30.24 29.09 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 -1.87 4.14 0.08 5.09 1.01 -0.99 -4.83 120.40 123.02 1u7t s VAL 221 Ca 0.35 1.40 -0.32 0.00 0.00 0.00 0.00 61.98 63.41 1u7t s VAL 221 Cb 0.20 -3.90 -0.17 0.00 0.00 0.00 0.00 36.38 32.51 1u7t s VAL 221 CO 0.30 -0.10 1.63 -0.65 0.00 0.00 0.00 175.10 176.28 1u7t h PRO 222 N 8.29 -0.76 -1.80 2.72 0.11 -1.85 -3.34 132.00 135.38 1u7t h PRO 222 Ca -0.30 0.05 0.06 0.00 0.11 0.00 0.00 66.00 65.92 1u7t h PRO 222 Cb 1.13 0.17 -0.23 0.00 0.11 0.00 0.00 31.00 32.17 1u7t h PRO 222 CO 0.95 -0.50 0.15 0.12 -0.21 0.00 0.00 178.00 178.51 1u7t s PHE 223 N -6.05 -0.89 0.43 0.65 5.36 -0.88 -4.19 117.98 112.41 1u7t s PHE 223 Ca -0.17 1.75 -0.23 0.00 -0.96 0.00 0.00 56.93 57.32 1u7t s PHE 223 Cb 0.04 0.53 -0.08 0.00 -0.34 0.00 0.00 43.02 43.17 1u7t s PHE 223 CO 0.63 -0.44 1.07 -1.25 -1.46 0.00 0.00 175.22 173.77 1u7t s PRO 224 N 1.61 3.99 -1.31 10.12 0.04 -1.26 -4.41 135.00 143.78 1u7t s PRO 224 Ca -0.09 1.53 -0.15 0.00 0.04 0.00 0.00 61.00 62.33 1u7t s PRO 224 Cb -0.05 -2.41 0.10 0.00 0.04 0.00 0.00 34.50 32.19 1u7t s PRO 224 CO -0.18 -0.29 1.79 0.43 0.04 0.00 0.00 177.00 178.78 1u7t n SER 225 N -0.37 4.81 -3.68 6.66 7.64 -1.25 -4.82 113.62 122.60 1u7t n SER 225 Ca 0.06 -2.94 -0.05 0.00 1.01 0.00 0.00 58.87 56.95 1u7t n SER 225 Cb 0.50 -1.65 -0.02 0.00 -1.01 0.00 0.00 64.21 62.03 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 2.83 1.13 0.69 1.43 1.70 -1.25 -4.85 118.95 120.64 1u7t s ARG 226 Ca 0.48 -0.57 -0.16 0.00 -0.47 0.00 0.00 55.73 55.01 1u7t s ARG 226 Cb 0.05 0.42 0.02 0.00 -0.57 0.00 0.00 34.95 34.87 1u7t s ARG 226 CO 0.02 -0.51 1.19 -0.51 -1.08 0.00 0.00 175.30 174.41 1u7t s LEU 227 N -2.81 3.39 0.52 -1.89 1.43 -1.26 -4.86 118.68 113.20 1u7t s LEU 227 Ca 0.10 2.31 -0.20 0.00 -1.03 0.00 0.00 54.13 55.31 1u7t s LEU 227 Cb -0.02 -4.59 -0.06 0.00 0.03 0.00 0.00 46.19 41.56 1u7t s LEU 227 CO -0.01 -2.04 1.13 -0.83 0.23 0.00 0.00 176.35 174.82 1u7t s GLY 228 N -2.03 2.65 -0.15 -3.19 0.00 0.15 -4.75 107.32 100.01 1u7t s GLY 228 Ca 0.74 0.83 -0.20 0.00 0.00 0.00 0.00 44.72 46.08 1u7t s GLY 228 CO 0.42 1.20 0.58 -0.35 0.00 0.00 0.00 173.10 174.95 1u7t s ASP 229 N -1.71 6.71 0.46 1.64 3.68 -1.26 -1.48 116.67 124.71 1u7t s ASP 229 Ca 0.70 0.85 0.26 0.00 2.13 0.00 0.00 52.55 56.50 1u7t s ASP 229 Cb -0.24 -2.33 1.30 0.00 -1.45 0.00 0.00 42.92 40.20 1u7t s ASP 229 CO 0.28 -0.15 1.77 -0.65 0.13 0.00 0.00 175.17 176.55 1u7t h PRO 230 N 7.15 0.21 -0.16 4.34 0.11 -1.94 0.98 132.00 142.70 1u7t h PRO 230 Ca -0.36 -0.01 0.03 0.00 0.11 0.00 0.00 66.00 65.77 1u7t h PRO 230 Cb 1.16 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 1u7t h PRO 230 CO 0.76 0.14 0.11 0.00 -0.21 0.00 0.00 178.00 178.80 1u7t h ALA 231 N 1.54 2.08 -0.26 -0.75 0.00 -1.93 -1.66 119.26 118.28 1u7t h ALA 231 Ca 0.60 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 55.37 1u7t h ALA 231 Cb 1.88 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.66 1u7t h ALA 231 CO -0.20 -0.11 -0.39 0.93 0.00 0.00 0.00 179.25 179.48 1u7t h GLU 232 N 0.06 0.60 -0.13 0.00 5.08 0.63 0.84 114.58 121.66 1u7t h GLU 232 Ca 0.07 -0.30 0.00 0.00 -1.00 0.00 0.00 59.36 58.14 1u7t h GLU 232 Cb 0.21 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.46 1u7t h GLU 232 CO -0.01 0.89 0.08 -0.92 -1.00 0.00 0.00 179.01 178.05 1u7t h TYR 233 N 0.50 0.14 -0.55 4.33 3.20 -1.27 -2.72 116.97 120.60 1u7t h TYR 233 Ca 0.05 0.00 0.05 0.00 3.14 0.00 0.00 58.73 61.97 1u7t h TYR 233 Cb 0.89 -0.05 -0.05 0.00 1.54 0.00 0.00 36.73 39.07 1u7t h TYR 233 CO 0.04 0.09 0.28 0.00 -1.64 0.00 0.00 178.16 176.93 1u7t h ALA 234 N 1.05 0.71 -0.64 1.82 0.00 -0.87 -0.90 119.26 120.42 1u7t h ALA 234 Ca 0.05 0.02 0.11 0.00 0.00 0.00 0.00 54.91 55.09 1u7t h ALA 234 Cb -0.01 -0.07 -0.08 0.00 0.00 0.00 0.00 17.79 17.62 1u7t h ALA 234 CO -0.02 -0.07 0.20 1.25 0.00 0.00 0.00 179.25 180.62 1u7t h HIS 235 N 0.53 0.34 -0.49 0.00 -0.00 -0.79 -1.29 115.15 113.46 1u7t h HIS 235 Ca 0.24 0.03 -0.11 0.00 -0.00 0.00 0.00 60.37 60.54 1u7t h HIS 235 Cb 0.16 -0.06 -0.02 0.00 -0.00 0.00 0.00 27.41 27.49 1u7t h HIS 235 CO -0.10 0.04 -0.12 1.25 -0.00 0.00 0.00 177.93 179.00 1u7t h LEU 236 N 0.35 0.92 -0.41 0.26 5.85 -0.88 -0.99 115.31 120.42 1u7t h LEU 236 Ca 0.33 -0.30 0.05 0.00 0.84 0.00 0.00 57.88 58.81 1u7t h LEU 236 Cb 0.47 -0.25 -0.05 0.00 0.37 0.00 0.00 40.66 41.20 1u7t h LEU 236 CO -0.37 1.05 0.14 0.58 -0.34 0.00 0.00 178.44 179.50 1u7t h VAL 237 N 0.82 0.86 -0.46 1.05 2.07 -0.77 -1.01 116.25 118.81 1u7t h VAL 237 Ca 0.13 -0.10 0.00 0.00 0.82 0.00 0.00 66.70 67.55 1u7t h VAL 237 Cb 0.65 0.54 -0.02 0.00 -1.52 0.00 0.00 31.29 30.94 1u7t h VAL 237 CO 0.05 0.05 0.30 -0.61 0.02 0.00 0.00 177.57 177.38 1u7t h GLN 238 N 0.29 0.60 -0.61 1.57 4.15 -0.83 -0.63 115.11 119.66 1u7t h GLN 238 Ca 0.19 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.58 1u7t h GLN 238 Cb 0.19 -0.14 -0.03 0.00 0.21 0.00 0.00 27.48 27.71 1u7t h GLN 238 CO -0.20 0.40 0.39 0.00 -1.93 0.00 0.00 178.83 177.48 1u7t h ALA 239 N 1.17 1.54 -0.19 3.38 0.00 -0.66 -0.84 119.26 123.65 1u7t h ALA 239 Ca 0.17 -0.05 -0.19 0.00 0.00 0.00 0.00 54.91 54.84 1u7t h ALA 239 Cb -0.07 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.47 1u7t h ALA 239 CO -0.04 0.42 -0.64 0.82 0.00 0.00 0.00 179.25 179.81 1u7t h ILE 240 N 0.83 1.31 -0.70 0.00 2.04 -0.77 -1.71 117.51 118.50 1u7t h ILE 240 Ca 0.22 -1.88 -0.04 0.00 1.00 0.00 0.00 64.86 64.16 1u7t h ILE 240 Cb -0.07 1.84 -0.03 0.00 -0.74 0.00 0.00 36.82 37.82 1u7t h ILE 240 CO -0.05 0.59 0.30 0.40 0.00 0.00 0.00 178.15 179.40 1u7t h ILE 241 N 0.50 1.24 -0.07 -0.67 2.04 -0.37 -3.14 117.51 117.04 1u7t h ILE 241 Ca -0.01 -0.73 -0.18 0.00 1.00 0.00 0.00 64.86 64.94 1u7t h ILE 241 Cb 1.23 0.41 -0.01 0.00 -0.74 0.00 0.00 36.82 37.71 1u7t h ILE 241 CO 0.13 0.30 -0.72 -0.33 0.00 0.00 0.00 178.15 177.52 1u7t h GLU 242 N 1.00 0.36 -5.55 2.37 5.08 -1.12 -3.43 114.58 113.29 1u7t h GLU 242 Ca 0.24 -0.29 -0.63 0.00 -1.00 0.00 0.00 59.36 57.67 1u7t h GLU 242 Cb 0.18 0.06 -0.13 0.00 0.50 0.00 0.00 28.75 29.36 1u7t h GLU 242 CO -0.02 0.94 0.20 1.21 -1.00 0.00 0.00 179.01 180.34 1u7t s ASN 243 N -6.96 6.42 0.48 1.42 3.84 -0.65 -4.93 114.94 114.56 1u7t s ASN 243 Ca -0.05 0.05 0.32 0.00 0.21 0.00 0.00 52.86 53.39 1u7t s ASN 243 Cb 0.11 -2.34 1.53 0.00 -0.55 0.00 0.00 41.25 39.99 1u7t s ASN 243 CO 0.83 -0.69 1.97 -0.65 -2.79 0.00 0.00 177.10 175.77 1u7t h PRO 244 N 8.61 0.00 -0.36 0.43 0.11 -1.85 -3.13 132.00 135.81 1u7t h PRO 244 Ca -0.26 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.85 1u7t h PRO 244 Cb 1.10 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.21 1u7t h PRO 244 CO 0.87 0.00 0.00 0.34 -0.21 0.00 0.00 178.00 179.00 1u7t n PHE 245 N -2.75 0.47 -2.90 0.65 -0.00 -1.26 -4.86 117.46 106.82 1u7t n PHE 245 Ca -0.00 -0.27 -0.42 0.00 -0.00 0.00 0.00 57.45 56.75 1u7t n PHE 245 Cb 0.18 -0.00 -0.05 0.00 -0.00 0.00 0.00 39.48 39.61 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 -1.32 4.08 -0.16 -2.13 1.43 -1.19 -5.02 118.68 114.38 1u7t s LEU 246 Ca 0.34 0.35 -0.24 0.00 -1.03 0.00 0.00 54.13 53.56 1u7t s LEU 246 Cb 0.20 -3.11 0.06 0.00 0.03 0.00 0.00 46.19 43.37 1u7t s LEU 246 CO 0.28 -0.82 0.61 0.21 0.23 0.00 0.00 176.35 176.85 1u7t s ASN 247 N 1.93 -0.61 -1.28 2.29 2.47 -1.26 -4.78 114.94 113.70 1u7t s ASN 247 Ca 0.34 0.97 0.00 0.00 0.42 0.00 0.00 52.86 54.59 1u7t s ASN 247 Cb -0.12 0.95 0.00 0.00 -1.45 0.00 0.00 41.25 40.63 1u7t s ASN 247 CO 0.19 -0.36 0.00 0.61 -3.72 0.00 0.00 177.10 173.82 1u7t n GLY 248 N 2.04 0.96 3.35 1.21 0.00 -0.03 -5.00 105.19 107.72 1u7t n GLY 248 Ca -0.16 -0.41 -0.20 0.00 0.00 0.00 0.00 46.02 45.24 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 -3.48 1.34 -0.12 1.61 2.56 -1.26 -4.53 118.70 114.82 1u7t s GLU 249 Ca 0.00 -1.54 -0.01 0.00 0.00 0.00 0.00 54.97 53.42 1u7t s GLU 249 Cb 0.00 -1.25 -0.02 0.00 2.00 0.00 0.00 34.13 34.86 1u7t s GLU 249 CO 0.00 0.23 -0.09 0.08 -0.56 0.00 0.00 175.26 174.92 1u7t s VAL 250 N -2.61 3.48 -0.17 3.70 1.01 -1.26 -1.80 120.40 122.75 1u7t s VAL 250 Ca 0.21 -0.52 0.01 0.00 0.00 0.00 0.00 61.98 61.68 1u7t s VAL 250 Cb -0.03 -2.47 0.02 0.00 0.00 0.00 0.00 36.38 33.89 1u7t s VAL 250 CO 0.08 0.53 -0.20 -0.63 0.00 0.00 0.00 175.10 174.88 1u7t s ILE 251 N 0.08 2.11 -0.01 2.22 1.01 0.26 -4.95 121.20 121.91 1u7t s ILE 251 Ca -0.03 -0.94 -0.30 0.00 0.00 0.00 0.00 60.65 59.39 1u7t s ILE 251 Cb -0.14 -1.87 -0.03 0.00 0.01 0.00 0.00 42.46 40.43 1u7t s ILE 251 CO 0.04 0.54 1.00 -0.13 0.00 0.00 0.00 174.94 176.38 1u7t s ARG 252 N 1.15 4.53 -0.46 2.79 0.52 -1.26 -0.04 118.95 126.19 1u7t s ARG 252 Ca 0.01 1.44 0.03 0.00 -0.52 0.00 0.00 55.73 56.69 1u7t s ARG 252 Cb -0.14 -3.47 0.13 0.00 0.52 0.00 0.00 34.95 31.99 1u7t s ARG 252 CO -0.09 -0.10 0.22 -1.17 0.02 0.00 0.00 175.30 174.17 1u7t s LEU 253 N 1.16 3.58 0.00 2.53 2.96 -0.82 -4.92 118.68 123.17 1u7t s LEU 253 Ca 0.52 -2.68 0.00 0.00 -0.22 0.00 0.00 54.13 51.75 1u7t s LEU 253 Cb -0.21 -1.35 0.00 0.00 0.50 0.00 0.00 46.19 45.13 1u7t s LEU 253 CO 0.27 -0.27 0.41 -0.90 -1.32 0.00 0.00 176.35 174.54 1u7t n ASP 254 N 3.51 0.00 -1.27 3.68 5.68 -1.26 -1.36 116.55 125.53 1u7t n ASP 254 Ca 0.06 -1.13 -0.17 0.00 -0.50 0.00 0.00 54.79 53.06 1u7t n ASP 254 Cb 0.35 -0.03 -0.07 0.00 -1.14 0.00 0.00 41.12 40.23 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 1.64 2.27 6.12 0.00 -1.26 -1.84 105.19 112.12 1u7t n GLY 255 Ca 0.00 -0.15 -0.08 0.00 0.00 0.00 0.00 46.02 45.80 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 1.31 -0.11 -1.55 4.61 0.00 -1.26 -2.07 120.51 121.43 1u7t n ALA 256 Ca -0.17 0.12 -0.33 0.00 0.00 0.00 0.00 53.44 53.06 1u7t n ALA 256 Cb 0.58 -1.08 0.04 0.00 0.00 0.00 0.00 19.45 18.99 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 -2.23 3.17 -0.09 0.00 2.07 -0.77 -4.73 121.20 118.62 1u7t s ILE 257 Ca 0.00 0.58 0.01 0.00 -1.41 0.00 0.00 60.65 59.83 1u7t s ILE 257 Cb 0.00 -3.11 0.02 0.00 0.13 0.00 0.00 42.46 39.50 1u7t s ILE 257 CO 0.00 -0.30 -0.10 -0.13 -1.91 0.00 0.00 174.94 172.50 1u7t s ARG 258 N -3.93 1.64 0.09 3.50 1.81 -1.26 -5.01 118.95 115.80 1u7t s ARG 258 Ca 0.69 -0.34 -0.29 0.00 -1.72 0.00 0.00 55.73 54.07 1u7t s ARG 258 Cb -0.22 -1.53 -0.06 0.00 -0.45 0.00 0.00 34.95 32.70 1u7t s ARG 258 CO 0.39 -0.13 0.91 -1.64 -0.68 0.00 0.00 175.30 174.15 1u7t s MET 259 N 1.23 4.64 0.67 3.54 -1.94 -1.26 -5.04 119.30 121.14 1u7t s MET 259 Ca -0.04 1.35 -0.05 0.00 -1.71 0.00 0.00 55.69 55.25 1u7t s MET 259 Cb -0.14 -3.38 0.05 0.00 2.01 0.00 0.00 34.83 33.38 1u7t s MET 259 CO -0.03 0.22 0.96 -0.65 -0.01 0.00 0.00 175.02 175.51 1u7t s GLN 260 N 0.03 2.28 0.00 2.03 -1.52 -1.26 -4.91 119.66 116.31 1u7t s GLN 260 Ca 0.45 -0.37 0.00 0.00 -1.95 0.00 0.00 55.36 53.49 1u7t s GLN 260 Cb -0.22 -2.24 0.00 0.00 -0.22 0.00 0.00 33.01 30.33 1u7t s GLN 260 CO 0.28 -1.12 0.34 -2.30 -0.25 0.00 0.00 175.29 172.24