#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h4v s VAL 6 N 0.00 5.10 0.66 12.58 1.01 -1.26 -5.05 120.40 133.44 3h4v s VAL 6 Ca 0.00 1.03 -0.17 0.00 0.00 0.00 0.00 61.98 62.84 3h4v s VAL 6 Cb 0.00 -3.87 0.00 0.00 0.00 0.00 0.00 36.38 32.51 3h4v s VAL 6 CO 0.00 0.19 1.19 -2.16 0.00 0.00 0.00 175.10 174.32 3h4v s PRO 7 N 1.48 2.60 -0.10 2.72 0.04 -1.26 -4.73 135.00 135.75 3h4v s PRO 7 Ca 0.26 1.72 0.03 0.00 0.04 0.00 0.00 61.00 63.05 3h4v s PRO 7 Cb -0.16 -1.89 0.01 0.00 0.04 0.00 0.00 34.50 32.50 3h4v s PRO 7 CO 0.10 -1.47 -0.20 0.08 0.04 0.00 0.00 177.00 175.55 3h4v s VAL 8 N -1.89 1.78 -0.15 -0.36 1.01 -1.26 -0.74 120.40 118.79 3h4v s VAL 8 Ca 0.74 -0.84 -0.03 0.00 0.00 0.00 0.00 61.98 61.85 3h4v s VAL 8 Cb -0.28 -1.57 -0.02 0.00 0.00 0.00 0.00 36.38 34.50 3h4v s VAL 8 CO 0.40 0.50 -0.05 0.00 0.00 0.00 0.00 175.10 175.94 3h4v s ALA 9 N 0.61 2.94 -0.23 5.51 0.00 0.39 0.90 121.76 131.87 3h4v s ALA 9 Ca -0.14 -0.84 -0.10 0.00 0.00 0.00 0.00 51.96 50.88 3h4v s ALA 9 Cb -0.17 -1.51 -0.05 0.00 0.00 0.00 0.00 23.12 21.40 3h4v s ALA 9 CO 0.04 0.19 0.14 -1.17 0.00 0.00 0.00 175.76 174.97 3h4v s LEU 10 N 0.40 4.04 -0.21 0.00 2.96 0.35 -0.70 118.68 125.53 3h4v s LEU 10 Ca -0.05 0.09 0.02 0.00 -0.22 0.00 0.00 54.13 53.97 3h4v s LEU 10 Cb -0.14 -2.08 0.04 0.00 0.50 0.00 0.00 46.19 44.51 3h4v s LEU 10 CO 0.03 0.08 -0.15 -0.69 -1.32 0.00 0.00 176.35 174.30 3h4v s VAL 11 N 0.99 1.99 0.36 1.68 1.01 -0.67 -0.84 120.40 124.93 3h4v s VAL 11 Ca 0.07 -1.17 -0.18 0.00 0.00 0.00 0.00 61.98 60.70 3h4v s VAL 11 Cb -0.13 -1.95 -0.10 0.00 0.00 0.00 0.00 36.38 34.20 3h4v s VAL 11 CO 0.04 0.28 0.83 0.42 0.00 0.00 0.00 175.10 176.66 3h4v s THR 12 N 1.26 4.53 -1.35 3.92 -4.23 -0.91 -1.72 115.64 117.13 3h4v s THR 12 Ca -0.01 1.23 -0.01 0.00 -1.18 0.00 0.00 61.69 61.72 3h4v s THR 12 Cb -0.16 -3.64 -0.00 0.00 1.34 0.00 0.00 72.50 70.04 3h4v s THR 12 CO -0.09 -0.20 0.54 0.61 -0.54 0.00 0.00 174.62 174.93 3h4v n GLY 13 N -0.37 -0.29 0.03 3.99 0.00 -1.15 -2.57 105.19 104.84 3h4v n GLY 13 Ca 0.04 0.16 0.13 0.00 0.00 0.00 0.00 46.02 46.36 3h4v n GLY 13 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h4v n ALA 14 N -4.34 2.93 -0.01 4.61 0.00 -0.48 -4.27 120.51 118.95 3h4v n ALA 14 Ca -0.30 -0.25 -0.03 0.00 0.00 0.00 0.00 53.44 52.87 3h4v n ALA 14 Cb 0.68 -1.29 0.21 0.00 0.00 0.00 0.00 19.45 19.04 3h4v n ALA 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3h4v h ALA 15 N 3.16 1.14 -2.47 0.00 0.00 -1.87 -0.33 119.26 118.88 3h4v h ALA 15 Ca 0.00 -0.31 -0.30 0.00 0.00 0.00 0.00 54.91 54.30 3h4v h ALA 15 Cb 0.47 -0.14 -0.15 0.00 0.00 0.00 0.00 17.79 17.98 3h4v h ALA 15 CO 0.00 0.54 -0.61 0.15 0.00 0.00 0.00 179.25 179.33 3h4v s LYS 16 N -4.65 1.33 3.18 0.00 1.02 -1.26 -4.57 119.74 114.79 3h4v s LYS 16 Ca -0.07 -1.72 0.00 0.00 0.02 0.00 0.00 55.97 54.20 3h4v s LYS 16 Cb 0.14 0.02 0.00 0.00 -0.52 0.00 0.00 37.83 37.47 3h4v s LYS 16 CO 0.79 -0.36 0.00 0.54 -0.92 0.00 0.00 175.35 175.40 3h4v n ARG 17 N -0.38 0.00 0.09 1.68 1.74 -1.26 -1.65 116.66 116.87 3h4v n ARG 17 Ca 0.01 0.00 -0.06 0.00 -0.77 0.00 0.00 57.85 57.04 3h4v n ARG 17 Cb 0.66 0.00 0.08 0.00 -1.02 0.00 0.00 32.46 32.18 3h4v n ARG 17 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 3h4v h LEU 18 N 0.00 0.22 -0.49 0.55 3.38 -1.92 -2.48 115.31 114.58 3h4v h LEU 18 Ca 0.00 -0.15 -0.08 0.00 0.09 0.00 0.00 57.88 57.74 3h4v h LEU 18 Cb 0.00 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 3h4v h LEU 18 CO 0.00 0.85 -0.02 1.23 0.09 0.00 0.00 178.44 180.59 3h4v h GLY 19 N 1.67 0.94 0.64 0.83 0.00 -1.67 -1.13 103.07 104.36 3h4v h GLY 19 Ca -0.02 -0.70 0.03 0.00 0.00 0.00 0.00 47.33 46.64 3h4v h GLY 19 CO 0.10 0.65 -0.07 -0.09 0.00 0.00 0.00 176.54 177.14 3h4v h ARG 20 N 0.73 -0.05 -0.12 4.80 2.43 -0.10 -0.35 114.38 121.72 3h4v h ARG 20 Ca 0.14 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.31 3h4v h ARG 20 Cb 0.53 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.09 3h4v h ARG 20 CO 0.03 -0.03 0.07 1.03 -1.51 0.00 0.00 179.97 179.55 3h4v h SER 21 N -0.05 0.14 0.02 -3.80 0.87 -1.34 0.27 113.55 109.66 3h4v h SER 21 Ca 0.08 -0.01 -0.00 0.00 -1.23 0.00 0.00 61.79 60.63 3h4v h SER 21 Cb 0.17 -0.04 0.00 0.00 -0.44 0.00 0.00 62.40 62.09 3h4v h SER 21 CO -0.18 0.12 -0.01 0.40 -0.53 0.00 0.00 176.83 176.63 3h4v h ILE 22 N 0.17 1.42 -0.56 2.23 2.04 -1.00 -1.03 117.51 120.77 3h4v h ILE 22 Ca 0.04 -1.42 0.09 0.00 1.00 0.00 0.00 64.86 64.57 3h4v h ILE 22 Cb 0.01 2.37 -0.07 0.00 -0.74 0.00 0.00 36.82 38.38 3h4v h ILE 22 CO -0.01 0.36 0.16 0.00 0.00 0.00 0.00 178.15 178.67 3h4v h ALA 23 N 0.29 0.69 -0.59 1.87 0.00 -0.69 0.02 119.26 120.85 3h4v h ALA 23 Ca -0.00 0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 3h4v h ALA 23 Cb 0.61 0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.48 3h4v h ALA 23 CO 0.00 -0.26 0.30 0.93 0.00 0.00 0.00 179.25 180.23 3h4v h GLU 24 N 0.32 0.83 -0.23 0.00 5.08 -0.50 0.57 114.58 120.66 3h4v h GLU 24 Ca 0.29 -0.11 -0.14 0.00 -1.00 0.00 0.00 59.36 58.40 3h4v h GLU 24 Cb 0.38 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.46 3h4v h GLU 24 CO -0.33 0.66 -0.44 0.78 -1.00 0.00 0.00 179.01 178.68 3h4v h GLY 25 N 0.80 0.61 0.82 -3.84 0.00 -0.72 -0.56 103.07 100.18 3h4v h GLY 25 Ca 0.20 -0.63 -0.09 0.00 0.00 0.00 0.00 47.33 46.81 3h4v h GLY 25 CO -0.03 0.57 -0.22 1.41 0.00 0.00 0.00 176.54 178.27 3h4v h LEU 26 N 0.46 0.52 -0.95 3.11 3.38 -0.85 -3.14 115.31 117.83 3h4v h LEU 26 Ca 0.03 -0.50 0.14 0.00 0.09 0.00 0.00 57.88 57.64 3h4v h LEU 26 Cb 0.95 -0.15 -0.09 0.00 0.09 0.00 0.00 40.66 41.46 3h4v h LEU 26 CO 0.08 0.91 0.57 -0.74 0.09 0.00 0.00 178.44 179.36 3h4v h HIS 27 N 0.13 1.02 0.00 1.13 2.76 -0.57 -0.53 115.15 119.10 3h4v h HIS 27 Ca 0.02 0.03 -0.00 0.00 -2.20 0.00 0.00 60.37 58.22 3h4v h HIS 27 Cb 0.78 -0.31 -0.00 0.00 1.55 0.00 0.00 27.41 29.42 3h4v h HIS 27 CO 0.08 0.34 -0.02 0.00 -1.30 0.00 0.00 177.93 177.04 3h4v h ALA 28 N 1.56 1.02 -0.01 5.26 0.00 -1.07 -2.28 119.26 123.73 3h4v h ALA 28 Ca 0.50 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.39 3h4v h ALA 28 Cb 0.60 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.38 3h4v h ALA 28 CO -0.31 0.02 -0.29 0.39 0.00 0.00 0.00 179.25 179.06 3h4v n GLU 29 N -3.13 0.76 0.00 0.00 -0.58 -0.25 -4.93 120.64 112.51 3h4v n GLU 29 Ca -0.00 -0.46 0.00 0.00 -0.42 0.00 0.00 57.16 56.28 3h4v n GLU 29 Cb 0.26 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.64 3h4v n GLU 29 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3h4v n GLY 30 N 1.36 0.95 3.77 0.62 0.00 -0.86 -5.10 105.19 105.93 3h4v n GLY 30 Ca 0.11 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.75 3h4v n GLY 30 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3h4v s TYR 31 N -2.00 3.47 0.22 1.61 1.51 -0.94 -4.48 117.35 116.74 3h4v s TYR 31 Ca 0.00 1.70 -0.25 0.00 -1.01 0.00 0.00 57.07 57.51 3h4v s TYR 31 Cb 0.00 -3.13 -0.09 0.00 -0.11 0.00 0.00 41.96 38.63 3h4v s TYR 31 CO 0.00 -0.41 0.82 0.00 -1.11 0.00 0.00 175.55 174.85 3h4v s ALA 32 N -1.48 3.38 -0.16 3.71 0.00 0.09 -4.28 121.76 123.02 3h4v s ALA 32 Ca 0.52 0.39 -0.00 0.00 0.00 0.00 0.00 51.96 52.87 3h4v s ALA 32 Cb -0.25 -3.01 0.04 0.00 0.00 0.00 0.00 23.12 19.90 3h4v s ALA 32 CO 0.31 0.27 -0.08 0.08 0.00 0.00 0.00 175.76 176.34 3h4v s VAL 33 N -1.32 1.29 -0.43 0.00 1.01 -0.74 -0.46 120.40 119.75 3h4v s VAL 33 Ca 0.41 -0.66 -0.29 0.00 0.00 0.00 0.00 61.98 61.44 3h4v s VAL 33 Cb -0.21 -1.37 0.03 0.00 0.00 0.00 0.00 36.38 34.82 3h4v s VAL 33 CO 0.26 0.23 1.13 0.00 0.00 0.00 0.00 175.10 176.71 3h4v s LEU 35 N 4.26 5.54 0.34 0.00 1.43 0.24 -1.67 118.68 128.82 3h4v s LEU 35 Ca 0.48 -1.34 -0.10 0.00 -1.03 0.00 0.00 54.13 52.13 3h4v s LEU 35 Cb -0.09 -2.15 -0.07 0.00 0.03 0.00 0.00 46.19 43.91 3h4v s LEU 35 CO 0.27 -0.62 0.69 -2.28 0.23 0.00 0.00 176.35 174.64 3h4v s HIS 36 N 1.61 3.44 0.24 0.29 5.65 -0.70 -1.18 115.29 124.64 3h4v s HIS 36 Ca 0.04 0.99 -0.14 0.00 0.25 0.00 0.00 55.06 56.19 3h4v s HIS 36 Cb -0.24 -2.38 0.00 0.00 -1.18 0.00 0.00 32.58 28.79 3h4v s HIS 36 CO 0.06 0.05 0.51 1.52 -0.65 0.00 0.00 174.74 176.23 3h4v s TYR 37 N -2.15 0.22 0.14 3.88 -0.85 -0.76 -1.38 117.35 116.45 3h4v s TYR 37 Ca 0.50 -0.60 0.00 0.00 -0.52 0.00 0.00 57.07 56.45 3h4v s TYR 37 Cb -0.10 0.28 0.00 0.00 0.38 0.00 0.00 41.96 42.52 3h4v s TYR 37 CO 0.26 -1.01 0.00 1.58 -1.52 0.00 0.00 175.55 174.86 3h4v n HIS 38 N -0.38 -0.66 0.32 -3.49 -0.00 -1.26 -1.09 115.22 108.66 3h4v n HIS 38 Ca -0.03 0.12 0.03 0.00 -0.00 0.00 0.00 57.72 57.84 3h4v n HIS 38 Cb 0.62 0.17 -0.03 0.00 -0.00 0.00 0.00 29.99 30.74 3h4v n HIS 38 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.34 176.88 3h4v n ARG 39 N -3.37 4.08 -2.56 1.57 1.74 -1.26 -4.73 116.66 112.13 3h4v n ARG 39 Ca 0.00 -0.14 -0.38 0.00 -0.77 0.00 0.00 57.85 56.56 3h4v n ARG 39 Cb 0.00 -0.87 0.01 0.00 -1.02 0.00 0.00 32.46 30.59 3h4v n ARG 39 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 3h4v n SER 40 N -0.93 6.82 -0.06 0.55 7.64 -1.26 -4.82 113.62 121.56 3h4v n SER 40 Ca 0.02 -3.72 -0.07 0.00 1.01 0.00 0.00 58.87 56.11 3h4v n SER 40 Cb 0.12 -1.02 -0.01 0.00 -1.01 0.00 0.00 64.21 62.28 3h4v n SER 40 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3h4v h ALA 41 N 3.74 0.05 0.43 -0.43 0.00 -1.96 -2.11 119.26 118.98 3h4v h ALA 41 Ca 0.47 0.09 -0.02 0.00 0.00 0.00 0.00 54.91 55.46 3h4v h ALA 41 Cb 0.33 0.33 -0.00 0.00 0.00 0.00 0.00 17.79 18.44 3h4v h ALA 41 CO 1.15 -0.55 -0.26 0.00 0.00 0.00 0.00 179.25 179.59 3h4v h ALA 42 N 1.07 -0.65 -0.97 0.00 0.00 -1.99 -0.79 119.26 115.93 3h4v h ALA 42 Ca 0.14 -0.13 0.07 0.00 0.00 0.00 0.00 54.91 54.99 3h4v h ALA 42 Cb 0.32 0.31 -0.07 0.00 0.00 0.00 0.00 17.79 18.36 3h4v h ALA 42 CO -0.33 -0.88 0.62 0.93 0.00 0.00 0.00 179.25 179.60 3h4v h GLU 43 N -0.65 1.06 0.06 0.00 3.07 -1.90 -1.70 114.58 114.52 3h4v h GLU 43 Ca -0.05 -0.06 -0.00 0.00 -0.50 0.00 0.00 59.36 58.74 3h4v h GLU 43 Cb 0.53 -0.24 0.00 0.00 -0.84 0.00 0.00 28.75 28.20 3h4v h GLU 43 CO 0.05 0.70 -0.03 0.00 -1.40 0.00 0.00 179.01 178.34 3h4v h ALA 44 N 1.49 -0.08 -0.96 3.43 0.00 -0.92 -1.17 119.26 121.06 3h4v h ALA 44 Ca 0.43 -0.20 0.16 0.00 0.00 0.00 0.00 54.91 55.30 3h4v h ALA 44 Cb 0.23 0.03 -0.10 0.00 0.00 0.00 0.00 17.79 17.95 3h4v h ALA 44 CO -0.17 -0.34 0.56 -0.91 0.00 0.00 0.00 179.25 178.38 3h4v h ASN 45 N -0.49 0.74 -0.39 0.00 2.35 -1.16 0.51 115.58 117.14 3h4v h ASN 45 Ca -0.01 0.09 -0.11 0.00 -0.55 0.00 0.00 56.30 55.71 3h4v h ASN 45 Cb 0.43 -0.05 -0.01 0.00 0.05 0.00 0.00 38.32 38.74 3h4v h ASN 45 CO 0.01 0.30 -0.20 0.00 -1.65 0.00 0.00 177.43 175.90 3h4v h ALA 46 N 1.60 0.55 -0.39 -0.83 0.00 -1.22 -1.02 119.26 117.96 3h4v h ALA 46 Ca 0.53 -0.37 -0.04 0.00 0.00 0.00 0.00 54.91 55.03 3h4v h ALA 46 Cb 0.74 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 3h4v h ALA 46 CO -0.35 0.51 0.10 1.25 0.00 0.00 0.00 179.25 180.75 3h4v h LEU 47 N 0.63 0.58 -0.63 0.00 5.85 -0.86 -2.40 115.31 118.49 3h4v h LEU 47 Ca 0.09 -0.23 0.12 0.00 0.84 0.00 0.00 57.88 58.70 3h4v h LEU 47 Cb 0.76 -0.15 -0.09 0.00 0.37 0.00 0.00 40.66 41.54 3h4v h LEU 47 CO 0.06 0.66 0.14 -1.28 -0.34 0.00 0.00 178.44 177.68 3h4v h SER 48 N 0.48 0.01 -0.94 1.25 0.87 -0.77 -2.17 113.55 112.27 3h4v h SER 48 Ca 0.12 0.12 0.04 0.00 -1.23 0.00 0.00 61.79 60.83 3h4v h SER 48 Cb 0.30 0.16 -0.06 0.00 -0.44 0.00 0.00 62.40 62.37 3h4v h SER 48 CO 0.00 0.01 0.61 0.00 -0.53 0.00 0.00 176.83 176.92 3h4v h ALA 49 N 1.50 1.25 -0.36 6.23 0.00 -0.91 0.22 119.26 127.19 3h4v h ALA 49 Ca 0.33 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 55.15 3h4v h ALA 49 Cb 0.51 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 3h4v h ALA 49 CO -0.42 0.49 0.04 1.15 0.00 0.00 0.00 179.25 180.51 3h4v h THR 50 N 1.19 1.25 -0.27 0.00 2.02 -1.04 -0.64 112.91 115.40 3h4v h THR 50 Ca 0.38 -0.89 -0.12 0.00 0.77 0.00 0.00 66.41 66.55 3h4v h THR 50 Cb 0.00 1.12 -0.00 0.00 -1.74 0.00 0.00 68.15 67.53 3h4v h THR 50 CO -0.12 0.30 -0.28 -0.07 0.37 0.00 0.00 175.52 175.71 3h4v h LEU 51 N 0.44 0.72 -0.87 2.58 3.38 -0.91 -1.87 115.31 118.77 3h4v h LEU 51 Ca 0.11 -0.48 -0.03 0.00 0.09 0.00 0.00 57.88 57.57 3h4v h LEU 51 Cb 0.39 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.90 3h4v h LEU 51 CO 0.01 1.05 0.38 0.78 0.09 0.00 0.00 178.44 180.75 3h4v h ASN 52 N 0.40 1.09 -0.75 -0.43 2.35 -0.57 -0.05 115.58 117.62 3h4v h ASN 52 Ca 0.04 -0.14 0.01 0.00 -0.55 0.00 0.00 56.30 55.66 3h4v h ASN 52 Cb 0.85 -0.28 -0.04 0.00 0.05 0.00 0.00 38.32 38.90 3h4v h ASN 52 CO 0.07 0.93 0.50 0.00 -1.65 0.00 0.00 177.43 177.28 3h4v h ALA 53 N 1.23 0.96 -0.21 -0.83 0.00 -0.87 -1.56 119.26 117.97 3h4v h ALA 53 Ca 0.28 -0.05 -0.13 0.00 0.00 0.00 0.00 54.91 55.01 3h4v h ALA 53 Cb 0.14 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 3h4v h ALA 53 CO -0.03 0.37 -0.43 0.00 0.00 0.00 0.00 179.25 179.16 3h4v h ARG 54 N 1.02 0.51 -1.87 0.00 3.08 -1.14 -3.42 114.38 112.56 3h4v h ARG 54 Ca 0.28 -0.27 -0.16 0.00 0.07 0.00 0.00 59.98 59.90 3h4v h ARG 54 Cb -0.12 0.01 -0.30 0.00 0.08 0.00 0.00 29.97 29.65 3h4v h ARG 54 CO -0.06 0.85 -0.49 0.50 -1.07 0.00 0.00 179.97 179.70 3h4v s ARG 55 N -4.18 0.36 0.28 0.04 3.52 -0.05 -5.10 118.95 113.82 3h4v s ARG 55 Ca -0.07 0.47 -0.28 0.00 -0.13 0.00 0.00 55.73 55.72 3h4v s ARG 55 Cb 0.12 -0.46 -0.14 0.00 -1.56 0.00 0.00 34.95 32.92 3h4v s ARG 55 CO 0.82 -0.70 1.00 -2.30 -0.81 0.00 0.00 175.30 173.31 3h4v n PRO 56 N 5.36 1.29 -2.68 5.12 -0.02 -0.71 -2.48 135.00 140.88 3h4v n PRO 56 Ca -0.03 0.45 -0.18 0.00 -2.02 0.00 0.00 63.50 61.73 3h4v n PRO 56 Cb 0.50 -1.82 0.00 0.00 -0.02 0.00 0.00 33.50 32.16 3h4v n PRO 56 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 3h4v n ASN 57 N 1.31 -4.64 -1.48 2.55 5.15 -1.26 -4.88 115.26 112.00 3h4v n ASN 57 Ca 0.10 -0.02 0.08 0.00 -0.60 0.00 0.00 54.58 54.14 3h4v n ASN 57 Cb 0.31 -3.87 0.34 0.00 -0.53 0.00 0.00 39.78 36.04 3h4v n ASN 57 CO 0.00 0.00 0.00 -1.54 1.40 0.00 0.00 177.26 177.12 3h4v n SER 58 N -2.05 4.92 -3.59 1.20 3.41 -1.03 -4.96 113.62 111.52 3h4v n SER 58 Ca -0.14 -2.87 -0.12 0.00 -0.26 0.00 0.00 58.87 55.48 3h4v n SER 58 Cb 0.62 -0.61 -0.06 0.00 -0.26 0.00 0.00 64.21 63.89 3h4v n SER 58 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3h4v s ALA 59 N -2.62 -1.89 0.06 7.33 0.00 -1.26 -1.79 121.76 121.59 3h4v s ALA 59 Ca 0.49 1.68 -0.01 0.00 0.00 0.00 0.00 51.96 54.12 3h4v s ALA 59 Cb 0.37 -0.84 -0.04 0.00 0.00 0.00 0.00 23.12 22.61 3h4v s ALA 59 CO 0.15 -0.30 -0.02 0.96 0.00 0.00 0.00 175.76 176.54 3h4v s ILE 60 N -0.54 0.24 0.03 0.00 -4.36 -0.98 -4.91 121.20 110.69 3h4v s ILE 60 Ca -0.02 -1.83 0.08 0.00 -0.26 0.00 0.00 60.65 58.62 3h4v s ILE 60 Cb -0.02 -1.59 -0.03 0.00 1.25 0.00 0.00 42.46 42.07 3h4v s ILE 60 CO 0.01 -0.93 -0.22 0.42 0.24 0.00 0.00 174.94 174.46 3h4v s THR 61 N -3.91 2.51 -0.02 8.37 -4.23 -1.26 -0.59 115.64 116.51 3h4v s THR 61 Ca 0.09 -1.24 -0.01 0.00 -1.18 0.00 0.00 61.69 59.35 3h4v s THR 61 Cb 0.08 -2.01 0.01 0.00 1.34 0.00 0.00 72.50 71.91 3h4v s THR 61 CO -0.08 0.37 0.04 -0.69 -0.54 0.00 0.00 174.62 173.72 3h4v s VAL 62 N -0.85 -0.01 -0.15 2.29 1.01 -0.32 -4.89 120.40 117.48 3h4v s VAL 62 Ca 0.13 0.04 -0.08 0.00 0.00 0.00 0.00 61.98 62.06 3h4v s VAL 62 Cb -0.10 -0.07 -0.04 0.00 0.00 0.00 0.00 36.38 36.16 3h4v s VAL 62 CO 0.03 0.01 0.14 -1.58 0.00 0.00 0.00 175.10 173.71 3h4v s GLN 63 N 0.20 3.77 -0.22 2.72 0.74 -1.26 -1.83 119.66 123.78 3h4v s GLN 63 Ca -0.02 -0.17 -0.14 0.00 0.05 0.00 0.00 55.36 55.09 3h4v s GLN 63 Cb -0.02 -3.29 0.07 0.00 1.10 0.00 0.00 33.01 30.86 3h4v s GLN 63 CO -0.01 0.57 0.56 0.00 -0.55 0.00 0.00 175.29 175.86 3h4v s ALA 64 N -0.42 -1.47 -0.17 1.58 0.00 -0.25 -4.94 121.76 116.09 3h4v s ALA 64 Ca 0.12 1.92 -0.29 0.00 0.00 0.00 0.00 51.96 53.71 3h4v s ALA 64 Cb -0.12 -1.14 -0.02 0.00 0.00 0.00 0.00 23.12 21.84 3h4v s ALA 64 CO 0.01 -0.31 1.42 0.34 0.00 0.00 0.00 175.76 177.22 3h4v s ASP 65 N 1.28 6.73 -0.01 0.00 2.15 -1.26 -4.28 116.67 121.28 3h4v s ASP 65 Ca -0.08 1.73 0.19 0.00 0.43 0.00 0.00 52.55 54.82 3h4v s ASP 65 Cb -0.06 -2.54 0.57 0.00 -0.30 0.00 0.00 42.92 40.60 3h4v s ASP 65 CO -0.13 -0.94 1.48 0.18 -0.17 0.00 0.00 175.17 175.59 3h4v n LEU 66 N 7.23 3.78 -4.75 -1.34 4.77 -1.26 -4.93 117.00 120.50 3h4v n LEU 66 Ca 0.16 -2.05 -0.37 0.00 -0.03 0.00 0.00 56.01 53.72 3h4v n LEU 66 Cb 0.45 -0.44 0.03 0.00 -2.33 0.00 0.00 43.42 41.13 3h4v n LEU 66 CO 0.60 0.91 0.88 -0.55 -1.33 0.00 0.00 177.39 177.90 3h4v s SER 67 N -1.00 5.34 -1.27 -1.43 0.15 -1.26 -2.65 113.70 111.57 3h4v s SER 67 Ca 0.43 2.49 -0.14 0.00 0.70 0.00 0.00 55.95 59.43 3h4v s SER 67 Cb 0.23 -2.61 -0.05 0.00 -1.71 0.00 0.00 66.02 61.88 3h4v s SER 67 CO 0.28 -1.50 2.32 -3.20 1.20 0.00 0.00 173.24 172.35 3h4v n ASN 68 N -1.27 4.87 -4.12 5.45 5.15 0.27 -4.81 115.26 120.80 3h4v n ASN 68 Ca 0.12 -2.67 -0.15 0.00 -0.60 0.00 0.00 54.58 51.28 3h4v n ASN 68 Cb 0.48 -1.44 -0.11 0.00 -0.53 0.00 0.00 39.78 38.18 3h4v n ASN 68 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 3h4v s VAL 69 N 3.38 0.81 0.33 3.44 -7.23 -1.26 -4.84 120.40 115.03 3h4v s VAL 69 Ca 0.54 -1.27 -0.26 0.00 -1.81 0.00 0.00 61.98 59.17 3h4v s VAL 69 Cb 0.14 -0.92 -0.10 0.00 0.56 0.00 0.00 36.38 36.07 3h4v s VAL 69 CO -0.03 -0.37 0.98 0.00 -0.31 0.00 0.00 175.10 175.37 3h4v s ALA 70 N -1.58 3.21 0.00 1.32 0.00 -1.26 -3.85 121.76 119.60 3h4v s ALA 70 Ca -0.04 0.59 0.00 0.00 0.00 0.00 0.00 51.96 52.51 3h4v s ALA 70 Cb -0.08 -3.21 0.00 0.00 0.00 0.00 0.00 23.12 19.82 3h4v s ALA 70 CO 0.01 0.08 0.00 0.25 0.00 0.00 0.00 175.76 176.10 3h4v n THR 71 N 0.54 0.00 -2.82 0.00 -2.24 0.54 -4.83 114.28 105.47 3h4v n THR 71 Ca 0.02 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.37 3h4v n THR 71 Cb 0.49 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.69 3h4v n THR 71 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3h4v s ALA 72 N -2.00 3.10 0.74 6.98 0.00 -1.26 -3.60 121.76 125.72 3h4v s ALA 72 Ca 0.00 -2.03 -0.12 0.00 0.00 0.00 0.00 51.96 49.80 3h4v s ALA 72 Cb 0.00 -3.99 0.04 0.00 0.00 0.00 0.00 23.12 19.17 3h4v s ALA 72 CO 0.00 -2.94 1.11 -2.14 0.00 0.00 0.00 175.76 171.80 3h4v s PRO 73 N 3.99 2.33 0.00 0.00 0.02 -1.26 -4.40 135.00 135.68 3h4v s PRO 73 Ca 0.27 1.34 0.00 0.00 0.02 0.00 0.00 61.00 62.63 3h4v s PRO 73 Cb -0.12 -1.89 0.00 0.00 0.02 0.00 0.00 34.50 32.50 3h4v s PRO 73 CO 0.05 -1.61 0.00 0.28 -0.33 0.00 0.00 177.00 175.39 3h4v n VAL 74 N -3.12 0.00 -0.02 3.83 0.31 -1.26 -4.70 118.33 113.37 3h4v n VAL 74 Ca 0.10 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.43 3h4v n VAL 74 Cb 0.52 -0.16 0.00 0.00 -0.91 0.00 0.00 33.84 33.29 3h4v n VAL 74 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3h4v n ALA 77 N 0.57 -1.00 -2.87 3.52 0.00 -1.26 -4.67 120.51 114.81 3h4v n ALA 77 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3h4v n ALA 77 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 19.45 19.44 3h4v n ALA 77 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 3h4v n ASP 78 N -0.03 0.49 -0.05 0.00 5.68 -1.26 -5.08 116.55 116.29 3h4v n ASP 78 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.29 3h4v n ASP 78 Cb 0.00 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 39.98 3h4v n ASP 78 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3h4v n GLY 79 N 5.00 0.67 0.00 6.12 0.00 -1.26 -5.11 105.19 110.61 3h4v n GLY 79 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3h4v n GLY 79 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3h4v n SER 80 N 0.00 0.00 -4.86 1.61 3.41 -1.26 -4.96 113.62 107.56 3h4v n SER 80 Ca 0.00 0.00 -0.33 0.00 -0.26 0.00 0.00 58.87 58.28 3h4v n SER 80 Cb 0.33 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.23 3h4v n SER 80 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3h4v s ALA 81 N -1.00 3.51 0.36 7.33 0.00 -1.26 -4.93 121.76 125.77 3h4v s ALA 81 Ca 0.00 -0.14 -0.25 0.00 0.00 0.00 0.00 51.96 51.56 3h4v s ALA 81 Cb 0.00 -2.55 -0.09 0.00 0.00 0.00 0.00 23.12 20.47 3h4v s ALA 81 CO 0.00 0.45 1.03 -2.14 0.00 0.00 0.00 175.76 175.10 3h4v s PRO 82 N -2.59 4.34 -0.16 0.00 0.02 -1.26 -4.03 135.00 131.32 3h4v s PRO 82 Ca 0.46 1.51 -0.21 0.00 0.02 0.00 0.00 61.00 62.78 3h4v s PRO 82 Cb -0.12 -2.71 -0.03 0.00 0.02 0.00 0.00 34.50 31.66 3h4v s PRO 82 CO 0.20 0.02 0.64 0.08 -0.33 0.00 0.00 177.00 177.61 3h4v s VAL 83 N -1.57 5.03 0.53 3.83 1.01 -1.24 -4.79 120.40 123.21 3h4v s VAL 83 Ca 0.54 1.24 -0.20 0.00 0.00 0.00 0.00 61.98 63.57 3h4v s VAL 83 Cb -0.23 -3.96 -0.06 0.00 0.00 0.00 0.00 36.38 32.13 3h4v s VAL 83 CO 0.29 0.15 1.12 0.42 0.00 0.00 0.00 175.10 177.08 3h4v s THR 84 N 1.61 3.23 0.20 3.92 -4.23 -1.26 0.20 115.64 119.32 3h4v s THR 84 Ca 0.31 0.77 -0.11 0.00 -1.18 0.00 0.00 61.69 61.48 3h4v s THR 84 Cb -0.16 -3.31 0.15 0.00 1.34 0.00 0.00 72.50 70.52 3h4v s THR 84 CO 0.12 -0.16 1.70 0.25 -0.54 0.00 0.00 174.62 175.99 3h4v h LEU 85 N 1.27 -0.05 -0.41 4.79 5.85 -1.88 -1.26 115.31 123.62 3h4v h LEU 85 Ca -0.50 0.11 0.07 0.00 0.84 0.00 0.00 57.88 58.40 3h4v h LEU 85 Cb 1.26 0.17 -0.06 0.00 0.37 0.00 0.00 40.66 42.40 3h4v h LEU 85 CO 0.57 -0.01 0.07 0.15 -0.34 0.00 0.00 178.44 178.88 3h4v h PHE 86 N 0.22 0.11 -0.10 1.25 3.57 -1.93 0.82 116.94 120.88 3h4v h PHE 86 Ca 0.30 0.03 0.04 0.00 3.53 0.00 0.00 57.97 61.87 3h4v h PHE 86 Cb 0.44 0.01 -0.06 0.00 2.79 0.00 0.00 35.95 39.14 3h4v h PHE 86 CO -0.26 0.00 -0.26 1.15 -2.23 0.00 0.00 178.31 176.71 3h4v h THR 87 N 0.20 0.40 -0.79 4.41 2.02 -1.78 0.53 112.91 117.89 3h4v h THR 87 Ca 0.20 0.00 0.10 0.00 0.77 0.00 0.00 66.41 67.48 3h4v h THR 87 Cb 0.25 0.40 -0.07 0.00 -1.74 0.00 0.00 68.15 66.98 3h4v h THR 87 CO -0.27 0.00 0.43 0.03 0.37 0.00 0.00 175.52 176.08 3h4v h ARG 88 N -0.34 0.69 -0.56 6.66 3.08 -0.69 -0.76 114.38 122.46 3h4v h ARG 88 Ca 0.09 -0.04 -0.02 0.00 0.07 0.00 0.00 59.98 60.08 3h4v h ARG 88 Cb 0.48 -0.16 -0.03 0.00 0.08 0.00 0.00 29.97 30.34 3h4v h ARG 88 CO -0.30 0.46 0.26 0.00 -1.07 0.00 0.00 179.97 179.32 3h4v h ALA 90 N 1.10 1.12 0.00 0.00 0.00 -0.30 -2.86 119.26 118.31 3h4v h ALA 90 Ca 0.19 -0.19 -0.05 0.00 0.00 0.00 0.00 54.91 54.87 3h4v h ALA 90 Cb 0.14 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 3h4v h ALA 90 CO -0.02 0.63 -0.23 0.93 0.00 0.00 0.00 179.25 180.56 3h4v h GLU 91 N 1.09 0.00 0.07 0.00 5.08 -0.91 0.59 114.58 120.50 3h4v h GLU 91 Ca 0.25 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.61 3h4v h GLU 91 Cb 0.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.45 3h4v h GLU 91 CO -0.02 0.23 -0.04 -0.07 -1.00 0.00 0.00 179.01 178.11 3h4v h LEU 92 N 0.00 -0.08 -0.33 1.33 3.38 -1.18 -0.10 115.31 118.32 3h4v h LEU 92 Ca -0.00 -0.19 -0.09 0.00 0.09 0.00 0.00 57.88 57.69 3h4v h LEU 92 Cb 0.50 0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 3h4v h LEU 92 CO 0.03 0.14 -0.15 0.58 0.09 0.00 0.00 178.44 179.13 3h4v h VAL 93 N -0.31 1.29 -0.58 1.22 2.07 -1.42 -2.96 116.25 115.55 3h4v h VAL 93 Ca -0.01 -1.25 0.12 0.00 0.82 0.00 0.00 66.70 66.38 3h4v h VAL 93 Cb 0.27 1.40 -0.09 0.00 -1.52 0.00 0.00 31.29 31.35 3h4v h VAL 93 CO 0.02 0.41 0.05 0.00 0.02 0.00 0.00 177.57 178.06 3h4v h ALA 94 N 0.78 0.61 -0.91 1.67 0.00 -0.89 -1.86 119.26 118.65 3h4v h ALA 94 Ca 0.07 0.16 0.26 0.00 0.00 0.00 0.00 54.91 55.40 3h4v h ALA 94 Cb 0.67 0.26 -0.15 0.00 0.00 0.00 0.00 17.79 18.57 3h4v h ALA 94 CO 0.05 -0.36 0.28 0.00 0.00 0.00 0.00 179.25 179.21 3h4v h ALA 95 N 1.50 1.42 -0.70 0.00 0.00 -0.84 0.14 119.26 120.78 3h4v h ALA 95 Ca 0.30 0.23 -0.06 0.00 0.00 0.00 0.00 54.91 55.39 3h4v h ALA 95 Cb 0.47 0.32 -0.03 0.00 0.00 0.00 0.00 17.79 18.55 3h4v h ALA 95 CO -0.46 -0.52 0.20 0.00 0.00 0.00 0.00 179.25 178.47 3h4v h TYR 97 N 1.03 0.98 -0.76 0.00 -1.99 -0.67 -1.30 116.97 114.27 3h4v h TYR 97 Ca 0.22 -0.46 0.03 0.00 2.00 0.00 0.00 58.73 60.52 3h4v h TYR 97 Cb 0.33 -0.14 -0.04 0.00 2.00 0.00 0.00 36.73 38.88 3h4v h TYR 97 CO 0.03 1.28 0.49 1.15 -0.00 0.00 0.00 178.16 181.10 3h4v h THR 98 N 0.40 1.13 0.17 -2.88 2.02 -0.87 0.57 112.91 113.45 3h4v h THR 98 Ca -0.07 -0.33 -0.36 0.00 0.77 0.00 0.00 66.41 66.43 3h4v h THR 98 Cb 1.41 0.09 0.00 0.00 -1.74 0.00 0.00 68.15 67.91 3h4v h THR 98 CO 0.16 0.17 -1.81 -0.74 0.37 0.00 0.00 175.52 173.67 3h4v h HIS 99 N 0.96 0.67 0.00 3.16 -0.00 -1.45 -3.40 115.15 115.08 3h4v h HIS 99 Ca 0.30 -0.49 0.00 0.00 -0.00 0.00 0.00 60.37 60.18 3h4v h HIS 99 Cb -0.02 -0.03 0.00 0.00 -0.00 0.00 0.00 27.41 27.36 3h4v h HIS 99 CO -0.03 1.71 0.00 0.91 -0.00 0.00 0.00 177.93 180.52 3h4v n TRP 100 N -3.57 0.00 -1.17 5.26 8.01 -0.50 -5.02 117.44 120.45 3h4v n TRP 100 Ca -0.26 -0.02 -0.06 0.00 -1.31 0.00 0.00 57.50 55.85 3h4v n TRP 100 Cb 1.07 -0.00 -0.03 0.00 -2.01 0.00 0.00 31.31 30.34 3h4v n TRP 100 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3h4v n GLY 101 N -0.02 0.73 3.81 6.99 0.00 0.20 -4.88 105.19 112.02 3h4v n GLY 101 Ca 0.00 -0.18 -0.05 0.00 0.00 0.00 0.00 46.02 45.78 3h4v n GLY 101 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3h4v s ARG 102 N -2.10 1.55 -0.27 1.61 1.70 -1.24 -4.90 118.95 115.31 3h4v s ARG 102 Ca 0.00 -0.91 -0.02 0.00 -0.47 0.00 0.00 55.73 54.33 3h4v s ARG 102 Cb 0.00 0.50 0.16 0.00 -0.57 0.00 0.00 34.95 35.03 3h4v s ARG 102 CO 0.00 -0.72 0.47 0.00 -1.08 0.00 0.00 175.30 173.97 3h4v n ASP 104 N 5.39 0.60 -3.99 0.00 8.00 0.26 -4.95 116.55 121.85 3h4v n ASP 104 Ca -0.02 0.00 -0.21 0.00 0.71 0.00 0.00 54.79 55.26 3h4v n ASP 104 Cb 0.50 1.24 -0.16 0.00 -0.02 0.00 0.00 41.12 42.69 3h4v n ASP 104 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3h4v s VAL 105 N -2.72 0.82 -0.09 2.53 1.01 -0.73 -0.87 120.40 120.34 3h4v s VAL 105 Ca -0.08 -0.36 0.01 0.00 0.00 0.00 0.00 61.98 61.55 3h4v s VAL 105 Cb 0.08 -0.75 0.02 0.00 0.00 0.00 0.00 36.38 35.73 3h4v s VAL 105 CO 0.75 0.26 -0.12 -0.22 0.00 0.00 0.00 175.10 175.78 3h4v s LEU 106 N 0.34 1.53 -0.25 3.92 2.96 -0.38 -0.50 118.68 126.30 3h4v s LEU 106 Ca -0.06 -0.34 -0.01 0.00 -0.22 0.00 0.00 54.13 53.50 3h4v s LEU 106 Cb -0.10 -0.90 0.03 0.00 0.50 0.00 0.00 46.19 45.71 3h4v s LEU 106 CO 0.01 -0.02 -0.06 -0.69 -1.32 0.00 0.00 176.35 174.27 3h4v s VAL 107 N 1.08 2.84 -0.90 1.68 1.01 -0.02 0.02 120.40 126.11 3h4v s VAL 107 Ca -0.06 -1.05 -0.17 0.00 0.00 0.00 0.00 61.98 60.70 3h4v s VAL 107 Cb -0.14 -2.45 0.16 0.00 0.00 0.00 0.00 36.38 33.95 3h4v s VAL 107 CO -0.02 0.19 1.01 0.20 0.00 0.00 0.00 175.10 176.49 3h4v s ASN 108 N 1.32 6.69 -0.08 3.32 0.01 0.18 -2.15 114.94 124.22 3h4v s ASN 108 Ca -0.00 -2.30 0.03 0.00 -0.71 0.00 0.00 52.86 49.87 3h4v s ASN 108 Cb -0.17 -2.33 -0.07 0.00 0.41 0.00 0.00 41.25 39.09 3h4v s ASN 108 CO -0.05 -0.88 -0.05 -3.20 -1.51 0.00 0.00 177.10 171.42 3h4v n ASN 109 N 5.61 3.27 -4.63 -1.22 5.15 -1.25 -1.39 115.26 120.80 3h4v n ASN 109 Ca 0.21 -0.03 -0.41 0.00 -0.60 0.00 0.00 54.58 53.74 3h4v n ASN 109 Cb 0.48 0.12 0.01 0.00 -0.53 0.00 0.00 39.78 39.87 3h4v n ASN 109 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3h4v n ALA 110 N -2.60 0.43 -3.37 5.20 0.00 -1.06 -4.88 120.51 114.22 3h4v n ALA 110 Ca -0.15 0.24 0.02 0.00 0.00 0.00 0.00 53.44 53.55 3h4v n ALA 110 Cb 0.69 -2.12 -0.05 0.00 0.00 0.00 0.00 19.45 17.97 3h4v n ALA 110 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3h4v s SER 111 N -0.69 -0.27 0.41 0.00 0.15 -1.26 -4.41 113.70 107.62 3h4v s SER 111 Ca 0.63 0.38 -0.09 0.00 0.70 0.00 0.00 55.95 57.57 3h4v s SER 111 Cb -0.55 1.26 -0.06 0.00 -1.71 0.00 0.00 66.02 64.97 3h4v s SER 111 CO 0.57 -0.06 0.75 -0.94 1.20 0.00 0.00 173.24 174.76 3h4v s SER 112 N 1.94 6.45 -0.29 5.45 1.04 -1.26 -5.04 113.70 121.99 3h4v s SER 112 Ca -0.03 1.04 0.03 0.00 0.48 0.00 0.00 55.95 57.47 3h4v s SER 112 Cb -0.03 -2.28 0.20 0.00 0.10 0.00 0.00 66.02 64.00 3h4v s SER 112 CO -0.15 -0.41 0.65 0.12 0.98 0.00 0.00 173.24 174.42 3h4v s PHE 113 N -2.42 -1.69 -0.06 5.02 5.36 -1.26 -4.90 117.98 118.03 3h4v s PHE 113 Ca 0.49 1.04 -0.30 0.00 -0.96 0.00 0.00 56.93 57.20 3h4v s PHE 113 Cb -0.10 0.31 0.11 0.00 -0.34 0.00 0.00 43.02 43.00 3h4v s PHE 113 CO 0.34 -0.98 0.93 1.52 -1.46 0.00 0.00 175.22 175.58 3h4v s TYR 114 N 2.85 -0.35 0.28 10.12 -0.85 -1.26 -5.15 117.35 122.98 3h4v s TYR 114 Ca 0.13 0.35 -0.30 0.00 -0.52 0.00 0.00 57.07 56.73 3h4v s TYR 114 Cb -0.09 0.51 -0.10 0.00 0.38 0.00 0.00 41.96 42.65 3h4v s TYR 114 CO -0.25 -0.47 1.46 -2.14 -1.52 0.00 0.00 175.55 172.63 3h4v s PRO 115 N -2.44 4.23 -0.62 -3.49 0.02 -1.26 -4.77 135.00 126.67 3h4v s PRO 115 Ca 0.03 2.37 0.05 0.00 0.02 0.00 0.00 61.00 63.47 3h4v s PRO 115 Cb -0.01 -3.08 0.20 0.00 0.02 0.00 0.00 34.50 31.63 3h4v s PRO 115 CO -0.05 -0.45 0.55 0.25 -0.33 0.00 0.00 177.00 176.97 3h4v n THR 116 N 2.00 1.27 -1.93 0.99 -2.24 0.19 -4.95 114.28 109.60 3h4v n THR 116 Ca 0.06 -4.71 -0.39 0.00 -2.27 0.00 0.00 64.05 56.75 3h4v n THR 116 Cb 0.40 -2.07 0.02 0.00 -2.10 0.00 0.00 70.33 66.57 3h4v n THR 116 CO 0.00 0.00 0.00 -2.84 -0.57 0.00 0.00 175.07 171.66 3h4v s PRO 117 N -1.53 3.53 0.15 -0.78 0.02 -1.15 -4.04 135.00 131.20 3h4v s PRO 117 Ca 0.31 2.16 0.00 0.00 0.02 0.00 0.00 61.00 63.49 3h4v s PRO 117 Cb 0.04 -2.46 -0.03 0.00 0.02 0.00 0.00 34.50 32.07 3h4v s PRO 117 CO -0.12 -0.85 1.36 -0.07 -0.33 0.00 0.00 177.00 176.98 3h4v h LEU 118 N 1.98 0.36 -8.79 -5.54 3.38 -2.00 -3.47 115.31 101.23 3h4v h LEU 118 Ca -0.50 -0.28 -0.53 0.00 0.09 0.00 0.00 57.88 56.65 3h4v h LEU 118 Cb 1.27 -0.11 -0.19 0.00 0.09 0.00 0.00 40.66 41.72 3h4v h LEU 118 CO 0.60 1.08 -0.79 -0.76 0.09 0.00 0.00 178.44 178.65 3h4v s LEU 119 N -7.55 2.40 0.00 1.67 1.43 -1.26 -5.16 118.68 110.21 3h4v s LEU 119 Ca -0.04 -0.82 0.00 0.00 -1.03 0.00 0.00 54.13 52.24 3h4v s LEU 119 Cb 0.10 -0.85 0.00 0.00 0.03 0.00 0.00 46.19 45.47 3h4v s LEU 119 CO 0.84 -0.01 0.00 -1.14 0.23 0.00 0.00 176.35 176.27 3h4v n ARG 120 N 0.50 0.89 -0.85 1.70 0.63 -1.26 -5.17 116.66 113.10 3h4v n ARG 120 Ca -0.15 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.78 3h4v n ARG 120 Cb 0.56 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.47 3h4v n ARG 120 CO 0.00 0.00 0.00 0.27 -2.51 0.00 0.00 177.63 175.39 3h4v n ASN 121 N -1.82 0.00 -0.92 6.15 0.23 -1.26 -5.19 115.26 112.46 3h4v n ASN 121 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.05 3h4v n ASN 121 Cb 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 37.70 3h4v n ASN 121 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3h4v n GLY 131 N -0.06 0.00 0.15 4.83 0.00 -1.26 -5.31 105.19 103.54 3h4v n GLY 131 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3h4v n GLY 131 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3h4v n ASP 132 N 0.47 0.00 0.00 1.61 9.92 -1.26 0.84 116.55 128.13 3h4v n ASP 132 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.26 3h4v n ASP 132 Cb 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.48 3h4v n ASP 132 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 3h4v n ARG 133 N -0.20 0.00 0.01 -1.24 1.74 -1.26 -4.65 116.66 111.05 3h4v n ARG 133 Ca 0.00 0.00 -0.01 0.00 -0.77 0.00 0.00 57.85 57.07 3h4v n ARG 133 Cb 0.00 -0.02 -0.00 0.00 -1.02 0.00 0.00 32.46 31.42 3h4v n ARG 133 CO 0.00 0.00 0.00 1.49 -1.52 0.00 0.00 177.63 177.60 3h4v h GLU 134 N 0.00 -0.06 -0.10 5.56 4.81 0.01 -2.73 114.58 122.07 3h4v h GLU 134 Ca 0.00 0.00 0.01 0.00 -0.13 0.00 0.00 59.36 59.24 3h4v h GLU 134 Cb 0.05 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.43 3h4v h GLU 134 CO 0.00 -0.04 -0.06 0.00 -0.73 0.00 0.00 179.01 178.18 3h4v n ALA 135 N -2.30 -0.06 -0.15 2.92 0.00 0.15 0.16 120.51 121.24 3h4v n ALA 135 Ca -0.01 0.08 -0.04 0.00 0.00 0.00 0.00 53.44 53.48 3h4v n ALA 135 Cb 0.02 -0.01 0.03 0.00 0.00 0.00 0.00 19.45 19.49 3h4v n ALA 135 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 177.50 179.48 3h4v h MET 136 N 0.00 -0.05 0.01 0.00 1.85 -1.72 0.23 114.93 115.26 3h4v h MET 136 Ca 0.02 0.00 -0.20 0.00 -0.61 0.00 0.00 59.70 58.91 3h4v h MET 136 Cb 0.04 0.01 -0.01 0.00 0.43 0.00 0.00 31.60 32.07 3h4v h MET 136 CO -0.09 -0.03 -0.91 1.49 -0.40 0.00 0.00 176.91 176.96 3h4v h GLU 137 N -0.05 0.16 0.02 0.39 4.57 0.20 -2.54 114.58 117.33 3h4v h GLU 137 Ca 0.22 -0.19 -0.24 0.00 -1.18 0.00 0.00 59.36 57.98 3h4v h GLU 137 Cb 0.39 0.06 -0.03 0.00 -0.16 0.00 0.00 28.75 29.01 3h4v h GLU 137 CO -0.51 0.96 -1.18 1.79 -1.18 0.00 0.00 179.01 178.90 3h4v h THR 138 N 0.08 1.51 -0.55 0.32 1.35 0.76 -2.90 112.91 113.49 3h4v h THR 138 Ca -0.04 -3.22 0.01 0.00 -0.55 0.00 0.00 66.41 62.60 3h4v h THR 138 Cb 1.56 2.78 -0.03 0.00 -1.73 0.00 0.00 68.15 70.74 3h4v h THR 138 CO 0.14 0.88 0.36 0.00 -0.25 0.00 0.00 175.52 176.65 3h4v h ALA 139 N 0.91 0.69 -0.12 6.62 0.00 -0.43 -0.74 119.26 126.20 3h4v h ALA 139 Ca -0.09 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 3h4v h ALA 139 Cb 1.85 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 19.42 3h4v h ALA 139 CO 0.13 0.13 0.04 1.15 0.00 0.00 0.00 179.25 180.71 3h4v h THR 140 N 0.74 1.16 -0.47 0.00 2.02 -1.47 0.03 112.91 114.91 3h4v h THR 140 Ca 0.20 -0.47 -0.13 0.00 0.77 0.00 0.00 66.41 66.78 3h4v h THR 140 Cb -0.08 1.25 -0.01 0.00 -1.74 0.00 0.00 68.15 67.57 3h4v h THR 140 CO -0.05 0.14 -0.23 0.00 0.37 0.00 0.00 175.52 175.76 3h4v h ALA 141 N 0.88 0.70 -0.09 6.16 0.00 -1.48 -1.48 119.26 123.95 3h4v h ALA 141 Ca 0.04 -0.39 -0.06 0.00 0.00 0.00 0.00 54.91 54.50 3h4v h ALA 141 Cb 0.18 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.81 3h4v h ALA 141 CO -0.00 0.67 -0.17 0.22 0.00 0.00 0.00 179.25 179.97 3h4v h ASP 142 N 0.84 0.31 -0.03 0.00 3.58 -1.05 0.14 116.42 120.21 3h4v h ASP 142 Ca 0.11 -0.56 -0.01 0.00 0.42 0.00 0.00 57.03 56.99 3h4v h ASP 142 Cb 0.80 -0.09 -0.00 0.00 1.72 0.00 0.00 39.33 41.76 3h4v h ASP 142 CO 0.07 0.81 -0.02 -0.07 -2.88 0.00 0.00 179.24 177.15 3h4v h LEU 143 N -0.18 0.07 -1.06 2.28 3.38 -1.03 -2.38 115.31 116.38 3h4v h LEU 143 Ca 0.00 -0.45 -0.08 0.00 0.09 0.00 0.00 57.88 57.44 3h4v h LEU 143 Cb 0.76 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.47 3h4v h LEU 143 CO 0.04 0.50 -0.19 -0.26 0.09 0.00 0.00 178.44 178.63 3h4v h PHE 144 N -0.37 0.48 0.12 1.13 0.04 -1.39 -2.75 116.94 114.21 3h4v h PHE 144 Ca 0.01 -0.08 -0.01 0.00 2.80 0.00 0.00 57.97 60.68 3h4v h PHE 144 Cb 0.48 -0.13 0.00 0.00 2.20 0.00 0.00 35.95 38.51 3h4v h PHE 144 CO 0.08 0.61 -0.06 0.78 -0.60 0.00 0.00 178.31 179.12 3h4v h GLY 145 N 0.96 -0.17 1.13 -1.45 0.00 -0.94 0.36 103.07 102.95 3h4v h GLY 145 Ca 0.07 0.06 -0.20 0.00 0.00 0.00 0.00 47.33 47.27 3h4v h GLY 145 CO 0.04 -0.06 -0.62 1.48 0.00 0.00 0.00 176.54 177.37 3h4v h SER 146 N -0.52 0.94 1.17 0.19 4.64 -1.19 0.59 113.55 119.37 3h4v h SER 146 Ca -0.02 -0.58 -0.08 0.00 -0.47 0.00 0.00 61.79 60.65 3h4v h SER 146 Cb 0.42 -0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 62.22 3h4v h SER 146 CO 0.03 1.35 -0.86 0.78 -0.87 0.00 0.00 176.83 177.25 3h4v h ASN 147 N 0.57 0.00 0.00 4.97 2.35 -1.58 -3.41 115.58 118.49 3h4v h ASN 147 Ca -0.01 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.74 3h4v h ASN 147 Cb 1.24 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.61 3h4v h ASN 147 CO 0.13 0.29 0.00 0.00 -1.65 0.00 0.00 177.43 176.20 3h4v n ALA 148 N -2.24 2.42 -0.11 -0.83 0.00 -0.65 -4.47 120.51 114.63 3h4v n ALA 148 Ca -0.02 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.30 3h4v n ALA 148 Cb 0.68 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.09 3h4v n ALA 148 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 3h4v h ILE 149 N 0.00 1.29 -0.07 0.00 1.08 -0.15 -2.37 117.51 117.29 3h4v h ILE 149 Ca 0.00 -1.38 -0.01 0.00 -0.39 0.00 0.00 64.86 63.09 3h4v h ILE 149 Cb 0.00 1.46 -0.00 0.00 -3.07 0.00 0.00 36.82 35.21 3h4v h ILE 149 CO 0.00 0.45 0.02 0.00 -0.69 0.00 0.00 178.15 177.93 3h4v h ALA 150 N 0.75 0.09 -0.74 1.87 0.00 -0.02 -2.24 119.26 118.98 3h4v h ALA 150 Ca 0.06 -0.12 0.15 0.00 0.00 0.00 0.00 54.91 55.00 3h4v h ALA 150 Cb 0.79 -0.03 -0.14 0.00 0.00 0.00 0.00 17.79 18.41 3h4v h ALA 150 CO 0.06 -0.29 -0.19 -1.35 0.00 0.00 0.00 179.25 177.49 3h4v h PRO 151 N -0.09 -0.00 -0.39 0.00 0.11 -1.74 0.48 132.00 130.37 3h4v h PRO 151 Ca 0.02 0.00 0.07 0.00 0.11 0.00 0.00 66.00 66.20 3h4v h PRO 151 Cb 0.23 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 31.29 3h4v h PRO 151 CO -0.00 -0.00 0.04 -0.92 -0.21 0.00 0.00 178.00 176.91 3h4v h TYR 152 N -0.00 0.05 -0.20 0.65 3.20 -0.97 0.17 116.97 119.86 3h4v h TYR 152 Ca 0.35 0.03 -0.11 0.00 3.14 0.00 0.00 58.73 62.14 3h4v h TYR 152 Cb 0.54 0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.83 3h4v h TYR 152 CO -0.59 -0.03 -0.33 0.74 -1.64 0.00 0.00 178.16 176.30 3h4v h PHE 153 N 0.15 0.48 -0.20 -3.82 0.04 -0.72 -0.17 116.94 112.71 3h4v h PHE 153 Ca 0.19 -0.12 -0.04 0.00 2.80 0.00 0.00 57.97 60.80 3h4v h PHE 153 Cb 0.25 -0.11 -0.01 0.00 2.20 0.00 0.00 35.95 38.28 3h4v h PHE 153 CO -0.23 0.71 -0.02 -0.07 -0.60 0.00 0.00 178.31 178.10 3h4v h LEU 154 N 0.36 0.36 -0.85 1.54 3.38 -0.25 -0.74 115.31 119.11 3h4v h LEU 154 Ca 0.04 -0.34 0.02 0.00 0.09 0.00 0.00 57.88 57.70 3h4v h LEU 154 Cb 0.76 -0.10 -0.05 0.00 0.09 0.00 0.00 40.66 41.37 3h4v h LEU 154 CO 0.06 0.61 0.56 0.40 0.09 0.00 0.00 178.44 180.16 3h4v h ILE 155 N 0.10 1.17 0.12 1.22 2.04 -0.46 -1.21 117.51 120.51 3h4v h ILE 155 Ca 0.05 -0.38 -0.00 0.00 1.00 0.00 0.00 64.86 65.53 3h4v h ILE 155 Cb 0.44 -0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 36.48 3h4v h ILE 155 CO 0.01 0.20 -0.09 0.50 0.00 0.00 0.00 178.15 178.77 3h4v h LYS 156 N 1.11 -0.21 0.15 2.37 3.64 -0.77 -1.27 116.57 121.59 3h4v h LYS 156 Ca 0.33 0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.74 3h4v h LYS 156 Cb -0.06 0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 31.79 3h4v h LYS 156 CO -0.09 -0.14 -0.23 0.00 -2.27 0.00 0.00 179.45 176.71 3h4v h ALA 157 N 0.65 -0.42 -0.67 5.00 0.00 -0.86 -1.10 119.26 121.86 3h4v h ALA 157 Ca -0.00 -0.05 0.14 0.00 0.00 0.00 0.00 54.91 54.99 3h4v h ALA 157 Cb 0.20 0.36 -0.13 0.00 0.00 0.00 0.00 17.79 18.22 3h4v h ALA 157 CO -0.01 -0.77 -0.15 0.35 0.00 0.00 0.00 179.25 178.67 3h4v h PHE 158 N -0.45 -0.32 -0.20 0.00 3.04 -1.23 -2.15 116.94 115.63 3h4v h PHE 158 Ca 0.02 0.06 -0.06 0.00 3.98 0.00 0.00 57.97 61.97 3h4v h PHE 158 Cb 0.45 0.24 -0.00 0.00 2.56 0.00 0.00 35.95 39.20 3h4v h PHE 158 CO -0.20 -0.28 -0.11 0.00 -2.02 0.00 0.00 178.31 175.70 3h4v h ALA 159 N 1.66 0.28 -0.86 2.41 0.00 -1.07 -2.65 119.26 119.02 3h4v h ALA 159 Ca 0.33 -0.30 0.22 0.00 0.00 0.00 0.00 54.91 55.15 3h4v h ALA 159 Cb 0.50 -0.07 -0.13 0.00 0.00 0.00 0.00 17.79 18.10 3h4v h ALA 159 CO -0.67 0.13 0.29 0.45 0.00 0.00 0.00 179.25 179.44 3h4v h HIS 160 N 0.11 0.46 -0.04 0.00 3.86 -0.99 0.31 115.15 118.85 3h4v h HIS 160 Ca 0.04 0.05 -0.21 0.00 -1.16 0.00 0.00 60.37 59.09 3h4v h HIS 160 Cb 0.61 -0.07 0.00 0.00 1.06 0.00 0.00 27.41 29.02 3h4v h HIS 160 CO 0.07 -0.13 -0.84 0.00 0.86 0.00 0.00 177.93 177.89 3h4v h ARG 161 N 0.29 0.44 0.40 2.45 2.47 -1.26 -0.41 114.38 118.77 3h4v h ARG 161 Ca 0.53 -0.42 -0.02 0.00 -1.26 0.00 0.00 59.98 58.82 3h4v h ARG 161 Cb 1.03 0.10 0.00 0.00 -1.65 0.00 0.00 29.97 29.46 3h4v h ARG 161 CO -0.58 1.07 -0.19 0.28 0.56 0.00 0.00 179.97 181.10 3h4v h VAL 162 N 0.27 0.60 -0.98 2.04 2.07 -1.20 -2.24 116.25 116.82 3h4v h VAL 162 Ca -0.06 -0.26 0.19 0.00 0.82 0.00 0.00 66.70 67.39 3h4v h VAL 162 Cb 1.46 0.73 -0.09 0.00 -1.52 0.00 0.00 31.29 31.86 3h4v h VAL 162 CO 0.15 0.05 0.61 0.00 0.02 0.00 0.00 177.57 178.40 3h4v h ALA 163 N -0.15 1.82 0.00 1.67 0.00 -0.33 -0.45 119.26 121.81 3h4v h ALA 163 Ca -0.06 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3h4v h ALA 163 Cb 0.49 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.20 3h4v h ALA 163 CO 0.09 -0.15 0.00 0.41 0.00 0.00 0.00 179.25 179.60 3h4v n GLY 164 N -1.39 -1.42 3.66 0.00 0.00 -0.17 -4.74 105.19 101.14 3h4v n GLY 164 Ca 0.22 0.01 -0.41 0.00 0.00 0.00 0.00 46.02 45.83 3h4v n GLY 164 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3h4v s THR 165 N -3.17 4.88 0.20 2.61 2.01 -0.18 -5.02 115.64 116.97 3h4v s THR 165 Ca 0.08 1.59 -0.33 0.00 0.31 0.00 0.00 61.69 63.34 3h4v s THR 165 Cb 0.11 -4.12 -0.14 0.00 0.01 0.00 0.00 72.50 68.37 3h4v s THR 165 CO 0.46 0.01 1.50 -2.65 -0.69 0.00 0.00 174.62 173.25 3h4v n PRO 166 N 5.40 2.12 0.06 4.92 -0.02 -1.26 -4.78 135.00 141.43 3h4v n PRO 166 Ca 0.04 0.76 0.20 0.00 -2.02 0.00 0.00 63.50 62.48 3h4v n PRO 166 Cb 0.49 -2.48 0.59 0.00 -0.02 0.00 0.00 33.50 32.08 3h4v n PRO 166 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3h4v h ALA 167 N 5.10 2.25 0.00 3.55 0.00 -1.93 0.69 119.26 128.91 3h4v h ALA 167 Ca -0.45 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.44 3h4v h ALA 167 Cb 1.26 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.09 3h4v h ALA 167 CO 0.82 -0.98 0.00 1.57 0.00 0.00 0.00 179.25 180.66 3h4v h LYS 168 N 0.00 0.00 -0.24 0.00 2.10 -2.02 -3.12 116.57 113.29 3h4v h LYS 168 Ca 0.24 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.88 3h4v h LYS 168 Cb 1.68 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 33.01 3h4v h LYS 168 CO -0.00 0.00 -0.00 0.72 -2.00 0.00 0.00 179.45 178.17 3h4v n HIS 169 N -2.90 0.86 -3.51 0.07 8.25 0.24 -5.03 115.22 113.20 3h4v n HIS 169 Ca 0.02 -0.91 -0.35 0.00 -0.26 0.00 0.00 57.72 56.22 3h4v n HIS 169 Cb 0.38 -0.30 -0.06 0.00 1.12 0.00 0.00 29.99 31.13 3h4v n HIS 169 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 3h4v s ARG 170 N -2.85 3.84 1.06 -0.41 0.52 -1.18 -4.92 118.95 115.01 3h4v s ARG 170 Ca 0.41 0.29 -0.14 0.00 -0.52 0.00 0.00 55.73 55.77 3h4v s ARG 170 Cb 0.34 -3.02 0.22 0.00 0.52 0.00 0.00 34.95 33.01 3h4v s ARG 170 CO 0.08 0.56 1.09 0.20 0.02 0.00 0.00 175.30 177.25 3h4v s GLY 171 N -1.65 1.56 0.00 -3.53 0.00 -1.26 -4.98 107.32 97.46 3h4v s GLY 171 Ca 0.33 -0.52 0.02 0.00 0.00 0.00 0.00 44.72 44.56 3h4v s GLY 171 CO 0.18 0.18 0.54 -1.30 0.00 0.00 0.00 173.10 172.69 3h4v n THR 172 N -4.38 0.00 -3.11 0.90 -2.24 -1.26 -4.78 114.28 99.42 3h4v n THR 172 Ca 0.07 -0.50 -0.17 0.00 -2.27 0.00 0.00 64.05 61.18 3h4v n THR 172 Cb 0.58 1.05 -0.01 0.00 -2.10 0.00 0.00 70.33 69.84 3h4v n THR 172 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 3h4v n ASN 173 N 0.05 0.16 -4.69 3.42 5.15 -1.26 -5.09 115.26 113.00 3h4v n ASN 173 Ca 0.01 -3.10 -0.42 0.00 -0.60 0.00 0.00 54.58 50.47 3h4v n ASN 173 Cb 0.06 -0.15 -0.03 0.00 -0.53 0.00 0.00 39.78 39.13 3h4v n ASN 173 CO 0.00 0.00 0.00 -0.31 1.40 0.00 0.00 177.26 178.35 3h4v s TYR 174 N -1.80 3.17 -0.01 1.20 2.02 -1.26 -4.78 117.35 115.90 3h4v s TYR 174 Ca 0.36 1.21 0.00 0.00 -0.37 0.00 0.00 57.07 58.27 3h4v s TYR 174 Cb 0.32 -3.42 0.02 0.00 -0.40 0.00 0.00 41.96 38.47 3h4v s TYR 174 CO -0.08 -1.33 0.02 0.45 -1.57 0.00 0.00 175.55 173.04 3h4v s SER 175 N 1.50 0.07 -0.07 2.29 0.15 -0.05 -2.34 113.70 115.25 3h4v s SER 175 Ca 0.56 0.02 0.04 0.00 0.70 0.00 0.00 55.95 57.26 3h4v s SER 175 Cb -0.24 -0.05 0.00 0.00 -1.71 0.00 0.00 66.02 64.02 3h4v s SER 175 CO 0.21 -0.08 -0.19 -0.63 1.20 0.00 0.00 173.24 173.76 3h4v s ILE 176 N 0.64 1.64 -0.10 6.45 1.01 0.61 -1.25 121.20 130.19 3h4v s ILE 176 Ca -0.05 -0.79 0.02 0.00 0.00 0.00 0.00 60.65 59.83 3h4v s ILE 176 Cb -0.08 -1.43 0.01 0.00 0.01 0.00 0.00 42.46 40.98 3h4v s ILE 176 CO -0.02 0.47 -0.18 -0.63 0.00 0.00 0.00 174.94 174.58 3h4v s ILE 177 N 0.31 1.64 -0.19 2.92 -1.09 0.10 -1.58 121.20 123.32 3h4v s ILE 177 Ca -0.13 -0.75 -0.03 0.00 -2.23 0.00 0.00 60.65 57.51 3h4v s ILE 177 Cb -0.15 -1.47 -0.02 0.00 -1.58 0.00 0.00 42.46 39.24 3h4v s ILE 177 CO 0.05 0.47 -0.05 0.20 -1.23 0.00 0.00 174.94 174.38 3h4v s ASN 178 N 0.77 4.42 -0.55 3.58 0.01 -0.31 0.48 114.94 123.35 3h4v s ASN 178 Ca -0.11 -0.30 -0.27 0.00 -0.71 0.00 0.00 52.86 51.47 3h4v s ASN 178 Cb -0.16 -1.74 0.03 0.00 0.41 0.00 0.00 41.25 39.80 3h4v s ASN 178 CO 0.01 0.06 1.09 -0.04 -1.51 0.00 0.00 177.10 176.71 3h4v s MET 179 N 1.02 3.47 0.00 -0.60 -1.94 -0.48 -1.88 119.30 118.89 3h4v s MET 179 Ca 0.00 0.09 0.00 0.00 -1.71 0.00 0.00 55.69 54.08 3h4v s MET 179 Cb -0.15 -4.01 0.00 0.00 2.01 0.00 0.00 34.83 32.68 3h4v s MET 179 CO 0.00 -1.56 0.00 1.33 -0.01 0.00 0.00 175.02 174.78 3h4v n VAL 180 N 6.51 0.00 -3.64 -6.03 0.24 -0.39 -4.90 118.33 110.12 3h4v n VAL 180 Ca 0.06 0.00 -0.20 0.00 -2.04 0.00 0.00 64.34 62.16 3h4v n VAL 180 Cb 0.48 -0.47 -0.17 0.00 -1.47 0.00 0.00 33.84 32.22 3h4v n VAL 180 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 3h4v s ASP 181 N -0.87 1.32 0.62 -1.34 -1.08 -1.26 -4.07 116.67 109.99 3h4v s ASP 181 Ca 0.00 -0.03 0.31 0.00 -0.52 0.00 0.00 52.55 52.31 3h4v s ASP 181 Cb 0.00 -0.02 1.68 0.00 -1.46 0.00 0.00 42.92 43.13 3h4v s ASP 181 CO 0.00 -0.28 2.03 0.00 0.52 0.00 0.00 175.17 177.44 3h4v h ALA 182 N 8.41 1.68 -0.47 3.66 0.00 -1.24 -3.27 119.26 128.02 3h4v h ALA 182 Ca -0.13 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.77 3h4v h ALA 182 Cb 1.13 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.93 3h4v h ALA 182 CO 0.19 -0.38 0.00 -1.33 0.00 0.00 0.00 179.25 177.73 3h4v n MET 183 N -3.45 3.20 0.04 0.00 2.81 -1.26 -4.59 117.12 113.87 3h4v n MET 183 Ca 0.02 -2.58 0.12 0.00 -1.81 0.00 0.00 57.70 53.44 3h4v n MET 183 Cb 0.40 -1.65 0.11 0.00 -0.71 0.00 0.00 33.22 31.37 3h4v n MET 183 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 3h4v n THR 184 N 0.62 0.24 0.56 2.03 -2.24 -1.24 -1.99 114.28 112.27 3h4v n THR 184 Ca 0.20 -0.24 0.08 0.00 -2.27 0.00 0.00 64.05 61.83 3h4v n THR 184 Cb 0.71 0.05 0.36 0.00 -2.10 0.00 0.00 70.33 69.36 3h4v n THR 184 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3h4v n ASN 185 N -1.99 0.04 -3.65 3.42 4.13 -1.26 -3.48 115.26 112.46 3h4v n ASN 185 Ca 0.03 0.51 -0.27 0.00 1.68 0.00 0.00 54.58 56.52 3h4v n ASN 185 Cb 0.43 -0.52 -0.10 0.00 -1.54 0.00 0.00 39.78 38.05 3h4v n ASN 185 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3h4v n GLN 186 N -1.54 1.64 -2.14 3.52 6.02 -0.84 -5.10 117.38 118.95 3h4v n GLN 186 Ca 0.04 -4.22 -0.37 0.00 -0.01 0.00 0.00 57.00 52.43 3h4v n GLN 186 Cb 0.20 -2.10 0.00 0.00 1.02 0.00 0.00 30.24 29.36 3h4v n GLN 186 CO 0.00 0.00 0.00 -2.14 -1.01 0.00 0.00 177.06 173.91 3h4v s PRO 187 N -1.44 3.56 -0.07 -1.09 0.02 -1.23 -4.91 135.00 129.84 3h4v s PRO 187 Ca 0.31 1.87 -0.30 0.00 0.02 0.00 0.00 61.00 62.90 3h4v s PRO 187 Cb 0.03 -2.33 -0.02 0.00 0.02 0.00 0.00 34.50 32.21 3h4v s PRO 187 CO -0.13 -0.75 1.01 -1.17 -0.33 0.00 0.00 177.00 175.63 3h4v s LEU 188 N -3.23 4.29 0.07 -5.54 2.96 -1.26 -4.97 118.68 110.99 3h4v s LEU 188 Ca 0.67 1.58 -0.31 0.00 -0.22 0.00 0.00 54.13 55.85 3h4v s LEU 188 Cb -0.31 -3.56 -0.10 0.00 0.50 0.00 0.00 46.19 42.72 3h4v s LEU 188 CO 0.37 -0.40 1.90 -0.11 -1.32 0.00 0.00 176.35 176.79 3h4v n LEU 189 N 4.67 4.03 0.00 -0.68 7.94 -1.26 -2.48 117.00 129.23 3h4v n LEU 189 Ca 0.08 0.95 0.00 0.00 -1.11 0.00 0.00 56.01 55.93 3h4v n LEU 189 Cb 0.49 -1.52 0.00 0.00 0.53 0.00 0.00 43.42 42.92 3h4v n LEU 189 CO 0.52 0.16 0.00 0.61 -1.11 0.00 0.00 177.39 177.57 3h4v n GLY 190 N 4.37 0.71 2.55 -3.96 0.00 -1.26 -4.98 105.19 102.63 3h4v n GLY 190 Ca 0.19 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.91 3h4v n GLY 190 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3h4v n TYR 191 N -2.08 3.26 -0.05 1.61 4.02 -1.03 0.54 117.16 123.42 3h4v n TYR 191 Ca 0.00 -2.85 -0.11 0.00 -0.01 0.00 0.00 57.90 54.92 3h4v n TYR 191 Cb 0.00 -0.41 -0.05 0.00 -0.02 0.00 0.00 39.34 38.85 3h4v n TYR 191 CO 0.00 0.00 0.00 1.15 -1.01 0.00 0.00 176.86 177.00 3h4v h THR 192 N 2.36 1.22 -0.45 -0.72 2.02 -1.83 -0.74 112.91 114.77 3h4v h THR 192 Ca 0.38 -0.72 -0.04 0.00 0.77 0.00 0.00 66.41 66.80 3h4v h THR 192 Cb 0.73 1.37 -0.02 0.00 -1.74 0.00 0.00 68.15 68.49 3h4v h THR 192 CO 1.01 0.22 0.11 0.40 0.37 0.00 0.00 175.52 177.63 3h4v h ILE 193 N 0.07 1.23 -0.38 3.11 1.08 -1.90 0.77 117.51 121.49 3h4v h ILE 193 Ca 0.05 -0.81 0.05 0.00 -0.39 0.00 0.00 64.86 63.76 3h4v h ILE 193 Cb 0.30 0.90 -0.04 0.00 -3.07 0.00 0.00 36.82 34.91 3h4v h ILE 193 CO 0.00 0.29 0.13 0.22 -0.69 0.00 0.00 178.15 178.10 3h4v h TYR 194 N 0.60 0.24 -0.77 1.37 3.20 -1.80 0.86 116.97 120.66 3h4v h TYR 194 Ca 0.14 0.02 -0.04 0.00 3.14 0.00 0.00 58.73 61.99 3h4v h TYR 194 Cb 0.32 -0.05 -0.03 0.00 1.54 0.00 0.00 36.73 38.50 3h4v h TYR 194 CO 0.02 0.09 0.33 1.15 -1.64 0.00 0.00 178.16 178.11 3h4v h THR 195 N 0.29 1.25 -0.01 1.81 2.02 -0.65 -0.88 112.91 116.74 3h4v h THR 195 Ca 0.18 -0.77 -0.00 0.00 0.77 0.00 0.00 66.41 66.59 3h4v h THR 195 Cb 0.16 0.33 -0.00 0.00 -1.74 0.00 0.00 68.15 66.89 3h4v h THR 195 CO -0.18 0.32 0.00 0.24 0.37 0.00 0.00 175.52 176.27 3h4v h MET 196 N 1.10 0.01 -0.59 6.66 2.86 -0.60 -1.59 114.93 122.78 3h4v h MET 196 Ca 0.26 -0.00 0.11 0.00 -2.06 0.00 0.00 59.70 58.01 3h4v h MET 196 Cb 0.18 -0.00 -0.09 0.00 0.06 0.00 0.00 31.60 31.75 3h4v h MET 196 CO -0.03 0.19 0.10 0.00 1.06 0.00 0.00 176.91 178.23 3h4v h ALA 197 N 0.82 0.67 -0.91 6.32 0.00 -0.34 0.77 119.26 126.59 3h4v h ALA 197 Ca 0.00 0.14 0.01 0.00 0.00 0.00 0.00 54.91 55.06 3h4v h ALA 197 Cb 0.18 0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.12 3h4v h ALA 197 CO -0.00 -0.32 0.59 0.87 0.00 0.00 0.00 179.25 180.38 3h4v h LYS 198 N 0.23 1.20 -0.89 0.00 1.79 -1.07 0.73 116.57 118.56 3h4v h LYS 198 Ca 0.31 -0.08 0.00 0.00 -2.18 0.00 0.00 60.65 58.70 3h4v h LYS 198 Cb 0.46 -0.27 -0.04 0.00 -1.58 0.00 0.00 32.23 30.80 3h4v h LYS 198 CO -0.41 0.81 0.57 0.78 -1.08 0.00 0.00 179.45 180.11 3h4v h GLY 199 N 1.23 1.27 1.01 3.86 0.00 -0.47 -0.22 103.07 109.74 3h4v h GLY 199 Ca 0.33 -0.49 -0.01 0.00 0.00 0.00 0.00 47.33 47.16 3h4v h GLY 199 CO -0.07 0.48 0.43 0.00 0.00 0.00 0.00 176.54 177.38 3h4v h ALA 200 N 1.42 0.95 -0.56 3.60 0.00 -0.21 -2.45 119.26 122.02 3h4v h ALA 200 Ca 0.32 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 55.10 3h4v h ALA 200 Cb -0.11 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.36 3h4v h ALA 200 CO -0.07 0.44 0.21 1.25 0.00 0.00 0.00 179.25 181.08 3h4v h LEU 201 N 1.02 0.74 -0.62 0.00 5.85 -0.38 -1.50 115.31 120.42 3h4v h LEU 201 Ca 0.26 -0.10 -0.03 0.00 0.84 0.00 0.00 57.88 58.86 3h4v h LEU 201 Cb -0.00 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 40.81 3h4v h LEU 201 CO -0.05 0.68 0.29 -0.33 -0.34 0.00 0.00 178.44 178.69 3h4v h GLU 202 N 0.80 0.90 -0.27 1.25 5.08 -0.87 -1.13 114.58 120.34 3h4v h GLU 202 Ca 0.19 -0.14 0.04 0.00 -1.00 0.00 0.00 59.36 58.45 3h4v h GLU 202 Cb 0.18 -0.16 -0.04 0.00 0.50 0.00 0.00 28.75 29.23 3h4v h GLU 202 CO -0.02 0.73 0.04 0.78 -1.00 0.00 0.00 179.01 179.54 3h4v h GLY 203 N 0.86 0.30 0.68 -3.84 0.00 -1.18 -2.22 103.07 97.66 3h4v h GLY 203 Ca 0.21 -0.00 0.06 0.00 0.00 0.00 0.00 47.33 47.60 3h4v h GLY 203 CO -0.03 -0.03 0.40 -2.00 0.00 0.00 0.00 176.54 174.89 3h4v h LEU 204 N 0.13 0.59 -0.02 3.11 5.85 -0.99 -0.17 115.31 123.81 3h4v h LEU 204 Ca 0.13 0.03 0.03 0.00 0.84 0.00 0.00 57.88 58.91 3h4v h LEU 204 Cb 0.14 -0.09 -0.05 0.00 0.37 0.00 0.00 40.66 41.03 3h4v h LEU 204 CO -0.18 0.38 -0.31 0.74 -0.34 0.00 0.00 178.44 178.73 3h4v h THR 205 N 0.73 0.33 0.42 1.05 2.02 -0.64 0.19 112.91 117.00 3h4v h THR 205 Ca 0.31 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.47 3h4v h THR 205 Cb 0.19 0.33 0.00 0.00 -1.74 0.00 0.00 68.15 66.93 3h4v h THR 205 CO -0.18 0.00 -0.20 0.03 0.37 0.00 0.00 175.52 175.53 3h4v h ARG 206 N -0.44 -0.55 -0.26 6.66 3.08 -1.10 -1.44 114.38 120.33 3h4v h ARG 206 Ca 0.07 0.04 0.05 0.00 0.07 0.00 0.00 59.98 60.20 3h4v h ARG 206 Cb 0.54 0.12 -0.04 0.00 0.08 0.00 0.00 29.97 30.67 3h4v h ARG 206 CO -0.27 -0.29 -0.02 1.03 -1.07 0.00 0.00 179.97 179.35 3h4v h SER 207 N -0.72 -0.15 0.13 7.04 0.87 -1.00 -2.23 113.55 117.50 3h4v h SER 207 Ca -0.06 0.06 -0.13 0.00 -1.23 0.00 0.00 61.79 60.44 3h4v h SER 207 Cb 0.51 0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 62.59 3h4v h SER 207 CO 0.10 -0.04 -0.45 0.00 -0.53 0.00 0.00 176.83 175.91 3h4v h ALA 208 N 1.24 0.94 -0.92 6.23 0.00 -0.63 -2.07 119.26 124.05 3h4v h ALA 208 Ca 0.13 -0.45 0.03 0.00 0.00 0.00 0.00 54.91 54.61 3h4v h ALA 208 Cb 0.17 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 17.82 3h4v h ALA 208 CO -0.23 0.64 0.60 0.00 0.00 0.00 0.00 179.25 180.26 3h4v h ALA 209 N 1.21 1.40 0.01 0.00 0.00 -0.98 -0.30 119.26 120.60 3h4v h ALA 209 Ca 0.02 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 3h4v h ALA 209 Cb 0.91 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.36 3h4v h ALA 209 CO 0.08 0.53 -0.01 1.25 0.00 0.00 0.00 179.25 181.10 3h4v h LEU 210 N 1.18 -0.02 -0.75 0.00 5.85 -1.03 -2.60 115.31 117.95 3h4v h LEU 210 Ca 0.36 -0.52 -0.13 0.00 0.84 0.00 0.00 57.88 58.42 3h4v h LEU 210 Cb -0.03 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 40.99 3h4v h LEU 210 CO -0.10 0.52 -0.56 -0.08 -0.34 0.00 0.00 178.44 177.88 3h4v h GLU 211 N -0.56 0.20 -0.01 1.25 4.81 -1.26 -3.20 114.58 115.82 3h4v h GLU 211 Ca -0.00 -0.13 0.00 0.00 -0.13 0.00 0.00 59.36 59.10 3h4v h GLU 211 Cb 0.54 0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.93 3h4v h GLU 211 CO 0.00 0.70 -0.48 1.28 -0.73 0.00 0.00 179.01 179.79 3h4v n LEU 212 N -3.90 1.11 -0.29 1.64 4.77 -0.14 -4.30 117.00 115.90 3h4v n LEU 212 Ca -0.02 -0.34 0.10 0.00 -0.03 0.00 0.00 56.01 55.71 3h4v n LEU 212 Cb 0.58 -0.11 0.23 0.00 -2.33 0.00 0.00 43.42 41.79 3h4v n LEU 212 CO 0.43 0.23 0.87 0.00 -1.33 0.00 0.00 177.39 177.59 3h4v h ALA 213 N 3.45 1.05 0.00 -1.18 0.00 -1.45 -1.72 119.26 119.41 3h4v h ALA 213 Ca 0.00 0.25 -0.01 0.00 0.00 0.00 0.00 54.91 55.15 3h4v h ALA 213 Cb 0.56 0.40 -0.00 0.00 0.00 0.00 0.00 17.79 18.74 3h4v h ALA 213 CO 0.00 -0.46 -0.03 -1.35 0.00 0.00 0.00 179.25 177.41 3h4v h PRO 214 N 0.14 0.00 -0.27 0.00 0.11 -1.81 0.26 132.00 130.43 3h4v h PRO 214 Ca 0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.61 3h4v h PRO 214 Cb 0.95 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.06 3h4v h PRO 214 CO -0.69 0.03 0.00 1.28 -0.21 0.00 0.00 178.00 178.41 3h4v n LEU 215 N -3.38 2.77 -1.87 2.35 4.77 -0.70 -4.94 117.00 116.00 3h4v n LEU 215 Ca -0.02 -1.15 -0.18 0.00 -0.03 0.00 0.00 56.01 54.63 3h4v n LEU 215 Cb 0.15 -0.17 -0.02 0.00 -2.33 0.00 0.00 43.42 41.05 3h4v n LEU 215 CO 0.25 0.57 -0.21 0.00 -1.33 0.00 0.00 177.39 176.67 3h4v n GLN 216 N 1.06 -1.38 -2.81 3.23 6.02 0.91 -4.97 117.38 119.44 3h4v n GLN 216 Ca 0.18 0.92 -0.43 0.00 -0.01 0.00 0.00 57.00 57.66 3h4v n GLN 216 Cb 0.51 -5.36 -0.04 0.00 1.02 0.00 0.00 30.24 26.37 3h4v n GLN 216 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 3h4v s ILE 217 N -2.83 4.47 0.26 5.09 1.01 -0.88 -4.34 121.20 123.98 3h4v s ILE 217 Ca 0.00 0.78 -0.27 0.00 0.00 0.00 0.00 60.65 61.16 3h4v s ILE 217 Cb 0.00 -4.43 -0.09 0.00 0.01 0.00 0.00 42.46 37.94 3h4v s ILE 217 CO 0.00 -0.82 0.90 -0.13 0.00 0.00 0.00 174.94 174.88 3h4v s ARG 218 N 3.76 4.65 -0.12 2.79 0.52 -0.99 -3.96 118.95 125.60 3h4v s ARG 218 Ca 0.37 1.32 -0.04 0.00 -0.52 0.00 0.00 55.73 56.87 3h4v s ARG 218 Cb -0.10 -3.05 0.05 0.00 0.52 0.00 0.00 34.95 32.37 3h4v s ARG 218 CO 0.26 0.42 0.08 0.08 0.02 0.00 0.00 175.30 176.17 3h4v s VAL 219 N -1.38 -0.11 0.09 3.52 1.01 -1.26 -0.29 120.40 121.99 3h4v s VAL 219 Ca 0.44 0.08 -0.01 0.00 0.00 0.00 0.00 61.98 62.49 3h4v s VAL 219 Cb -0.22 -0.41 -0.04 0.00 0.00 0.00 0.00 36.38 35.71 3h4v s VAL 219 CO 0.27 -0.09 0.01 0.20 0.00 0.00 0.00 175.10 175.48 3h4v s ASN 220 N 2.16 0.47 0.18 3.32 0.01 -0.62 -0.43 114.94 120.04 3h4v s ASN 220 Ca 0.03 -1.10 0.10 0.00 -0.71 0.00 0.00 52.86 51.18 3h4v s ASN 220 Cb -0.14 0.24 -0.04 0.00 0.41 0.00 0.00 41.25 41.71 3h4v s ASN 220 CO -0.07 -0.65 -0.14 -0.83 -1.51 0.00 0.00 177.10 173.91 3h4v s GLY 221 N -2.99 1.72 -0.10 0.66 0.00 0.90 -1.16 107.32 106.35 3h4v s GLY 221 Ca 0.16 -1.52 0.00 0.00 0.00 0.00 0.00 44.72 43.36 3h4v s GLY 221 CO -0.04 -1.54 -0.09 0.14 0.00 0.00 0.00 173.10 171.57 3h4v s VAL 222 N -1.69 1.08 -0.38 1.40 1.01 -0.78 -0.91 120.40 120.13 3h4v s VAL 222 Ca 0.24 -0.36 -0.03 0.00 0.00 0.00 0.00 61.98 61.82 3h4v s VAL 222 Cb -0.09 -1.06 0.09 0.00 0.00 0.00 0.00 36.38 35.33 3h4v s VAL 222 CO 0.14 0.37 0.16 -0.83 0.00 0.00 0.00 175.10 174.93 3h4v s GLY 223 N 1.35 1.93 0.65 4.51 0.00 1.00 -1.26 107.32 115.50 3h4v s GLY 223 Ca -0.01 -2.28 -0.17 0.00 0.00 0.00 0.00 44.72 42.26 3h4v s GLY 223 CO -0.04 0.93 1.22 -4.14 0.00 0.00 0.00 173.10 171.07 3h4v s PRO 224 N 1.21 2.61 0.00 2.90 0.02 -1.26 -0.63 135.00 139.84 3h4v s PRO 224 Ca 0.04 1.83 0.00 0.00 0.02 0.00 0.00 61.00 62.89 3h4v s PRO 224 Cb -0.22 -1.88 0.00 0.00 0.02 0.00 0.00 34.50 32.42 3h4v s PRO 224 CO -0.02 -1.49 0.00 0.41 -0.33 0.00 0.00 177.00 175.56 3h4v n GLY 225 N 0.49 0.92 3.21 0.52 0.00 -0.71 -1.25 105.19 108.37 3h4v n GLY 225 Ca 0.14 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.82 3h4v n GLY 225 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h4v s LEU 226 N 0.00 2.86 -0.03 0.99 1.43 -1.26 -4.90 118.68 117.77 3h4v s LEU 226 Ca 0.00 -0.68 0.02 0.00 -1.03 0.00 0.00 54.13 52.44 3h4v s LEU 226 Cb 0.00 -1.64 0.00 0.00 0.03 0.00 0.00 46.19 44.58 3h4v s LEU 226 CO 0.00 -0.07 -0.09 -0.44 0.23 0.00 0.00 176.35 175.99 3h4v s SER 227 N 1.36 1.21 -0.67 2.29 0.01 -1.26 -0.42 113.70 116.21 3h4v s SER 227 Ca 0.03 -0.19 -0.13 0.00 1.31 0.00 0.00 55.95 56.97 3h4v s SER 227 Cb -0.15 -0.35 0.02 0.00 0.21 0.00 0.00 66.02 65.74 3h4v s SER 227 CO -0.06 0.06 0.41 1.33 0.41 0.00 0.00 173.24 175.39 3h4v n VAL 228 N 3.36 -1.84 -1.93 3.43 0.24 0.04 -4.76 118.33 116.87 3h4v n VAL 228 Ca -0.19 -0.21 -0.42 0.00 -2.04 0.00 0.00 64.34 61.48 3h4v n VAL 228 Cb 0.54 -1.60 -0.03 0.00 -1.47 0.00 0.00 33.84 31.28 3h4v n VAL 228 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 3h4v s LEU 229 N -5.43 4.37 0.21 1.34 2.96 -1.26 -4.92 118.68 115.95 3h4v s LEU 229 Ca 0.18 2.63 -0.30 0.00 -0.22 0.00 0.00 54.13 56.42 3h4v s LEU 229 Cb -0.10 -3.60 -0.10 0.00 0.50 0.00 0.00 46.19 42.90 3h4v s LEU 229 CO 0.61 -0.82 1.42 -0.69 -1.32 0.00 0.00 176.35 175.55 3h4v s VAL 230 N 1.06 2.84 -0.42 1.68 1.01 -1.26 -4.89 120.40 120.42 3h4v s VAL 230 Ca 0.69 0.68 0.04 0.00 0.00 0.00 0.00 61.98 63.40 3h4v s VAL 230 Cb -0.44 -3.43 0.65 0.00 0.00 0.00 0.00 36.38 33.16 3h4v s VAL 230 CO 0.32 0.09 1.88 -0.90 0.00 0.00 0.00 175.10 176.49 3h4v n ASP 231 N 2.78 3.81 -3.78 3.32 5.75 -1.26 -4.80 116.55 122.37 3h4v n ASP 231 Ca 0.08 -3.52 -0.42 0.00 -0.01 0.00 0.00 54.79 50.92 3h4v n ASP 231 Cb 0.41 -0.82 0.00 0.00 -1.03 0.00 0.00 41.12 39.68 3h4v n ASP 231 CO 0.00 0.00 0.00 -0.90 -0.11 0.00 0.00 177.20 176.19 3h4v n ASP 232 N -1.00 5.34 -3.61 -1.12 5.75 -1.26 -4.83 116.55 115.82 3h4v n ASP 232 Ca 0.56 -3.06 -0.00 0.00 -0.01 0.00 0.00 54.79 52.28 3h4v n ASP 232 Cb 1.61 -1.49 -0.01 0.00 -1.03 0.00 0.00 41.12 40.20 3h4v n ASP 232 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3h4v s MET 233 N 0.70 0.34 0.12 0.11 0.23 -1.26 -5.12 119.30 114.41 3h4v s MET 233 Ca 0.43 -0.17 -0.35 0.00 -1.03 0.00 0.00 55.69 54.57 3h4v s MET 233 Cb 0.12 0.13 -0.16 0.00 -1.53 0.00 0.00 34.83 33.38 3h4v s MET 233 CO -0.02 -0.15 1.35 -2.30 -2.03 0.00 0.00 175.02 171.86 3h4v n PRO 234 N -0.36 1.33 -0.36 3.16 -0.02 -1.26 -4.79 135.00 132.70 3h4v n PRO 234 Ca -0.06 0.48 0.03 0.00 -2.02 0.00 0.00 63.50 61.94 3h4v n PRO 234 Cb 0.61 -2.11 0.11 0.00 -0.02 0.00 0.00 33.50 32.08 3h4v n PRO 234 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 3h4v h PRO 235 N 4.54 -0.00 -0.20 0.52 0.11 -1.99 -1.76 132.00 133.22 3h4v h PRO 235 Ca -0.46 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.62 3h4v h PRO 235 Cb 1.32 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.42 3h4v h PRO 235 CO 0.78 -0.00 -0.01 0.00 -0.21 0.00 0.00 178.00 178.56 3h4v h ALA 236 N 1.78 1.62 -0.07 -0.75 0.00 -1.98 0.43 119.26 120.29 3h4v h ALA 236 Ca 0.43 -0.13 -0.15 0.00 0.00 0.00 0.00 54.91 55.06 3h4v h ALA 236 Cb 0.68 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 3h4v h ALA 236 CO -0.99 0.28 -0.61 0.28 0.00 0.00 0.00 179.25 178.21 3h4v h VAL 237 N 0.29 1.38 -0.07 0.00 2.07 -1.73 0.14 116.25 118.34 3h4v h VAL 237 Ca 0.07 -1.99 -0.20 0.00 0.82 0.00 0.00 66.70 65.40 3h4v h VAL 237 Cb 0.21 2.00 0.01 0.00 -1.52 0.00 0.00 31.29 31.99 3h4v h VAL 237 CO 0.01 0.59 -0.73 -0.25 0.02 0.00 0.00 177.57 177.21 3h4v h TRP 238 N 0.19 0.87 -0.46 1.57 7.01 0.50 -1.69 115.95 123.94 3h4v h TRP 238 Ca -0.01 -0.42 -0.08 0.00 2.11 0.00 0.00 58.89 60.49 3h4v h TRP 238 Cb 1.12 -0.12 -0.02 0.00 -2.10 0.00 0.00 29.16 28.04 3h4v h TRP 238 CO 0.02 1.24 -0.03 1.49 -2.79 0.00 0.00 178.44 178.37 3h4v h GLU 239 N 0.26 0.78 -0.75 2.65 4.22 -0.53 -2.20 114.58 119.01 3h4v h GLU 239 Ca -0.07 -0.22 -0.05 0.00 0.08 0.00 0.00 59.36 59.10 3h4v h GLU 239 Cb 1.38 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 30.52 3h4v h GLU 239 CO 0.15 0.81 0.27 0.78 -2.18 0.00 0.00 179.01 178.84 3h4v h GLY 240 N 0.97 1.22 0.64 1.92 0.00 -0.55 -0.33 103.07 106.94 3h4v h GLY 240 Ca 0.14 -0.69 -0.01 0.00 0.00 0.00 0.00 47.33 46.77 3h4v h GLY 240 CO 0.02 0.65 -0.12 0.45 0.00 0.00 0.00 176.54 177.54 3h4v h HIS 241 N 1.09 -0.32 -0.20 5.60 3.86 -0.87 -3.22 115.15 121.09 3h4v h HIS 241 Ca 0.25 -0.01 0.02 0.00 -1.16 0.00 0.00 60.37 59.47 3h4v h HIS 241 Cb 0.25 0.10 -0.01 0.00 1.06 0.00 0.00 27.41 28.82 3h4v h HIS 241 CO 0.02 0.03 0.14 0.00 0.86 0.00 0.00 177.93 178.97 3h4v h ARG 242 N -0.71 0.19 0.00 2.45 3.08 -1.39 -2.60 114.38 115.41 3h4v h ARG 242 Ca -0.03 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.00 3h4v h ARG 242 Cb 0.48 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.49 3h4v h ARG 242 CO 0.06 0.12 0.00 -1.13 -1.07 0.00 0.00 179.97 177.95 3h4v n SER 243 N -4.50 0.00 0.13 7.04 3.41 -0.14 -2.02 113.62 117.54 3h4v n SER 243 Ca 0.01 0.25 0.09 0.00 -0.26 0.00 0.00 58.87 58.96 3h4v n SER 243 Cb 0.14 -0.36 0.04 0.00 -0.26 0.00 0.00 64.21 63.76 3h4v n SER 243 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 3h4v h LYS 244 N 0.00 0.00 -6.36 4.33 1.79 -1.57 -3.45 116.57 111.32 3h4v h LYS 244 Ca 0.00 0.00 -0.54 0.00 -2.18 0.00 0.00 60.65 57.93 3h4v h LYS 244 Cb 0.15 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 30.81 3h4v h LYS 244 CO 0.00 0.08 1.08 0.08 -1.08 0.00 0.00 179.45 179.61 3h4v s VAL 245 N -3.23 3.24 0.23 0.50 1.01 -0.86 -4.90 120.40 116.39 3h4v s VAL 245 Ca 0.02 0.49 -0.05 0.00 0.00 0.00 0.00 61.98 62.43 3h4v s VAL 245 Cb 0.08 -3.31 0.09 0.00 0.00 0.00 0.00 36.38 33.24 3h4v s VAL 245 CO 0.75 -0.02 1.71 -0.65 0.00 0.00 0.00 175.10 176.89 3h4v h PRO 246 N 9.20 0.92 -6.04 2.72 0.11 -1.84 -2.57 132.00 134.50 3h4v h PRO 246 Ca -0.43 -0.27 -0.60 0.00 0.11 0.00 0.00 66.00 64.82 3h4v h PRO 246 Cb 1.20 -0.10 -0.10 0.00 0.11 0.00 0.00 31.00 32.11 3h4v h PRO 246 CO 0.94 0.91 0.55 -1.17 -0.21 0.00 0.00 178.00 179.02 3h4v s LEU 247 N -9.24 4.03 0.00 2.35 2.96 -0.13 -4.01 118.68 114.63 3h4v s LEU 247 Ca -0.10 0.38 0.00 0.00 -0.22 0.00 0.00 54.13 54.19 3h4v s LEU 247 Cb 0.14 -3.19 0.00 0.00 0.50 0.00 0.00 46.19 43.64 3h4v s LEU 247 CO 0.83 -0.89 0.00 -1.22 -1.32 0.00 0.00 176.35 173.75 3h4v n TYR 248 N 6.82 0.00 -3.99 5.38 4.01 -1.26 -3.97 117.16 124.15 3h4v n TYR 248 Ca 0.06 0.00 -0.28 0.00 -0.16 0.00 0.00 57.90 57.52 3h4v n TYR 248 Cb 0.48 -0.14 -0.01 0.00 -0.31 0.00 0.00 39.34 39.36 3h4v n TYR 248 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 3h4v n GLN 249 N -1.99 -3.79 -3.78 -0.72 3.00 -0.97 -4.97 117.38 104.16 3h4v n GLN 249 Ca 0.00 0.45 -0.10 0.00 -0.01 0.00 0.00 57.00 57.34 3h4v n GLN 249 Cb 0.00 -4.89 -0.05 0.00 0.00 0.00 0.00 30.24 25.30 3h4v n GLN 249 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.06 176.08 3h4v s ARG 250 N -6.59 1.25 0.70 -1.09 1.70 -1.03 -3.83 118.95 110.06 3h4v s ARG 250 Ca 0.29 -0.92 -0.12 0.00 -0.47 0.00 0.00 55.73 54.51 3h4v s ARG 250 Cb -0.15 0.47 0.01 0.00 -0.57 0.00 0.00 34.95 34.71 3h4v s ARG 250 CO 0.88 -0.51 1.07 0.16 -1.08 0.00 0.00 175.30 175.83 3h4v s ASP 251 N -2.88 5.18 0.72 -2.89 -4.77 -1.26 -4.81 116.67 105.95 3h4v s ASP 251 Ca 0.10 1.74 -0.11 0.00 -3.30 0.00 0.00 52.55 50.98 3h4v s ASP 251 Cb 0.01 -2.51 0.02 0.00 -1.09 0.00 0.00 42.92 39.35 3h4v s ASP 251 CO -0.04 -1.58 1.07 -0.94 0.70 0.00 0.00 175.17 174.38 3h4v s SER 252 N -3.41 5.07 0.70 2.11 1.04 0.44 -4.79 113.70 114.86 3h4v s SER 252 Ca 0.61 1.70 -0.11 0.00 0.48 0.00 0.00 55.95 58.63 3h4v s SER 252 Cb -0.16 -2.51 0.02 0.00 0.10 0.00 0.00 66.02 63.48 3h4v s SER 252 CO 0.51 -1.65 1.08 -0.94 0.98 0.00 0.00 173.24 173.21 3h4v s SER 253 N -3.61 5.31 0.20 7.02 1.04 -1.26 -0.78 113.70 121.62 3h4v s SER 253 Ca 0.59 1.00 -0.11 0.00 0.48 0.00 0.00 55.95 57.91 3h4v s SER 253 Cb -0.15 -1.77 0.13 0.00 0.10 0.00 0.00 66.02 64.32 3h4v s SER 253 CO 0.55 -1.39 1.86 0.00 0.98 0.00 0.00 173.24 175.24 3h4v h ALA 254 N -0.64 0.87 -0.37 5.32 0.00 -1.96 -2.73 119.26 119.76 3h4v h ALA 254 Ca -0.45 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.36 3h4v h ALA 254 Cb 1.27 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.76 3h4v h ALA 254 CO 0.64 0.31 0.03 0.00 0.00 0.00 0.00 179.25 180.22 3h4v h ALA 255 N 1.24 1.37 -0.05 0.00 0.00 -1.94 0.11 119.26 120.00 3h4v h ALA 255 Ca 0.25 -0.19 0.01 0.00 0.00 0.00 0.00 54.91 54.98 3h4v h ALA 255 Cb -0.09 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.54 3h4v h ALA 255 CO -0.05 0.44 0.06 0.93 0.00 0.00 0.00 179.25 180.62 3h4v h GLU 256 N 0.54 0.00 0.00 0.00 5.08 -1.87 -0.55 114.58 117.78 3h4v h GLU 256 Ca 0.12 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.36 3h4v h GLU 256 Cb 0.30 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.53 3h4v h GLU 256 CO 0.01 0.00 -0.83 0.28 -1.00 0.00 0.00 179.01 177.47 3h4v h VAL 257 N 0.00 0.63 -0.01 3.13 2.07 -1.42 -3.41 116.25 117.24 3h4v h VAL 257 Ca 0.02 -1.73 0.00 0.00 0.82 0.00 0.00 66.70 65.81 3h4v h VAL 257 Cb 0.14 1.45 -0.00 0.00 -1.52 0.00 0.00 31.29 31.36 3h4v h VAL 257 CO -0.00 0.21 0.01 0.77 0.02 0.00 0.00 177.57 178.58 3h4v h SER 258 N -1.00 0.00 0.15 0.57 4.64 -0.50 -2.45 113.55 114.97 3h4v h SER 258 Ca -0.18 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.06 3h4v h SER 258 Cb 0.94 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.01 3h4v h SER 258 CO -0.11 0.00 -0.27 0.44 -0.87 0.00 0.00 176.83 176.02 3h4v h ASP 259 N 0.00 0.20 -0.14 4.97 3.32 -1.33 -0.80 116.42 122.64 3h4v h ASP 259 Ca 0.00 -0.06 -0.03 0.00 0.02 0.00 0.00 57.03 56.96 3h4v h ASP 259 Cb 0.01 -0.05 -0.00 0.00 0.22 0.00 0.00 39.33 39.51 3h4v h ASP 259 CO -0.00 0.48 -0.04 0.58 -1.72 0.00 0.00 179.24 178.53 3h4v h VAL 260 N 0.18 1.30 -0.36 -1.35 2.07 -1.67 -1.91 116.25 114.50 3h4v h VAL 260 Ca 0.03 -1.02 0.07 0.00 0.82 0.00 0.00 66.70 66.60 3h4v h VAL 260 Cb 0.58 1.69 -0.07 0.00 -1.52 0.00 0.00 31.29 31.98 3h4v h VAL 260 CO 0.04 0.30 -0.06 0.58 0.02 0.00 0.00 177.57 178.45 3h4v h VAL 261 N -0.04 0.67 -0.68 2.57 2.07 -1.36 -1.14 116.25 118.33 3h4v h VAL 261 Ca 0.03 -0.01 -0.01 0.00 0.82 0.00 0.00 66.70 67.54 3h4v h VAL 261 Cb 0.48 0.63 -0.03 0.00 -1.52 0.00 0.00 31.29 30.86 3h4v h VAL 261 CO 0.02 0.01 0.40 0.40 0.02 0.00 0.00 177.57 178.41 3h4v h ILE 262 N 0.03 1.20 0.36 4.57 5.03 -1.17 -2.35 117.51 125.18 3h4v h ILE 262 Ca 0.17 -0.46 -0.00 0.00 -0.12 0.00 0.00 64.86 64.45 3h4v h ILE 262 Cb 0.26 0.27 -0.02 0.00 -3.03 0.00 0.00 36.82 34.30 3h4v h ILE 262 CO -0.35 0.21 -0.34 0.15 -0.68 0.00 0.00 178.15 177.15 3h4v h PHE 263 N 0.93 -0.91 -0.97 1.37 3.57 -0.79 -1.98 116.94 118.16 3h4v h PHE 263 Ca 0.24 0.00 0.27 0.00 3.53 0.00 0.00 57.97 62.02 3h4v h PHE 263 Cb -0.01 0.35 -0.05 0.00 2.79 0.00 0.00 35.95 39.03 3h4v h PHE 263 CO -0.01 -0.48 0.68 -0.07 -2.23 0.00 0.00 178.31 176.20 3h4v h LEU 264 N -0.71 0.12 0.00 0.59 3.38 -0.99 0.36 115.31 118.05 3h4v h LEU 264 Ca -0.02 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.96 3h4v h LEU 264 Cb 0.64 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.39 3h4v h LEU 264 CO -0.05 0.03 -0.15 0.00 0.09 0.00 0.00 178.44 178.37 3h4v s SER 266 N -5.58 5.64 0.50 0.00 1.04 0.13 -4.90 113.70 110.53 3h4v s SER 266 Ca 0.07 1.83 0.34 0.00 0.48 0.00 0.00 55.95 58.67 3h4v s SER 266 Cb 0.08 -2.53 1.68 0.00 0.10 0.00 0.00 66.02 65.34 3h4v s SER 266 CO 0.67 -1.26 2.02 0.77 0.98 0.00 0.00 173.24 176.41 3h4v h SER 267 N 0.29 0.00 0.31 7.02 4.64 -1.90 0.24 113.55 124.16 3h4v h SER 267 Ca -0.47 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 60.84 3h4v h SER 267 Cb 1.22 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.31 3h4v h SER 267 CO 0.57 0.00 -0.08 0.11 -0.87 0.00 0.00 176.83 176.56 3h4v h LYS 268 N 0.00 0.00 -0.55 4.77 1.57 -1.90 -2.95 116.57 117.51 3h4v h LYS 268 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3h4v h LYS 268 Cb 0.17 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.48 3h4v h LYS 268 CO 0.00 0.08 0.00 0.00 -0.57 0.00 0.00 179.45 178.96 3h4v n ALA 269 N -2.26 3.54 0.33 3.86 0.00 0.07 -4.74 120.51 121.31 3h4v n ALA 269 Ca -0.02 -1.88 0.05 0.00 0.00 0.00 0.00 53.44 51.59 3h4v n ALA 269 Cb 0.20 -1.03 0.21 0.00 0.00 0.00 0.00 19.45 18.83 3h4v n ALA 269 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 3h4v n LYS 270 N 0.61 0.00 0.00 0.00 2.85 -1.11 -1.62 118.16 118.89 3h4v n LYS 270 Ca 0.26 0.34 0.12 0.00 -1.05 0.00 0.00 58.31 57.98 3h4v n LYS 270 Cb 1.07 -1.51 0.12 0.00 -0.65 0.00 0.00 35.03 34.06 3h4v n LYS 270 CO 0.00 0.00 0.00 0.98 -0.05 0.00 0.00 177.40 178.33 3h4v n TYR 271 N -1.52 0.00 -3.58 5.58 9.36 -1.26 -4.91 117.16 120.83 3h4v n TYR 271 Ca 0.02 0.00 -0.37 0.00 3.32 0.00 0.00 57.90 60.87 3h4v n TYR 271 Cb 0.11 -0.00 -0.09 0.00 -0.63 0.00 0.00 39.34 38.74 3h4v n TYR 271 CO 0.00 0.00 0.00 0.42 0.22 0.00 0.00 176.86 177.50 3h4v s ILE 272 N -2.05 5.32 -0.03 2.97 1.01 -0.64 -5.05 121.20 122.72 3h4v s ILE 272 Ca 0.28 0.36 -0.28 0.00 0.00 0.00 0.00 60.65 61.00 3h4v s ILE 272 Cb 0.20 -3.57 0.06 0.00 0.01 0.00 0.00 42.46 39.16 3h4v s ILE 272 CO 0.33 0.33 0.63 0.28 0.00 0.00 0.00 174.94 176.51 3h4v s THR 273 N 1.00 0.01 0.00 2.92 -1.32 -1.26 -4.70 115.64 112.29 3h4v s THR 273 Ca 0.12 -0.06 0.00 0.00 -1.21 0.00 0.00 61.69 60.53 3h4v s THR 273 Cb -0.13 -0.96 0.00 0.00 -1.51 0.00 0.00 72.50 69.89 3h4v s THR 273 CO 0.05 -0.03 0.00 0.61 -2.21 0.00 0.00 174.62 173.03 3h4v n GLY 274 N 0.84 0.56 3.67 6.08 0.00 0.43 -4.95 105.19 111.82 3h4v n GLY 274 Ca -0.19 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.57 3h4v n GLY 274 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3h4v s THR 275 N -2.34 2.20 0.12 2.61 -4.23 -1.26 -4.65 115.64 108.09 3h4v s THR 275 Ca 0.00 -1.88 0.10 0.00 -1.18 0.00 0.00 61.69 58.74 3h4v s THR 275 Cb 0.00 -2.97 -0.04 0.00 1.34 0.00 0.00 72.50 70.83 3h4v s THR 275 CO 0.00 -0.03 -0.24 0.00 -0.54 0.00 0.00 174.62 173.81 3h4v s VAL 277 N -1.07 1.47 0.09 0.00 1.01 -0.08 -4.93 120.40 116.89 3h4v s VAL 277 Ca 0.15 -0.62 -0.28 0.00 0.00 0.00 0.00 61.98 61.24 3h4v s VAL 277 Cb -0.10 -1.35 -0.06 0.00 0.00 0.00 0.00 36.38 34.87 3h4v s VAL 277 CO 0.07 0.44 0.87 -0.54 0.00 0.00 0.00 175.10 175.94 3h4v s LYS 278 N 1.08 4.61 -0.54 2.72 1.02 -1.26 -0.00 119.74 127.37 3h4v s LYS 278 Ca -0.05 1.28 0.04 0.00 0.02 0.00 0.00 55.97 57.26 3h4v s LYS 278 Cb -0.15 -3.36 0.16 0.00 -0.52 0.00 0.00 37.83 33.96 3h4v s LYS 278 CO -0.03 0.27 0.38 0.08 -0.92 0.00 0.00 175.35 175.13 3h4v s VAL 279 N -0.13 1.73 0.00 3.17 1.01 0.19 -4.89 120.40 121.49 3h4v s VAL 279 Ca 0.43 -3.33 0.00 0.00 0.00 0.00 0.00 61.98 59.08 3h4v s VAL 279 Cb -0.22 -2.17 0.00 0.00 0.00 0.00 0.00 36.38 33.99 3h4v s VAL 279 CO 0.27 -1.04 0.31 -0.90 0.00 0.00 0.00 175.10 173.73 3h4v n ASP 280 N 2.66 0.00 -1.90 3.32 5.75 -1.26 -1.74 116.55 123.37 3h4v n ASP 280 Ca 0.20 -1.00 -0.18 0.00 -0.01 0.00 0.00 54.79 53.79 3h4v n ASP 280 Cb 0.39 0.00 -0.03 0.00 -1.03 0.00 0.00 41.12 40.45 3h4v n ASP 280 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3h4v n GLY 281 N 0.00 0.20 2.70 6.12 0.00 -1.26 -1.12 105.19 111.82 3h4v n GLY 281 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.90 3h4v n GLY 281 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h4v n GLY 282 N -0.94 0.76 0.37 -0.02 0.00 -1.26 -0.96 105.19 103.14 3h4v n GLY 282 Ca -0.21 0.00 0.12 0.00 0.00 0.00 0.00 46.02 45.93 3h4v n GLY 282 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 3h4v h TYR 283 N 0.00 0.96 0.00 1.61 3.20 -1.48 -0.75 116.97 120.52 3h4v h TYR 283 Ca 0.00 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.90 3h4v h TYR 283 Cb 0.02 -0.30 0.00 0.00 1.54 0.00 0.00 36.73 38.00 3h4v h TYR 283 CO 0.02 0.31 0.00 0.66 -1.64 0.00 0.00 178.16 177.51 3h4v h SER 284 N 0.78 0.00 0.49 -2.11 4.64 -1.87 -2.29 113.55 113.18 3h4v h SER 284 Ca 0.50 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.82 3h4v h SER 284 Cb 0.75 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.84 3h4v h SER 284 CO -0.27 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 175.87 3h4v n LEU 285 N -2.32 0.00 -4.92 5.97 4.77 -0.29 -4.88 117.00 115.33 3h4v n LEU 285 Ca 0.01 0.28 -0.26 0.00 -0.03 0.00 0.00 56.01 56.01 3h4v n LEU 285 Cb 0.16 -0.28 -0.00 0.00 -2.33 0.00 0.00 43.42 40.96 3h4v n LEU 285 CO 0.16 -0.04 0.35 0.42 -1.33 0.00 0.00 177.39 176.96 3h4v s THR 286 N -2.56 4.92 0.13 -5.08 -4.23 -0.86 -5.11 115.64 102.84 3h4v s THR 286 Ca 0.25 -0.04 0.03 0.00 -1.18 0.00 0.00 61.69 60.75 3h4v s THR 286 Cb 0.18 -3.84 -0.04 0.00 1.34 0.00 0.00 72.50 70.13 3h4v s THR 286 CO 0.40 -0.73 -0.06 0.00 -0.54 0.00 0.00 174.62 173.69 3h4v s ARG 287 N -4.61 0.97 0.00 3.99 1.70 -1.26 -5.12 118.95 114.61 3h4v s ARG 287 Ca 0.45 -1.42 0.13 0.00 -0.47 0.00 0.00 55.73 54.43 3h4v s ARG 287 Cb -0.10 -0.34 0.80 0.00 -0.57 0.00 0.00 34.95 34.75 3h4v s ARG 287 CO 0.42 -0.02 1.23 0.00 -1.08 0.00 0.00 175.30 175.85