#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i9t n ASP 12 N 0.00 3.02 -0.23 1.69 8.00 -1.26 -4.84 116.55 122.94 3i9t n ASP 12 Ca 0.00 1.15 0.02 0.00 0.71 0.00 0.00 54.79 56.67 3i9t n ASP 12 Cb 0.00 -1.47 0.11 0.00 -0.02 0.00 0.00 41.12 39.73 3i9t n ASP 12 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 3i9t h LEU 13 N 4.23 -0.42 -1.20 0.64 5.85 -1.90 0.89 115.31 123.40 3i9t h LEU 13 Ca -0.46 0.18 0.04 0.00 0.84 0.00 0.00 57.88 58.49 3i9t h LEU 13 Cb 1.26 0.34 -0.05 0.00 0.37 0.00 0.00 40.66 42.59 3i9t h LEU 13 CO 0.76 -0.17 0.56 0.77 -0.34 0.00 0.00 178.44 180.01 3i9t h SER 14 N 0.07 0.89 -0.12 1.25 4.64 -1.87 -0.52 113.55 117.88 3i9t h SER 14 Ca 0.35 -0.01 -0.14 0.00 -0.47 0.00 0.00 61.79 61.52 3i9t h SER 14 Cb 0.57 -0.20 0.01 0.00 -0.31 0.00 0.00 62.40 62.46 3i9t h SER 14 CO -0.62 0.60 -0.46 -0.33 -0.87 0.00 0.00 176.83 175.15 3i9t h GLU 15 N 1.03 0.52 -0.69 4.77 5.08 -1.74 -2.50 114.58 121.05 3i9t h GLU 15 Ca 0.34 -0.40 0.09 0.00 -1.00 0.00 0.00 59.36 58.39 3i9t h GLU 15 Cb 0.07 0.08 -0.07 0.00 0.50 0.00 0.00 28.75 29.33 3i9t h GLU 15 CO -0.11 1.03 0.34 0.00 -1.00 0.00 0.00 179.01 179.27 3i9t h ALA 16 N 0.50 0.94 -0.32 3.43 0.00 -0.60 -1.28 119.26 121.93 3i9t h ALA 16 Ca -0.02 0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 3i9t h ALA 16 Cb 1.09 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 3i9t h ALA 16 CO 0.10 -0.05 0.03 -0.07 0.00 0.00 0.00 179.25 179.26 3i9t h LEU 17 N 0.59 0.52 0.20 0.00 3.38 -1.11 0.06 115.31 118.96 3i9t h LEU 17 Ca 0.34 -0.28 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 3i9t h LEU 17 Cb 0.34 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 40.95 3i9t h LEU 17 CO -0.26 0.67 -0.11 0.50 0.09 0.00 0.00 178.44 179.33 3i9t h LYS 18 N 0.35 -0.28 -0.79 1.13 3.64 -1.27 -1.30 116.57 118.05 3i9t h LYS 18 Ca 0.09 0.02 0.13 0.00 -1.27 0.00 0.00 60.65 59.63 3i9t h LYS 18 Cb 0.38 0.06 -0.09 0.00 -0.41 0.00 0.00 32.23 32.18 3i9t h LYS 18 CO 0.01 -0.19 0.37 0.93 -2.27 0.00 0.00 179.45 178.30 3i9t h GLU 19 N -0.30 0.54 0.00 1.90 4.39 -1.24 -1.75 114.58 118.13 3i9t h GLU 19 Ca -0.02 -0.03 -0.08 0.00 0.34 0.00 0.00 59.36 59.56 3i9t h GLU 19 Cb 0.24 -0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 28.76 3i9t h GLU 19 CO 0.03 0.36 -0.40 0.00 -1.16 0.00 0.00 179.01 177.84 3i9t h ALA 20 N 1.53 0.92 -0.13 3.43 0.00 -0.64 -3.24 119.26 121.13 3i9t h ALA 20 Ca 0.42 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3i9t h ALA 20 Cb 0.58 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.30 3i9t h ALA 20 CO -0.35 0.50 0.00 0.25 0.00 0.00 0.00 179.25 179.65 3i9t n THR 21 N -3.46 0.34 0.18 0.00 -2.24 -0.52 -4.60 114.28 103.98 3i9t n THR 21 Ca 0.00 -0.67 0.04 0.00 -2.27 0.00 0.00 64.05 61.15 3i9t n THR 21 Cb 0.55 0.98 0.33 0.00 -2.10 0.00 0.00 70.33 70.09 3i9t n THR 21 CO 0.00 0.00 0.00 0.07 -0.57 0.00 0.00 175.07 174.57 3i9t h LYS 22 N 2.12 0.00 0.06 -0.78 2.10 -1.35 0.11 116.57 118.84 3i9t h LYS 22 Ca 0.00 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.65 3i9t h LYS 22 Cb 0.55 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.88 3i9t h LYS 22 CO 0.00 0.40 -0.03 0.93 -2.00 0.00 0.00 179.45 178.75 3i9t h GLU 23 N 0.00 -0.08 -0.35 0.07 5.08 -1.81 -2.81 114.58 114.67 3i9t h GLU 23 Ca -0.00 0.01 0.06 0.00 -1.00 0.00 0.00 59.36 58.42 3i9t h GLU 23 Cb 0.88 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.13 3i9t h GLU 23 CO 0.05 0.50 0.24 -0.24 -1.00 0.00 0.00 179.01 178.56 3i9t h VAL 24 N -0.88 0.94 -0.57 3.13 3.04 -1.84 -2.12 116.25 117.95 3i9t h VAL 24 Ca -0.01 -0.08 -0.03 0.00 -1.01 0.00 0.00 66.70 65.57 3i9t h VAL 24 Cb 0.62 0.70 -0.03 0.00 -2.01 0.00 0.00 31.29 30.57 3i9t h VAL 24 CO 0.01 0.04 0.23 -0.74 -1.01 0.00 0.00 177.57 176.11 3i9t h HIS 25 N 0.22 0.87 -0.76 3.17 -0.00 -0.74 0.52 115.15 118.44 3i9t h HIS 25 Ca 0.16 -0.06 0.12 0.00 -0.00 0.00 0.00 60.37 60.58 3i9t h HIS 25 Cb 0.33 -0.26 -0.08 0.00 -0.00 0.00 0.00 27.41 27.40 3i9t h HIS 25 CO -0.00 0.70 0.36 0.82 -0.00 0.00 0.00 177.93 179.81 3i9t h ILE 26 N 0.78 0.76 -0.46 6.26 2.04 -1.12 0.11 117.51 125.88 3i9t h ILE 26 Ca 0.19 -0.19 -0.06 0.00 1.00 0.00 0.00 64.86 65.80 3i9t h ILE 26 Cb 0.20 0.15 -0.02 0.00 -0.74 0.00 0.00 36.82 36.41 3i9t h ILE 26 CO -0.02 0.10 0.05 0.03 0.00 0.00 0.00 178.15 178.31 3i9t h ARG 27 N 0.56 0.78 -0.53 2.37 3.08 -1.14 -2.73 114.38 116.76 3i9t h ARG 27 Ca 0.40 -0.22 -0.03 0.00 0.07 0.00 0.00 59.98 60.20 3i9t h ARG 27 Cb 0.52 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.46 3i9t h ARG 27 CO -0.33 0.81 0.22 0.00 -1.07 0.00 0.00 179.97 179.60 3i9t h ALA 28 N 0.94 0.69 -0.96 0.04 0.00 -0.14 -2.15 119.26 117.68 3i9t h ALA 28 Ca 0.14 -0.15 0.24 0.00 0.00 0.00 0.00 54.91 55.13 3i9t h ALA 28 Cb 0.43 -0.21 -0.07 0.00 0.00 0.00 0.00 17.79 17.94 3i9t h ALA 28 CO 0.01 0.29 0.64 0.93 0.00 0.00 0.00 179.25 181.12 3i9t h GLU 29 N 0.72 0.34 -0.51 0.00 5.08 -0.80 -2.60 114.58 116.81 3i9t h GLU 29 Ca 0.18 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.52 3i9t h GLU 29 Cb 0.18 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.35 3i9t h GLU 29 CO -0.02 0.22 0.00 0.09 -1.00 0.00 0.00 179.01 178.31 3i9t n ASN 30 N -4.51 4.31 -4.59 1.42 3.02 -0.85 -3.60 115.26 110.45 3i9t n ASN 30 Ca 0.21 -2.50 -0.37 0.00 -0.03 0.00 0.00 54.58 51.89 3i9t n ASN 30 Cb 0.81 -0.51 0.06 0.00 -0.61 0.00 0.00 39.78 39.52 3i9t n ASN 30 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 3i9t n SER 31 N 0.67 0.43 -0.30 6.41 3.41 -0.94 -4.72 113.62 118.57 3i9t n SER 31 Ca 0.22 0.76 0.04 0.00 -0.26 0.00 0.00 58.87 59.64 3i9t n SER 31 Cb 0.82 -1.36 0.18 0.00 -0.26 0.00 0.00 64.21 63.59 3i9t n SER 31 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 3i9t h GLU 32 N 0.29 0.78 0.13 4.33 5.08 -1.92 0.25 114.58 123.54 3i9t h GLU 32 Ca -0.48 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 57.84 3i9t h GLU 32 Cb 1.37 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 30.43 3i9t h GLU 32 CO 0.49 0.52 -0.13 0.35 -1.00 0.00 0.00 179.01 179.24 3i9t h PHE 33 N 0.81 -0.34 -0.20 4.33 3.57 -1.88 -0.47 116.94 122.75 3i9t h PHE 33 Ca 0.42 0.00 -0.12 0.00 3.53 0.00 0.00 57.97 61.80 3i9t h PHE 33 Cb 0.40 0.13 -0.01 0.00 2.79 0.00 0.00 35.95 39.27 3i9t h PHE 33 CO -0.06 -0.20 -0.39 0.52 -2.23 0.00 0.00 178.31 175.95 3i9t h MET 34 N -0.29 0.44 0.42 1.11 2.86 -1.70 -0.11 114.93 117.66 3i9t h MET 34 Ca 0.01 -0.21 -0.02 0.00 -2.06 0.00 0.00 59.70 57.41 3i9t h MET 34 Cb 0.28 -0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.94 3i9t h MET 34 CO -0.04 0.77 -0.20 -0.09 1.06 0.00 0.00 176.91 178.41 3i9t h ARG 35 N 0.37 -0.55 -0.37 1.72 2.43 -0.28 -0.59 114.38 117.11 3i9t h ARG 35 Ca 0.03 0.04 0.05 0.00 -0.81 0.00 0.00 59.98 59.29 3i9t h ARG 35 Cb 0.85 0.12 -0.05 0.00 -0.42 0.00 0.00 29.97 30.48 3i9t h ARG 35 CO 0.07 -0.31 0.10 -0.91 -1.51 0.00 0.00 179.97 177.41 3i9t h ASN 36 N -0.66 0.08 -0.09 -3.80 -0.26 -0.98 -2.56 115.58 107.30 3i9t h ASN 36 Ca -0.06 0.05 0.04 0.00 -0.56 0.00 0.00 56.30 55.77 3i9t h ASN 36 Cb 0.49 0.06 -0.06 0.00 -1.06 0.00 0.00 38.32 37.74 3i9t h ASN 36 CO 0.10 0.08 -0.43 0.15 -1.06 0.00 0.00 177.43 176.26 3i9t h PHE 37 N 0.24 -1.24 -0.71 1.19 3.04 -0.84 -0.42 116.94 118.19 3i9t h PHE 37 Ca 0.18 0.05 0.17 0.00 3.98 0.00 0.00 57.97 62.35 3i9t h PHE 37 Cb 0.18 0.56 -0.04 0.00 2.56 0.00 0.00 35.95 39.21 3i9t h PHE 37 CO -0.17 -0.49 0.49 1.96 -2.02 0.00 0.00 178.31 178.08 3i9t h GLN 38 N -0.53 0.20 -0.08 1.11 4.20 -0.97 0.53 115.11 119.57 3i9t h GLN 38 Ca 0.06 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.76 3i9t h GLN 38 Cb 0.64 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.38 3i9t h GLN 38 CO -0.38 0.13 0.00 1.63 -0.67 0.00 0.00 178.83 179.54 3i9t n LYS 39 N -4.41 1.23 -0.97 1.46 5.02 -0.91 -4.91 118.16 114.66 3i9t n LYS 39 Ca 0.14 -0.35 0.00 0.00 -2.02 0.00 0.00 58.31 56.08 3i9t n LYS 39 Cb 0.64 -1.17 0.00 0.00 -0.02 0.00 0.00 35.03 34.49 3i9t n LYS 39 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3i9t n GLY 40 N 0.75 0.45 2.65 0.72 0.00 0.18 -4.94 105.19 104.99 3i9t n GLY 40 Ca 0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 3i9t n GLY 40 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3i9t n GLN 41 N -1.98 3.58 -4.38 1.61 6.02 -0.22 -4.77 117.38 117.23 3i9t n GLN 41 Ca 0.00 -2.97 -0.21 0.00 -0.01 0.00 0.00 57.00 53.81 3i9t n GLN 41 Cb 0.10 -2.96 -0.16 0.00 1.02 0.00 0.00 30.24 28.24 3i9t n GLN 41 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 3i9t s VAL 42 N 1.32 0.80 0.43 5.09 0.11 -1.26 -3.89 120.40 123.00 3i9t s VAL 42 Ca 0.50 -0.33 0.06 0.00 -2.93 0.00 0.00 61.98 59.28 3i9t s VAL 42 Cb 0.14 -0.74 -0.07 0.00 -1.53 0.00 0.00 36.38 34.19 3i9t s VAL 42 CO -0.05 0.26 0.02 -0.94 -3.33 0.00 0.00 175.10 171.06 3i9t s SER 43 N 0.47 3.96 0.25 3.54 1.04 -1.26 -4.69 113.70 117.02 3i9t s SER 43 Ca -0.08 -1.39 -0.07 0.00 0.48 0.00 0.00 55.95 54.89 3i9t s SER 43 Cb -0.12 -0.25 0.45 0.00 0.10 0.00 0.00 66.02 66.20 3i9t s SER 43 CO 0.01 -0.53 1.62 -0.09 0.98 0.00 0.00 173.24 175.24 3i9t h ARG 44 N 1.67 0.08 -0.17 4.02 2.43 -1.98 0.16 114.38 120.58 3i9t h ARG 44 Ca -0.44 -0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 58.70 3i9t h ARG 44 Cb 1.25 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.78 3i9t h ARG 44 CO 0.79 0.05 0.01 1.49 -1.51 0.00 0.00 179.97 180.80 3i9t h GLU 45 N 0.08 0.30 -0.39 0.20 4.81 -1.99 -0.27 114.58 117.31 3i9t h GLU 45 Ca 0.43 -0.09 -0.08 0.00 -0.13 0.00 0.00 59.36 59.48 3i9t h GLU 45 Cb 0.75 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.09 3i9t h GLU 45 CO -0.71 0.49 -0.08 0.78 -0.73 0.00 0.00 179.01 178.76 3i9t h GLY 46 N 0.06 0.82 1.06 1.92 0.00 -1.91 -2.59 103.07 102.42 3i9t h GLY 46 Ca 0.05 -0.66 -0.08 0.00 0.00 0.00 0.00 47.33 46.64 3i9t h GLY 46 CO 0.01 0.61 0.07 -2.75 0.00 0.00 0.00 176.54 174.47 3i9t h PHE 47 N 0.57 1.12 -0.74 5.60 3.57 -0.43 -1.29 116.94 125.33 3i9t h PHE 47 Ca 0.10 -0.17 -0.04 0.00 3.53 0.00 0.00 57.97 61.40 3i9t h PHE 47 Cb 0.60 -0.30 -0.03 0.00 2.79 0.00 0.00 35.95 39.00 3i9t h PHE 47 CO 0.05 0.96 0.33 0.87 -2.23 0.00 0.00 178.31 178.29 3i9t h LYS 48 N 0.95 1.10 -0.32 1.11 1.57 -1.06 -0.45 116.57 119.47 3i9t h LYS 48 Ca 0.18 -0.18 0.02 0.00 -1.87 0.00 0.00 60.65 58.80 3i9t h LYS 48 Cb 0.47 -0.19 -0.03 0.00 0.08 0.00 0.00 32.23 32.57 3i9t h LYS 48 CO 0.02 0.88 0.16 -0.07 -0.57 0.00 0.00 179.45 179.87 3i9t h LEU 49 N 1.06 0.24 -0.32 2.94 3.38 -1.02 -1.14 115.31 120.45 3i9t h LEU 49 Ca 0.25 0.01 -0.15 0.00 0.09 0.00 0.00 57.88 58.09 3i9t h LEU 49 Cb 0.17 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 40.88 3i9t h LEU 49 CO -0.03 0.18 -0.37 1.62 0.09 0.00 0.00 178.44 179.93 3i9t h VAL 50 N 0.34 1.29 -0.33 1.22 3.04 -0.92 -2.36 116.25 118.53 3i9t h VAL 50 Ca 0.13 -1.55 -0.11 0.00 -1.01 0.00 0.00 66.70 64.16 3i9t h VAL 50 Cb 0.04 1.54 -0.01 0.00 -2.01 0.00 0.00 31.29 30.85 3i9t h VAL 50 CO -0.09 0.50 -0.26 0.24 -1.01 0.00 0.00 177.57 176.96 3i9t h MET 51 N 0.58 0.66 -0.61 4.17 2.86 -1.04 -0.57 114.93 120.99 3i9t h MET 51 Ca 0.04 -0.27 -0.06 0.00 -2.06 0.00 0.00 59.70 57.35 3i9t h MET 51 Cb 0.96 -0.03 -0.03 0.00 0.06 0.00 0.00 31.60 32.56 3i9t h MET 51 CO 0.09 0.85 0.14 0.00 1.06 0.00 0.00 176.91 179.05 3i9t h ALA 52 N 1.14 1.09 -0.57 6.32 0.00 -1.17 0.29 119.26 126.37 3i9t h ALA 52 Ca 0.08 -0.23 -0.11 0.00 0.00 0.00 0.00 54.91 54.65 3i9t h ALA 52 Cb 0.74 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 3i9t h ALA 52 CO 0.06 0.60 -0.07 0.77 0.00 0.00 0.00 179.25 180.61 3i9t h SER 53 N 0.91 1.05 -0.55 0.00 0.02 -1.10 -2.46 113.55 111.43 3i9t h SER 53 Ca 0.19 -0.34 -0.07 0.00 -0.84 0.00 0.00 61.79 60.74 3i9t h SER 53 Cb 0.34 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.57 3i9t h SER 53 CO 0.00 1.14 0.08 -0.07 -1.14 0.00 0.00 176.83 176.84 3i9t h LEU 54 N 0.94 0.92 -0.52 5.07 3.38 -0.82 -1.82 115.31 122.46 3i9t h LEU 54 Ca 0.15 -0.21 0.10 0.00 0.09 0.00 0.00 57.88 58.02 3i9t h LEU 54 Cb 0.64 -0.24 -0.09 0.00 0.09 0.00 0.00 40.66 41.06 3i9t h LEU 54 CO 0.04 0.93 -0.07 0.22 0.09 0.00 0.00 178.44 179.66 3i9t h TYR 55 N 0.90 -0.16 -0.25 1.13 3.20 -0.50 -0.06 116.97 121.23 3i9t h TYR 55 Ca 0.18 0.04 -0.15 0.00 3.14 0.00 0.00 58.73 61.95 3i9t h TYR 55 Cb 0.42 0.15 -0.01 0.00 1.54 0.00 0.00 36.73 38.83 3i9t h TYR 55 CO 0.03 -0.18 -0.44 0.45 -1.64 0.00 0.00 178.16 176.38 3i9t h HIS 56 N 0.05 0.77 -0.05 -3.82 3.86 -1.05 -1.77 115.15 113.14 3i9t h HIS 56 Ca 0.26 -0.24 -0.01 0.00 -1.16 0.00 0.00 60.37 59.22 3i9t h HIS 56 Cb 0.40 -0.16 -0.00 0.00 1.06 0.00 0.00 27.41 28.71 3i9t h HIS 56 CO -0.38 0.96 -0.00 0.82 0.86 0.00 0.00 177.93 180.19 3i9t h ILE 57 N 0.51 1.26 -0.07 2.45 2.04 -0.83 -1.94 117.51 120.93 3i9t h ILE 57 Ca 0.04 -0.79 -0.13 0.00 1.00 0.00 0.00 64.86 64.98 3i9t h ILE 57 Cb 0.97 1.68 -0.01 0.00 -0.74 0.00 0.00 36.82 38.71 3i9t h ILE 57 CO 0.09 0.22 -0.56 1.88 0.00 0.00 0.00 178.15 179.77 3i9t h TYR 58 N -0.20 0.25 -0.40 1.37 0.05 -1.04 -0.91 116.97 116.08 3i9t h TYR 58 Ca 0.02 -0.09 0.06 0.00 0.05 0.00 0.00 58.73 58.76 3i9t h TYR 58 Cb 0.34 -0.05 -0.05 0.00 1.01 0.00 0.00 36.73 37.99 3i9t h TYR 58 CO 0.04 0.72 0.11 1.15 -1.05 0.00 0.00 178.16 179.12 3i9t h THR 59 N 0.15 0.83 -0.37 -2.88 2.02 -1.26 -0.01 112.91 111.39 3i9t h THR 59 Ca -0.00 -0.09 -0.10 0.00 0.77 0.00 0.00 66.41 66.99 3i9t h THR 59 Cb 1.04 0.56 -0.01 0.00 -1.74 0.00 0.00 68.15 67.99 3i9t h THR 59 CO 0.08 0.05 -0.18 0.00 0.37 0.00 0.00 175.52 175.84 3i9t h ALA 60 N 1.28 0.52 -0.78 6.16 0.00 -1.07 -2.09 119.26 123.30 3i9t h ALA 60 Ca 0.19 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 3i9t h ALA 60 Cb 0.21 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.83 3i9t h ALA 60 CO -0.22 0.46 0.46 1.25 0.00 0.00 0.00 179.25 181.19 3i9t h LEU 61 N 0.57 0.94 0.00 0.00 5.85 -0.97 -1.51 115.31 120.19 3i9t h LEU 61 Ca 0.08 -0.07 -0.14 0.00 0.84 0.00 0.00 57.88 58.59 3i9t h LEU 61 Cb 0.73 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.50 3i9t h LEU 61 CO 0.05 0.74 -0.75 -0.33 -0.34 0.00 0.00 178.44 177.82 3i9t h GLU 62 N 1.07 0.00 -0.67 1.25 5.08 -0.96 0.78 114.58 121.12 3i9t h GLU 62 Ca 0.28 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.56 3i9t h GLU 62 Cb -0.02 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.20 3i9t h GLU 62 CO -0.05 0.56 0.12 1.49 -1.00 0.00 0.00 179.01 180.13 3i9t h GLU 63 N 0.00 1.11 -0.04 2.33 4.81 -1.11 -1.18 114.58 120.49 3i9t h GLU 63 Ca -0.03 -0.29 -0.22 0.00 -0.13 0.00 0.00 59.36 58.69 3i9t h GLU 63 Cb 1.49 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 30.74 3i9t h GLU 63 CO 0.07 1.00 -0.87 0.93 -0.73 0.00 0.00 179.01 179.42 3i9t h GLU 64 N 1.04 0.46 -0.37 1.92 4.39 -0.87 -1.53 114.58 119.62 3i9t h GLU 64 Ca 0.21 -0.45 0.05 0.00 0.34 0.00 0.00 59.36 59.51 3i9t h GLU 64 Cb 0.43 0.12 -0.05 0.00 -0.10 0.00 0.00 28.75 29.15 3i9t h GLU 64 CO 0.01 1.09 0.10 0.82 -1.16 0.00 0.00 179.01 179.88 3i9t h ILE 65 N 0.28 0.85 -0.11 3.13 2.04 -0.79 -1.80 117.51 121.12 3i9t h ILE 65 Ca -0.07 -0.08 0.04 0.00 1.00 0.00 0.00 64.86 65.75 3i9t h ILE 65 Cb 1.49 0.59 -0.04 0.00 -0.74 0.00 0.00 36.82 38.12 3i9t h ILE 65 CO 0.15 0.04 -0.14 -0.33 0.00 0.00 0.00 178.15 177.88 3i9t h GLU 66 N 0.24 -0.18 -0.98 2.37 4.39 -1.04 0.55 114.58 119.94 3i9t h GLU 66 Ca 0.17 0.01 0.15 0.00 0.34 0.00 0.00 59.36 60.04 3i9t h GLU 66 Cb 0.18 0.04 -0.09 0.00 -0.10 0.00 0.00 28.75 28.77 3i9t h GLU 66 CO -0.20 -0.12 0.59 -0.09 -1.16 0.00 0.00 179.01 178.03 3i9t h ARG 67 N -0.18 0.83 -0.47 2.33 2.43 -1.19 -2.63 114.38 115.50 3i9t h ARG 67 Ca 0.08 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.20 3i9t h ARG 67 Cb 0.30 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 29.67 3i9t h ARG 67 CO -0.22 0.55 0.00 0.09 -1.51 0.00 0.00 179.97 178.88 3i9t n ASN 68 N -4.71 4.04 -0.34 -3.80 4.13 -0.69 -4.71 115.26 109.18 3i9t n ASN 68 Ca 0.20 -2.47 0.12 0.00 1.68 0.00 0.00 54.58 54.11 3i9t n ASN 68 Cb 0.45 -0.47 0.32 0.00 -1.54 0.00 0.00 39.78 38.54 3i9t n ASN 68 CO 0.00 0.00 0.00 0.07 0.28 0.00 0.00 177.26 177.61 3i9t h LYS 69 N 2.94 0.76 -0.00 3.52 2.10 -0.51 -1.69 116.57 123.69 3i9t h LYS 69 Ca 0.00 -0.05 0.00 0.00 -2.00 0.00 0.00 60.65 58.60 3i9t h LYS 69 Cb 1.25 -0.17 0.00 0.00 -0.90 0.00 0.00 32.23 32.41 3i9t h LYS 69 CO 0.17 0.51 -0.44 1.04 -2.00 0.00 0.00 179.45 178.72 3i9t n GLN 70 N -4.68 0.02 -2.73 0.07 1.13 -1.26 -4.01 117.38 105.92 3i9t n GLN 70 Ca 0.21 -0.01 -0.42 0.00 -1.94 0.00 0.00 57.00 54.84 3i9t n GLN 70 Cb 0.52 -1.50 -0.03 0.00 0.11 0.00 0.00 30.24 29.34 3i9t n GLN 70 CO 0.00 0.00 0.00 1.21 -1.44 0.00 0.00 177.06 176.83 3i9t s ASN 71 N -2.99 7.27 0.34 1.08 3.84 -0.63 -4.85 114.94 118.99 3i9t s ASN 71 Ca 0.12 1.54 0.23 0.00 0.21 0.00 0.00 52.86 54.96 3i9t s ASN 71 Cb 0.18 -2.55 1.23 0.00 -0.55 0.00 0.00 41.25 39.56 3i9t s ASN 71 CO 0.68 -0.35 1.70 1.55 -2.79 0.00 0.00 177.10 177.88 3i9t h PRO 72 N 6.98 0.00 -0.00 0.43 0.13 -1.89 0.26 132.00 137.91 3i9t h PRO 72 Ca -0.35 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.78 3i9t h PRO 72 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 3i9t h PRO 72 CO 0.81 0.00 -0.03 1.33 -0.23 0.00 0.00 178.00 179.88 3i9t n VAL 73 N -2.30 0.00 0.00 1.56 0.24 -1.26 -4.07 118.33 112.51 3i9t n VAL 73 Ca -0.01 -0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.28 3i9t n VAL 73 Cb 0.04 -0.44 0.00 0.00 -1.47 0.00 0.00 33.84 31.97 3i9t n VAL 73 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3i9t n TYR 74 N -1.39 0.00 -0.26 6.34 9.36 0.02 -4.76 117.16 126.47 3i9t n TYR 74 Ca 0.10 0.00 0.26 0.00 3.32 0.00 0.00 57.90 61.58 3i9t n TYR 74 Cb 0.30 0.00 0.63 0.00 -0.63 0.00 0.00 39.34 39.64 3i9t n TYR 74 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 3i9t h ALA 75 N 0.00 2.61 0.00 2.98 0.00 -0.72 -0.32 119.26 123.81 3i9t h ALA 75 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3i9t h ALA 75 Cb 0.59 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.42 3i9t h ALA 75 CO 0.00 -0.93 0.00 -1.35 0.00 0.00 0.00 179.25 176.97 3i9t h PRO 76 N 0.19 0.00 -0.66 0.00 0.11 -1.86 -2.31 132.00 127.47 3i9t h PRO 76 Ca 0.51 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.62 3i9t h PRO 76 Cb 1.65 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.76 3i9t h PRO 76 CO -0.12 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 178.95 3i9t n LEU 77 N -2.98 3.80 -4.56 2.35 4.77 -0.13 -4.87 117.00 115.39 3i9t n LEU 77 Ca -0.02 -1.95 -0.38 0.00 -0.03 0.00 0.00 56.01 53.63 3i9t n LEU 77 Cb 0.09 -0.44 -0.03 0.00 -2.33 0.00 0.00 43.42 40.70 3i9t n LEU 77 CO 0.19 0.94 1.38 -0.47 -1.33 0.00 0.00 177.39 178.10 3i9t s TYR 78 N -1.04 2.15 -0.51 -1.77 5.04 -0.87 -4.86 117.35 115.50 3i9t s TYR 78 Ca 0.45 -0.02 0.07 0.00 -2.44 0.00 0.00 57.07 55.14 3i9t s TYR 78 Cb 0.24 -4.44 0.26 0.00 0.35 0.00 0.00 41.96 38.37 3i9t s TYR 78 CO 0.31 -2.02 0.66 1.19 -1.34 0.00 0.00 175.55 174.36 3i9t n PHE 79 N 10.72 1.71 -0.31 4.97 3.72 -1.26 -4.97 117.46 132.05 3i9t n PHE 79 Ca 0.23 -3.87 -0.04 0.00 -0.05 0.00 0.00 57.45 53.72 3i9t n PHE 79 Cb 0.50 -0.45 0.08 0.00 -0.94 0.00 0.00 39.48 38.66 3i9t n PHE 79 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 3i9t h PRO 80 N 3.93 1.15 -0.05 -1.08 0.13 -1.97 -1.63 132.00 132.48 3i9t h PRO 80 Ca 0.13 -0.12 -0.00 0.00 -0.87 0.00 0.00 66.00 65.14 3i9t h PRO 80 Cb 0.77 -0.24 -0.00 0.00 0.13 0.00 0.00 31.00 31.66 3i9t h PRO 80 CO 0.65 0.83 0.02 1.49 -0.23 0.00 0.00 178.00 180.76 3i9t h GLU 81 N 1.16 0.08 -0.41 0.86 4.57 -1.94 -2.05 114.58 116.85 3i9t h GLU 81 Ca 0.30 -0.01 -0.11 0.00 -1.18 0.00 0.00 59.36 58.36 3i9t h GLU 81 Cb -0.01 -0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 28.55 3i9t h GLU 81 CO -0.05 0.19 -0.17 0.93 -1.18 0.00 0.00 179.01 178.73 3i9t h GLU 82 N -0.06 0.84 0.00 1.92 3.07 -1.85 -3.42 114.58 115.09 3i9t h GLU 82 Ca 0.02 -0.35 -0.13 0.00 -0.50 0.00 0.00 59.36 58.39 3i9t h GLU 82 Cb 0.14 -0.03 -0.02 0.00 -0.84 0.00 0.00 28.75 28.00 3i9t h GLU 82 CO -0.00 0.99 -1.51 1.28 -1.40 0.00 0.00 179.01 178.37 3i9t n LEU 83 N -4.25 2.03 -4.71 1.33 4.77 -0.62 -4.65 117.00 110.90 3i9t n LEU 83 Ca -0.01 -0.03 -0.42 0.00 -0.03 0.00 0.00 56.01 55.52 3i9t n LEU 83 Cb 0.41 -0.16 0.00 0.00 -2.33 0.00 0.00 43.42 41.34 3i9t n LEU 83 CO 0.44 0.50 0.94 1.41 -1.33 0.00 0.00 177.39 179.35 3i9t n HIS 84 N -2.60 2.36 0.08 -1.77 8.25 -0.78 -4.91 115.22 115.85 3i9t n HIS 84 Ca -0.15 0.52 0.04 0.00 -0.26 0.00 0.00 57.72 57.87 3i9t n HIS 84 Cb 0.69 -2.42 -0.06 0.00 1.12 0.00 0.00 29.99 29.31 3i9t n HIS 84 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 3i9t n ARG 85 N 0.34 1.06 -0.18 -0.41 5.12 -1.26 -4.73 116.66 116.61 3i9t n ARG 85 Ca 0.05 -0.06 -0.03 0.00 -1.93 0.00 0.00 57.85 55.88 3i9t n ARG 85 Cb 0.38 -1.14 0.07 0.00 -1.16 0.00 0.00 32.46 30.61 3i9t n ARG 85 CO 0.00 0.00 0.00 -0.09 -1.93 0.00 0.00 177.63 175.61 3i9t h ARG 86 N 0.00 0.41 -0.61 5.56 2.43 -1.91 -0.81 114.38 119.45 3i9t h ARG 86 Ca 0.00 -0.02 0.03 0.00 -0.81 0.00 0.00 59.98 59.18 3i9t h ARG 86 Cb 0.36 -0.09 -0.04 0.00 -0.42 0.00 0.00 29.97 29.77 3i9t h ARG 86 CO 0.00 0.27 0.37 0.00 -1.51 0.00 0.00 179.97 179.10 3i9t h ALA 87 N 1.34 0.80 -0.51 2.80 0.00 -2.00 0.11 119.26 121.81 3i9t h ALA 87 Ca 0.25 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.17 3i9t h ALA 87 Cb 0.25 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 3i9t h ALA 87 CO -0.23 0.10 0.31 0.00 0.00 0.00 0.00 179.25 179.43 3i9t h ALA 88 N 1.28 0.65 -0.60 0.00 0.00 -1.72 -2.45 119.26 116.41 3i9t h ALA 88 Ca 0.25 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.13 3i9t h ALA 88 Cb 0.05 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 3i9t h ALA 88 CO -0.11 0.01 0.28 -0.07 0.00 0.00 0.00 179.25 179.36 3i9t h LEU 89 N 0.61 0.76 -0.71 0.00 3.38 -0.86 -1.00 115.31 117.49 3i9t h LEU 89 Ca 0.20 -0.08 -0.11 0.00 0.09 0.00 0.00 57.88 57.99 3i9t h LEU 89 Cb 0.01 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 3i9t h LEU 89 CO -0.08 0.66 -0.14 -0.33 0.09 0.00 0.00 178.44 178.63 3i9t h GLU 90 N 0.85 0.85 -0.36 1.13 5.08 -0.75 0.20 114.58 121.57 3i9t h GLU 90 Ca 0.21 -0.31 -0.04 0.00 -1.00 0.00 0.00 59.36 58.22 3i9t h GLU 90 Cb 0.10 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 3i9t h GLU 90 CO -0.03 0.94 0.07 1.96 -1.00 0.00 0.00 179.01 180.95 3i9t h GLN 91 N 0.76 0.59 -0.71 2.33 4.20 -0.93 -2.28 115.11 119.06 3i9t h GLN 91 Ca 0.12 -0.15 -0.04 0.00 0.06 0.00 0.00 58.65 58.64 3i9t h GLN 91 Cb 0.66 -0.07 -0.03 0.00 0.30 0.00 0.00 27.48 28.33 3i9t h GLN 91 CO 0.05 0.65 0.29 -0.44 -0.67 0.00 0.00 178.83 178.71 3i9t h ASP 92 N 0.43 0.96 -0.78 1.46 3.45 -0.91 -1.21 116.42 119.83 3i9t h ASP 92 Ca 0.11 -0.13 -0.05 0.00 0.43 0.00 0.00 57.03 57.38 3i9t h ASP 92 Cb 0.33 -0.25 -0.03 0.00 -0.56 0.00 0.00 39.33 38.82 3i9t h ASP 92 CO 0.00 0.85 0.28 0.24 -1.57 0.00 0.00 179.24 179.04 3i9t h MET 93 N 1.03 1.19 -0.31 3.56 2.86 -0.48 0.99 114.93 123.77 3i9t h MET 93 Ca 0.24 -0.23 -0.08 0.00 -2.06 0.00 0.00 59.70 57.56 3i9t h MET 93 Cb 0.18 -0.18 -0.02 0.00 0.06 0.00 0.00 31.60 31.64 3i9t h MET 93 CO -0.02 0.98 -0.16 0.00 1.06 0.00 0.00 176.91 178.77 3i9t h ALA 94 N 1.15 1.14 0.33 6.32 0.00 -0.77 0.30 119.26 127.72 3i9t h ALA 94 Ca 0.26 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 3i9t h ALA 94 Cb 0.26 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.91 3i9t h ALA 94 CO -0.02 0.54 -0.16 0.35 0.00 0.00 0.00 179.25 179.97 3i9t h PHE 95 N 0.51 -0.41 0.15 0.00 3.57 -0.92 -0.68 116.94 119.16 3i9t h PHE 95 Ca 0.09 -0.01 -0.29 0.00 3.53 0.00 0.00 57.97 61.29 3i9t h PHE 95 Cb 0.57 0.14 0.01 0.00 2.79 0.00 0.00 35.95 39.45 3i9t h PHE 95 CO 0.02 -0.12 -1.30 -1.49 -2.23 0.00 0.00 178.31 173.20 3i9t h TRP 96 N -0.68 0.57 -0.01 0.41 4.06 -0.69 -3.38 115.95 116.22 3i9t h TRP 96 Ca -0.05 -0.41 0.00 0.00 2.06 0.00 0.00 58.89 60.49 3i9t h TRP 96 Cb 0.48 -0.02 0.00 0.00 -1.00 0.00 0.00 29.16 28.61 3i9t h TRP 96 CO 0.00 1.33 -0.21 0.66 -3.56 0.00 0.00 178.44 176.66 3i9t n TYR 97 N -3.55 0.00 -0.02 0.49 4.01 0.08 -5.08 117.16 113.08 3i9t n TYR 97 Ca -0.10 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.64 3i9t n TYR 97 Cb 1.04 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 40.07 3i9t n TYR 97 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3i9t n GLY 98 N 0.90 -3.52 0.29 2.72 0.00 -0.26 -4.28 105.19 101.05 3i9t n GLY 98 Ca 0.04 -1.88 0.18 0.00 0.00 0.00 0.00 46.02 44.37 3i9t n GLY 98 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3i9t h PRO 99 N 0.00 0.00 -0.93 1.61 0.13 -1.91 -2.55 132.00 128.35 3i9t h PRO 99 Ca 0.00 0.00 -0.59 0.00 -0.87 0.00 0.00 66.00 64.54 3i9t h PRO 99 Cb 0.00 0.00 -0.29 0.00 0.13 0.00 0.00 31.00 30.84 3i9t h PRO 99 CO 0.00 0.02 0.59 0.72 -0.23 0.00 0.00 178.00 179.10 3i9t n HIS 100 N -3.16 2.98 -0.05 1.56 8.25 -1.26 -4.77 115.22 118.77 3i9t n HIS 100 Ca -0.01 -2.53 0.11 0.00 -0.26 0.00 0.00 57.72 55.03 3i9t n HIS 100 Cb 0.23 -1.14 0.50 0.00 1.12 0.00 0.00 29.99 30.69 3i9t n HIS 100 CO 0.00 0.00 0.00 0.11 0.64 0.00 0.00 176.34 177.09 3i9t h TRP 101 N 1.67 0.42 -0.83 4.41 5.08 -1.64 -2.17 115.95 122.89 3i9t h TRP 101 Ca 0.57 0.01 0.08 0.00 1.08 0.00 0.00 58.89 60.63 3i9t h TRP 101 Cb 1.51 -0.14 -0.06 0.00 -3.00 0.00 0.00 29.16 27.47 3i9t h TRP 101 CO 1.40 0.21 0.54 1.96 -1.28 0.00 0.00 178.44 181.27 3i9t h GLN 102 N 0.41 0.81 0.00 0.12 7.50 -1.88 0.80 115.11 122.86 3i9t h GLN 102 Ca 0.24 -0.05 0.00 0.00 0.50 0.00 0.00 58.65 59.34 3i9t h GLN 102 Cb 0.43 -0.18 0.00 0.00 0.05 0.00 0.00 27.48 27.78 3i9t h GLN 102 CO -0.06 0.54 -0.43 1.05 -1.50 0.00 0.00 178.83 178.43 3i9t h GLU 103 N 0.84 0.00 0.00 1.46 9.09 -1.80 -3.36 114.58 120.81 3i9t h GLU 103 Ca 0.37 0.00 -0.24 0.00 0.05 0.00 0.00 59.36 59.54 3i9t h GLU 103 Cb 0.35 0.00 -0.04 0.00 -1.65 0.00 0.00 28.75 27.41 3i9t h GLU 103 CO -0.14 0.00 -1.71 0.00 0.05 0.00 0.00 179.01 177.20 3i9t n ALA 104 N -2.03 1.73 -1.77 1.06 0.00 -0.24 -4.98 120.51 114.29 3i9t n ALA 104 Ca 0.03 -0.76 -0.39 0.00 0.00 0.00 0.00 53.44 52.32 3i9t n ALA 104 Cb 0.51 -0.78 -0.02 0.00 0.00 0.00 0.00 19.45 19.15 3i9t n ALA 104 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 3i9t s ILE 105 N -2.76 3.12 0.68 0.00 -4.36 0.11 -5.00 121.20 113.00 3i9t s ILE 105 Ca -0.05 1.02 -0.11 0.00 -0.26 0.00 0.00 60.65 61.25 3i9t s ILE 105 Cb 0.08 -3.61 -0.00 0.00 1.25 0.00 0.00 42.46 40.18 3i9t s ILE 105 CO 0.82 0.16 1.05 -2.16 0.24 0.00 0.00 174.94 175.06 3i9t s PRO 106 N -2.01 3.09 -0.41 0.37 0.04 -1.26 -5.04 135.00 129.78 3i9t s PRO 106 Ca 0.53 0.85 0.02 0.00 0.04 0.00 0.00 61.00 62.43 3i9t s PRO 106 Cb -0.33 -2.01 0.15 0.00 0.04 0.00 0.00 34.50 32.34 3i9t s PRO 106 CO 0.42 -0.96 0.26 -0.47 0.04 0.00 0.00 177.00 176.29 3i9t s TYR 107 N -3.11 1.35 0.72 0.56 5.04 -1.26 -4.64 117.35 116.02 3i9t s TYR 107 Ca 0.57 -2.10 -0.11 0.00 -2.44 0.00 0.00 57.07 52.99 3i9t s TYR 107 Cb -0.13 -1.33 0.02 0.00 0.35 0.00 0.00 41.96 40.87 3i9t s TYR 107 CO 0.55 -0.80 1.07 0.95 -1.34 0.00 0.00 175.55 175.98 3i9t s THR 108 N 0.53 3.73 0.17 4.34 -4.23 -1.26 -4.80 115.64 114.11 3i9t s THR 108 Ca 0.21 0.56 -0.14 0.00 -1.18 0.00 0.00 61.69 61.14 3i9t s THR 108 Cb -0.18 -3.34 0.06 0.00 1.34 0.00 0.00 72.50 70.38 3i9t s THR 108 CO -0.04 -0.73 1.76 -0.65 -0.54 0.00 0.00 174.62 174.42 3i9t h PRO 109 N -0.81 0.33 -0.44 3.99 0.11 -2.01 0.59 132.00 133.78 3i9t h PRO 109 Ca -0.45 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.64 3i9t h PRO 109 Cb 1.23 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 32.24 3i9t h PRO 109 CO 0.58 0.22 0.25 0.00 -0.21 0.00 0.00 178.00 178.85 3i9t h ALA 110 N 1.28 1.62 -0.16 -0.75 0.00 -1.94 -1.21 119.26 118.10 3i9t h ALA 110 Ca 0.20 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 55.01 3i9t h ALA 110 Cb 0.18 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 3i9t h ALA 110 CO -0.20 0.33 -0.04 1.15 0.00 0.00 0.00 179.25 180.49 3i9t h THR 111 N 0.60 1.29 -0.97 0.00 2.02 -1.79 -1.94 112.91 112.12 3i9t h THR 111 Ca 0.16 -1.02 0.15 0.00 0.77 0.00 0.00 66.41 66.47 3i9t h THR 111 Cb -0.00 1.64 -0.09 0.00 -1.74 0.00 0.00 68.15 67.96 3i9t h THR 111 CO -0.03 0.30 0.61 1.56 0.37 0.00 0.00 175.52 178.33 3i9t h GLN 112 N 0.01 0.79 -0.11 6.66 4.20 -0.64 -0.82 115.11 125.20 3i9t h GLN 112 Ca 0.04 -0.05 -0.03 0.00 0.06 0.00 0.00 58.65 58.67 3i9t h GLN 112 Cb 0.48 -0.18 -0.00 0.00 0.30 0.00 0.00 27.48 28.08 3i9t h GLN 112 CO 0.02 0.52 -0.05 1.25 -0.67 0.00 0.00 178.83 179.90 3i9t h HIS 113 N 0.82 0.27 -0.01 2.96 2.76 -1.11 -0.07 115.15 120.77 3i9t h HIS 113 Ca 0.50 -0.07 0.01 0.00 -2.20 0.00 0.00 60.37 58.62 3i9t h HIS 113 Cb 0.70 -0.06 -0.01 0.00 1.55 0.00 0.00 27.41 29.59 3i9t h HIS 113 CO -0.00 0.57 -0.06 -0.92 -1.30 0.00 0.00 177.93 176.22 3i9t h TYR 114 N -0.11 -0.14 -0.95 5.26 5.03 -1.18 -1.54 116.97 123.34 3i9t h TYR 114 Ca 0.03 0.01 0.12 0.00 2.58 0.00 0.00 58.73 61.47 3i9t h TYR 114 Cb 0.50 0.06 -0.08 0.00 1.55 0.00 0.00 36.73 38.76 3i9t h TYR 114 CO 0.06 -0.09 0.61 0.28 -1.32 0.00 0.00 178.16 177.70 3i9t h VAL 115 N -0.09 0.90 -0.28 1.81 2.07 -1.09 -0.94 116.25 118.62 3i9t h VAL 115 Ca 0.03 -0.30 -0.05 0.00 0.82 0.00 0.00 66.70 67.19 3i9t h VAL 115 Cb 0.13 -0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 29.82 3i9t h VAL 115 CO -0.07 0.16 -0.02 0.50 0.02 0.00 0.00 177.57 178.16 3i9t h LYS 116 N 0.88 0.51 -0.68 1.57 3.64 -0.55 -1.06 116.57 120.89 3i9t h LYS 116 Ca 0.47 -0.17 -0.07 0.00 -1.27 0.00 0.00 60.65 59.61 3i9t h LYS 116 Cb 0.55 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 32.30 3i9t h LYS 116 CO -0.24 0.68 0.16 -0.09 -2.27 0.00 0.00 179.45 177.70 3i9t h ARG 117 N 0.29 1.08 -0.71 1.90 9.65 -0.74 -1.60 114.38 124.25 3i9t h ARG 117 Ca 0.08 -0.25 0.01 0.00 -1.10 0.00 0.00 59.98 58.71 3i9t h ARG 117 Cb 0.47 -0.15 -0.04 0.00 -1.39 0.00 0.00 29.97 28.86 3i9t h ARG 117 CO 0.02 0.95 0.47 -0.07 2.80 0.00 0.00 179.97 184.14 3i9t h LEU 118 N 1.02 0.81 -1.05 3.80 3.38 -0.82 0.25 115.31 122.70 3i9t h LEU 118 Ca 0.21 -0.02 -0.06 0.00 0.09 0.00 0.00 57.88 58.10 3i9t h LEU 118 Cb 0.36 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 3i9t h LEU 118 CO 0.00 0.58 0.00 0.45 0.09 0.00 0.00 178.44 179.57 3i9t h HIS 119 N 0.95 0.71 0.08 1.13 3.86 -0.99 -0.10 115.15 120.79 3i9t h HIS 119 Ca 0.26 -0.09 -0.00 0.00 -1.16 0.00 0.00 60.37 59.38 3i9t h HIS 119 Cb -0.10 -0.20 0.00 0.00 1.06 0.00 0.00 27.41 28.18 3i9t h HIS 119 CO -0.03 0.67 -0.04 0.93 0.86 0.00 0.00 177.93 180.33 3i9t h GLU 120 N 0.64 -0.10 0.21 2.45 5.08 -0.83 0.61 114.58 122.64 3i9t h GLU 120 Ca 0.13 0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.49 3i9t h GLU 120 Cb 0.39 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.66 3i9t h GLU 120 CO 0.01 0.05 -0.13 0.28 -1.00 0.00 0.00 179.01 178.23 3i9t h VAL 121 N -0.23 0.73 -0.54 3.13 2.07 -0.92 0.29 116.25 120.78 3i9t h VAL 121 Ca -0.01 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.44 3i9t h VAL 121 Cb 0.19 0.73 -0.02 0.00 -1.52 0.00 0.00 31.29 30.67 3i9t h VAL 121 CO 0.02 0.00 0.07 1.23 0.02 0.00 0.00 177.57 178.91 3i9t h GLY 122 N -0.32 0.93 1.58 2.17 0.00 -1.01 0.20 103.07 106.62 3i9t h GLY 122 Ca -0.02 -0.59 -0.27 0.00 0.00 0.00 0.00 47.33 46.45 3i9t h GLY 122 CO 0.02 0.55 -1.28 -1.33 0.00 0.00 0.00 176.54 174.50 3i9t h GLY 123 N 0.99 0.19 0.00 4.60 0.00 -0.76 -3.40 103.07 104.69 3i9t h GLY 123 Ca 0.17 -0.49 0.00 0.00 0.00 0.00 0.00 47.33 47.01 3i9t h GLY 123 CO 0.01 0.43 -0.72 2.41 0.00 0.00 0.00 176.54 178.67 3i9t n THR 124 N -3.42 0.00 -2.93 4.70 -1.04 1.00 -4.84 114.28 107.74 3i9t n THR 124 Ca -0.09 0.00 -0.22 0.00 -2.04 0.00 0.00 64.05 61.70 3i9t n THR 124 Cb 1.01 -0.71 -0.02 0.00 -1.82 0.00 0.00 70.33 68.78 3i9t n THR 124 CO 0.00 0.00 0.00 1.41 -0.64 0.00 0.00 175.07 175.84 3i9t n HIS 125 N -1.58 2.46 0.30 -1.42 8.25 0.59 -4.93 115.22 118.89 3i9t n HIS 125 Ca 0.00 -3.71 0.19 0.00 -0.26 0.00 0.00 57.72 53.94 3i9t n HIS 125 Cb 0.36 -0.40 0.96 0.00 1.12 0.00 0.00 29.99 32.02 3i9t n HIS 125 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 3i9t h PRO 126 N 2.93 0.00 0.00 -0.41 0.13 -1.51 0.36 132.00 133.51 3i9t h PRO 126 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 3i9t h PRO 126 Cb 0.77 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.90 3i9t h PRO 126 CO 0.69 0.03 0.00 -0.85 -0.23 0.00 0.00 178.00 177.64 3i9t n GLU 127 N -3.26 0.16 0.00 0.86 0.00 -1.26 -1.53 120.64 115.61 3i9t n GLU 127 Ca -0.02 0.57 0.12 0.00 0.00 0.00 0.00 57.16 57.83 3i9t n GLU 127 Cb 0.17 -1.94 0.08 0.00 0.00 0.00 0.00 31.44 29.74 3i9t n GLU 127 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 3i9t n LEU 128 N -2.27 2.50 0.25 -1.84 4.77 0.12 -4.44 117.00 116.09 3i9t n LEU 128 Ca -0.00 -0.87 0.08 0.00 -0.03 0.00 0.00 56.01 55.19 3i9t n LEU 128 Cb 0.10 -0.00 0.62 0.00 -2.33 0.00 0.00 43.42 41.81 3i9t n LEU 128 CO 0.13 0.43 1.00 0.25 -1.33 0.00 0.00 177.39 177.88 3i9t h LEU 129 N 3.60 0.00 -1.67 2.23 5.85 -1.37 -1.41 115.31 122.55 3i9t h LEU 129 Ca 0.00 0.00 0.05 0.00 0.84 0.00 0.00 57.88 58.77 3i9t h LEU 129 Cb 0.87 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.88 3i9t h LEU 129 CO 0.00 0.09 0.31 1.62 -0.34 0.00 0.00 178.44 180.12 3i9t h VAL 130 N 0.00 0.98 -0.82 1.05 3.04 -1.78 -0.80 116.25 117.92 3i9t h VAL 130 Ca -0.00 -0.14 0.08 0.00 -1.01 0.00 0.00 66.70 65.62 3i9t h VAL 130 Cb 0.16 0.53 -0.07 0.00 -2.01 0.00 0.00 31.29 29.91 3i9t h VAL 130 CO 0.01 0.08 0.48 0.00 -1.01 0.00 0.00 177.57 177.13 3i9t h ALA 131 N 1.75 1.14 0.06 3.17 0.00 -1.53 0.03 119.26 123.88 3i9t h ALA 131 Ca 0.20 0.01 -0.26 0.00 0.00 0.00 0.00 54.91 54.86 3i9t h ALA 131 Cb 0.27 -0.17 0.01 0.00 0.00 0.00 0.00 17.79 17.90 3i9t h ALA 131 CO -0.05 0.16 -1.10 0.45 0.00 0.00 0.00 179.25 178.71 3i9t h HIS 132 N 0.85 0.76 -0.36 0.00 -0.00 -1.27 -2.27 115.15 112.84 3i9t h HIS 132 Ca 0.38 -0.45 -0.06 0.00 -0.00 0.00 0.00 60.37 60.23 3i9t h HIS 132 Cb 0.27 -0.07 -0.01 0.00 -0.00 0.00 0.00 27.41 27.59 3i9t h HIS 132 CO -0.05 1.30 -0.00 0.00 -0.00 0.00 0.00 177.93 179.18 3i9t h ALA 133 N 0.54 0.49 -0.21 2.45 0.00 -1.30 -2.92 119.26 118.31 3i9t h ALA 133 Ca -0.13 -0.25 0.04 0.00 0.00 0.00 0.00 54.91 54.57 3i9t h ALA 133 Cb 1.76 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 19.38 3i9t h ALA 133 CO 0.20 0.25 -0.03 -0.92 0.00 0.00 0.00 179.25 178.75 3i9t h TYR 134 N 0.45 -0.06 -0.68 0.00 3.20 -1.02 -0.18 116.97 118.67 3i9t h TYR 134 Ca 0.10 0.02 -0.06 0.00 3.14 0.00 0.00 58.73 61.93 3i9t h TYR 134 Cb 0.46 0.06 -0.03 0.00 1.54 0.00 0.00 36.73 38.76 3i9t h TYR 134 CO 0.04 -0.06 0.18 1.15 -1.64 0.00 0.00 178.16 177.82 3i9t h THR 135 N 0.03 1.26 0.00 1.81 2.02 -1.36 -2.44 112.91 114.23 3i9t h THR 135 Ca 0.10 -0.93 0.00 0.00 0.77 0.00 0.00 66.41 66.36 3i9t h THR 135 Cb 0.14 0.54 0.00 0.00 -1.74 0.00 0.00 68.15 67.09 3i9t h THR 135 CO -0.20 0.36 -0.01 0.03 0.37 0.00 0.00 175.52 176.06 3i9t h ARG 136 N 1.02 0.00 -0.81 6.66 2.47 -1.44 -3.33 114.38 118.96 3i9t h ARG 136 Ca 0.22 0.00 0.01 0.00 -1.26 0.00 0.00 59.98 58.94 3i9t h ARG 136 Cb 0.34 0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 28.62 3i9t h ARG 136 CO -0.00 0.00 0.53 1.88 0.56 0.00 0.00 179.97 182.94 3i9t h TYR 137 N -0.17 1.03 -0.40 3.04 0.05 -1.12 0.04 116.97 119.43 3i9t h TYR 137 Ca 0.00 0.02 -0.07 0.00 0.05 0.00 0.00 58.73 58.73 3i9t h TYR 137 Cb 0.01 -0.35 -0.02 0.00 1.01 0.00 0.00 36.73 37.39 3i9t h TYR 137 CO -0.01 0.65 -0.04 -0.07 -1.05 0.00 0.00 178.16 177.65 3i9t h LEU 138 N 1.10 0.64 -0.26 3.88 3.38 -1.55 -1.36 115.31 121.15 3i9t h LEU 138 Ca 0.29 -0.16 -0.06 0.00 0.09 0.00 0.00 57.88 58.05 3i9t h LEU 138 Cb -0.11 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.46 3i9t h LEU 138 CO -0.06 0.74 -0.07 1.23 0.09 0.00 0.00 178.44 180.37 3i9t h GLY 139 N 0.94 0.55 0.69 0.83 0.00 -1.60 -2.67 103.07 101.81 3i9t h GLY 139 Ca 0.12 -0.46 0.14 0.00 0.00 0.00 0.00 47.33 47.14 3i9t h GLY 139 CO 0.02 0.42 0.51 -0.55 0.00 0.00 0.00 176.54 176.94 3i9t h ASP 140 N 0.25 0.42 -0.02 0.19 3.45 -0.61 0.26 116.42 120.36 3i9t h ASP 140 Ca 0.07 0.02 0.00 0.00 0.43 0.00 0.00 57.03 57.55 3i9t h ASP 140 Cb 0.54 -0.06 0.00 0.00 -0.56 0.00 0.00 39.33 39.25 3i9t h ASP 140 CO 0.03 0.22 0.00 0.18 -1.57 0.00 0.00 179.24 178.10 3i9t n LEU 141 N -4.49 0.58 0.00 1.55 4.77 -0.54 -3.68 117.00 115.18 3i9t n LEU 141 Ca 0.14 -0.20 0.00 0.00 -0.03 0.00 0.00 56.01 55.92 3i9t n LEU 141 Cb 0.51 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.59 3i9t n LEU 141 CO 0.32 0.10 0.00 -1.20 -1.33 0.00 0.00 177.39 175.29 3i9t n SER 142 N -0.52 0.00 0.25 -1.43 7.64 0.83 -4.76 113.62 115.64 3i9t n SER 142 Ca 0.21 0.00 0.09 0.00 1.01 0.00 0.00 58.87 60.18 3i9t n SER 142 Cb 0.19 0.00 0.65 0.00 -1.01 0.00 0.00 64.21 64.05 3i9t n SER 142 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 3i9t h GLY 143 N 0.00 0.00 1.07 0.23 0.00 -1.79 -1.72 103.07 100.87 3i9t h GLY 143 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 47.33 47.44 3i9t h GLY 143 CO 0.00 0.00 0.36 -1.33 0.00 0.00 0.00 176.54 175.57 3i9t h GLY 144 N 0.43 0.34 1.72 4.60 0.00 -1.50 0.12 103.07 108.79 3i9t h GLY 144 Ca -0.00 -0.10 -0.13 0.00 0.00 0.00 0.00 47.33 47.10 3i9t h GLY 144 CO 0.01 0.05 -0.49 1.46 0.00 0.00 0.00 176.54 177.58 3i9t h GLN 145 N 0.24 0.30 -0.09 4.80 1.08 -1.38 -1.08 115.11 118.97 3i9t h GLN 145 Ca 0.25 -0.17 -0.07 0.00 -1.45 0.00 0.00 58.65 57.21 3i9t h GLN 145 Cb 0.67 0.01 0.00 0.00 -0.05 0.00 0.00 27.48 28.11 3i9t h GLN 145 CO -0.05 0.73 -0.21 0.28 -0.95 0.00 0.00 178.83 178.62 3i9t h VAL 146 N 0.24 1.40 -0.68 -0.54 2.07 -0.96 -3.06 116.25 114.72 3i9t h VAL 146 Ca 0.01 -1.53 0.02 0.00 0.82 0.00 0.00 66.70 66.02 3i9t h VAL 146 Cb 0.96 2.18 -0.04 0.00 -1.52 0.00 0.00 31.29 32.86 3i9t h VAL 146 CO 0.08 0.44 0.43 -0.07 0.02 0.00 0.00 177.57 178.47 3i9t h LEU 147 N -0.16 0.72 -0.64 2.57 3.38 -0.76 -1.98 115.31 118.45 3i9t h LEU 147 Ca -0.00 -0.01 0.13 0.00 0.09 0.00 0.00 57.88 58.09 3i9t h LEU 147 Cb 0.82 -0.16 -0.12 0.00 0.09 0.00 0.00 40.66 41.29 3i9t h LEU 147 CO 0.05 0.51 -0.10 0.50 0.09 0.00 0.00 178.44 179.49 3i9t h LYS 148 N 0.86 0.04 -0.86 1.13 3.64 -1.25 0.03 116.57 120.16 3i9t h LYS 148 Ca 0.26 -0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.62 3i9t h LYS 148 Cb -0.02 -0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 31.75 3i9t h LYS 148 CO -0.09 0.03 0.46 0.87 -2.27 0.00 0.00 179.45 178.44 3i9t h LYS 149 N 0.04 1.21 -0.01 1.90 1.57 -1.26 -1.03 116.57 118.99 3i9t h LYS 149 Ca 0.32 -0.15 -0.00 0.00 -1.87 0.00 0.00 60.65 58.95 3i9t h LYS 149 Cb 0.51 -0.23 -0.00 0.00 0.08 0.00 0.00 32.23 32.58 3i9t h LYS 149 CO -0.62 0.89 0.00 0.82 -0.57 0.00 0.00 179.45 179.98 3i9t h ILE 150 N 1.21 1.17 -0.62 1.86 2.04 -0.95 -2.10 117.51 120.12 3i9t h ILE 150 Ca 0.30 -0.51 0.09 0.00 1.00 0.00 0.00 64.86 65.74 3i9t h ILE 150 Cb 0.05 1.50 -0.07 0.00 -0.74 0.00 0.00 36.82 37.56 3i9t h ILE 150 CO -0.05 0.13 0.26 0.00 0.00 0.00 0.00 178.15 178.50 3i9t h ALA 151 N 0.79 0.82 -0.23 1.87 0.00 -0.82 -0.22 119.26 121.46 3i9t h ALA 151 Ca 0.00 0.07 -0.13 0.00 0.00 0.00 0.00 54.91 54.86 3i9t h ALA 151 Cb 0.22 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 3i9t h ALA 151 CO -0.00 -0.15 -0.39 0.37 0.00 0.00 0.00 179.25 179.09 3i9t h GLN 152 N 0.46 0.54 -0.04 0.00 4.15 -1.11 -0.87 115.11 118.24 3i9t h GLN 152 Ca 0.31 -0.26 -0.04 0.00 0.77 0.00 0.00 58.65 59.42 3i9t h GLN 152 Cb 0.35 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.04 3i9t h GLN 152 CO -0.28 0.84 -0.15 -0.22 -1.93 0.00 0.00 178.83 177.09 3i9t h LYS 153 N 0.45 0.16 -0.48 1.69 3.64 -1.13 -0.82 116.57 120.07 3i9t h LYS 153 Ca 0.04 -0.13 0.03 0.00 -1.27 0.00 0.00 60.65 59.32 3i9t h LYS 153 Cb 0.87 0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 32.68 3i9t h LYS 153 CO 0.07 0.77 0.27 0.00 -2.27 0.00 0.00 179.45 178.30 3i9t h ALA 154 N 0.39 0.62 -0.21 5.00 0.00 -0.78 -3.23 119.26 121.05 3i9t h ALA 154 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3i9t h ALA 154 Cb 0.80 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.48 3i9t h ALA 154 CO 0.03 -0.05 0.00 -1.33 0.00 0.00 0.00 179.25 177.90 3i9t n MET 155 N -4.85 2.12 -3.23 0.00 2.81 -0.35 -4.97 117.12 108.65 3i9t n MET 155 Ca 0.03 -1.96 -0.15 0.00 -1.81 0.00 0.00 57.70 53.82 3i9t n MET 155 Cb 0.09 -1.42 0.08 0.00 -0.71 0.00 0.00 33.22 31.26 3i9t n MET 155 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3i9t n ALA 156 N 1.21 -1.68 -2.37 3.04 0.00 -0.73 -5.00 120.51 114.98 3i9t n ALA 156 Ca 0.15 -0.03 -0.38 0.00 0.00 0.00 0.00 53.44 53.17 3i9t n ALA 156 Cb 0.53 -2.27 -0.06 0.00 0.00 0.00 0.00 19.45 17.65 3i9t n ALA 156 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3i9t s LEU 157 N -5.74 4.50 0.57 0.00 1.43 -0.39 -5.05 118.68 114.01 3i9t s LEU 157 Ca 0.03 1.15 -0.17 0.00 -1.03 0.00 0.00 54.13 54.11 3i9t s LEU 157 Cb -0.01 -2.79 -0.04 0.00 0.03 0.00 0.00 46.19 43.37 3i9t s LEU 157 CO 0.62 0.28 1.06 -2.16 0.23 0.00 0.00 176.35 176.38 3i9t s PRO 158 N -1.01 3.38 0.54 1.29 0.04 -1.26 -4.80 135.00 133.18 3i9t s PRO 158 Ca 0.27 1.27 0.26 0.00 0.04 0.00 0.00 61.00 62.83 3i9t s PRO 158 Cb -0.18 -2.04 1.43 0.00 0.04 0.00 0.00 34.50 33.75 3i9t s PRO 158 CO 0.17 -0.77 2.01 0.77 0.04 0.00 0.00 177.00 179.22 3i9t h SER 159 N 0.67 0.00 0.36 6.66 0.02 -1.96 -1.61 113.55 117.69 3i9t h SER 159 Ca -0.47 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.48 3i9t h SER 159 Cb 1.22 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.76 3i9t h SER 159 CO 0.57 0.00 0.00 0.77 -1.14 0.00 0.00 176.83 177.03 3i9t h SER 160 N 0.00 0.00 0.00 3.07 4.64 -2.05 -3.46 113.55 115.75 3i9t h SER 160 Ca 0.21 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.53 3i9t h SER 160 Cb 0.91 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.00 3i9t h SER 160 CO -0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 3i9t n GLY 161 N -0.68 0.30 3.65 -0.77 0.00 -0.61 -5.05 105.19 102.04 3i9t n GLY 161 Ca -0.00 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.55 3i9t n GLY 161 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3i9t n GLU 162 N -1.84 1.86 -0.01 1.61 4.71 -1.26 -1.60 120.64 124.11 3i9t n GLU 162 Ca 0.00 0.67 0.00 0.00 -0.01 0.00 0.00 57.16 57.82 3i9t n GLU 162 Cb 0.00 -2.37 0.00 0.00 -1.01 0.00 0.00 31.44 28.06 3i9t n GLU 162 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 3i9t n GLY 163 N 2.87 1.43 0.76 0.62 0.00 -1.26 -4.53 105.19 105.07 3i9t n GLY 163 Ca 0.16 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.22 3i9t n GLY 163 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3i9t n LEU 164 N 0.00 1.39 -0.18 0.99 4.77 -0.63 -4.85 117.00 118.49 3i9t n LEU 164 Ca 0.00 -2.39 0.14 0.00 -0.03 0.00 0.00 56.01 53.73 3i9t n LEU 164 Cb 0.00 -0.20 0.47 0.00 -2.33 0.00 0.00 43.42 41.36 3i9t n LEU 164 CO 0.00 0.68 1.21 0.00 -1.33 0.00 0.00 177.39 177.95 3i9t h ALA 165 N 0.55 2.04 -0.99 -1.18 0.00 -1.79 -0.89 119.26 116.99 3i9t h ALA 165 Ca -0.07 0.00 0.23 0.00 0.00 0.00 0.00 54.91 55.07 3i9t h ALA 165 Cb 1.39 -0.08 -0.09 0.00 0.00 0.00 0.00 17.79 19.02 3i9t h ALA 165 CO 0.03 -0.24 0.64 0.35 0.00 0.00 0.00 179.25 180.03 3i9t h PHE 166 N 0.48 0.70 -0.31 0.00 3.57 -1.89 -1.10 116.94 118.39 3i9t h PHE 166 Ca 0.37 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.90 3i9t h PHE 166 Cb 0.77 -0.21 0.00 0.00 2.79 0.00 0.00 35.95 39.30 3i9t h PHE 166 CO -0.00 0.12 0.00 1.19 -2.23 0.00 0.00 178.31 177.39 3i9t n PHE 167 N -4.61 0.40 -4.70 0.41 3.72 -0.34 -4.85 117.46 107.49 3i9t n PHE 167 Ca 0.23 -0.20 -0.33 0.00 -0.05 0.00 0.00 57.45 57.10 3i9t n PHE 167 Cb 0.76 0.00 -0.15 0.00 -0.94 0.00 0.00 39.48 39.15 3i9t n PHE 167 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 3i9t s THR 168 N -1.60 2.77 -0.76 4.37 2.01 -0.42 -4.88 115.64 117.14 3i9t s THR 168 Ca 0.36 -0.75 -0.02 0.00 0.31 0.00 0.00 61.69 61.59 3i9t s THR 168 Cb 0.20 -2.16 0.19 0.00 0.01 0.00 0.00 72.50 70.75 3i9t s THR 168 CO 0.29 0.52 0.60 -0.36 -0.69 0.00 0.00 174.62 174.98 3i9t s PHE 169 N 0.58 3.63 -0.76 4.92 0.40 -1.26 -4.95 117.98 120.55 3i9t s PHE 169 Ca -0.09 -2.88 0.17 0.00 -0.60 0.00 0.00 56.93 53.53 3i9t s PHE 169 Cb -0.16 -3.20 0.75 0.00 0.51 0.00 0.00 43.02 40.92 3i9t s PHE 169 CO 0.03 -0.78 1.54 -0.35 0.70 0.00 0.00 175.22 176.37 3i9t n PRO 170 N 2.88 0.08 -0.18 0.24 -0.04 -1.26 -2.27 135.00 134.45 3i9t n PRO 170 Ca 0.15 0.35 0.10 0.00 -0.04 0.00 0.00 63.50 64.06 3i9t n PRO 170 Cb 0.37 -1.67 0.19 0.00 -0.04 0.00 0.00 33.50 32.36 3i9t n PRO 170 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 3i9t n SER 171 N -1.82 3.22 -4.19 3.54 7.64 -1.26 -4.77 113.62 115.98 3i9t n SER 171 Ca 0.02 -1.93 -0.36 0.00 1.01 0.00 0.00 58.87 57.62 3i9t n SER 171 Cb 0.18 -0.23 -0.13 0.00 -1.01 0.00 0.00 64.21 63.01 3i9t n SER 171 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 3i9t s ILE 172 N -1.29 3.16 0.16 0.44 1.01 -0.96 -4.78 121.20 118.93 3i9t s ILE 172 Ca 0.34 -1.40 -0.16 0.00 0.00 0.00 0.00 60.65 59.43 3i9t s ILE 172 Cb 0.19 -2.84 0.02 0.00 0.01 0.00 0.00 42.46 39.84 3i9t s ILE 172 CO 0.27 -0.17 1.77 0.44 0.00 0.00 0.00 174.94 177.25 3i9t h ASP 173 N 8.04 0.24 -3.04 3.58 3.32 -1.86 -3.42 116.42 123.29 3i9t h ASP 173 Ca -0.21 0.02 -0.59 0.00 0.02 0.00 0.00 57.03 56.28 3i9t h ASP 173 Cb 1.06 -0.02 -0.40 0.00 0.22 0.00 0.00 39.33 40.20 3i9t h ASP 173 CO 0.56 0.18 -0.79 0.21 -1.72 0.00 0.00 179.24 177.68 3i9t s ASN 174 N -5.42 3.46 0.31 6.45 3.84 -1.26 -5.01 114.94 117.31 3i9t s ASN 174 Ca -0.13 -2.14 0.07 0.00 0.21 0.00 0.00 52.86 50.86 3i9t s ASN 174 Cb 0.12 -0.70 0.86 0.00 -0.55 0.00 0.00 41.25 40.97 3i9t s ASN 174 CO 0.71 -0.33 1.64 -0.65 -2.79 0.00 0.00 177.10 175.69 3i9t h PRO 175 N 7.26 0.20 -0.29 0.43 0.11 -1.91 -0.26 132.00 137.55 3i9t h PRO 175 Ca -0.03 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 66.06 3i9t h PRO 175 Cb 0.97 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.02 3i9t h PRO 175 CO 0.40 0.13 0.13 1.15 -0.21 0.00 0.00 178.00 179.60 3i9t h THR 176 N 0.21 1.16 -0.44 -1.15 2.02 -1.95 0.86 112.91 113.62 3i9t h THR 176 Ca 0.63 -0.48 -0.06 0.00 0.77 0.00 0.00 66.41 67.27 3i9t h THR 176 Cb 1.35 0.94 -0.02 0.00 -1.74 0.00 0.00 68.15 68.69 3i9t h THR 176 CO -0.67 0.17 0.03 0.11 0.37 0.00 0.00 175.52 175.52 3i9t h LYS 177 N 0.33 0.75 -0.08 6.66 1.57 -1.67 -2.30 116.57 121.82 3i9t h LYS 177 Ca 0.10 -0.22 0.01 0.00 -1.87 0.00 0.00 60.65 58.67 3i9t h LYS 177 Cb 0.14 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 3i9t h LYS 177 CO -0.01 0.80 0.01 0.35 -0.57 0.00 0.00 179.45 180.03 3i9t h PHE 178 N 0.60 0.01 -0.90 -1.35 3.57 -0.79 -1.04 116.94 117.04 3i9t h PHE 178 Ca 0.13 0.01 0.22 0.00 3.53 0.00 0.00 57.97 61.85 3i9t h PHE 178 Cb 0.44 0.01 -0.12 0.00 2.79 0.00 0.00 35.95 39.07 3i9t h PHE 178 CO 0.03 -0.00 0.40 0.87 -2.23 0.00 0.00 178.31 177.38 3i9t h LYS 179 N 0.04 0.39 -0.48 1.11 1.57 -0.83 0.20 116.57 118.57 3i9t h LYS 179 Ca 0.04 -0.02 -0.10 0.00 -1.87 0.00 0.00 60.65 58.69 3i9t h LYS 179 Cb 0.04 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.24 3i9t h LYS 179 CO -0.06 0.26 -0.11 1.96 -0.57 0.00 0.00 179.45 180.93 3i9t h GLN 180 N 0.40 0.88 -0.05 3.15 4.20 -0.80 -0.25 115.11 122.64 3i9t h GLN 180 Ca 0.56 -0.31 -0.00 0.00 0.06 0.00 0.00 58.65 58.96 3i9t h GLN 180 Cb 1.06 -0.07 -0.00 0.00 0.30 0.00 0.00 27.48 28.78 3i9t h GLN 180 CO -0.53 0.95 0.02 1.25 -0.67 0.00 0.00 178.83 179.85 3i9t h LEU 181 N 0.79 0.08 -0.81 1.46 5.85 0.15 -1.61 115.31 121.22 3i9t h LEU 181 Ca 0.13 -0.21 0.04 0.00 0.84 0.00 0.00 57.88 58.68 3i9t h LEU 181 Cb 0.63 -0.02 -0.05 0.00 0.37 0.00 0.00 40.66 41.59 3i9t h LEU 181 CO 0.04 0.27 0.51 0.22 -0.34 0.00 0.00 178.44 179.13 3i9t h TYR 182 N -0.12 0.94 -0.05 1.25 5.03 -0.53 -0.11 116.97 123.39 3i9t h TYR 182 Ca 0.02 0.03 0.01 0.00 2.58 0.00 0.00 58.73 61.36 3i9t h TYR 182 Cb 0.22 -0.31 -0.01 0.00 1.55 0.00 0.00 36.73 38.18 3i9t h TYR 182 CO -0.00 0.52 -0.01 0.00 -1.32 0.00 0.00 178.16 177.35 3i9t h ARG 183 N 0.96 0.01 -0.96 1.82 3.08 -0.94 -0.22 114.38 118.13 3i9t h ARG 183 Ca 0.33 -0.00 0.06 0.00 0.07 0.00 0.00 59.98 60.45 3i9t h ARG 183 Cb 0.07 -0.00 -0.07 0.00 0.08 0.00 0.00 29.97 30.05 3i9t h ARG 183 CO -0.13 0.01 0.61 0.00 -1.07 0.00 0.00 179.97 179.39 3i9t h ALA 184 N 1.05 1.33 -0.47 0.04 0.00 -0.89 -1.74 119.26 118.57 3i9t h ALA 184 Ca 0.02 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.79 3i9t h ALA 184 Cb 0.03 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 3i9t h ALA 184 CO -0.04 0.40 -0.18 0.00 0.00 0.00 0.00 179.25 179.43 3i9t h ARG 185 N 1.12 0.92 -0.71 0.00 2.47 -0.61 -1.42 114.38 116.15 3i9t h ARG 185 Ca 0.41 -0.36 0.07 0.00 -1.26 0.00 0.00 59.98 58.84 3i9t h ARG 185 Cb 0.16 -0.05 -0.04 0.00 -1.65 0.00 0.00 29.97 28.39 3i9t h ARG 185 CO -0.17 1.02 0.47 0.52 0.56 0.00 0.00 179.97 182.36 3i9t h MET 186 N 0.81 0.69 0.00 0.04 2.86 -0.62 -1.09 114.93 117.61 3i9t h MET 186 Ca 0.12 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.71 3i9t h MET 186 Cb 0.72 -0.15 0.00 0.00 0.06 0.00 0.00 31.60 32.23 3i9t h MET 186 CO 0.06 0.45 0.00 0.09 1.06 0.00 0.00 176.91 178.57 3i9t n ASN 187 N -4.48 0.00 -0.13 1.22 3.02 -0.54 -2.37 115.26 111.97 3i9t n ASN 187 Ca 0.11 -0.14 0.07 0.00 -0.03 0.00 0.00 54.58 54.59 3i9t n ASN 187 Cb 0.25 -0.19 -0.05 0.00 -0.61 0.00 0.00 39.78 39.17 3i9t n ASN 187 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 3i9t n THR 188 N -1.19 0.00 -1.66 3.41 -2.24 -0.42 -4.89 114.28 107.29 3i9t n THR 188 Ca 0.09 -0.23 -0.38 0.00 -2.27 0.00 0.00 64.05 61.26 3i9t n THR 188 Cb 0.11 1.07 0.05 0.00 -2.10 0.00 0.00 70.33 69.46 3i9t n THR 188 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 3i9t n LEU 189 N -0.88 4.43 -4.67 3.22 4.77 -1.00 -4.92 117.00 117.94 3i9t n LEU 189 Ca 0.04 0.87 -0.48 0.00 -0.03 0.00 0.00 56.01 56.41 3i9t n LEU 189 Cb 0.26 -1.46 -0.05 0.00 -2.33 0.00 0.00 43.42 39.84 3i9t n LEU 189 CO 0.25 -1.38 1.31 1.21 -1.33 0.00 0.00 177.39 177.45 3i9t n GLU 190 N -1.06 1.99 -3.73 3.23 4.07 -1.26 -4.98 120.64 118.90 3i9t n GLU 190 Ca 0.13 0.72 -0.16 0.00 -0.06 0.00 0.00 57.16 57.80 3i9t n GLU 190 Cb 0.46 -2.51 -0.16 0.00 -0.06 0.00 0.00 31.44 29.18 3i9t n GLU 190 CO 0.00 0.00 0.00 1.41 -0.06 0.00 0.00 177.13 178.48 3i9t s MET 191 N 2.44 0.02 0.17 5.31 1.75 -1.26 -4.99 119.30 122.75 3i9t s MET 191 Ca 0.87 0.36 0.07 0.00 -1.25 0.00 0.00 55.69 55.74 3i9t s MET 191 Cb -0.74 -0.27 -0.04 0.00 2.84 0.00 0.00 34.83 36.61 3i9t s MET 191 CO 0.47 -0.22 -0.14 0.95 -0.65 0.00 0.00 175.02 175.42 3i9t s THR 192 N 1.53 1.60 0.39 10.11 -4.23 -1.26 -5.00 115.64 118.78 3i9t s THR 192 Ca -0.04 -2.05 0.20 0.00 -1.18 0.00 0.00 61.69 58.61 3i9t s THR 192 Cb -0.12 -1.89 0.40 0.00 1.34 0.00 0.00 72.50 72.23 3i9t s THR 192 CO -0.05 -0.54 1.73 -0.65 -0.54 0.00 0.00 174.62 174.57 3i9t h PRO 193 N 2.88 0.33 0.14 3.99 0.11 -2.00 -1.32 132.00 136.13 3i9t h PRO 193 Ca -0.39 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.70 3i9t h PRO 193 Cb 1.21 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.25 3i9t h PRO 193 CO 0.58 0.22 -0.07 1.49 -0.21 0.00 0.00 178.00 180.02 3i9t h GLU 194 N 0.34 -0.18 -0.48 1.05 4.22 -1.99 -1.64 114.58 115.90 3i9t h GLU 194 Ca 0.65 0.01 -0.05 0.00 0.08 0.00 0.00 59.36 60.06 3i9t h GLU 194 Cb 1.70 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 30.97 3i9t h GLU 194 CO -0.36 0.11 0.11 0.28 -2.18 0.00 0.00 179.01 176.97 3i9t h VAL 195 N -0.46 1.24 0.10 0.32 2.07 -1.88 -2.38 116.25 115.27 3i9t h VAL 195 Ca -0.02 -0.85 -0.01 0.00 0.82 0.00 0.00 66.70 66.65 3i9t h VAL 195 Cb 0.37 0.87 0.00 0.00 -1.52 0.00 0.00 31.29 31.00 3i9t h VAL 195 CO 0.03 0.30 -0.05 0.50 0.02 0.00 0.00 177.57 178.38 3i9t h LYS 196 N 0.66 -0.13 -0.61 1.57 3.64 -1.23 0.40 116.57 120.87 3i9t h LYS 196 Ca 0.15 0.01 0.10 0.00 -1.27 0.00 0.00 60.65 59.64 3i9t h LYS 196 Cb 0.34 0.03 -0.08 0.00 -0.41 0.00 0.00 32.23 32.11 3i9t h LYS 196 CO 0.00 -0.07 0.21 0.45 -2.27 0.00 0.00 179.45 177.77 3i9t h HIS 197 N -0.16 0.36 0.02 1.91 3.86 -1.29 -2.31 115.15 117.54 3i9t h HIS 197 Ca -0.01 0.03 -0.22 0.00 -1.16 0.00 0.00 60.37 59.01 3i9t h HIS 197 Cb 0.12 -0.07 -0.03 0.00 1.06 0.00 0.00 27.41 28.50 3i9t h HIS 197 CO -0.07 0.07 -1.04 0.00 0.86 0.00 0.00 177.93 177.75 3i9t h ARG 198 N 0.37 0.04 -0.49 2.45 3.08 -0.85 -2.58 114.38 116.40 3i9t h ARG 198 Ca 0.31 -0.06 0.01 0.00 0.07 0.00 0.00 59.98 60.31 3i9t h ARG 198 Cb 0.40 0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.45 3i9t h ARG 198 CO -0.33 1.02 0.31 0.28 -1.07 0.00 0.00 179.97 180.19 3i9t h VAL 199 N 0.01 1.10 -0.19 2.04 2.07 -0.13 0.09 116.25 121.24 3i9t h VAL 199 Ca -0.03 -0.22 -0.10 0.00 0.82 0.00 0.00 66.70 67.17 3i9t h VAL 199 Cb 1.80 0.41 -0.01 0.00 -1.52 0.00 0.00 31.29 31.96 3i9t h VAL 199 CO 0.14 0.12 -0.33 0.71 0.02 0.00 0.00 177.57 178.22 3i9t h THR 200 N 0.64 1.28 -0.56 2.57 1.35 -1.38 -0.42 112.91 116.40 3i9t h THR 200 Ca 0.19 -1.39 -0.10 0.00 -0.55 0.00 0.00 66.41 64.56 3i9t h THR 200 Cb -0.04 1.51 -0.02 0.00 -1.73 0.00 0.00 68.15 67.87 3i9t h THR 200 CO -0.06 0.43 -0.04 -0.08 -0.25 0.00 0.00 175.52 175.52 3i9t h GLU 201 N 0.33 0.99 -0.01 4.72 4.57 -1.30 -2.31 114.58 121.57 3i9t h GLU 201 Ca 0.04 -0.32 -0.13 0.00 -1.18 0.00 0.00 59.36 57.77 3i9t h GLU 201 Cb 0.75 -0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 29.23 3i9t h GLU 201 CO 0.06 1.00 -0.61 1.49 -1.18 0.00 0.00 179.01 179.77 3i9t h GLU 202 N 0.90 0.02 -0.24 1.92 4.57 -0.53 -1.78 114.58 119.44 3i9t h GLU 202 Ca 0.16 -0.01 -0.12 0.00 -1.18 0.00 0.00 59.36 58.20 3i9t h GLU 202 Cb 0.58 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.16 3i9t h GLU 202 CO 0.04 0.63 -0.35 0.00 -1.18 0.00 0.00 179.01 178.14 3i9t h ALA 203 N 1.37 0.94 -0.70 2.92 0.00 -0.85 -0.95 119.26 122.00 3i9t h ALA 203 Ca -0.01 -0.41 -0.05 0.00 0.00 0.00 0.00 54.91 54.45 3i9t h ALA 203 Cb 1.09 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.73 3i9t h ALA 203 CO 0.08 0.62 0.25 0.87 0.00 0.00 0.00 179.25 181.07 3i9t h LYS 204 N 0.45 1.05 -0.77 0.00 1.57 -0.89 -2.08 116.57 115.89 3i9t h LYS 204 Ca 0.05 -0.19 -0.03 0.00 -1.87 0.00 0.00 60.65 58.61 3i9t h LYS 204 Cb 0.82 -0.17 -0.04 0.00 0.08 0.00 0.00 32.23 32.93 3i9t h LYS 204 CO 0.07 0.87 0.37 1.15 -0.57 0.00 0.00 179.45 181.33 3i9t h THR 205 N 1.02 1.24 -0.56 -0.16 2.02 -1.04 -0.73 112.91 114.70 3i9t h THR 205 Ca 0.23 -0.68 -0.10 0.00 0.77 0.00 0.00 66.41 66.62 3i9t h THR 205 Cb 0.23 0.25 -0.02 0.00 -1.74 0.00 0.00 68.15 66.88 3i9t h THR 205 CO -0.02 0.29 -0.06 0.00 0.37 0.00 0.00 175.52 176.10 3i9t h ALA 206 N 1.30 0.83 -0.61 6.16 0.00 -0.95 -0.19 119.26 125.80 3i9t h ALA 206 Ca 0.27 -0.33 -0.09 0.00 0.00 0.00 0.00 54.91 54.75 3i9t h ALA 206 Cb 0.11 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 3i9t h ALA 206 CO -0.03 0.66 0.01 0.74 0.00 0.00 0.00 179.25 180.63 3i9t h PHE 207 N 0.92 1.17 -0.59 0.00 -1.00 -1.05 -2.18 116.94 114.21 3i9t h PHE 207 Ca 0.15 -0.20 -0.02 0.00 2.81 0.00 0.00 57.97 60.71 3i9t h PHE 207 Cb 0.62 -0.31 -0.03 0.00 3.61 0.00 0.00 35.95 39.84 3i9t h PHE 207 CO 0.04 1.02 0.28 1.25 -1.61 0.00 0.00 178.31 179.29 3i9t h LEU 208 N 0.98 0.77 -1.20 1.54 5.85 -0.66 -0.20 115.31 122.39 3i9t h LEU 208 Ca 0.18 -0.13 0.08 0.00 0.84 0.00 0.00 57.88 58.84 3i9t h LEU 208 Cb 0.55 -0.20 -0.06 0.00 0.37 0.00 0.00 40.66 41.32 3i9t h LEU 208 CO 0.03 0.68 0.57 -0.07 -0.34 0.00 0.00 178.44 179.31 3i9t h LEU 209 N 0.80 0.83 -0.12 2.25 3.38 -0.85 0.21 115.31 121.80 3i9t h LEU 209 Ca 0.20 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.17 3i9t h LEU 209 Cb 0.12 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.70 3i9t h LEU 209 CO -0.03 0.51 0.02 0.78 0.09 0.00 0.00 178.44 179.82 3i9t h ASN 210 N 0.93 0.20 -0.76 -0.43 2.35 -0.83 -1.44 115.58 115.59 3i9t h ASN 210 Ca 0.39 -0.26 0.04 0.00 -0.55 0.00 0.00 56.30 55.92 3i9t h ASN 210 Cb 0.31 -0.05 -0.05 0.00 0.05 0.00 0.00 38.32 38.57 3i9t h ASN 210 CO -0.16 0.41 0.48 0.40 -1.65 0.00 0.00 177.43 176.91 3i9t h ILE 211 N -0.03 1.08 -0.21 2.81 2.04 -0.38 -1.11 117.51 121.72 3i9t h ILE 211 Ca 0.04 -0.31 -0.10 0.00 1.00 0.00 0.00 64.86 65.48 3i9t h ILE 211 Cb 0.30 0.09 -0.01 0.00 -0.74 0.00 0.00 36.82 36.46 3i9t h ILE 211 CO 0.00 0.17 -0.31 -0.33 0.00 0.00 0.00 178.15 177.67 3i9t h GLU 212 N 0.91 0.43 -0.28 2.37 5.08 -0.54 -1.23 114.58 121.32 3i9t h GLU 212 Ca 0.32 -0.18 0.01 0.00 -1.00 0.00 0.00 59.36 58.50 3i9t h GLU 212 Cb 0.06 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.28 3i9t h GLU 212 CO -0.13 0.70 0.17 1.25 -1.00 0.00 0.00 179.01 180.00 3i9t h LEU 213 N 0.37 0.28 -0.54 1.33 5.85 -0.51 -1.01 115.31 121.08 3i9t h LEU 213 Ca 0.05 -0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.75 3i9t h LEU 213 Cb 0.74 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.68 3i9t h LEU 213 CO 0.06 0.21 0.27 -0.26 -0.34 0.00 0.00 178.44 178.38 3i9t h PHE 214 N 0.35 0.77 -0.81 1.25 0.04 -0.59 -0.16 116.94 117.79 3i9t h PHE 214 Ca 0.11 -0.03 -0.01 0.00 2.80 0.00 0.00 57.97 60.83 3i9t h PHE 214 Cb -0.02 -0.24 -0.04 0.00 2.20 0.00 0.00 35.95 37.85 3i9t h PHE 214 CO -0.07 0.59 0.46 0.93 -0.60 0.00 0.00 178.31 179.61 3i9t h GLU 215 N 0.73 1.13 -0.13 1.51 5.08 -1.20 -0.17 114.58 121.53 3i9t h GLU 215 Ca 0.19 -0.13 -0.00 0.00 -1.00 0.00 0.00 59.36 58.42 3i9t h GLU 215 Cb 0.10 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.12 3i9t h GLU 215 CO -0.03 0.82 0.07 1.49 -1.00 0.00 0.00 179.01 180.37 3i9t h GLU 216 N 1.13 0.17 -0.77 2.33 4.81 -0.63 -2.55 114.58 119.07 3i9t h GLU 216 Ca 0.29 -0.02 -0.03 0.00 -0.13 0.00 0.00 59.36 59.47 3i9t h GLU 216 Cb 0.01 -0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.32 3i9t h GLU 216 CO -0.05 0.17 0.37 -0.07 -0.73 0.00 0.00 179.01 178.70 3i9t h LEU 217 N 0.13 1.00 -1.26 1.64 3.38 -0.78 0.05 115.31 119.46 3i9t h LEU 217 Ca 0.04 -0.13 0.03 0.00 0.09 0.00 0.00 57.88 57.92 3i9t h LEU 217 Cb 0.04 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.49 3i9t h LEU 217 CO -0.01 0.85 0.51 -0.61 0.09 0.00 0.00 178.44 179.28 3i9t h GLN 218 N 1.08 0.93 -0.00 1.13 5.75 -0.94 -0.52 115.11 122.54 3i9t h GLN 218 Ca 0.26 -0.06 -0.22 0.00 -0.15 0.00 0.00 58.65 58.49 3i9t h GLN 218 Cb 0.11 -0.21 0.00 0.00 1.07 0.00 0.00 27.48 28.45 3i9t h GLN 218 CO -0.03 0.62 -0.92 0.00 -2.65 0.00 0.00 178.83 175.84 3i9t h ALA 219 N 1.54 0.39 -0.69 3.38 0.00 -0.94 -1.32 119.26 121.62 3i9t h ALA 219 Ca 0.31 -0.71 -0.02 0.00 0.00 0.00 0.00 54.91 54.50 3i9t h ALA 219 Cb 0.04 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 3i9t h ALA 219 CO -0.09 0.83 0.36 -0.07 0.00 0.00 0.00 179.25 180.28 3i9t h LEU 220 N 0.22 0.88 -0.62 0.00 3.38 -0.31 -2.78 115.31 116.09 3i9t h LEU 220 Ca -0.07 -0.11 -0.15 0.00 0.09 0.00 0.00 57.88 57.64 3i9t h LEU 220 Cb 1.56 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 42.06 3i9t h LEU 220 CO 0.16 0.74 -0.68 -0.07 0.09 0.00 0.00 178.44 178.68 3i9t h LEU 221 N 0.96 0.09 -1.86 1.67 3.38 -0.85 -3.51 115.31 115.19 3i9t h LEU 221 Ca 0.24 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.15 3i9t h LEU 221 Cb 0.07 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.79 3i9t h LEU 221 CO -0.04 0.74 0.00 0.35 0.09 0.00 0.00 178.44 179.59