#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ivt s SER 4 N 0.00 0.43 0.13 4.52 0.01 -1.26 -5.18 113.70 112.36 3ivt s SER 4 Ca 0.00 -0.96 0.03 0.00 1.31 0.00 0.00 55.95 56.33 3ivt s SER 4 Cb 0.00 0.22 -0.01 0.00 0.21 0.00 0.00 66.02 66.44 3ivt s SER 4 CO 0.00 -0.62 0.12 -1.84 0.41 0.00 0.00 173.24 171.31 3ivt n GLU 5 N 0.08 0.17 -0.22 12.44 0.28 -1.26 -5.07 120.64 127.07 3ivt n GLU 5 Ca -0.14 -1.33 -0.02 0.00 -0.16 0.00 0.00 57.16 55.51 3ivt n GLU 5 Cb 0.61 1.11 0.06 0.00 1.43 0.00 0.00 31.44 34.65 3ivt n GLU 5 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 3ivt n ALA 6 N -2.07 2.95 -2.77 -1.84 0.00 -1.26 -4.14 120.51 111.38 3ivt n ALA 6 Ca -0.05 -0.48 -0.39 0.00 0.00 0.00 0.00 53.44 52.52 3ivt n ALA 6 Cb 0.24 -1.06 0.01 0.00 0.00 0.00 0.00 19.45 18.64 3ivt n ALA 6 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 3ivt n ASN 7 N 0.15 6.65 -1.94 0.00 2.04 -1.26 -4.97 115.26 115.93 3ivt n ASN 7 Ca 0.09 -3.64 0.00 0.00 -0.44 0.00 0.00 54.58 50.58 3ivt n ASN 7 Cb 0.59 -1.07 0.00 0.00 -2.53 0.00 0.00 39.78 36.77 3ivt n ASN 7 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 3ivt n GLY 8 N 0.14 3.97 3.22 4.83 0.00 -1.26 -5.18 105.19 110.91 3ivt n GLY 8 Ca 0.41 -2.19 -0.09 0.00 0.00 0.00 0.00 46.02 44.15 3ivt n GLY 8 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3ivt s THR 9 N -0.66 0.13 0.18 2.61 -1.32 -1.26 -5.12 115.64 110.20 3ivt s THR 9 Ca 0.00 -1.31 -0.32 0.00 -1.21 0.00 0.00 61.69 58.86 3ivt s THR 9 Cb 0.00 -1.48 -0.11 0.00 -1.51 0.00 0.00 72.50 69.40 3ivt s THR 9 CO 0.00 -0.61 1.62 -1.83 -2.21 0.00 0.00 174.62 171.58 3ivt s GLU 10 N -3.89 4.19 0.23 7.08 1.03 -1.26 -4.96 118.70 121.11 3ivt s GLU 10 Ca 0.08 2.44 -0.32 0.00 0.03 0.00 0.00 54.97 57.21 3ivt s GLU 10 Cb 0.05 -3.13 -0.13 0.00 -0.80 0.00 0.00 34.13 30.12 3ivt s GLU 10 CO -0.08 -0.65 1.49 2.41 -1.33 0.00 0.00 175.26 177.10 3ivt n THR 11 N 3.93 0.68 -2.84 1.83 -1.04 -1.26 -4.96 114.28 110.62 3ivt n THR 11 Ca 0.14 -0.17 -0.43 0.00 -2.04 0.00 0.00 64.05 61.55 3ivt n THR 11 Cb 0.37 -1.59 -0.04 0.00 -1.82 0.00 0.00 70.33 67.25 3ivt n THR 11 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 3ivt s ILE 12 N 0.25 4.46 0.11 12.58 1.01 -1.26 -5.03 121.20 133.33 3ivt s ILE 12 Ca 0.71 0.60 0.05 0.00 0.00 0.00 0.00 60.65 62.01 3ivt s ILE 12 Cb -0.63 -4.45 -0.04 0.00 0.01 0.00 0.00 42.46 37.35 3ivt s ILE 12 CO 0.46 -0.89 0.00 -0.54 0.00 0.00 0.00 174.94 173.96 3ivt s LYS 13 N 3.77 2.52 0.78 2.79 -0.14 -1.26 -5.13 119.74 123.07 3ivt s LYS 13 Ca 0.35 -0.90 -0.12 0.00 -1.36 0.00 0.00 55.97 53.94 3ivt s LYS 13 Cb -0.11 -2.50 0.06 0.00 -1.68 0.00 0.00 37.83 33.60 3ivt s LYS 13 CO 0.24 0.52 1.11 -1.25 -0.76 0.00 0.00 175.35 175.21 3ivt s PRO 14 N -2.46 2.19 0.00 -1.68 0.04 -1.26 -5.31 135.00 126.52 3ivt s PRO 14 Ca 0.26 0.48 0.00 0.00 0.04 0.00 0.00 61.00 61.78 3ivt s PRO 14 Cb -0.11 -1.94 0.00 0.00 0.04 0.00 0.00 34.50 32.48 3ivt s PRO 14 CO 0.18 -1.51 0.96 -2.30 0.04 0.00 0.00 177.00 174.38 3ivt n PRO 15 N -3.33 0.00 -2.48 0.56 -0.02 -1.26 -5.30 135.00 123.17 3ivt n PRO 15 Ca 0.07 0.70 -0.32 0.00 -2.02 0.00 0.00 63.50 61.93 3ivt n PRO 15 Cb 0.57 -1.46 -0.04 0.00 -0.02 0.00 0.00 33.50 32.56 3ivt n PRO 15 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 3ivt s PRO 20 N -2.84 3.94 0.04 0.52 0.02 -1.26 -5.33 135.00 130.09 3ivt s PRO 20 Ca 0.00 0.90 0.07 0.00 0.02 0.00 0.00 61.00 61.99 3ivt s PRO 20 Cb 0.00 -2.17 -0.03 0.00 0.02 0.00 0.00 34.50 32.32 3ivt s PRO 20 CO 0.00 -0.23 -0.17 0.71 -0.33 0.00 0.00 177.00 176.99 3ivt s TYR 21 N -2.57 2.59 0.00 6.54 2.02 -1.26 -5.10 117.35 119.58 3ivt s TYR 21 Ca 0.58 -0.23 0.00 0.00 -0.37 0.00 0.00 57.07 57.05 3ivt s TYR 21 Cb -0.10 -1.48 0.00 0.00 -0.40 0.00 0.00 41.96 39.99 3ivt s TYR 21 CO 0.30 0.27 0.00 0.41 -1.57 0.00 0.00 175.55 174.96 3ivt n GLY 22 N 1.53 2.60 3.77 0.71 0.00 -1.26 -5.15 105.19 107.39 3ivt n GLY 22 Ca -0.16 -0.80 -0.40 0.00 0.00 0.00 0.00 46.02 44.67 3ivt n GLY 22 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3ivt s PRO 23 N 0.35 4.52 0.49 1.61 0.04 -1.26 -5.05 135.00 135.70 3ivt s PRO 23 Ca 0.00 1.10 -0.21 0.00 0.04 0.00 0.00 61.00 61.93 3ivt s PRO 23 Cb 0.00 -3.30 -0.07 0.00 0.04 0.00 0.00 34.50 31.16 3ivt s PRO 23 CO 0.00 0.46 1.10 -0.80 0.04 0.00 0.00 177.00 177.80 3ivt s ASN 24 N -0.71 6.15 0.35 6.66 0.01 -1.26 -4.96 114.94 121.18 3ivt s ASN 24 Ca 0.37 2.11 0.13 0.00 -0.71 0.00 0.00 52.86 54.75 3ivt s ASN 24 Cb -0.22 -2.58 0.98 0.00 0.41 0.00 0.00 41.25 39.85 3ivt s ASN 24 CO 0.25 -0.92 1.73 -0.65 -1.51 0.00 0.00 177.10 175.99 3ivt h PRO 25 N 1.67 0.47 -0.69 -0.60 0.11 -2.03 -1.56 132.00 129.37 3ivt h PRO 25 Ca -0.49 -0.03 0.13 0.00 0.11 0.00 0.00 66.00 65.71 3ivt h PRO 25 Cb 1.24 -0.11 -0.09 0.00 0.11 0.00 0.00 31.00 32.15 3ivt h PRO 25 CO 0.59 0.31 0.24 0.77 -0.21 0.00 0.00 178.00 179.70 3ivt h SER 26 N 0.49 0.18 -0.31 -2.05 0.02 -2.00 -2.01 113.55 107.88 3ivt h SER 26 Ca 0.65 0.11 0.09 0.00 -0.84 0.00 0.00 61.79 61.80 3ivt h SER 26 Cb 1.40 0.11 -0.01 0.00 0.14 0.00 0.00 62.40 64.03 3ivt h SER 26 CO -0.45 0.08 0.24 0.44 -1.14 0.00 0.00 176.83 176.00 3ivt h ASP 27 N 0.38 0.00 0.33 3.07 3.32 -1.63 -0.52 116.42 121.36 3ivt h ASP 27 Ca 0.37 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.41 3ivt h ASP 27 Cb 0.55 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.10 3ivt h ASP 27 CO -0.39 0.00 -0.08 -0.26 -1.72 0.00 0.00 179.24 176.79 3ivt h PHE 28 N 0.00 0.00 0.00 4.55 0.04 -1.46 -1.72 116.94 118.35 3ivt h PHE 28 Ca 0.15 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.92 3ivt h PHE 28 Cb 0.63 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.78 3ivt h PHE 28 CO 0.00 0.08 -0.60 1.28 -0.60 0.00 0.00 178.31 178.46 3ivt n LEU 29 N -3.55 0.57 -4.76 1.54 4.77 -0.21 -4.93 117.00 110.44 3ivt n LEU 29 Ca -0.02 -0.01 -0.41 0.00 -0.03 0.00 0.00 56.01 55.54 3ivt n LEU 29 Cb 0.20 -0.21 -0.02 0.00 -2.33 0.00 0.00 43.42 41.06 3ivt n LEU 29 CO 0.28 0.11 1.05 -0.55 -1.33 0.00 0.00 177.39 176.95 3ivt s SER 30 N -3.23 6.67 -0.19 -1.43 0.15 -0.65 -3.43 113.70 111.59 3ivt s SER 30 Ca 0.10 2.72 0.16 0.00 0.70 0.00 0.00 55.95 59.63 3ivt s SER 30 Cb 0.17 -2.64 0.57 0.00 -1.71 0.00 0.00 66.02 62.41 3ivt s SER 30 CO 0.72 -0.65 1.48 0.54 1.20 0.00 0.00 173.24 176.53 3ivt n ARG 31 N 1.40 3.15 0.20 5.44 5.12 0.87 -4.78 116.66 128.07 3ivt n ARG 31 Ca 0.03 -2.91 0.13 0.00 -1.93 0.00 0.00 57.85 53.17 3ivt n ARG 31 Cb 0.41 -1.91 0.72 0.00 -1.16 0.00 0.00 32.46 30.52 3ivt n ARG 31 CO 0.00 0.00 0.00 -0.39 -1.93 0.00 0.00 177.63 175.31 3ivt h VAL 32 N 2.07 0.79 -0.34 1.55 -1.51 -1.91 -2.18 116.25 114.72 3ivt h VAL 32 Ca 0.02 0.00 -0.24 0.00 -1.23 0.00 0.00 66.70 65.25 3ivt h VAL 32 Cb 1.55 0.92 -0.17 0.00 -2.13 0.00 0.00 31.29 31.45 3ivt h VAL 32 CO 0.28 0.00 -0.49 -0.46 -1.23 0.00 0.00 177.57 175.67 3ivt n ASN 33 N -4.29 3.11 -2.71 4.19 0.23 -1.26 -4.84 115.26 109.68 3ivt n ASN 33 Ca 0.00 -3.83 -0.04 0.00 -0.53 0.00 0.00 54.58 50.18 3ivt n ASN 33 Cb 0.24 -0.50 0.03 0.00 -2.08 0.00 0.00 39.78 37.46 3ivt n ASN 33 CO 0.00 0.00 0.00 -3.20 -0.93 0.00 0.00 177.26 173.13 3ivt n ASN 34 N -0.98 -2.44 -3.79 0.53 5.15 -0.82 -5.03 115.26 107.88 3ivt n ASN 34 Ca 0.31 -2.00 -0.09 0.00 -0.60 0.00 0.00 54.58 52.20 3ivt n ASN 34 Cb 0.84 1.25 -0.04 0.00 -0.53 0.00 0.00 39.78 41.31 3ivt n ASN 34 CO 0.00 0.00 0.00 0.72 1.40 0.00 0.00 177.26 179.38 3ivt s PHE 35 N 0.87 0.25 -0.03 1.20 -0.12 -1.25 -4.76 117.98 114.14 3ivt s PHE 35 Ca 0.27 -0.66 0.06 0.00 -0.05 0.00 0.00 56.93 56.55 3ivt s PHE 35 Cb 0.08 0.37 -0.01 0.00 -0.63 0.00 0.00 43.02 42.82 3ivt s PHE 35 CO -0.09 -1.13 -0.23 -1.12 -0.05 0.00 0.00 175.22 172.60 3ivt s SER 36 N -3.02 2.77 -0.01 1.98 0.01 -0.33 -5.02 113.70 110.09 3ivt s SER 36 Ca 0.19 -0.44 -0.21 0.00 1.31 0.00 0.00 55.95 56.80 3ivt s SER 36 Cb -0.03 -0.52 -0.05 0.00 0.21 0.00 0.00 66.02 65.64 3ivt s SER 36 CO 0.10 0.26 0.61 -0.63 0.41 0.00 0.00 173.24 173.99 3ivt s ILE 37 N -0.35 4.93 -0.42 1.44 1.01 -1.26 -1.38 121.20 125.17 3ivt s ILE 37 Ca 0.03 1.28 -0.12 0.00 0.00 0.00 0.00 60.65 61.85 3ivt s ILE 37 Cb -0.11 -3.95 0.06 0.00 0.01 0.00 0.00 42.46 38.47 3ivt s ILE 37 CO 0.01 0.39 0.28 -0.63 0.00 0.00 0.00 174.94 174.98 3ivt s ILE 38 N -0.02 4.62 -0.18 2.92 1.01 -0.39 -2.81 121.20 126.35 3ivt s ILE 38 Ca 0.32 -1.12 -0.21 0.00 0.00 0.00 0.00 60.65 59.65 3ivt s ILE 38 Cb -0.18 -3.72 -0.03 0.00 0.01 0.00 0.00 42.46 38.54 3ivt s ILE 38 CO 0.17 -0.43 0.63 -0.70 0.00 0.00 0.00 174.94 174.62 3ivt s GLU 39 N 1.53 4.23 -0.14 2.79 -6.30 0.21 -1.79 118.70 119.24 3ivt s GLU 39 Ca 0.03 0.63 0.17 0.00 -2.50 0.00 0.00 54.97 53.31 3ivt s GLU 39 Cb -0.22 -3.56 0.30 0.00 0.00 0.00 0.00 34.13 30.65 3ivt s GLU 39 CO 0.05 -0.20 1.16 0.45 0.02 0.00 0.00 175.26 176.73 3ivt n SER 40 N 4.90 2.17 -0.08 -1.70 2.88 0.68 -0.95 113.62 121.53 3ivt n SER 40 Ca -0.02 -3.17 0.11 0.00 -1.33 0.00 0.00 58.87 54.47 3ivt n SER 40 Cb 0.50 -0.44 0.48 0.00 -0.75 0.00 0.00 64.21 64.00 3ivt n SER 40 CO 0.00 0.00 0.00 0.74 -1.23 0.00 0.00 175.04 174.55 3ivt h THR 41 N 0.41 0.93 -0.36 2.46 2.02 -1.84 -0.30 112.91 116.23 3ivt h THR 41 Ca -0.00 -0.15 0.00 0.00 0.77 0.00 0.00 66.41 67.03 3ivt h THR 41 Cb 1.02 0.44 0.00 0.00 -1.74 0.00 0.00 68.15 67.87 3ivt h THR 41 CO 0.00 0.08 0.00 0.18 0.37 0.00 0.00 175.52 176.15 3ivt n LEU 42 N -4.47 2.67 0.00 2.58 4.77 -1.26 -2.88 117.00 118.41 3ivt n LEU 42 Ca 0.09 -1.21 0.00 0.00 -0.03 0.00 0.00 56.01 54.87 3ivt n LEU 42 Cb 0.33 -0.24 0.00 0.00 -2.33 0.00 0.00 43.42 41.18 3ivt n LEU 42 CO 0.34 0.60 0.00 -1.14 -1.33 0.00 0.00 177.39 175.86 3ivt n ARG 43 N 0.97 0.00 -0.29 3.23 0.63 -0.35 -2.69 116.66 118.16 3ivt n ARG 43 Ca 0.18 0.00 0.08 0.00 -0.92 0.00 0.00 57.85 57.19 3ivt n ARG 43 Cb 0.46 0.00 0.31 0.00 0.45 0.00 0.00 32.46 33.68 3ivt n ARG 43 CO 0.00 0.00 0.00 1.49 -2.51 0.00 0.00 177.63 176.61 3ivt h GLU 44 N 0.00 0.83 -0.14 -0.14 4.57 -1.36 -0.98 114.58 117.36 3ivt h GLU 44 Ca 0.00 -0.05 0.04 0.00 -1.18 0.00 0.00 59.36 58.17 3ivt h GLU 44 Cb 0.00 -0.19 -0.01 0.00 -0.16 0.00 0.00 28.75 28.40 3ivt h GLU 44 CO 0.00 0.55 0.10 0.78 -1.18 0.00 0.00 179.01 179.26 3ivt h GLY 45 N 0.85 0.00 2.00 1.92 0.00 -1.22 -0.38 103.07 106.24 3ivt h GLY 45 Ca 0.43 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.75 3ivt h GLY 45 CO -0.19 0.00 -0.03 0.83 0.00 0.00 0.00 176.54 177.15 3ivt h GLU 46 N 0.00 0.00 0.00 4.80 4.39 -1.21 -1.36 114.58 121.20 3ivt h GLU 46 Ca 0.06 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.76 3ivt h GLU 46 Cb 0.26 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.91 3ivt h GLU 46 CO -0.00 0.03 0.00 1.04 -1.16 0.00 0.00 179.01 178.92 3ivt n GLN 47 N -3.22 0.01 -1.76 2.33 6.02 -0.15 -4.77 117.38 115.84 3ivt n GLN 47 Ca -0.01 0.05 -0.42 0.00 -0.01 0.00 0.00 57.00 56.61 3ivt n GLN 47 Cb 0.20 -1.50 -0.02 0.00 1.02 0.00 0.00 30.24 29.94 3ivt n GLN 47 CO 0.00 0.00 0.00 0.12 -1.01 0.00 0.00 177.06 176.17 3ivt s PHE 48 N -2.99 2.82 0.47 1.08 5.36 -0.51 -3.94 117.98 120.27 3ivt s PHE 48 Ca 0.13 0.60 0.33 0.00 -0.96 0.00 0.00 56.93 57.03 3ivt s PHE 48 Cb 0.17 -4.09 1.46 0.00 -0.34 0.00 0.00 43.02 40.22 3ivt s PHE 48 CO 0.48 -3.88 1.66 0.00 -1.46 0.00 0.00 175.22 172.02 3ivt h ALA 49 N 5.70 2.94 -0.07 11.12 0.00 -1.89 -0.90 119.26 136.15 3ivt h ALA 49 Ca -0.45 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.49 3ivt h ALA 49 Cb 1.21 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 19.14 3ivt h ALA 49 CO 0.86 -1.48 -0.11 -1.71 0.00 0.00 0.00 179.25 176.81 3ivt n ASN 50 N -4.46 2.46 -4.69 0.00 5.15 -1.26 -5.00 115.26 107.46 3ivt n ASN 50 Ca 0.35 -3.31 -0.39 0.00 -0.60 0.00 0.00 54.58 50.64 3ivt n ASN 50 Cb 1.43 -0.48 -0.06 0.00 -0.53 0.00 0.00 39.78 40.14 3ivt n ASN 50 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3ivt s ALA 51 N -2.98 3.51 -0.38 5.20 0.00 -0.34 -4.45 121.76 122.31 3ivt s ALA 51 Ca 0.36 -0.28 0.10 0.00 0.00 0.00 0.00 51.96 52.14 3ivt s ALA 51 Cb 0.32 -2.77 0.31 0.00 0.00 0.00 0.00 23.12 20.98 3ivt s ALA 51 CO 0.02 -0.26 0.66 1.19 0.00 0.00 0.00 175.76 177.36 3ivt n PHE 52 N 4.32 -0.13 -2.02 0.00 3.72 -1.26 -4.91 117.46 117.18 3ivt n PHE 52 Ca -0.05 -3.67 -0.42 0.00 -0.05 0.00 0.00 57.45 53.26 3ivt n PHE 52 Cb 0.51 -0.33 -0.03 0.00 -0.94 0.00 0.00 39.48 38.69 3ivt n PHE 52 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 176.76 176.65 3ivt s PHE 53 N -1.87 2.57 0.69 1.38 0.08 -1.26 -5.03 117.98 114.54 3ivt s PHE 53 Ca 0.38 0.48 -0.03 0.00 0.12 0.00 0.00 56.93 57.88 3ivt s PHE 53 Cb 0.28 -3.87 0.08 0.00 -0.57 0.00 0.00 43.02 38.95 3ivt s PHE 53 CO -0.09 -3.41 0.96 0.16 -0.10 0.00 0.00 175.22 172.74 3ivt s ASP 54 N 2.22 4.66 0.15 1.36 1.47 -1.26 -4.86 116.67 120.41 3ivt s ASP 54 Ca 0.71 0.05 -0.20 0.00 1.18 0.00 0.00 52.55 54.29 3ivt s ASP 54 Cb -0.37 -0.63 0.04 0.00 -0.34 0.00 0.00 42.92 41.61 3ivt s ASP 54 CO 0.30 -1.64 1.67 0.74 0.68 0.00 0.00 175.17 176.92 3ivt h THR 55 N -0.47 0.58 -0.89 2.11 2.02 -1.98 -0.33 112.91 113.96 3ivt h THR 55 Ca -0.41 0.00 0.07 0.00 0.77 0.00 0.00 66.41 66.83 3ivt h THR 55 Cb 1.29 0.58 -0.06 0.00 -1.74 0.00 0.00 68.15 68.22 3ivt h THR 55 CO 0.50 0.00 0.55 -0.33 0.37 0.00 0.00 175.52 176.61 3ivt h GLU 56 N -0.09 0.97 -0.29 6.66 3.07 -1.99 0.40 114.58 123.31 3ivt h GLU 56 Ca 0.15 -0.06 -0.15 0.00 -0.50 0.00 0.00 59.36 58.80 3ivt h GLU 56 Cb 0.31 -0.22 -0.01 0.00 -0.84 0.00 0.00 28.75 28.00 3ivt h GLU 56 CO -0.34 0.64 -0.44 -0.22 -1.40 0.00 0.00 179.01 177.25 3ivt h LYS 57 N 0.99 0.72 -0.82 2.33 1.63 -1.68 -1.70 116.57 118.05 3ivt h LYS 57 Ca 0.39 -0.40 -0.02 0.00 -0.85 0.00 0.00 60.65 59.77 3ivt h LYS 57 Cb 0.20 0.02 -0.04 0.00 -0.60 0.00 0.00 32.23 31.81 3ivt h LYS 57 CO -0.18 1.02 0.44 0.87 -3.45 0.00 0.00 179.45 178.14 3ivt h LYS 58 N 0.58 1.15 -0.36 1.90 1.57 -0.54 -1.77 116.57 119.10 3ivt h LYS 58 Ca 0.04 -0.14 -0.02 0.00 -1.87 0.00 0.00 60.65 58.65 3ivt h LYS 58 Cb 0.99 -0.22 -0.02 0.00 0.08 0.00 0.00 32.23 33.07 3ivt h LYS 58 CO 0.09 0.86 0.14 0.82 -0.57 0.00 0.00 179.45 180.79 3ivt h ILE 59 N 1.14 1.19 -0.42 1.86 2.04 -0.56 -0.17 117.51 122.60 3ivt h ILE 59 Ca 0.29 -0.61 0.01 0.00 1.00 0.00 0.00 64.86 65.56 3ivt h ILE 59 Cb 0.05 0.91 -0.03 0.00 -0.74 0.00 0.00 36.82 37.02 3ivt h ILE 59 CO -0.04 0.21 0.26 1.56 0.00 0.00 0.00 178.15 180.14 3ivt h GLN 60 N 0.44 0.51 -0.46 2.37 4.20 -1.26 0.56 115.11 121.47 3ivt h GLN 60 Ca 0.12 -0.03 -0.03 0.00 0.06 0.00 0.00 58.65 58.77 3ivt h GLN 60 Cb 0.20 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 27.85 3ivt h GLN 60 CO -0.01 0.34 0.17 0.82 -0.67 0.00 0.00 178.83 179.47 3ivt h ILE 61 N 0.52 1.21 -0.13 2.54 2.04 -1.09 -0.78 117.51 121.83 3ivt h ILE 61 Ca 0.16 -0.68 -0.00 0.00 1.00 0.00 0.00 64.86 65.34 3ivt h ILE 61 Cb -0.01 0.80 -0.01 0.00 -0.74 0.00 0.00 36.82 36.86 3ivt h ILE 61 CO -0.06 0.25 0.08 0.00 0.00 0.00 0.00 178.15 178.42 3ivt h ALA 62 N 1.01 0.17 -0.78 1.87 0.00 -0.84 0.50 119.26 121.19 3ivt h ALA 62 Ca 0.15 -0.03 0.05 0.00 0.00 0.00 0.00 54.91 55.08 3ivt h ALA 62 Cb 0.22 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 17.91 3ivt h ALA 62 CO -0.01 -0.32 0.48 0.87 0.00 0.00 0.00 179.25 180.27 3ivt h LYS 63 N 0.15 0.86 -0.06 0.00 1.57 -0.70 0.27 116.57 118.66 3ivt h LYS 63 Ca 0.05 -0.05 -0.18 0.00 -1.87 0.00 0.00 60.65 58.59 3ivt h LYS 63 Cb 0.02 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.13 3ivt h LYS 63 CO -0.01 0.57 -0.75 0.00 -0.57 0.00 0.00 179.45 178.69 3ivt h ALA 64 N 1.37 0.61 -0.41 3.86 0.00 -0.91 -1.94 119.26 121.84 3ivt h ALA 64 Ca 0.34 -0.62 -0.04 0.00 0.00 0.00 0.00 54.91 54.58 3ivt h ALA 64 Cb 0.13 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 3ivt h ALA 64 CO -0.16 0.78 0.09 -0.07 0.00 0.00 0.00 179.25 179.89 3ivt h LEU 65 N 0.23 0.63 -0.18 0.00 3.38 -0.33 -0.46 115.31 118.59 3ivt h LEU 65 Ca -0.03 -0.24 0.03 0.00 0.09 0.00 0.00 57.88 57.73 3ivt h LEU 65 Cb 1.32 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.88 3ivt h LEU 65 CO 0.12 0.71 -0.02 -0.78 0.09 0.00 0.00 178.44 178.57 3ivt h ASP 66 N 0.53 -0.12 -0.06 -0.43 3.58 -0.81 -2.25 116.42 116.86 3ivt h ASP 66 Ca 0.13 0.05 -0.07 0.00 0.42 0.00 0.00 57.03 57.56 3ivt h ASP 66 Cb 0.34 0.09 -0.01 0.00 1.72 0.00 0.00 39.33 41.46 3ivt h ASP 66 CO 0.00 -0.04 -0.14 0.78 -2.88 0.00 0.00 179.24 176.97 3ivt h ASN 67 N 0.03 0.38 -0.81 2.28 2.35 -1.30 -2.66 115.58 115.85 3ivt h ASN 67 Ca 0.08 -0.09 0.00 0.00 -0.55 0.00 0.00 56.30 55.74 3ivt h ASN 67 Cb 0.12 -0.10 -0.04 0.00 0.05 0.00 0.00 38.32 38.34 3ivt h ASN 67 CO -0.16 0.55 0.51 0.15 -1.65 0.00 0.00 177.43 176.83 3ivt h PHE 68 N 0.37 1.05 0.00 1.19 3.57 -0.52 -3.43 116.94 119.17 3ivt h PHE 68 Ca 0.07 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.58 3ivt h PHE 68 Cb 0.47 -0.35 0.00 0.00 2.79 0.00 0.00 35.95 38.86 3ivt h PHE 68 CO 0.01 0.68 0.00 0.41 -2.23 0.00 0.00 178.31 177.19 3ivt n GLY 69 N -1.34 0.28 3.76 2.40 0.00 -0.92 -0.87 105.19 108.51 3ivt n GLY 69 Ca 0.09 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.76 3ivt n GLY 69 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3ivt s VAL 70 N -1.13 2.91 0.01 1.61 -7.23 -1.19 -4.86 120.40 110.52 3ivt s VAL 70 Ca 0.00 0.55 0.11 0.00 -1.81 0.00 0.00 61.98 60.82 3ivt s VAL 70 Cb 0.00 -3.19 -0.19 0.00 0.56 0.00 0.00 36.38 33.56 3ivt s VAL 70 CO 0.00 -0.14 1.02 0.44 -0.31 0.00 0.00 175.10 176.11 3ivt h ASP 71 N 0.89 0.00 -4.46 4.85 3.32 -1.93 -3.42 116.42 115.67 3ivt h ASP 71 Ca -0.50 0.00 -0.19 0.00 0.02 0.00 0.00 57.03 56.36 3ivt h ASP 71 Cb 1.28 0.00 -0.24 0.00 0.22 0.00 0.00 39.33 40.59 3ivt h ASP 71 CO 0.56 0.92 -0.69 -0.31 -1.72 0.00 0.00 179.24 178.00 3ivt s TYR 72 N -2.71 0.13 -0.05 4.55 2.02 -1.12 -0.72 117.35 119.45 3ivt s TYR 72 Ca -0.01 -0.27 0.06 0.00 -0.37 0.00 0.00 57.07 56.48 3ivt s TYR 72 Cb 0.09 -0.10 -0.01 0.00 -0.40 0.00 0.00 41.96 41.54 3ivt s TYR 72 CO 0.82 -0.12 -0.23 0.96 -1.57 0.00 0.00 175.55 175.40 3ivt s ILE 73 N -0.84 1.92 -0.15 2.71 -4.36 -0.78 -0.62 121.20 119.07 3ivt s ILE 73 Ca -0.09 -0.99 -0.06 0.00 -0.26 0.00 0.00 60.65 59.25 3ivt s ILE 73 Cb -0.06 -1.62 -0.04 0.00 1.25 0.00 0.00 42.46 41.99 3ivt s ILE 73 CO -0.00 0.54 0.06 -0.70 0.24 0.00 0.00 174.94 175.07 3ivt s GLU 74 N -0.14 3.66 0.14 0.37 2.12 -0.13 -1.04 118.70 123.67 3ivt s GLU 74 Ca -0.03 -0.33 0.08 0.00 0.36 0.00 0.00 54.97 55.05 3ivt s GLU 74 Cb -0.13 -3.10 -0.04 0.00 0.26 0.00 0.00 34.13 31.11 3ivt s GLU 74 CO 0.03 0.46 -0.11 -0.51 -0.54 0.00 0.00 175.26 174.59 3ivt s LEU 75 N -0.15 2.97 0.27 2.70 1.43 0.42 -2.83 118.68 123.49 3ivt s LEU 75 Ca 0.07 -0.48 -0.28 0.00 -1.03 0.00 0.00 54.13 52.41 3ivt s LEU 75 Cb -0.12 -1.73 -0.15 0.00 0.03 0.00 0.00 46.19 44.22 3ivt s LEU 75 CO 0.01 0.15 0.87 0.41 0.23 0.00 0.00 176.35 178.02 3ivt n THR 76 N 0.46 2.00 -1.55 5.49 -1.04 -1.09 -1.55 114.28 116.99 3ivt n THR 76 Ca -0.13 -0.50 -0.52 0.00 -2.04 0.00 0.00 64.05 60.86 3ivt n THR 76 Cb 0.54 -0.74 -0.05 0.00 -1.82 0.00 0.00 70.33 68.26 3ivt n THR 76 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 3ivt n SER 77 N 1.41 0.92 0.00 8.00 2.88 -1.09 -4.65 113.62 121.09 3ivt n SER 77 Ca 0.12 1.14 0.10 0.00 -1.33 0.00 0.00 58.87 58.89 3ivt n SER 77 Cb 0.31 -1.12 0.44 0.00 -0.75 0.00 0.00 64.21 63.09 3ivt n SER 77 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 3ivt n PRO 78 N 1.87 0.04 -0.05 -1.46 -0.04 -1.26 -2.02 135.00 132.08 3ivt n PRO 78 Ca 0.17 0.15 0.12 0.00 -0.04 0.00 0.00 63.50 63.90 3ivt n PRO 78 Cb 0.19 -1.50 0.35 0.00 -0.04 0.00 0.00 33.50 32.50 3ivt n PRO 78 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 3ivt n VAL 79 N -1.47 0.12 -0.11 0.52 0.24 -1.26 -2.99 118.33 113.38 3ivt n VAL 79 Ca 0.05 -0.40 0.00 0.00 -2.04 0.00 0.00 64.34 61.96 3ivt n VAL 79 Cb 0.22 0.76 0.27 0.00 -1.47 0.00 0.00 33.84 33.63 3ivt n VAL 79 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3ivt h ALA 80 N 4.38 1.42 -1.78 2.33 0.00 -1.77 -3.46 119.26 120.38 3ivt h ALA 80 Ca 0.00 -0.12 0.15 0.00 0.00 0.00 0.00 54.91 54.93 3ivt h ALA 80 Cb 0.68 -0.22 -0.19 0.00 0.00 0.00 0.00 17.79 18.05 3ivt h ALA 80 CO 0.00 0.46 0.62 -1.54 0.00 0.00 0.00 179.25 178.78 3ivt s SER 81 N -6.56 -0.29 0.20 0.00 1.04 -1.26 -5.00 113.70 101.83 3ivt s SER 81 Ca -0.09 0.13 -0.10 0.00 0.48 0.00 0.00 55.95 56.36 3ivt s SER 81 Cb 0.17 0.28 0.22 0.00 0.10 0.00 0.00 66.02 66.79 3ivt s SER 81 CO 0.77 -0.40 1.79 -0.08 0.98 0.00 0.00 173.24 176.30 3ivt h GLU 82 N 2.18 0.56 -0.74 4.02 4.57 -1.89 -0.74 114.58 122.53 3ivt h GLU 82 Ca -0.17 -0.03 0.08 0.00 -1.18 0.00 0.00 59.36 58.06 3ivt h GLU 82 Cb 1.19 -0.13 -0.07 0.00 -0.16 0.00 0.00 28.75 29.59 3ivt h GLU 82 CO 0.28 0.37 0.41 0.37 -1.18 0.00 0.00 179.01 179.26 3ivt h GLN 83 N 0.58 0.68 -0.31 1.92 5.75 -1.96 -1.17 115.11 120.60 3ivt h GLN 83 Ca 0.28 -0.04 0.00 0.00 -0.15 0.00 0.00 58.65 58.74 3ivt h GLN 83 Cb 0.22 -0.15 -0.02 0.00 1.07 0.00 0.00 27.48 28.60 3ivt h GLN 83 CO -0.20 0.45 0.20 0.77 -2.65 0.00 0.00 178.83 177.40 3ivt h SER 84 N 0.70 0.36 -0.56 -0.69 0.02 -1.50 0.18 113.55 112.06 3ivt h SER 84 Ca 0.35 -0.03 0.06 0.00 -0.84 0.00 0.00 61.79 61.34 3ivt h SER 84 Cb 0.31 -0.09 -0.06 0.00 0.14 0.00 0.00 62.40 62.71 3ivt h SER 84 CO -0.24 0.28 0.26 -0.09 -1.14 0.00 0.00 176.83 175.90 3ivt h ARG 85 N 0.41 0.47 -0.57 3.45 2.43 -0.66 -1.35 114.38 118.57 3ivt h ARG 85 Ca 0.11 -0.03 -0.11 0.00 -0.81 0.00 0.00 59.98 59.15 3ivt h ARG 85 Cb -0.03 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.40 3ivt h ARG 85 CO -0.02 0.31 -0.07 1.96 -1.51 0.00 0.00 179.97 180.64 3ivt h GLN 86 N 0.49 1.05 -0.52 0.20 4.20 -0.62 -2.38 115.11 117.54 3ivt h GLN 86 Ca 0.26 -0.37 -0.08 0.00 0.06 0.00 0.00 58.65 58.53 3ivt h GLN 86 Cb 0.23 -0.08 -0.02 0.00 0.30 0.00 0.00 27.48 27.91 3ivt h GLN 86 CO -0.21 1.06 0.00 -0.44 -0.67 0.00 0.00 178.83 178.57 3ivt h ASP 87 N 0.94 0.84 0.11 1.46 3.32 -0.64 -0.70 116.42 121.75 3ivt h ASP 87 Ca 0.15 -0.21 -0.01 0.00 0.02 0.00 0.00 57.03 56.98 3ivt h ASP 87 Cb 0.63 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 39.96 3ivt h ASP 87 CO 0.04 0.90 -0.05 0.00 -1.72 0.00 0.00 179.24 178.42 3ivt h GLU 89 N -0.28 0.10 0.01 0.00 5.08 -1.24 -1.01 114.58 117.24 3ivt h GLU 89 Ca -0.01 -0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.34 3ivt h GLU 89 Cb 0.23 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 3ivt h GLU 89 CO 0.02 0.07 -0.03 0.00 -1.00 0.00 0.00 179.01 178.07 3ivt h ALA 90 N 1.46 -0.04 -0.54 3.43 0.00 -0.94 -2.54 119.26 120.08 3ivt h ALA 90 Ca 0.25 -0.00 -0.08 0.00 0.00 0.00 0.00 54.91 55.09 3ivt h ALA 90 Cb 0.39 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 3ivt h ALA 90 CO -0.43 -0.53 0.03 0.82 0.00 0.00 0.00 179.25 179.13 3ivt h ILE 91 N -0.07 1.25 0.00 0.00 2.04 -0.83 -1.52 117.51 118.38 3ivt h ILE 91 Ca 0.01 -1.03 0.00 0.00 1.00 0.00 0.00 64.86 64.84 3ivt h ILE 91 Cb 0.08 0.81 0.00 0.00 -0.74 0.00 0.00 36.82 36.97 3ivt h ILE 91 CO -0.03 0.37 0.00 0.00 0.00 0.00 0.00 178.15 178.49 3ivt n LYS 93 N -2.11 2.07 0.00 0.00 5.02 -0.58 -4.42 118.16 118.15 3ivt n LYS 93 Ca 0.00 -1.75 0.15 0.00 -2.02 0.00 0.00 58.31 54.70 3ivt n LYS 93 Cb 0.10 -1.44 0.76 0.00 -0.02 0.00 0.00 35.03 34.42 3ivt n LYS 93 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3ivt n LEU 94 N 1.11 0.01 -2.60 -0.35 4.77 -1.10 -4.92 117.00 113.92 3ivt n LEU 94 Ca 0.13 0.28 -0.17 0.00 -0.03 0.00 0.00 56.01 56.22 3ivt n LEU 94 Cb 0.56 -0.28 0.05 0.00 -2.33 0.00 0.00 43.42 41.42 3ivt n LEU 94 CO 0.16 0.00 0.13 0.61 -1.33 0.00 0.00 177.39 176.97 3ivt n GLY 95 N 1.29 -0.14 3.71 -0.72 0.00 -1.26 -5.01 105.19 103.05 3ivt n GLY 95 Ca 0.14 -0.04 -0.33 0.00 0.00 0.00 0.00 46.02 45.80 3ivt n GLY 95 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ivt s LEU 96 N -5.39 3.16 0.02 0.99 1.43 -1.26 -4.96 118.68 112.68 3ivt s LEU 96 Ca 0.37 2.29 -0.10 0.00 -1.03 0.00 0.00 54.13 55.66 3ivt s LEU 96 Cb -0.16 -4.58 -0.32 0.00 0.03 0.00 0.00 46.19 41.16 3ivt s LEU 96 CO 0.46 -2.52 0.95 0.07 0.23 0.00 0.00 176.35 175.54 3ivt h LYS 97 N -0.82 0.40 -7.22 1.70 5.09 -1.95 -3.46 116.57 110.32 3ivt h LYS 97 Ca -0.46 -0.69 -0.51 0.00 0.09 0.00 0.00 60.65 59.08 3ivt h LYS 97 Cb 1.29 0.26 0.10 0.00 0.10 0.00 0.00 32.23 33.97 3ivt h LYS 97 CO 0.47 1.31 0.37 0.00 -2.09 0.00 0.00 179.45 179.51 3ivt s LYS 99 N -4.21 4.04 -0.20 0.00 1.02 0.10 -4.90 119.74 115.59 3ivt s LYS 99 Ca 0.65 1.38 -0.02 0.00 0.02 0.00 0.00 55.97 58.00 3ivt s LYS 99 Cb -0.19 -2.32 0.00 0.00 -0.52 0.00 0.00 37.83 34.80 3ivt s LYS 99 CO 0.43 -0.22 -0.10 0.42 -0.92 0.00 0.00 175.35 174.96 3ivt s ILE 100 N -1.86 2.95 0.18 2.17 1.01 -1.26 -1.87 121.20 122.51 3ivt s ILE 100 Ca 0.62 -0.64 0.06 0.00 0.00 0.00 0.00 60.65 60.69 3ivt s ILE 100 Cb -0.18 -2.31 -0.04 0.00 0.01 0.00 0.00 42.46 39.94 3ivt s ILE 100 CO 0.22 0.46 0.06 -0.76 0.00 0.00 0.00 174.94 174.93 3ivt s LEU 101 N 1.37 3.52 0.08 2.97 1.43 -0.21 0.24 118.68 128.09 3ivt s LEU 101 Ca 0.05 -0.29 0.06 0.00 -1.03 0.00 0.00 54.13 52.92 3ivt s LEU 101 Cb -0.14 -2.15 -0.03 0.00 0.03 0.00 0.00 46.19 43.90 3ivt s LEU 101 CO -0.06 0.07 -0.17 0.28 0.23 0.00 0.00 176.35 176.71 3ivt s THR 102 N -1.77 1.35 -0.26 5.49 -1.32 -0.76 -0.44 115.64 117.93 3ivt s THR 102 Ca 0.29 -1.38 -0.10 0.00 -1.21 0.00 0.00 61.69 59.29 3ivt s THR 102 Cb -0.09 -1.26 -0.05 0.00 -1.51 0.00 0.00 72.50 69.59 3ivt s THR 102 CO 0.21 -0.14 0.16 -2.28 -2.21 0.00 0.00 174.62 170.36 3ivt s HIS 103 N -1.20 3.21 0.04 9.09 2.46 -0.59 -0.19 115.29 128.10 3ivt s HIS 103 Ca 0.02 0.04 0.00 0.00 0.47 0.00 0.00 55.06 55.59 3ivt s HIS 103 Cb -0.10 -2.32 -0.03 0.00 -0.13 0.00 0.00 32.58 30.00 3ivt s HIS 103 CO 0.03 -0.14 -0.04 0.96 -2.47 0.00 0.00 174.74 173.08 3ivt s ILE 104 N 1.56 0.23 0.78 0.89 -4.36 -0.22 -2.65 121.20 117.42 3ivt s ILE 104 Ca 0.07 -1.25 -0.11 0.00 -0.26 0.00 0.00 60.65 59.11 3ivt s ILE 104 Cb -0.15 -0.74 0.06 0.00 1.25 0.00 0.00 42.46 42.87 3ivt s ILE 104 CO 0.08 -0.65 1.09 -0.13 0.24 0.00 0.00 174.94 175.57 3ivt s ARG 105 N -2.31 2.23 -1.31 0.37 0.52 -1.26 -1.45 118.95 115.74 3ivt s ARG 105 Ca -0.07 1.11 -0.14 0.00 -0.52 0.00 0.00 55.73 56.11 3ivt s ARG 105 Cb -0.04 -1.90 0.11 0.00 0.52 0.00 0.00 34.95 33.64 3ivt s ARG 105 CO -0.04 -1.64 1.81 0.00 0.02 0.00 0.00 175.30 175.45 3ivt s HIS 107 N 2.63 0.44 0.21 0.00 3.76 -1.26 -4.85 115.29 116.22 3ivt s HIS 107 Ca 0.47 -0.23 -0.09 0.00 -0.15 0.00 0.00 55.06 55.05 3ivt s HIS 107 Cb 0.06 -0.28 0.29 0.00 1.11 0.00 0.00 32.58 33.76 3ivt s HIS 107 CO 0.01 -0.04 1.73 0.52 -0.85 0.00 0.00 174.74 176.10 3ivt h MET 108 N 5.49 0.33 -0.37 1.40 2.86 -1.90 -1.99 114.93 120.75 3ivt h MET 108 Ca -0.30 -0.02 -0.02 0.00 -2.06 0.00 0.00 59.70 57.30 3ivt h MET 108 Cb 1.20 -0.08 -0.02 0.00 0.06 0.00 0.00 31.60 32.77 3ivt h MET 108 CO 0.47 0.22 0.14 0.22 1.06 0.00 0.00 176.91 179.02 3ivt h ASP 109 N 0.34 0.52 -0.96 1.22 3.58 -1.97 -1.14 116.42 118.01 3ivt h ASP 109 Ca 0.31 -0.17 0.14 0.00 0.42 0.00 0.00 57.03 57.74 3ivt h ASP 109 Cb 0.43 -0.13 -0.08 0.00 1.72 0.00 0.00 39.33 41.26 3ivt h ASP 109 CO -0.35 0.55 0.61 0.44 -2.88 0.00 0.00 179.24 177.60 3ivt h ASP 110 N 0.45 0.77 -0.05 2.28 5.19 -1.80 -2.44 116.42 120.83 3ivt h ASP 110 Ca 0.12 0.05 -0.13 0.00 -0.62 0.00 0.00 57.03 56.46 3ivt h ASP 110 Cb 0.20 -0.10 0.01 0.00 0.18 0.00 0.00 39.33 39.62 3ivt h ASP 110 CO -0.01 0.38 -0.46 0.00 -3.12 0.00 0.00 179.24 176.02 3ivt h ALA 111 N 1.58 0.12 -0.51 3.45 0.00 -0.79 -1.96 119.26 121.16 3ivt h ALA 111 Ca 0.49 -0.51 0.09 0.00 0.00 0.00 0.00 54.91 54.99 3ivt h ALA 111 Cb 0.68 0.01 -0.08 0.00 0.00 0.00 0.00 17.79 18.40 3ivt h ALA 111 CO -0.26 0.29 0.05 0.00 0.00 0.00 0.00 179.25 179.34 3ivt h ARG 112 N -0.09 0.17 -0.47 0.00 3.08 -1.04 -0.43 114.38 115.61 3ivt h ARG 112 Ca -0.04 -0.01 -0.08 0.00 0.07 0.00 0.00 59.98 59.92 3ivt h ARG 112 Cb 1.14 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 31.14 3ivt h ARG 112 CO 0.09 0.11 -0.02 0.28 -1.07 0.00 0.00 179.97 179.37 3ivt h VAL 113 N 0.17 1.26 -0.27 2.04 2.07 -1.45 0.38 116.25 120.45 3ivt h VAL 113 Ca 0.26 -1.09 0.05 0.00 0.82 0.00 0.00 66.70 66.75 3ivt h VAL 113 Cb 0.38 1.03 -0.05 0.00 -1.52 0.00 0.00 31.29 31.12 3ivt h VAL 113 CO -0.38 0.38 -0.06 0.00 0.02 0.00 0.00 177.57 177.52 3ivt h ALA 114 N 0.91 0.19 -0.40 1.67 0.00 -0.79 -1.42 119.26 119.42 3ivt h ALA 114 Ca 0.13 0.10 -0.04 0.00 0.00 0.00 0.00 54.91 55.11 3ivt h ALA 114 Cb 0.53 0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 3ivt h ALA 114 CO 0.03 -0.46 0.10 0.28 0.00 0.00 0.00 179.25 179.19 3ivt h VAL 115 N 0.01 1.23 -0.81 0.00 2.07 -0.82 -2.77 116.25 115.16 3ivt h VAL 115 Ca 0.13 -0.79 0.12 0.00 0.82 0.00 0.00 66.70 66.98 3ivt h VAL 115 Cb 0.20 0.97 -0.08 0.00 -1.52 0.00 0.00 31.29 30.86 3ivt h VAL 115 CO -0.28 0.27 0.43 -0.33 0.02 0.00 0.00 177.57 177.69 3ivt h GLU 116 N 0.51 0.65 0.00 1.57 5.08 -0.58 -2.35 114.58 119.46 3ivt h GLU 116 Ca 0.13 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.44 3ivt h GLU 116 Cb 0.31 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.41 3ivt h GLU 116 CO 0.00 0.43 -0.04 1.79 -1.00 0.00 0.00 179.01 180.19 3ivt h THR 117 N 0.67 0.18 0.00 1.13 1.35 -0.97 -3.46 112.91 111.81 3ivt h THR 117 Ca 0.42 -0.36 0.00 0.00 -0.55 0.00 0.00 66.41 65.91 3ivt h THR 117 Cb 0.49 1.30 0.00 0.00 -1.73 0.00 0.00 68.15 68.21 3ivt h THR 117 CO -0.30 0.04 0.00 0.61 -0.25 0.00 0.00 175.52 175.62 3ivt n GLY 118 N -0.54 1.14 3.59 5.82 0.00 -0.89 -4.31 105.19 110.01 3ivt n GLY 118 Ca -0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.67 3ivt n GLY 118 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3ivt n VAL 119 N -1.55 1.51 0.50 1.61 0.24 -1.23 -4.93 118.33 114.49 3ivt n VAL 119 Ca 0.00 -0.23 0.12 0.00 -2.04 0.00 0.00 64.34 62.19 3ivt n VAL 119 Cb 0.00 -0.98 0.20 0.00 -1.47 0.00 0.00 33.84 31.58 3ivt n VAL 119 CO 0.00 0.00 0.00 0.44 -2.14 0.00 0.00 176.83 175.13 3ivt h ASP 120 N -0.96 0.00 -4.37 -1.34 3.32 -0.59 -3.48 116.42 109.00 3ivt h ASP 120 Ca -0.45 -0.13 0.17 0.00 0.02 0.00 0.00 57.03 56.64 3ivt h ASP 120 Cb 1.31 0.00 -0.18 0.00 0.22 0.00 0.00 39.33 40.68 3ivt h ASP 120 CO 0.43 0.07 0.65 -0.83 -1.72 0.00 0.00 179.24 177.83 3ivt s GLY 121 N -3.77 -0.36 -0.15 2.75 0.00 -1.11 -2.12 107.32 102.57 3ivt s GLY 121 Ca 0.06 1.42 0.01 0.00 0.00 0.00 0.00 44.72 46.22 3ivt s GLY 121 CO 0.70 0.51 -0.18 -1.34 0.00 0.00 0.00 173.10 172.79 3ivt s VAL 122 N -2.56 2.40 -0.47 1.40 -7.23 0.00 -1.82 120.40 112.12 3ivt s VAL 122 Ca 0.06 -0.86 -0.21 0.00 -1.81 0.00 0.00 61.98 59.16 3ivt s VAL 122 Cb -0.01 -1.99 0.03 0.00 0.56 0.00 0.00 36.38 34.97 3ivt s VAL 122 CO -0.06 0.53 0.69 -1.81 -0.31 0.00 0.00 175.10 174.14 3ivt s ASP 123 N 0.84 6.32 -0.12 4.85 1.01 0.73 -1.87 116.67 128.42 3ivt s ASP 123 Ca -0.06 -0.43 -0.07 0.00 0.71 0.00 0.00 52.55 52.70 3ivt s ASP 123 Cb -0.15 -2.34 -0.04 0.00 1.01 0.00 0.00 42.92 41.40 3ivt s ASP 123 CO -0.01 -0.88 0.14 -0.69 0.21 0.00 0.00 175.17 173.94 3ivt s VAL 124 N 2.98 5.49 -0.18 -1.27 1.01 0.21 -1.06 120.40 127.58 3ivt s VAL 124 Ca 0.23 0.20 -0.04 0.00 0.00 0.00 0.00 61.98 62.37 3ivt s VAL 124 Cb -0.15 -3.39 -0.02 0.00 0.00 0.00 0.00 36.38 32.82 3ivt s VAL 124 CO 0.18 0.62 -0.02 -0.69 0.00 0.00 0.00 175.10 175.19 3ivt s VAL 125 N -1.01 3.86 -0.14 2.92 1.01 -0.53 0.02 120.40 126.53 3ivt s VAL 125 Ca 0.15 -0.35 -0.12 0.00 0.00 0.00 0.00 61.98 61.66 3ivt s VAL 125 Cb -0.12 -2.73 -0.05 0.00 0.00 0.00 0.00 36.38 33.49 3ivt s VAL 125 CO 0.04 0.45 0.25 -0.51 0.00 0.00 0.00 175.10 175.34 3ivt s ILE 126 N 0.79 5.32 0.29 2.22 2.07 -0.51 -2.46 121.20 128.93 3ivt s ILE 126 Ca -0.00 0.47 -0.19 0.00 -1.41 0.00 0.00 60.65 59.51 3ivt s ILE 126 Cb -0.14 -3.58 -0.09 0.00 0.13 0.00 0.00 42.46 38.78 3ivt s ILE 126 CO 0.02 0.46 0.78 -0.83 -1.91 0.00 0.00 174.94 173.45 3ivt s GLY 127 N 0.02 2.52 0.02 1.50 0.00 -1.26 -4.57 107.32 105.54 3ivt s GLY 127 Ca 0.16 0.19 0.01 0.00 0.00 0.00 0.00 44.72 45.07 3ivt s GLY 127 CO 0.04 0.50 0.83 -1.30 0.00 0.00 0.00 173.10 173.17 3ivt n THR 128 N 0.20 1.19 1.19 0.90 -2.24 -1.26 -0.44 114.28 113.82 3ivt n THR 128 Ca 0.01 0.51 0.13 0.00 -2.27 0.00 0.00 64.05 62.43 3ivt n THR 128 Cb 0.52 -1.51 0.35 0.00 -2.10 0.00 0.00 70.33 67.59 3ivt n THR 128 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3ivt n SER 129 N -1.34 0.87 -0.97 3.42 3.41 -1.26 -4.17 113.62 113.58 3ivt n SER 129 Ca -0.00 -0.71 0.11 0.00 -0.26 0.00 0.00 58.87 58.01 3ivt n SER 129 Cb 0.20 0.15 0.26 0.00 -0.26 0.00 0.00 64.21 64.56 3ivt n SER 129 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3ivt n GLN 130 N -0.88 2.27 -3.78 4.33 6.02 0.41 -4.83 117.38 120.92 3ivt n GLN 130 Ca 0.11 -1.91 -0.13 0.00 -0.01 0.00 0.00 57.00 55.06 3ivt n GLN 130 Cb 0.34 -1.47 -0.11 0.00 1.02 0.00 0.00 30.24 30.02 3ivt n GLN 130 CO 0.00 0.00 0.00 1.52 -1.01 0.00 0.00 177.06 177.57 3ivt s TYR 131 N -1.60 -0.28 0.12 1.08 1.13 -1.26 -0.99 117.35 115.56 3ivt s TYR 131 Ca 0.36 0.65 0.03 0.00 -1.41 0.00 0.00 57.07 56.71 3ivt s TYR 131 Cb 0.21 0.10 -0.04 0.00 -1.10 0.00 0.00 41.96 41.13 3ivt s TYR 131 CO 0.30 -0.20 -0.09 -0.48 -2.51 0.00 0.00 175.55 172.57 3ivt s LEU 132 N -0.18 2.51 0.03 -3.49 2.34 -0.91 -4.96 118.68 114.02 3ivt s LEU 132 Ca -0.03 -1.00 -0.07 0.00 0.06 0.00 0.00 54.13 53.09 3ivt s LEU 132 Cb -0.03 -0.23 -0.05 0.00 -0.56 0.00 0.00 46.19 45.32 3ivt s LEU 132 CO 0.01 -0.38 0.30 -0.13 -1.06 0.00 0.00 176.35 175.09 3ivt s ARG 133 N -3.71 3.62 0.07 1.48 0.52 -1.26 -1.50 118.95 118.16 3ivt s ARG 133 Ca 0.14 -0.03 -0.13 0.00 -0.52 0.00 0.00 55.73 55.19 3ivt s ARG 133 Cb 0.03 -3.05 0.02 0.00 0.52 0.00 0.00 34.95 32.47 3ivt s ARG 133 CO -0.02 0.62 0.29 0.15 0.02 0.00 0.00 175.30 176.37 3ivt s LYS 134 N -1.87 0.87 -0.12 3.54 -0.14 -0.05 -4.99 119.74 116.97 3ivt s LYS 134 Ca 0.30 -0.65 -0.20 0.00 -1.36 0.00 0.00 55.97 54.06 3ivt s LYS 134 Cb -0.13 0.37 -0.04 0.00 -1.68 0.00 0.00 37.83 36.35 3ivt s LYS 134 CO 0.17 -0.29 0.55 0.71 -0.76 0.00 0.00 175.35 175.73 3ivt s TYR 135 N -3.10 3.50 -0.12 3.18 4.12 -1.26 -0.61 117.35 123.06 3ivt s TYR 135 Ca -0.01 0.97 -0.04 0.00 0.02 0.00 0.00 57.07 58.01 3ivt s TYR 135 Cb 0.01 -2.65 0.06 0.00 -1.52 0.00 0.00 41.96 37.86 3ivt s TYR 135 CO -0.07 0.08 0.14 0.45 0.02 0.00 0.00 175.55 176.18 3ivt s SER 136 N 0.78 1.29 -1.38 2.29 0.15 -0.37 -4.84 113.70 111.62 3ivt s SER 136 Ca 0.29 -0.03 -0.01 0.00 0.70 0.00 0.00 55.95 56.90 3ivt s SER 136 Cb -0.16 0.13 0.00 0.00 -1.71 0.00 0.00 66.02 64.29 3ivt s SER 136 CO 0.12 -0.29 0.51 0.00 1.20 0.00 0.00 173.24 174.79 3ivt n HIS 137 N 5.31 -1.74 -1.22 3.44 -0.00 -1.26 -2.82 115.22 116.94 3ivt n HIS 137 Ca -0.05 0.78 -0.08 0.00 -0.00 0.00 0.00 57.72 58.37 3ivt n HIS 137 Cb 0.50 -3.93 -0.03 0.00 -0.00 0.00 0.00 29.99 26.52 3ivt n HIS 137 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 3ivt n GLY 138 N -1.85 0.94 3.29 -1.39 0.00 -1.26 -5.02 105.19 99.91 3ivt n GLY 138 Ca -0.30 -0.45 -0.28 0.00 0.00 0.00 0.00 46.02 44.99 3ivt n GLY 138 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ivt s LYS 139 N -2.41 1.73 -0.33 1.61 -0.14 -1.13 -5.10 119.74 113.97 3ivt s LYS 139 Ca 0.00 -0.95 -0.29 0.00 -1.36 0.00 0.00 55.97 53.37 3ivt s LYS 139 Cb 0.00 -1.79 0.02 0.00 -1.68 0.00 0.00 37.83 34.37 3ivt s LYS 139 CO 0.00 0.47 1.06 0.34 -0.76 0.00 0.00 175.35 176.46 3ivt s ASP 140 N -0.94 6.88 -0.08 2.83 -1.08 -1.26 -1.24 116.67 121.78 3ivt s ASP 140 Ca 0.10 0.96 0.03 0.00 -0.52 0.00 0.00 52.55 53.12 3ivt s ASP 140 Cb -0.09 -2.53 0.01 0.00 -1.46 0.00 0.00 42.92 38.84 3ivt s ASP 140 CO 0.01 -0.89 -0.19 -0.04 0.52 0.00 0.00 175.17 174.57 3ivt s MET 141 N 3.67 2.47 -0.21 4.34 -1.94 0.22 -4.99 119.30 122.85 3ivt s MET 141 Ca 0.44 -0.69 -0.10 0.00 -1.71 0.00 0.00 55.69 53.64 3ivt s MET 141 Cb -0.12 -1.92 -0.05 0.00 2.01 0.00 0.00 34.83 34.75 3ivt s MET 141 CO 0.17 0.12 0.13 0.99 -0.01 0.00 0.00 175.02 176.42 3ivt s THR 142 N 0.46 5.28 0.01 2.05 2.01 -1.26 -0.88 115.64 123.30 3ivt s THR 142 Ca -0.17 0.15 0.08 0.00 0.31 0.00 0.00 61.69 62.06 3ivt s THR 142 Cb -0.17 -3.42 -0.02 0.00 0.01 0.00 0.00 72.50 68.89 3ivt s THR 142 CO 0.07 0.41 -0.25 -0.31 -0.69 0.00 0.00 174.62 173.85 3ivt s TYR 143 N 0.64 2.20 -0.11 4.92 2.02 -0.56 -4.91 117.35 121.53 3ivt s TYR 143 Ca 0.07 -0.41 -0.21 0.00 -0.37 0.00 0.00 57.07 56.15 3ivt s TYR 143 Cb -0.12 -1.37 -0.03 0.00 -0.40 0.00 0.00 41.96 40.03 3ivt s TYR 143 CO 0.01 0.02 0.62 0.42 -1.57 0.00 0.00 175.55 175.05 3ivt s ILE 144 N -0.67 5.08 0.74 2.71 1.01 -1.26 -2.15 121.20 126.66 3ivt s ILE 144 Ca 0.10 1.25 -0.14 0.00 0.00 0.00 0.00 60.65 61.85 3ivt s ILE 144 Cb -0.10 -3.96 0.04 0.00 0.01 0.00 0.00 42.46 38.46 3ivt s ILE 144 CO 0.00 0.24 1.17 0.27 0.00 0.00 0.00 174.94 176.61 3ivt s ILE 145 N 1.03 2.59 0.17 2.92 -4.36 -0.17 -4.69 121.20 118.70 3ivt s ILE 145 Ca 0.32 0.26 -0.26 0.00 -0.26 0.00 0.00 60.65 60.72 3ivt s ILE 145 Cb -0.16 -2.75 0.03 0.00 1.25 0.00 0.00 42.46 40.83 3ivt s ILE 145 CO 0.14 -0.18 1.57 0.44 0.24 0.00 0.00 174.94 177.15 3ivt h ASP 146 N -0.47 -1.47 -0.54 4.36 3.45 -1.96 -1.81 116.42 117.97 3ivt h ASP 146 Ca -0.47 0.24 -0.02 0.00 0.43 0.00 0.00 57.03 57.22 3ivt h ASP 146 Cb 1.27 0.67 -0.03 0.00 -0.56 0.00 0.00 39.33 40.68 3ivt h ASP 146 CO 0.50 -0.34 0.28 0.77 -1.57 0.00 0.00 179.24 178.88 3ivt h SER 147 N -0.24 0.72 -0.08 6.45 4.64 -1.97 -1.79 113.55 121.28 3ivt h SER 147 Ca 0.17 -0.07 -0.16 0.00 -0.47 0.00 0.00 61.79 61.27 3ivt h SER 147 Cb 0.57 -0.18 -0.01 0.00 -0.31 0.00 0.00 62.40 62.47 3ivt h SER 147 CO -0.67 0.61 -0.49 0.00 -0.87 0.00 0.00 176.83 175.41 3ivt h ALA 148 N 1.50 0.69 -0.15 5.18 0.00 -1.75 -2.96 119.26 121.77 3ivt h ALA 148 Ca 0.20 -0.49 -0.05 0.00 0.00 0.00 0.00 54.91 54.57 3ivt h ALA 148 Cb 0.08 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 3ivt h ALA 148 CO -0.03 0.68 -0.14 1.15 0.00 0.00 0.00 179.25 180.91 3ivt h THR 149 N 0.51 1.18 -0.58 0.00 2.02 -0.64 -2.87 112.91 112.53 3ivt h THR 149 Ca 0.02 -0.82 -0.02 0.00 0.77 0.00 0.00 66.41 66.36 3ivt h THR 149 Cb 1.04 1.23 -0.03 0.00 -1.74 0.00 0.00 68.15 68.65 3ivt h THR 149 CO 0.10 0.26 0.29 -0.08 0.37 0.00 0.00 175.52 176.45 3ivt h GLU 150 N 0.23 0.81 -0.13 6.66 4.81 -1.17 -2.55 114.58 123.23 3ivt h GLU 150 Ca 0.05 -0.10 -0.01 0.00 -0.13 0.00 0.00 59.36 59.17 3ivt h GLU 150 Cb 0.40 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.61 3ivt h GLU 150 CO 0.02 0.62 0.06 0.28 -0.73 0.00 0.00 179.01 179.26 3ivt h VAL 151 N 0.82 1.14 -0.60 0.32 2.07 -1.53 -0.06 116.25 118.40 3ivt h VAL 151 Ca 0.20 -0.43 0.09 0.00 0.82 0.00 0.00 66.70 67.39 3ivt h VAL 151 Cb 0.07 1.18 -0.07 0.00 -1.52 0.00 0.00 31.29 30.95 3ivt h VAL 151 CO -0.03 0.13 0.22 0.40 0.02 0.00 0.00 177.57 178.32 3ivt h ILE 152 N 0.07 0.77 -0.25 4.57 2.04 -1.58 -1.49 117.51 121.64 3ivt h ILE 152 Ca 0.04 -0.14 -0.17 0.00 1.00 0.00 0.00 64.86 65.60 3ivt h ILE 152 Cb 0.16 0.33 -0.00 0.00 -0.74 0.00 0.00 36.82 36.56 3ivt h ILE 152 CO -0.00 0.07 -0.52 0.78 0.00 0.00 0.00 178.15 178.48 3ivt h ASN 153 N 0.40 0.78 0.34 1.72 2.35 -1.03 -1.35 115.58 118.80 3ivt h ASN 153 Ca 0.30 -0.41 -0.02 0.00 -0.55 0.00 0.00 56.30 55.63 3ivt h ASN 153 Cb 0.37 -0.22 0.00 0.00 0.05 0.00 0.00 38.32 38.52 3ivt h ASN 153 CO -0.31 1.16 -0.16 0.15 -1.65 0.00 0.00 177.43 176.62 3ivt h PHE 154 N 0.55 -0.42 -0.69 1.19 3.57 -0.85 0.17 116.94 120.46 3ivt h PHE 154 Ca 0.02 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.54 3ivt h PHE 154 Cb 1.09 0.14 -0.04 0.00 2.79 0.00 0.00 35.95 39.93 3ivt h PHE 154 CO 0.06 -0.23 0.43 0.28 -2.23 0.00 0.00 178.31 176.62 3ivt h VAL 155 N -0.50 1.09 -0.94 1.41 2.07 -1.21 -0.68 116.25 117.50 3ivt h VAL 155 Ca -0.05 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 67.19 3ivt h VAL 155 Cb 0.38 0.18 -0.05 0.00 -1.52 0.00 0.00 31.29 30.28 3ivt h VAL 155 CO 0.08 0.15 0.59 0.11 0.02 0.00 0.00 177.57 178.52 3ivt h LYS 156 N 0.84 1.26 -0.00 1.57 1.57 -1.11 -1.80 116.57 118.89 3ivt h LYS 156 Ca 0.28 -0.10 -0.08 0.00 -1.87 0.00 0.00 60.65 58.88 3ivt h LYS 156 Cb 0.02 -0.27 -0.01 0.00 0.08 0.00 0.00 32.23 32.04 3ivt h LYS 156 CO -0.11 0.86 -0.38 0.66 -0.57 0.00 0.00 179.45 179.92 3ivt h SER 157 N 1.28 0.01 -0.28 0.86 4.64 0.46 -1.87 113.55 118.65 3ivt h SER 157 Ca 0.34 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.66 3ivt h SER 157 Cb -0.09 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.00 3ivt h SER 157 CO -0.07 0.39 0.00 0.29 -0.87 0.00 0.00 176.83 176.57 3ivt n LYS 158 N -4.09 1.66 -1.52 4.77 4.01 -0.52 -4.92 118.16 117.56 3ivt n LYS 158 Ca -0.02 -1.01 -0.05 0.00 -0.51 0.00 0.00 58.31 56.73 3ivt n LYS 158 Cb 0.41 -1.22 -0.01 0.00 -0.51 0.00 0.00 35.03 33.70 3ivt n LYS 158 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 3ivt n GLY 159 N 0.94 0.51 3.65 0.72 0.00 -0.70 -5.04 105.19 105.26 3ivt n GLY 159 Ca 0.09 -0.79 -0.30 0.00 0.00 0.00 0.00 46.02 45.02 3ivt n GLY 159 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ivt s ILE 160 N -2.20 3.78 0.33 -0.61 1.01 -0.70 -5.03 121.20 117.79 3ivt s ILE 160 Ca 0.00 -1.08 -0.27 0.00 0.00 0.00 0.00 60.65 59.30 3ivt s ILE 160 Cb 0.00 -2.78 -0.09 0.00 0.01 0.00 0.00 42.46 39.59 3ivt s ILE 160 CO 0.00 0.13 1.12 -1.61 0.00 0.00 0.00 174.94 174.57 3ivt s GLU 161 N -2.24 4.40 -0.04 2.79 2.02 -0.90 -4.26 118.70 120.47 3ivt s GLU 161 Ca 0.24 1.77 0.02 0.00 0.02 0.00 0.00 54.97 57.03 3ivt s GLU 161 Cb -0.11 -2.93 0.01 0.00 0.10 0.00 0.00 34.13 31.19 3ivt s GLU 161 CO 0.16 0.00 -0.11 0.54 0.02 0.00 0.00 175.26 175.88 3ivt s VAL 162 N -1.32 0.95 0.06 2.63 0.11 -1.26 -0.82 120.40 120.75 3ivt s VAL 162 Ca 0.50 -0.41 0.06 0.00 -2.93 0.00 0.00 61.98 59.20 3ivt s VAL 162 Cb -0.30 -0.87 -0.03 0.00 -1.53 0.00 0.00 36.38 33.66 3ivt s VAL 162 CO 0.38 0.30 -0.17 0.00 -3.33 0.00 0.00 175.10 172.28 3ivt s ARG 163 N 0.44 1.06 -0.09 1.54 1.04 -0.78 -1.23 118.95 120.94 3ivt s ARG 163 Ca -0.09 -0.92 0.03 0.00 -1.04 0.00 0.00 55.73 53.71 3ivt s ARG 163 Cb -0.12 -1.15 0.01 0.00 -2.04 0.00 0.00 34.95 31.64 3ivt s ARG 163 CO 0.02 0.28 -0.16 0.12 -0.04 0.00 0.00 175.30 175.51 3ivt s PHE 164 N -0.98 1.94 0.33 5.89 5.36 -0.83 0.66 117.98 130.34 3ivt s PHE 164 Ca 0.03 -0.81 0.04 0.00 -0.96 0.00 0.00 56.93 55.23 3ivt s PHE 164 Cb -0.09 -1.37 -0.03 0.00 -0.34 0.00 0.00 43.02 41.19 3ivt s PHE 164 CO 0.02 -0.39 0.17 -1.54 -1.46 0.00 0.00 175.22 172.02 3ivt s SER 165 N 0.69 1.81 -0.02 6.13 1.04 0.10 -1.09 113.70 122.36 3ivt s SER 165 Ca -0.13 -1.60 0.07 0.00 0.48 0.00 0.00 55.95 54.77 3ivt s SER 165 Cb -0.16 0.42 -0.02 0.00 0.10 0.00 0.00 66.02 66.36 3ivt s SER 165 CO 0.03 -0.91 -0.22 -0.94 0.98 0.00 0.00 173.24 172.18 3ivt s SER 166 N -3.42 2.58 0.45 7.02 1.04 -1.25 -1.43 113.70 118.68 3ivt s SER 166 Ca 0.34 -0.40 -0.25 0.00 0.48 0.00 0.00 55.95 56.12 3ivt s SER 166 Cb 0.04 -0.29 -0.08 0.00 0.10 0.00 0.00 66.02 65.80 3ivt s SER 166 CO 0.18 0.27 1.32 -1.61 0.98 0.00 0.00 173.24 174.38 3ivt s GLU 167 N -0.53 3.74 -1.33 4.02 2.02 -1.26 -3.85 118.70 121.51 3ivt s GLU 167 Ca 0.08 2.18 -0.09 0.00 0.02 0.00 0.00 54.97 57.17 3ivt s GLU 167 Cb -0.08 -2.61 0.01 0.00 0.10 0.00 0.00 34.13 31.55 3ivt s GLU 167 CO -0.01 -0.69 1.16 -3.47 0.02 0.00 0.00 175.26 172.28 3ivt n ASP 168 N -0.21 -6.29 -0.20 -0.19 2.03 -1.13 -4.87 116.55 105.69 3ivt n ASP 168 Ca 0.06 -0.53 0.22 0.00 0.52 0.00 0.00 54.79 55.06 3ivt n ASP 168 Cb 0.44 -4.94 0.60 0.00 -0.72 0.00 0.00 41.12 36.50 3ivt n ASP 168 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 3ivt h SER 169 N -2.66 0.24 0.10 1.67 0.02 -1.43 0.17 113.55 111.67 3ivt h SER 169 Ca -0.56 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.42 3ivt h SER 169 Cb 1.36 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.88 3ivt h SER 169 CO 0.55 0.09 -0.02 0.49 -1.14 0.00 0.00 176.83 176.80 3ivt n PHE 170 N -4.42 0.00 -0.19 3.45 3.72 -1.26 -3.12 117.46 115.63 3ivt n PHE 170 Ca 0.18 0.00 0.03 0.00 -0.05 0.00 0.00 57.45 57.61 3ivt n PHE 170 Cb 0.77 -0.05 0.07 0.00 -0.94 0.00 0.00 39.48 39.33 3ivt n PHE 170 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 3ivt n ARG 171 N -0.68 2.82 -3.12 -1.08 1.74 0.58 -5.03 116.66 111.88 3ivt n ARG 171 Ca 0.20 -1.83 -0.24 0.00 -0.77 0.00 0.00 57.85 55.20 3ivt n ARG 171 Cb 0.22 -1.17 -0.00 0.00 -1.02 0.00 0.00 32.46 30.49 3ivt n ARG 171 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 3ivt s SER 172 N -1.20 6.19 0.15 0.55 0.01 -1.11 -5.06 113.70 113.23 3ivt s SER 172 Ca 0.12 0.53 -0.31 0.00 1.31 0.00 0.00 55.95 57.61 3ivt s SER 172 Cb 0.08 -1.98 -0.08 0.00 0.21 0.00 0.00 66.02 64.24 3ivt s SER 172 CO 0.06 -0.45 1.36 -0.62 0.41 0.00 0.00 173.24 174.00 3ivt s ASP 173 N -4.09 6.85 0.27 2.44 3.68 -1.26 -4.93 116.67 119.62 3ivt s ASP 173 Ca 0.43 2.36 -0.02 0.00 2.13 0.00 0.00 52.55 57.45 3ivt s ASP 173 Cb -0.10 -2.60 0.35 0.00 -1.45 0.00 0.00 42.92 39.13 3ivt s ASP 173 CO 0.39 -0.61 1.80 -0.07 0.13 0.00 0.00 175.17 176.81 3ivt h LEU 174 N 6.26 0.82 -0.48 -1.34 3.38 -1.97 -1.04 115.31 120.95 3ivt h LEU 174 Ca -0.43 -0.15 0.10 0.00 0.09 0.00 0.00 57.88 57.48 3ivt h LEU 174 Cb 1.21 -0.21 -0.10 0.00 0.09 0.00 0.00 40.66 41.65 3ivt h LEU 174 CO 0.83 0.81 -0.22 0.58 0.09 0.00 0.00 178.44 180.53 3ivt h VAL 175 N 0.84 0.35 -0.08 1.22 2.07 -1.99 0.19 116.25 118.85 3ivt h VAL 175 Ca 0.18 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.69 3ivt h VAL 175 Cb 0.32 0.35 -0.00 0.00 -1.52 0.00 0.00 31.29 30.43 3ivt h VAL 175 CO 0.00 0.00 -0.00 0.44 0.02 0.00 0.00 177.57 178.03 3ivt h ASP 176 N -0.12 0.14 0.53 0.57 3.32 -1.84 -2.98 116.42 116.03 3ivt h ASP 176 Ca 0.22 -0.32 -0.03 0.00 0.02 0.00 0.00 57.03 56.93 3ivt h ASP 176 Cb 0.47 -0.04 0.01 0.00 0.22 0.00 0.00 39.33 39.98 3ivt h ASP 176 CO -0.55 0.42 -0.25 0.25 -1.72 0.00 0.00 179.24 177.39 3ivt h LEU 177 N -0.15 -0.60 -0.95 1.55 5.85 -0.85 -0.98 115.31 119.17 3ivt h LEU 177 Ca 0.02 -0.04 -0.04 0.00 0.84 0.00 0.00 57.88 58.66 3ivt h LEU 177 Cb 0.36 0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.51 3ivt h LEU 177 CO 0.00 -0.32 0.31 -0.07 -0.34 0.00 0.00 178.44 178.02 3ivt h LEU 178 N -0.87 0.97 -1.12 2.25 3.38 -1.12 -1.85 115.31 116.96 3ivt h LEU 178 Ca -0.07 -0.13 -0.02 0.00 0.09 0.00 0.00 57.88 57.75 3ivt h LEU 178 Cb 0.60 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.07 3ivt h LEU 178 CO 0.12 0.85 0.35 0.28 0.09 0.00 0.00 178.44 180.13 3ivt h SER 179 N 1.05 0.87 -0.09 -0.43 0.02 -1.45 -0.88 113.55 112.62 3ivt h SER 179 Ca 0.25 -0.08 -0.01 0.00 -0.84 0.00 0.00 61.79 61.11 3ivt h SER 179 Cb 0.17 -0.22 -0.00 0.00 0.14 0.00 0.00 62.40 62.49 3ivt h SER 179 CO -0.02 0.72 0.02 0.25 -1.14 0.00 0.00 176.83 176.66 3ivt h LEU 180 N 0.96 0.14 -1.40 5.07 5.85 -0.50 -1.83 115.31 123.60 3ivt h LEU 180 Ca 0.24 -0.22 -0.02 0.00 0.84 0.00 0.00 57.88 58.71 3ivt h LEU 180 Cb 0.07 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.04 3ivt h LEU 180 CO -0.03 0.32 0.12 1.88 -0.34 0.00 0.00 178.44 180.39 3ivt h TYR 181 N -0.06 0.53 -0.42 1.25 0.05 -1.07 -0.11 116.97 117.14 3ivt h TYR 181 Ca 0.03 -0.02 -0.13 0.00 0.05 0.00 0.00 58.73 58.66 3ivt h TYR 181 Cb 0.24 -0.16 -0.01 0.00 1.01 0.00 0.00 36.73 37.80 3ivt h TYR 181 CO 0.00 0.44 -0.24 -0.22 -1.05 0.00 0.00 178.16 177.09 3ivt h LYS 182 N 0.53 0.87 -0.01 4.88 3.64 -1.03 -1.33 116.57 124.12 3ivt h LYS 182 Ca 0.13 -0.37 -0.00 0.00 -1.27 0.00 0.00 60.65 59.13 3ivt h LYS 182 Cb 0.15 -0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 31.94 3ivt h LYS 182 CO -0.01 1.02 0.00 0.00 -2.27 0.00 0.00 179.45 178.19 3ivt h ALA 183 N 0.97 0.01 -0.69 5.00 0.00 -0.50 -0.69 119.26 123.36 3ivt h ALA 183 Ca 0.10 -0.06 0.05 0.00 0.00 0.00 0.00 54.91 55.00 3ivt h ALA 183 Cb 0.79 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.52 3ivt h ALA 183 CO 0.07 -0.44 0.40 0.28 0.00 0.00 0.00 179.25 179.56 3ivt h VAL 184 N -0.11 1.01 -0.59 0.00 2.07 -1.00 -1.89 116.25 115.74 3ivt h VAL 184 Ca 0.00 -0.26 0.02 0.00 0.82 0.00 0.00 66.70 67.28 3ivt h VAL 184 Cb 0.11 0.19 -0.04 0.00 -1.52 0.00 0.00 31.29 30.04 3ivt h VAL 184 CO -0.00 0.14 0.37 -0.78 0.02 0.00 0.00 177.57 177.32 3ivt h ASP 185 N 0.75 0.62 -0.36 0.57 3.58 -1.06 0.14 116.42 120.66 3ivt h ASP 185 Ca 0.30 -0.00 0.03 0.00 0.42 0.00 0.00 57.03 57.78 3ivt h ASP 185 Cb 0.14 -0.14 -0.03 0.00 1.72 0.00 0.00 39.33 41.02 3ivt h ASP 185 CO -0.16 0.43 0.16 0.11 -2.88 0.00 0.00 179.24 176.90 3ivt h LYS 186 N 0.74 0.32 -0.39 0.28 6.56 -0.45 -1.81 116.57 121.81 3ivt h LYS 186 Ca 0.23 -0.02 0.04 0.00 -1.06 0.00 0.00 60.65 59.85 3ivt h LYS 186 Cb -0.01 -0.07 -0.04 0.00 -0.57 0.00 0.00 32.23 31.53 3ivt h LYS 186 CO -0.08 0.21 0.15 0.82 -2.06 0.00 0.00 179.45 178.49 3ivt h ILE 187 N 0.33 0.90 0.00 1.86 2.04 -1.08 -3.49 117.51 118.07 3ivt h ILE 187 Ca 0.16 -0.11 0.00 0.00 1.00 0.00 0.00 64.86 65.91 3ivt h ILE 187 Cb 0.10 0.55 0.00 0.00 -0.74 0.00 0.00 36.82 36.73 3ivt h ILE 187 CO -0.13 0.06 0.00 0.61 0.00 0.00 0.00 178.15 178.69 3ivt n GLY 188 N -1.23 1.35 3.62 5.37 0.00 0.46 -5.11 105.19 109.66 3ivt n GLY 188 Ca 0.02 -0.82 -0.28 0.00 0.00 0.00 0.00 46.02 44.94 3ivt n GLY 188 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3ivt s VAL 189 N 0.00 1.29 0.09 1.61 -7.23 -1.25 -4.99 120.40 109.92 3ivt s VAL 189 Ca 0.00 -2.00 -0.06 0.00 -1.81 0.00 0.00 61.98 58.11 3ivt s VAL 189 Cb 0.00 -2.53 -0.24 0.00 0.56 0.00 0.00 36.38 34.16 3ivt s VAL 189 CO 0.00 0.00 1.20 0.78 -0.31 0.00 0.00 175.10 176.77 3ivt h ASN 190 N 1.68 0.55 -4.70 4.85 4.21 -1.57 -3.46 115.58 117.14 3ivt h ASN 190 Ca -0.42 -0.51 -0.09 0.00 1.21 0.00 0.00 56.30 56.48 3ivt h ASN 190 Cb 1.27 -0.17 -0.21 0.00 -1.12 0.00 0.00 38.32 38.09 3ivt h ASN 190 CO 0.72 1.35 -0.09 -0.60 -1.29 0.00 0.00 177.43 177.53 3ivt s ARG 191 N -2.96 0.77 0.16 0.81 3.52 -1.11 -2.07 118.95 118.08 3ivt s ARG 191 Ca -0.06 0.19 0.09 0.00 -0.13 0.00 0.00 55.73 55.83 3ivt s ARG 191 Cb 0.07 0.36 -0.04 0.00 -1.56 0.00 0.00 34.95 33.78 3ivt s ARG 191 CO 0.89 -0.20 -0.12 0.14 -0.81 0.00 0.00 175.30 175.20 3ivt s VAL 192 N -0.85 3.10 0.08 7.11 -7.23 -0.48 -1.96 120.40 120.16 3ivt s VAL 192 Ca -0.09 -1.63 0.09 0.00 -1.81 0.00 0.00 61.98 58.55 3ivt s VAL 192 Cb -0.03 -2.51 -0.03 0.00 0.56 0.00 0.00 36.38 34.37 3ivt s VAL 192 CO 0.05 -0.06 -0.25 -0.83 -0.31 0.00 0.00 175.10 173.70 3ivt s GLY 193 N -2.66 1.39 -0.11 2.32 0.00 -0.25 -0.28 107.32 107.73 3ivt s GLY 193 Ca 0.23 -1.30 0.01 0.00 0.00 0.00 0.00 44.72 43.67 3ivt s GLY 193 CO 0.14 -1.24 -0.16 -0.42 0.00 0.00 0.00 173.10 171.43 3ivt s ILE 194 N -0.94 2.84 -0.18 0.90 -1.09 0.97 -3.81 121.20 119.89 3ivt s ILE 194 Ca 0.11 -0.75 0.00 0.00 -2.23 0.00 0.00 60.65 57.78 3ivt s ILE 194 Cb -0.10 -2.16 0.04 0.00 -1.58 0.00 0.00 42.46 38.66 3ivt s ILE 194 CO 0.04 0.54 -0.07 0.00 -1.23 0.00 0.00 174.94 174.21 3ivt s ALA 195 N 0.20 1.68 -1.31 9.38 0.00 -1.25 -0.61 121.76 129.85 3ivt s ALA 195 Ca -0.10 -0.96 -0.13 0.00 0.00 0.00 0.00 51.96 50.77 3ivt s ALA 195 Cb -0.16 -1.17 0.12 0.00 0.00 0.00 0.00 23.12 21.91 3ivt s ALA 195 CO 0.06 -0.78 1.83 -3.47 0.00 0.00 0.00 175.76 173.40 3ivt n ASP 196 N 4.80 4.78 0.12 0.00 2.03 0.96 -1.55 116.55 127.71 3ivt n ASP 196 Ca -0.13 -2.97 0.08 0.00 0.52 0.00 0.00 54.79 52.28 3ivt n ASP 196 Cb 0.47 -1.60 0.56 0.00 -0.72 0.00 0.00 41.12 39.82 3ivt n ASP 196 CO 0.00 0.00 0.00 0.74 -1.92 0.00 0.00 177.20 176.02 3ivt h THR 197 N 4.41 1.01 0.00 5.18 2.02 -1.93 -2.21 112.91 121.39 3ivt h THR 197 Ca 0.43 -0.08 0.00 0.00 0.77 0.00 0.00 66.41 67.53 3ivt h THR 197 Cb 0.74 0.76 0.00 0.00 -1.74 0.00 0.00 68.15 67.91 3ivt h THR 197 CO 1.57 0.04 -1.52 0.55 0.37 0.00 0.00 175.52 176.53 3ivt n VAL 198 N -4.50 0.13 -2.26 3.16 3.14 -1.26 -4.83 118.33 111.92 3ivt n VAL 198 Ca 0.01 -0.40 0.00 0.00 -2.96 0.00 0.00 64.34 60.99 3ivt n VAL 198 Cb 0.13 0.11 0.00 0.00 -1.06 0.00 0.00 33.84 33.02 3ivt n VAL 198 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 3ivt n GLY 199 N 1.30 0.83 0.00 7.55 0.00 -1.18 -4.81 105.19 108.88 3ivt n GLY 199 Ca -0.01 -0.70 0.03 0.00 0.00 0.00 0.00 46.02 45.34 3ivt n GLY 199 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ivt s ALA 201 N -1.91 3.07 0.14 0.00 0.00 -1.26 -5.05 121.76 116.75 3ivt s ALA 201 Ca 0.00 1.31 0.07 0.00 0.00 0.00 0.00 51.96 53.34 3ivt s ALA 201 Cb 0.04 -3.54 -0.04 0.00 0.00 0.00 0.00 23.12 19.58 3ivt s ALA 201 CO 0.23 -1.11 -0.05 0.95 0.00 0.00 0.00 175.76 175.78 3ivt s THR 202 N -1.29 3.56 0.26 0.00 -4.23 -1.26 -4.85 115.64 107.83 3ivt s THR 202 Ca 0.64 -1.33 -0.02 0.00 -1.18 0.00 0.00 61.69 59.80 3ivt s THR 202 Cb -0.40 -2.72 0.25 0.00 1.34 0.00 0.00 72.50 70.97 3ivt s THR 202 CO 0.49 0.01 1.83 -0.65 -0.54 0.00 0.00 174.62 175.76 3ivt h PRO 203 N 3.19 0.89 -0.07 3.99 0.11 -1.91 0.15 132.00 138.35 3ivt h PRO 203 Ca -0.48 -0.05 -0.16 0.00 0.11 0.00 0.00 66.00 65.42 3ivt h PRO 203 Cb 1.18 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 32.08 3ivt h PRO 203 CO 0.55 0.59 -0.65 0.00 -0.21 0.00 0.00 178.00 178.28 3ivt h ARG 204 N 0.92 0.26 -0.29 1.05 3.08 -1.97 -0.40 114.38 117.03 3ivt h ARG 204 Ca 0.44 -0.19 -0.01 0.00 0.07 0.00 0.00 59.98 60.29 3ivt h ARG 204 Cb 0.39 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.46 3ivt h ARG 204 CO -0.25 0.82 0.14 0.37 -1.07 0.00 0.00 179.97 179.98 3ivt h GLN 205 N 0.19 0.42 -0.01 0.04 4.15 -1.69 -1.39 115.11 116.82 3ivt h GLN 205 Ca -0.01 -0.06 0.02 0.00 0.77 0.00 0.00 58.65 59.36 3ivt h GLN 205 Cb 1.18 -0.08 -0.02 0.00 0.21 0.00 0.00 27.48 28.77 3ivt h GLN 205 CO 0.10 0.40 -0.08 0.28 -1.93 0.00 0.00 178.83 177.59 3ivt h VAL 206 N 0.33 0.78 -0.63 2.39 2.07 -0.48 -1.60 116.25 119.11 3ivt h VAL 206 Ca 0.10 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.73 3ivt h VAL 206 Cb 0.12 0.78 -0.08 0.00 -1.52 0.00 0.00 31.29 30.59 3ivt h VAL 206 CO -0.01 0.00 0.21 0.22 0.02 0.00 0.00 177.57 178.01 3ivt h TYR 207 N -0.14 0.36 -0.36 1.57 3.20 -0.99 -0.46 116.97 120.15 3ivt h TYR 207 Ca 0.04 0.03 -0.08 0.00 3.14 0.00 0.00 58.73 61.86 3ivt h TYR 207 Cb 0.19 -0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.38 3ivt h TYR 207 CO -0.16 0.06 -0.07 0.22 -1.64 0.00 0.00 178.16 176.57 3ivt h ASP 208 N 0.37 0.69 -0.43 -2.11 -0.00 -0.98 -1.51 116.42 112.45 3ivt h ASP 208 Ca 0.33 -0.35 -0.07 0.00 -0.00 0.00 0.00 57.03 56.93 3ivt h ASP 208 Cb 0.45 -0.19 -0.01 0.00 -0.00 0.00 0.00 39.33 39.58 3ivt h ASP 208 CO -0.35 0.88 -0.02 0.25 -0.00 0.00 0.00 179.24 180.00 3ivt h LEU 209 N 0.49 0.76 -0.24 2.28 5.85 -0.87 -1.66 115.31 121.92 3ivt h LEU 209 Ca 0.09 -0.32 -0.11 0.00 0.84 0.00 0.00 57.88 58.38 3ivt h LEU 209 Cb 0.57 -0.20 -0.00 0.00 0.37 0.00 0.00 40.66 41.39 3ivt h LEU 209 CO 0.03 0.90 -0.29 0.40 -0.34 0.00 0.00 178.44 179.14 3ivt h ILE 210 N 0.61 1.32 -0.85 4.05 1.08 -1.01 0.19 117.51 122.89 3ivt h ILE 210 Ca 0.12 -1.47 0.10 0.00 -0.39 0.00 0.00 64.86 63.22 3ivt h ILE 210 Cb 0.52 1.70 -0.08 0.00 -3.07 0.00 0.00 36.82 35.89 3ivt h ILE 210 CO 0.03 0.46 0.49 -0.09 -0.69 0.00 0.00 178.15 178.35 3ivt h ARG 211 N 0.33 0.79 -0.27 2.37 9.65 -1.27 0.45 114.38 126.43 3ivt h ARG 211 Ca 0.03 -0.05 -0.09 0.00 -1.10 0.00 0.00 59.98 58.78 3ivt h ARG 211 Cb 0.86 -0.18 -0.01 0.00 -1.39 0.00 0.00 29.97 29.25 3ivt h ARG 211 CO 0.07 0.52 -0.16 1.15 2.80 0.00 0.00 179.97 184.35 3ivt h THR 212 N 0.81 1.30 -0.39 0.20 2.02 -1.05 -2.95 112.91 112.86 3ivt h THR 212 Ca 0.41 -1.27 0.03 0.00 0.77 0.00 0.00 66.41 66.35 3ivt h THR 212 Cb 0.39 1.54 -0.03 0.00 -1.74 0.00 0.00 68.15 68.31 3ivt h THR 212 CO -0.26 0.40 0.21 0.25 0.37 0.00 0.00 175.52 176.49 3ivt h LEU 213 N 0.32 0.31 -1.54 2.58 5.85 -0.13 -1.14 115.31 121.57 3ivt h LEU 213 Ca 0.06 0.01 0.26 0.00 0.84 0.00 0.00 57.88 59.06 3ivt h LEU 213 Cb 0.69 -0.05 -0.08 0.00 0.37 0.00 0.00 40.66 41.60 3ivt h LEU 213 CO 0.05 0.23 0.68 -0.09 -0.34 0.00 0.00 178.44 178.96 3ivt h ARG 214 N 0.42 0.30 0.00 1.25 9.65 -0.12 0.20 114.38 126.07 3ivt h ARG 214 Ca 0.16 -0.02 -0.00 0.00 -1.10 0.00 0.00 59.98 59.02 3ivt h ARG 214 Cb 0.06 -0.07 -0.00 0.00 -1.39 0.00 0.00 29.97 28.57 3ivt h ARG 214 CO -0.10 0.20 -0.02 0.78 2.80 0.00 0.00 179.97 183.62 3ivt h GLY 215 N 0.30 0.00 0.68 2.80 0.00 -1.05 -3.37 103.07 102.43 3ivt h GLY 215 Ca 0.55 0.00 -0.36 0.00 0.00 0.00 0.00 47.33 47.52 3ivt h GLY 215 CO -0.20 0.00 -1.95 -2.08 0.00 0.00 0.00 176.54 172.31 3ivt h VAL 216 N 0.00 0.68 -1.73 4.60 2.07 0.12 -3.48 116.25 118.52 3ivt h VAL 216 Ca -0.00 -2.38 -0.56 0.00 0.82 0.00 0.00 66.70 64.58 3ivt h VAL 216 Cb 1.01 2.55 -0.08 0.00 -1.52 0.00 0.00 31.29 33.24 3ivt h VAL 216 CO 0.00 0.88 -0.52 0.68 0.02 0.00 0.00 177.57 178.63 3ivt s VAL 217 N -2.56 2.58 -0.73 2.57 -7.23 -0.66 -4.85 120.40 109.51 3ivt s VAL 217 Ca -0.21 -1.73 0.09 0.00 -1.81 0.00 0.00 61.98 58.32 3ivt s VAL 217 Cb 0.06 -2.96 -0.02 0.00 0.56 0.00 0.00 36.38 34.03 3ivt s VAL 217 CO 0.79 -0.09 0.55 -1.54 -0.31 0.00 0.00 175.10 174.50 3ivt n SER 218 N -1.18 1.00 -1.66 4.85 3.41 -1.26 -4.78 113.62 114.01 3ivt n SER 218 Ca -0.02 -1.00 0.00 0.00 -0.26 0.00 0.00 58.87 57.59 3ivt n SER 218 Cb 0.63 0.55 0.00 0.00 -0.26 0.00 0.00 64.21 65.14 3ivt n SER 218 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3ivt s ASP 220 N -1.00 5.42 -0.06 0.00 1.01 -0.88 -4.93 116.67 116.23 3ivt s ASP 220 Ca 0.00 1.10 -0.00 0.00 0.71 0.00 0.00 52.55 54.36 3ivt s ASP 220 Cb 0.00 -1.89 0.02 0.00 1.01 0.00 0.00 42.92 42.06 3ivt s ASP 220 CO 0.00 -1.35 -0.02 -0.63 0.21 0.00 0.00 175.17 173.38 3ivt s ILE 221 N -3.35 0.47 -0.02 0.77 1.01 -1.26 -1.38 121.20 117.44 3ivt s ILE 221 Ca 0.58 -0.01 0.03 0.00 0.00 0.00 0.00 60.65 61.25 3ivt s ILE 221 Cb -0.11 -0.56 -0.03 0.00 0.01 0.00 0.00 42.46 41.77 3ivt s ILE 221 CO 0.51 0.25 -0.07 -0.70 0.00 0.00 0.00 174.94 174.93 3ivt s GLU 222 N 1.45 2.60 -0.01 2.79 2.12 0.61 -0.67 118.70 127.60 3ivt s GLU 222 Ca -0.03 -0.68 0.05 0.00 0.36 0.00 0.00 54.97 54.68 3ivt s GLU 222 Cb -0.13 -2.52 -0.01 0.00 0.26 0.00 0.00 34.13 31.72 3ivt s GLU 222 CO -0.03 0.62 -0.16 0.00 -0.54 0.00 0.00 175.26 175.15 3ivt s HIS 224 N -0.42 1.16 -0.16 0.00 5.04 0.22 -1.68 115.29 119.46 3ivt s HIS 224 Ca 0.06 -0.69 0.01 0.00 -1.54 0.00 0.00 55.06 52.89 3ivt s HIS 224 Cb -0.06 -1.06 0.02 0.00 0.04 0.00 0.00 32.58 31.52 3ivt s HIS 224 CO -0.00 -0.51 -0.15 -0.06 -2.34 0.00 0.00 174.74 171.68 3ivt s PHE 225 N 1.81 2.36 0.61 3.88 0.08 -1.26 -0.02 117.98 125.44 3ivt s PHE 225 Ca 0.02 -1.39 -0.12 0.00 0.12 0.00 0.00 56.93 55.57 3ivt s PHE 225 Cb -0.14 -1.68 -0.04 0.00 -0.57 0.00 0.00 43.02 40.58 3ivt s PHE 225 CO -0.07 -0.72 1.03 -1.01 -0.10 0.00 0.00 175.22 174.35 3ivt s HIS 226 N 1.42 3.57 -0.17 0.36 3.76 -0.84 -2.68 115.29 120.71 3ivt s HIS 226 Ca 0.04 1.32 0.16 0.00 -0.15 0.00 0.00 55.06 56.43 3ivt s HIS 226 Cb -0.13 -2.74 0.41 0.00 1.11 0.00 0.00 32.58 31.23 3ivt s HIS 226 CO -0.11 -0.68 1.29 -1.71 -0.85 0.00 0.00 174.74 172.68 3ivt n ASN 227 N -2.62 2.84 -0.29 1.40 5.15 -0.08 -4.08 115.26 117.57 3ivt n ASN 227 Ca 0.06 -3.23 0.22 0.00 -0.60 0.00 0.00 54.58 51.04 3ivt n ASN 227 Cb 0.54 -0.50 0.53 0.00 -0.53 0.00 0.00 39.78 39.81 3ivt n ASN 227 CO 0.00 0.00 0.00 0.44 1.40 0.00 0.00 177.26 179.10 3ivt h ASP 228 N 0.84 0.40 0.00 1.20 5.19 -1.80 -2.24 116.42 120.01 3ivt h ASP 228 Ca 0.03 0.06 -0.00 0.00 -0.62 0.00 0.00 57.03 56.50 3ivt h ASP 228 Cb 1.23 -0.01 -0.01 0.00 0.18 0.00 0.00 39.33 40.73 3ivt h ASP 228 CO 0.12 0.11 -0.23 0.35 -3.12 0.00 0.00 179.24 176.47 3ivt n THR 229 N -4.55 1.96 -1.21 0.35 -2.24 -1.25 -4.99 114.28 102.35 3ivt n THR 229 Ca 0.23 -2.62 -0.07 0.00 -2.27 0.00 0.00 64.05 59.32 3ivt n THR 229 Cb 0.84 -0.21 -0.03 0.00 -2.10 0.00 0.00 70.33 68.83 3ivt n THR 229 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3ivt n GLY 230 N -1.25 0.90 0.40 3.38 0.00 -0.84 -4.94 105.19 102.83 3ivt n GLY 230 Ca 0.17 -0.74 0.06 0.00 0.00 0.00 0.00 46.02 45.51 3ivt n GLY 230 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 3ivt n MET 231 N -2.79 1.33 -0.28 1.61 2.81 -1.26 -4.71 117.12 113.83 3ivt n MET 231 Ca -0.07 -0.98 -0.03 0.00 -1.81 0.00 0.00 57.70 54.81 3ivt n MET 231 Cb 0.23 -1.20 0.09 0.00 -0.71 0.00 0.00 33.22 31.63 3ivt n MET 231 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3ivt h ALA 232 N 2.30 1.01 -0.09 3.04 0.00 -1.86 0.29 119.26 123.95 3ivt h ALA 232 Ca 0.00 -0.03 -0.17 0.00 0.00 0.00 0.00 54.91 54.71 3ivt h ALA 232 Cb 0.47 -0.26 0.01 0.00 0.00 0.00 0.00 17.79 18.01 3ivt h ALA 232 CO 0.00 0.30 -0.62 0.82 0.00 0.00 0.00 179.25 179.75 3ivt h ILE 233 N 0.96 1.35 -0.99 0.00 2.04 -1.92 -2.54 117.51 116.41 3ivt h ILE 233 Ca 0.31 -1.93 0.01 0.00 1.00 0.00 0.00 64.86 64.24 3ivt h ILE 233 Cb -0.00 2.23 -0.05 0.00 -0.74 0.00 0.00 36.82 38.26 3ivt h ILE 233 CO -0.11 0.59 0.66 0.00 0.00 0.00 0.00 178.15 179.29 3ivt h ALA 234 N 0.46 1.25 -0.45 1.87 0.00 -1.76 -1.68 119.26 118.95 3ivt h ALA 234 Ca -0.05 -0.07 -0.13 0.00 0.00 0.00 0.00 54.91 54.66 3ivt h ALA 234 Cb 1.28 -0.40 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 3ivt h ALA 234 CO 0.13 0.64 -0.23 -0.91 0.00 0.00 0.00 179.25 178.88 3ivt h ASN 235 N 1.34 0.99 -0.74 0.00 2.35 -0.44 -1.28 115.58 117.80 3ivt h ASN 235 Ca 0.36 -0.41 0.07 0.00 -0.55 0.00 0.00 56.30 55.78 3ivt h ASN 235 Cb -0.16 -0.27 -0.06 0.00 0.05 0.00 0.00 38.32 37.88 3ivt h ASN 235 CO -0.08 1.18 0.42 0.00 -1.65 0.00 0.00 177.43 177.30 3ivt h ALA 236 N 0.84 1.01 -0.11 -0.83 0.00 -1.16 0.13 119.26 119.14 3ivt h ALA 236 Ca 0.10 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 3ivt h ALA 236 Cb 0.81 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.46 3ivt h ALA 236 CO 0.07 0.08 0.02 -0.92 0.00 0.00 0.00 179.25 178.50 3ivt h TYR 237 N 0.74 0.20 -0.25 0.00 3.20 -0.92 -0.86 116.97 119.08 3ivt h TYR 237 Ca 0.34 -0.03 -0.08 0.00 3.14 0.00 0.00 58.73 62.10 3ivt h TYR 237 Cb 0.25 -0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.45 3ivt h TYR 237 CO -0.07 0.37 -0.21 0.00 -1.64 0.00 0.00 178.16 176.62 3ivt h ALA 239 N 1.38 -0.15 -0.86 0.00 0.00 -0.54 -1.26 119.26 117.84 3ivt h ALA 239 Ca 0.07 -0.00 0.12 0.00 0.00 0.00 0.00 54.91 55.09 3ivt h ALA 239 Cb 0.59 0.19 -0.08 0.00 0.00 0.00 0.00 17.79 18.48 3ivt h ALA 239 CO 0.04 -0.61 0.48 -0.07 0.00 0.00 0.00 179.25 179.09 3ivt h LEU 240 N -0.20 0.66 -1.24 0.00 3.38 -0.74 -1.39 115.31 115.77 3ivt h LEU 240 Ca 0.03 0.06 -0.07 0.00 0.09 0.00 0.00 57.88 58.00 3ivt h LEU 240 Cb 0.24 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 3ivt h LEU 240 CO -0.09 0.34 -0.23 -0.33 0.09 0.00 0.00 178.44 178.21 3ivt h GLU 241 N 0.76 0.23 -0.00 1.13 5.08 -0.65 0.26 114.58 121.37 3ivt h GLU 241 Ca 0.44 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.73 3ivt h GLU 241 Cb 0.49 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.72 3ivt h GLU 241 CO -0.29 0.45 -0.08 0.00 -1.00 0.00 0.00 179.01 178.10 3ivt n ALA 242 N -2.48 2.71 0.00 3.43 0.00 -0.52 -3.61 120.51 120.03 3ivt n ALA 242 Ca -0.01 -0.27 0.00 0.00 0.00 0.00 0.00 53.44 53.16 3ivt n ALA 242 Cb 0.34 -1.36 0.00 0.00 0.00 0.00 0.00 19.45 18.44 3ivt n ALA 242 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ivt n GLY 243 N 1.23 0.95 3.74 0.00 0.00 -0.94 -4.12 105.19 106.06 3ivt n GLY 243 Ca 0.16 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.78 3ivt n GLY 243 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ivt n ALA 244 N -0.43 1.78 -0.01 4.61 0.00 -0.70 -4.74 120.51 121.02 3ivt n ALA 244 Ca 0.00 0.24 0.03 0.00 0.00 0.00 0.00 53.44 53.71 3ivt n ALA 244 Cb 0.00 -2.35 -0.07 0.00 0.00 0.00 0.00 19.45 17.03 3ivt n ALA 244 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3ivt n THR 245 N -0.29 0.10 -4.18 0.00 -2.24 0.15 -4.54 114.28 103.29 3ivt n THR 245 Ca 0.06 -0.24 -0.17 0.00 -2.27 0.00 0.00 64.05 61.43 3ivt n THR 245 Cb 0.41 0.10 -0.15 0.00 -2.10 0.00 0.00 70.33 68.60 3ivt n THR 245 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 3ivt s HIS 246 N -2.56 0.56 -0.09 4.78 3.76 -0.72 -1.19 115.29 119.83 3ivt s HIS 246 Ca -0.03 -0.11 0.03 0.00 -0.15 0.00 0.00 55.06 54.79 3ivt s HIS 246 Cb 0.05 -0.41 0.01 0.00 1.11 0.00 0.00 32.58 33.34 3ivt s HIS 246 CO 0.38 -0.05 -0.20 0.42 -0.85 0.00 0.00 174.74 174.43 3ivt s ILE 247 N 0.15 1.74 0.10 0.60 -1.09 -0.48 -1.53 121.20 120.68 3ivt s ILE 247 Ca -0.01 -0.83 -0.31 0.00 -2.23 0.00 0.00 60.65 57.27 3ivt s ILE 247 Cb -0.06 -1.53 -0.07 0.00 -1.58 0.00 0.00 42.46 39.23 3ivt s ILE 247 CO -0.00 0.49 1.23 -1.81 -1.23 0.00 0.00 174.94 173.61 3ivt s ASP 248 N 0.48 7.04 0.32 3.58 -0.00 -0.67 -1.26 116.67 126.16 3ivt s ASP 248 Ca -0.17 2.11 0.03 0.00 -0.00 0.00 0.00 52.55 54.53 3ivt s ASP 248 Cb -0.17 -2.59 -0.05 0.00 -0.00 0.00 0.00 42.92 40.12 3ivt s ASP 248 CO 0.07 -0.47 0.11 0.42 -0.00 0.00 0.00 175.17 175.29 3ivt s THR 249 N 0.81 0.71 -0.01 -1.27 -4.23 -0.74 -4.46 115.64 106.45 3ivt s THR 249 Ca 0.58 -2.00 -0.05 0.00 -1.18 0.00 0.00 61.69 59.05 3ivt s THR 249 Cb -0.31 -2.59 -0.00 0.00 1.34 0.00 0.00 72.50 70.93 3ivt s THR 249 CO 0.31 0.00 0.09 -0.55 -0.54 0.00 0.00 174.62 173.93 3ivt s SER 250 N -3.44 0.03 0.08 3.99 0.15 -0.66 -0.23 113.70 113.62 3ivt s SER 250 Ca 0.34 -0.15 -0.31 0.00 0.70 0.00 0.00 55.95 56.53 3ivt s SER 250 Cb 0.06 0.19 -0.08 0.00 -1.71 0.00 0.00 66.02 64.49 3ivt s SER 250 CO 0.15 -0.26 1.50 -0.63 1.20 0.00 0.00 173.24 175.20 3ivt s ILE 251 N -1.00 3.21 -1.27 6.45 1.01 -1.26 -0.57 121.20 127.78 3ivt s ILE 251 Ca -0.11 0.76 0.00 0.00 0.00 0.00 0.00 60.65 61.30 3ivt s ILE 251 Cb -0.06 -3.49 0.00 0.00 0.01 0.00 0.00 42.46 38.92 3ivt s ILE 251 CO 0.01 0.03 0.00 0.18 0.00 0.00 0.00 174.94 175.15 3ivt n LEU 252 N 4.77 -0.51 -0.07 2.97 4.77 -1.26 -2.38 117.00 125.30 3ivt n LEU 252 Ca 0.14 0.30 -0.01 0.00 -0.03 0.00 0.00 56.01 56.40 3ivt n LEU 252 Cb 0.41 -2.58 -0.00 0.00 -2.33 0.00 0.00 43.42 38.92 3ivt n LEU 252 CO 0.60 -0.99 -0.01 0.61 -1.33 0.00 0.00 177.39 176.27 3ivt n GLY 253 N -0.05 0.24 3.72 -0.72 0.00 -0.25 -4.89 105.19 103.25 3ivt n GLY 253 Ca -0.12 -0.02 -0.42 0.00 0.00 0.00 0.00 46.02 45.45 3ivt n GLY 253 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3ivt n ILE 254 N -2.33 0.67 -2.87 -0.61 -5.35 -1.00 -0.72 119.36 107.15 3ivt n ILE 254 Ca -0.01 -0.17 0.00 0.00 -0.27 0.00 0.00 62.75 62.30 3ivt n ILE 254 Cb 0.35 -1.88 0.00 0.00 -1.74 0.00 0.00 39.64 36.37 3ivt n ILE 254 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3ivt n GLY 255 N 2.74 1.33 3.74 3.28 0.00 -1.26 -3.54 105.19 111.47 3ivt n GLY 255 Ca 0.11 -0.68 -0.40 0.00 0.00 0.00 0.00 46.02 45.05 3ivt n GLY 255 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3ivt n GLU 256 N 0.00 1.98 0.00 1.61 4.07 -1.25 -3.36 120.64 123.69 3ivt n GLU 256 Ca 0.00 0.71 0.00 0.00 -0.06 0.00 0.00 57.16 57.81 3ivt n GLU 256 Cb 0.00 -2.53 0.00 0.00 -0.06 0.00 0.00 31.44 28.85 3ivt n GLU 256 CO 0.00 0.00 0.00 0.54 -0.06 0.00 0.00 177.13 177.61 3ivt n ARG 257 N -0.34 0.00 -0.03 5.31 1.74 -1.26 -0.64 116.66 121.44 3ivt n ARG 257 Ca 0.07 0.00 0.05 0.00 -0.77 0.00 0.00 57.85 57.20 3ivt n ARG 257 Cb 0.42 0.00 0.25 0.00 -1.02 0.00 0.00 32.46 32.11 3ivt n ARG 257 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 3ivt n ASN 258 N 1.33 0.35 0.00 0.55 6.94 -1.26 -4.86 115.26 118.32 3ivt n ASN 258 Ca 0.00 -1.76 0.00 0.00 -0.02 0.00 0.00 54.58 52.80 3ivt n ASN 258 Cb 0.00 -0.03 0.00 0.00 -2.36 0.00 0.00 39.78 37.39 3ivt n ASN 258 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3ivt n GLY 259 N 0.72 -1.82 0.00 4.83 0.00 0.19 -4.74 105.19 104.37 3ivt n GLY 259 Ca 0.08 -1.93 0.00 0.00 0.00 0.00 0.00 46.02 44.17 3ivt n GLY 259 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3ivt n ILE 260 N 0.00 0.00 -1.64 -0.61 -5.35 0.10 -0.90 119.36 110.96 3ivt n ILE 260 Ca 0.00 0.00 -0.48 0.00 -0.27 0.00 0.00 62.75 62.00 3ivt n ILE 260 Cb 0.00 0.00 -0.05 0.00 -1.74 0.00 0.00 39.64 37.85 3ivt n ILE 260 CO 0.00 0.00 0.00 0.41 -1.76 0.00 0.00 176.55 175.20 3ivt n THR 261 N 0.00 0.51 -2.44 7.28 -1.04 -1.09 -4.43 114.28 113.06 3ivt n THR 261 Ca 0.00 -0.17 -0.41 0.00 -2.04 0.00 0.00 64.05 61.43 3ivt n THR 261 Cb 0.00 -1.95 -0.04 0.00 -1.82 0.00 0.00 70.33 66.52 3ivt n THR 261 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 3ivt s PRO 262 N 4.69 4.59 0.11 -2.82 0.02 -1.26 -1.66 135.00 138.67 3ivt s PRO 262 Ca 0.96 1.83 -0.32 0.00 0.02 0.00 0.00 61.00 63.49 3ivt s PRO 262 Cb -0.66 -3.21 -0.11 0.00 0.02 0.00 0.00 34.50 30.54 3ivt s PRO 262 CO 0.49 0.11 1.59 1.25 -0.33 0.00 0.00 177.00 180.11 3ivt h LEU 263 N 4.31 -1.21 -1.02 -5.54 5.85 -1.18 -0.96 115.31 115.55 3ivt h LEU 263 Ca -0.46 0.13 0.04 0.00 0.84 0.00 0.00 57.88 58.43 3ivt h LEU 263 Cb 1.21 0.44 -0.06 0.00 0.37 0.00 0.00 40.66 42.63 3ivt h LEU 263 CO 0.69 -0.51 0.65 1.23 -0.34 0.00 0.00 178.44 180.17 3ivt h GLY 264 N -0.71 1.47 0.89 3.75 0.00 -1.93 -1.63 103.07 104.92 3ivt h GLY 264 Ca 0.01 -0.49 -0.02 0.00 0.00 0.00 0.00 47.33 46.82 3ivt h GLY 264 CO -0.20 0.41 0.08 0.00 0.00 0.00 0.00 176.54 176.83 3ivt h ALA 265 N 1.43 0.37 -0.46 3.60 0.00 -1.78 -0.86 119.26 121.56 3ivt h ALA 265 Ca 0.40 -0.15 0.04 0.00 0.00 0.00 0.00 54.91 55.20 3ivt h ALA 265 Cb 0.04 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.68 3ivt h ALA 265 CO -0.13 0.01 0.22 1.25 0.00 0.00 0.00 179.25 180.60 3ivt h LEU 266 N 0.29 0.32 -1.06 0.00 5.85 -0.83 -1.95 115.31 117.93 3ivt h LEU 266 Ca 0.09 0.03 -0.06 0.00 0.84 0.00 0.00 57.88 58.77 3ivt h LEU 266 Cb 0.25 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.23 3ivt h LEU 266 CO -0.00 0.23 -0.02 -0.07 -0.34 0.00 0.00 178.44 178.24 3ivt h LEU 267 N 0.45 0.61 -0.40 2.25 3.38 -0.94 -0.21 115.31 120.45 3ivt h LEU 267 Ca 0.20 -0.14 0.02 0.00 0.09 0.00 0.00 57.88 58.05 3ivt h LEU 267 Cb 0.11 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.68 3ivt h LEU 267 CO -0.15 0.69 0.23 0.00 0.09 0.00 0.00 178.44 179.31 3ivt h ALA 268 N 1.38 0.50 -0.35 1.53 0.00 -0.64 0.99 119.26 122.66 3ivt h ALA 268 Ca 0.12 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 3ivt h ALA 268 Cb 0.41 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 3ivt h ALA 268 CO 0.02 -0.11 0.17 -0.09 0.00 0.00 0.00 179.25 179.23 3ivt h ARG 269 N 0.46 0.51 0.00 0.00 9.65 -0.80 -2.90 114.38 121.31 3ivt h ARG 269 Ca 0.16 -0.08 -0.11 0.00 -1.10 0.00 0.00 59.98 58.85 3ivt h ARG 269 Cb 0.02 -0.09 -0.02 0.00 -1.39 0.00 0.00 29.97 28.49 3ivt h ARG 269 CO -0.08 0.47 -0.53 0.52 2.80 0.00 0.00 179.97 183.15 3ivt h MET 270 N 0.43 0.00 -0.22 0.20 2.86 -0.90 -2.93 114.93 114.38 3ivt h MET 270 Ca 0.12 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.76 3ivt h MET 270 Cb 0.13 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.78 3ivt h MET 270 CO -0.01 0.53 0.14 -0.92 1.06 0.00 0.00 176.91 177.71 3ivt h TYR 271 N 0.00 0.28 -0.55 -0.22 3.20 -0.72 -0.65 116.97 118.31 3ivt h TYR 271 Ca -0.01 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.86 3ivt h TYR 271 Cb 1.13 -0.09 -0.03 0.00 1.54 0.00 0.00 36.73 39.28 3ivt h TYR 271 CO 0.00 0.18 0.30 0.28 -1.64 0.00 0.00 178.16 177.28 3ivt h VAL 272 N 0.29 1.18 -0.95 1.81 2.07 -1.37 -0.60 116.25 118.68 3ivt h VAL 272 Ca 0.08 -0.47 -0.00 0.00 0.82 0.00 0.00 66.70 67.13 3ivt h VAL 272 Cb -0.03 0.49 -0.05 0.00 -1.52 0.00 0.00 31.29 30.18 3ivt h VAL 272 CO -0.02 0.20 0.58 0.74 0.02 0.00 0.00 177.57 179.09 3ivt h THR 273 N 0.74 1.26 -1.38 2.57 2.02 -1.39 -3.40 112.91 113.34 3ivt h THR 273 Ca 0.19 -0.56 -0.19 0.00 0.77 0.00 0.00 66.41 66.63 3ivt h THR 273 Cb 0.05 -0.09 -0.24 0.00 -1.74 0.00 0.00 68.15 66.13 3ivt h THR 273 CO -0.03 0.27 -0.55 -0.62 0.37 0.00 0.00 175.52 174.96 3ivt s ASP 274 N -6.18 -0.47 0.14 4.18 3.68 -0.26 -5.05 116.67 112.71 3ivt s ASP 274 Ca -0.13 -1.13 -0.20 0.00 2.13 0.00 0.00 52.55 53.21 3ivt s ASP 274 Cb 0.17 1.41 0.00 0.00 -1.45 0.00 0.00 42.92 43.05 3ivt s ASP 274 CO 0.82 -0.20 1.68 -0.09 0.13 0.00 0.00 175.17 177.51 3ivt h ARG 275 N 6.97 -0.10 -0.54 4.34 2.43 -1.34 -2.68 114.38 123.47 3ivt h ARG 275 Ca 0.05 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 3ivt h ARG 275 Cb 1.13 0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 30.67 3ivt h ARG 275 CO 0.14 -0.06 0.34 0.93 -1.51 0.00 0.00 179.97 179.80 3ivt h GLU 276 N -0.10 0.72 0.44 0.20 4.39 -1.97 0.02 114.58 118.29 3ivt h GLU 276 Ca 0.12 -0.06 -0.01 0.00 0.34 0.00 0.00 59.36 59.75 3ivt h GLU 276 Cb 0.28 -0.16 -0.03 0.00 -0.10 0.00 0.00 28.75 28.74 3ivt h GLU 276 CO -0.27 0.50 -0.48 -0.92 -1.16 0.00 0.00 179.01 176.68 3ivt h TYR 277 N 0.72 -1.34 -0.28 4.33 3.20 -1.92 -1.84 116.97 119.84 3ivt h TYR 277 Ca 0.19 0.01 -0.03 0.00 3.14 0.00 0.00 58.73 62.05 3ivt h TYR 277 Cb -0.04 0.53 -0.01 0.00 1.54 0.00 0.00 36.73 38.75 3ivt h TYR 277 CO -0.03 -0.64 0.06 0.82 -1.64 0.00 0.00 178.16 176.73 3ivt h ILE 278 N -0.95 1.22 0.00 1.81 1.08 -1.36 -2.14 117.51 117.18 3ivt h ILE 278 Ca -0.05 -0.74 -0.03 0.00 -0.39 0.00 0.00 64.86 63.64 3ivt h ILE 278 Cb 0.84 1.18 -0.00 0.00 -3.07 0.00 0.00 36.82 35.77 3ivt h ILE 278 CO -0.09 0.24 -0.15 0.71 -0.69 0.00 0.00 178.15 178.17 3ivt h THR 279 N 0.27 0.97 0.03 -0.27 1.35 -0.95 -2.48 112.91 111.83 3ivt h THR 279 Ca 0.09 -0.54 -0.28 0.00 -0.55 0.00 0.00 66.41 65.12 3ivt h THR 279 Cb 0.31 1.30 -0.04 0.00 -1.73 0.00 0.00 68.15 68.00 3ivt h THR 279 CO 0.00 0.15 -1.54 0.45 -0.25 0.00 0.00 175.52 174.33 3ivt h HIS 280 N 0.00 0.11 -0.01 4.73 3.86 -1.25 -3.37 115.15 119.21 3ivt h HIS 280 Ca -0.00 -0.08 -0.21 0.00 -1.16 0.00 0.00 60.37 58.91 3ivt h HIS 280 Cb 0.29 -0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.76 3ivt h HIS 280 CO 0.00 1.12 -0.90 -0.22 0.86 0.00 0.00 177.93 178.79 3ivt h LYS 281 N 0.02 0.38 -6.81 2.45 3.64 -1.17 -3.46 116.57 111.62 3ivt h LYS 281 Ca -0.23 -0.39 -0.69 0.00 -1.27 0.00 0.00 60.65 58.07 3ivt h LYS 281 Cb 1.96 0.11 -0.24 0.00 -0.41 0.00 0.00 32.23 33.65 3ivt h LYS 281 CO 0.10 1.06 -0.87 0.71 -2.27 0.00 0.00 179.45 178.19 3ivt s TYR 282 N -3.32 2.33 -1.19 1.91 2.02 -0.95 -4.69 117.35 113.46 3ivt s TYR 282 Ca -0.05 -0.39 -0.14 0.00 -0.37 0.00 0.00 57.07 56.11 3ivt s TYR 282 Cb 0.09 -1.33 0.17 0.00 -0.40 0.00 0.00 41.96 40.49 3ivt s TYR 282 CO 0.86 0.23 1.41 0.15 -1.57 0.00 0.00 175.55 176.63 3ivt s LYS 283 N -1.62 4.06 0.32 -0.62 -0.14 -0.05 -4.70 119.74 116.98 3ivt s LYS 283 Ca 0.13 -2.53 0.05 0.00 -1.36 0.00 0.00 55.97 52.26 3ivt s LYS 283 Cb -0.10 -5.05 0.70 0.00 -1.68 0.00 0.00 37.83 31.70 3ivt s LYS 283 CO 0.04 -1.77 1.84 -0.07 -0.76 0.00 0.00 175.35 174.63 3ivt h LEU 284 N 9.76 0.79 0.00 3.17 3.38 -1.85 -1.48 115.31 129.08 3ivt h LEU 284 Ca 0.31 0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.33 3ivt h LEU 284 Cb 0.88 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.53 3ivt h LEU 284 CO 1.24 0.39 0.00 -0.46 0.09 0.00 0.00 178.44 179.69 3ivt n ASN 285 N -4.62 0.00 -0.61 -0.43 6.94 -1.26 -1.67 115.26 113.61 3ivt n ASN 285 Ca 0.19 0.24 0.12 0.00 -0.02 0.00 0.00 54.58 55.11 3ivt n ASN 285 Cb 0.44 -0.25 0.15 0.00 -2.36 0.00 0.00 39.78 37.77 3ivt n ASN 285 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3ivt n GLN 286 N -1.25 1.59 -0.14 -3.83 6.02 -0.55 -4.55 117.38 114.67 3ivt n GLN 286 Ca 0.00 -1.23 -0.11 0.00 -0.01 0.00 0.00 57.00 55.65 3ivt n GLN 286 Cb 0.00 -1.47 -0.01 0.00 1.02 0.00 0.00 30.24 29.78 3ivt n GLN 286 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 177.06 177.30 3ivt h LEU 287 N 3.01 0.74 -0.50 1.08 5.85 -1.48 -0.95 115.31 123.04 3ivt h LEU 287 Ca 0.00 -0.33 0.07 0.00 0.84 0.00 0.00 57.88 58.46 3ivt h LEU 287 Cb 0.77 -0.20 -0.06 0.00 0.37 0.00 0.00 40.66 41.55 3ivt h LEU 287 CO 0.00 0.89 0.19 -0.09 -0.34 0.00 0.00 178.44 179.09 3ivt h ARG 288 N 0.57 0.37 -0.01 1.25 2.43 -1.82 0.64 114.38 117.81 3ivt h ARG 288 Ca 0.11 -0.02 -0.14 0.00 -0.81 0.00 0.00 59.98 59.12 3ivt h ARG 288 Cb 0.53 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.98 3ivt h ARG 288 CO 0.03 0.25 -0.64 1.49 -1.51 0.00 0.00 179.97 179.58 3ivt h GLU 289 N 0.38 0.04 -0.14 0.20 4.57 -1.78 0.12 114.58 117.97 3ivt h GLU 289 Ca 0.24 -0.03 -0.10 0.00 -1.18 0.00 0.00 59.36 58.29 3ivt h GLU 289 Cb 0.24 0.01 0.00 0.00 -0.16 0.00 0.00 28.75 28.84 3ivt h GLU 289 CO -0.23 0.67 -0.31 1.25 -1.18 0.00 0.00 179.01 179.20 3ivt h LEU 290 N 0.03 0.51 -0.16 1.64 5.85 -0.75 -2.85 115.31 119.58 3ivt h LEU 290 Ca -0.01 -0.57 -0.01 0.00 0.84 0.00 0.00 57.88 58.13 3ivt h LEU 290 Cb 1.14 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 42.01 3ivt h LEU 290 CO 0.09 0.99 0.04 -0.33 -0.34 0.00 0.00 178.44 178.89 3ivt h GLU 291 N 0.06 0.25 -0.86 1.25 5.08 -0.57 -3.09 114.58 116.70 3ivt h GLU 291 Ca 0.00 -0.06 0.14 0.00 -1.00 0.00 0.00 59.36 58.44 3ivt h GLU 291 Cb 0.91 -0.03 -0.07 0.00 0.50 0.00 0.00 28.75 30.06 3ivt h GLU 291 CO 0.07 0.39 0.56 -0.91 -1.00 0.00 0.00 179.01 178.11 3ivt h ASN 292 N 0.07 0.61 -0.11 1.42 2.35 -0.85 0.30 115.58 119.37 3ivt h ASN 292 Ca 0.05 0.03 -0.00 0.00 -0.55 0.00 0.00 56.30 55.83 3ivt h ASN 292 Cb 0.24 -0.09 -0.01 0.00 0.05 0.00 0.00 38.32 38.52 3ivt h ASN 292 CO -0.00 0.32 0.06 0.25 -1.65 0.00 0.00 177.43 176.41 3ivt h LEU 293 N 0.65 0.14 -0.25 1.61 5.85 -1.47 -0.11 115.31 121.73 3ivt h LEU 293 Ca 0.43 -0.07 -0.08 0.00 0.84 0.00 0.00 57.88 59.00 3ivt h LEU 293 Cb 0.71 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.70 3ivt h LEU 293 CO -0.18 0.17 -0.14 0.58 -0.34 0.00 0.00 178.44 178.52 3ivt h VAL 294 N 0.10 1.30 -0.89 1.05 2.07 -1.31 -2.69 116.25 115.89 3ivt h VAL 294 Ca 0.04 -1.24 0.12 0.00 0.82 0.00 0.00 66.70 66.44 3ivt h VAL 294 Cb 0.06 1.57 -0.08 0.00 -1.52 0.00 0.00 31.29 31.32 3ivt h VAL 294 CO -0.01 0.39 0.52 0.00 0.02 0.00 0.00 177.57 178.49 3ivt h ALA 295 N 0.72 1.32 -0.52 1.67 0.00 -0.23 0.57 119.26 122.79 3ivt h ALA 295 Ca 0.05 0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.95 3ivt h ALA 295 Cb 0.66 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 3ivt h ALA 295 CO 0.04 0.09 0.11 0.22 0.00 0.00 0.00 179.25 179.71 3ivt h ASP 296 N 0.82 0.81 -0.26 0.00 3.58 -0.97 0.23 116.42 120.62 3ivt h ASP 296 Ca 0.45 -0.24 -0.16 0.00 0.42 0.00 0.00 57.03 57.49 3ivt h ASP 296 Cb 0.48 -0.21 -0.00 0.00 1.72 0.00 0.00 39.33 41.32 3ivt h ASP 296 CO -0.28 0.84 -0.46 0.00 -2.88 0.00 0.00 179.24 176.47 3ivt h ALA 297 N 0.99 0.41 -0.51 -0.78 0.00 -0.72 -3.04 119.26 115.61 3ivt h ALA 297 Ca 0.16 -0.48 0.00 0.00 0.00 0.00 0.00 54.91 54.59 3ivt h ALA 297 Cb 0.36 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.08 3ivt h ALA 297 CO 0.01 0.56 0.00 1.33 0.00 0.00 0.00 179.25 181.15 3ivt n VAL 298 N -4.12 0.68 -3.83 0.00 0.24 0.02 -4.65 118.33 106.66 3ivt n VAL 298 Ca -0.05 -0.70 -0.35 0.00 -2.04 0.00 0.00 64.34 61.21 3ivt n VAL 298 Cb 0.57 0.39 0.02 0.00 -1.47 0.00 0.00 33.84 33.36 3ivt n VAL 298 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 3ivt n GLU 299 N 1.05 -0.89 -4.38 7.34 1.02 -0.02 -4.77 120.64 119.98 3ivt n GLU 299 Ca 0.18 0.42 -0.19 0.00 -0.02 0.00 0.00 57.16 57.55 3ivt n GLU 299 Cb 0.45 -3.20 -0.10 0.00 -0.02 0.00 0.00 31.44 28.57 3ivt n GLU 299 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 3ivt s VAL 300 N -3.37 1.39 0.01 2.62 -7.23 -0.64 -5.04 120.40 108.13 3ivt s VAL 300 Ca 0.36 -2.09 -0.07 0.00 -1.81 0.00 0.00 61.98 58.38 3ivt s VAL 300 Cb -0.17 -2.39 -0.05 0.00 0.56 0.00 0.00 36.38 34.34 3ivt s VAL 300 CO 0.91 -0.33 0.27 -1.10 -0.31 0.00 0.00 175.10 174.54 3ivt s GLN 301 N -3.78 3.59 -0.06 4.82 -0.21 -1.26 -4.59 119.66 118.16 3ivt s GLN 301 Ca 0.29 -0.06 -0.29 0.00 0.02 0.00 0.00 55.36 55.31 3ivt s GLN 301 Cb 0.04 -3.08 -0.06 0.00 1.00 0.00 0.00 33.01 30.91 3ivt s GLN 301 CO 0.10 0.65 1.86 0.42 -2.12 0.00 0.00 175.29 176.20 3ivt s ILE 302 N -1.29 3.29 0.42 1.08 -1.09 -1.26 -4.96 121.20 117.38 3ivt s ILE 302 Ca 0.27 0.34 -0.24 0.00 -2.23 0.00 0.00 60.65 58.79 3ivt s ILE 302 Cb -0.13 -3.25 -0.11 0.00 -1.58 0.00 0.00 42.46 37.39 3ivt s ILE 302 CO 0.16 -0.06 0.91 -2.65 -1.23 0.00 0.00 174.94 172.06 3ivt n PRO 303 N 7.60 1.15 0.16 2.79 -0.02 -1.26 -4.83 135.00 140.59 3ivt n PRO 303 Ca 0.20 0.41 0.13 0.00 -2.02 0.00 0.00 63.50 62.23 3ivt n PRO 303 Cb 0.43 -1.91 0.66 0.00 -0.02 0.00 0.00 33.50 32.66 3ivt n PRO 303 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 3ivt h PHE 304 N 1.36 0.00 -0.46 6.00 -5.15 -1.94 -1.65 116.94 115.10 3ivt h PHE 304 Ca -0.43 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.34 3ivt h PHE 304 Cb 1.35 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.52 3ivt h PHE 304 CO 0.42 0.00 0.00 0.27 -2.00 0.00 0.00 178.31 177.00 3ivt n ASN 305 N -4.46 3.56 -4.57 -0.68 0.23 -1.26 -1.47 115.26 106.62 3ivt n ASN 305 Ca 0.02 -2.21 -0.49 0.00 -0.53 0.00 0.00 54.58 51.37 3ivt n ASN 305 Cb 0.29 -0.38 -0.04 0.00 -2.08 0.00 0.00 39.78 37.57 3ivt n ASN 305 CO 0.00 0.00 0.00 -3.20 -0.93 0.00 0.00 177.26 173.13 3ivt n ASN 306 N 0.69 1.13 -4.67 0.53 5.15 -0.62 -4.82 115.26 112.66 3ivt n ASN 306 Ca 0.18 1.15 -0.44 0.00 -0.60 0.00 0.00 54.58 54.86 3ivt n ASN 306 Cb 0.61 -1.19 -0.02 0.00 -0.53 0.00 0.00 39.78 38.64 3ivt n ASN 306 CO 0.00 0.00 0.00 -1.22 1.40 0.00 0.00 177.26 177.44 3ivt n TYR 307 N 1.30 2.15 0.00 1.20 4.01 -1.26 -0.64 117.16 123.92 3ivt n TYR 307 Ca 0.15 0.46 0.00 0.00 -0.16 0.00 0.00 57.90 58.35 3ivt n TYR 307 Cb 0.24 -2.45 0.00 0.00 -0.31 0.00 0.00 39.34 36.83 3ivt n TYR 307 CO 0.00 0.00 0.00 -0.89 -0.46 0.00 0.00 176.86 175.51 3ivt n ILE 308 N 1.66 0.00 0.97 -0.72 5.41 -1.26 -4.11 119.36 121.30 3ivt n ILE 308 Ca 0.11 0.00 0.11 0.00 1.00 0.00 0.00 62.75 63.97 3ivt n ILE 308 Cb 0.32 0.00 0.01 0.00 -0.71 0.00 0.00 39.64 39.26 3ivt n ILE 308 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 3ivt n THR 309 N 0.00 0.00 -1.89 1.39 -2.24 -1.21 -4.63 114.28 105.69 3ivt n THR 309 Ca 0.00 -0.31 -0.32 0.00 -2.27 0.00 0.00 64.05 61.15 3ivt n THR 309 Cb 0.00 1.30 0.02 0.00 -2.10 0.00 0.00 70.33 69.55 3ivt n THR 309 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 3ivt s GLY 310 N -2.34 2.00 0.35 3.38 0.00 0.18 -4.92 107.32 105.98 3ivt s GLY 310 Ca 0.20 0.32 0.14 0.00 0.00 0.00 0.00 44.72 45.38 3ivt s GLY 310 CO 0.51 0.64 1.70 -0.33 0.00 0.00 0.00 173.10 175.62 3ivt h MET 311 N 0.10 0.41 -0.06 2.90 2.86 -1.51 -2.21 114.93 117.40 3ivt h MET 311 Ca -0.46 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.16 3ivt h MET 311 Cb 1.22 -0.09 0.00 0.00 0.06 0.00 0.00 31.60 32.79 3ivt h MET 311 CO 0.57 0.27 0.00 0.00 1.06 0.00 0.00 176.91 178.81 3ivt h ALA 313 N 4.18 1.13 -1.57 0.00 0.00 -1.59 -2.81 119.26 118.60 3ivt h ALA 313 Ca 0.00 -0.07 -0.73 0.00 0.00 0.00 0.00 54.91 54.11 3ivt h ALA 313 Cb 0.89 -0.36 -0.32 0.00 0.00 0.00 0.00 17.79 18.00 3ivt h ALA 313 CO 0.00 0.55 0.46 1.19 0.00 0.00 0.00 179.25 181.44 3ivt n PHE 314 N -4.45 3.21 -5.02 0.00 3.72 -1.26 -4.94 117.46 108.72 3ivt n PHE 314 Ca 0.10 -3.02 -0.28 0.00 -0.05 0.00 0.00 57.45 54.20 3ivt n PHE 314 Cb 0.02 -0.94 -0.15 0.00 -0.94 0.00 0.00 39.48 37.47 3ivt n PHE 314 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 3ivt s THR 315 N -4.47 1.83 -0.03 4.37 -4.23 -1.06 -1.34 115.64 110.70 3ivt s THR 315 Ca 0.43 -1.07 0.07 0.00 -1.18 0.00 0.00 61.69 59.94 3ivt s THR 315 Cb 0.24 -1.54 -0.02 0.00 1.34 0.00 0.00 72.50 72.53 3ivt s THR 315 CO -0.15 0.44 -0.23 -1.00 -0.54 0.00 0.00 174.62 173.14 3ivt s HIS 316 N -0.62 2.43 0.04 3.99 3.76 -0.56 -4.93 115.29 119.41 3ivt s HIS 316 Ca 0.09 -0.40 -0.30 0.00 -0.15 0.00 0.00 55.06 54.30 3ivt s HIS 316 Cb -0.09 -1.54 -0.05 0.00 1.11 0.00 0.00 32.58 32.02 3ivt s HIS 316 CO -0.00 -0.00 1.08 0.21 -0.85 0.00 0.00 174.74 175.18 3ivt s LYS 317 N -0.60 4.52 0.02 1.40 2.47 -1.26 -1.15 119.74 125.14 3ivt s LYS 317 Ca 0.09 1.59 -0.00 0.00 -1.56 0.00 0.00 55.97 56.09 3ivt s LYS 317 Cb -0.10 -3.40 -0.04 0.00 -1.46 0.00 0.00 37.83 32.83 3ivt s LYS 317 CO -0.00 -0.11 0.12 0.00 0.16 0.00 0.00 175.35 175.52 3ivt s ALA 318 N 0.89 3.73 0.00 3.13 0.00 -0.40 -4.28 121.76 124.83 3ivt s ALA 318 Ca 0.54 -0.87 0.00 0.00 0.00 0.00 0.00 51.96 51.64 3ivt s ALA 318 Cb -0.25 -1.66 0.00 0.00 0.00 0.00 0.00 23.12 21.21 3ivt s ALA 318 CO 0.29 0.73 0.00 0.41 0.00 0.00 0.00 175.76 177.19 3ivt n GLY 319 N 0.88 0.52 0.37 0.00 0.00 -1.26 -4.37 105.19 101.32 3ivt n GLY 319 Ca -0.11 -2.25 0.16 0.00 0.00 0.00 0.00 46.02 43.82 3ivt n GLY 319 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 3ivt h ILE 320 N 0.00 0.81 0.00 -0.61 3.07 -2.00 -2.67 117.51 116.12 3ivt h ILE 320 Ca 0.00 -0.08 -0.04 0.00 1.55 0.00 0.00 64.86 66.29 3ivt h ILE 320 Cb 0.00 0.55 -0.01 0.00 -0.27 0.00 0.00 36.82 37.09 3ivt h ILE 320 CO 0.00 0.04 -0.41 0.45 -1.05 0.00 0.00 178.15 177.18 3ivt h HIS 321 N 0.24 0.00 0.00 0.16 3.86 -1.93 -3.12 115.15 114.36 3ivt h HIS 321 Ca 0.28 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.49 3ivt h HIS 321 Cb 0.77 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.24 3ivt h HIS 321 CO -0.00 0.17 -0.00 0.00 0.86 0.00 0.00 177.93 178.96 3ivt h ALA 322 N 1.83 1.94 0.00 2.45 0.00 -1.65 -3.00 119.26 120.83 3ivt h ALA 322 Ca -0.01 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3ivt h ALA 322 Cb 1.14 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.93 3ivt h ALA 322 CO 0.02 0.00 0.00 0.36 0.00 0.00 0.00 179.25 179.63 3ivt n LYS 323 N -4.45 0.29 -0.01 0.00 2.85 -1.18 -2.88 118.16 112.78 3ivt n LYS 323 Ca -0.03 0.08 -0.18 0.00 -1.05 0.00 0.00 58.31 57.13 3ivt n LYS 323 Cb 0.09 -1.50 -0.09 0.00 -0.65 0.00 0.00 35.03 32.88 3ivt n LYS 323 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 3ivt h ALA 324 N 2.69 0.21 -2.52 0.58 0.00 -1.74 -3.42 119.26 115.05 3ivt h ALA 324 Ca 0.00 -0.59 -0.49 0.00 0.00 0.00 0.00 54.91 53.83 3ivt h ALA 324 Cb 0.05 0.01 0.04 0.00 0.00 0.00 0.00 17.79 17.89 3ivt h ALA 324 CO 0.00 0.56 0.43 0.42 0.00 0.00 0.00 179.25 180.65 3ivt s ILE 325 N -3.57 3.48 -0.12 0.00 1.01 -1.14 -5.02 121.20 115.84 3ivt s ILE 325 Ca -0.11 1.04 0.01 0.00 0.00 0.00 0.00 60.65 61.58 3ivt s ILE 325 Cb 0.07 -3.49 -0.24 0.00 0.01 0.00 0.00 42.46 38.81 3ivt s ILE 325 CO 0.88 -0.09 0.36 0.18 0.00 0.00 0.00 174.94 176.27 3ivt n LEU 326 N -0.61 2.07 -4.90 2.97 4.32 -1.26 -4.92 117.00 114.67 3ivt n LEU 326 Ca 0.08 0.21 -0.28 0.00 -0.02 0.00 0.00 56.01 55.99 3ivt n LEU 326 Cb 0.50 -0.67 0.06 0.00 -1.62 0.00 0.00 43.42 41.69 3ivt n LEU 326 CO 0.44 0.72 0.70 0.00 -1.22 0.00 0.00 177.39 178.03 3ivt s ALA 327 N -2.56 2.96 0.15 -1.18 0.00 -1.26 -5.01 121.76 114.86 3ivt s ALA 327 Ca -0.19 -0.58 -0.34 0.00 0.00 0.00 0.00 51.96 50.86 3ivt s ALA 327 Cb 0.07 -2.86 -0.13 0.00 0.00 0.00 0.00 23.12 20.20 3ivt s ALA 327 CO 0.77 -1.23 1.62 0.09 0.00 0.00 0.00 175.76 177.01 3ivt n ASN 328 N -2.99 3.26 0.06 0.00 3.02 -1.26 -4.86 115.26 112.49 3ivt n ASN 328 Ca 0.07 1.07 0.21 0.00 -0.03 0.00 0.00 54.58 55.90 3ivt n ASN 328 Cb 0.59 -1.45 0.70 0.00 -0.61 0.00 0.00 39.78 39.01 3ivt n ASN 328 CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 3ivt h PRO 329 N 6.32 0.00 0.00 3.52 0.11 -1.93 0.29 132.00 140.31 3ivt h PRO 329 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 3ivt h PRO 329 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 3ivt h PRO 329 CO 0.90 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 177.56 3ivt n SER 330 N -3.58 0.30 0.21 -2.05 3.41 -1.26 -2.43 113.62 108.23 3ivt n SER 330 Ca 0.09 0.56 0.05 0.00 -0.26 0.00 0.00 58.87 59.32 3ivt n SER 330 Cb 0.76 -0.63 0.48 0.00 -0.26 0.00 0.00 64.21 64.55 3ivt n SER 330 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 3ivt h THR 331 N 0.00 1.08 -3.22 6.66 2.02 -1.29 -3.35 112.91 114.81 3ivt h THR 331 Ca 0.00 -0.90 -0.76 0.00 0.77 0.00 0.00 66.41 65.51 3ivt h THR 331 Cb 0.36 1.50 -0.31 0.00 -1.74 0.00 0.00 68.15 67.95 3ivt h THR 331 CO 0.00 0.25 0.32 -1.22 0.37 0.00 0.00 175.52 175.24 3ivt n TYR 332 N -4.09 4.07 -3.15 3.16 4.01 -1.02 -4.82 117.16 115.32 3ivt n TYR 332 Ca -0.02 -3.63 -0.21 0.00 -0.16 0.00 0.00 57.90 53.88 3ivt n TYR 332 Cb 0.32 -1.35 -0.04 0.00 -0.31 0.00 0.00 39.34 37.96 3ivt n TYR 332 CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 3ivt n GLU 333 N 2.07 1.46 -0.23 -0.72 1.02 -1.26 -4.96 120.64 118.01 3ivt n GLU 333 Ca 0.24 -3.71 0.25 0.00 -0.02 0.00 0.00 57.16 53.92 3ivt n GLU 333 Cb 0.37 -1.78 0.62 0.00 -0.02 0.00 0.00 31.44 30.63 3ivt n GLU 333 CO 0.00 0.00 0.00 0.97 1.18 0.00 0.00 177.13 179.28 3ivt h ILE 334 N 1.59 0.58 -3.44 -3.67 6.09 -1.95 -3.37 117.51 113.33 3ivt h ILE 334 Ca 0.11 -0.07 -0.63 0.00 -1.37 0.00 0.00 64.86 62.90 3ivt h ILE 334 Cb 0.85 0.36 -0.17 0.00 0.47 0.00 0.00 36.82 38.33 3ivt h ILE 334 CO 0.57 0.04 -0.57 -0.76 -3.07 0.00 0.00 178.15 174.36 3ivt s LEU 335 N -8.99 3.76 -0.27 2.19 1.43 -1.26 -4.87 118.68 110.68 3ivt s LEU 335 Ca -0.07 0.01 -0.22 0.00 -1.03 0.00 0.00 54.13 52.82 3ivt s LEU 335 Cb 0.23 -1.98 -0.01 0.00 0.03 0.00 0.00 46.19 44.46 3ivt s LEU 335 CO 0.78 0.10 0.70 -0.54 0.23 0.00 0.00 176.35 177.63 3ivt s LYS 336 N 0.82 4.07 0.50 1.70 -0.14 -1.26 -4.96 119.74 120.47 3ivt s LYS 336 Ca 0.04 0.61 0.20 0.00 -1.36 0.00 0.00 55.97 55.46 3ivt s LYS 336 Cb -0.13 -3.68 1.27 0.00 -1.68 0.00 0.00 37.83 33.61 3ivt s LYS 336 CO 0.02 -0.51 2.03 -1.00 -0.76 0.00 0.00 175.35 175.13 3ivt h PRO 337 N 7.93 0.10 0.00 -1.68 0.13 -1.93 -0.23 132.00 136.33 3ivt h PRO 337 Ca -0.25 -0.01 -0.06 0.00 -0.87 0.00 0.00 66.00 64.81 3ivt h PRO 337 Cb 1.11 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 32.21 3ivt h PRO 337 CO 0.82 0.07 -0.29 0.93 -0.23 0.00 0.00 178.00 179.30 3ivt h GLU 338 N 0.11 0.00 0.00 0.86 3.07 -1.82 0.23 114.58 117.03 3ivt h GLU 338 Ca 0.20 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.06 3ivt h GLU 338 Cb 0.64 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.55 3ivt h GLU 338 CO -0.02 0.29 0.00 -0.25 -1.40 0.00 0.00 179.01 177.63 3ivt n ASP 339 N -3.72 0.63 -0.15 1.42 8.00 -0.10 -2.83 116.55 119.81 3ivt n ASP 339 Ca -0.01 0.62 0.08 0.00 0.71 0.00 0.00 54.79 56.18 3ivt n ASP 339 Cb 0.39 -0.77 0.12 0.00 -0.02 0.00 0.00 41.12 40.85 3ivt n ASP 339 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3ivt n PHE 340 N -2.16 0.10 -0.47 1.24 3.72 -0.82 -4.35 117.46 114.73 3ivt n PHE 340 Ca 0.04 -0.87 0.00 0.00 -0.05 0.00 0.00 57.45 56.57 3ivt n PHE 340 Cb 0.30 -0.14 0.00 0.00 -0.94 0.00 0.00 39.48 38.70 3ivt n PHE 340 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3ivt n GLY 341 N -1.09 0.86 3.95 1.37 0.00 -1.03 -4.38 105.19 104.86 3ivt n GLY 341 Ca 0.13 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.92 3ivt n GLY 341 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3ivt s MET 342 N -0.46 3.47 -0.07 1.61 -1.94 0.74 -4.52 119.30 118.13 3ivt s MET 342 Ca 0.00 -0.47 0.07 0.00 -1.71 0.00 0.00 55.69 53.58 3ivt s MET 342 Cb 0.00 -2.75 -0.24 0.00 2.01 0.00 0.00 34.83 33.85 3ivt s MET 342 CO 0.00 0.26 0.57 -1.13 -0.01 0.00 0.00 175.02 174.71 3ivt n SER 343 N -1.58 1.22 -3.68 3.03 3.41 -0.19 -2.72 113.62 113.12 3ivt n SER 343 Ca -0.06 0.35 -0.03 0.00 -0.26 0.00 0.00 58.87 58.87 3ivt n SER 343 Cb 0.56 -0.28 -0.01 0.00 -0.26 0.00 0.00 64.21 64.22 3ivt n SER 343 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3ivt s ARG 344 N -2.59 0.94 0.22 4.33 1.70 -1.26 -4.78 118.95 117.52 3ivt s ARG 344 Ca -0.10 -0.49 -0.30 0.00 -0.47 0.00 0.00 55.73 54.37 3ivt s ARG 344 Cb 0.08 0.34 -0.09 0.00 -0.57 0.00 0.00 34.95 34.71 3ivt s ARG 344 CO 0.81 -0.43 1.06 0.71 -1.08 0.00 0.00 175.30 176.37 3ivt s TYR 345 N -3.06 3.67 -0.19 5.89 1.51 -1.26 -4.94 117.35 118.97 3ivt s TYR 345 Ca 0.11 1.71 -0.14 0.00 -1.01 0.00 0.00 57.07 57.74 3ivt s TYR 345 Cb -0.00 -3.21 -0.04 0.00 -0.11 0.00 0.00 41.96 38.59 3ivt s TYR 345 CO -0.01 -0.34 0.31 0.08 -1.11 0.00 0.00 175.55 174.47 3ivt s VAL 346 N -0.75 5.28 -0.44 0.71 1.01 -0.45 -4.94 120.40 120.82 3ivt s VAL 346 Ca 0.46 0.54 -0.19 0.00 0.00 0.00 0.00 61.98 62.79 3ivt s VAL 346 Cb -0.29 -3.64 0.03 0.00 0.00 0.00 0.00 36.38 32.47 3ivt s VAL 346 CO 0.36 0.34 0.52 -1.00 0.00 0.00 0.00 175.10 175.32 3ivt s HIS 347 N 0.84 3.12 -0.31 5.22 3.76 -1.26 -1.49 115.29 125.18 3ivt s HIS 347 Ca 0.16 -0.32 -0.12 0.00 -0.15 0.00 0.00 55.06 54.63 3ivt s HIS 347 Cb -0.14 -3.12 -0.04 0.00 1.11 0.00 0.00 32.58 30.40 3ivt s HIS 347 CO 0.05 -0.80 0.22 0.08 -0.85 0.00 0.00 174.74 173.44 3ivt s VAL 348 N 2.39 5.30 0.00 -0.90 1.01 -0.30 -4.78 120.40 123.12 3ivt s VAL 348 Ca 0.15 0.02 0.00 0.00 0.00 0.00 0.00 61.98 62.15 3ivt s VAL 348 Cb -0.17 -3.61 0.00 0.00 0.00 0.00 0.00 36.38 32.60 3ivt s VAL 348 CO 0.15 0.14 0.00 0.61 0.00 0.00 0.00 175.10 175.99 3ivt n GLY 349 N 5.07 -0.25 3.78 4.51 0.00 -1.26 -1.28 105.19 115.76 3ivt n GLY 349 Ca -0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.58 3ivt n GLY 349 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3ivt s SER 350 N -0.74 4.76 0.02 1.61 0.01 -1.26 -4.92 113.70 113.17 3ivt s SER 350 Ca 0.00 1.80 -0.20 0.00 1.31 0.00 0.00 55.95 58.86 3ivt s SER 350 Cb 0.00 -2.52 -0.06 0.00 0.21 0.00 0.00 66.02 63.65 3ivt s SER 350 CO 0.00 -1.86 0.59 0.00 0.41 0.00 0.00 173.24 172.38 3ivt s ARG 351 N -4.84 4.30 -0.30 12.44 1.70 -1.26 -5.04 118.95 125.95 3ivt s ARG 351 Ca 0.61 0.74 -0.19 0.00 -0.47 0.00 0.00 55.73 56.43 3ivt s ARG 351 Cb -0.17 -3.32 -0.01 0.00 -0.57 0.00 0.00 34.95 30.88 3ivt s ARG 351 CO 0.54 0.43 0.56 -0.51 -1.08 0.00 0.00 175.30 175.24 3ivt s LEU 352 N -0.41 4.15 0.51 -1.89 1.43 -1.26 -5.06 118.68 116.15 3ivt s LEU 352 Ca 0.31 0.38 -0.15 0.00 -1.03 0.00 0.00 54.13 53.64 3ivt s LEU 352 Cb -0.19 -2.71 -0.07 0.00 0.03 0.00 0.00 46.19 43.25 3ivt s LEU 352 CO 0.18 -0.41 0.96 0.42 0.23 0.00 0.00 176.35 177.73 3ivt s THR 353 N 2.46 4.59 0.00 5.49 -4.23 -1.26 -4.23 115.64 118.46 3ivt s THR 353 Ca 0.22 1.09 0.00 0.00 -1.18 0.00 0.00 61.69 61.82 3ivt s THR 353 Cb -0.15 -3.74 0.00 0.00 1.34 0.00 0.00 72.50 69.95 3ivt s THR 353 CO 0.11 -0.73 0.00 0.61 -0.54 0.00 0.00 174.62 174.07 3ivt n GLY 354 N -1.70 2.92 0.29 3.99 0.00 -1.26 -2.56 105.19 106.87 3ivt n GLY 354 Ca 0.06 -0.24 0.03 0.00 0.00 0.00 0.00 46.02 45.87 3ivt n GLY 354 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 3ivt h TRP 355 N 0.00 0.44 -0.92 1.61 7.01 -1.94 -1.15 115.95 121.01 3ivt h TRP 355 Ca 0.00 -0.01 0.16 0.00 2.11 0.00 0.00 58.89 61.15 3ivt h TRP 355 Cb 0.00 -0.14 -0.10 0.00 -2.10 0.00 0.00 29.16 26.82 3ivt h TRP 355 CO 0.00 0.34 0.51 -0.91 -2.79 0.00 0.00 178.44 175.60 3ivt h ASN 356 N 0.46 0.65 -0.42 2.65 2.35 -1.85 -0.05 115.58 119.37 3ivt h ASN 356 Ca 0.12 0.09 -0.05 0.00 -0.55 0.00 0.00 56.30 55.90 3ivt h ASN 356 Cb 0.07 -0.02 -0.02 0.00 0.05 0.00 0.00 38.32 38.40 3ivt h ASN 356 CO -0.01 0.27 0.07 0.00 -1.65 0.00 0.00 177.43 176.10 3ivt h ALA 357 N 1.58 0.56 0.26 -0.83 0.00 -1.11 -2.66 119.26 117.06 3ivt h ALA 357 Ca 0.50 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 55.18 3ivt h ALA 357 Cb 0.71 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.34 3ivt h ALA 357 CO -0.36 0.28 -0.15 0.82 0.00 0.00 0.00 179.25 179.85 3ivt h ILE 358 N 0.56 0.70 -0.44 0.00 1.08 -1.05 -2.73 117.51 115.62 3ivt h ILE 358 Ca 0.13 0.00 0.09 0.00 -0.39 0.00 0.00 64.86 64.68 3ivt h ILE 358 Cb 0.38 0.70 -0.08 0.00 -3.07 0.00 0.00 36.82 34.75 3ivt h ILE 358 CO 0.01 0.00 -0.05 0.50 -0.69 0.00 0.00 178.15 177.92 3ivt h LYS 359 N -0.38 0.05 0.49 2.37 3.64 -1.04 0.25 116.57 121.96 3ivt h LYS 359 Ca -0.03 -0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.33 3ivt h LYS 359 Cb 0.31 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.11 3ivt h LYS 359 CO 0.04 0.03 -0.35 1.03 -2.27 0.00 0.00 179.45 177.93 3ivt h SER 360 N 0.05 -0.91 -0.34 4.20 0.87 -1.48 0.72 113.55 116.66 3ivt h SER 360 Ca 0.21 0.06 -0.09 0.00 -1.23 0.00 0.00 61.79 60.74 3ivt h SER 360 Cb 0.32 0.28 -0.02 0.00 -0.44 0.00 0.00 62.40 62.55 3ivt h SER 360 CO -0.41 -0.53 -0.12 -0.09 -0.53 0.00 0.00 176.83 175.16 3ivt h ARG 361 N -0.82 0.78 -0.63 2.24 9.65 -1.14 -0.15 114.38 124.30 3ivt h ARG 361 Ca -0.05 -0.26 -0.07 0.00 -1.10 0.00 0.00 59.98 58.49 3ivt h ARG 361 Cb 0.69 -0.06 -0.02 0.00 -1.39 0.00 0.00 29.97 29.19 3ivt h ARG 361 CO 0.02 0.86 0.10 0.00 2.80 0.00 0.00 179.97 183.76 3ivt h ALA 362 N 1.17 0.83 -0.67 2.80 0.00 -0.42 0.56 119.26 123.52 3ivt h ALA 362 Ca 0.12 -0.26 -0.08 0.00 0.00 0.00 0.00 54.91 54.68 3ivt h ALA 362 Cb 0.60 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.12 3ivt h ALA 362 CO 0.04 0.59 0.10 0.93 0.00 0.00 0.00 179.25 180.91 3ivt h GLU 363 N 0.95 1.12 -0.79 0.00 5.08 -0.41 -1.83 114.58 118.70 3ivt h GLU 363 Ca 0.19 -0.31 -0.03 0.00 -1.00 0.00 0.00 59.36 58.22 3ivt h GLU 363 Cb 0.43 -0.13 -0.04 0.00 0.50 0.00 0.00 28.75 29.51 3ivt h GLU 363 CO 0.01 1.03 0.38 0.37 -1.00 0.00 0.00 179.01 179.80 3ivt h GLN 364 N 1.04 1.14 -0.00 2.33 4.15 -0.48 -2.39 115.11 120.90 3ivt h GLN 364 Ca 0.20 -0.17 0.00 0.00 0.77 0.00 0.00 58.65 59.46 3ivt h GLN 364 Cb 0.46 -0.21 0.00 0.00 0.21 0.00 0.00 27.48 27.94 3ivt h GLN 364 CO 0.01 0.88 -0.01 1.28 -1.93 0.00 0.00 178.83 179.07 3ivt n LEU 365 N -4.31 0.15 -1.81 -2.39 4.77 0.14 -1.02 117.00 112.53 3ivt n LEU 365 Ca 0.08 -0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 55.91 3ivt n LEU 365 Cb 0.14 -0.05 0.01 0.00 -2.33 0.00 0.00 43.42 41.19 3ivt n LEU 365 CO 0.39 0.03 -0.10 0.59 -1.33 0.00 0.00 177.39 176.97 3ivt n ASN 366 N -0.94 -4.42 -4.47 -1.43 4.13 -0.81 -4.70 115.26 102.62 3ivt n ASN 366 Ca 0.22 -0.09 -0.43 0.00 1.68 0.00 0.00 54.58 55.95 3ivt n ASN 366 Cb 0.16 -3.45 -0.05 0.00 -1.54 0.00 0.00 39.78 34.89 3ivt n ASN 366 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 3ivt s LEU 367 N -4.26 4.62 -0.82 3.41 1.43 -0.75 -4.38 118.68 117.93 3ivt s LEU 367 Ca 0.09 -0.70 -0.23 0.00 -1.03 0.00 0.00 54.13 52.26 3ivt s LEU 367 Cb -0.04 -2.59 0.06 0.00 0.03 0.00 0.00 46.19 43.65 3ivt s LEU 367 CO 0.11 -1.04 1.20 -1.00 0.23 0.00 0.00 176.35 175.85 3ivt s HIS 368 N 3.18 2.60 0.29 0.29 3.76 -1.26 -4.64 115.29 119.52 3ivt s HIS 368 Ca 0.21 -0.62 -0.18 0.00 -0.15 0.00 0.00 55.06 54.32 3ivt s HIS 368 Cb -0.17 -4.49 -0.09 0.00 1.11 0.00 0.00 32.58 28.95 3ivt s HIS 368 CO 0.15 -1.82 0.76 -0.51 -0.85 0.00 0.00 174.74 172.47 3ivt s LEU 369 N 4.53 4.19 0.76 0.89 1.43 -1.26 -5.08 118.68 124.14 3ivt s LEU 369 Ca 0.33 1.41 -0.11 0.00 -1.03 0.00 0.00 54.13 54.73 3ivt s LEU 369 Cb -0.08 -3.90 0.05 0.00 0.03 0.00 0.00 46.19 42.29 3ivt s LEU 369 CO 0.03 -0.10 1.08 -0.89 0.23 0.00 0.00 176.35 176.70 3ivt s THR 370 N -1.77 3.45 0.24 5.49 2.01 -1.26 -4.90 115.64 118.90 3ivt s THR 370 Ca 0.50 0.47 -0.05 0.00 0.31 0.00 0.00 61.69 62.92 3ivt s THR 370 Cb -0.13 -3.21 0.21 0.00 0.01 0.00 0.00 72.50 69.37 3ivt s THR 370 CO 0.19 -0.62 1.83 -2.24 -0.69 0.00 0.00 174.62 173.09 3ivt h ASP 371 N -0.95 0.73 -0.67 3.53 3.04 -1.99 -1.40 116.42 118.72 3ivt h ASP 371 Ca -0.46 0.03 -0.05 0.00 -3.24 0.00 0.00 57.03 53.31 3ivt h ASP 371 Cb 1.24 -0.11 -0.03 0.00 -1.04 0.00 0.00 39.33 39.39 3ivt h ASP 371 CO 0.58 0.44 0.21 0.00 -2.04 0.00 0.00 179.24 178.43 3ivt h ALA 372 N 1.43 1.08 -0.08 4.15 0.00 -2.01 -2.86 119.26 120.97 3ivt h ALA 372 Ca 0.38 -0.22 -0.23 0.00 0.00 0.00 0.00 54.91 54.85 3ivt h ALA 372 Cb 0.27 -0.27 0.01 0.00 0.00 0.00 0.00 17.79 17.80 3ivt h ALA 372 CO -0.21 0.63 -0.86 1.96 0.00 0.00 0.00 179.25 180.76 3ivt h GLN 373 N 1.02 0.64 -0.72 0.00 4.20 -1.90 -2.69 115.11 115.66 3ivt h GLN 373 Ca 0.22 -0.58 0.14 0.00 0.06 0.00 0.00 58.65 58.49 3ivt h GLN 373 Cb 0.29 0.14 -0.10 0.00 0.30 0.00 0.00 27.48 28.11 3ivt h GLN 373 CO -0.01 1.20 0.23 0.00 -0.67 0.00 0.00 178.83 179.58 3ivt h ALA 374 N 0.62 0.96 0.04 3.87 0.00 -1.15 -1.61 119.26 122.00 3ivt h ALA 374 Ca -0.07 0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 3ivt h ALA 374 Cb 1.49 0.15 0.00 0.00 0.00 0.00 0.00 17.79 19.43 3ivt h ALA 374 CO 0.17 -0.27 -0.02 1.57 0.00 0.00 0.00 179.25 180.69 3ivt h LYS 375 N 0.35 -0.05 -0.67 0.00 -0.00 -1.46 -1.57 116.57 113.17 3ivt h LYS 375 Ca 0.40 0.00 0.14 0.00 -0.00 0.00 0.00 60.65 61.20 3ivt h LYS 375 Cb 0.63 0.01 -0.12 0.00 -0.00 0.00 0.00 32.23 32.76 3ivt h LYS 375 CO -0.44 0.41 -0.01 1.05 -0.00 0.00 0.00 179.45 180.46 3ivt h GLU 376 N -0.53 0.10 -0.16 0.07 -0.00 -1.30 0.65 114.58 113.41 3ivt h GLU 376 Ca -0.01 -0.01 -0.00 0.00 -0.00 0.00 0.00 59.36 59.35 3ivt h GLU 376 Cb 0.48 -0.02 -0.01 0.00 -0.00 0.00 0.00 28.75 29.20 3ivt h GLU 376 CO 0.01 0.07 0.09 -0.07 -0.00 0.00 0.00 179.01 179.11 3ivt h LEU 377 N 0.11 0.20 -0.48 3.06 3.38 -1.25 -0.61 115.31 119.71 3ivt h LEU 377 Ca 0.35 -0.07 0.02 0.00 0.09 0.00 0.00 57.88 58.28 3ivt h LEU 377 Cb 0.59 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.26 3ivt h LEU 377 CO -0.59 0.21 0.29 0.74 0.09 0.00 0.00 178.44 179.18 3ivt h THR 378 N 0.17 1.05 -0.60 0.22 2.02 -0.61 0.50 112.91 115.66 3ivt h THR 378 Ca 0.06 -0.20 0.03 0.00 0.77 0.00 0.00 66.41 67.07 3ivt h THR 378 Cb 0.05 0.42 -0.04 0.00 -1.74 0.00 0.00 68.15 66.85 3ivt h THR 378 CO -0.01 0.11 0.37 -0.37 0.37 0.00 0.00 175.52 175.98 3ivt h VAL 379 N 0.58 1.08 -0.45 3.16 -1.51 -0.75 -1.97 116.25 116.38 3ivt h VAL 379 Ca 0.19 -0.25 -0.11 0.00 -1.23 0.00 0.00 66.70 65.31 3ivt h VAL 379 Cb 0.02 0.28 -0.02 0.00 -2.13 0.00 0.00 31.29 29.44 3ivt h VAL 379 CO -0.09 0.13 -0.14 0.08 -1.23 0.00 0.00 177.57 176.32 3ivt h ARG 380 N 0.73 0.84 -0.14 5.19 0.11 -0.29 -1.90 114.38 118.93 3ivt h ARG 380 Ca 0.24 -0.31 -0.13 0.00 0.10 0.00 0.00 59.98 59.88 3ivt h ARG 380 Cb 0.02 -0.06 -0.01 0.00 1.11 0.00 0.00 29.97 31.03 3ivt h ARG 380 CO -0.10 0.93 -0.49 -0.84 0.10 0.00 0.00 179.97 179.58 3ivt h ILE 381 N 0.75 1.33 0.25 0.08 -0.00 -0.76 -1.85 117.51 117.31 3ivt h ILE 381 Ca 0.12 -1.71 -0.01 0.00 -0.00 0.00 0.00 64.86 63.26 3ivt h ILE 381 Cb 0.66 1.76 -0.01 0.00 -0.00 0.00 0.00 36.82 39.23 3ivt h ILE 381 CO 0.05 0.52 -0.17 0.11 -0.00 0.00 0.00 178.15 178.66 3ivt h LYS 382 N 0.28 -0.40 0.00 0.16 1.79 -1.21 -0.69 116.57 116.50 3ivt h LYS 382 Ca 0.01 0.03 -0.00 0.00 -2.18 0.00 0.00 60.65 58.51 3ivt h LYS 382 Cb 0.96 0.09 -0.00 0.00 -1.58 0.00 0.00 32.23 31.70 3ivt h LYS 382 CO 0.08 -0.27 -0.02 1.57 -1.08 0.00 0.00 179.45 179.74 3ivt h LYS 383 N -0.41 0.00 0.21 3.15 -0.00 -1.17 0.61 116.57 118.95 3ivt h LYS 383 Ca -0.02 0.00 -0.28 0.00 -0.00 0.00 0.00 60.65 60.35 3ivt h LYS 383 Cb 0.35 0.00 0.03 0.00 -0.00 0.00 0.00 32.23 32.61 3ivt h LYS 383 CO 0.02 0.02 -1.26 1.25 -0.00 0.00 0.00 179.45 179.48 3ivt h LEU 384 N 0.00 0.69 -0.94 7.07 5.85 -1.04 -3.34 115.31 123.60 3ivt h LEU 384 Ca -0.00 -0.93 -0.11 0.00 0.84 0.00 0.00 57.88 57.68 3ivt h LEU 384 Cb 0.09 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 40.88 3ivt h LEU 384 CO 0.00 1.60 -0.52 0.00 -0.34 0.00 0.00 178.44 179.19 3ivt h ALA 385 N 0.11 1.11 -0.17 1.25 0.00 -0.08 -2.29 119.26 119.19 3ivt h ALA 385 Ca -0.22 -0.47 0.05 0.00 0.00 0.00 0.00 54.91 54.26 3ivt h ALA 385 Cb 1.97 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.67 3ivt h ALA 385 CO 0.22 0.65 0.19 0.38 0.00 0.00 0.00 179.25 180.69 3ivt h ASP 386 N 0.00 0.00 0.00 0.00 -0.00 -1.04 -3.12 116.42 112.26 3ivt h ASP 386 Ca -0.01 0.00 -0.06 0.00 -0.00 0.00 0.00 57.03 56.96 3ivt h ASP 386 Cb 0.94 0.00 -0.01 0.00 -0.00 0.00 0.00 39.33 40.26 3ivt h ASP 386 CO 0.07 0.00 -0.52 0.58 -0.00 0.00 0.00 179.24 179.37 3ivt h VAL 387 N 0.00 0.50 -3.55 4.15 2.07 -1.54 -3.50 116.25 114.38 3ivt h VAL 387 Ca 0.08 -1.51 -0.04 0.00 0.82 0.00 0.00 66.70 66.05 3ivt h VAL 387 Cb 0.46 1.08 -0.09 0.00 -1.52 0.00 0.00 31.29 31.22 3ivt h VAL 387 CO -0.00 0.17 -0.07 0.00 0.02 0.00 0.00 177.57 177.69 3ivt s ARG 388 N -2.12 1.57 0.25 1.57 3.03 -1.11 -5.14 118.95 117.00 3ivt s ARG 388 Ca -0.16 -1.21 -0.29 0.00 2.03 0.00 0.00 55.73 56.11 3ivt s ARG 388 Cb 0.02 0.49 -0.15 0.00 -1.03 0.00 0.00 34.95 34.28 3ivt s ARG 388 CO 0.34 -0.67 0.93 2.41 -1.13 0.00 0.00 175.30 177.18 3ivt n THR 389 N -0.39 1.81 -1.15 4.99 -1.04 -1.26 -4.11 114.28 113.13 3ivt n THR 389 Ca -0.02 -0.45 -0.31 0.00 -2.04 0.00 0.00 64.05 61.22 3ivt n THR 389 Cb 0.61 -0.76 0.11 0.00 -1.82 0.00 0.00 70.33 68.48 3ivt n THR 389 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 3ivt s LEU 390 N 1.01 3.01 0.02 -4.42 1.43 -1.26 -4.98 118.68 113.49 3ivt s LEU 390 Ca 0.62 1.93 0.05 0.00 -1.03 0.00 0.00 54.13 55.70 3ivt s LEU 390 Cb -0.78 -4.53 -0.02 0.00 0.03 0.00 0.00 46.19 40.89 3ivt s LEU 390 CO 0.58 -2.28 -0.16 0.00 0.23 0.00 0.00 176.35 174.72 3ivt s ALA 391 N -2.80 1.30 0.43 4.21 0.00 -1.26 -5.01 121.76 118.63 3ivt s ALA 391 Ca 0.63 -0.79 0.34 0.00 0.00 0.00 0.00 51.96 52.13 3ivt s ALA 391 Cb -0.19 -0.26 1.42 0.00 0.00 0.00 0.00 23.12 24.09 3ivt s ALA 391 CO 0.56 0.28 1.43 -0.12 0.00 0.00 0.00 175.76 177.91 3ivt n MET 392 N 2.20 -0.02 0.04 0.00 1.56 -1.26 0.78 117.12 120.41 3ivt n MET 392 Ca -0.16 1.11 -0.01 0.00 -0.27 0.00 0.00 57.70 58.37 3ivt n MET 392 Cb 0.55 -2.27 0.29 0.00 2.15 0.00 0.00 33.22 33.93 3ivt n MET 392 CO 0.00 0.00 0.00 -0.44 -0.73 0.00 0.00 175.97 174.80 3ivt h ASP 393 N 0.00 0.41 -0.12 6.12 5.19 -1.94 -3.07 116.42 123.01 3ivt h ASP 393 Ca 0.82 -0.10 -0.03 0.00 -0.62 0.00 0.00 57.03 57.10 3ivt h ASP 393 Cb 2.81 -0.11 -0.01 0.00 0.18 0.00 0.00 39.33 42.20 3ivt h ASP 393 CO -0.32 0.57 0.01 0.44 -3.12 0.00 0.00 179.24 176.82 3ivt h ASP 394 N 0.40 0.28 -0.29 6.45 3.32 -0.04 -2.03 116.42 124.52 3ivt h ASP 394 Ca 0.08 -0.03 -0.01 0.00 0.02 0.00 0.00 57.03 57.08 3ivt h ASP 394 Cb 0.46 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.93 3ivt h ASP 394 CO 0.03 0.33 0.14 0.58 -1.72 0.00 0.00 179.24 178.60 3ivt h VAL 395 N 0.30 1.15 -0.11 -1.35 2.07 -1.62 -0.98 116.25 115.71 3ivt h VAL 395 Ca 0.07 -0.41 -0.08 0.00 0.82 0.00 0.00 66.70 67.10 3ivt h VAL 395 Cb 0.19 0.89 -0.01 0.00 -1.52 0.00 0.00 31.29 30.84 3ivt h VAL 395 CO 0.00 0.15 -0.30 0.44 0.02 0.00 0.00 177.57 177.88 3ivt h ASP 396 N 0.34 0.21 0.11 0.57 3.32 -1.65 -2.93 116.42 116.39 3ivt h ASP 396 Ca 0.10 -0.07 -0.01 0.00 0.02 0.00 0.00 57.03 57.07 3ivt h ASP 396 Cb 0.11 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.60 3ivt h ASP 396 CO -0.01 0.52 -0.05 -0.09 -1.72 0.00 0.00 179.24 177.88 3ivt h ARG 397 N 0.19 -0.14 0.00 3.56 9.65 -0.81 -2.57 114.38 124.26 3ivt h ARG 397 Ca 0.03 0.01 -0.01 0.00 -1.10 0.00 0.00 59.98 58.91 3ivt h ARG 397 Cb 0.64 0.03 -0.00 0.00 -1.39 0.00 0.00 29.97 29.25 3ivt h ARG 397 CO 0.05 0.21 -0.05 -0.39 2.80 0.00 0.00 179.97 182.59 3ivt h VAL 398 N -0.52 0.52 -0.01 0.20 -1.51 -1.23 -1.47 116.25 112.24 3ivt h VAL 398 Ca -0.02 -0.21 0.00 0.00 -1.23 0.00 0.00 66.70 65.25 3ivt h VAL 398 Cb 0.42 1.14 0.00 0.00 -2.13 0.00 0.00 31.29 30.71 3ivt h VAL 398 CO 0.03 0.05 -0.05 0.18 -1.23 0.00 0.00 177.57 176.55 3ivt n LEU 399 N -3.74 1.30 -0.30 4.19 4.77 -1.11 -4.43 117.00 117.68 3ivt n LEU 399 Ca -0.03 -0.41 0.10 0.00 -0.03 0.00 0.00 56.01 55.64 3ivt n LEU 399 Cb 0.14 -0.03 0.33 0.00 -2.33 0.00 0.00 43.42 41.54 3ivt n LEU 399 CO 0.28 0.22 1.22 -0.09 -1.33 0.00 0.00 177.39 177.70 3ivt h ARG 400 N 1.97 0.77 -0.08 3.23 2.43 -0.84 -1.72 114.38 120.14 3ivt h ARG 400 Ca 0.00 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 3ivt h ARG 400 Cb 0.47 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.84 3ivt h ARG 400 CO 0.00 0.51 0.00 0.39 -1.51 0.00 0.00 179.97 179.36 3ivt n GLU 401 N -4.58 1.22 -4.46 0.20 1.02 -1.26 -4.83 120.64 107.95 3ivt n GLU 401 Ca 0.18 -0.34 -0.32 0.00 -0.02 0.00 0.00 57.16 56.65 3ivt n GLU 401 Cb 0.42 -1.16 -0.10 0.00 -0.02 0.00 0.00 31.44 30.58 3ivt n GLU 401 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 3ivt s TYR 402 N -1.89 2.91 0.11 -0.32 2.02 -0.65 -5.12 117.35 114.42 3ivt s TYR 402 Ca 0.14 -0.02 0.09 0.00 -0.37 0.00 0.00 57.07 56.91 3ivt s TYR 402 Cb 0.07 -1.63 -0.04 0.00 -0.40 0.00 0.00 41.96 39.97 3ivt s TYR 402 CO 0.11 0.38 -0.22 -1.01 -1.57 0.00 0.00 175.55 173.24 3ivt s HIS 403 N -0.98 1.90 -2.00 2.71 3.76 -1.26 -5.06 115.29 114.36 3ivt s HIS 403 Ca 0.17 -0.41 0.23 0.00 -0.15 0.00 0.00 55.06 54.89 3ivt s HIS 403 Cb -0.11 -1.03 1.38 0.00 1.11 0.00 0.00 32.58 33.94 3ivt s HIS 403 CO 0.07 0.25 1.75 0.00 -0.85 0.00 0.00 174.74 175.96