#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h4v s PRO 7 N 0.00 2.89 -0.06 5.55 0.04 -1.26 -4.77 135.00 137.38 3h4v s PRO 7 Ca 0.00 0.83 0.06 0.00 0.04 0.00 0.00 61.00 61.93 3h4v s PRO 7 Cb 0.00 -1.99 -0.01 0.00 0.04 0.00 0.00 34.50 32.54 3h4v s PRO 7 CO 0.00 -1.10 -0.24 0.08 0.04 0.00 0.00 177.00 175.78 3h4v s VAL 8 N -3.11 2.00 -0.14 -0.36 1.01 -1.26 -0.14 120.40 118.40 3h4v s VAL 8 Ca 0.58 -1.03 0.01 0.00 0.00 0.00 0.00 61.98 61.54 3h4v s VAL 8 Cb -0.13 -1.70 -0.00 0.00 0.00 0.00 0.00 36.38 34.55 3h4v s VAL 8 CO 0.54 0.55 -0.16 0.00 0.00 0.00 0.00 175.10 176.04 3h4v s ALA 9 N -0.08 2.47 -0.28 5.51 0.00 0.69 -0.12 121.76 129.95 3h4v s ALA 9 Ca -0.06 -1.00 -0.12 0.00 0.00 0.00 0.00 51.96 50.78 3h4v s ALA 9 Cb -0.14 -1.15 -0.04 0.00 0.00 0.00 0.00 23.12 21.79 3h4v s ALA 9 CO 0.04 0.09 0.26 -1.17 0.00 0.00 0.00 175.76 174.98 3h4v s LEU 10 N 0.63 4.03 -0.17 0.00 2.96 0.30 0.14 118.68 126.58 3h4v s LEU 10 Ca -0.09 0.10 0.00 0.00 -0.22 0.00 0.00 54.13 53.92 3h4v s LEU 10 Cb -0.16 -2.24 0.01 0.00 0.50 0.00 0.00 46.19 44.30 3h4v s LEU 10 CO 0.03 -0.10 -0.16 -0.69 -1.32 0.00 0.00 176.35 174.10 3h4v s VAL 11 N 1.88 2.46 0.28 1.68 1.01 -0.28 -0.36 120.40 127.06 3h4v s VAL 11 Ca 0.10 -0.82 -0.14 0.00 0.00 0.00 0.00 61.98 61.11 3h4v s VAL 11 Cb -0.16 -2.04 -0.08 0.00 0.00 0.00 0.00 36.38 34.09 3h4v s VAL 11 CO 0.11 0.52 0.68 0.42 0.00 0.00 0.00 175.10 176.82 3h4v s THR 12 N 1.05 4.74 -1.48 3.92 -4.23 -0.95 -0.91 115.64 117.78 3h4v s THR 12 Ca -0.01 0.86 -0.08 0.00 -1.18 0.00 0.00 61.69 61.29 3h4v s THR 12 Cb -0.14 -3.65 0.06 0.00 1.34 0.00 0.00 72.50 70.10 3h4v s THR 12 CO -0.05 -0.08 0.70 0.61 -0.54 0.00 0.00 174.62 175.26 3h4v n GLY 13 N -0.11 -0.35 0.00 3.99 0.00 -0.91 -2.59 105.19 105.21 3h4v n GLY 13 Ca 0.02 0.15 0.14 0.00 0.00 0.00 0.00 46.02 46.33 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 -4.45 2.48 -0.11 4.61 0.00 0.13 -4.33 120.51 118.84 3h4v n ALA 14 Ca -0.13 -0.15 -0.12 0.00 0.00 0.00 0.00 53.44 53.04 3h4v n ALA 14 Cb 0.60 -1.48 0.01 0.00 0.00 0.00 0.00 19.45 18.58 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 3.48 0.66 -2.37 0.00 0.00 -1.84 -2.92 119.26 116.27 3h4v h ALA 15 Ca 0.00 -0.44 -0.28 0.00 0.00 0.00 0.00 54.91 54.19 3h4v h ALA 15 Cb 0.22 -0.13 -0.15 0.00 0.00 0.00 0.00 17.79 17.73 3h4v h ALA 15 CO 0.00 0.67 -0.64 -1.59 0.00 0.00 0.00 179.25 177.69 3h4v s LYS 16 N -4.44 1.19 6.20 0.00 -2.85 -1.26 -4.48 119.74 114.09 3h4v s LYS 16 Ca -0.10 -1.60 0.00 0.00 -1.00 0.00 0.00 55.97 53.26 3h4v s LYS 16 Cb 0.12 -0.10 0.00 0.00 -2.06 0.00 0.00 37.83 35.79 3h4v s LYS 16 CO 0.87 -0.24 0.00 0.54 0.10 0.00 0.00 175.35 176.61 3h4v n ARG 17 N -0.29 0.00 -0.31 1.78 1.74 -1.26 -2.30 116.66 116.02 3h4v n ARG 17 Ca -0.03 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.05 3h4v n ARG 17 Cb 0.65 0.00 0.19 0.00 -1.02 0.00 0.00 32.46 32.27 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 1.00 -1.30 0.55 3.38 -1.92 -2.00 115.31 115.02 3h4v h LEU 18 Ca 0.00 -0.02 -0.06 0.00 0.09 0.00 0.00 57.88 57.89 3h4v h LEU 18 Cb 0.00 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 3h4v h LEU 18 CO 0.00 0.71 -0.30 1.23 0.09 0.00 0.00 178.44 180.17 3h4v h GLY 19 N 1.17 0.00 0.38 0.83 0.00 -1.71 -0.99 103.07 102.74 3h4v h GLY 19 Ca 0.35 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.67 3h4v h GLY 19 CO -0.09 0.00 -0.03 -0.09 0.00 0.00 0.00 176.54 176.33 3h4v h ARG 20 N 0.00 -0.08 0.00 4.80 2.43 -0.95 -2.46 114.38 118.12 3h4v h ARG 20 Ca -0.00 0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3h4v h ARG 20 Cb 0.67 0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 30.24 3h4v h ARG 20 CO 0.04 0.48 -0.01 1.03 -1.51 0.00 0.00 179.97 180.00 3h4v h SER 21 N -0.70 0.00 0.00 -3.80 0.87 -1.14 0.07 113.55 108.84 3h4v h SER 21 Ca -0.01 0.00 -0.04 0.00 -1.23 0.00 0.00 61.79 60.51 3h4v h SER 21 Cb 0.59 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.54 3h4v h SER 21 CO 0.01 0.01 -0.30 0.40 -0.53 0.00 0.00 176.83 176.41 3h4v h ILE 22 N 0.00 0.92 -0.84 2.23 2.04 -1.20 -1.81 117.51 118.85 3h4v h ILE 22 Ca -0.00 -1.78 0.17 0.00 1.00 0.00 0.00 64.86 64.24 3h4v h ILE 22 Cb 0.04 1.83 -0.16 0.00 -0.74 0.00 0.00 36.82 37.78 3h4v h ILE 22 CO 0.00 0.31 -0.22 0.00 0.00 0.00 0.00 178.15 178.24 3h4v h ALA 23 N -0.49 0.52 -0.48 1.87 0.00 -1.20 0.25 119.26 119.73 3h4v h ALA 23 Ca -0.07 0.32 -0.07 0.00 0.00 0.00 0.00 54.91 55.09 3h4v h ALA 23 Cb 0.72 0.66 -0.02 0.00 0.00 0.00 0.00 17.79 19.15 3h4v h ALA 23 CO -0.04 -0.42 0.03 0.93 0.00 0.00 0.00 179.25 179.75 3h4v h GLU 24 N -0.01 0.82 -0.24 0.00 5.08 -1.07 0.12 114.58 119.29 3h4v h GLU 24 Ca 0.40 -0.25 -0.13 0.00 -1.00 0.00 0.00 59.36 58.37 3h4v h GLU 24 Cb 0.61 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.77 3h4v h GLU 24 CO -0.86 0.86 -0.41 0.78 -1.00 0.00 0.00 179.01 178.38 3h4v h GLY 25 N 0.69 0.63 0.56 -3.84 0.00 -0.53 0.14 103.07 100.71 3h4v h GLY 25 Ca 0.14 -0.63 -0.00 0.00 0.00 0.00 0.00 47.33 46.83 3h4v h GLY 25 CO 0.02 0.57 -0.05 1.41 0.00 0.00 0.00 176.54 178.49 3h4v h LEU 26 N 0.47 -0.11 -0.95 3.11 3.38 -0.42 -3.23 115.31 117.57 3h4v h LEU 26 Ca 0.04 -0.36 0.25 0.00 0.09 0.00 0.00 57.88 57.90 3h4v h LEU 26 Cb 0.91 0.03 -0.13 0.00 0.09 0.00 0.00 40.66 41.56 3h4v h LEU 26 CO 0.08 0.33 0.46 -0.74 0.09 0.00 0.00 178.44 178.66 3h4v h HIS 27 N -0.57 0.76 0.00 1.13 2.76 -0.31 0.40 115.15 119.32 3h4v h HIS 27 Ca -0.01 0.04 -0.00 0.00 -2.20 0.00 0.00 60.37 58.20 3h4v h HIS 27 Cb 0.47 -0.18 -0.00 0.00 1.55 0.00 0.00 27.41 29.24 3h4v h HIS 27 CO 0.07 -0.08 -0.01 0.00 -1.30 0.00 0.00 177.93 176.61 3h4v h ALA 28 N 1.76 1.04 -0.01 5.26 0.00 -0.77 -2.28 119.26 124.26 3h4v h ALA 28 Ca 0.62 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.53 3h4v h ALA 28 Cb 1.26 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.05 3h4v h ALA 28 CO -0.56 0.01 -0.23 0.39 0.00 0.00 0.00 179.25 178.86 3h4v n GLU 29 N -3.15 1.27 0.00 0.00 -0.58 0.14 -4.95 120.64 113.37 3h4v n GLU 29 Ca -0.02 -0.89 0.00 0.00 -0.42 0.00 0.00 57.16 55.83 3h4v n GLU 29 Cb 0.13 -1.48 0.00 0.00 -0.57 0.00 0.00 31.44 29.52 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 1.33 1.01 3.77 0.62 0.00 -0.86 -5.11 105.19 105.95 3h4v n GLY 30 Ca 0.13 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.77 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 2.77 0.27 1.61 1.51 -1.12 -4.51 117.35 115.88 3h4v s TYR 31 Ca 0.00 1.46 -0.19 0.00 -1.01 0.00 0.00 57.07 57.34 3h4v s TYR 31 Cb 0.00 -3.56 -0.09 0.00 -0.11 0.00 0.00 41.96 38.20 3h4v s TYR 31 CO 0.00 -1.94 0.75 0.00 -1.11 0.00 0.00 175.55 173.24 3h4v s ALA 32 N -1.39 3.36 -0.12 3.71 0.00 0.80 -4.40 121.76 123.72 3h4v s ALA 32 Ca 0.62 0.15 -0.00 0.00 0.00 0.00 0.00 51.96 52.73 3h4v s ALA 32 Cb -0.34 -2.84 0.02 0.00 0.00 0.00 0.00 23.12 19.97 3h4v s ALA 32 CO 0.42 0.31 -0.09 0.08 0.00 0.00 0.00 175.76 176.49 3h4v s VAL 33 N -1.70 1.12 -0.48 0.00 1.01 -0.64 -0.22 120.40 119.48 3h4v s VAL 33 Ca 0.48 -0.36 -0.24 0.00 0.00 0.00 0.00 61.98 61.85 3h4v s VAL 33 Cb -0.14 -1.13 0.03 0.00 0.00 0.00 0.00 36.38 35.14 3h4v s VAL 33 CO 0.20 0.38 0.89 0.00 0.00 0.00 0.00 175.10 176.56 3h4v s LEU 35 N 3.67 4.57 0.07 0.00 1.43 -0.02 -1.13 118.68 127.27 3h4v s LEU 35 Ca 0.33 -0.36 -0.04 0.00 -1.03 0.00 0.00 54.13 53.03 3h4v s LEU 35 Cb -0.11 -2.34 -0.05 0.00 0.03 0.00 0.00 46.19 43.72 3h4v s LEU 35 CO 0.23 -0.40 0.30 -2.28 0.23 0.00 0.00 176.35 174.43 3h4v s HIS 36 N 2.03 3.52 0.15 0.29 5.65 -0.09 -2.05 115.29 124.79 3h4v s HIS 36 Ca 0.11 0.48 -0.13 0.00 0.25 0.00 0.00 55.06 55.78 3h4v s HIS 36 Cb -0.17 -1.94 0.01 0.00 -1.18 0.00 0.00 32.58 29.31 3h4v s HIS 36 CO 0.12 0.54 0.36 1.52 -0.65 0.00 0.00 174.74 176.63 3h4v s TYR 37 N -1.50 0.08 0.06 3.88 -0.85 -1.01 0.21 117.35 118.23 3h4v s TYR 37 Ca 0.35 -0.44 -0.00 0.00 -0.52 0.00 0.00 57.07 56.46 3h4v s TYR 37 Cb -0.13 0.14 -0.00 0.00 0.38 0.00 0.00 41.96 42.35 3h4v s TYR 37 CO 0.23 -0.74 -0.00 1.58 -1.52 0.00 0.00 175.55 175.09 3h4v n HIS 38 N -0.23 0.00 -0.06 -3.49 -0.00 -1.26 -1.69 115.22 108.49 3h4v n HIS 38 Ca -0.11 0.00 -0.05 0.00 -0.00 0.00 0.00 57.72 57.56 3h4v n HIS 38 Cb 0.63 -0.00 -0.12 0.00 -0.00 0.00 0.00 29.99 30.49 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 -3.17 1.32 -1.82 1.57 1.74 -1.26 -4.76 116.66 110.28 3h4v n ARG 39 Ca -0.00 -0.03 -0.40 0.00 -0.77 0.00 0.00 57.85 56.64 3h4v n ARG 39 Cb 0.00 -1.39 -0.01 0.00 -1.02 0.00 0.00 32.46 30.04 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 -2.47 7.60 -0.29 0.55 7.64 -1.26 -4.72 113.62 120.67 3h4v n SER 40 Ca -0.21 -2.95 -0.05 0.00 1.01 0.00 0.00 58.87 56.68 3h4v n SER 40 Cb 0.89 -1.45 0.07 0.00 -1.01 0.00 0.00 64.21 62.70 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 4.96 1.02 -0.15 -0.43 0.00 -1.96 -2.16 119.26 120.55 3h4v h ALA 41 Ca 0.71 -0.10 -0.13 0.00 0.00 0.00 0.00 54.91 55.39 3h4v h ALA 41 Cb 0.36 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.83 3h4v h ALA 41 CO 1.62 0.49 -0.43 0.00 0.00 0.00 0.00 179.25 180.93 3h4v h ALA 42 N 1.25 0.25 0.53 0.00 0.00 -1.99 -0.83 119.26 118.46 3h4v h ALA 42 Ca 0.28 -0.47 -0.03 0.00 0.00 0.00 0.00 54.91 54.70 3h4v h ALA 42 Cb -0.03 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 17.74 3h4v h ALA 42 CO -0.05 0.38 -0.25 0.93 0.00 0.00 0.00 179.25 180.25 3h4v h GLU 43 N 0.19 -0.68 -0.21 0.00 3.07 -1.90 -2.07 114.58 112.97 3h4v h GLU 43 Ca -0.01 0.05 0.05 0.00 -0.50 0.00 0.00 59.36 58.94 3h4v h GLU 43 Cb 1.05 0.16 -0.05 0.00 -0.84 0.00 0.00 28.75 29.06 3h4v h GLU 43 CO 0.09 -0.40 -0.12 0.00 -1.40 0.00 0.00 179.01 177.19 3h4v h ALA 44 N -0.48 0.05 -0.93 3.43 0.00 -1.37 0.70 119.26 120.67 3h4v h ALA 44 Ca -0.07 0.08 0.15 0.00 0.00 0.00 0.00 54.91 55.07 3h4v h ALA 44 Cb 0.60 0.28 -0.08 0.00 0.00 0.00 0.00 17.79 18.59 3h4v h ALA 44 CO 0.12 -0.54 0.59 -0.91 0.00 0.00 0.00 179.25 178.51 3h4v h ASN 45 N -0.10 0.71 -0.30 0.00 2.35 -1.20 0.11 115.58 117.13 3h4v h ASN 45 Ca 0.12 0.05 -0.15 0.00 -0.55 0.00 0.00 56.30 55.77 3h4v h ASN 45 Cb 0.28 -0.09 -0.01 0.00 0.05 0.00 0.00 38.32 38.55 3h4v h ASN 45 CO -0.27 0.34 -0.37 0.00 -1.65 0.00 0.00 177.43 175.47 3h4v h ALA 46 N 1.59 0.66 -0.57 -0.83 0.00 -0.43 -2.06 119.26 117.62 3h4v h ALA 46 Ca 0.48 -0.45 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 3h4v h ALA 46 Cb 0.74 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 3h4v h ALA 46 CO -0.24 0.67 0.08 1.25 0.00 0.00 0.00 179.25 181.01 3h4v h LEU 47 N 0.70 0.92 -0.24 0.00 5.85 -0.19 -2.11 115.31 120.23 3h4v h LEU 47 Ca 0.06 -0.27 0.02 0.00 0.84 0.00 0.00 57.88 58.53 3h4v h LEU 47 Cb 0.94 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.71 3h4v h LEU 47 CO 0.09 0.95 0.11 -1.28 -0.34 0.00 0.00 178.44 177.97 3h4v h SER 48 N 0.85 0.15 -0.40 1.25 0.87 -0.73 -2.23 113.55 113.30 3h4v h SER 48 Ca 0.17 0.02 0.08 0.00 -1.23 0.00 0.00 61.79 60.83 3h4v h SER 48 Cb 0.44 -0.01 -0.08 0.00 -0.44 0.00 0.00 62.40 62.31 3h4v h SER 48 CO 0.01 0.12 -0.12 0.00 -0.53 0.00 0.00 176.83 176.32 3h4v h ALA 49 N 1.13 0.24 -0.40 6.23 0.00 -1.20 0.47 119.26 125.72 3h4v h ALA 49 Ca 0.10 0.15 0.06 0.00 0.00 0.00 0.00 54.91 55.23 3h4v h ALA 49 Cb 0.04 0.33 -0.05 0.00 0.00 0.00 0.00 17.79 18.11 3h4v h ALA 49 CO -0.08 -0.47 0.07 1.15 0.00 0.00 0.00 179.25 179.92 3h4v h THR 50 N -0.02 0.79 -0.27 0.00 2.02 -1.12 0.29 112.91 114.59 3h4v h THR 50 Ca 0.19 -0.07 -0.12 0.00 0.77 0.00 0.00 66.41 67.19 3h4v h THR 50 Cb 0.32 0.57 -0.00 0.00 -1.74 0.00 0.00 68.15 67.29 3h4v h THR 50 CO -0.42 0.04 -0.28 -0.07 0.37 0.00 0.00 175.52 175.15 3h4v h LEU 51 N 0.20 0.72 -0.23 2.58 3.38 -0.65 -1.87 115.31 119.45 3h4v h LEU 51 Ca 0.19 -0.48 -0.01 0.00 0.09 0.00 0.00 57.88 57.68 3h4v h LEU 51 Cb 0.24 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 3h4v h LEU 51 CO -0.26 1.05 0.11 0.78 0.09 0.00 0.00 178.44 180.22 3h4v h ASN 52 N 0.41 0.29 -0.98 -0.43 2.35 0.05 -1.34 115.58 115.93 3h4v h ASN 52 Ca 0.04 -0.11 0.20 0.00 -0.55 0.00 0.00 56.30 55.88 3h4v h ASN 52 Cb 0.85 -0.08 -0.09 0.00 0.05 0.00 0.00 38.32 39.05 3h4v h ASN 52 CO 0.07 0.33 0.62 0.00 -1.65 0.00 0.00 177.43 176.79 3h4v h ALA 53 N 0.98 1.89 0.00 -0.83 0.00 -0.65 0.40 119.26 121.06 3h4v h ALA 53 Ca 0.08 0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.97 3h4v h ALA 53 Cb 0.11 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 3h4v h ALA 53 CO -0.01 -0.25 -0.40 -0.09 0.00 0.00 0.00 179.25 178.51 3h4v h ARG 54 N 0.62 0.00 -0.64 0.00 2.43 -0.83 -3.42 114.38 112.54 3h4v h ARG 54 Ca 0.55 0.00 0.14 0.00 -0.81 0.00 0.00 59.98 59.86 3h4v h ARG 54 Cb 1.06 0.00 -0.20 0.00 -0.42 0.00 0.00 29.97 30.40 3h4v h ARG 54 CO -0.32 0.40 -0.15 0.50 -1.51 0.00 0.00 179.97 178.89 3h4v s ARG 55 N -3.40 0.36 0.29 0.20 3.52 0.13 -5.10 118.95 114.95 3h4v s ARG 55 Ca 0.01 0.47 -0.27 0.00 -0.13 0.00 0.00 55.73 55.81 3h4v s ARG 55 Cb 0.10 0.24 -0.14 0.00 -1.56 0.00 0.00 34.95 33.58 3h4v s ARG 55 CO 0.70 -0.57 0.87 -2.30 -0.81 0.00 0.00 175.30 173.19 3h4v n PRO 56 N 5.34 1.03 -2.86 5.12 -0.02 -0.48 -2.53 135.00 140.60 3h4v n PRO 56 Ca 0.03 0.36 -0.17 0.00 -2.02 0.00 0.00 63.50 61.69 3h4v n PRO 56 Cb 0.55 -1.66 -0.00 0.00 -0.02 0.00 0.00 33.50 32.36 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 1.33 -4.04 -1.23 2.55 5.15 -1.26 -4.86 115.26 112.91 3h4v n ASN 57 Ca 0.11 -0.08 0.08 0.00 -0.60 0.00 0.00 54.58 54.10 3h4v n ASN 57 Cb 0.32 -3.38 0.31 0.00 -0.53 0.00 0.00 39.78 36.50 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 -2.06 4.51 -3.61 1.20 3.41 -1.05 -4.95 113.62 111.07 3h4v n SER 58 Ca -0.09 -3.00 -0.10 0.00 -0.26 0.00 0.00 58.87 55.42 3h4v n SER 58 Cb 0.58 -0.59 -0.06 0.00 -0.26 0.00 0.00 64.21 63.88 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 -2.82 -1.95 0.06 7.33 0.00 -1.26 -1.63 121.76 121.50 3h4v s ALA 59 Ca 0.46 1.73 0.02 0.00 0.00 0.00 0.00 51.96 54.17 3h4v s ALA 59 Cb 0.37 -1.08 -0.03 0.00 0.00 0.00 0.00 23.12 22.38 3h4v s ALA 59 CO 0.11 -0.27 -0.07 0.96 0.00 0.00 0.00 175.76 176.49 3h4v s ILE 60 N -0.40 0.56 -0.11 0.00 -4.36 -0.59 -4.91 121.20 111.38 3h4v s ILE 60 Ca 0.01 -1.48 0.01 0.00 -0.26 0.00 0.00 60.65 58.93 3h4v s ILE 60 Cb -0.03 -1.10 -0.02 0.00 1.25 0.00 0.00 42.46 42.56 3h4v s ILE 60 CO -0.02 -0.64 -0.12 0.42 0.24 0.00 0.00 174.94 174.82 3h4v s THR 61 N -2.50 3.14 0.00 8.37 -4.23 -1.26 -0.84 115.64 118.34 3h4v s THR 61 Ca -0.00 -0.65 0.04 0.00 -1.18 0.00 0.00 61.69 59.90 3h4v s THR 61 Cb -0.02 -2.30 -0.01 0.00 1.34 0.00 0.00 72.50 71.51 3h4v s THR 61 CO -0.03 0.55 -0.14 -0.69 -0.54 0.00 0.00 174.62 173.77 3h4v s VAL 62 N -0.02 1.07 -0.06 2.29 1.01 -0.87 -4.98 120.40 118.84 3h4v s VAL 62 Ca -0.03 -0.69 -0.03 0.00 0.00 0.00 0.00 61.98 61.23 3h4v s VAL 62 Cb -0.14 -0.92 -0.04 0.00 0.00 0.00 0.00 36.38 35.29 3h4v s VAL 62 CO 0.04 0.21 0.07 -1.58 0.00 0.00 0.00 175.10 173.84 3h4v s GLN 63 N -0.55 3.13 -0.28 2.72 -0.44 -1.26 -2.40 119.66 120.57 3h4v s GLN 63 Ca 0.04 -0.37 -0.16 0.00 -2.50 0.00 0.00 55.36 52.38 3h4v s GLN 63 Cb -0.06 -2.92 0.08 0.00 -1.64 0.00 0.00 33.01 28.48 3h4v s GLN 63 CO -0.00 0.70 0.70 0.00 0.50 0.00 0.00 175.29 177.20 3h4v s ALA 64 N -1.04 -1.90 -0.13 1.58 0.00 -0.68 -4.97 121.76 114.62 3h4v s ALA 64 Ca 0.17 2.42 -0.29 0.00 0.00 0.00 0.00 51.96 54.26 3h4v s ALA 64 Cb -0.12 -1.45 -0.02 0.00 0.00 0.00 0.00 23.12 21.53 3h4v s ALA 64 CO 0.07 -0.39 1.29 0.34 0.00 0.00 0.00 175.76 177.08 3h4v s ASP 65 N 1.65 6.93 0.00 0.00 2.15 -1.26 -4.27 116.67 121.87 3h4v s ASP 65 Ca -0.10 1.78 0.22 0.00 0.43 0.00 0.00 52.55 54.88 3h4v s ASP 65 Cb -0.05 -2.54 0.53 0.00 -0.30 0.00 0.00 42.92 40.56 3h4v s ASP 65 CO -0.20 -0.75 1.46 0.18 -0.17 0.00 0.00 175.17 175.69 3h4v n LEU 66 N 6.39 3.68 -4.77 -1.34 4.77 -1.26 -4.95 117.00 119.53 3h4v n LEU 66 Ca 0.14 -1.80 -0.37 0.00 -0.03 0.00 0.00 56.01 53.95 3h4v n LEU 66 Cb 0.45 -0.38 -0.00 0.00 -2.33 0.00 0.00 43.42 41.16 3h4v n LEU 66 CO 0.56 0.87 0.85 -0.55 -1.33 0.00 0.00 177.39 177.80 3h4v s SER 67 N -1.18 6.00 -1.09 -1.43 0.15 -1.26 -2.55 113.70 112.35 3h4v s SER 67 Ca 0.43 2.38 -0.16 0.00 0.70 0.00 0.00 55.95 59.29 3h4v s SER 67 Cb 0.23 -2.61 -0.07 0.00 -1.71 0.00 0.00 66.02 61.86 3h4v s SER 67 CO 0.31 -1.04 2.13 -3.20 1.20 0.00 0.00 173.24 172.64 3h4v n ASN 68 N -0.61 3.72 -3.98 5.45 5.15 -0.02 -4.80 115.26 120.18 3h4v n ASN 68 Ca 0.08 -2.68 -0.09 0.00 -0.60 0.00 0.00 54.58 51.29 3h4v n ASN 68 Cb 0.48 -1.33 -0.11 0.00 -0.53 0.00 0.00 39.78 38.29 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 3.99 0.12 0.43 3.44 -7.23 -1.26 -4.82 120.40 115.06 3h4v s VAL 69 Ca 0.53 -0.96 -0.23 0.00 -1.81 0.00 0.00 61.98 59.50 3h4v s VAL 69 Cb 0.14 -0.34 -0.08 0.00 0.56 0.00 0.00 36.38 36.66 3h4v s VAL 69 CO 0.02 -0.53 1.11 0.00 -0.31 0.00 0.00 175.10 175.39 3h4v s ALA 70 N -1.61 3.03 0.37 1.32 0.00 -1.26 -3.63 121.76 119.99 3h4v s ALA 70 Ca -0.15 0.82 0.09 0.00 0.00 0.00 0.00 51.96 52.72 3h4v s ALA 70 Cb -0.09 -3.33 -0.07 0.00 0.00 0.00 0.00 23.12 19.64 3h4v s ALA 70 CO -0.01 -0.43 -0.06 0.95 0.00 0.00 0.00 175.76 176.21 3h4v s THR 71 N -1.60 2.14 -0.05 0.00 -4.23 -0.58 -4.92 115.64 106.40 3h4v s THR 71 Ca 0.61 -2.13 -0.37 0.00 -1.18 0.00 0.00 61.69 58.62 3h4v s THR 71 Cb -0.25 -2.77 -0.15 0.00 1.34 0.00 0.00 72.50 70.68 3h4v s THR 71 CO 0.31 -0.13 1.63 0.00 -0.54 0.00 0.00 174.62 175.89 3h4v n ALA 72 N -0.85 0.15 -1.00 3.99 0.00 -1.26 -1.98 120.51 119.56 3h4v n ALA 72 Ca -0.05 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.80 3h4v n ALA 72 Cb 0.65 -2.27 0.00 0.00 0.00 0.00 0.00 19.45 17.82 3h4v n ALA 72 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3h4v n PRO 73 N 4.50 3.67 0.00 0.00 -0.02 -1.26 -4.70 135.00 137.19 3h4v n PRO 73 Ca 0.21 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.69 3h4v n PRO 73 Cb 0.22 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.70 3h4v n PRO 73 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3h4v n ALA 81 N -3.00 -0.50 -1.77 3.55 0.00 -1.26 -5.04 120.51 112.49 3h4v n ALA 81 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 53.05 3h4v n ALA 81 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.44 3h4v n ALA 81 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 3h4v s PRO 82 N 0.00 4.04 -0.24 0.00 0.02 -1.26 -4.96 135.00 132.61 3h4v s PRO 82 Ca 0.00 2.03 -0.19 0.00 0.02 0.00 0.00 61.00 62.87 3h4v s PRO 82 Cb 0.00 -2.76 -0.03 0.00 0.02 0.00 0.00 34.50 31.73 3h4v s PRO 82 CO 0.00 -0.39 0.54 0.08 -0.33 0.00 0.00 177.00 176.90 3h4v s VAL 83 N -1.30 5.06 0.69 3.83 1.01 -0.84 -4.87 120.40 123.98 3h4v s VAL 83 Ca 0.56 0.96 -0.14 0.00 0.00 0.00 0.00 61.98 63.36 3h4v s VAL 83 Cb -0.35 -3.86 0.01 0.00 0.00 0.00 0.00 36.38 32.19 3h4v s VAL 83 CO 0.45 0.11 1.12 0.42 0.00 0.00 0.00 175.10 177.19 3h4v s THR 84 N 2.11 3.15 0.26 3.92 -4.23 -1.26 -1.53 115.64 118.07 3h4v s THR 84 Ca 0.23 0.51 -0.01 0.00 -1.18 0.00 0.00 61.69 61.24 3h4v s THR 84 Cb -0.16 -3.02 0.26 0.00 1.34 0.00 0.00 72.50 70.92 3h4v s THR 84 CO 0.09 -0.36 1.70 0.25 -0.54 0.00 0.00 174.62 175.77 3h4v h LEU 85 N -0.19 0.23 -0.22 4.79 5.85 -1.87 -2.18 115.31 121.71 3h4v h LEU 85 Ca -0.46 0.14 0.04 0.00 0.84 0.00 0.00 57.88 58.44 3h4v h LEU 85 Cb 1.25 0.14 -0.04 0.00 0.37 0.00 0.00 40.66 42.38 3h4v h LEU 85 CO 0.53 0.02 -0.04 0.15 -0.34 0.00 0.00 178.44 178.76 3h4v h PHE 86 N 0.38 -0.09 -0.33 1.25 3.57 -1.93 -0.86 116.94 118.92 3h4v h PHE 86 Ca 0.48 0.02 0.03 0.00 3.53 0.00 0.00 57.97 62.03 3h4v h PHE 86 Cb 0.83 0.07 -0.03 0.00 2.79 0.00 0.00 35.95 39.61 3h4v h PHE 86 CO -0.18 -0.08 0.12 1.15 -2.23 0.00 0.00 178.31 177.09 3h4v h THR 87 N 0.02 0.92 -0.56 4.41 2.02 -1.86 -0.44 112.91 117.41 3h4v h THR 87 Ca 0.11 -0.09 0.03 0.00 0.77 0.00 0.00 66.41 67.23 3h4v h THR 87 Cb 0.15 0.62 -0.03 0.00 -1.74 0.00 0.00 68.15 67.16 3h4v h THR 87 CO -0.21 0.05 0.37 0.03 0.37 0.00 0.00 175.52 176.13 3h4v h ARG 88 N 0.27 0.63 -0.22 6.66 3.08 -0.76 -0.29 114.38 123.75 3h4v h ARG 88 Ca 0.15 -0.04 -0.19 0.00 0.07 0.00 0.00 59.98 59.97 3h4v h ARG 88 Cb 0.11 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.02 3h4v h ARG 88 CO -0.14 0.41 -0.59 0.00 -1.07 0.00 0.00 179.97 178.58 3h4v h ALA 90 N 0.61 0.58 0.00 0.00 0.00 -0.29 -2.56 119.26 117.60 3h4v h ALA 90 Ca -0.01 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 3h4v h ALA 90 Cb 1.21 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.88 3h4v h ALA 90 CO 0.13 -0.07 -0.10 0.93 0.00 0.00 0.00 179.25 180.14 3h4v h GLU 91 N 0.51 0.00 0.08 0.00 5.08 -0.99 0.28 114.58 119.55 3h4v h GLU 91 Ca 0.19 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.54 3h4v h GLU 91 Cb 0.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.29 3h4v h GLU 91 CO -0.10 0.10 -0.04 -0.07 -1.00 0.00 0.00 179.01 177.90 3h4v h LEU 92 N 0.00 -0.09 -0.14 1.33 3.38 -0.98 -0.92 115.31 117.89 3h4v h LEU 92 Ca -0.00 -0.16 -0.03 0.00 0.09 0.00 0.00 57.88 57.79 3h4v h LEU 92 Cb 0.19 0.02 -0.00 0.00 0.09 0.00 0.00 40.66 40.96 3h4v h LEU 92 CO 0.01 0.11 -0.01 0.58 0.09 0.00 0.00 178.44 179.22 3h4v h VAL 93 N -0.28 1.27 -0.82 1.22 2.07 -1.29 -2.85 116.25 115.57 3h4v h VAL 93 Ca -0.01 -0.88 0.19 0.00 0.82 0.00 0.00 66.70 66.81 3h4v h VAL 93 Cb 0.24 1.58 -0.12 0.00 -1.52 0.00 0.00 31.29 31.47 3h4v h VAL 93 CO 0.02 0.26 0.28 0.00 0.02 0.00 0.00 177.57 178.15 3h4v h ALA 94 N 0.74 1.18 -1.01 1.67 0.00 -0.45 -0.13 119.26 121.26 3h4v h ALA 94 Ca 0.04 0.16 0.26 0.00 0.00 0.00 0.00 54.91 55.37 3h4v h ALA 94 Cb 0.40 0.19 -0.12 0.00 0.00 0.00 0.00 17.79 18.26 3h4v h ALA 94 CO 0.01 -0.33 0.61 0.00 0.00 0.00 0.00 179.25 179.54 3h4v h ALA 95 N 1.66 1.87 -0.03 0.00 0.00 -0.91 0.32 119.26 122.17 3h4v h ALA 95 Ca 0.48 0.12 -0.13 0.00 0.00 0.00 0.00 54.91 55.38 3h4v h ALA 95 Cb 0.87 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.67 3h4v h ALA 95 CO -0.52 -0.35 -0.58 0.00 0.00 0.00 0.00 179.25 177.80 3h4v h TYR 97 N 0.07 0.00 -0.97 0.00 -1.99 -0.26 -2.38 116.97 111.44 3h4v h TYR 97 Ca -0.00 0.00 0.32 0.00 2.00 0.00 0.00 58.73 61.05 3h4v h TYR 97 Cb 1.05 0.00 -0.16 0.00 2.00 0.00 0.00 36.73 39.61 3h4v h TYR 97 CO 0.01 0.90 0.38 1.15 -0.00 0.00 0.00 178.16 180.60 3h4v h THR 98 N -1.00 0.16 0.02 -2.88 2.02 -0.99 2.36 112.91 112.59 3h4v h THR 98 Ca -0.00 -0.05 -0.37 0.00 0.77 0.00 0.00 66.41 66.77 3h4v h THR 98 Cb 0.90 0.01 -0.06 0.00 -1.74 0.00 0.00 68.15 67.25 3h4v h THR 98 CO -0.00 0.03 -2.28 1.57 0.37 0.00 0.00 175.52 175.21 3h4v n HIS 99 N -5.24 0.31 -0.40 3.16 -0.00 -0.99 -4.53 115.22 107.53 3h4v n HIS 99 Ca 0.30 0.09 0.00 0.00 -0.00 0.00 0.00 57.72 58.10 3h4v n HIS 99 Cb 0.97 -1.05 0.00 0.00 -0.00 0.00 0.00 29.99 29.91 3h4v n HIS 99 CO 0.00 0.00 0.00 0.91 -0.00 0.00 0.00 176.34 177.25 3h4v n TRP 100 N -3.08 0.00 -1.44 1.57 8.01 -0.91 -5.01 117.44 116.58 3h4v n TRP 100 Ca -0.35 -0.21 -0.15 0.00 -1.31 0.00 0.00 57.50 55.48 3h4v n TRP 100 Cb 1.07 -0.02 -0.07 0.00 -2.01 0.00 0.00 31.31 30.28 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 -0.21 1.45 3.82 6.99 0.00 0.79 -4.94 105.19 113.10 3h4v n GLY 101 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 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 -3.29 2.03 -0.27 1.61 1.70 -1.18 -4.89 118.95 114.66 3h4v s ARG 102 Ca 0.00 -1.25 -0.02 0.00 -0.47 0.00 0.00 55.73 53.99 3h4v s ARG 102 Cb 0.00 0.61 0.16 0.00 -0.57 0.00 0.00 34.95 35.15 3h4v s ARG 102 CO 0.00 -0.94 0.49 0.00 -1.08 0.00 0.00 175.30 173.77 3h4v n ASP 104 N 5.40 0.58 -4.18 0.00 8.00 0.83 -4.95 116.55 122.23 3h4v n ASP 104 Ca -0.02 -0.02 -0.27 0.00 0.71 0.00 0.00 54.79 55.19 3h4v n ASP 104 Cb 0.51 0.79 -0.16 0.00 -0.02 0.00 0.00 41.12 42.24 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 -2.46 1.57 -0.07 2.53 1.01 -0.41 -0.95 120.40 121.62 3h4v s VAL 105 Ca -0.12 -0.82 0.01 0.00 0.00 0.00 0.00 61.98 61.05 3h4v s VAL 105 Cb 0.06 -1.33 0.02 0.00 0.00 0.00 0.00 36.38 35.13 3h4v s VAL 105 CO 0.74 0.45 -0.07 -0.22 0.00 0.00 0.00 175.10 176.00 3h4v s LEU 106 N -0.19 1.26 -0.23 3.92 2.96 -0.61 -0.54 118.68 125.27 3h4v s LEU 106 Ca 0.01 -0.22 -0.03 0.00 -0.22 0.00 0.00 54.13 53.67 3h4v s LEU 106 Cb -0.10 -0.67 0.00 0.00 0.50 0.00 0.00 46.19 45.92 3h4v s LEU 106 CO 0.01 -0.07 -0.05 -0.69 -1.32 0.00 0.00 176.35 174.23 3h4v s VAL 107 N 1.24 3.16 -0.81 1.68 1.01 0.51 -0.54 120.40 126.65 3h4v s VAL 107 Ca -0.05 -0.68 -0.18 0.00 0.00 0.00 0.00 61.98 61.08 3h4v s VAL 107 Cb -0.14 -2.48 0.15 0.00 0.00 0.00 0.00 36.38 33.90 3h4v s VAL 107 CO -0.02 0.36 0.92 0.20 0.00 0.00 0.00 175.10 176.56 3h4v s ASN 108 N 1.42 6.54 -0.10 3.32 0.01 0.16 -2.23 114.94 124.07 3h4v s ASN 108 Ca 0.04 -2.03 0.05 0.00 -0.71 0.00 0.00 52.86 50.21 3h4v s ASN 108 Cb -0.15 -2.33 -0.09 0.00 0.41 0.00 0.00 41.25 39.09 3h4v s ASN 108 CO -0.04 -0.96 -0.02 -3.20 -1.51 0.00 0.00 177.10 171.36 3h4v n ASN 109 N 5.85 2.99 -4.72 -1.22 5.15 -1.25 -1.40 115.26 120.66 3h4v n ASN 109 Ca 0.12 -0.02 -0.42 0.00 -0.60 0.00 0.00 54.58 53.65 3h4v n ASN 109 Cb 0.47 0.35 -0.01 0.00 -0.53 0.00 0.00 39.78 40.06 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 -2.52 1.75 -3.46 5.20 0.00 -1.07 -4.87 120.51 115.53 3h4v n ALA 110 Ca -0.16 0.37 0.01 0.00 0.00 0.00 0.00 53.44 53.65 3h4v n ALA 110 Cb 0.75 -2.34 -0.05 0.00 0.00 0.00 0.00 19.45 17.81 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 0.00 -0.45 0.42 0.00 0.15 -1.26 -4.33 113.70 108.23 3h4v s SER 111 Ca 0.59 0.65 -0.12 0.00 0.70 0.00 0.00 55.95 57.77 3h4v s SER 111 Cb -0.55 1.40 -0.07 0.00 -1.71 0.00 0.00 66.02 65.10 3h4v s SER 111 CO 0.57 -0.09 0.80 -0.94 1.20 0.00 0.00 173.24 174.78 3h4v s SER 112 N 1.96 6.55 -0.29 5.45 1.04 -1.26 -5.02 113.70 122.13 3h4v s SER 112 Ca -0.04 1.20 -0.01 0.00 0.48 0.00 0.00 55.95 57.58 3h4v s SER 112 Cb -0.04 -2.35 0.18 0.00 0.10 0.00 0.00 66.02 63.91 3h4v s SER 112 CO -0.16 -0.42 0.56 0.12 0.98 0.00 0.00 173.24 174.32 3h4v s PHE 113 N -2.39 -1.49 -0.09 5.02 5.36 -1.26 -4.87 117.98 118.26 3h4v s PHE 113 Ca 0.52 1.52 -0.31 0.00 -0.96 0.00 0.00 56.93 57.70 3h4v s PHE 113 Cb -0.10 0.46 0.12 0.00 -0.34 0.00 0.00 43.02 43.15 3h4v s PHE 113 CO 0.31 -0.87 1.00 1.52 -1.46 0.00 0.00 175.22 175.72 3h4v s TYR 114 N 2.80 -0.28 0.45 10.12 -0.85 -1.26 -5.17 117.35 123.16 3h4v s TYR 114 Ca 0.19 0.24 -0.24 0.00 -0.52 0.00 0.00 57.07 56.73 3h4v s TYR 114 Cb -0.15 0.52 -0.08 0.00 0.38 0.00 0.00 41.96 42.63 3h4v s TYR 114 CO -0.21 -0.41 1.31 -2.14 -1.52 0.00 0.00 175.55 172.59 3h4v s PRO 115 N -2.58 3.70 -0.49 -3.49 0.02 -1.26 -4.79 135.00 126.10 3h4v s PRO 115 Ca 0.05 2.16 0.06 0.00 0.02 0.00 0.00 61.00 63.29 3h4v s PRO 115 Cb -0.01 -2.57 0.21 0.00 0.02 0.00 0.00 34.50 32.15 3h4v s PRO 115 CO -0.06 -0.72 0.49 0.25 -0.33 0.00 0.00 177.00 176.63 3h4v n THR 116 N -0.29 0.01 -1.81 0.99 -2.24 0.29 -4.96 114.28 106.27 3h4v n THR 116 Ca 0.06 -4.14 -0.39 0.00 -2.27 0.00 0.00 64.05 57.31 3h4v n THR 116 Cb 0.44 -1.91 0.03 0.00 -2.10 0.00 0.00 70.33 66.79 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 -0.99 3.32 0.00 -0.78 0.02 -1.15 -4.24 135.00 131.17 3h4v s PRO 117 Ca 0.33 2.27 0.29 0.00 0.02 0.00 0.00 61.00 63.91 3h4v s PRO 117 Cb 0.08 -2.38 1.22 0.00 0.02 0.00 0.00 34.50 33.45 3h4v s PRO 117 CO -0.14 -1.06 1.87 1.28 -0.33 0.00 0.00 177.00 178.62 3h4v n LEU 118 N -0.77 0.35 -3.84 -5.54 4.77 -1.26 -4.88 117.00 105.82 3h4v n LEU 118 Ca 0.09 0.10 -0.21 0.00 -0.03 0.00 0.00 56.01 55.96 3h4v n LEU 118 Cb 0.44 -0.23 -0.17 0.00 -2.33 0.00 0.00 43.42 41.13 3h4v n LEU 118 CO 0.54 0.07 -0.40 -0.76 -1.33 0.00 0.00 177.39 175.51 3h4v s LEU 119 N -2.58 1.07 0.36 2.23 1.43 -1.26 -5.24 118.68 114.69 3h4v s LEU 119 Ca 0.26 -0.11 -0.28 0.00 -1.03 0.00 0.00 54.13 52.98 3h4v s LEU 119 Cb 0.20 -0.43 -0.12 0.00 0.03 0.00 0.00 46.19 45.87 3h4v s LEU 119 CO 0.49 -0.11 1.39 -2.11 0.23 0.00 0.00 176.35 176.25 3h4v n ARG 120 N 4.43 2.42 -1.32 1.70 1.85 -1.26 -5.18 116.66 119.28 3h4v n ARG 120 Ca -0.19 0.85 -0.37 0.00 -1.00 0.00 0.00 57.85 57.13 3h4v n ARG 120 Cb 0.50 -2.51 0.04 0.00 -1.05 0.00 0.00 32.46 29.45 3h4v n ARG 120 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 3h4v n GLY 131 N 0.61 -2.04 0.23 2.89 0.00 -1.26 -5.23 105.19 100.38 3h4v n GLY 131 Ca 0.03 -0.28 -0.09 0.00 0.00 0.00 0.00 46.02 45.68 3h4v n GLY 131 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 3h4v h ASP 132 N -0.09 -0.56 0.79 1.61 1.82 -2.06 0.48 116.42 118.40 3h4v h ASP 132 Ca -0.45 0.03 0.00 0.00 -0.39 0.00 0.00 57.03 56.23 3h4v h ASP 132 Cb 1.39 0.17 0.00 0.00 0.68 0.00 0.00 39.33 41.57 3h4v h ASP 132 CO 0.43 -0.32 -0.21 0.54 -1.61 0.00 0.00 179.24 178.07 3h4v n ARG 133 N -3.65 0.00 0.03 0.28 1.74 -1.26 -2.91 116.66 110.89 3h4v n ARG 133 Ca -0.06 0.00 -0.15 0.00 -0.77 0.00 0.00 57.85 56.87 3h4v n ARG 133 Cb 0.22 -1.50 -0.05 0.00 -1.02 0.00 0.00 32.46 30.11 3h4v n ARG 133 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 3h4v h GLU 134 N 0.00 0.58 -0.19 5.56 4.39 -1.98 -2.87 114.58 120.08 3h4v h GLU 134 Ca 0.00 -0.54 0.05 0.00 0.34 0.00 0.00 59.36 59.21 3h4v h GLU 134 Cb 0.50 0.13 -0.06 0.00 -0.10 0.00 0.00 28.75 29.22 3h4v h GLU 134 CO 0.00 1.16 -0.26 0.00 -1.16 0.00 0.00 179.01 178.76 3h4v h ALA 135 N 0.66 -0.21 -0.65 3.43 0.00 0.09 0.75 119.26 123.33 3h4v h ALA 135 Ca -0.07 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 3h4v h ALA 135 Cb 1.49 0.52 -0.03 0.00 0.00 0.00 0.00 17.79 19.76 3h4v h ALA 135 CO 0.16 -0.71 0.34 0.52 0.00 0.00 0.00 179.25 179.57 3h4v h MET 136 N -0.30 0.92 -0.36 0.00 2.86 -1.62 0.58 114.93 117.01 3h4v h MET 136 Ca 0.12 -0.12 -0.02 0.00 -2.06 0.00 0.00 59.70 57.62 3h4v h MET 136 Cb 0.48 -0.17 -0.02 0.00 0.06 0.00 0.00 31.60 31.95 3h4v h MET 136 CO -0.36 0.70 0.15 1.49 1.06 0.00 0.00 176.91 179.96 3h4v h GLU 137 N 0.89 0.53 -0.07 1.72 4.57 -1.34 -2.87 114.58 118.02 3h4v h GLU 137 Ca 0.23 -0.09 -0.17 0.00 -1.18 0.00 0.00 59.36 58.15 3h4v h GLU 137 Cb 0.07 -0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 28.56 3h4v h GLU 137 CO -0.03 0.51 -0.68 1.79 -1.18 0.00 0.00 179.01 179.41 3h4v h THR 138 N 0.44 1.40 -0.49 0.32 1.35 -0.60 -2.27 112.91 113.05 3h4v h THR 138 Ca 0.12 -2.12 -0.04 0.00 -0.55 0.00 0.00 66.41 63.82 3h4v h THR 138 Cb 0.17 2.10 -0.02 0.00 -1.73 0.00 0.00 68.15 68.66 3h4v h THR 138 CO -0.01 0.63 0.15 0.00 -0.25 0.00 0.00 175.52 176.04 3h4v h ALA 139 N 1.08 0.64 0.68 6.62 0.00 0.11 -0.53 119.26 127.85 3h4v h ALA 139 Ca -0.02 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.68 3h4v h ALA 139 Cb 1.23 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.83 3h4v h ALA 139 CO 0.11 0.29 -0.34 1.15 0.00 0.00 0.00 179.25 180.46 3h4v h THR 140 N 0.65 0.30 -0.91 0.00 2.02 -1.40 0.81 112.91 114.39 3h4v h THR 140 Ca 0.16 0.00 0.13 0.00 0.77 0.00 0.00 66.41 67.47 3h4v h THR 140 Cb 0.27 0.30 -0.09 0.00 -1.74 0.00 0.00 68.15 66.89 3h4v h THR 140 CO -0.01 0.00 0.53 0.00 0.37 0.00 0.00 175.52 176.41 3h4v h ALA 141 N -0.63 1.37 0.00 6.16 0.00 -1.42 -1.33 119.26 123.42 3h4v h ALA 141 Ca -0.09 0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 3h4v h ALA 141 Cb 0.73 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.40 3h4v h ALA 141 CO 0.14 0.07 -0.00 0.22 0.00 0.00 0.00 179.25 179.68 3h4v h ASP 142 N 0.81 -0.00 0.16 0.00 3.58 -0.81 0.16 116.42 120.32 3h4v h ASP 142 Ca 0.47 -0.77 -0.01 0.00 0.42 0.00 0.00 57.03 57.14 3h4v h ASP 142 Cb 0.54 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.60 3h4v h ASP 142 CO -0.30 0.77 -0.08 -0.07 -2.88 0.00 0.00 179.24 176.69 3h4v h LEU 143 N -0.79 -0.18 -1.13 2.28 3.38 -0.91 -2.31 115.31 115.66 3h4v h LEU 143 Ca -0.00 -0.20 -0.06 0.00 0.09 0.00 0.00 57.88 57.71 3h4v h LEU 143 Cb 0.77 0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.55 3h4v h LEU 143 CO 0.00 0.10 -0.08 -0.26 0.09 0.00 0.00 178.44 178.29 3h4v h PHE 144 N -0.48 0.55 0.84 1.13 0.04 -1.37 -2.23 116.94 115.43 3h4v h PHE 144 Ca -0.02 -0.07 -0.04 0.00 2.80 0.00 0.00 57.97 60.63 3h4v h PHE 144 Cb 0.37 -0.15 0.01 0.00 2.20 0.00 0.00 35.95 38.38 3h4v h PHE 144 CO 0.01 0.59 -0.40 0.78 -0.60 0.00 0.00 178.31 178.69 3h4v h GLY 145 N 0.90 -1.18 1.01 -1.45 0.00 -0.76 -0.67 103.07 100.92 3h4v h GLY 145 Ca 0.10 0.44 -0.07 0.00 0.00 0.00 0.00 47.33 47.79 3h4v h GLY 145 CO 0.02 -0.43 0.04 1.48 0.00 0.00 0.00 176.54 177.65 3h4v h SER 146 N -1.22 0.86 1.40 0.19 4.64 -1.13 0.43 113.55 118.72 3h4v h SER 146 Ca -0.12 -0.29 -0.09 0.00 -0.47 0.00 0.00 61.79 60.83 3h4v h SER 146 Cb 0.86 -0.23 -0.01 0.00 -0.31 0.00 0.00 62.40 62.71 3h4v h SER 146 CO 0.19 0.93 -0.41 0.78 -0.87 0.00 0.00 176.83 177.45 3h4v h ASN 147 N 0.75 0.00 0.00 4.97 2.35 -1.50 -3.41 115.58 118.74 3h4v h ASN 147 Ca 0.15 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.90 3h4v h ASN 147 Cb 0.47 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.84 3h4v h ASN 147 CO 0.02 0.41 0.00 0.00 -1.65 0.00 0.00 177.43 176.21 3h4v n ALA 148 N -2.22 2.98 -0.06 -0.83 0.00 -0.65 -4.52 120.51 115.20 3h4v n ALA 148 Ca 0.02 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.31 3h4v n ALA 148 Cb 0.66 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 20.05 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 1.32 -0.35 0.00 1.08 -0.79 -2.66 117.51 116.11 3h4v h ILE 149 Ca 0.00 -1.64 -0.04 0.00 -0.39 0.00 0.00 64.86 62.79 3h4v h ILE 149 Cb 0.00 1.85 -0.01 0.00 -3.07 0.00 0.00 36.82 35.58 3h4v h ILE 149 CO 0.00 0.51 0.06 0.00 -0.69 0.00 0.00 178.15 178.03 3h4v h ALA 150 N 0.60 0.46 -0.73 1.87 0.00 -0.38 -1.78 119.26 119.31 3h4v h ALA 150 Ca 0.01 -0.20 0.16 0.00 0.00 0.00 0.00 54.91 54.88 3h4v h ALA 150 Cb 1.01 -0.13 -0.12 0.00 0.00 0.00 0.00 17.79 18.55 3h4v h ALA 150 CO 0.09 0.16 0.05 -1.35 0.00 0.00 0.00 179.25 178.20 3h4v h PRO 151 N 0.41 0.14 -0.36 0.00 0.11 -1.75 0.18 132.00 130.73 3h4v h PRO 151 Ca 0.11 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.21 3h4v h PRO 151 Cb 0.34 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 31.40 3h4v h PRO 151 CO 0.01 0.09 0.24 -0.92 -0.21 0.00 0.00 178.00 177.21 3h4v h TYR 152 N 0.14 0.45 -0.16 0.65 3.20 -0.98 0.35 116.97 120.63 3h4v h TYR 152 Ca 0.40 0.01 -0.11 0.00 3.14 0.00 0.00 58.73 62.17 3h4v h TYR 152 Cb 0.70 -0.15 -0.01 0.00 1.54 0.00 0.00 36.73 38.80 3h4v h TYR 152 CO -0.37 0.29 -0.38 0.74 -1.64 0.00 0.00 178.16 176.80 3h4v h PHE 153 N 0.49 0.40 0.16 -3.82 0.04 -0.74 -0.76 116.94 112.71 3h4v h PHE 153 Ca 0.13 -0.10 -0.01 0.00 2.80 0.00 0.00 57.97 60.79 3h4v h PHE 153 Cb -0.05 -0.09 0.00 0.00 2.20 0.00 0.00 35.95 38.01 3h4v h PHE 153 CO -0.05 0.68 -0.08 -0.07 -0.60 0.00 0.00 178.31 178.19 3h4v h LEU 154 N 0.29 -0.18 -0.75 1.54 3.38 0.62 -1.34 115.31 118.88 3h4v h LEU 154 Ca 0.03 -0.26 0.10 0.00 0.09 0.00 0.00 57.88 57.84 3h4v h LEU 154 Cb 0.80 0.05 -0.08 0.00 0.09 0.00 0.00 40.66 41.52 3h4v h LEU 154 CO 0.06 0.18 0.38 0.40 0.09 0.00 0.00 178.44 179.55 3h4v h ILE 155 N -0.57 0.84 -0.15 1.22 2.04 -0.30 -0.77 117.51 119.82 3h4v h ILE 155 Ca -0.02 -0.22 0.04 0.00 1.00 0.00 0.00 64.86 65.66 3h4v h ILE 155 Cb 0.43 0.15 -0.05 0.00 -0.74 0.00 0.00 36.82 36.61 3h4v h ILE 155 CO 0.04 0.12 -0.13 0.50 0.00 0.00 0.00 178.15 178.67 3h4v h LYS 156 N 0.63 -0.15 -0.44 2.37 3.64 -1.04 -0.45 116.57 121.13 3h4v h LYS 156 Ca 0.38 0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.74 3h4v h LYS 156 Cb 0.41 0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.25 3h4v h LYS 156 CO -0.28 -0.10 0.17 0.00 -2.27 0.00 0.00 179.45 176.97 3h4v h ALA 157 N 0.94 0.58 -0.52 5.00 0.00 -0.46 0.48 119.26 125.28 3h4v h ALA 157 Ca 0.10 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 3h4v h ALA 157 Cb 0.29 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 3h4v h ALA 157 CO -0.24 0.19 0.30 0.35 0.00 0.00 0.00 179.25 179.85 3h4v h PHE 158 N 0.57 0.68 0.07 0.00 3.04 -1.10 -1.81 116.94 118.38 3h4v h PHE 158 Ca 0.15 0.00 -0.12 0.00 3.98 0.00 0.00 57.97 61.98 3h4v h PHE 158 Cb 0.20 -0.22 0.01 0.00 2.56 0.00 0.00 35.95 38.50 3h4v h PHE 158 CO 0.00 0.46 -0.52 0.00 -2.02 0.00 0.00 178.31 176.24 3h4v h ALA 159 N 1.62 -0.03 -0.86 2.41 0.00 -0.42 -2.98 119.26 118.99 3h4v h ALA 159 Ca 0.19 -0.60 0.11 0.00 0.00 0.00 0.00 54.91 54.61 3h4v h ALA 159 Cb -0.01 0.05 -0.06 0.00 0.00 0.00 0.00 17.79 17.77 3h4v h ALA 159 CO -0.03 0.24 0.56 0.45 0.00 0.00 0.00 179.25 180.47 3h4v h HIS 160 N -0.50 0.85 -0.05 0.00 3.86 -0.72 0.17 115.15 118.75 3h4v h HIS 160 Ca -0.08 0.02 -0.17 0.00 -1.16 0.00 0.00 60.37 58.98 3h4v h HIS 160 Cb 1.36 -0.27 -0.01 0.00 1.06 0.00 0.00 27.41 29.54 3h4v h HIS 160 CO 0.21 0.37 -0.71 0.00 0.86 0.00 0.00 177.93 178.65 3h4v h ARG 161 N 0.77 0.28 -0.04 2.45 2.47 -1.36 0.14 114.38 119.08 3h4v h ARG 161 Ca 0.41 -0.23 -0.12 0.00 -1.26 0.00 0.00 59.98 58.79 3h4v h ARG 161 Cb 0.54 0.05 0.01 0.00 -1.65 0.00 0.00 29.97 28.91 3h4v h ARG 161 CO -0.18 0.88 -0.44 0.28 0.56 0.00 0.00 179.97 181.07 3h4v h VAL 162 N 0.19 1.44 -1.00 2.04 2.07 -1.20 -3.04 116.25 116.74 3h4v h VAL 162 Ca -0.02 -1.91 0.13 0.00 0.82 0.00 0.00 66.70 65.72 3h4v h VAL 162 Cb 1.27 2.47 -0.09 0.00 -1.52 0.00 0.00 31.29 33.43 3h4v h VAL 162 CO 0.11 0.55 0.63 0.00 0.02 0.00 0.00 177.57 178.88 3h4v h ALA 163 N 0.37 1.56 0.00 1.67 0.00 -0.50 -0.21 119.26 122.14 3h4v h ALA 163 Ca -0.04 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3h4v h ALA 163 Cb 1.13 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.73 3h4v h ALA 163 CO 0.09 0.18 0.00 0.41 0.00 0.00 0.00 179.25 179.93 3h4v n GLY 164 N -1.35 -1.23 3.67 0.00 0.00 0.47 -4.73 105.19 102.02 3h4v n GLY 164 Ca 0.19 -0.05 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 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 -3.03 5.01 0.29 2.61 2.01 -0.09 -5.02 115.64 117.41 3h4v s THR 165 Ca 0.09 1.29 -0.30 0.00 0.31 0.00 0.00 61.69 63.09 3h4v s THR 165 Cb 0.13 -3.99 -0.12 0.00 0.01 0.00 0.00 72.50 68.53 3h4v s THR 165 CO 0.38 0.13 1.51 -2.65 -0.69 0.00 0.00 174.62 173.30 3h4v n PRO 166 N 4.78 2.46 0.21 4.92 -0.02 -1.26 -4.77 135.00 141.32 3h4v n PRO 166 Ca -0.01 0.87 0.08 0.00 -2.02 0.00 0.00 63.50 62.43 3h4v n PRO 166 Cb 0.50 -2.60 0.44 0.00 -0.02 0.00 0.00 33.50 31.82 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 4.28 1.28 -0.11 3.55 0.00 -1.93 -0.84 119.26 125.48 3h4v h ALA 167 Ca -0.47 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.44 3h4v h ALA 167 Cb 1.25 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.04 3h4v h ALA 167 CO 0.76 -0.28 0.00 1.63 0.00 0.00 0.00 179.25 181.36 3h4v n LYS 168 N -2.26 1.69 0.00 0.00 5.02 -1.26 -3.30 118.16 118.05 3h4v n LYS 168 Ca -0.01 -1.03 0.00 0.00 -2.02 0.00 0.00 58.31 55.25 3h4v n LYS 168 Cb 0.38 -1.43 0.00 0.00 -0.02 0.00 0.00 35.03 33.96 3h4v n LYS 168 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 3h4v n HIS 169 N 0.25 0.00 -2.15 2.13 8.25 -0.32 -5.08 115.22 118.29 3h4v n HIS 169 Ca 0.17 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 57.26 3h4v n HIS 169 Cb 0.33 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.45 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 -0.33 3.61 1.33 -0.41 0.52 -1.21 -5.01 118.95 117.46 3h4v s ARG 170 Ca 0.00 1.87 -0.22 0.00 -0.52 0.00 0.00 55.73 56.86 3h4v s ARG 170 Cb 0.00 -2.37 0.34 0.00 0.52 0.00 0.00 34.95 33.44 3h4v s ARG 170 CO 0.00 -0.70 1.03 0.20 0.02 0.00 0.00 175.30 175.85 3h4v s GLY 171 N -1.28 1.51 0.00 -3.53 0.00 -1.26 -5.00 107.32 97.76 3h4v s GLY 171 Ca 0.65 -0.99 0.00 0.00 0.00 0.00 0.00 44.72 44.39 3h4v s GLY 171 CO 0.37 -0.00 0.48 -1.30 0.00 0.00 0.00 173.10 172.64 3h4v n THR 172 N -5.24 0.11 -2.79 0.90 -2.24 -1.26 -4.81 114.28 98.95 3h4v n THR 172 Ca 0.14 -0.46 -0.11 0.00 -2.27 0.00 0.00 64.05 61.36 3h4v n THR 172 Cb 0.60 1.10 0.04 0.00 -2.10 0.00 0.00 70.33 69.97 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 0.37 -4.70 3.42 5.15 -1.26 -5.08 115.26 113.10 3h4v n ASN 173 Ca 0.00 -2.81 -0.42 0.00 -0.60 0.00 0.00 54.58 50.75 3h4v n ASN 173 Cb 0.08 -0.06 -0.03 0.00 -0.53 0.00 0.00 39.78 39.24 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 -2.07 2.60 -0.05 1.20 2.02 -1.26 -4.81 117.35 114.99 3h4v s TYR 174 Ca 0.28 0.32 -0.02 0.00 -0.37 0.00 0.00 57.07 57.28 3h4v s TYR 174 Cb 0.41 -4.04 0.03 0.00 -0.40 0.00 0.00 41.96 37.96 3h4v s TYR 174 CO -0.02 -4.07 0.10 0.45 -1.57 0.00 0.00 175.55 170.45 3h4v s SER 175 N 1.96 -0.07 -0.09 2.29 0.15 -0.12 -2.35 113.70 115.47 3h4v s SER 175 Ca 0.75 0.21 0.03 0.00 0.70 0.00 0.00 55.95 57.63 3h4v s SER 175 Cb -0.44 0.14 0.01 0.00 -1.71 0.00 0.00 66.02 64.02 3h4v s SER 175 CO 0.33 -0.11 -0.17 -0.63 1.20 0.00 0.00 173.24 173.86 3h4v s ILE 176 N 0.78 1.54 -0.10 6.45 1.01 -0.23 -1.57 121.20 129.08 3h4v s ILE 176 Ca -0.06 -0.70 0.03 0.00 0.00 0.00 0.00 60.65 59.92 3h4v s ILE 176 Cb -0.08 -1.38 -0.01 0.00 0.01 0.00 0.00 42.46 41.00 3h4v s ILE 176 CO -0.03 0.45 -0.21 -0.63 0.00 0.00 0.00 174.94 174.51 3h4v s ILE 177 N 0.66 2.36 -0.14 2.92 -1.09 0.30 -1.01 121.20 125.20 3h4v s ILE 177 Ca -0.14 -0.92 -0.02 0.00 -2.23 0.00 0.00 60.65 57.35 3h4v s ILE 177 Cb -0.16 -1.92 -0.02 0.00 -1.58 0.00 0.00 42.46 38.77 3h4v s ILE 177 CO 0.04 0.55 -0.08 0.20 -1.23 0.00 0.00 174.94 174.42 3h4v s ASN 178 N 0.25 4.42 -0.37 3.58 0.01 -0.26 0.38 114.94 122.95 3h4v s ASN 178 Ca -0.14 -0.22 -0.20 0.00 -0.71 0.00 0.00 52.86 51.58 3h4v s ASN 178 Cb -0.17 -1.70 0.01 0.00 0.41 0.00 0.00 41.25 39.80 3h4v s ASN 178 CO 0.07 0.17 0.63 -0.04 -1.51 0.00 0.00 177.10 176.42 3h4v s MET 179 N 0.35 3.60 0.00 -0.60 -1.94 -0.49 -1.44 119.30 118.77 3h4v s MET 179 Ca -0.07 -0.05 0.00 0.00 -1.71 0.00 0.00 55.69 53.86 3h4v s MET 179 Cb -0.15 -3.84 0.00 0.00 2.01 0.00 0.00 34.83 32.85 3h4v s MET 179 CO 0.04 -0.78 0.00 1.33 -0.01 0.00 0.00 175.02 175.60 3h4v n VAL 180 N 5.63 0.00 -3.61 -6.03 0.24 -0.71 -4.91 118.33 108.94 3h4v n VAL 180 Ca -0.02 0.00 -0.09 0.00 -2.04 0.00 0.00 64.34 62.19 3h4v n VAL 180 Cb 0.48 0.00 -0.10 0.00 -1.47 0.00 0.00 33.84 32.76 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 0.24 -0.11 0.57 -1.34 -1.08 -1.26 -4.28 116.67 109.41 3h4v s ASP 181 Ca 0.00 0.83 0.27 0.00 -0.52 0.00 0.00 52.55 53.13 3h4v s ASP 181 Cb 0.00 1.24 1.58 0.00 -1.46 0.00 0.00 42.92 44.28 3h4v s ASP 181 CO 0.00 -0.24 2.11 0.00 0.52 0.00 0.00 175.17 177.56 3h4v h ALA 182 N 8.19 1.90 -0.64 3.66 0.00 -1.24 -3.26 119.26 127.87 3h4v h ALA 182 Ca -0.16 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.74 3h4v h ALA 182 Cb 1.12 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.92 3h4v h ALA 182 CO 0.14 -0.27 0.00 -1.33 0.00 0.00 0.00 179.25 177.79 3h4v n MET 183 N -3.99 3.43 0.04 0.00 2.81 -1.26 -4.53 117.12 113.61 3h4v n MET 183 Ca 0.02 -2.79 0.12 0.00 -1.81 0.00 0.00 57.70 53.24 3h4v n MET 183 Cb 0.31 -1.78 0.26 0.00 -0.71 0.00 0.00 33.22 31.29 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 1.18 0.24 0.58 2.03 -2.24 -1.23 -2.14 114.28 112.70 3h4v n THR 184 Ca 0.25 -0.17 0.11 0.00 -2.27 0.00 0.00 64.05 61.97 3h4v n THR 184 Cb 0.80 -0.10 0.45 0.00 -2.10 0.00 0.00 70.33 69.38 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 -1.90 0.41 -3.88 3.42 4.13 -1.26 -3.46 115.26 112.72 3h4v n ASN 185 Ca 0.04 0.57 -0.28 0.00 1.68 0.00 0.00 54.58 56.59 3h4v n ASN 185 Cb 0.40 -0.67 -0.12 0.00 -1.54 0.00 0.00 39.78 37.85 3h4v n ASN 185 CO 0.00 0.00 0.00 -1.10 0.28 0.00 0.00 177.26 176.44 3h4v s GLN 186 N -3.13 2.25 0.47 3.52 -0.21 -0.91 -5.10 119.66 116.55 3h4v s GLN 186 Ca 0.08 -3.10 -0.22 0.00 0.02 0.00 0.00 55.36 52.14 3h4v s GLN 186 Cb 0.12 -3.28 -0.07 0.00 1.00 0.00 0.00 33.01 30.78 3h4v s GLN 186 CO 0.43 -1.25 1.15 -2.14 -2.12 0.00 0.00 175.29 171.35 3h4v s PRO 187 N -1.09 3.70 -0.04 2.91 0.02 -1.22 -4.91 135.00 134.37 3h4v s PRO 187 Ca 0.23 1.71 -0.25 0.00 0.02 0.00 0.00 61.00 62.72 3h4v s PRO 187 Cb -0.09 -2.32 -0.04 0.00 0.02 0.00 0.00 34.50 32.07 3h4v s PRO 187 CO -0.13 -0.59 0.77 -1.17 -0.33 0.00 0.00 177.00 175.55 3h4v s LEU 188 N -3.18 4.35 -0.11 -5.54 2.96 -1.26 -4.94 118.68 110.96 3h4v s LEU 188 Ca 0.65 1.33 -0.29 0.00 -0.22 0.00 0.00 54.13 55.59 3h4v s LEU 188 Cb -0.27 -3.21 -0.04 0.00 0.50 0.00 0.00 46.19 43.17 3h4v s LEU 188 CO 0.32 -0.13 1.60 -0.22 -1.32 0.00 0.00 176.35 176.60 3h4v s LEU 189 N 0.71 4.20 0.00 -0.68 2.96 -1.26 -1.91 118.68 122.71 3h4v s LEU 189 Ca 0.41 2.03 0.00 0.00 -0.22 0.00 0.00 54.13 56.35 3h4v s LEU 189 Cb -0.19 -3.53 0.00 0.00 0.50 0.00 0.00 46.19 42.97 3h4v s LEU 189 CO 0.21 -0.98 0.00 0.61 -1.32 0.00 0.00 176.35 174.87 3h4v n GLY 190 N 4.18 0.65 2.16 7.98 0.00 -1.26 -4.99 105.19 113.91 3h4v n GLY 190 Ca 0.17 -0.09 -0.28 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.69 2.95 -0.02 1.61 4.02 -0.80 0.10 117.16 122.34 3h4v n TYR 191 Ca 0.00 -2.54 -0.09 0.00 -0.01 0.00 0.00 57.90 55.26 3h4v n TYR 191 Cb 0.00 -0.76 -0.03 0.00 -0.02 0.00 0.00 39.34 38.53 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 1.75 0.56 -0.79 -0.72 2.02 -1.80 -1.54 112.91 112.38 3h4v h THR 192 Ca 0.46 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.60 3h4v h THR 192 Cb 1.24 0.56 -0.04 0.00 -1.74 0.00 0.00 68.15 68.17 3h4v h THR 192 CO 1.08 0.00 0.33 0.40 0.37 0.00 0.00 175.52 177.70 3h4v h ILE 193 N -0.19 1.26 -0.09 3.11 1.08 -1.91 0.43 117.51 121.21 3h4v h ILE 193 Ca 0.11 -0.81 0.01 0.00 -0.39 0.00 0.00 64.86 63.78 3h4v h ILE 193 Cb 0.35 0.31 -0.01 0.00 -3.07 0.00 0.00 36.82 34.40 3h4v h ILE 193 CO -0.27 0.33 0.03 0.22 -0.69 0.00 0.00 178.15 177.76 3h4v h TYR 194 N 1.15 0.05 -0.47 1.37 3.20 -1.79 0.18 116.97 120.67 3h4v h TYR 194 Ca 0.27 0.00 -0.06 0.00 3.14 0.00 0.00 58.73 62.08 3h4v h TYR 194 Cb 0.20 -0.01 -0.02 0.00 1.54 0.00 0.00 36.73 38.45 3h4v h TYR 194 CO 0.02 0.03 0.04 1.15 -1.64 0.00 0.00 178.16 177.76 3h4v h THR 195 N 0.07 1.25 -0.52 1.81 2.02 -0.86 -1.36 112.91 115.32 3h4v h THR 195 Ca 0.04 -0.97 0.01 0.00 0.77 0.00 0.00 66.41 66.25 3h4v h THR 195 Cb 0.02 0.97 -0.03 0.00 -1.74 0.00 0.00 68.15 67.37 3h4v h THR 195 CO -0.04 0.34 0.34 0.24 0.37 0.00 0.00 175.52 176.77 3h4v h MET 196 N 0.65 0.66 0.49 6.66 2.86 0.11 -0.36 114.93 126.00 3h4v h MET 196 Ca 0.14 -0.04 -0.02 0.00 -2.06 0.00 0.00 59.70 57.72 3h4v h MET 196 Cb 0.44 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 31.94 3h4v h MET 196 CO 0.02 0.44 -0.30 0.00 1.06 0.00 0.00 176.91 178.12 3h4v h ALA 197 N 1.20 -0.76 -0.86 6.32 0.00 -0.04 0.14 119.26 125.26 3h4v h ALA 197 Ca 0.20 -0.15 0.22 0.00 0.00 0.00 0.00 54.91 55.18 3h4v h ALA 197 Cb -0.05 0.38 -0.15 0.00 0.00 0.00 0.00 17.79 17.96 3h4v h ALA 197 CO -0.06 -0.94 0.11 0.87 0.00 0.00 0.00 179.25 179.23 3h4v h LYS 198 N -0.76 0.12 -0.31 0.00 1.79 -1.29 0.72 116.57 116.85 3h4v h LYS 198 Ca -0.06 -0.01 0.05 0.00 -2.18 0.00 0.00 60.65 58.46 3h4v h LYS 198 Cb 0.62 -0.03 -0.05 0.00 -1.58 0.00 0.00 32.23 31.20 3h4v h LYS 198 CO 0.06 0.08 0.01 0.78 -1.08 0.00 0.00 179.45 179.30 3h4v h GLY 199 N 0.13 0.32 0.05 3.86 0.00 -0.34 -0.25 103.07 106.83 3h4v h GLY 199 Ca 0.52 0.02 0.16 0.00 0.00 0.00 0.00 47.33 48.03 3h4v h GLY 199 CO -0.72 -0.06 0.33 0.00 0.00 0.00 0.00 176.54 176.09 3h4v h ALA 200 N 1.26 1.17 -0.26 3.60 0.00 -0.23 -1.85 119.26 122.96 3h4v h ALA 200 Ca 0.15 0.13 -0.08 0.00 0.00 0.00 0.00 54.91 55.11 3h4v h ALA 200 Cb 0.19 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 3h4v h ALA 200 CO -0.24 -0.23 -0.18 1.25 0.00 0.00 0.00 179.25 179.85 3h4v h LEU 201 N 0.45 0.44 -1.15 0.00 5.85 0.91 -1.43 115.31 120.37 3h4v h LEU 201 Ca 0.46 -0.12 -0.03 0.00 0.84 0.00 0.00 57.88 59.02 3h4v h LEU 201 Cb 0.74 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.63 3h4v h LEU 201 CO -0.44 0.64 0.24 -0.33 -0.34 0.00 0.00 178.44 178.21 3h4v h GLU 202 N 0.41 0.84 -0.29 1.25 4.39 -0.48 -1.87 114.58 118.82 3h4v h GLU 202 Ca 0.07 -0.12 -0.04 0.00 0.34 0.00 0.00 59.36 59.61 3h4v h GLU 202 Cb 0.55 -0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 29.03 3h4v h GLU 202 CO 0.04 0.68 0.04 0.78 -1.16 0.00 0.00 179.01 179.39 3h4v h GLY 203 N 0.94 0.53 1.06 -3.84 0.00 -1.04 -2.89 103.07 97.82 3h4v h GLY 203 Ca 0.20 -0.35 0.05 0.00 0.00 0.00 0.00 47.33 47.22 3h4v h GLY 203 CO -0.02 0.33 0.51 -2.00 0.00 0.00 0.00 176.54 175.36 3h4v h LEU 204 N 0.30 0.78 -0.15 3.11 5.85 -1.03 -0.72 115.31 123.45 3h4v h LEU 204 Ca 0.09 -0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.80 3h4v h LEU 204 Cb 0.35 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.20 3h4v h LEU 204 CO 0.01 0.52 0.06 0.74 -0.34 0.00 0.00 178.44 179.43 3h4v h THR 205 N 0.90 1.14 0.36 1.05 2.02 -1.21 0.97 112.91 118.14 3h4v h THR 205 Ca 0.32 -0.43 -0.02 0.00 0.77 0.00 0.00 66.41 67.05 3h4v h THR 205 Cb 0.14 1.15 0.00 0.00 -1.74 0.00 0.00 68.15 67.70 3h4v h THR 205 CO -0.10 0.13 -0.17 0.03 0.37 0.00 0.00 175.52 175.78 3h4v h ARG 206 N 0.10 -0.46 -0.52 6.66 3.08 -1.31 -2.46 114.38 119.47 3h4v h ARG 206 Ca 0.05 0.03 0.08 0.00 0.07 0.00 0.00 59.98 60.21 3h4v h ARG 206 Cb 0.15 0.11 -0.06 0.00 0.08 0.00 0.00 29.97 30.25 3h4v h ARG 206 CO -0.00 -0.14 0.17 1.03 -1.07 0.00 0.00 179.97 179.95 3h4v h SER 207 N -0.88 0.14 0.65 7.04 0.87 -1.22 -1.72 113.55 118.42 3h4v h SER 207 Ca -0.05 0.07 -0.04 0.00 -1.23 0.00 0.00 61.79 60.54 3h4v h SER 207 Cb 0.53 0.07 -0.01 0.00 -0.44 0.00 0.00 62.40 62.56 3h4v h SER 207 CO 0.08 0.10 -0.19 0.00 -0.53 0.00 0.00 176.83 176.29 3h4v h ALA 208 N 1.37 1.14 0.09 6.23 0.00 -0.87 -1.96 119.26 125.25 3h4v h ALA 208 Ca 0.26 -0.17 -0.26 0.00 0.00 0.00 0.00 54.91 54.73 3h4v h ALA 208 Cb 0.30 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.07 3h4v h ALA 208 CO -0.28 0.24 -1.14 0.00 0.00 0.00 0.00 179.25 178.07 3h4v h ALA 209 N 1.81 0.18 0.11 0.00 0.00 -0.90 -1.25 119.26 119.21 3h4v h ALA 209 Ca -0.00 -0.80 -0.01 0.00 0.00 0.00 0.00 54.91 54.10 3h4v h ALA 209 Cb 0.57 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.38 3h4v h ALA 209 CO 0.02 0.87 -0.05 1.25 0.00 0.00 0.00 179.25 181.34 3h4v h LEU 210 N 0.16 -0.13 -0.31 0.00 5.85 -1.20 -2.45 115.31 117.23 3h4v h LEU 210 Ca -0.12 -0.15 -0.12 0.00 0.84 0.00 0.00 57.88 58.32 3h4v h LEU 210 Cb 1.82 0.03 -0.02 0.00 0.37 0.00 0.00 40.66 42.87 3h4v h LEU 210 CO 0.20 0.08 -0.59 -0.08 -0.34 0.00 0.00 178.44 177.71 3h4v h GLU 211 N -0.33 0.00 0.00 1.25 4.81 -1.29 -3.20 114.58 115.82 3h4v h GLU 211 Ca -0.02 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 3h4v h GLU 211 Cb 0.27 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.65 3h4v h GLU 211 CO 0.03 0.59 -0.96 1.28 -0.73 0.00 0.00 179.01 179.21 3h4v n LEU 212 N -3.37 0.81 -0.35 1.64 4.77 -0.48 -4.31 117.00 115.71 3h4v n LEU 212 Ca 0.01 -0.33 0.03 0.00 -0.03 0.00 0.00 56.01 55.68 3h4v n LEU 212 Cb 0.71 -0.06 0.09 0.00 -2.33 0.00 0.00 43.42 41.83 3h4v n LEU 212 CO 0.41 0.19 0.59 0.00 -1.33 0.00 0.00 177.39 177.25 3h4v n ALA 213 N -1.57 0.07 0.24 -1.18 0.00 -0.92 -0.64 120.51 116.51 3h4v n ALA 213 Ca 0.04 0.99 0.10 0.00 0.00 0.00 0.00 53.44 54.56 3h4v n ALA 213 Cb 0.35 -0.52 0.47 0.00 0.00 0.00 0.00 19.45 19.75 3h4v n ALA 213 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3h4v n PRO 214 N -5.46 0.13 -0.13 0.00 -0.02 -1.26 0.30 135.00 128.56 3h4v n PRO 214 Ca 0.12 0.53 0.11 0.00 -2.02 0.00 0.00 63.50 62.24 3h4v n PRO 214 Cb 0.43 -1.85 0.17 0.00 -0.02 0.00 0.00 33.50 32.22 3h4v n PRO 214 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 3h4v n LEU 215 N -2.12 3.16 -1.28 2.45 4.77 0.19 -4.94 117.00 119.24 3h4v n LEU 215 Ca 0.00 -1.38 -0.16 0.00 -0.03 0.00 0.00 56.01 54.44 3h4v n LEU 215 Cb 0.10 -0.17 -0.06 0.00 -2.33 0.00 0.00 43.42 40.96 3h4v n LEU 215 CO 0.12 0.65 -0.16 0.00 -1.33 0.00 0.00 177.39 176.68 3h4v n GLN 216 N 1.30 -1.11 -2.67 3.23 6.02 0.87 -4.96 117.38 120.05 3h4v n GLN 216 Ca 0.16 1.01 -0.43 0.00 -0.01 0.00 0.00 57.00 57.73 3h4v n GLN 216 Cb 0.55 -5.20 -0.03 0.00 1.02 0.00 0.00 30.24 26.59 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 -2.61 4.30 0.40 5.09 1.01 -1.03 -4.37 121.20 123.99 3h4v s ILE 217 Ca 0.00 1.09 -0.20 0.00 0.00 0.00 0.00 60.65 61.54 3h4v s ILE 217 Cb 0.00 -4.54 -0.10 0.00 0.01 0.00 0.00 42.46 37.82 3h4v s ILE 217 CO 0.00 -0.94 0.89 -0.13 0.00 0.00 0.00 174.94 174.77 3h4v s ARG 218 N 4.20 4.18 -0.19 2.79 0.52 -0.99 -3.98 118.95 125.49 3h4v s ARG 218 Ca 0.44 1.01 -0.05 0.00 -0.52 0.00 0.00 55.73 56.62 3h4v s ARG 218 Cb -0.08 -2.27 0.07 0.00 0.52 0.00 0.00 34.95 33.19 3h4v s ARG 218 CO 0.29 0.03 0.13 0.08 0.02 0.00 0.00 175.30 175.86 3h4v s VAL 219 N -2.11 -0.17 0.28 3.52 1.01 -1.26 -1.07 120.40 120.61 3h4v s VAL 219 Ca 0.59 -0.17 0.05 0.00 0.00 0.00 0.00 61.98 62.46 3h4v s VAL 219 Cb -0.10 -0.62 -0.06 0.00 0.00 0.00 0.00 36.38 35.60 3h4v s VAL 219 CO 0.14 -0.27 -0.00 0.20 0.00 0.00 0.00 175.10 175.17 3h4v s ASN 220 N 2.20 2.36 0.13 3.32 0.01 -0.18 -0.09 114.94 122.69 3h4v s ASN 220 Ca 0.04 -1.26 0.06 0.00 -0.71 0.00 0.00 52.86 50.98 3h4v s ASN 220 Cb -0.16 -0.09 -0.04 0.00 0.41 0.00 0.00 41.25 41.37 3h4v s ASN 220 CO -0.11 -0.48 0.03 -0.83 -1.51 0.00 0.00 177.10 174.20 3h4v s GLY 221 N -3.42 1.81 -0.11 0.66 0.00 0.19 -1.10 107.32 105.35 3h4v s GLY 221 Ca 0.31 -1.22 0.00 0.00 0.00 0.00 0.00 44.72 43.82 3h4v s GLY 221 CO 0.12 -1.22 -0.10 0.14 0.00 0.00 0.00 173.10 172.05 3h4v s VAL 222 N -1.55 1.15 -0.42 1.40 1.01 -0.52 -1.78 120.40 119.69 3h4v s VAL 222 Ca 0.28 -0.38 -0.08 0.00 0.00 0.00 0.00 61.98 61.79 3h4v s VAL 222 Cb -0.11 -1.13 0.09 0.00 0.00 0.00 0.00 36.38 35.23 3h4v s VAL 222 CO 0.20 0.39 0.25 -0.83 0.00 0.00 0.00 175.10 175.11 3h4v s GLY 223 N 1.52 1.97 0.81 4.51 0.00 0.24 -1.73 107.32 114.64 3h4v s GLY 223 Ca 0.02 -2.26 -0.12 0.00 0.00 0.00 0.00 44.72 42.36 3h4v s GLY 223 CO -0.07 0.99 1.16 -4.14 0.00 0.00 0.00 173.10 171.04 3h4v s PRO 224 N 1.36 1.72 0.00 2.90 0.02 -1.26 0.59 135.00 140.33 3h4v s PRO 224 Ca 0.04 1.56 0.00 0.00 0.02 0.00 0.00 61.00 62.62 3h4v s PRO 224 Cb -0.23 -1.80 0.00 0.00 0.02 0.00 0.00 34.50 32.48 3h4v s PRO 224 CO 0.00 -2.11 0.00 0.41 -0.33 0.00 0.00 177.00 174.97 3h4v n GLY 225 N 0.01 -0.20 3.18 0.52 0.00 -0.79 -1.19 105.19 106.73 3h4v n GLY 225 Ca 0.12 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.80 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 -1.25 2.94 0.02 0.99 1.43 -1.26 -4.89 118.68 116.66 3h4v s LEU 226 Ca 0.00 -0.81 0.03 0.00 -1.03 0.00 0.00 54.13 52.32 3h4v s LEU 226 Cb 0.00 -1.62 -0.01 0.00 0.03 0.00 0.00 46.19 44.58 3h4v s LEU 226 CO 0.00 -0.09 -0.10 -0.44 0.23 0.00 0.00 176.35 175.95 3h4v s SER 227 N 1.32 1.15 -1.00 2.29 0.01 -1.26 -0.31 113.70 115.90 3h4v s SER 227 Ca 0.01 -0.33 -0.04 0.00 1.31 0.00 0.00 55.95 56.90 3h4v s SER 227 Cb -0.16 -0.07 0.01 0.00 0.21 0.00 0.00 66.02 66.00 3h4v s SER 227 CO -0.06 0.01 0.07 1.33 0.41 0.00 0.00 173.24 175.00 3h4v n VAL 228 N 2.27 -0.84 -1.69 3.43 0.24 -0.61 -4.75 118.33 116.37 3h4v n VAL 228 Ca -0.17 -0.34 -0.44 0.00 -2.04 0.00 0.00 64.34 61.35 3h4v n VAL 228 Cb 0.56 -0.80 -0.04 0.00 -1.47 0.00 0.00 33.84 32.10 3h4v n VAL 228 CO 0.00 0.00 0.00 -0.11 -2.14 0.00 0.00 176.83 174.58 3h4v n LEU 229 N -3.45 3.52 -4.72 1.34 7.94 -1.26 -4.95 117.00 115.42 3h4v n LEU 229 Ca -0.20 1.08 -0.41 0.00 -1.11 0.00 0.00 56.01 55.37 3h4v n LEU 229 Cb 0.45 -1.49 -0.04 0.00 0.53 0.00 0.00 43.42 42.87 3h4v n LEU 229 CO 0.56 -0.09 0.71 -0.69 -1.11 0.00 0.00 177.39 176.77 3h4v s VAL 230 N 0.93 4.46 -0.41 1.96 1.01 -1.26 -4.98 120.40 122.12 3h4v s VAL 230 Ca 0.76 1.93 0.05 0.00 0.00 0.00 0.00 61.98 64.72 3h4v s VAL 230 Cb -0.60 -4.24 0.47 0.00 0.00 0.00 0.00 36.38 32.01 3h4v s VAL 230 CO 0.37 0.24 1.52 -0.90 0.00 0.00 0.00 175.10 176.32 3h4v n ASP 231 N 3.17 5.28 -3.30 3.32 5.75 -1.26 -4.86 116.55 124.65 3h4v n ASP 231 Ca 0.04 -3.77 -0.39 0.00 -0.01 0.00 0.00 54.79 50.66 3h4v n ASP 231 Cb 0.49 -0.60 -0.03 0.00 -1.03 0.00 0.00 41.12 39.95 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 -0.86 8.73 -3.60 -1.12 5.75 -1.26 -4.79 116.55 119.40 3h4v n ASP 232 Ca 0.48 -2.59 -0.04 0.00 -0.01 0.00 0.00 54.79 52.63 3h4v n ASP 232 Cb 0.90 -1.55 -0.02 0.00 -1.03 0.00 0.00 41.12 39.42 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 2.03 0.43 0.53 0.11 0.23 -1.26 -5.15 119.30 116.22 3h4v s MET 233 Ca 0.69 -0.18 -0.20 0.00 -1.03 0.00 0.00 55.69 54.97 3h4v s MET 233 Cb 0.18 0.18 -0.08 0.00 -1.53 0.00 0.00 34.83 33.58 3h4v s MET 233 CO -0.06 -0.19 0.73 -2.30 -2.03 0.00 0.00 175.02 171.17 3h4v n PRO 234 N -0.21 0.77 -0.17 3.16 -0.02 -1.26 -4.73 135.00 132.54 3h4v n PRO 234 Ca -0.03 0.29 -0.03 0.00 -2.02 0.00 0.00 63.50 61.72 3h4v n PRO 234 Cb 0.60 -1.86 0.04 0.00 -0.02 0.00 0.00 33.50 32.25 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 0.61 -0.02 -0.16 0.52 0.11 -1.99 -2.19 132.00 128.87 3h4v h PRO 235 Ca -0.45 0.00 -0.17 0.00 0.11 0.00 0.00 66.00 65.49 3h4v h PRO 235 Cb 1.38 0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.49 3h4v h PRO 235 CO 0.50 -0.02 -0.60 0.00 -0.21 0.00 0.00 178.00 177.68 3h4v h ALA 236 N 1.47 0.65 -0.80 -0.75 0.00 -1.99 0.32 119.26 118.16 3h4v h ALA 236 Ca 0.25 -0.54 0.04 0.00 0.00 0.00 0.00 54.91 54.67 3h4v h ALA 236 Cb 0.41 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.07 3h4v h ALA 236 CO -0.55 0.70 0.53 0.28 0.00 0.00 0.00 179.25 180.21 3h4v h VAL 237 N 0.40 1.10 0.10 0.00 2.07 -1.88 -1.86 116.25 116.19 3h4v h VAL 237 Ca -0.00 -0.33 -0.19 0.00 0.82 0.00 0.00 66.70 67.00 3h4v h VAL 237 Cb 1.16 0.07 0.02 0.00 -1.52 0.00 0.00 31.29 31.02 3h4v h VAL 237 CO 0.11 0.17 -0.80 -0.25 0.02 0.00 0.00 177.57 176.83 3h4v h TRP 238 N 0.95 0.60 0.00 1.57 7.01 0.20 -3.09 115.95 123.19 3h4v h TRP 238 Ca 0.33 -0.40 0.00 0.00 2.11 0.00 0.00 58.89 60.92 3h4v h TRP 238 Cb 0.10 -0.04 0.00 0.00 -2.10 0.00 0.00 29.16 27.12 3h4v h TRP 238 CO -0.00 1.28 0.00 1.49 -2.79 0.00 0.00 178.44 178.42 3h4v h GLU 239 N -0.25 0.00 -0.31 2.65 4.57 -1.14 -3.04 114.58 117.06 3h4v h GLU 239 Ca -0.13 0.00 -0.09 0.00 -1.18 0.00 0.00 59.36 57.96 3h4v h GLU 239 Cb 1.58 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 30.15 3h4v h GLU 239 CO 0.15 0.00 -0.18 0.78 -1.18 0.00 0.00 179.01 178.58 3h4v h GLY 240 N 3.31 0.61 0.68 1.92 0.00 -1.28 -2.32 103.07 105.99 3h4v h GLY 240 Ca 0.00 -0.47 -0.07 0.00 0.00 0.00 0.00 47.33 46.79 3h4v h GLY 240 CO 0.00 0.43 -0.21 0.45 0.00 0.00 0.00 176.54 177.21 3h4v h HIS 241 N 0.51 0.40 -0.75 5.60 3.86 -1.46 -3.06 115.15 120.25 3h4v h HIS 241 Ca 0.08 -0.15 0.17 0.00 -1.16 0.00 0.00 60.37 59.32 3h4v h HIS 241 Cb 0.60 -0.07 -0.13 0.00 1.06 0.00 0.00 27.41 28.87 3h4v h HIS 241 CO 0.02 0.82 0.03 0.00 0.86 0.00 0.00 177.93 179.67 3h4v h ARG 242 N -0.14 0.12 -1.79 2.45 3.08 -1.50 -2.69 114.38 113.91 3h4v h ARG 242 Ca 0.00 -0.01 -0.05 0.00 0.07 0.00 0.00 59.98 60.00 3h4v h ARG 242 Cb 0.81 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.81 3h4v h ARG 242 CO 0.05 0.08 0.06 -1.13 -1.07 0.00 0.00 179.97 177.95 3h4v n SER 243 N -5.32 5.13 -0.02 7.04 3.41 -0.88 -1.97 113.62 121.01 3h4v n SER 243 Ca 0.14 -2.44 -0.03 0.00 -0.26 0.00 0.00 58.87 56.27 3h4v n SER 243 Cb 0.47 -1.03 -0.02 0.00 -0.26 0.00 0.00 64.21 63.38 3h4v n SER 243 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3h4v n LYS 244 N 1.18 0.11 -1.43 4.33 4.76 -1.01 -4.97 118.16 121.13 3h4v n LYS 244 Ca 0.04 0.03 -0.47 0.00 -2.87 0.00 0.00 58.31 55.04 3h4v n LYS 244 Cb 0.52 -1.02 -0.11 0.00 -1.84 0.00 0.00 35.03 32.58 3h4v n LYS 244 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 3h4v n VAL 245 N -2.73 0.03 0.13 -0.18 0.31 -0.83 -4.75 118.33 110.31 3h4v n VAL 245 Ca -0.08 -0.18 0.05 0.00 -0.01 0.00 0.00 64.34 64.12 3h4v n VAL 245 Cb 0.58 -1.12 0.51 0.00 -0.91 0.00 0.00 33.84 32.91 3h4v n VAL 245 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 3h4v h PRO 246 N 12.52 0.25 -5.87 5.55 0.11 -1.81 -2.33 132.00 140.42 3h4v h PRO 246 Ca -0.14 -0.02 -0.58 0.00 0.11 0.00 0.00 66.00 65.36 3h4v h PRO 246 Cb 1.33 -0.05 -0.07 0.00 0.11 0.00 0.00 31.00 32.31 3h4v h PRO 246 CO 1.20 0.21 0.25 -1.17 -0.21 0.00 0.00 178.00 178.27 3h4v s LEU 247 N -9.19 4.19 0.00 2.35 2.96 -0.70 -4.24 118.68 114.05 3h4v s LEU 247 Ca -0.06 1.07 0.00 0.00 -0.22 0.00 0.00 54.13 54.92 3h4v s LEU 247 Cb 0.17 -3.10 0.00 0.00 0.50 0.00 0.00 46.19 43.76 3h4v s LEU 247 CO 0.70 -0.31 0.00 -1.22 -1.32 0.00 0.00 176.35 174.20 3h4v n TYR 248 N 4.93 0.00 -2.22 5.38 4.01 -1.26 -3.60 117.16 124.40 3h4v n TYR 248 Ca 0.02 0.00 -0.17 0.00 -0.16 0.00 0.00 57.90 57.58 3h4v n TYR 248 Cb 0.49 -0.80 -0.02 0.00 -0.31 0.00 0.00 39.34 38.71 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 -1.98 -1.36 -3.74 -0.72 3.00 -0.88 -4.97 117.38 106.73 3h4v n GLN 249 Ca 0.00 0.87 -0.10 0.00 -0.01 0.00 0.00 57.00 57.77 3h4v n GLN 249 Cb 0.00 -5.30 -0.06 0.00 0.00 0.00 0.00 30.24 24.88 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 -4.68 0.97 0.77 -1.09 1.70 -1.13 -3.41 118.95 112.08 3h4v s ARG 250 Ca 0.00 -0.83 -0.11 0.00 -0.47 0.00 0.00 55.73 54.32 3h4v s ARG 250 Cb 0.00 0.41 0.05 0.00 -0.57 0.00 0.00 34.95 34.84 3h4v s ARG 250 CO 0.00 -0.35 1.09 0.16 -1.08 0.00 0.00 175.30 175.12 3h4v s ASP 251 N -2.83 4.54 0.84 -2.89 -4.77 -1.26 -4.82 116.67 105.48 3h4v s ASP 251 Ca 0.04 1.82 -0.12 0.00 -3.30 0.00 0.00 52.55 50.98 3h4v s ASP 251 Cb 0.03 -2.52 0.10 0.00 -1.09 0.00 0.00 42.92 39.44 3h4v s ASP 251 CO -0.11 -2.01 1.18 -0.94 0.70 0.00 0.00 175.17 173.98 3h4v s SER 252 N -3.41 4.17 0.49 2.11 1.04 0.58 -4.83 113.70 113.85 3h4v s SER 252 Ca 0.61 0.79 0.02 0.00 0.48 0.00 0.00 55.95 57.84 3h4v s SER 252 Cb -0.17 -1.27 0.02 0.00 0.10 0.00 0.00 66.02 64.69 3h4v s SER 252 CO 0.56 -2.12 0.71 -0.94 0.98 0.00 0.00 173.24 172.43 3h4v s SER 253 N -4.47 5.55 0.13 7.02 1.04 -1.26 -1.58 113.70 120.13 3h4v s SER 253 Ca 0.63 0.07 -0.19 0.00 0.48 0.00 0.00 55.95 56.95 3h4v s SER 253 Cb -0.11 -1.14 -0.04 0.00 0.10 0.00 0.00 66.02 64.82 3h4v s SER 253 CO 0.50 -0.91 1.77 0.00 0.98 0.00 0.00 173.24 175.58 3h4v h ALA 254 N 0.27 0.28 -0.07 5.32 0.00 -1.96 -2.61 119.26 120.50 3h4v h ALA 254 Ca -0.44 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.45 3h4v h ALA 254 Cb 1.28 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 3h4v h ALA 254 CO 0.54 -0.27 -0.04 0.00 0.00 0.00 0.00 179.25 179.47 3h4v h ALA 255 N 1.11 1.81 -0.02 0.00 0.00 -1.95 0.36 119.26 120.58 3h4v h ALA 255 Ca 0.09 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3h4v h ALA 255 Cb 0.01 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 3h4v h ALA 255 CO -0.05 0.15 0.02 0.93 0.00 0.00 0.00 179.25 180.30 3h4v h GLU 256 N 0.09 0.00 0.00 0.00 5.08 -1.86 -1.19 114.58 116.70 3h4v h GLU 256 Ca 0.02 0.00 -0.35 0.00 -1.00 0.00 0.00 59.36 58.03 3h4v h GLU 256 Cb 0.14 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.34 3h4v h GLU 256 CO 0.01 0.00 -1.95 0.28 -1.00 0.00 0.00 179.01 176.34 3h4v n VAL 257 N -3.68 1.53 0.28 3.13 0.31 -0.26 -4.53 118.33 115.11 3h4v n VAL 257 Ca -0.03 -0.22 0.16 0.00 -0.01 0.00 0.00 64.34 64.25 3h4v n VAL 257 Cb 0.10 -1.97 0.76 0.00 -0.91 0.00 0.00 33.84 31.82 3h4v n VAL 257 CO 0.00 0.00 0.00 0.77 -1.32 0.00 0.00 176.83 176.28 3h4v h SER 258 N -1.00 0.00 0.13 4.52 4.64 -0.88 -2.14 113.55 118.82 3h4v h SER 258 Ca -0.53 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 60.68 3h4v h SER 258 Cb 1.45 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.53 3h4v h SER 258 CO -0.32 0.07 -0.38 0.44 -0.87 0.00 0.00 176.83 175.77 3h4v h ASP 259 N 0.00 0.35 0.23 4.97 3.32 -1.45 -1.31 116.42 122.52 3h4v h ASP 259 Ca -0.00 -0.14 -0.01 0.00 0.02 0.00 0.00 57.03 56.89 3h4v h ASP 259 Cb 0.41 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.87 3h4v h ASP 259 CO 0.01 0.71 -0.11 0.58 -1.72 0.00 0.00 179.24 178.71 3h4v h VAL 260 N 0.29 0.84 -0.64 -1.35 2.07 -1.62 -1.64 116.25 114.19 3h4v h VAL 260 Ca 0.03 -0.44 0.11 0.00 0.82 0.00 0.00 66.70 67.22 3h4v h VAL 260 Cb 0.81 1.10 -0.12 0.00 -1.52 0.00 0.00 31.29 31.55 3h4v h VAL 260 CO 0.06 0.10 -0.33 0.58 0.02 0.00 0.00 177.57 178.00 3h4v h VAL 261 N -0.53 0.16 -0.48 2.57 2.07 -1.43 -0.59 116.25 118.03 3h4v h VAL 261 Ca -0.03 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.49 3h4v h VAL 261 Cb 0.39 0.16 -0.02 0.00 -1.52 0.00 0.00 31.29 30.30 3h4v h VAL 261 CO 0.05 0.00 0.31 0.40 0.02 0.00 0.00 177.57 178.35 3h4v h ILE 262 N -0.13 1.13 0.00 4.57 5.03 -1.15 -1.76 117.51 125.20 3h4v h ILE 262 Ca 0.25 -0.25 0.01 0.00 -0.12 0.00 0.00 64.86 64.75 3h4v h ILE 262 Cb 0.55 0.44 -0.01 0.00 -3.03 0.00 0.00 36.82 34.77 3h4v h ILE 262 CO -0.72 0.13 -0.14 0.15 -0.68 0.00 0.00 178.15 176.89 3h4v h PHE 263 N 0.64 -0.42 -1.33 1.37 3.57 -0.24 -2.40 116.94 118.14 3h4v h PHE 263 Ca 0.17 0.01 0.46 0.00 3.53 0.00 0.00 57.97 62.15 3h4v h PHE 263 Cb -0.06 0.18 -0.13 0.00 2.79 0.00 0.00 35.95 38.73 3h4v h PHE 263 CO -0.04 -0.15 0.86 1.28 -2.23 0.00 0.00 178.31 178.03 3h4v n LEU 264 N -3.29 0.19 -0.02 0.59 4.77 -0.35 0.23 117.00 119.13 3h4v n LEU 264 Ca -0.02 1.31 0.14 0.00 -0.03 0.00 0.00 56.01 57.41 3h4v n LEU 264 Cb 0.11 -0.64 0.60 0.00 -2.33 0.00 0.00 43.42 41.15 3h4v n LEU 264 CO 0.03 -1.42 0.88 0.00 -1.33 0.00 0.00 177.39 175.55 3h4v s SER 266 N -2.79 6.60 0.64 0.00 1.04 0.63 -4.92 113.70 114.90 3h4v s SER 266 Ca 0.20 1.26 0.41 0.00 0.48 0.00 0.00 55.95 58.30 3h4v s SER 266 Cb 0.19 -2.37 2.19 0.00 0.10 0.00 0.00 66.02 66.13 3h4v s SER 266 CO 0.53 -0.39 2.30 0.77 0.98 0.00 0.00 173.24 177.43 3h4v h SER 267 N 1.42 0.00 0.30 7.02 4.64 -1.90 0.80 113.55 125.82 3h4v h SER 267 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 3h4v h SER 267 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 3h4v h SER 267 CO 0.64 0.01 0.00 1.17 -0.87 0.00 0.00 176.83 177.77 3h4v n LYS 268 N -3.22 0.02 -0.44 4.77 4.81 -1.26 -2.78 118.16 120.06 3h4v n LYS 268 Ca -0.03 0.33 0.08 0.00 -0.87 0.00 0.00 58.31 57.82 3h4v n LYS 268 Cb 0.11 -1.50 0.26 0.00 0.02 0.00 0.00 35.03 33.92 3h4v n LYS 268 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3h4v n ALA 269 N -1.48 2.81 1.65 3.14 0.00 0.28 -4.80 120.51 122.11 3h4v n ALA 269 Ca 0.02 -1.72 0.05 0.00 0.00 0.00 0.00 53.44 51.79 3h4v n ALA 269 Cb 0.10 -0.74 0.27 0.00 0.00 0.00 0.00 19.45 19.08 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 0.36 0.82 0.00 0.00 -0.00 -1.12 -1.17 118.16 117.06 3h4v n LYS 270 Ca 0.20 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.51 3h4v n LYS 270 Cb 0.76 -1.17 0.00 0.00 -0.00 0.00 0.00 35.03 34.62 3h4v n LYS 270 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.40 178.38 3h4v n TYR 271 N -0.67 0.00 -3.34 5.58 9.36 -1.26 -4.98 117.16 121.84 3h4v n TYR 271 Ca 0.07 0.00 -0.38 0.00 3.32 0.00 0.00 57.90 60.91 3h4v n TYR 271 Cb 0.03 0.00 -0.06 0.00 -0.63 0.00 0.00 39.34 38.68 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 -0.51 5.19 -0.15 2.97 1.01 -0.32 -5.05 121.20 124.34 3h4v s ILE 272 Ca 0.01 0.91 -0.29 0.00 0.00 0.00 0.00 60.65 61.27 3h4v s ILE 272 Cb 0.01 -3.79 0.11 0.00 0.01 0.00 0.00 42.46 38.79 3h4v s ILE 272 CO 0.02 0.35 0.89 0.28 0.00 0.00 0.00 174.94 176.47 3h4v s THR 273 N 0.50 0.00 -0.08 2.92 -1.32 -1.26 -4.69 115.64 111.72 3h4v s THR 273 Ca 0.25 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.73 3h4v s THR 273 Cb -0.15 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 69.84 3h4v s THR 273 CO 0.10 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.12 3h4v n GLY 274 N 1.14 0.45 3.67 6.08 0.00 0.87 -4.94 105.19 112.46 3h4v n GLY 274 Ca -0.13 -0.14 -0.28 0.00 0.00 0.00 0.00 46.02 45.48 3h4v n GLY 274 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3h4v s THR 275 N -1.85 2.00 0.08 2.61 2.01 -1.26 -4.66 115.64 114.58 3h4v s THR 275 Ca 0.00 -1.91 0.10 0.00 0.31 0.00 0.00 61.69 60.19 3h4v s THR 275 Cb 0.00 -2.91 -0.03 0.00 0.01 0.00 0.00 72.50 69.56 3h4v s THR 275 CO 0.00 0.00 -0.26 0.00 -0.69 0.00 0.00 174.62 173.67 3h4v s VAL 277 N -0.94 1.93 -0.06 0.00 1.01 -0.73 -4.94 120.40 116.67 3h4v s VAL 277 Ca 0.13 -1.48 -0.30 0.00 0.00 0.00 0.00 61.98 60.34 3h4v s VAL 277 Cb -0.10 -2.09 -0.05 0.00 0.00 0.00 0.00 36.38 34.14 3h4v s VAL 277 CO 0.04 -0.05 1.54 -0.54 0.00 0.00 0.00 175.10 176.09 3h4v s LYS 278 N 1.21 4.21 -0.97 2.72 1.02 -1.26 -0.59 119.74 126.08 3h4v s LYS 278 Ca -0.08 2.06 -0.04 0.00 0.02 0.00 0.00 55.97 57.94 3h4v s LYS 278 Cb -0.20 -3.84 0.24 0.00 -0.52 0.00 0.00 37.83 33.51 3h4v s LYS 278 CO -0.05 -0.76 0.90 0.08 -0.92 0.00 0.00 175.35 174.59 3h4v s VAL 279 N 3.54 4.90 -0.00 3.17 1.01 0.20 -4.90 120.40 128.32 3h4v s VAL 279 Ca 0.68 -3.75 0.00 0.00 0.00 0.00 0.00 61.98 58.92 3h4v s VAL 279 Cb -0.31 -4.00 0.00 0.00 0.00 0.00 0.00 36.38 32.07 3h4v s VAL 279 CO 0.26 -1.12 0.66 -0.90 0.00 0.00 0.00 175.10 174.00 3h4v n ASP 280 N 2.42 0.02 -2.28 3.32 5.75 -1.26 -1.88 116.55 122.65 3h4v n ASP 280 Ca 0.22 -1.33 -0.09 0.00 -0.01 0.00 0.00 54.79 53.59 3h4v n ASP 280 Cb 0.38 -0.06 -0.01 0.00 -1.03 0.00 0.00 41.12 40.39 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 -0.01 -0.29 1.97 6.12 0.00 -1.26 -0.49 105.19 111.22 3h4v n GLY 281 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -0.64 0.76 0.38 -0.02 0.00 -1.26 -1.72 105.19 102.68 3h4v n GLY 282 Ca -0.10 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.05 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 0.67 0.00 1.61 3.20 -1.10 -1.43 116.97 119.92 3h4v h TYR 283 Ca 0.00 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.88 3h4v h TYR 283 Cb 0.00 -0.21 -0.00 0.00 1.54 0.00 0.00 36.73 38.06 3h4v h TYR 283 CO 0.00 0.25 -0.02 0.66 -1.64 0.00 0.00 178.16 177.41 3h4v h SER 284 N 0.57 0.00 0.06 -2.11 4.64 -1.88 -1.87 113.55 112.96 3h4v h SER 284 Ca 0.41 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.73 3h4v h SER 284 Cb 0.77 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.86 3h4v h SER 284 CO -0.17 0.02 0.00 0.18 -0.87 0.00 0.00 176.83 176.00 3h4v n LEU 285 N -3.15 0.00 -4.96 5.97 4.77 -0.54 -4.85 117.00 114.24 3h4v n LEU 285 Ca -0.00 0.08 -0.22 0.00 -0.03 0.00 0.00 56.01 55.84 3h4v n LEU 285 Cb 0.26 -0.08 0.01 0.00 -2.33 0.00 0.00 43.42 41.27 3h4v n LEU 285 CO 0.26 -0.05 0.23 0.42 -1.33 0.00 0.00 177.39 176.92 3h4v s THR 286 N -2.16 4.02 0.07 -5.08 -4.23 -0.71 -5.12 115.64 102.43 3h4v s THR 286 Ca 0.16 -0.61 -0.05 0.00 -1.18 0.00 0.00 61.69 60.02 3h4v s THR 286 Cb 0.08 -3.47 -0.02 0.00 1.34 0.00 0.00 72.50 70.43 3h4v s THR 286 CO 0.15 -0.29 0.07 0.00 -0.54 0.00 0.00 174.62 174.01 3h4v s ARG 287 N -4.47 0.72 0.00 3.99 1.70 -1.26 -5.13 118.95 114.50 3h4v s ARG 287 Ca 0.47 -1.10 0.11 0.00 -0.47 0.00 0.00 55.73 54.75 3h4v s ARG 287 Cb -0.10 0.27 0.67 0.00 -0.57 0.00 0.00 34.95 35.23 3h4v s ARG 287 CO 0.36 -0.18 1.11 0.00 -1.08 0.00 0.00 175.30 175.51