#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1laj n GLN 37 N 0.00 0.63 -0.07 1.09 6.02 -1.26 -3.78 117.38 120.01 1laj n GLN 37 Ca 0.00 0.13 -0.12 0.00 -0.01 0.00 0.00 57.00 57.00 1laj n GLN 37 Cb 0.00 -1.74 -0.05 0.00 1.02 0.00 0.00 30.24 29.47 1laj n GLN 37 CO 0.00 0.00 0.00 0.37 -1.01 0.00 0.00 177.06 176.42 1laj h GLN 38 N 0.00 0.42 -0.24 -1.09 5.75 -2.06 -2.43 115.11 115.46 1laj h GLN 38 Ca -0.16 -0.16 -0.01 0.00 -0.15 0.00 0.00 58.65 58.17 1laj h GLN 38 Cb 1.50 -0.03 -0.01 0.00 1.07 0.00 0.00 27.48 30.01 1laj h GLN 38 CO 0.03 0.65 0.11 0.28 -2.65 0.00 0.00 178.83 177.26 1laj h VAL 39 N 0.15 1.14 -0.01 2.39 2.07 -2.01 -1.75 116.25 118.23 1laj h VAL 39 Ca 0.06 -0.41 -0.05 0.00 0.82 0.00 0.00 66.70 67.12 1laj h VAL 39 Cb 0.49 0.98 -0.01 0.00 -1.52 0.00 0.00 31.29 31.23 1laj h VAL 39 CO 0.02 0.14 -0.24 -1.13 0.02 0.00 0.00 177.57 176.38 1laj h ASN 40 N 0.25 0.02 -0.52 0.57 -1.24 -1.65 -1.82 115.58 111.18 1laj h ASN 40 Ca 0.08 -0.00 -0.12 0.00 0.71 0.00 0.00 56.30 56.96 1laj h ASN 40 Cb 0.12 -0.00 -0.02 0.00 0.73 0.00 0.00 38.32 39.15 1laj h ASN 40 CO -0.01 0.26 -0.16 -0.09 -1.29 0.00 0.00 177.43 176.13 1laj h ARG 41 N 0.02 1.03 -0.16 6.67 1.12 -0.93 -0.98 114.38 121.15 1laj h ARG 41 Ca 0.00 -0.41 -0.14 0.00 -1.11 0.00 0.00 59.98 58.32 1laj h ARG 41 Cb 0.43 -0.05 -0.01 0.00 -0.01 0.00 0.00 29.97 30.33 1laj h ARG 41 CO 0.03 1.10 -0.49 1.25 -3.11 0.00 0.00 179.97 178.75 1laj h LEU 42 N 0.90 0.46 -0.89 3.80 7.12 -0.86 -2.09 115.31 123.75 1laj h LEU 42 Ca 0.13 -0.23 -0.07 0.00 0.13 0.00 0.00 57.88 57.84 1laj h LEU 42 Cb 0.74 -0.13 -0.02 0.00 -0.53 0.00 0.00 40.66 40.72 1laj h LEU 42 CO 0.06 0.88 0.09 0.00 -0.13 0.00 0.00 178.44 179.34 1laj h ALA 43 N 1.14 1.09 -0.10 1.25 0.00 -1.03 -0.16 119.26 121.45 1laj h ALA 43 Ca 0.02 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 1laj h ALA 43 Cb 0.98 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.55 1laj h ALA 43 CO 0.09 0.59 0.01 -0.91 0.00 0.00 0.00 179.25 179.03 1laj h ASN 44 N 0.86 0.16 -0.78 0.00 2.35 -1.06 -2.49 115.58 114.63 1laj h ASN 44 Ca 0.18 -0.28 -0.03 0.00 -0.55 0.00 0.00 56.30 55.62 1laj h ASN 44 Cb 0.38 -0.04 -0.04 0.00 0.05 0.00 0.00 38.32 38.67 1laj h ASN 44 CO 0.01 0.40 0.38 0.40 -1.65 0.00 0.00 177.43 176.97 1laj h ILE 45 N -0.08 1.25 -0.29 2.81 2.04 -1.11 -2.04 117.51 120.08 1laj h ILE 45 Ca 0.03 -0.69 -0.04 0.00 1.00 0.00 0.00 64.86 65.16 1laj h ILE 45 Cb 0.31 0.27 -0.02 0.00 -0.74 0.00 0.00 36.82 36.64 1laj h ILE 45 CO 0.00 0.29 -0.01 0.00 0.00 0.00 0.00 178.15 178.43 1laj h ALA 46 N 1.19 1.45 -0.39 1.87 0.00 -1.02 -2.84 119.26 119.52 1laj h ALA 46 Ca 0.27 -0.18 -0.08 0.00 0.00 0.00 0.00 54.91 54.92 1laj h ALA 46 Cb 0.11 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1laj h ALA 46 CO -0.03 0.39 -0.05 0.77 0.00 0.00 0.00 179.25 180.33 1laj h SER 47 N 0.42 0.72 -0.47 0.00 0.02 -0.90 -2.81 113.55 110.54 1laj h SER 47 Ca 0.09 -0.34 0.03 0.00 -0.84 0.00 0.00 61.79 60.73 1laj h SER 47 Cb 0.30 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 62.62 1laj h SER 47 CO 0.01 0.89 0.31 -1.28 -1.14 0.00 0.00 176.83 175.62 1laj h SER 48 N 0.54 0.46 -2.11 3.07 0.87 -1.24 -3.22 113.55 111.91 1laj h SER 48 Ca 0.10 -0.01 -0.79 0.00 -1.23 0.00 0.00 61.79 59.87 1laj h SER 48 Cb 0.55 -0.11 -0.23 0.00 -0.44 0.00 0.00 62.40 62.18 1laj h SER 48 CO 0.03 0.32 1.38 -1.20 -0.53 0.00 0.00 176.83 176.83 1laj n SER 49 N -4.47 6.84 -3.30 6.23 7.64 -1.06 -4.71 113.62 120.79 1laj n SER 49 Ca 0.05 -3.41 0.03 0.00 1.01 0.00 0.00 58.87 56.55 1laj n SER 49 Cb 0.13 -1.29 -0.03 0.00 -1.01 0.00 0.00 64.21 62.02 1laj n SER 49 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1laj s ALA 50 N -2.49 -2.91 -0.24 -0.43 0.00 -1.22 -4.94 121.76 109.53 1laj s ALA 50 Ca 0.39 1.84 -0.42 0.00 0.00 0.00 0.00 51.96 53.78 1laj s ALA 50 Cb 0.13 -2.20 -0.18 0.00 0.00 0.00 0.00 23.12 20.86 1laj s ALA 50 CO -0.03 -1.13 1.48 -2.30 0.00 0.00 0.00 175.76 173.78 1laj n PRO 51 N 5.14 0.49 -3.94 0.00 -0.02 -1.26 -4.94 135.00 130.47 1laj n PRO 51 Ca -0.08 0.18 -0.30 0.00 -2.02 0.00 0.00 63.50 61.28 1laj n PRO 51 Cb 0.53 -1.75 -0.04 0.00 -0.02 0.00 0.00 33.50 32.22 1laj n PRO 51 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1laj s SER 52 N 2.10 6.24 0.00 2.55 0.15 -1.26 -5.00 113.70 118.48 1laj s SER 52 Ca 0.97 0.22 -0.03 0.00 0.70 0.00 0.00 55.95 57.81 1laj s SER 52 Cb -1.25 -1.89 -0.12 0.00 -1.71 0.00 0.00 66.02 61.05 1laj s SER 52 CO 0.67 0.16 2.49 0.18 1.20 0.00 0.00 173.24 177.93 1laj n LEU 53 N 0.21 4.62 -0.15 3.45 4.77 -1.26 -3.05 117.00 125.59 1laj n LEU 53 Ca -0.06 -2.47 0.00 0.00 -0.03 0.00 0.00 56.01 53.45 1laj n LEU 53 Cb 0.51 -1.11 0.00 0.00 -2.33 0.00 0.00 43.42 40.49 1laj n LEU 53 CO 0.51 1.15 0.13 0.00 -1.33 0.00 0.00 177.39 177.85 1laj n GLN 54 N 2.06 0.00 -3.97 3.23 1.13 -1.26 -5.12 117.38 113.45 1laj n GLN 54 Ca 0.19 -0.22 -0.12 0.00 -1.94 0.00 0.00 57.00 54.90 1laj n GLN 54 Cb 0.62 -0.17 -0.13 0.00 0.11 0.00 0.00 30.24 30.66 1laj n GLN 54 CO 0.00 0.00 0.00 -1.01 -1.44 0.00 0.00 177.06 174.61 1laj s HIS 55 N 0.00 0.22 -0.09 1.08 3.76 -1.17 -5.04 115.29 114.06 1laj s HIS 55 Ca 0.00 -0.21 -0.26 0.00 -0.15 0.00 0.00 55.06 54.45 1laj s HIS 55 Cb 0.00 -0.15 -0.27 0.00 1.11 0.00 0.00 32.58 33.28 1laj s HIS 55 CO 0.00 -0.06 0.88 -1.00 -0.85 0.00 0.00 174.74 173.71 1laj h PRO 56 N 5.56 0.13 0.00 8.40 0.13 -2.00 -3.44 132.00 140.78 1laj h PRO 56 Ca -0.28 -0.19 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1laj h PRO 56 Cb 1.21 0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.40 1laj h PRO 56 CO 0.47 1.04 0.00 2.41 -0.23 0.00 0.00 178.00 181.69 1laj n THR 57 N -4.45 0.00 -1.88 1.56 -1.04 -1.26 -4.97 114.28 102.23 1laj n THR 57 Ca -0.11 0.00 -0.42 0.00 -2.04 0.00 0.00 64.05 61.48 1laj n THR 57 Cb 0.58 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 69.06 1laj n THR 57 CO 0.00 0.00 0.00 -0.36 -0.64 0.00 0.00 175.07 174.07 1laj s PHE 58 N 0.00 1.59 1.14 -1.42 2.99 -1.26 -3.81 117.98 117.21 1laj s PHE 58 Ca 0.00 0.69 -0.16 0.00 0.00 0.00 0.00 56.93 57.47 1laj s PHE 58 Cb 0.00 -4.04 0.18 0.00 0.00 0.00 0.00 43.02 39.17 1laj s PHE 58 CO 0.00 -3.11 0.46 1.51 -0.00 0.00 0.00 175.22 174.08 1laj n ILE 59 N 7.52 0.00 -0.33 0.64 0.13 -1.25 -4.81 119.36 121.27 1laj n ILE 59 Ca 0.25 -0.36 -0.25 0.00 -1.10 0.00 0.00 62.75 61.29 1laj n ILE 59 Cb 0.47 -0.78 0.24 0.00 -0.84 0.00 0.00 39.64 38.74 1laj n ILE 59 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 1laj n ALA 60 N -4.65 -3.35 -2.68 1.51 0.00 -1.26 -4.88 120.51 105.20 1laj n ALA 60 Ca 0.02 -1.61 -0.03 0.00 0.00 0.00 0.00 53.44 51.82 1laj n ALA 60 Cb 0.58 -1.29 0.03 0.00 0.00 0.00 0.00 19.45 18.77 1laj n ALA 60 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1laj s SER 61 N -2.69 -0.42 0.48 0.00 0.15 -1.26 -4.92 113.70 105.03 1laj s SER 61 Ca 0.55 -0.50 -0.22 0.00 0.70 0.00 0.00 55.95 56.48 1laj s SER 61 Cb -0.10 0.55 -0.07 0.00 -1.71 0.00 0.00 66.02 64.69 1laj s SER 61 CO 0.46 -0.02 1.12 -1.59 1.20 0.00 0.00 173.24 174.42 1laj s LYS 62 N 0.98 3.68 0.47 5.44 0.00 -1.26 -5.04 119.74 124.02 1laj s LYS 62 Ca 0.24 1.64 -0.04 0.00 0.00 0.00 0.00 55.97 57.80 1laj s LYS 62 Cb 0.11 -2.25 -0.03 0.00 0.00 0.00 0.00 37.83 35.66 1laj s LYS 62 CO -0.10 -0.58 0.76 -1.59 0.00 0.00 0.00 175.35 173.84 1laj s LYS 63 N -2.93 3.47 -0.37 1.78 0.00 -1.26 -5.04 119.74 115.39 1laj s LYS 63 Ca 0.66 0.10 0.06 0.00 0.00 0.00 0.00 55.97 56.79 1laj s LYS 63 Cb -0.25 -2.41 0.59 0.00 0.00 0.00 0.00 37.83 35.76 1laj s LYS 63 CO 0.29 -0.20 1.69 0.00 0.00 0.00 0.00 175.35 177.14 1laj n ARG 65 N -1.14 0.00 -4.15 0.00 3.00 -1.26 -4.86 116.66 108.25 1laj n ARG 65 Ca 0.47 0.00 -0.29 0.00 -0.00 0.00 0.00 57.85 58.03 1laj n ARG 65 Cb 1.36 0.00 -0.08 0.00 0.00 0.00 0.00 32.46 33.74 1laj n ARG 65 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1laj s ALA 66 N -1.79 3.26 0.00 5.13 0.00 -1.26 -4.27 121.76 122.83 1laj s ALA 66 Ca 0.00 -1.19 0.00 0.00 0.00 0.00 0.00 51.96 50.77 1laj s ALA 66 Cb 0.00 -1.14 0.00 0.00 0.00 0.00 0.00 23.12 21.98 1laj s ALA 66 CO 0.00 0.64 0.00 0.41 0.00 0.00 0.00 175.76 176.81 1laj n GLY 67 N 0.36 0.73 3.64 0.00 0.00 -1.26 -4.97 105.19 103.69 1laj n GLY 67 Ca -0.11 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.61 1laj n GLY 67 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1laj s TYR 68 N -3.15 2.89 0.44 1.61 1.51 -1.26 -3.44 117.35 115.95 1laj s TYR 68 Ca 0.00 -0.08 0.04 0.00 -1.01 0.00 0.00 57.07 56.03 1laj s TYR 68 Cb 0.00 -1.50 -0.05 0.00 -0.11 0.00 0.00 41.96 40.30 1laj s TYR 68 CO 0.00 0.45 0.02 -0.08 -1.11 0.00 0.00 175.55 174.84 1laj s THR 69 N -1.26 1.47 0.24 -0.71 -1.32 -0.38 -4.88 115.64 108.80 1laj s THR 69 Ca 0.24 -2.00 0.03 0.00 -1.21 0.00 0.00 61.69 58.75 1laj s THR 69 Cb -0.11 -2.61 -0.01 0.00 -1.51 0.00 0.00 72.50 68.25 1laj s THR 69 CO 0.16 0.00 0.11 0.00 -2.21 0.00 0.00 174.62 172.68 1laj n TYR 70 N -1.03 -0.06 -3.68 9.09 0.18 -1.25 -1.30 117.16 119.10 1laj n TYR 70 Ca -0.10 -1.67 -0.10 0.00 1.88 0.00 0.00 57.90 57.92 1laj n TYR 70 Cb 0.67 0.04 -0.10 0.00 -0.38 0.00 0.00 39.34 39.57 1laj n TYR 70 CO 0.00 0.00 0.00 0.99 -2.08 0.00 0.00 176.86 175.77 1laj s THR 71 N -2.59 -0.06 0.37 -3.48 2.01 -1.03 -4.88 115.64 105.99 1laj s THR 71 Ca 0.16 0.08 0.06 0.00 0.31 0.00 0.00 61.69 62.30 1laj s THR 71 Cb 0.01 -0.69 -0.00 0.00 0.01 0.00 0.00 72.50 71.83 1laj s THR 71 CO 0.11 0.03 0.52 -0.44 -0.69 0.00 0.00 174.62 174.16 1laj s SER 72 N 1.52 5.88 0.03 3.53 0.01 -1.25 -0.81 113.70 122.60 1laj s SER 72 Ca -0.09 -0.16 0.01 0.00 1.31 0.00 0.00 55.95 57.02 1laj s SER 72 Cb -0.08 -1.17 -0.02 0.00 0.21 0.00 0.00 66.02 64.96 1laj s SER 72 CO -0.14 -0.55 -0.05 -0.76 0.41 0.00 0.00 173.24 172.15 1laj s LEU 73 N -4.27 2.25 -0.10 2.44 1.02 -0.38 -4.88 118.68 114.76 1laj s LEU 73 Ca 0.47 -0.52 -0.02 0.00 0.02 0.00 0.00 54.13 54.08 1laj s LEU 73 Cb -0.10 -0.00 -0.03 0.00 0.02 0.00 0.00 46.19 46.08 1laj s LEU 73 CO 0.33 -0.26 -0.00 -1.81 0.02 0.00 0.00 176.35 174.62 1laj s ASP 74 N -1.51 5.19 -0.40 2.29 1.11 -1.26 -1.92 116.67 120.17 1laj s ASP 74 Ca -0.14 0.10 0.02 0.00 0.18 0.00 0.00 52.55 52.71 1laj s ASP 74 Cb -0.10 -1.54 0.15 0.00 1.07 0.00 0.00 42.92 42.50 1laj s ASP 74 CO -0.00 0.33 0.28 -0.69 1.18 0.00 0.00 175.17 176.27 1laj s VAL 75 N -0.61 0.40 -0.46 -1.27 1.01 0.67 -4.96 120.40 115.18 1laj s VAL 75 Ca 0.10 -2.28 -0.29 0.00 0.00 0.00 0.00 61.98 59.52 1laj s VAL 75 Cb -0.12 -1.29 0.01 0.00 0.00 0.00 0.00 36.38 34.98 1laj s VAL 75 CO 0.02 -1.10 1.36 -0.60 0.00 0.00 0.00 175.10 174.78 1laj s ARG 76 N 0.48 3.54 0.31 2.72 6.06 -1.26 -2.86 118.95 127.94 1laj s ARG 76 Ca 0.25 0.75 -0.28 0.00 -2.50 0.00 0.00 55.73 53.95 1laj s ARG 76 Cb -0.10 -4.02 -0.09 0.00 0.06 0.00 0.00 34.95 30.79 1laj s ARG 76 CO -0.09 -1.61 1.06 -1.25 -2.50 0.00 0.00 175.30 170.91 1laj s PRO 77 N 4.97 4.53 0.59 5.12 0.05 -1.26 -5.00 135.00 144.00 1laj s PRO 77 Ca 0.57 1.68 -0.19 0.00 0.05 0.00 0.00 61.00 63.11 1laj s PRO 77 Cb -0.12 -3.01 -0.04 0.00 0.05 0.00 0.00 34.50 31.38 1laj s PRO 77 CO 0.31 0.15 1.21 0.95 0.05 0.00 0.00 177.00 179.68 1laj s THR 78 N -1.31 2.61 0.10 1.26 -4.23 -1.26 -4.33 115.64 108.49 1laj s THR 78 Ca 0.48 0.39 -0.34 0.00 -1.18 0.00 0.00 61.69 61.03 1laj s THR 78 Cb -0.28 -3.16 -0.14 0.00 1.34 0.00 0.00 72.50 70.26 1laj s THR 78 CO 0.36 -0.08 1.61 -2.11 -0.54 0.00 0.00 174.62 173.87 1laj n ARG 79 N -1.52 2.04 -4.12 3.99 -4.01 -1.26 -4.67 116.66 107.11 1laj n ARG 79 Ca 0.13 0.74 -0.30 0.00 -1.04 0.00 0.00 57.85 57.39 1laj n ARG 79 Cb 0.49 -2.51 -0.17 0.00 -3.04 0.00 0.00 32.46 27.24 1laj n ARG 79 CO 0.00 0.00 0.00 0.99 -3.04 0.00 0.00 177.63 175.58 1laj s THR 80 N 1.48 1.53 0.74 8.89 2.01 0.10 -4.92 115.64 125.47 1laj s THR 80 Ca 0.82 -0.62 -0.10 0.00 0.31 0.00 0.00 61.69 62.10 1laj s THR 80 Cb -0.71 -1.43 -0.00 0.00 0.01 0.00 0.00 72.50 70.36 1laj s THR 80 CO 0.42 0.45 -0.27 -0.62 -0.69 0.00 0.00 174.62 173.91 1laj n GLU 81 N 4.64 -0.56 -2.74 4.92 -0.58 -1.26 -1.94 120.64 123.12 1laj n GLU 81 Ca -0.17 -0.17 -0.33 0.00 -0.42 0.00 0.00 57.16 56.07 1laj n GLU 81 Cb 0.50 -1.13 -0.06 0.00 -0.57 0.00 0.00 31.44 30.18 1laj n GLU 81 CO 0.00 0.00 0.00 0.21 -0.48 0.00 0.00 177.13 176.86 1laj s LYS 82 N -2.38 4.14 0.00 3.49 2.36 -1.26 -3.29 119.74 122.80 1laj s LYS 82 Ca 0.18 1.04 0.00 0.00 -2.55 0.00 0.00 55.97 54.63 1laj s LYS 82 Cb 0.01 -2.19 0.00 0.00 -1.05 0.00 0.00 37.83 34.60 1laj s LYS 82 CO 0.24 -0.08 0.00 -3.47 1.55 0.00 0.00 175.35 173.59 1laj n ASP 83 N -0.87 0.00 -4.91 1.43 2.03 0.14 -4.90 116.55 109.48 1laj n ASP 83 Ca 0.07 0.00 -0.29 0.00 0.52 0.00 0.00 54.79 55.09 1laj n ASP 83 Cb 0.54 -1.83 -0.04 0.00 -0.72 0.00 0.00 41.12 39.08 1laj n ASP 83 CO 0.00 0.00 0.00 -0.75 -1.92 0.00 0.00 177.20 174.53 1laj s LYS 84 N -0.61 3.62 0.12 -0.67 2.20 -1.21 -4.86 119.74 118.33 1laj s LYS 84 Ca 0.00 -0.07 0.10 0.00 -0.36 0.00 0.00 55.97 55.64 1laj s LYS 84 Cb 0.00 -2.73 -0.04 0.00 -1.51 0.00 0.00 37.83 33.55 1laj s LYS 84 CO 0.00 0.31 -0.21 -1.12 -0.36 0.00 0.00 175.35 173.97 1laj s SER 85 N -2.97 3.70 0.10 1.43 0.01 -1.26 -2.29 113.70 112.41 1laj s SER 85 Ca 0.42 -0.62 0.10 0.00 1.31 0.00 0.00 55.95 57.16 1laj s SER 85 Cb -0.11 -0.44 -0.03 0.00 0.21 0.00 0.00 66.02 65.65 1laj s SER 85 CO 0.28 0.18 -0.25 0.12 0.41 0.00 0.00 173.24 173.98 1laj s PHE 86 N -1.11 2.18 0.04 2.43 5.36 0.61 -4.96 117.98 122.52 1laj s PHE 86 Ca 0.17 -0.39 -0.15 0.00 -0.96 0.00 0.00 56.93 55.59 1laj s PHE 86 Cb -0.10 -1.22 0.02 0.00 -0.34 0.00 0.00 43.02 41.38 1laj s PHE 86 CO 0.09 0.24 0.33 0.20 -1.46 0.00 0.00 175.22 174.62 1laj s GLY 87 N -1.75 -0.17 -0.01 13.12 0.00 -1.26 0.19 107.32 117.44 1laj s GLY 87 Ca 0.12 0.11 0.00 0.00 0.00 0.00 0.00 44.72 44.95 1laj s GLY 87 CO 0.04 -0.11 -0.00 1.62 0.00 0.00 0.00 173.10 174.65 1laj s GLN 88 N -2.44 0.14 0.79 2.90 2.00 -0.16 -5.01 119.66 117.89 1laj s GLN 88 Ca -0.06 0.03 -0.11 0.00 -2.00 0.00 0.00 55.36 53.22 1laj s GLN 88 Cb -0.01 -0.25 0.06 0.00 0.80 0.00 0.00 33.01 33.61 1laj s GLN 88 CO -0.02 -0.05 1.09 0.50 -0.50 0.00 0.00 175.29 176.31 1laj s ARG 89 N 0.47 2.17 -0.90 1.67 3.52 -1.26 -0.75 118.95 123.86 1laj s ARG 89 Ca -0.04 0.70 -0.21 0.00 -0.13 0.00 0.00 55.73 56.05 1laj s ARG 89 Cb -0.07 -1.92 0.09 0.00 -1.56 0.00 0.00 34.95 31.49 1laj s ARG 89 CO -0.01 -1.57 1.20 -0.51 -0.81 0.00 0.00 175.30 173.59 1laj s LEU 90 N -5.77 4.42 -0.97 -0.88 2.01 -1.05 -4.79 118.68 111.65 1laj s LEU 90 Ca 0.60 -1.63 -0.15 0.00 0.01 0.00 0.00 54.13 52.96 1laj s LEU 90 Cb -0.15 -2.46 0.19 0.00 0.01 0.00 0.00 46.19 43.79 1laj s LEU 90 CO 0.54 -1.29 1.06 0.27 1.01 0.00 0.00 176.35 177.95 1laj s ILE 91 N 3.69 5.26 0.83 -0.59 -0.00 -1.26 -2.90 121.20 126.24 1laj s ILE 91 Ca 0.35 -2.32 -0.15 0.00 -0.00 0.00 0.00 60.65 58.52 1laj s ILE 91 Cb -0.05 -4.68 -0.04 0.00 -0.00 0.00 0.00 42.46 37.69 1laj s ILE 91 CO -0.05 -1.33 0.20 -0.38 -0.00 0.00 0.00 174.94 173.38 1laj n ILE 92 N 4.44 0.72 -2.68 8.37 -0.00 -1.26 -4.95 119.36 124.00 1laj n ILE 92 Ca 0.23 -0.35 -0.23 0.00 -0.00 0.00 0.00 62.75 62.39 1laj n ILE 92 Cb 0.46 -0.51 0.03 0.00 -0.00 0.00 0.00 39.64 39.62 1laj n ILE 92 CO 0.00 0.00 0.00 -2.16 -0.00 0.00 0.00 176.55 174.39 1laj s PRO 93 N -2.79 2.78 0.33 0.38 0.04 -1.26 -4.80 135.00 129.68 1laj s PRO 93 Ca 0.57 -0.46 0.11 0.00 0.04 0.00 0.00 61.00 61.26 1laj s PRO 93 Cb -0.28 -2.44 1.00 0.00 0.04 0.00 0.00 34.50 32.82 1laj s PRO 93 CO 0.66 -0.60 1.64 -0.39 0.04 0.00 0.00 177.00 178.36 1laj h VAL 94 N 0.08 0.25 0.00 -0.36 -1.51 -1.97 0.25 116.25 112.98 1laj h VAL 94 Ca -0.44 -0.08 -0.06 0.00 -1.23 0.00 0.00 66.70 64.89 1laj h VAL 94 Cb 1.27 -0.01 -0.01 0.00 -2.13 0.00 0.00 31.29 30.42 1laj h VAL 94 CO 0.57 0.04 -0.98 1.55 -1.23 0.00 0.00 177.57 177.52 1laj h PRO 95 N 0.23 0.00 0.06 5.19 0.13 -2.03 -3.38 132.00 132.20 1laj h PRO 95 Ca 0.69 0.00 -0.34 0.00 -0.87 0.00 0.00 66.00 65.49 1laj h PRO 95 Cb 1.57 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.66 1laj h PRO 95 CO -0.66 0.12 -1.88 0.28 -0.23 0.00 0.00 178.00 175.63 1laj n VAL 96 N -2.82 1.64 0.03 1.56 0.31 -0.94 -3.99 118.33 114.12 1laj n VAL 96 Ca -0.02 -0.41 0.00 0.00 -0.01 0.00 0.00 64.34 63.90 1laj n VAL 96 Cb 0.64 -1.81 0.01 0.00 -0.91 0.00 0.00 33.84 31.77 1laj n VAL 96 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1laj n SER 97 N -3.85 0.01 0.00 4.52 3.41 0.85 0.43 113.62 118.99 1laj n SER 97 Ca -0.36 0.08 0.12 0.00 -0.26 0.00 0.00 58.87 58.44 1laj n SER 97 Cb 0.90 -0.03 0.20 0.00 -0.26 0.00 0.00 64.21 65.03 1laj n SER 97 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1laj n GLU 98 N -1.18 0.00 -2.59 4.33 -0.58 -1.26 -4.21 120.64 115.15 1laj n GLU 98 Ca -0.00 0.00 -0.28 0.00 -0.42 0.00 0.00 57.16 56.46 1laj n GLU 98 Cb 0.53 -1.50 -0.01 0.00 -0.57 0.00 0.00 31.44 29.89 1laj n GLU 98 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 1laj n TYR 99 N -1.50 3.57 0.20 -0.32 4.02 0.17 -4.90 117.16 118.39 1laj n TYR 99 Ca 0.05 -3.32 0.15 0.00 -0.01 0.00 0.00 57.90 54.77 1laj n TYR 99 Cb 0.34 -0.33 0.55 0.00 -0.02 0.00 0.00 39.34 39.87 1laj n TYR 99 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 176.86 174.50 1laj h PRO 100 N 2.80 0.00 0.00 -0.72 0.11 -1.75 0.40 132.00 132.84 1laj h PRO 100 Ca 0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.39 1laj h PRO 100 Cb 0.70 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.81 1laj h PRO 100 CO 0.90 0.00 0.00 1.63 -0.21 0.00 0.00 178.00 180.32 1laj n LYS 101 N -3.03 0.44 -2.65 1.05 4.76 -1.26 -2.27 118.16 115.19 1laj n LYS 101 Ca 0.04 0.05 -0.41 0.00 -2.87 0.00 0.00 58.31 55.12 1laj n LYS 101 Cb 0.76 -1.50 -0.04 0.00 -1.84 0.00 0.00 35.03 32.41 1laj n LYS 101 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 1laj s LYS 102 N -2.43 4.60 0.43 1.97 3.01 0.13 -4.80 119.74 122.64 1laj s LYS 102 Ca 0.26 1.52 -0.18 0.00 -1.01 0.00 0.00 55.97 56.56 1laj s LYS 102 Cb 0.16 -3.39 -0.09 0.00 -1.01 0.00 0.00 37.83 33.50 1laj s LYS 102 CO 0.34 0.05 0.90 0.21 0.51 0.00 0.00 175.35 177.35 1laj s LYS 103 N 0.41 4.07 -0.07 1.68 2.47 -1.26 0.13 119.74 127.17 1laj s LYS 103 Ca 0.50 0.93 0.03 0.00 -1.56 0.00 0.00 55.97 55.87 1laj s LYS 103 Cb -0.24 -2.24 -0.02 0.00 -1.46 0.00 0.00 37.83 33.87 1laj s LYS 103 CO 0.30 -0.06 -0.13 0.08 0.16 0.00 0.00 175.35 175.70 1laj s VAL 104 N -2.27 3.11 -0.01 4.02 1.01 0.19 -2.46 120.40 123.99 1laj s VAL 104 Ca 0.59 -0.69 -0.01 0.00 0.00 0.00 0.00 61.98 61.87 1laj s VAL 104 Cb -0.10 -2.24 -0.00 0.00 0.00 0.00 0.00 36.38 34.04 1laj s VAL 104 CO 0.20 0.58 -0.01 -1.54 0.00 0.00 0.00 175.10 174.33 1laj n SER 105 N 2.56 0.11 -3.69 3.32 3.41 -0.11 -4.04 113.62 115.19 1laj n SER 105 Ca -0.17 0.21 -0.24 0.00 -0.26 0.00 0.00 58.87 58.41 1laj n SER 105 Cb 0.52 -0.52 -0.08 0.00 -0.26 0.00 0.00 64.21 63.87 1laj n SER 105 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1laj s VAL 107 N -3.26 -0.58 0.50 0.00 -7.23 -0.19 -1.81 120.40 107.82 1laj s VAL 107 Ca 0.30 -0.21 -0.10 0.00 -1.81 0.00 0.00 61.98 60.17 1laj s VAL 107 Cb 0.01 -0.90 -0.05 0.00 0.56 0.00 0.00 36.38 36.01 1laj s VAL 107 CO 0.21 -0.23 0.87 -1.58 -0.31 0.00 0.00 175.10 174.06 1laj s GLN 108 N 2.52 3.68 -0.37 4.82 0.74 -0.09 -2.47 119.66 128.49 1laj s GLN 108 Ca 0.11 0.51 0.00 0.00 0.05 0.00 0.00 55.36 56.03 1laj s GLN 108 Cb -0.14 -2.28 0.13 0.00 1.10 0.00 0.00 33.01 31.82 1laj s GLN 108 CO -0.23 -0.25 0.20 0.08 -0.55 0.00 0.00 175.29 174.53 1laj s VAL 109 N -2.73 0.58 0.20 1.34 1.01 0.36 0.48 120.40 121.65 1laj s VAL 109 Ca 0.52 -1.83 -0.13 0.00 0.00 0.00 0.00 61.98 60.53 1laj s VAL 109 Cb -0.10 -1.43 -0.07 0.00 0.00 0.00 0.00 36.38 34.78 1laj s VAL 109 CO 0.41 -0.90 0.59 0.00 0.00 0.00 0.00 175.10 175.20 1laj s ARG 110 N 1.02 3.95 -0.26 2.72 1.70 0.30 -3.21 118.95 125.17 1laj s ARG 110 Ca 0.16 0.47 -0.02 0.00 -0.47 0.00 0.00 55.73 55.87 1laj s ARG 110 Cb -0.22 -2.77 0.08 0.00 -0.57 0.00 0.00 34.95 31.47 1laj s ARG 110 CO -0.06 0.38 0.08 -0.48 -1.08 0.00 0.00 175.30 174.14 1laj s LEU 111 N -2.37 1.49 -0.45 -1.89 2.34 -1.03 -0.07 118.68 116.70 1laj s LEU 111 Ca 0.43 -1.24 -0.26 0.00 0.06 0.00 0.00 54.13 53.13 1laj s LEU 111 Cb -0.13 -0.66 0.03 0.00 -0.56 0.00 0.00 46.19 44.87 1laj s LEU 111 CO 0.20 -0.38 0.94 0.20 -1.06 0.00 0.00 176.35 176.25 1laj s ASN 112 N 1.81 6.53 0.38 1.48 -0.87 -0.67 -4.94 114.94 118.65 1laj s ASN 112 Ca 0.05 0.21 -0.13 0.00 -1.57 0.00 0.00 52.86 51.42 1laj s ASN 112 Cb -0.17 -2.46 -0.08 0.00 -0.02 0.00 0.00 41.25 38.53 1laj s ASN 112 CO -0.20 -1.03 0.77 -2.16 -2.57 0.00 0.00 177.10 171.90 1laj s PRO 113 N 3.75 3.89 0.69 -0.60 0.05 -1.26 -2.13 135.00 139.39 1laj s PRO 113 Ca 0.38 0.59 -0.07 0.00 0.05 0.00 0.00 61.00 61.95 1laj s PRO 113 Cb -0.10 -2.39 0.05 0.00 0.05 0.00 0.00 34.50 32.10 1laj s PRO 113 CO 0.25 0.03 1.01 -1.54 0.05 0.00 0.00 177.00 176.81 1laj s SER 114 N -2.75 5.04 0.52 6.66 1.04 -0.87 -4.91 113.70 118.42 1laj s SER 114 Ca 0.53 0.62 0.28 0.00 0.48 0.00 0.00 55.95 57.86 1laj s SER 114 Cb -0.10 -1.35 1.40 0.00 0.10 0.00 0.00 66.02 66.06 1laj s SER 114 CO 0.25 -1.47 2.03 -0.65 0.98 0.00 0.00 173.24 174.38 1laj h PRO 115 N -0.54 0.00 0.00 4.02 0.11 -1.87 -0.57 132.00 133.15 1laj h PRO 115 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1laj h PRO 115 Cb 1.30 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.41 1laj h PRO 115 CO 0.61 0.12 0.00 1.17 -0.21 0.00 0.00 178.00 179.70 1laj n LYS 116 N -3.49 0.02 -1.55 1.05 0.00 -1.26 -4.72 118.16 108.21 1laj n LYS 116 Ca -0.01 0.18 -0.38 0.00 0.00 0.00 0.00 58.31 58.10 1laj n LYS 116 Cb 0.28 -1.50 -0.04 0.00 0.00 0.00 0.00 35.03 33.77 1laj n LYS 116 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.40 177.74 1laj n PHE 117 N -1.48 1.49 -0.06 5.64 7.35 -0.22 -4.70 117.46 125.47 1laj n PHE 117 Ca 0.05 0.09 -0.08 0.00 -0.76 0.00 0.00 57.45 56.75 1laj n PHE 117 Cb 0.21 -2.64 -0.07 0.00 0.35 0.00 0.00 39.48 37.33 1laj n PHE 117 CO 0.00 0.00 0.00 0.27 -0.76 0.00 0.00 176.76 176.27 1laj n ASN 118 N 14.65 2.82 -3.53 -2.13 6.94 -1.26 -4.90 115.26 127.85 1laj n ASN 118 Ca 0.37 -0.05 -0.30 0.00 -0.02 0.00 0.00 54.58 54.58 1laj n ASN 118 Cb 0.49 0.07 0.28 0.00 -2.36 0.00 0.00 39.78 38.26 1laj n ASN 118 CO 0.00 0.00 0.00 -0.55 -1.03 0.00 0.00 177.26 175.68 1laj s SER 119 N -4.99 -0.51 -0.05 0.53 0.15 -1.26 -4.45 113.70 103.11 1laj s SER 119 Ca -0.14 0.77 0.01 0.00 0.70 0.00 0.00 55.95 57.28 1laj s SER 119 Cb 0.04 -1.07 0.02 0.00 -1.71 0.00 0.00 66.02 63.30 1laj s SER 119 CO 0.34 -5.02 -0.03 0.42 1.20 0.00 0.00 173.24 170.15 1laj s THR 120 N -2.51 0.49 0.06 6.45 -4.23 -1.26 -3.46 115.64 111.18 1laj s THR 120 Ca 0.70 -0.07 -0.00 0.00 -1.18 0.00 0.00 61.69 61.13 1laj s THR 120 Cb -0.12 -0.54 -0.04 0.00 1.34 0.00 0.00 72.50 73.14 1laj s THR 120 CO 0.57 0.23 -0.04 0.27 -0.54 0.00 0.00 174.62 175.11 1laj s ILE 121 N 1.11 0.32 -0.04 2.99 -0.00 0.57 -1.84 121.20 124.32 1laj s ILE 121 Ca -0.08 -1.73 -0.00 0.00 -0.00 0.00 0.00 60.65 58.84 1laj s ILE 121 Cb -0.14 -1.41 -0.03 0.00 -0.00 0.00 0.00 42.46 40.88 1laj s ILE 121 CO -0.01 -0.91 0.01 0.26 -0.00 0.00 0.00 174.94 174.29 1laj s TRP 122 N -3.55 3.14 -0.01 1.37 0.52 -0.89 0.08 118.94 119.60 1laj s TRP 122 Ca 0.05 0.15 -0.13 0.00 0.02 0.00 0.00 56.10 56.19 1laj s TRP 122 Cb 0.05 -1.73 0.02 0.00 -1.15 0.00 0.00 33.47 30.66 1laj s TRP 122 CO -0.08 0.48 0.28 0.14 0.02 0.00 0.00 176.95 177.79 1laj s VAL 123 N -1.00 0.06 0.00 4.03 -7.23 0.54 -0.17 120.40 116.63 1laj s VAL 123 Ca 0.17 -0.52 0.00 0.00 -1.81 0.00 0.00 61.98 59.82 1laj s VAL 123 Cb -0.11 -0.59 0.00 0.00 0.56 0.00 0.00 36.38 36.23 1laj s VAL 123 CO 0.07 -0.29 0.00 -0.24 -0.31 0.00 0.00 175.10 174.33 1laj n SER 124 N 1.28 0.00 0.00 4.85 2.88 -1.18 -0.89 113.62 120.56 1laj n SER 124 Ca -0.22 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.32 1laj n SER 124 Cb 0.56 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.02 1laj n SER 124 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1laj n LEU 125 N 0.00 0.00 0.00 2.46 -0.00 -1.26 -0.64 117.00 117.56 1laj n LEU 125 Ca 0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 56.01 55.92 1laj n LEU 125 Cb 0.00 0.00 0.02 0.00 -0.00 0.00 0.00 43.42 43.44 1laj n LEU 125 CO 0.00 0.00 0.43 0.54 -0.00 0.00 0.00 177.39 178.36 1laj n ARG 126 N -0.06 0.95 -1.50 1.47 1.74 -1.11 -4.94 116.66 113.21 1laj n ARG 126 Ca 0.00 -2.06 -0.36 0.00 -0.77 0.00 0.00 57.85 54.67 1laj n ARG 126 Cb 0.00 2.46 0.09 0.00 -1.02 0.00 0.00 32.46 33.99 1laj n ARG 126 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 1laj s ARG 127 N -2.17 2.19 0.13 5.56 3.52 -1.26 -2.19 118.95 124.73 1laj s ARG 127 Ca 0.16 1.97 -0.03 0.00 -0.13 0.00 0.00 55.73 57.70 1laj s ARG 127 Cb -0.04 -1.81 -0.03 0.00 -1.56 0.00 0.00 34.95 31.50 1laj s ARG 127 CO 0.12 -1.85 0.09 -1.17 -0.81 0.00 0.00 175.30 171.68 1laj s LEU 128 N -4.87 1.70 -0.37 -0.88 1.98 -0.80 -4.87 118.68 110.56 1laj s LEU 128 Ca 0.80 -1.11 0.13 0.00 -2.89 0.00 0.00 54.13 51.05 1laj s LEU 128 Cb -0.35 0.46 0.44 0.00 0.66 0.00 0.00 46.19 47.40 1laj s LEU 128 CO 0.44 -0.74 0.99 0.47 -1.89 0.00 0.00 176.35 175.62 1laj n ASP 129 N -0.09 2.63 0.00 3.68 8.00 -1.26 -4.89 116.55 124.62 1laj n ASP 129 Ca -0.07 -3.10 0.00 0.00 0.71 0.00 0.00 54.79 52.33 1laj n ASP 129 Cb 0.63 -0.51 0.00 0.00 -0.02 0.00 0.00 41.12 41.22 1laj n ASP 129 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1laj n GLU 130 N -0.19 0.00 -0.37 -1.24 4.71 -1.26 -2.10 120.64 120.19 1laj n GLU 130 Ca 0.21 0.00 -0.10 0.00 -0.01 0.00 0.00 57.16 57.26 1laj n GLU 130 Cb 0.74 0.00 -0.09 0.00 -1.01 0.00 0.00 31.44 31.08 1laj n GLU 130 CO 0.00 0.00 0.00 1.79 0.09 0.00 0.00 177.13 179.01 1laj h THR 131 N 0.00 0.00 -1.02 2.62 1.35 -2.05 -3.39 112.91 110.43 1laj h THR 131 Ca 0.00 0.00 -0.86 0.00 -0.55 0.00 0.00 66.41 65.00 1laj h THR 131 Cb 0.00 0.00 0.02 0.00 -1.73 0.00 0.00 68.15 66.44 1laj h THR 131 CO 0.00 0.00 0.62 0.35 -0.25 0.00 0.00 175.52 176.24 1laj n THR 132 N -5.08 0.01 -4.38 6.82 -2.24 -0.89 -4.85 114.28 103.66 1laj n THR 132 Ca 0.01 -0.00 -0.34 0.00 -2.27 0.00 0.00 64.05 61.45 1laj n THR 132 Cb 0.25 -0.46 -0.11 0.00 -2.10 0.00 0.00 70.33 67.91 1laj n THR 132 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1laj s LEU 133 N 2.65 3.43 0.00 3.22 1.98 -1.26 -4.85 118.68 123.85 1laj s LEU 133 Ca 1.03 0.02 0.00 0.00 -2.89 0.00 0.00 54.13 52.29 1laj s LEU 133 Cb -1.46 -1.80 0.00 0.00 0.66 0.00 0.00 46.19 43.59 1laj s LEU 133 CO 0.78 0.28 0.00 0.00 -1.89 0.00 0.00 176.35 175.53 1laj n LEU 134 N 2.78 0.00 -4.73 -0.68 -0.00 -1.26 -4.62 117.00 108.50 1laj n LEU 134 Ca -0.18 0.00 -0.42 0.00 -0.00 0.00 0.00 56.01 55.41 1laj n LEU 134 Cb 0.53 0.00 -0.03 0.00 -0.00 0.00 0.00 43.42 43.92 1laj n LEU 134 CO 0.30 0.00 1.26 0.28 -0.00 0.00 0.00 177.39 179.24 1laj s THR 135 N 0.64 2.35 0.10 1.47 -1.32 -1.26 -4.73 115.64 112.88 1laj s THR 135 Ca 0.00 0.26 -0.19 0.00 -1.21 0.00 0.00 61.69 60.55 1laj s THR 135 Cb 0.00 -3.17 -0.04 0.00 -1.51 0.00 0.00 72.50 67.78 1laj s THR 135 CO 0.00 0.03 1.00 -1.20 -2.21 0.00 0.00 174.62 172.24 1laj n SER 136 N 3.48 -0.66 -0.24 8.08 7.64 -1.26 0.80 113.62 131.45 1laj n SER 136 Ca 0.13 1.15 0.05 0.00 1.01 0.00 0.00 58.87 61.21 1laj n SER 136 Cb 0.37 -0.16 0.17 0.00 -1.01 0.00 0.00 64.21 63.58 1laj n SER 136 CO 0.00 0.00 0.00 1.05 -3.01 0.00 0.00 175.04 173.08 1laj h GLU 137 N 0.00 0.22 -0.18 1.43 -0.00 -1.94 -0.47 114.58 113.65 1laj h GLU 137 Ca 0.10 -0.01 0.03 0.00 -0.00 0.00 0.00 59.36 59.48 1laj h GLU 137 Cb 0.26 -0.05 -0.03 0.00 -0.00 0.00 0.00 28.75 28.93 1laj h GLU 137 CO -0.59 0.15 -0.01 -0.91 -0.00 0.00 0.00 179.01 177.65 1laj h ASN 138 N 0.23 -0.10 -0.27 3.06 2.35 0.13 -2.88 115.58 118.10 1laj h ASN 138 Ca 0.41 0.04 0.03 0.00 -0.55 0.00 0.00 56.30 56.23 1laj h ASN 138 Cb 0.70 0.08 -0.04 0.00 0.05 0.00 0.00 38.32 39.11 1laj h ASN 138 CO -0.53 -0.02 -0.26 0.58 -1.65 0.00 0.00 177.43 175.54 1laj h VAL 139 N 0.04 0.00 -0.71 2.81 2.07 -0.10 -1.86 116.25 118.50 1laj h VAL 139 Ca 0.09 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.71 1laj h VAL 139 Cb 0.11 0.00 -0.12 0.00 -1.52 0.00 0.00 31.29 29.76 1laj h VAL 139 CO -0.16 0.00 -0.43 -0.26 0.02 0.00 0.00 177.57 176.74 1laj h PHE 140 N -0.12 -1.27 -0.42 1.57 -1.00 -1.40 -0.93 116.94 113.37 1laj h PHE 140 Ca 0.05 0.09 0.04 0.00 2.81 0.00 0.00 57.97 60.96 1laj h PHE 140 Cb 0.24 0.66 -0.05 0.00 3.61 0.00 0.00 35.95 40.40 1laj h PHE 140 CO -0.77 -0.41 -0.23 1.17 -1.61 0.00 0.00 178.31 176.46 1laj n LYS 141 N -5.41 -0.17 0.01 1.51 0.00 -0.70 -0.42 118.16 112.98 1laj n LYS 141 Ca 0.04 0.63 -0.18 0.00 0.00 0.00 0.00 58.31 58.80 1laj n LYS 141 Cb 0.35 -0.93 -0.13 0.00 0.00 0.00 0.00 35.03 34.32 1laj n LYS 141 CO 0.00 0.00 0.00 1.37 0.00 0.00 0.00 177.40 178.77 1laj h LEU 142 N 0.00 0.37 -0.86 3.14 -0.00 -1.29 -3.26 115.31 113.41 1laj h LEU 142 Ca 0.08 -0.88 0.17 0.00 -0.00 0.00 0.00 57.88 57.25 1laj h LEU 142 Cb 0.19 -0.12 -0.16 0.00 -0.00 0.00 0.00 40.66 40.57 1laj h LEU 142 CO -0.40 1.21 -0.21 0.49 -0.00 0.00 0.00 178.44 179.54 1laj n PHE 143 N -4.29 0.32 -2.99 0.17 0.99 0.44 -2.68 117.46 109.41 1laj n PHE 143 Ca -0.12 1.04 -0.44 0.00 -0.00 0.00 0.00 57.45 57.94 1laj n PHE 143 Cb 0.68 -1.00 0.00 0.00 -1.00 0.00 0.00 39.48 38.16 1laj n PHE 143 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.76 177.01 1laj n THR 144 N -5.39 4.30 -0.52 4.37 -2.24 -0.13 -4.82 114.28 109.85 1laj n THR 144 Ca 0.14 -4.81 0.00 0.00 -2.27 0.00 0.00 64.05 57.11 1laj n THR 144 Cb 0.44 -2.48 0.00 0.00 -2.10 0.00 0.00 70.33 66.19 1laj n THR 144 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1laj n ASP 145 N 5.23 0.00 -4.45 3.42 3.85 -1.09 -4.91 116.55 118.61 1laj n ASP 145 Ca 0.35 0.00 -0.15 0.00 -0.71 0.00 0.00 54.79 54.28 1laj n ASP 145 Cb 0.42 0.00 -0.14 0.00 -1.35 0.00 0.00 41.12 40.05 1laj n ASP 145 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1laj n GLY 146 N -0.19 -0.32 0.00 6.12 0.00 -1.26 -4.75 105.19 104.78 1laj n GLY 146 Ca 0.00 0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.12 1laj n GLY 146 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1laj n LEU 147 N 10.61 0.00 -4.77 0.99 -0.00 -1.26 -5.14 117.00 117.44 1laj n LEU 147 Ca 0.49 0.00 -0.39 0.00 -0.00 0.00 0.00 56.01 56.10 1laj n LEU 147 Cb 0.31 0.00 -0.03 0.00 -0.00 0.00 0.00 43.42 43.70 1laj n LEU 147 CO 0.79 0.00 0.82 0.00 -0.00 0.00 0.00 177.39 179.01 1laj s ALA 148 N -1.46 3.32 -0.07 1.96 0.00 -1.26 -4.96 121.76 119.29 1laj s ALA 148 Ca 0.00 0.94 -0.09 0.00 0.00 0.00 0.00 51.96 52.81 1laj s ALA 148 Cb 0.00 -3.35 0.02 0.00 0.00 0.00 0.00 23.12 19.79 1laj s ALA 148 CO 0.00 -0.32 0.23 0.08 0.00 0.00 0.00 175.76 175.74 1laj s VAL 149 N -1.29 0.02 -0.07 0.00 1.01 -1.26 -4.72 120.40 114.09 1laj s VAL 149 Ca 0.50 -0.15 0.00 0.00 0.00 0.00 0.00 61.98 62.34 1laj s VAL 149 Cb -0.31 -0.37 -0.03 0.00 0.00 0.00 0.00 36.38 35.67 1laj s VAL 149 CO 0.40 -0.08 -0.06 -0.22 0.00 0.00 0.00 175.10 175.14 1laj s LEU 150 N -0.23 3.21 -0.11 3.92 2.96 -0.07 -4.96 118.68 123.40 1laj s LEU 150 Ca -0.03 -0.01 0.01 0.00 -0.22 0.00 0.00 54.13 53.88 1laj s LEU 150 Cb -0.03 -1.70 -0.02 0.00 0.50 0.00 0.00 46.19 44.94 1laj s LEU 150 CO 0.01 0.36 -0.14 0.27 -1.32 0.00 0.00 176.35 175.53 1laj s ILE 151 N -0.78 3.04 -0.22 6.68 -0.00 -1.26 -0.34 121.20 128.32 1laj s ILE 151 Ca 0.12 -0.68 -0.00 0.00 -0.00 0.00 0.00 60.65 60.08 1laj s ILE 151 Cb -0.11 -2.25 0.06 0.00 -0.00 0.00 0.00 42.46 40.16 1laj s ILE 151 CO 0.02 0.54 -0.03 -0.47 -0.00 0.00 0.00 174.94 175.00 1laj s TYR 152 N 0.05 2.03 0.04 1.37 5.04 0.11 -4.98 117.35 121.00 1laj s TYR 152 Ca -0.05 -1.52 0.02 0.00 -2.44 0.00 0.00 57.07 53.09 1laj s TYR 152 Cb -0.15 -1.43 -0.04 0.00 0.35 0.00 0.00 41.96 40.69 1laj s TYR 152 CO 0.04 -0.73 0.02 -1.14 -1.34 0.00 0.00 175.55 172.40 1laj s GLN 153 N 1.52 2.75 -0.40 4.97 0.74 -1.26 -0.31 119.66 127.67 1laj s GLN 153 Ca -0.04 -0.68 -0.22 0.00 0.05 0.00 0.00 55.36 54.47 1laj s GLN 153 Cb -0.18 -2.65 0.02 0.00 1.10 0.00 0.00 33.01 31.29 1laj s GLN 153 CO -0.07 0.59 0.71 -1.58 -0.55 0.00 0.00 175.29 174.40 1laj s HIS 154 N -1.20 3.08 0.26 1.67 5.65 -1.22 -4.33 115.29 119.20 1laj s HIS 154 Ca 0.23 0.25 0.06 0.00 0.25 0.00 0.00 55.06 55.84 1laj s HIS 154 Cb -0.12 -3.39 -0.03 0.00 -1.18 0.00 0.00 32.58 27.87 1laj s HIS 154 CO 0.14 -0.80 0.32 0.14 -0.65 0.00 0.00 174.74 173.89 1laj s VAL 155 N 2.98 4.74 -0.10 0.89 -7.23 -1.26 -5.02 120.40 115.39 1laj s VAL 155 Ca 0.27 -1.14 -0.00 0.00 -1.81 0.00 0.00 61.98 59.30 1laj s VAL 155 Cb -0.13 -3.62 -0.25 0.00 0.56 0.00 0.00 36.38 32.94 1laj s VAL 155 CO 0.18 -0.30 0.44 -0.81 -0.31 0.00 0.00 175.10 174.31 1laj n PRO 156 N -1.37 0.72 -1.28 4.82 -0.04 -1.26 -4.52 135.00 132.07 1laj n PRO 156 Ca -0.07 0.27 -0.42 0.00 -0.04 0.00 0.00 63.50 63.24 1laj n PRO 156 Cb 0.58 -1.73 -0.04 0.00 -0.04 0.00 0.00 33.50 32.26 1laj n PRO 156 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1laj n THR 157 N -3.33 2.27 0.00 0.52 -2.24 -1.26 -4.74 114.28 105.49 1laj n THR 157 Ca -0.27 -1.94 0.00 0.00 -2.27 0.00 0.00 64.05 59.56 1laj n THR 157 Cb 1.05 -2.39 0.00 0.00 -2.10 0.00 0.00 70.33 66.89 1laj n THR 157 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1laj n GLY 158 N 4.39 1.19 3.54 3.38 0.00 -1.26 -4.91 105.19 111.51 1laj n GLY 158 Ca 0.50 -0.93 -0.17 0.00 0.00 0.00 0.00 46.02 45.43 1laj n GLY 158 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1laj s ILE 159 N 0.00 0.00 0.24 -0.61 1.10 -1.26 -4.73 121.20 115.93 1laj s ILE 159 Ca 0.00 0.00 -0.23 0.00 -0.51 0.00 0.00 60.65 59.91 1laj s ILE 159 Cb 0.00 -1.00 -0.15 0.00 0.15 0.00 0.00 42.46 41.46 1laj s ILE 159 CO 0.00 0.00 0.35 0.00 -2.11 0.00 0.00 174.94 173.18 1laj n GLN 160 N 1.25 0.00 0.00 3.50 6.02 -1.26 -4.78 117.38 122.11 1laj n GLN 160 Ca -0.18 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.81 1laj n GLN 160 Cb 0.57 -0.90 0.00 0.00 1.02 0.00 0.00 30.24 30.92 1laj n GLN 160 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 177.06 175.70 1laj n PRO 161 N 1.00 0.00 -1.22 -1.09 -0.04 -1.25 -4.60 135.00 127.79 1laj n PRO 161 Ca 0.14 0.00 -0.31 0.00 -0.04 0.00 0.00 63.50 63.29 1laj n PRO 161 Cb 0.27 0.00 -0.13 0.00 -0.04 0.00 0.00 33.50 33.60 1laj n PRO 161 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 1laj n ASN 162 N 0.00 0.05 -0.44 3.54 6.94 -1.26 -3.74 115.26 120.35 1laj n ASN 162 Ca 0.00 0.07 0.05 0.00 -0.02 0.00 0.00 54.58 54.68 1laj n ASN 162 Cb 0.00 -0.71 0.06 0.00 -2.36 0.00 0.00 39.78 36.77 1laj n ASN 162 CO 0.00 0.00 0.00 -0.46 -1.03 0.00 0.00 177.26 175.77 1laj n ASN 163 N 8.03 1.99 -4.49 0.53 6.94 -1.26 -4.94 115.26 122.05 1laj n ASN 163 Ca 0.54 -1.50 -0.24 0.00 -0.02 0.00 0.00 54.58 53.36 1laj n ASN 163 Cb 0.04 -0.02 -0.10 0.00 -2.36 0.00 0.00 39.78 37.33 1laj n ASN 163 CO 0.00 0.00 0.00 -1.59 -1.03 0.00 0.00 177.26 174.64 1laj s LYS 164 N -0.89 1.75 -0.15 -3.83 -2.85 -1.26 -2.48 119.74 110.04 1laj s LYS 164 Ca 0.13 -1.73 -0.27 0.00 -1.00 0.00 0.00 55.97 53.11 1laj s LYS 164 Cb 0.09 -1.82 0.07 0.00 -2.06 0.00 0.00 37.83 34.11 1laj s LYS 164 CO 0.13 0.33 0.68 -1.50 0.10 0.00 0.00 175.35 175.09 1laj s ILE 165 N -2.48 0.00 0.14 3.79 2.07 -1.20 -4.96 121.20 118.56 1laj s ILE 165 Ca 0.30 -0.02 0.07 0.00 -1.41 0.00 0.00 60.65 59.60 1laj s ILE 165 Cb -0.05 -0.97 -0.04 0.00 0.13 0.00 0.00 42.46 41.53 1laj s ILE 165 CO 0.16 -0.01 -0.16 -0.89 -1.91 0.00 0.00 174.94 172.13 1laj s THR 166 N -0.46 1.55 0.02 4.00 2.01 -1.26 -0.49 115.64 121.01 1laj s THR 166 Ca -0.06 -1.79 0.05 0.00 0.31 0.00 0.00 61.69 60.19 1laj s THR 166 Cb -0.02 -1.66 -0.02 0.00 0.01 0.00 0.00 72.50 70.81 1laj s THR 166 CO 0.06 -0.36 -0.14 -0.36 -0.69 0.00 0.00 174.62 173.13 1laj s PHE 167 N -2.06 1.22 -0.12 4.92 0.40 -1.03 -4.93 117.98 116.38 1laj s PHE 167 Ca 0.12 -0.31 -0.04 0.00 -0.60 0.00 0.00 56.93 56.10 1laj s PHE 167 Cb -0.05 -0.74 -0.03 0.00 0.51 0.00 0.00 43.02 42.70 1laj s PHE 167 CO 0.04 0.02 0.02 0.34 0.70 0.00 0.00 175.22 176.34 1laj s ASP 168 N -0.85 5.38 0.00 1.36 2.15 -1.26 -1.02 116.67 122.43 1laj s ASP 168 Ca 0.03 0.13 0.03 0.00 0.43 0.00 0.00 52.55 53.17 1laj s ASP 168 Cb -0.07 -1.67 0.02 0.00 -0.30 0.00 0.00 42.92 40.90 1laj s ASP 168 CO 0.01 0.31 0.54 0.23 -0.17 0.00 0.00 175.17 176.09 1laj n MET 169 N 2.58 0.35 0.00 4.34 2.81 0.37 -4.78 117.12 122.80 1laj n MET 169 Ca -0.18 -0.60 0.00 0.00 -1.81 0.00 0.00 57.70 55.11 1laj n MET 169 Cb 0.53 -1.00 0.00 0.00 -0.71 0.00 0.00 33.22 32.04 1laj n MET 169 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 1laj n SER 170 N 0.01 0.00 -0.07 7.83 7.64 -1.09 -0.17 113.62 127.76 1laj n SER 170 Ca 0.02 0.83 -0.15 0.00 1.01 0.00 0.00 58.87 60.58 1laj n SER 170 Cb 0.08 -0.33 -0.10 0.00 -1.01 0.00 0.00 64.21 62.85 1laj n SER 170 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1laj h ASN 171 N 0.00 -1.80 -1.03 6.43 7.08 -1.92 0.06 115.58 124.40 1laj h ASN 171 Ca 0.00 0.22 0.29 0.00 -3.08 0.00 0.00 56.30 53.73 1laj h ASN 171 Cb 0.00 0.72 -0.05 0.00 -2.08 0.00 0.00 38.32 36.91 1laj h ASN 171 CO 0.00 -0.44 0.73 0.58 -2.08 0.00 0.00 177.43 176.21 1laj h VAL 172 N -0.49 0.50 -3.26 6.14 2.07 -1.83 -3.46 116.25 115.92 1laj h VAL 172 Ca 0.05 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.54 1laj h VAL 172 Cb 0.64 0.39 -0.01 0.00 -1.52 0.00 0.00 31.29 30.79 1laj h VAL 172 CO -0.52 0.02 -0.19 0.61 0.02 0.00 0.00 177.57 177.51 1laj n GLY 173 N -1.68 -3.20 3.08 2.17 0.00 0.76 -5.04 105.19 101.28 1laj n GLY 173 Ca 0.22 -0.11 -0.31 0.00 0.00 0.00 0.00 46.02 45.82 1laj n GLY 173 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1laj s ALA 174 N -0.11 2.00 0.40 4.61 0.00 -1.15 -5.03 121.76 122.48 1laj s ALA 174 Ca -0.03 -0.97 0.00 0.00 0.00 0.00 0.00 51.96 50.96 1laj s ALA 174 Cb 0.00 -1.01 -0.02 0.00 0.00 0.00 0.00 23.12 22.09 1laj s ALA 174 CO 0.10 -0.22 0.61 -2.00 0.00 0.00 0.00 175.76 174.25 1laj s GLU 175 N 1.17 3.32 0.20 0.00 2.56 -1.26 0.57 118.70 125.25 1laj s GLU 175 Ca -0.01 -0.38 -0.11 0.00 0.00 0.00 0.00 54.97 54.48 1laj s GLU 175 Cb -0.14 -2.61 0.24 0.00 2.00 0.00 0.00 34.13 33.62 1laj s GLU 175 CO -0.07 -0.04 1.75 0.82 -0.56 0.00 0.00 175.26 177.16 1laj h ILE 176 N 0.58 0.82 -0.68 -3.70 1.08 0.15 -1.10 117.51 114.66 1laj h ILE 176 Ca -0.48 -0.15 0.08 0.00 -0.39 0.00 0.00 64.86 63.92 1laj h ILE 176 Cb 1.23 0.35 -0.06 0.00 -3.07 0.00 0.00 36.82 35.27 1laj h ILE 176 CO 0.60 0.08 0.35 1.23 -0.69 0.00 0.00 178.15 179.71 1laj h GLY 177 N 0.43 1.00 -0.45 5.37 0.00 -1.80 -2.24 103.07 105.37 1laj h GLY 177 Ca 0.28 -0.23 0.31 0.00 0.00 0.00 0.00 47.33 47.70 1laj h GLY 177 CO -0.27 0.09 0.58 -0.55 0.00 0.00 0.00 176.54 176.40 1laj h ASP 178 N 0.62 0.54 -0.99 0.19 5.19 -1.49 -2.74 116.42 117.73 1laj h ASP 178 Ca 0.32 0.18 0.12 0.00 -0.62 0.00 0.00 57.03 57.03 1laj h ASP 178 Cb 0.29 0.11 -0.14 0.00 0.18 0.00 0.00 39.33 39.78 1laj h ASP 178 CO -0.23 -0.09 -0.50 0.24 -3.12 0.00 0.00 179.24 175.54 1laj h MET 179 N 0.37 -0.01 -1.02 3.56 2.86 -1.35 0.21 114.93 119.55 1laj h MET 179 Ca 0.72 0.00 0.40 0.00 -2.06 0.00 0.00 59.70 58.76 1laj h MET 179 Cb 1.61 0.00 -0.15 0.00 0.06 0.00 0.00 31.60 33.11 1laj h MET 179 CO -0.57 -0.00 0.59 0.41 1.06 0.00 0.00 176.91 178.39 1laj n GLY 180 N -1.35 -0.71 0.21 8.32 0.00 -1.03 0.70 105.19 111.32 1laj n GLY 180 Ca 0.06 0.72 -0.03 0.00 0.00 0.00 0.00 46.02 46.77 1laj n GLY 180 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1laj h LYS 181 N 0.00 0.40 -7.46 1.61 1.63 -0.78 -3.36 116.57 108.62 1laj h LYS 181 Ca 0.78 -0.02 -0.44 0.00 -0.85 0.00 0.00 60.65 60.12 1laj h LYS 181 Cb 2.21 -0.09 0.17 0.00 -0.60 0.00 0.00 32.23 33.92 1laj h LYS 181 CO -0.61 0.27 0.21 0.71 -3.45 0.00 0.00 179.45 176.58 1laj s TYR 182 N -6.12 1.43 -0.28 1.91 4.12 0.22 -1.91 117.35 116.72 1laj s TYR 182 Ca -0.13 0.67 -0.26 0.00 0.02 0.00 0.00 57.07 57.37 1laj s TYR 182 Cb 0.15 -3.47 0.15 0.00 -1.52 0.00 0.00 41.96 37.26 1laj s TYR 182 CO 0.73 -3.20 1.17 0.00 0.02 0.00 0.00 175.55 174.28 1laj s ALA 183 N -3.15 -2.05 0.25 3.71 0.00 -0.93 -2.54 121.76 117.05 1laj s ALA 183 Ca 0.68 1.79 -0.17 0.00 0.00 0.00 0.00 51.96 54.27 1laj s ALA 183 Cb -0.12 -1.49 -0.08 0.00 0.00 0.00 0.00 23.12 21.42 1laj s ALA 183 CO 0.56 -0.20 0.70 -1.17 0.00 0.00 0.00 175.76 175.65 1laj s LEU 184 N 0.01 4.23 0.30 0.00 2.96 0.07 -2.77 118.68 123.48 1laj s LEU 184 Ca 0.04 1.31 0.05 0.00 -0.22 0.00 0.00 54.13 55.32 1laj s LEU 184 Cb -0.04 -3.74 -0.06 0.00 0.50 0.00 0.00 46.19 42.85 1laj s LEU 184 CO -0.09 -0.05 -0.01 0.27 -1.32 0.00 0.00 176.35 175.15 1laj s ILE 185 N -1.70 1.45 -0.18 6.68 -5.25 0.19 -0.99 121.20 121.41 1laj s ILE 185 Ca 0.47 -2.07 -0.21 0.00 -0.99 0.00 0.00 60.65 57.85 1laj s ILE 185 Cb -0.14 -2.58 0.05 0.00 2.95 0.00 0.00 42.46 42.75 1laj s ILE 185 CO 0.19 -0.19 0.56 -0.69 -1.79 0.00 0.00 174.94 173.03 1laj s VAL 186 N -3.13 0.00 -0.15 8.37 1.01 0.13 -3.08 120.40 123.55 1laj s VAL 186 Ca 0.32 -0.03 -0.01 0.00 0.00 0.00 0.00 61.98 62.25 1laj s VAL 186 Cb 0.06 -0.80 0.04 0.00 0.00 0.00 0.00 36.38 35.68 1laj s VAL 186 CO 0.13 -0.02 -0.03 -0.47 0.00 0.00 0.00 175.10 174.71 1laj s TYR 187 N 0.02 1.37 -0.80 5.22 5.04 0.76 -0.29 117.35 128.68 1laj s TYR 187 Ca -0.02 -0.85 -0.25 0.00 -2.44 0.00 0.00 57.07 53.50 1laj s TYR 187 Cb -0.04 -1.16 0.05 0.00 0.35 0.00 0.00 41.96 41.16 1laj s TYR 187 CO 0.02 -0.56 1.26 0.45 -1.34 0.00 0.00 175.55 175.38 1laj s SER 188 N 1.74 6.26 0.37 4.32 0.15 -0.97 -2.10 113.70 123.47 1laj s SER 188 Ca 0.01 -0.83 0.15 0.00 0.70 0.00 0.00 55.95 55.99 1laj s SER 188 Cb -0.15 -2.53 0.72 0.00 -1.71 0.00 0.00 66.02 62.35 1laj s SER 188 CO -0.07 -1.67 1.79 0.50 1.20 0.00 0.00 173.24 174.99 1laj h LYS 189 N 9.85 0.00 0.00 5.44 3.64 -1.69 0.39 116.57 134.20 1laj h LYS 189 Ca -0.16 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.22 1laj h LYS 189 Cb 1.04 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.86 1laj h LYS 189 CO 1.29 0.39 0.00 -0.25 -2.27 0.00 0.00 179.45 178.61 1laj n ASP 190 N -3.86 0.00 -4.59 4.20 8.00 -1.24 -4.45 116.55 114.62 1laj n ASP 190 Ca -0.01 0.00 -0.31 0.00 0.71 0.00 0.00 54.79 55.17 1laj n ASP 190 Cb 0.45 0.00 0.17 0.00 -0.02 0.00 0.00 41.12 41.72 1laj n ASP 190 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1laj n ASP 191 N 0.00 -0.44 -4.53 -2.24 -0.08 -1.26 -4.56 116.55 103.44 1laj n ASP 191 Ca 0.00 0.33 -0.43 0.00 -1.51 0.00 0.00 54.79 53.18 1laj n ASP 191 Cb 0.00 -1.39 0.00 0.00 2.34 0.00 0.00 41.12 42.07 1laj n ASP 191 CO 0.00 0.00 0.00 0.52 0.12 0.00 0.00 177.20 177.84 1laj n VAL 192 N -4.21 4.03 -0.76 5.18 0.31 -1.26 -4.30 118.33 117.32 1laj n VAL 192 Ca 0.10 -4.27 -0.30 0.00 -0.01 0.00 0.00 64.34 59.86 1laj n VAL 192 Cb 0.53 -2.39 -0.04 0.00 -0.91 0.00 0.00 33.84 31.03 1laj n VAL 192 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 1laj n LEU 193 N 7.53 0.38 -4.91 7.52 7.94 -0.82 -4.67 117.00 129.97 1laj n LEU 193 Ca 0.45 0.53 -0.27 0.00 -1.11 0.00 0.00 56.01 55.62 1laj n LEU 193 Cb 0.45 -0.40 0.01 0.00 0.53 0.00 0.00 43.42 44.00 1laj n LEU 193 CO 0.73 -0.53 0.46 -1.61 -1.11 0.00 0.00 177.39 175.33 1laj s GLU 194 N 0.94 3.38 0.19 1.96 0.41 -1.26 -0.73 118.70 123.60 1laj s GLU 194 Ca 0.46 0.13 -0.08 0.00 -0.41 0.00 0.00 54.97 55.06 1laj s GLU 194 Cb -0.65 -2.36 0.10 0.00 -1.78 0.00 0.00 34.13 29.45 1laj s GLU 194 CO 0.34 -0.32 1.69 0.00 -0.49 0.00 0.00 175.26 176.47 1laj h ALA 195 N 0.13 0.91 -0.00 5.21 0.00 -1.83 -2.24 119.26 121.44 1laj h ALA 195 Ca -0.47 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.17 1laj h ALA 195 Cb 1.22 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.75 1laj h ALA 195 CO 0.61 0.67 -0.09 -0.40 0.00 0.00 0.00 179.25 180.04 1laj n ASP 196 N -4.21 0.55 0.28 0.00 3.85 -1.26 -3.89 116.55 111.87 1laj n ASP 196 Ca 0.05 -0.71 0.14 0.00 -0.71 0.00 0.00 54.79 53.56 1laj n ASP 196 Cb 0.29 -0.05 0.84 0.00 -1.35 0.00 0.00 41.12 40.85 1laj n ASP 196 CO 0.00 0.00 0.00 -0.33 -1.01 0.00 0.00 177.20 175.86 1laj h GLU 197 N 0.71 0.00 -1.18 0.11 5.08 -1.69 -3.40 114.58 114.21 1laj h GLU 197 Ca 0.00 0.00 0.37 0.00 -1.00 0.00 0.00 59.36 58.73 1laj h GLU 197 Cb 0.34 0.00 -0.13 0.00 0.50 0.00 0.00 28.75 29.46 1laj h GLU 197 CO 0.00 0.06 0.93 1.41 -1.00 0.00 0.00 179.01 180.41 1laj s MET 198 N -4.38 0.16 -0.02 2.33 -2.45 -1.25 -2.05 119.30 111.63 1laj s MET 198 Ca -0.04 -0.09 -0.01 0.00 -1.25 0.00 0.00 55.69 54.31 1laj s MET 198 Cb 0.14 0.05 0.02 0.00 1.25 0.00 0.00 34.83 36.30 1laj s MET 198 CO 0.56 -0.07 0.05 0.08 1.05 0.00 0.00 175.02 176.68 1laj s VAL 199 N -2.17 -0.04 -0.02 10.11 1.01 -0.90 -4.28 120.40 124.10 1laj s VAL 199 Ca 0.15 0.16 0.02 0.00 0.00 0.00 0.00 61.98 62.31 1laj s VAL 199 Cb 0.07 -0.09 -0.03 0.00 0.00 0.00 0.00 36.38 36.32 1laj s VAL 199 CO -0.06 0.07 -0.07 -0.63 0.00 0.00 0.00 175.10 174.41 1laj s ILE 200 N 0.83 3.67 -0.12 2.22 1.09 -1.13 -1.67 121.20 126.08 1laj s ILE 200 Ca -0.07 -0.67 0.02 0.00 -1.10 0.00 0.00 60.65 58.83 1laj s ILE 200 Cb -0.10 -2.56 -0.00 0.00 -1.06 0.00 0.00 42.46 38.74 1laj s ILE 200 CO -0.03 0.46 -0.20 -1.00 -0.10 0.00 0.00 174.94 174.08 1laj s HIS 201 N -0.93 2.66 -0.27 3.97 3.76 0.90 -0.24 115.29 125.15 1laj s HIS 201 Ca 0.15 -1.00 -0.05 0.00 -0.15 0.00 0.00 55.06 54.02 1laj s HIS 201 Cb -0.11 -1.78 0.01 0.00 1.11 0.00 0.00 32.58 31.81 1laj s HIS 201 CO 0.05 -0.41 0.02 0.42 -0.85 0.00 0.00 174.74 173.98 1laj s ILE 202 N 0.48 3.56 -0.07 0.60 -1.09 -0.81 -0.54 121.20 123.33 1laj s ILE 202 Ca -0.13 -0.75 -0.12 0.00 -2.23 0.00 0.00 60.65 57.41 1laj s ILE 202 Cb -0.17 -2.79 -0.05 0.00 -1.58 0.00 0.00 42.46 37.87 1laj s ILE 202 CO 0.05 0.17 0.30 -1.81 -1.23 0.00 0.00 174.94 172.43 1laj s ASP 203 N 1.45 6.61 -0.29 3.58 1.01 0.18 -1.25 116.67 127.95 1laj s ASP 203 Ca 0.02 0.72 0.02 0.00 0.71 0.00 0.00 52.55 54.02 1laj s ASP 203 Cb -0.17 -2.18 0.08 0.00 1.01 0.00 0.00 42.92 41.67 1laj s ASP 203 CO -0.00 0.30 0.01 -0.63 0.21 0.00 0.00 175.17 175.06 1laj s ILE 204 N -0.73 1.73 0.02 0.77 -1.09 0.01 -0.92 121.20 121.00 1laj s ILE 204 Ca 0.20 -1.73 -0.30 0.00 -2.23 0.00 0.00 60.65 56.59 1laj s ILE 204 Cb -0.14 -2.15 -0.04 0.00 -1.58 0.00 0.00 42.46 38.55 1laj s ILE 204 CO 0.09 -0.41 1.01 -1.61 -1.23 0.00 0.00 174.94 172.79 1laj s GLU 205 N 1.23 4.56 0.31 2.79 0.41 -0.75 -2.45 118.70 124.79 1laj s GLU 205 Ca 0.04 1.47 -0.19 0.00 -0.41 0.00 0.00 54.97 55.88 1laj s GLU 205 Cb -0.19 -3.43 0.04 0.00 -1.78 0.00 0.00 34.13 28.77 1laj s GLU 205 CO -0.11 -0.05 0.77 -3.38 -0.49 0.00 0.00 175.26 172.00 1laj s HIS 206 N 0.90 -0.06 0.26 1.61 -3.43 -0.42 -0.93 115.29 113.22 1laj s HIS 206 Ca 0.52 -0.48 -0.30 0.00 -0.80 0.00 0.00 55.06 54.01 1laj s HIS 206 Cb -0.22 0.76 -0.10 0.00 -1.43 0.00 0.00 32.58 31.58 1laj s HIS 206 CO 0.28 -1.34 1.45 -0.65 -2.00 0.00 0.00 174.74 172.49 1laj s GLN 207 N -3.21 4.25 0.58 -0.38 -0.21 -1.03 -1.25 119.66 118.42 1laj s GLN 207 Ca 0.13 2.33 -0.18 0.00 0.02 0.00 0.00 55.36 57.66 1laj s GLN 207 Cb -0.05 -3.10 -0.06 0.00 1.00 0.00 0.00 33.01 30.80 1laj s GLN 207 CO 0.08 -0.43 0.81 0.54 -2.12 0.00 0.00 175.29 174.17 1laj n ARG 208 N 2.22 0.77 -3.36 2.91 1.74 -1.22 -4.72 116.66 115.00 1laj n ARG 208 Ca 0.06 0.30 -0.35 0.00 -0.77 0.00 0.00 57.85 57.09 1laj n ARG 208 Cb 0.40 -1.99 -0.06 0.00 -1.02 0.00 0.00 32.46 29.79 1laj n ARG 208 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1laj s ILE 209 N -1.58 4.86 -0.05 0.55 1.09 -1.26 -4.99 121.20 119.82 1laj s ILE 209 Ca 0.73 0.83 -0.38 0.00 -1.10 0.00 0.00 60.65 60.74 1laj s ILE 209 Cb -0.43 -3.74 -0.16 0.00 -1.06 0.00 0.00 42.46 37.07 1laj s ILE 209 CO 0.50 0.25 1.52 -2.65 -0.10 0.00 0.00 174.94 174.46 1laj n PRO 210 N 0.82 1.24 -0.47 2.79 -0.02 -1.26 -4.77 135.00 133.33 1laj n PRO 210 Ca -0.05 0.45 0.39 0.00 -2.02 0.00 0.00 63.50 62.27 1laj n PRO 210 Cb 0.52 -2.12 0.69 0.00 -0.02 0.00 0.00 33.50 32.56 1laj n PRO 210 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 1laj h SER 211 N 5.75 0.18 -6.61 2.55 0.02 -2.04 -3.44 113.55 109.96 1laj h SER 211 Ca -0.47 0.08 -0.53 0.00 -0.84 0.00 0.00 61.79 60.04 1laj h SER 211 Cb 1.32 0.07 -0.13 0.00 0.14 0.00 0.00 62.40 63.80 1laj h SER 211 CO 0.85 -0.10 -0.85 0.00 -1.14 0.00 0.00 176.83 175.60 1laj n ALA 212 N -2.64 -1.54 -1.58 3.77 0.00 -1.26 -4.74 120.51 112.52 1laj n ALA 212 Ca 0.36 -0.09 -0.15 0.00 0.00 0.00 0.00 53.44 53.57 1laj n ALA 212 Cb 1.48 -2.84 -0.07 0.00 0.00 0.00 0.00 19.45 18.03 1laj n ALA 212 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1laj s SER 213 N -3.70 3.94 0.00 0.00 0.01 -1.26 -4.61 113.70 108.07 1laj s SER 213 Ca 0.45 0.11 0.00 0.00 1.31 0.00 0.00 55.95 57.82 1laj s SER 213 Cb -0.24 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.44 1laj s SER 213 CO 0.90 -3.81 0.00 0.41 0.41 0.00 0.00 173.24 171.16 1laj n THR 214 N 8.73 0.00 -1.35 1.44 -1.04 -1.26 -5.15 114.28 115.64 1laj n THR 214 Ca 0.46 0.00 -0.50 0.00 -2.04 0.00 0.00 64.05 61.97 1laj n THR 214 Cb 0.44 0.00 -0.05 0.00 -1.82 0.00 0.00 70.33 68.90 1laj n THR 214 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1laj n LEU 215 N 0.00 -0.58 -3.62 -4.42 4.77 -1.26 -4.87 117.00 107.02 1laj n LEU 215 Ca 0.00 1.07 -0.35 0.00 -0.03 0.00 0.00 56.01 56.70 1laj n LEU 215 Cb 0.00 -0.87 0.03 0.00 -2.33 0.00 0.00 43.42 40.25 1laj n LEU 215 CO 0.00 -2.28 -1.91 -2.65 -1.33 0.00 0.00 177.39 169.22 1laj n PRO 216 N 1.17 0.00 0.00 3.23 -0.02 -1.26 -5.27 135.00 132.85 1laj n PRO 216 Ca 0.18 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.66 1laj n PRO 216 Cb 0.15 -0.90 0.00 0.00 -0.02 0.00 0.00 33.50 32.73 1laj n PRO 216 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76