#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2p76 s TRP 45 N 0.00 1.86 0.00 2.61 0.51 -1.26 -5.02 118.94 117.64 2p76 s TRP 45 Ca 0.00 -0.48 -0.10 0.00 -2.12 0.00 0.00 56.10 53.41 2p76 s TRP 45 Cb 0.00 -2.50 -0.05 0.00 -0.81 0.00 0.00 33.47 30.11 2p76 s TRP 45 CO 0.00 -1.13 0.32 -1.01 -0.51 0.00 0.00 176.95 174.61 2p76 s HIS 46 N -2.74 3.63 0.14 -1.98 3.76 -1.26 -5.10 115.29 111.73 2p76 s HIS 46 Ca 0.61 0.73 0.10 0.00 -0.15 0.00 0.00 55.06 56.36 2p76 s HIS 46 Cb -0.07 -2.11 -0.04 0.00 1.11 0.00 0.00 32.58 31.48 2p76 s HIS 46 CO 0.39 0.62 -0.25 0.95 -0.85 0.00 0.00 174.74 175.60 2p76 s THR 47 N -1.22 2.14 0.28 1.30 -4.23 -1.26 -4.84 115.64 107.81 2p76 s THR 47 Ca 0.26 -1.76 -0.21 0.00 -1.18 0.00 0.00 61.69 58.79 2p76 s THR 47 Cb -0.14 -1.92 -0.14 0.00 1.34 0.00 0.00 72.50 71.64 2p76 s THR 47 CO 0.14 0.01 0.24 0.59 -0.54 0.00 0.00 174.62 175.06 2p76 n ASN 48 N 0.82 -1.92 0.24 3.99 3.02 -1.25 -4.81 115.26 115.35 2p76 n ASN 48 Ca -0.17 0.84 0.16 0.00 -0.03 0.00 0.00 54.58 55.38 2p76 n ASN 48 Cb 0.54 -0.81 0.60 0.00 -0.61 0.00 0.00 39.78 39.50 2p76 n ASN 48 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 2p76 h LEU 49 N 0.55 0.00 0.00 3.41 3.38 -1.89 -2.04 115.31 118.71 2p76 h LEU 49 Ca -0.29 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.68 2p76 h LEU 49 Cb 1.28 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.03 2p76 h LEU 49 CO 0.45 0.00 0.00 0.35 0.09 0.00 0.00 178.44 179.33 2p76 n THR 50 N -2.92 0.45 -1.04 0.22 -2.24 -1.22 -3.86 114.28 103.67 2p76 n THR 50 Ca 0.01 0.11 -0.02 0.00 -2.27 0.00 0.00 64.05 61.89 2p76 n THR 50 Cb 0.31 -0.76 -0.01 0.00 -2.10 0.00 0.00 70.33 67.78 2p76 n THR 50 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2p76 n ASN 51 N -1.38 -3.40 -4.85 3.42 5.15 -0.77 -5.01 115.26 108.42 2p76 n ASN 51 Ca 0.08 0.04 -0.36 0.00 -0.60 0.00 0.00 54.58 53.73 2p76 n ASN 51 Cb 0.20 -1.04 -0.06 0.00 -0.53 0.00 0.00 39.78 38.36 2p76 n ASN 51 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 2p76 s GLU 52 N -1.28 3.85 0.08 1.20 2.02 -1.26 -4.98 118.70 118.33 2p76 s GLU 52 Ca 0.00 0.31 -0.15 0.00 0.02 0.00 0.00 54.97 55.15 2p76 s GLU 52 Cb 0.00 -3.11 -0.12 0.00 0.10 0.00 0.00 34.13 31.00 2p76 s GLU 52 CO 0.00 0.63 1.35 -0.09 0.02 0.00 0.00 175.26 177.17 2p76 h ARG 53 N 4.24 0.67 -4.52 1.61 9.65 -1.93 -3.34 114.38 120.75 2p76 h ARG 53 Ca -0.50 -0.42 -0.59 0.00 -1.10 0.00 0.00 59.98 57.36 2p76 h ARG 53 Cb 1.21 0.05 -0.37 0.00 -1.39 0.00 0.00 29.97 29.47 2p76 h ARG 53 CO 0.64 1.04 -0.82 -0.06 2.80 0.00 0.00 179.97 183.57 2p76 s PHE 54 N -4.10 2.07 -0.05 2.20 0.08 -1.26 -4.67 117.98 112.25 2p76 s PHE 54 Ca -0.12 -1.23 -0.08 0.00 0.12 0.00 0.00 56.93 55.62 2p76 s PHE 54 Cb 0.08 -1.52 -0.05 0.00 -0.57 0.00 0.00 43.02 40.96 2p76 s PHE 54 CO 0.84 -0.66 0.23 -0.08 -0.10 0.00 0.00 175.22 175.45 2p76 s THR 55 N 1.51 5.36 -0.45 0.64 -1.32 0.24 -4.94 115.64 116.68 2p76 s THR 55 Ca 0.03 0.28 -0.09 0.00 -1.21 0.00 0.00 61.69 60.70 2p76 s THR 55 Cb -0.14 -3.52 0.10 0.00 -1.51 0.00 0.00 72.50 67.43 2p76 s THR 55 CO -0.09 0.51 0.31 -0.89 -2.21 0.00 0.00 174.62 172.25 2p76 s THR 56 N -1.14 4.25 -0.42 5.08 2.01 -1.26 -2.78 115.64 121.37 2p76 s THR 56 Ca 0.21 -1.58 -0.22 0.00 0.31 0.00 0.00 61.69 60.41 2p76 s THR 56 Cb -0.13 -3.70 0.02 0.00 0.01 0.00 0.00 72.50 68.70 2p76 s THR 56 CO 0.10 -0.64 0.72 -0.63 -0.69 0.00 0.00 174.62 173.48 2p76 s ILE 57 N 1.40 4.75 -1.04 1.82 1.01 -0.51 -0.86 121.20 127.77 2p76 s ILE 57 Ca 0.04 0.39 -0.23 0.00 0.00 0.00 0.00 60.65 60.85 2p76 s ILE 57 Cb -0.25 -4.24 -0.03 0.00 0.01 0.00 0.00 42.46 37.95 2p76 s ILE 57 CO 0.01 -0.59 1.85 0.00 0.00 0.00 0.00 174.94 176.20 2p76 s ALA 58 N 3.03 2.01 -0.50 9.38 0.00 -0.99 -1.17 121.76 133.52 2p76 s ALA 58 Ca 0.27 -1.95 -0.35 0.00 0.00 0.00 0.00 51.96 49.93 2p76 s ALA 58 Cb -0.13 -4.60 -0.14 0.00 0.00 0.00 0.00 23.12 18.25 2p76 s ALA 58 CO 0.20 -4.63 2.30 1.58 0.00 0.00 0.00 175.76 175.21 2p76 n HIS 59 N 12.84 1.33 -2.09 0.00 -0.00 -0.47 0.21 115.22 127.03 2p76 n HIS 59 Ca 0.41 0.34 -0.21 0.00 0.46 0.00 0.00 57.72 58.73 2p76 n HIS 59 Cb 0.47 -2.48 -0.04 0.00 -0.12 0.00 0.00 29.99 27.82 2p76 n HIS 59 CO 0.00 0.00 0.00 0.54 0.46 0.00 0.00 176.34 177.34 2p76 n ARG 60 N 8.26 -1.59 0.00 1.57 1.74 -1.21 -3.74 116.66 121.69 2p76 n ARG 60 Ca 0.47 1.10 0.00 0.00 -0.77 0.00 0.00 57.85 58.65 2p76 n ARG 60 Cb 0.20 -5.66 0.00 0.00 -1.02 0.00 0.00 32.46 25.98 2p76 n ARG 60 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2p76 n GLY 61 N -0.78 -0.34 2.21 -0.13 0.00 0.13 -1.51 105.19 104.78 2p76 n GLY 61 Ca -0.23 -1.59 -0.25 0.00 0.00 0.00 0.00 46.02 43.95 2p76 n GLY 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2p76 n ALA 62 N 1.69 6.80 -0.33 4.61 0.00 0.17 -4.71 120.51 128.74 2p76 n ALA 62 Ca 0.00 -2.75 0.14 0.00 0.00 0.00 0.00 53.44 50.83 2p76 n ALA 62 Cb 0.00 -2.66 0.27 0.00 0.00 0.00 0.00 19.45 17.06 2p76 n ALA 62 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2p76 n SER 63 N 2.52 -0.13 0.22 0.00 2.88 -1.25 -0.82 113.62 117.05 2p76 n SER 63 Ca 0.57 1.62 0.15 0.00 -1.33 0.00 0.00 58.87 59.88 2p76 n SER 63 Cb 0.59 -0.58 0.60 0.00 -0.75 0.00 0.00 64.21 64.07 2p76 n SER 63 CO 0.00 0.00 0.00 1.23 -1.23 0.00 0.00 175.04 175.04 2p76 h GLY 64 N 0.00 0.00 0.00 0.46 0.00 -1.32 -3.29 103.07 98.92 2p76 h GLY 64 Ca 0.57 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.90 2p76 h GLY 64 CO -0.90 0.00 -1.30 -1.72 0.00 0.00 0.00 176.54 172.62 2p76 n TYR 65 N -2.79 0.00 -4.17 5.60 4.01 -0.04 -4.98 117.16 114.80 2p76 n TYR 65 Ca 0.01 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.65 2p76 n TYR 65 Cb 0.29 -0.15 -0.10 0.00 -0.31 0.00 0.00 39.34 39.07 2p76 n TYR 65 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2p76 s ALA 66 N -2.46 0.95 -0.12 -0.72 0.00 0.00 -4.86 121.76 114.56 2p76 s ALA 66 Ca -0.02 -1.42 -0.29 0.00 0.00 0.00 0.00 51.96 50.23 2p76 s ALA 66 Cb 0.04 0.47 -0.07 0.00 0.00 0.00 0.00 23.12 23.57 2p76 s ALA 66 CO 0.27 -0.35 2.11 -1.25 0.00 0.00 0.00 175.76 176.55 2p76 s PRO 67 N -3.93 3.54 0.41 0.00 0.04 -1.26 -4.25 135.00 129.55 2p76 s PRO 67 Ca 0.17 2.26 -0.21 0.00 0.04 0.00 0.00 61.00 63.27 2p76 s PRO 67 Cb 0.07 -4.29 -0.15 0.00 0.04 0.00 0.00 34.50 30.17 2p76 s PRO 67 CO -0.02 -1.64 0.07 -0.85 0.04 0.00 0.00 177.00 174.60 2p76 n GLU 68 N 8.26 0.00 -3.88 4.56 0.28 -1.26 -3.31 120.64 125.29 2p76 n GLU 68 Ca 0.26 0.00 -0.28 0.00 -0.16 0.00 0.00 57.16 56.98 2p76 n GLU 68 Cb 0.43 -0.98 0.00 0.00 1.43 0.00 0.00 31.44 32.32 2p76 n GLU 68 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 177.13 177.69 2p76 n HIS 69 N -1.05 -1.71 -4.03 -1.84 8.25 -0.57 -4.97 115.22 109.31 2p76 n HIS 69 Ca 0.11 0.63 -0.08 0.00 -0.26 0.00 0.00 57.72 58.12 2p76 n HIS 69 Cb 0.40 -3.63 -0.10 0.00 1.12 0.00 0.00 29.99 27.78 2p76 n HIS 69 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 2p76 s THR 70 N -3.79 0.17 0.32 1.59 -4.23 -1.21 -4.31 115.64 104.18 2p76 s THR 70 Ca 0.16 -1.38 0.08 0.00 -1.18 0.00 0.00 61.69 59.37 2p76 s THR 70 Cb -0.06 -0.98 0.32 0.00 1.34 0.00 0.00 72.50 73.11 2p76 s THR 70 CO 0.88 -0.76 1.77 -0.26 -0.54 0.00 0.00 174.62 175.71 2p76 h PHE 71 N 3.75 0.99 0.29 3.99 0.04 -1.91 0.31 116.94 124.40 2p76 h PHE 71 Ca -0.33 0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.48 2p76 h PHE 71 Cb 1.17 -0.30 -0.03 0.00 2.20 0.00 0.00 35.95 38.99 2p76 h PHE 71 CO 0.58 0.19 -0.42 1.96 -0.60 0.00 0.00 178.31 180.01 2p76 h GLN 72 N 0.68 -0.74 -0.88 1.51 7.50 -1.95 0.99 115.11 122.22 2p76 h GLN 72 Ca 0.58 0.05 0.04 0.00 0.50 0.00 0.00 58.65 59.82 2p76 h GLN 72 Cb 1.02 0.17 -0.05 0.00 0.05 0.00 0.00 27.48 28.67 2p76 h GLN 72 CO -0.37 -0.49 0.58 0.00 -1.50 0.00 0.00 178.83 177.04 2p76 h ALA 73 N -0.38 1.46 -0.08 3.87 0.00 -1.36 -0.76 119.26 122.02 2p76 h ALA 73 Ca -0.01 -0.04 -0.14 0.00 0.00 0.00 0.00 54.91 54.71 2p76 h ALA 73 Cb 0.72 -0.31 0.01 0.00 0.00 0.00 0.00 17.79 18.22 2p76 h ALA 73 CO -0.14 0.45 -0.50 1.88 0.00 0.00 0.00 179.25 180.94 2p76 h TYR 74 N 1.09 0.66 -0.55 0.00 0.05 -0.49 0.49 116.97 118.21 2p76 h TYR 74 Ca 0.35 -0.30 0.06 0.00 0.05 0.00 0.00 58.73 58.89 2p76 h TYR 74 Cb 0.04 -0.10 -0.05 0.00 1.01 0.00 0.00 36.73 37.63 2p76 h TYR 74 CO -0.00 1.08 0.26 -0.44 -1.05 0.00 0.00 178.16 178.02 2p76 h ASP 75 N 0.05 0.36 0.49 3.88 3.32 0.13 -0.09 116.42 124.55 2p76 h ASP 75 Ca -0.04 0.04 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 2p76 h ASP 75 Cb 1.16 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 40.69 2p76 h ASP 75 CO 0.10 0.24 -0.24 0.50 -1.72 0.00 0.00 179.24 178.13 2p76 h LYS 76 N 0.50 -0.64 -0.06 3.56 3.64 -1.15 1.00 116.57 123.42 2p76 h LYS 76 Ca 0.25 0.04 -0.08 0.00 -1.27 0.00 0.00 60.65 59.60 2p76 h LYS 76 Cb 0.20 0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.15 2p76 h LYS 76 CO -0.20 -0.41 -0.33 0.66 -2.27 0.00 0.00 179.45 176.90 2p76 h SER 77 N -0.69 0.12 0.00 4.20 4.64 -1.31 0.30 113.55 120.81 2p76 h SER 77 Ca -0.07 -0.04 -0.11 0.00 -0.47 0.00 0.00 61.79 61.10 2p76 h SER 77 Cb 0.52 -0.03 -0.02 0.00 -0.31 0.00 0.00 62.40 62.56 2p76 h SER 77 CO 0.11 0.45 -0.65 -0.74 -0.87 0.00 0.00 176.83 175.13 2p76 h HIS 78 N 0.10 0.00 0.00 4.77 -0.00 -0.95 0.18 115.15 119.26 2p76 h HIS 78 Ca 0.01 0.00 -0.00 0.00 -0.00 0.00 0.00 60.37 60.38 2p76 h HIS 78 Cb 0.64 0.00 -0.00 0.00 -0.00 0.00 0.00 27.41 28.05 2p76 h HIS 78 CO 0.01 1.08 -0.03 -0.91 -0.00 0.00 0.00 177.93 178.08 2p76 h ASN 79 N -1.00 0.00 0.00 3.26 -0.26 -0.92 -3.26 115.58 113.40 2p76 h ASN 79 Ca -0.17 -0.88 0.00 0.00 -0.56 0.00 0.00 56.30 54.69 2p76 h ASN 79 Cb 1.03 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.29 2p76 h ASN 79 CO -0.10 0.96 0.00 1.21 -1.06 0.00 0.00 177.43 178.44 2p76 n GLU 80 N -4.62 0.00 0.13 0.81 2.13 -0.81 -4.22 120.64 114.06 2p76 n GLU 80 Ca -0.09 0.26 0.12 0.00 0.66 0.00 0.00 57.16 58.11 2p76 n GLU 80 Cb 0.43 -0.87 0.50 0.00 0.27 0.00 0.00 31.44 31.77 2p76 n GLU 80 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 2p76 n LEU 81 N -1.29 0.64 -3.69 4.31 4.77 0.03 -4.92 117.00 116.85 2p76 n LEU 81 Ca 0.00 0.68 -0.31 0.00 -0.03 0.00 0.00 56.01 56.36 2p76 n LEU 81 Cb 0.00 -0.62 0.04 0.00 -2.33 0.00 0.00 43.42 40.51 2p76 n LEU 81 CO 0.00 -0.63 -0.08 0.29 -1.33 0.00 0.00 177.39 175.64 2p76 n LYS 82 N -2.23 -1.46 -2.32 3.23 5.02 -0.76 -4.79 118.16 114.86 2p76 n LYS 82 Ca 0.01 0.47 -0.29 0.00 -2.02 0.00 0.00 58.31 56.48 2p76 n LYS 82 Cb 0.19 -4.21 0.00 0.00 -0.02 0.00 0.00 35.03 30.99 2p76 n LYS 82 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2p76 s ALA 83 N -3.49 3.27 0.12 7.82 0.00 0.56 -5.01 121.76 125.03 2p76 s ALA 83 Ca 0.44 -0.32 -0.17 0.00 0.00 0.00 0.00 51.96 51.91 2p76 s ALA 83 Cb -0.15 -2.80 -0.03 0.00 0.00 0.00 0.00 23.12 20.14 2p76 s ALA 83 CO 0.86 -0.49 1.69 0.77 0.00 0.00 0.00 175.76 178.59 2p76 h SER 84 N 0.01 0.46 -3.77 0.00 0.02 -1.33 -3.46 113.55 105.49 2p76 h SER 84 Ca -0.46 -0.14 -0.50 0.00 -0.84 0.00 0.00 61.79 59.85 2p76 h SER 84 Cb 1.20 -0.12 -0.19 0.00 0.14 0.00 0.00 62.40 63.43 2p76 h SER 84 CO 0.62 0.47 -0.78 -0.31 -1.14 0.00 0.00 176.83 175.69 2p76 s TYR 85 N -5.65 1.71 -0.41 3.45 2.02 -0.96 -4.23 117.35 113.28 2p76 s TYR 85 Ca -0.13 -0.48 -0.11 0.00 -0.37 0.00 0.00 57.07 55.97 2p76 s TYR 85 Cb 0.09 -0.87 0.06 0.00 -0.40 0.00 0.00 41.96 40.84 2p76 s TYR 85 CO 0.74 0.27 0.27 0.42 -1.57 0.00 0.00 175.55 175.67 2p76 s ILE 86 N -1.94 4.55 -0.17 2.71 1.01 0.04 -2.36 121.20 125.04 2p76 s ILE 86 Ca 0.13 -1.15 -0.25 0.00 0.00 0.00 0.00 60.65 59.37 2p76 s ILE 86 Cb -0.06 -3.69 -0.01 0.00 0.01 0.00 0.00 42.46 38.71 2p76 s ILE 86 CO 0.05 -0.43 0.82 -0.70 0.00 0.00 0.00 174.94 174.68 2p76 s GLU 87 N 1.51 4.29 -0.05 2.79 -6.30 -1.16 -1.70 118.70 118.08 2p76 s GLU 87 Ca 0.03 0.99 0.06 0.00 -2.50 0.00 0.00 54.97 53.55 2p76 s GLU 87 Cb -0.22 -3.58 -0.01 0.00 0.00 0.00 0.00 34.13 30.33 2p76 s GLU 87 CO 0.05 -0.33 -0.22 0.42 0.02 0.00 0.00 175.26 175.20 2p76 s ILE 88 N 2.15 1.84 -0.20 -3.70 1.01 0.35 -3.34 121.20 119.31 2p76 s ILE 88 Ca 0.38 -0.95 -0.05 0.00 0.00 0.00 0.00 60.65 60.02 2p76 s ILE 88 Cb -0.16 -1.56 -0.03 0.00 0.01 0.00 0.00 42.46 40.72 2p76 s ILE 88 CO 0.12 0.52 0.01 -1.81 0.00 0.00 0.00 174.94 173.78 2p76 s ASP 89 N -0.11 4.92 -0.04 3.58 1.01 -1.26 -1.17 116.67 123.59 2p76 s ASP 89 Ca -0.03 -0.18 -0.13 0.00 0.71 0.00 0.00 52.55 52.92 2p76 s ASP 89 Cb -0.13 -1.84 -0.05 0.00 1.01 0.00 0.00 42.92 41.91 2p76 s ASP 89 CO 0.03 0.07 0.34 -0.76 0.21 0.00 0.00 175.17 175.05 2p76 s LEU 90 N 0.99 4.44 0.16 1.23 1.43 -1.07 -0.27 118.68 125.59 2p76 s LEU 90 Ca 0.02 0.81 -0.04 0.00 -1.03 0.00 0.00 54.13 53.89 2p76 s LEU 90 Cb -0.14 -2.45 -0.03 0.00 0.03 0.00 0.00 46.19 43.60 2p76 s LEU 90 CO 0.02 0.32 0.16 -1.10 0.23 0.00 0.00 176.35 175.98 2p76 s GLN 91 N -0.93 1.08 0.03 1.70 -1.52 -0.24 -4.77 119.66 115.01 2p76 s GLN 91 Ca 0.21 -1.38 0.04 0.00 -1.95 0.00 0.00 55.36 52.28 2p76 s GLN 91 Cb -0.15 0.30 -0.02 0.00 -0.22 0.00 0.00 33.01 32.92 2p76 s GLN 91 CO 0.10 -0.35 -0.13 0.50 -0.25 0.00 0.00 175.29 175.16 2p76 s ARG 92 N -4.04 0.92 0.80 2.91 3.52 -1.26 -0.55 118.95 121.25 2p76 s ARG 92 Ca 0.25 -0.68 -0.11 0.00 -0.13 0.00 0.00 55.73 55.06 2p76 s ARG 92 Cb 0.06 -0.91 0.09 0.00 -1.56 0.00 0.00 34.95 32.62 2p76 s ARG 92 CO 0.03 0.23 1.15 0.95 -0.81 0.00 0.00 175.30 176.86 2p76 s THR 93 N -0.74 2.06 0.28 4.11 -4.23 -0.26 -3.00 115.64 113.86 2p76 s THR 93 Ca 0.02 -0.06 0.01 0.00 -1.18 0.00 0.00 61.69 60.47 2p76 s THR 93 Cb -0.07 -3.00 0.28 0.00 1.34 0.00 0.00 72.50 71.05 2p76 s THR 93 CO 0.01 0.00 1.83 0.50 -0.54 0.00 0.00 174.62 176.41 2p76 h LYS 94 N -1.00 0.93 -0.91 3.99 3.64 0.53 0.14 116.57 123.88 2p76 h LYS 94 Ca -0.45 -0.06 -0.25 0.00 -1.27 0.00 0.00 60.65 58.62 2p76 h LYS 94 Cb 1.32 -0.21 -0.15 0.00 -0.41 0.00 0.00 32.23 32.78 2p76 h LYS 94 CO 0.62 0.61 0.31 -0.40 -2.27 0.00 0.00 179.45 178.33 2p76 n ASP 95 N -4.65 3.74 -1.17 4.20 5.75 -1.26 -4.93 116.55 118.23 2p76 n ASP 95 Ca 0.19 -2.96 -0.12 0.00 -0.01 0.00 0.00 54.79 51.89 2p76 n ASP 95 Cb 0.37 -0.70 -0.03 0.00 -1.03 0.00 0.00 41.12 39.73 2p76 n ASP 95 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2p76 n GLY 96 N -0.30 0.63 3.72 6.12 0.00 0.48 -4.98 105.19 110.86 2p76 n GLY 96 Ca 0.34 -0.41 -0.39 0.00 0.00 0.00 0.00 46.02 45.56 2p76 n GLY 96 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2p76 s HIS 97 N -2.54 3.56 0.01 1.61 3.76 -1.26 -4.74 115.29 115.69 2p76 s HIS 97 Ca 0.00 1.13 -0.30 0.00 -0.15 0.00 0.00 55.06 55.74 2p76 s HIS 97 Cb 0.00 -2.72 -0.04 0.00 1.11 0.00 0.00 32.58 30.93 2p76 s HIS 97 CO 0.00 0.12 1.17 -0.51 -0.85 0.00 0.00 174.74 174.68 2p76 s LEU 98 N 0.71 4.33 0.14 0.89 1.43 -1.26 -1.10 118.68 123.82 2p76 s LEU 98 Ca 0.34 1.89 0.03 0.00 -1.03 0.00 0.00 54.13 55.36 2p76 s LEU 98 Cb -0.17 -3.57 -0.04 0.00 0.03 0.00 0.00 46.19 42.44 2p76 s LEU 98 CO 0.16 -0.49 -0.08 0.68 0.23 0.00 0.00 176.35 176.85 2p76 s VAL 99 N 1.53 0.97 -0.25 -1.59 -7.23 0.29 -1.03 120.40 113.09 2p76 s VAL 99 Ca 0.57 -2.01 -0.17 0.00 -1.81 0.00 0.00 61.98 58.55 2p76 s VAL 99 Cb -0.26 -1.84 -0.03 0.00 0.56 0.00 0.00 36.38 34.80 2p76 s VAL 99 CO 0.26 -0.74 0.47 0.00 -0.31 0.00 0.00 175.10 174.78 2p76 s ALA 100 N -3.45 3.58 -0.29 1.32 0.00 0.06 -1.08 121.76 121.90 2p76 s ALA 100 Ca 0.16 -0.63 -0.22 0.00 0.00 0.00 0.00 51.96 51.27 2p76 s ALA 100 Cb 0.04 -2.82 0.13 0.00 0.00 0.00 0.00 23.12 20.48 2p76 s ALA 100 CO -0.00 -0.66 1.05 1.41 0.00 0.00 0.00 175.76 177.56 2p76 s MET 101 N 2.11 0.43 -0.05 0.00 0.00 0.63 -4.48 119.30 117.95 2p76 s MET 101 Ca 0.20 0.57 -0.24 0.00 0.00 0.00 0.00 55.69 56.22 2p76 s MET 101 Cb -0.16 0.18 -0.19 0.00 0.00 0.00 0.00 34.83 34.66 2p76 s MET 101 CO 0.09 -0.06 1.05 1.25 0.00 0.00 0.00 175.02 177.35 2p76 h HIS 102 N 4.65 -0.11 -3.99 4.11 2.76 -1.94 -3.38 115.15 117.25 2p76 h HIS 102 Ca -0.28 -0.00 -0.48 0.00 -2.20 0.00 0.00 60.37 57.40 2p76 h HIS 102 Cb 1.18 0.03 0.06 0.00 1.55 0.00 0.00 27.41 30.24 2p76 h HIS 102 CO 0.25 0.41 0.27 -0.51 -1.30 0.00 0.00 177.93 177.06 2p76 s ASP 103 N -5.63 5.55 0.00 3.26 1.01 -1.26 -4.97 116.67 114.64 2p76 s ASP 103 Ca -0.15 0.89 0.28 0.00 0.71 0.00 0.00 52.55 54.28 2p76 s ASP 103 Cb 0.01 -1.81 1.12 0.00 1.01 0.00 0.00 42.92 43.24 2p76 s ASP 103 CO 0.59 -1.17 1.82 -0.62 0.21 0.00 0.00 175.17 176.00 2p76 n GLU 104 N -2.75 0.18 -4.67 8.23 1.02 -1.26 -4.78 120.64 116.60 2p76 n GLU 104 Ca 0.05 -0.04 -0.28 0.00 -0.02 0.00 0.00 57.16 56.88 2p76 n GLU 104 Cb 0.57 -1.50 -0.14 0.00 -0.02 0.00 0.00 31.44 30.35 2p76 n GLU 104 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 2p76 s THR 105 N -2.85 1.92 -1.21 2.62 -4.23 -1.26 0.29 115.64 110.92 2p76 s THR 105 Ca 0.18 -1.38 0.29 0.00 -1.18 0.00 0.00 61.69 59.60 2p76 s THR 105 Cb 0.19 -1.67 0.37 0.00 1.34 0.00 0.00 72.50 72.73 2p76 s THR 105 CO 0.55 0.22 1.95 1.33 -0.54 0.00 0.00 174.62 178.13 2p76 n VAL 106 N 1.62 0.06 -0.14 2.29 0.24 -0.55 -4.42 118.33 117.43 2p76 n VAL 106 Ca -0.17 0.01 -0.12 0.00 -2.04 0.00 0.00 64.34 62.02 2p76 n VAL 106 Cb 0.53 -0.53 -0.09 0.00 -1.47 0.00 0.00 33.84 32.27 2p76 n VAL 106 CO 0.00 0.00 0.00 0.78 -2.14 0.00 0.00 176.83 175.47 2p76 h ASN 107 N 0.00 -1.70 -0.80 -1.34 4.21 -1.75 -1.33 115.58 112.87 2p76 h ASN 107 Ca 0.00 0.22 0.02 0.00 1.21 0.00 0.00 56.30 57.76 2p76 h ASN 107 Cb 0.38 0.70 -0.05 0.00 -1.12 0.00 0.00 38.32 38.23 2p76 h ASN 107 CO 0.00 -0.36 0.51 -0.09 -1.29 0.00 0.00 177.43 176.21 2p76 h ARG 108 N -0.34 0.99 -0.41 0.81 2.43 -1.86 -3.27 114.38 112.73 2p76 h ARG 108 Ca 0.07 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 2p76 h ARG 108 Cb 0.53 -0.22 0.00 0.00 -0.42 0.00 0.00 29.97 29.86 2p76 h ARG 108 CO -0.55 0.65 0.00 0.25 -1.51 0.00 0.00 179.97 178.81 2p76 n THR 109 N -4.57 1.57 -4.08 0.20 -2.24 -1.16 -4.94 114.28 99.05 2p76 n THR 109 Ca 0.09 -1.30 -0.12 0.00 -2.27 0.00 0.00 64.05 60.45 2p76 n THR 109 Cb 0.06 0.20 -0.06 0.00 -2.10 0.00 0.00 70.33 68.43 2p76 n THR 109 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2p76 s THR 110 N -1.72 0.00 -0.35 4.28 -4.23 -0.51 -4.18 115.64 108.92 2p76 s THR 110 Ca 0.37 -1.62 0.03 0.00 -1.18 0.00 0.00 61.69 59.29 2p76 s THR 110 Cb 0.24 -2.45 0.28 0.00 1.34 0.00 0.00 72.50 71.91 2p76 s THR 110 CO 0.17 0.00 1.23 -0.46 -0.54 0.00 0.00 174.62 175.02 2p76 n ASN 111 N -0.79 3.14 -4.30 3.99 6.94 -1.10 -4.73 115.26 118.40 2p76 n ASN 111 Ca 0.00 -2.53 -0.20 0.00 -0.02 0.00 0.00 54.58 51.83 2p76 n ASN 111 Cb 0.63 -0.61 -0.10 0.00 -2.36 0.00 0.00 39.78 37.33 2p76 n ASN 111 CO 0.00 0.00 0.00 -0.83 -1.03 0.00 0.00 177.26 175.40 2p76 s GLY 112 N -0.02 2.02 0.09 4.83 0.00 -1.26 -4.93 107.32 108.04 2p76 s GLY 112 Ca 0.22 -1.84 0.05 0.00 0.00 0.00 0.00 44.72 43.14 2p76 s GLY 112 CO 0.05 -1.71 -0.13 0.30 0.00 0.00 0.00 173.10 171.61 2p76 s HIS 113 N -3.49 1.19 0.00 1.90 3.76 -1.26 -3.15 115.29 114.23 2p76 s HIS 113 Ca 0.35 -0.52 0.00 0.00 -0.15 0.00 0.00 55.06 54.74 2p76 s HIS 113 Cb 0.07 -0.65 0.00 0.00 1.11 0.00 0.00 32.58 33.11 2p76 s HIS 113 CO 0.15 0.05 0.00 0.41 -0.85 0.00 0.00 174.74 174.50 2p76 n GLY 114 N 0.99 2.52 3.77 -2.22 0.00 -1.26 -4.89 105.19 104.10 2p76 n GLY 114 Ca -0.19 -2.12 -0.38 0.00 0.00 0.00 0.00 46.02 43.33 2p76 n GLY 114 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2p76 s LYS 115 N -1.94 4.57 0.27 1.61 1.02 -1.26 -1.48 119.74 122.53 2p76 s LYS 115 Ca 0.00 1.45 0.00 0.00 0.02 0.00 0.00 55.97 57.44 2p76 s LYS 115 Cb 0.00 -2.89 0.57 0.00 -0.52 0.00 0.00 37.83 34.99 2p76 s LYS 115 CO 0.00 0.24 1.77 0.28 -0.92 0.00 0.00 175.35 176.72 2p76 h VAL 116 N 2.69 0.73 0.00 3.17 2.07 -0.47 0.14 116.25 124.59 2p76 h VAL 116 Ca -0.47 -0.22 0.00 0.00 0.82 0.00 0.00 66.70 66.83 2p76 h VAL 116 Cb 1.20 0.02 0.00 0.00 -1.52 0.00 0.00 31.29 30.99 2p76 h VAL 116 CO 0.65 0.12 0.00 -1.84 0.02 0.00 0.00 177.57 176.52 2p76 n GLU 117 N -4.85 0.18 0.00 1.57 0.28 -1.16 -1.47 120.64 115.19 2p76 n GLU 117 Ca 0.18 0.16 0.12 0.00 -0.16 0.00 0.00 57.16 57.46 2p76 n GLU 117 Cb 0.45 -1.50 0.26 0.00 1.43 0.00 0.00 31.44 32.08 2p76 n GLU 117 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 2p76 n ASP 118 N -1.28 0.49 -4.84 -1.84 8.00 0.50 -2.80 116.55 114.79 2p76 n ASP 118 Ca 0.06 -0.18 -0.33 0.00 0.71 0.00 0.00 54.79 55.05 2p76 n ASP 118 Cb 0.10 0.21 -0.06 0.00 -0.02 0.00 0.00 41.12 41.35 2p76 n ASP 118 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 2p76 s TYR 119 N -3.02 3.40 0.31 1.24 2.02 -0.54 -4.84 117.35 115.92 2p76 s TYR 119 Ca 0.11 0.27 -0.07 0.00 -0.37 0.00 0.00 57.07 57.01 2p76 s TYR 119 Cb 0.17 -1.78 -0.06 0.00 -0.40 0.00 0.00 41.96 39.90 2p76 s TYR 119 CO 0.69 0.60 0.60 0.95 -1.57 0.00 0.00 175.55 176.82 2p76 s THR 120 N -1.26 4.96 0.26 -0.71 -4.23 -1.26 0.77 115.64 114.18 2p76 s THR 120 Ca 0.25 0.22 -0.02 0.00 -1.18 0.00 0.00 61.69 60.95 2p76 s THR 120 Cb -0.12 -3.72 0.28 0.00 1.34 0.00 0.00 72.50 70.28 2p76 s THR 120 CO 0.16 -0.34 1.65 0.25 -0.54 0.00 0.00 174.62 175.81 2p76 h LEU 121 N 1.68 -0.11 -0.94 4.79 5.85 -1.93 0.26 115.31 124.90 2p76 h LEU 121 Ca -0.47 0.19 0.05 0.00 0.84 0.00 0.00 57.88 58.48 2p76 h LEU 121 Cb 1.19 0.28 -0.06 0.00 0.37 0.00 0.00 40.66 42.43 2p76 h LEU 121 CO 0.66 -0.14 0.60 -0.78 -0.34 0.00 0.00 178.44 178.45 2p76 h ASP 122 N 0.19 0.98 -0.13 1.25 1.82 -1.99 -0.60 116.42 117.95 2p76 h ASP 122 Ca 0.48 0.00 -0.10 0.00 -0.39 0.00 0.00 57.03 57.02 2p76 h ASP 122 Cb 0.89 -0.21 0.00 0.00 0.68 0.00 0.00 39.33 40.70 2p76 h ASP 122 CO -0.63 0.65 -0.33 -0.33 -1.61 0.00 0.00 179.24 176.99 2p76 h GLU 123 N 1.13 0.45 -0.49 0.28 5.08 -1.00 -3.06 114.58 116.96 2p76 h GLU 123 Ca 0.39 -0.31 0.10 0.00 -1.00 0.00 0.00 59.36 58.54 2p76 h GLU 123 Cb 0.09 0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.37 2p76 h GLU 123 CO -0.15 0.92 0.34 1.25 -1.00 0.00 0.00 179.01 180.37 2p76 h LEU 124 N 0.04 0.23 -0.17 1.33 5.85 -0.28 0.79 115.31 123.10 2p76 h LEU 124 Ca -0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2p76 h LEU 124 Cb 0.94 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.92 2p76 h LEU 124 CO 0.07 0.14 0.00 0.29 -0.34 0.00 0.00 178.44 178.60 2p76 n LYS 125 N -4.46 0.05 0.07 1.25 4.76 -0.28 -2.15 118.16 117.41 2p76 n LYS 125 Ca 0.08 0.30 -0.02 0.00 -2.87 0.00 0.00 58.31 55.80 2p76 n LYS 125 Cb 0.38 -1.59 -0.06 0.00 -1.84 0.00 0.00 35.03 31.93 2p76 n LYS 125 CO 0.00 0.00 0.00 1.96 -1.37 0.00 0.00 177.40 177.99 2p76 h GLN 126 N 0.00 0.00 -7.26 1.97 1.08 -0.89 -3.47 115.11 106.54 2p76 h GLN 126 Ca 0.00 0.00 -0.51 0.00 -1.45 0.00 0.00 58.65 56.69 2p76 h GLN 126 Cb 0.27 0.00 0.20 0.00 -0.05 0.00 0.00 27.48 27.90 2p76 h GLN 126 CO 0.00 0.57 0.20 -0.51 -0.95 0.00 0.00 178.83 178.14 2p76 s LEU 127 N -6.30 2.65 -0.36 1.46 1.43 -0.91 -5.00 118.68 111.65 2p76 s LEU 127 Ca 0.01 2.12 -0.08 0.00 -1.03 0.00 0.00 54.13 55.15 2p76 s LEU 127 Cb 0.08 -4.46 0.04 0.00 0.03 0.00 0.00 46.19 41.89 2p76 s LEU 127 CO 0.79 -3.21 0.15 -0.62 0.23 0.00 0.00 176.35 173.69 2p76 s ASP 128 N -2.66 5.48 0.00 2.29 -1.08 -1.26 -4.72 116.67 114.72 2p76 s ASP 128 Ca 0.67 -1.15 0.22 0.00 -0.52 0.00 0.00 52.55 51.77 2p76 s ASP 128 Cb -0.23 -1.93 0.63 0.00 -1.46 0.00 0.00 42.92 39.94 2p76 s ASP 128 CO 0.59 -0.37 1.53 0.00 0.52 0.00 0.00 175.17 177.43 2p76 n ALA 129 N 4.88 2.38 -0.04 3.66 0.00 0.13 -2.72 120.51 128.79 2p76 n ALA 129 Ca -0.12 -1.26 -0.07 0.00 0.00 0.00 0.00 53.44 51.99 2p76 n ALA 129 Cb 0.45 -0.94 -0.03 0.00 0.00 0.00 0.00 19.45 18.93 2p76 n ALA 129 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2p76 n GLY 130 N 1.65 -0.12 0.33 0.00 0.00 -1.25 -4.79 105.19 101.01 2p76 n GLY 130 Ca 0.24 -0.04 0.12 0.00 0.00 0.00 0.00 46.02 46.33 2p76 n GLY 130 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2p76 h SER 131 N -0.18 -0.46 -0.97 1.61 0.02 -1.80 0.25 113.55 112.02 2p76 h SER 131 Ca -0.19 0.26 0.27 0.00 -0.84 0.00 0.00 61.79 61.28 2p76 h SER 131 Cb 1.21 0.45 -0.05 0.00 0.14 0.00 0.00 62.40 64.15 2p76 h SER 131 CO -0.09 -0.30 0.68 4.11 -1.14 0.00 0.00 176.83 180.09 2p76 h TRP 132 N 0.04 0.17 -0.24 3.45 5.08 -1.86 -0.30 115.95 122.29 2p76 h TRP 132 Ca 0.54 0.01 -0.09 0.00 1.08 0.00 0.00 58.89 60.43 2p76 h TRP 132 Cb 1.06 -0.05 -0.00 0.00 -3.00 0.00 0.00 29.16 27.17 2p76 h TRP 132 CO -0.49 0.03 -0.20 0.35 -1.28 0.00 0.00 178.44 176.85 2p76 h PHE 133 N 0.11 0.67 -0.42 0.12 3.57 -0.81 -1.68 116.94 118.50 2p76 h PHE 133 Ca 0.48 -0.19 0.03 0.00 3.53 0.00 0.00 57.97 61.82 2p76 h PHE 133 Cb 1.71 -0.15 -0.03 0.00 2.79 0.00 0.00 35.95 40.27 2p76 h PHE 133 CO -0.00 0.88 0.22 -0.91 -2.23 0.00 0.00 178.31 176.27 2p76 h ASN 134 N 0.28 0.34 -0.40 0.41 2.35 -1.10 0.14 115.58 117.59 2p76 h ASN 134 Ca 0.04 0.02 -0.07 0.00 -0.55 0.00 0.00 56.30 55.74 2p76 h ASN 134 Cb 0.75 -0.05 -0.02 0.00 0.05 0.00 0.00 38.32 39.04 2p76 h ASN 134 CO 0.05 0.24 -0.00 0.50 -1.65 0.00 0.00 177.43 176.57 2p76 h LYS 135 N 0.45 0.79 0.02 0.81 3.64 -1.38 -2.60 116.57 118.31 2p76 h LYS 135 Ca 0.18 -0.22 -0.24 0.00 -1.27 0.00 0.00 60.65 59.11 2p76 h LYS 135 Cb 0.06 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 31.76 2p76 h LYS 135 CO -0.11 0.80 -1.16 -0.22 -2.27 0.00 0.00 179.45 176.49 2p76 h LYS 136 N 0.74 0.05 -2.12 1.90 3.64 -0.93 -3.38 116.57 116.46 2p76 h LYS 136 Ca 0.14 -0.09 -0.58 0.00 -1.27 0.00 0.00 60.65 58.85 2p76 h LYS 136 Cb 0.46 0.03 -0.41 0.00 -0.41 0.00 0.00 32.23 31.90 2p76 h LYS 136 CO 0.02 0.97 -0.78 0.66 -2.27 0.00 0.00 179.45 178.05 2p76 n TYR 137 N -3.34 2.22 -0.23 1.91 4.01 0.45 -4.95 117.16 117.24 2p76 n TYR 137 Ca -0.04 -3.94 0.30 0.00 -0.16 0.00 0.00 57.90 54.06 2p76 n TYR 137 Cb 0.97 -0.48 0.72 0.00 -0.31 0.00 0.00 39.34 40.24 2p76 n TYR 137 CO 0.00 0.00 0.00 -1.35 -0.46 0.00 0.00 176.86 175.05 2p76 h PRO 138 N 4.06 0.02 0.00 -0.72 0.11 -1.66 0.08 132.00 133.88 2p76 h PRO 138 Ca 0.15 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.26 2p76 h PRO 138 Cb 0.74 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.84 2p76 h PRO 138 CO 0.70 0.01 0.00 0.36 -0.21 0.00 0.00 178.00 178.86 2p76 n LYS 139 N -4.25 0.05 0.00 1.05 2.85 -1.26 -2.87 118.16 113.72 2p76 n LYS 139 Ca 0.21 0.19 0.00 0.00 -1.05 0.00 0.00 58.31 57.66 2p76 n LYS 139 Cb 1.04 -1.57 0.00 0.00 -0.65 0.00 0.00 35.03 33.85 2p76 n LYS 139 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 2p76 n TYR 140 N -1.66 0.00 -1.01 5.58 4.01 -0.06 -5.07 117.16 118.94 2p76 n TYR 140 Ca 0.05 0.00 -0.36 0.00 -0.16 0.00 0.00 57.90 57.43 2p76 n TYR 140 Cb 0.25 0.00 0.05 0.00 -0.31 0.00 0.00 39.34 39.33 2p76 n TYR 140 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2p76 n ALA 141 N -0.45 -4.72 -3.64 -0.72 0.00 -0.73 -4.92 120.51 105.34 2p76 n ALA 141 Ca 0.00 -0.59 -0.08 0.00 0.00 0.00 0.00 53.44 52.78 2p76 n ALA 141 Cb 0.00 -1.28 -0.07 0.00 0.00 0.00 0.00 19.45 18.10 2p76 n ALA 141 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 2p76 s ARG 142 N -2.11 0.59 0.34 0.00 3.52 -1.26 -5.04 118.95 114.98 2p76 s ARG 142 Ca 0.45 0.87 0.03 0.00 -0.13 0.00 0.00 55.73 56.94 2p76 s ARG 142 Cb -0.23 0.20 0.63 0.00 -1.56 0.00 0.00 34.95 33.99 2p76 s ARG 142 CO 0.78 -0.10 1.96 0.00 -0.81 0.00 0.00 175.30 177.14 2p76 h ALA 143 N 5.66 1.59 0.00 6.12 0.00 -1.99 -1.53 119.26 129.09 2p76 h ALA 143 Ca -0.29 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.58 2p76 h ALA 143 Cb 1.19 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.74 2p76 h ALA 143 CO 0.14 0.32 -0.05 0.66 0.00 0.00 0.00 179.25 180.32 2p76 h SER 144 N 0.89 0.00 0.73 0.00 4.64 -2.02 -2.42 113.55 115.38 2p76 h SER 144 Ca 0.31 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.62 2p76 h SER 144 Cb 0.11 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.20 2p76 h SER 144 CO -0.09 0.05 -0.04 1.88 -0.87 0.00 0.00 176.83 177.75 2p76 h TYR 145 N 0.00 0.00 -3.67 4.77 0.05 -1.65 -3.44 116.97 113.03 2p76 h TYR 145 Ca -0.00 0.00 -0.53 0.00 0.05 0.00 0.00 58.73 58.25 2p76 h TYR 145 Cb 0.26 0.00 0.08 0.00 1.01 0.00 0.00 36.73 38.08 2p76 h TYR 145 CO 0.00 0.04 0.77 0.15 -1.05 0.00 0.00 178.16 178.08 2p76 s LYS 146 N -3.83 4.19 -1.63 4.88 1.02 -0.91 -2.39 119.74 121.07 2p76 s LYS 146 Ca -0.01 2.45 0.00 0.00 0.02 0.00 0.00 55.97 58.43 2p76 s LYS 146 Cb 0.10 -3.03 0.00 0.00 -0.52 0.00 0.00 37.83 34.38 2p76 s LYS 146 CO 0.54 -0.47 0.00 0.09 -0.92 0.00 0.00 175.35 174.59 2p76 n ASN 147 N 1.32 -5.28 -4.76 2.83 3.02 -1.26 -4.91 115.26 106.22 2p76 n ASN 147 Ca 0.04 0.07 -0.36 0.00 -0.03 0.00 0.00 54.58 54.29 2p76 n ASN 147 Cb 0.39 -4.36 0.03 0.00 -0.61 0.00 0.00 39.78 35.24 2p76 n ASN 147 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2p76 s ALA 148 N -2.87 2.63 0.22 5.41 0.00 -1.01 -4.76 121.76 121.38 2p76 s ALA 148 Ca 0.00 1.04 0.07 0.00 0.00 0.00 0.00 51.96 53.06 2p76 s ALA 148 Cb 0.00 -3.46 -0.04 0.00 0.00 0.00 0.00 23.12 19.63 2p76 s ALA 148 CO 0.00 -1.12 0.15 0.15 0.00 0.00 0.00 175.76 174.94 2p76 s LYS 149 N -3.21 2.85 0.11 0.00 -0.14 -1.26 0.17 119.74 118.25 2p76 s LYS 149 Ca 0.75 -1.02 -0.30 0.00 -1.36 0.00 0.00 55.97 54.04 2p76 s LYS 149 Cb -0.31 -2.55 -0.06 0.00 -1.68 0.00 0.00 37.83 33.22 2p76 s LYS 149 CO 0.35 0.43 1.07 0.08 -0.76 0.00 0.00 175.35 176.51 2p76 s VAL 150 N -1.99 4.23 0.11 3.17 1.01 -1.26 -4.58 120.40 121.09 2p76 s VAL 150 Ca 0.32 1.77 -0.02 0.00 0.00 0.00 0.00 61.98 64.05 2p76 s VAL 150 Cb -0.09 -4.13 -0.05 0.00 0.00 0.00 0.00 36.38 32.11 2p76 s VAL 150 CO 0.24 0.24 0.31 -2.16 0.00 0.00 0.00 175.10 173.72 2p76 s PRO 151 N 0.24 3.53 0.38 2.72 0.04 -1.26 -4.91 135.00 135.74 2p76 s PRO 151 Ca 0.51 -0.26 -0.05 0.00 0.04 0.00 0.00 61.00 61.24 2p76 s PRO 151 Cb -0.26 -2.93 -0.05 0.00 0.04 0.00 0.00 34.50 31.30 2p76 s PRO 151 CO 0.31 0.52 0.66 0.95 0.04 0.00 0.00 177.00 179.49 2p76 s THR 152 N -1.61 4.96 0.37 1.26 -4.23 -1.26 -0.76 115.64 114.37 2p76 s THR 152 Ca 0.38 0.11 0.04 0.00 -1.18 0.00 0.00 61.69 61.04 2p76 s THR 152 Cb -0.12 -3.80 0.27 0.00 1.34 0.00 0.00 72.50 70.19 2p76 s THR 152 CO 0.26 -0.56 2.03 0.25 -0.54 0.00 0.00 174.62 176.06 2p76 h LEU 153 N 1.00 0.64 0.17 4.79 5.85 -1.39 -1.82 115.31 124.55 2p76 h LEU 153 Ca -0.48 -0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.22 2p76 h LEU 153 Cb 1.20 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 42.07 2p76 h LEU 153 CO 0.63 0.46 -0.08 -0.78 -0.34 0.00 0.00 178.44 178.33 2p76 h ASP 154 N 0.75 -0.19 -0.83 1.25 3.58 -1.93 -1.48 116.42 117.56 2p76 h ASP 154 Ca 0.21 -0.07 0.10 0.00 0.42 0.00 0.00 57.03 57.69 2p76 h ASP 154 Cb -0.07 0.05 -0.07 0.00 1.72 0.00 0.00 39.33 40.96 2p76 h ASP 154 CO -0.05 -0.06 0.48 -0.33 -2.88 0.00 0.00 179.24 176.40 2p76 h GLU 155 N -0.32 0.77 0.49 0.28 5.08 -1.81 0.24 114.58 119.31 2p76 h GLU 155 Ca -0.02 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.27 2p76 h GLU 155 Cb 0.25 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.33 2p76 h GLU 155 CO 0.04 0.51 -0.23 0.82 -1.00 0.00 0.00 179.01 179.14 2p76 h ILE 156 N 0.79 0.52 -0.77 3.13 2.04 -1.09 0.20 117.51 122.33 2p76 h ILE 156 Ca 0.40 -0.05 0.02 0.00 1.00 0.00 0.00 64.86 66.24 2p76 h ILE 156 Cb 0.37 0.54 -0.04 0.00 -0.74 0.00 0.00 36.82 36.95 2p76 h ILE 156 CO -0.25 0.01 0.50 -0.07 0.00 0.00 0.00 178.15 178.34 2p76 h LEU 157 N -0.68 0.83 0.08 1.44 3.38 -0.86 -1.91 115.31 117.60 2p76 h LEU 157 Ca -0.07 -0.01 0.02 0.00 0.09 0.00 0.00 57.88 57.92 2p76 h LEU 157 Cb 0.52 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 41.03 2p76 h LEU 157 CO 0.11 0.58 -0.33 -0.08 0.09 0.00 0.00 178.44 178.81 2p76 h GLU 158 N 0.98 -0.52 0.23 1.13 4.57 -0.30 -1.88 114.58 118.79 2p76 h GLU 158 Ca 0.30 0.04 -0.01 0.00 -1.18 0.00 0.00 59.36 58.51 2p76 h GLU 158 Cb -0.03 0.12 0.00 0.00 -0.16 0.00 0.00 28.75 28.68 2p76 h GLU 158 CO -0.10 -0.34 -0.11 -0.09 -1.18 0.00 0.00 179.01 177.19 2p76 h ARG 159 N -0.54 -0.29 -0.01 1.92 2.43 -0.19 -3.23 114.38 114.48 2p76 h ARG 159 Ca 0.04 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 2p76 h ARG 159 Cb 0.58 0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.20 2p76 h ARG 159 CO -0.22 -0.16 -0.09 0.66 -1.51 0.00 0.00 179.97 178.66 2p76 n TYR 160 N -5.20 0.00 -1.08 2.20 4.01 -0.75 -5.05 117.16 111.29 2p76 n TYR 160 Ca -0.09 0.00 0.14 0.00 -0.16 0.00 0.00 57.90 57.79 2p76 n TYR 160 Cb 0.16 -0.08 -0.04 0.00 -0.31 0.00 0.00 39.34 39.07 2p76 n TYR 160 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2p76 n GLY 161 N 1.22 -2.13 0.00 2.72 0.00 -0.71 -3.84 105.19 102.45 2p76 n GLY 161 Ca 0.17 -1.23 0.09 0.00 0.00 0.00 0.00 46.02 45.05 2p76 n GLY 161 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2p76 n PRO 162 N -3.65 0.54 -0.00 1.61 -0.04 -1.26 -2.85 135.00 129.34 2p76 n PRO 162 Ca -0.01 0.00 0.08 0.00 -0.04 0.00 0.00 63.50 63.53 2p76 n PRO 162 Cb 0.50 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.36 2p76 n PRO 162 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2p76 n ASN 163 N -1.00 0.82 -4.11 3.54 3.02 -1.26 -4.96 115.26 111.31 2p76 n ASN 163 Ca 0.13 -0.88 -0.30 0.00 -0.03 0.00 0.00 54.58 53.50 2p76 n ASN 163 Cb 0.06 1.03 0.20 0.00 -0.61 0.00 0.00 39.78 40.46 2p76 n ASN 163 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2p76 s ALA 164 N -2.66 1.50 -0.09 5.41 0.00 -1.13 -5.05 121.76 119.73 2p76 s ALA 164 Ca 0.06 -0.99 0.02 0.00 0.00 0.00 0.00 51.96 51.06 2p76 s ALA 164 Cb 0.13 -2.86 0.01 0.00 0.00 0.00 0.00 23.12 20.40 2p76 s ALA 164 CO 0.71 -2.88 -0.15 -0.80 0.00 0.00 0.00 175.76 172.64 2p76 s ASN 165 N -4.34 2.25 -0.01 0.00 0.01 -1.26 -4.75 114.94 106.83 2p76 s ASN 165 Ca 0.71 -0.39 0.05 0.00 -0.71 0.00 0.00 52.86 52.52 2p76 s ASN 165 Cb -0.08 -1.02 -0.03 0.00 0.41 0.00 0.00 41.25 40.53 2p76 s ASN 165 CO 0.54 0.05 -0.16 -0.31 -1.51 0.00 0.00 177.10 175.71 2p76 s TYR 166 N 0.73 2.64 -0.38 2.20 2.02 -0.19 -0.78 117.35 123.59 2p76 s TYR 166 Ca -0.12 -0.21 0.03 0.00 -0.37 0.00 0.00 57.07 56.40 2p76 s TYR 166 Cb -0.16 -1.56 0.11 0.00 -0.40 0.00 0.00 41.96 39.95 2p76 s TYR 166 CO 0.03 0.20 0.12 -0.47 -1.57 0.00 0.00 175.55 173.86 2p76 s TYR 167 N -0.81 3.13 -0.15 2.71 5.04 -0.69 -1.46 117.35 125.13 2p76 s TYR 167 Ca 0.13 -2.78 -0.06 0.00 -2.44 0.00 0.00 57.07 51.92 2p76 s TYR 167 Cb -0.11 -2.61 -0.04 0.00 0.35 0.00 0.00 41.96 39.56 2p76 s TYR 167 CO 0.03 -0.88 0.06 0.42 -1.34 0.00 0.00 175.55 173.84 2p76 s ILE 168 N 0.70 4.76 -0.14 3.14 1.01 -0.34 -0.49 121.20 129.83 2p76 s ILE 168 Ca 0.13 -0.06 -0.04 0.00 0.00 0.00 0.00 60.65 60.68 2p76 s ILE 168 Cb -0.21 -3.10 -0.03 0.00 0.01 0.00 0.00 42.46 39.13 2p76 s ILE 168 CO -0.08 0.52 -0.00 -0.70 0.00 0.00 0.00 174.94 174.68 2p76 s GLU 169 N -0.17 3.55 0.19 2.79 2.12 -0.31 0.56 118.70 127.42 2p76 s GLU 169 Ca 0.07 -0.45 0.08 0.00 0.36 0.00 0.00 54.97 55.04 2p76 s GLU 169 Cb -0.12 -2.95 -0.04 0.00 0.26 0.00 0.00 34.13 31.28 2p76 s GLU 169 CO 0.01 0.38 -0.03 0.95 -0.54 0.00 0.00 175.26 176.03 2p76 s THR 170 N 0.01 3.51 0.00 -1.70 -4.23 -0.69 -2.59 115.64 109.95 2p76 s THR 170 Ca 0.02 -1.56 0.00 0.00 -1.18 0.00 0.00 61.69 58.97 2p76 s THR 170 Cb -0.13 -2.77 0.00 0.00 1.34 0.00 0.00 72.50 70.94 2p76 s THR 170 CO 0.02 -0.14 0.00 0.29 -0.54 0.00 0.00 174.62 174.25 2p76 n LYS 171 N -0.16 1.53 -2.29 3.99 4.01 -1.26 -4.40 118.16 119.58 2p76 n LYS 171 Ca -0.10 0.00 -0.40 0.00 -0.51 0.00 0.00 58.31 57.30 2p76 n LYS 171 Cb 0.56 0.00 -0.03 0.00 -0.51 0.00 0.00 35.03 35.05 2p76 n LYS 171 CO 0.00 0.00 0.00 -1.12 -1.11 0.00 0.00 177.40 175.17 2p76 s SER 172 N -1.00 6.98 0.00 4.39 0.01 -1.26 -4.75 113.70 118.07 2p76 s SER 172 Ca 0.00 2.47 0.00 0.00 1.31 0.00 0.00 55.95 59.73 2p76 s SER 172 Cb 0.00 -2.64 0.00 0.00 0.21 0.00 0.00 66.02 63.59 2p76 s SER 172 CO 0.00 -0.36 0.66 -2.65 0.41 0.00 0.00 173.24 171.30 2p76 n PRO 173 N 0.93 0.00 -0.11 12.44 -0.02 -1.26 -0.38 135.00 146.59 2p76 n PRO 173 Ca -0.00 0.21 -0.14 0.00 -2.02 0.00 0.00 63.50 61.55 2p76 n PRO 173 Cb 0.43 -1.56 -0.14 0.00 -0.02 0.00 0.00 33.50 32.22 2p76 n PRO 173 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 2p76 n ASP 174 N -1.16 0.91 -0.11 2.55 5.75 -1.26 -3.65 116.55 119.58 2p76 n ASP 174 Ca 0.00 -0.06 -0.12 0.00 -0.01 0.00 0.00 54.79 54.59 2p76 n ASP 174 Cb 0.06 0.35 -0.03 0.00 -1.03 0.00 0.00 41.12 40.47 2p76 n ASP 174 CO 0.00 0.00 0.00 1.62 -0.11 0.00 0.00 177.20 178.71 2p76 h VAL 175 N 0.00 1.29 -2.12 2.12 3.04 -1.08 -3.37 116.25 116.13 2p76 h VAL 175 Ca -0.56 -1.32 -0.57 0.00 -1.01 0.00 0.00 66.70 63.24 2p76 h VAL 175 Cb 2.09 1.41 -0.40 0.00 -2.01 0.00 0.00 31.29 32.38 2p76 h VAL 175 CO -0.02 0.43 -0.96 -1.22 -1.01 0.00 0.00 177.57 174.78 2p76 n TYR 176 N -4.31 0.58 -1.67 3.17 4.01 -1.17 -5.06 117.16 112.71 2p76 n TYR 176 Ca -0.03 -3.69 -0.54 0.00 -0.16 0.00 0.00 57.90 53.49 2p76 n TYR 176 Cb 0.41 -0.34 -0.06 0.00 -0.31 0.00 0.00 39.34 39.04 2p76 n TYR 176 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 2p76 n PRO 177 N 1.46 1.41 0.00 -0.72 -0.02 -1.24 -0.97 135.00 134.92 2p76 n PRO 177 Ca 0.24 0.51 0.00 0.00 -2.02 0.00 0.00 63.50 62.23 2p76 n PRO 177 Cb 0.49 -2.22 0.00 0.00 -0.02 0.00 0.00 33.50 31.75 2p76 n PRO 177 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2p76 n GLY 178 N 3.76 0.17 0.33 -1.23 0.00 -1.26 -4.98 105.19 101.98 2p76 n GLY 178 Ca 0.23 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.14 2p76 n GLY 178 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 2p76 h MET 179 N 3.59 -0.42 -0.04 1.61 -1.53 -1.43 -0.07 114.93 116.65 2p76 h MET 179 Ca 0.00 0.03 0.04 0.00 -3.44 0.00 0.00 59.70 56.33 2p76 h MET 179 Cb 0.00 0.09 -0.05 0.00 -0.55 0.00 0.00 31.60 31.09 2p76 h MET 179 CO 0.00 -0.28 -0.29 0.93 0.14 0.00 0.00 176.91 177.42 2p76 h GLU 180 N -0.43 -0.39 -1.00 0.39 3.07 -1.94 0.25 114.58 114.53 2p76 h GLU 180 Ca 0.08 0.03 0.14 0.00 -0.50 0.00 0.00 59.36 59.10 2p76 h GLU 180 Cb 0.55 0.09 -0.09 0.00 -0.84 0.00 0.00 28.75 28.46 2p76 h GLU 180 CO -0.31 -0.26 0.63 0.93 -1.40 0.00 0.00 179.01 178.60 2p76 h GLU 181 N -0.41 0.91 -0.21 2.33 3.07 -1.91 -1.25 114.58 117.11 2p76 h GLU 181 Ca 0.07 -0.05 -0.06 0.00 -0.50 0.00 0.00 59.36 58.82 2p76 h GLU 181 Cb 0.52 -0.20 -0.01 0.00 -0.84 0.00 0.00 28.75 28.22 2p76 h GLU 181 CO -0.27 0.60 -0.09 1.96 -1.40 0.00 0.00 179.01 179.81 2p76 h GLN 182 N 0.93 0.43 0.26 2.33 4.20 -0.05 -1.63 115.11 121.59 2p76 h GLN 182 Ca 0.51 -0.18 0.01 0.00 0.06 0.00 0.00 58.65 59.04 2p76 h GLN 182 Cb 0.58 -0.02 -0.03 0.00 0.30 0.00 0.00 27.48 28.32 2p76 h GLN 182 CO -0.28 0.71 -0.34 1.25 -0.67 0.00 0.00 178.83 179.50 2p76 h LEU 183 N 0.14 -0.93 -0.81 1.46 5.85 0.21 0.57 115.31 121.81 2p76 h LEU 183 Ca 0.05 0.09 0.08 0.00 0.84 0.00 0.00 57.88 58.94 2p76 h LEU 183 Cb 0.57 0.33 -0.07 0.00 0.37 0.00 0.00 40.66 41.86 2p76 h LEU 183 CO 0.03 -0.46 0.47 -0.07 -0.34 0.00 0.00 178.44 178.07 2p76 h LEU 184 N -0.65 0.71 -0.74 2.25 3.38 -1.29 0.16 115.31 119.13 2p76 h LEU 184 Ca -0.00 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 2p76 h LEU 184 Cb 0.62 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.23 2p76 h LEU 184 CO -0.11 0.43 0.37 0.00 0.09 0.00 0.00 178.44 179.23 2p76 h ALA 185 N 1.42 0.95 -0.19 1.53 0.00 -0.81 -0.20 119.26 121.96 2p76 h ALA 185 Ca 0.37 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 55.13 2p76 h ALA 185 Cb 0.26 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2p76 h ALA 185 CO -0.21 0.49 0.05 1.03 0.00 0.00 0.00 179.25 180.61 2p76 h SER 186 N 1.03 0.28 -0.60 0.00 0.87 0.16 -0.51 113.55 114.78 2p76 h SER 186 Ca 0.26 -0.22 0.06 0.00 -1.23 0.00 0.00 61.79 60.65 2p76 h SER 186 Cb 0.09 -0.07 -0.06 0.00 -0.44 0.00 0.00 62.40 61.92 2p76 h SER 186 CO -0.04 0.43 0.31 -0.07 -0.53 0.00 0.00 176.83 176.93 2p76 h LEU 187 N 0.11 0.42 -0.62 2.23 3.38 -0.42 -1.80 115.31 118.62 2p76 h LEU 187 Ca 0.06 0.04 -0.03 0.00 0.09 0.00 0.00 57.88 58.04 2p76 h LEU 187 Cb 0.26 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 40.94 2p76 h LEU 187 CO -0.00 0.28 0.28 0.50 0.09 0.00 0.00 178.44 179.59 2p76 h LYS 188 N 0.57 0.90 -0.87 1.13 3.64 -0.75 -1.16 116.57 120.03 2p76 h LYS 188 Ca 0.28 -0.14 0.12 0.00 -1.27 0.00 0.00 60.65 59.64 2p76 h LYS 188 Cb 0.21 -0.16 -0.08 0.00 -0.41 0.00 0.00 32.23 31.79 2p76 h LYS 188 CO -0.20 0.74 0.49 -0.22 -2.27 0.00 0.00 179.45 177.98 2p76 h LYS 189 N 0.86 0.73 -0.82 1.90 3.64 -0.28 -0.81 116.57 121.78 2p76 h LYS 189 Ca 0.21 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.53 2p76 h LYS 189 Cb 0.14 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 31.79 2p76 h LYS 189 CO -0.02 0.48 0.03 0.72 -2.27 0.00 0.00 179.45 178.38 2p76 n HIS 190 N -4.78 1.01 -1.90 1.91 8.25 -0.83 -4.90 115.22 113.98 2p76 n HIS 190 Ca 0.16 -0.40 -0.20 0.00 -0.26 0.00 0.00 57.72 57.03 2p76 n HIS 190 Cb 0.37 -0.32 -0.05 0.00 1.12 0.00 0.00 29.99 31.11 2p76 n HIS 190 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2p76 n HIS 191 N 0.24 -0.46 1.26 4.41 8.25 -0.31 -4.60 115.22 124.02 2p76 n HIS 191 Ca 0.14 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.73 2p76 n HIS 191 Cb 0.72 -3.51 0.33 0.00 1.12 0.00 0.00 29.99 28.65 2p76 n HIS 191 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2p76 n LEU 192 N -2.56 1.84 -0.30 2.41 4.77 -0.49 -3.95 117.00 118.71 2p76 n LEU 192 Ca -0.21 -0.61 0.12 0.00 -0.03 0.00 0.00 56.01 55.28 2p76 n LEU 192 Cb 0.66 -0.03 0.14 0.00 -2.33 0.00 0.00 43.42 41.86 2p76 n LEU 192 CO 0.29 0.32 0.40 0.18 -1.33 0.00 0.00 177.39 177.24 2p76 n LEU 193 N 0.27 1.41 -4.68 2.23 4.77 -1.25 -4.37 117.00 115.39 2p76 n LEU 193 Ca 0.15 -0.48 -0.45 0.00 -0.03 0.00 0.00 56.01 55.20 2p76 n LEU 193 Cb 0.43 -0.07 -0.03 0.00 -2.33 0.00 0.00 43.42 41.42 2p76 n LEU 193 CO 0.19 0.27 1.14 -3.20 -1.33 0.00 0.00 177.39 174.47 2p76 n ASN 194 N -0.55 3.13 -0.33 -1.43 5.15 -1.25 -4.75 115.26 115.22 2p76 n ASN 194 Ca 0.09 1.11 0.23 0.00 -0.60 0.00 0.00 54.58 55.42 2p76 n ASN 194 Cb 0.40 -1.46 0.50 0.00 -0.53 0.00 0.00 39.78 38.69 2p76 n ASN 194 CO 0.00 0.00 0.00 0.78 1.40 0.00 0.00 177.26 179.44 2p76 h ASN 195 N 5.12 0.46 0.63 1.20 4.21 -1.96 -0.64 115.58 124.60 2p76 h ASN 195 Ca -0.45 0.09 -0.03 0.00 1.21 0.00 0.00 56.30 57.13 2p76 h ASN 195 Cb 1.25 0.02 -0.00 0.00 -1.12 0.00 0.00 38.32 38.48 2p76 h ASN 195 CO 0.83 0.07 -0.38 -1.13 -1.29 0.00 0.00 177.43 175.52 2p76 h ASN 196 N 0.39 -0.94 -0.96 5.81 -0.73 -1.97 -1.78 115.58 115.40 2p76 h ASN 196 Ca 0.62 0.05 0.10 0.00 1.87 0.00 0.00 56.30 58.94 2p76 h ASN 196 Cb 1.55 0.27 -0.08 0.00 0.27 0.00 0.00 38.32 40.34 2p76 h ASN 196 CO -0.33 -0.59 0.60 0.11 -0.37 0.00 0.00 177.43 176.85 2p76 h LYS 197 N -0.95 0.97 -0.64 6.67 1.79 -1.49 -2.83 116.57 120.10 2p76 h LYS 197 Ca -0.08 -0.06 -0.03 0.00 -2.18 0.00 0.00 60.65 58.30 2p76 h LYS 197 Cb 0.76 -0.22 -0.03 0.00 -1.58 0.00 0.00 32.23 31.16 2p76 h LYS 197 CO 0.09 0.64 0.29 -0.07 -1.08 0.00 0.00 179.45 179.32 2p76 h LEU 198 N 1.00 0.85 -0.40 2.94 3.38 -0.85 -2.50 115.31 119.74 2p76 h LEU 198 Ca 0.45 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 58.28 2p76 h LEU 198 Cb 0.36 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.89 2p76 h LEU 198 CO -0.23 0.76 0.00 2.29 0.09 0.00 0.00 178.44 181.35 2p76 n LYS 199 N -4.47 1.27 -0.21 1.13 2.85 -0.70 -2.95 118.16 115.08 2p76 n LYS 199 Ca 0.04 -0.39 0.10 0.00 -1.05 0.00 0.00 58.31 57.01 2p76 n LYS 199 Cb 0.14 -1.43 0.21 0.00 -0.65 0.00 0.00 35.03 33.30 2p76 n LYS 199 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 2p76 n ASN 200 N -0.48 3.35 -0.04 -5.58 3.02 -1.06 -4.82 115.26 109.64 2p76 n ASN 200 Ca 0.19 -1.95 -0.01 0.00 -0.03 0.00 0.00 54.58 52.79 2p76 n ASN 200 Cb 0.19 -0.27 -0.00 0.00 -0.61 0.00 0.00 39.78 39.09 2p76 n ASN 200 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2p76 n GLY 201 N 1.29 0.47 0.23 7.41 0.00 -1.15 -3.37 105.19 110.06 2p76 n GLY 201 Ca 0.18 -0.43 0.16 0.00 0.00 0.00 0.00 46.02 45.92 2p76 n GLY 201 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 2p76 h HIS 202 N 0.00 0.00 -3.50 1.61 3.86 -1.67 -3.42 115.15 112.03 2p76 h HIS 202 Ca -0.01 0.00 -0.34 0.00 -1.16 0.00 0.00 60.37 58.86 2p76 h HIS 202 Cb 0.07 0.00 -0.34 0.00 1.06 0.00 0.00 27.41 28.20 2p76 h HIS 202 CO 0.04 0.00 -0.75 0.08 0.86 0.00 0.00 177.93 178.16 2p76 s VAL 203 N -3.67 0.18 -0.17 2.45 1.01 -1.26 -1.02 120.40 117.92 2p76 s VAL 203 Ca -0.01 0.08 -0.04 0.00 0.00 0.00 0.00 61.98 62.01 2p76 s VAL 203 Cb 0.09 -0.27 0.06 0.00 0.00 0.00 0.00 36.38 36.26 2p76 s VAL 203 CO 0.38 0.14 0.07 -0.04 0.00 0.00 0.00 175.10 175.65 2p76 s MET 204 N 0.99 0.24 -0.18 2.72 -1.94 -0.54 -4.25 119.30 116.35 2p76 s MET 204 Ca -0.10 -0.16 -0.14 0.00 -1.71 0.00 0.00 55.69 53.58 2p76 s MET 204 Cb -0.14 -1.84 -0.04 0.00 2.01 0.00 0.00 34.83 34.82 2p76 s MET 204 CO -0.02 -0.64 0.32 0.42 -0.01 0.00 0.00 175.02 175.10 2p76 s ILE 205 N 2.05 5.28 0.15 2.53 1.01 -0.79 -1.20 121.20 130.23 2p76 s ILE 205 Ca 0.01 0.59 0.10 0.00 0.00 0.00 0.00 60.65 61.35 2p76 s ILE 205 Cb -0.16 -3.66 -0.04 0.00 0.01 0.00 0.00 42.46 38.61 2p76 s ILE 205 CO -0.08 0.34 -0.24 0.00 0.00 0.00 0.00 174.94 174.96 2p76 s GLN 206 N 0.75 1.39 -0.09 2.79 -2.07 0.19 -0.20 119.66 122.42 2p76 s GLN 206 Ca 0.17 -1.39 -0.30 0.00 -1.82 0.00 0.00 55.36 52.02 2p76 s GLN 206 Cb -0.14 -1.74 0.12 0.00 -1.09 0.00 0.00 33.01 30.16 2p76 s GLN 206 CO 0.05 0.39 0.97 0.45 -1.32 0.00 0.00 175.29 175.83 2p76 s SER 207 N -2.33 -0.35 0.23 12.60 0.15 -0.63 -1.70 113.70 121.67 2p76 s SER 207 Ca 0.16 0.18 0.22 0.00 0.70 0.00 0.00 55.95 57.20 2p76 s SER 207 Cb -0.09 0.32 0.04 0.00 -1.71 0.00 0.00 66.02 64.59 2p76 s SER 207 CO 0.07 -0.46 1.13 -0.26 1.20 0.00 0.00 173.24 174.92 2p76 h PHE 208 N 2.25 0.00 -3.20 3.44 0.04 -1.77 0.20 116.94 117.90 2p76 h PHE 208 Ca -0.19 0.00 -0.60 0.00 2.80 0.00 0.00 57.97 59.98 2p76 h PHE 208 Cb 1.20 0.00 -0.11 0.00 2.20 0.00 0.00 35.95 39.24 2p76 h PHE 208 CO 0.28 0.08 0.65 0.45 -0.60 0.00 0.00 178.31 179.17 2p76 s SER 209 N -5.59 6.36 0.43 2.17 0.15 -1.26 -4.80 113.70 111.16 2p76 s SER 209 Ca 0.01 -0.25 0.09 0.00 0.70 0.00 0.00 55.95 56.49 2p76 s SER 209 Cb 0.09 -2.46 0.93 0.00 -1.71 0.00 0.00 66.02 62.86 2p76 s SER 209 CO 0.77 -1.28 2.06 0.44 1.20 0.00 0.00 173.24 176.43 2p76 h ASP 210 N 9.36 0.41 -0.36 5.45 3.32 -1.97 -1.69 116.42 130.93 2p76 h ASP 210 Ca -0.26 -0.01 -0.01 0.00 0.02 0.00 0.00 57.03 56.78 2p76 h ASP 210 Cb 1.07 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 40.50 2p76 h ASP 210 CO 1.11 0.29 0.20 -0.08 -1.72 0.00 0.00 179.24 179.04 2p76 h GLU 211 N 0.47 0.50 -0.39 3.56 4.57 -1.98 0.93 114.58 122.25 2p76 h GLU 211 Ca 0.15 -0.06 -0.02 0.00 -1.18 0.00 0.00 59.36 58.25 2p76 h GLU 211 Cb 0.03 -0.10 -0.02 0.00 -0.16 0.00 0.00 28.75 28.50 2p76 h GLU 211 CO -0.04 0.40 0.16 1.03 -1.18 0.00 0.00 179.01 179.38 2p76 h SER 212 N 0.46 0.54 -0.31 1.04 0.87 -1.63 -1.08 113.55 113.44 2p76 h SER 212 Ca 0.13 -0.17 -0.03 0.00 -1.23 0.00 0.00 61.79 60.49 2p76 h SER 212 Cb 0.05 -0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 61.85 2p76 h SER 212 CO -0.02 0.56 0.07 -0.07 -0.53 0.00 0.00 176.83 176.84 2p76 h LEU 213 N 0.49 0.47 -1.23 2.23 3.38 -1.19 -2.15 115.31 117.30 2p76 h LEU 213 Ca 0.13 -0.24 -0.02 0.00 0.09 0.00 0.00 57.88 57.84 2p76 h LEU 213 Cb 0.19 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.79 2p76 h LEU 213 CO -0.01 0.59 0.29 0.11 0.09 0.00 0.00 178.44 179.50 2p76 h LYS 214 N 0.33 0.82 -0.29 1.13 1.57 -0.71 0.22 116.57 119.64 2p76 h LYS 214 Ca 0.10 -0.10 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 2p76 h LYS 214 Cb 0.30 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.44 2p76 h LYS 214 CO 0.00 0.63 0.13 -0.22 -0.57 0.00 0.00 179.45 179.42 2p76 h LYS 215 N 0.82 0.42 -0.55 3.15 3.64 -0.98 -1.68 116.57 121.39 2p76 h LYS 215 Ca 0.21 -0.07 -0.05 0.00 -1.27 0.00 0.00 60.65 59.47 2p76 h LYS 215 Cb 0.07 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.80 2p76 h LYS 215 CO -0.03 0.41 0.14 0.82 -2.27 0.00 0.00 179.45 178.52 2p76 h ILE 216 N 0.32 1.24 -0.90 2.00 2.04 -0.69 -2.05 117.51 119.48 2p76 h ILE 216 Ca 0.10 -0.87 0.02 0.00 1.00 0.00 0.00 64.86 65.11 2p76 h ILE 216 Cb 0.14 0.75 -0.05 0.00 -0.74 0.00 0.00 36.82 36.92 2p76 h ILE 216 CO -0.01 0.32 0.59 -0.74 0.00 0.00 0.00 178.15 178.31 2p76 h HIS 217 N 0.79 1.11 -0.12 1.37 2.76 -0.38 0.20 115.15 120.88 2p76 h HIS 217 Ca 0.17 0.03 -0.02 0.00 -2.20 0.00 0.00 60.37 58.35 2p76 h HIS 217 Cb 0.33 -0.37 -0.00 0.00 1.55 0.00 0.00 27.41 28.91 2p76 h HIS 217 CO 0.02 0.67 -0.01 0.00 -1.30 0.00 0.00 177.93 177.32 2p76 h ARG 218 N 1.18 0.21 -0.06 5.26 3.08 -1.05 -2.11 114.38 120.90 2p76 h ARG 218 Ca 0.34 -0.07 -0.07 0.00 0.07 0.00 0.00 59.98 60.26 2p76 h ARG 218 Cb -0.06 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 29.96 2p76 h ARG 218 CO -0.09 0.48 -0.27 0.37 -1.07 0.00 0.00 179.97 179.39 2p76 h GLN 219 N -0.07 0.10 -1.17 0.04 4.15 -0.92 -3.40 115.11 113.83 2p76 h GLN 219 Ca 0.03 -0.03 -0.06 0.00 0.77 0.00 0.00 58.65 59.36 2p76 h GLN 219 Cb 0.39 -0.01 -0.22 0.00 0.21 0.00 0.00 27.48 27.85 2p76 h GLN 219 CO 0.01 0.37 -0.45 1.21 -1.93 0.00 0.00 178.83 178.04 2p76 s ASN 220 N -6.93 -1.09 0.16 -0.69 3.84 0.66 -5.02 114.94 105.87 2p76 s ASN 220 Ca -0.04 -0.38 0.15 0.00 0.21 0.00 0.00 52.86 52.80 2p76 s ASN 220 Cb 0.15 1.76 0.72 0.00 -0.55 0.00 0.00 41.25 43.33 2p76 s ASN 220 CO 0.73 -0.26 1.46 2.29 -2.79 0.00 0.00 177.10 178.53 2p76 n LYS 221 N 4.96 0.09 0.00 0.43 2.85 -0.80 -3.00 118.16 122.69 2p76 n LYS 221 Ca 0.07 0.49 0.13 0.00 -1.05 0.00 0.00 58.31 57.94 2p76 n LYS 221 Cb 0.54 -1.74 0.38 0.00 -0.65 0.00 0.00 35.03 33.56 2p76 n LYS 221 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 177.40 178.07 2p76 n HIS 222 N -1.92 0.00 -3.02 5.58 8.25 -1.26 -4.84 115.22 118.01 2p76 n HIS 222 Ca 0.01 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.06 2p76 n HIS 222 Cb 0.09 -0.21 -0.05 0.00 1.12 0.00 0.00 29.99 30.94 2p76 n HIS 222 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2p76 s VAL 223 N -2.72 4.96 0.20 1.59 1.01 -1.16 -4.82 120.40 119.45 2p76 s VAL 223 Ca 0.19 1.38 -0.32 0.00 0.00 0.00 0.00 61.98 63.23 2p76 s VAL 223 Cb 0.19 -4.03 -0.12 0.00 0.00 0.00 0.00 36.38 32.42 2p76 s VAL 223 CO 0.58 0.07 1.72 -2.84 0.00 0.00 0.00 175.10 174.64 2p76 s PRO 224 N 2.04 4.13 0.02 2.72 0.02 -1.26 -4.94 135.00 137.72 2p76 s PRO 224 Ca 0.33 2.61 0.08 0.00 0.02 0.00 0.00 61.00 64.03 2p76 s PRO 224 Cb -0.16 -3.09 -0.03 0.00 0.02 0.00 0.00 34.50 31.24 2p76 s PRO 224 CO 0.11 -0.75 -0.23 -0.51 -0.33 0.00 0.00 177.00 175.29 2p76 s LEU 225 N 1.23 2.31 -0.12 -5.54 1.43 -1.26 -1.89 118.68 114.83 2p76 s LEU 225 Ca 0.75 -0.48 0.01 0.00 -1.03 0.00 0.00 54.13 53.39 2p76 s LEU 225 Cb -0.50 -1.39 0.02 0.00 0.03 0.00 0.00 46.19 44.35 2p76 s LEU 225 CO 0.32 0.28 -0.15 -0.69 0.23 0.00 0.00 176.35 176.35 2p76 s VAL 226 N -0.78 1.51 -0.27 -1.59 1.01 0.72 -1.50 120.40 119.51 2p76 s VAL 226 Ca 0.12 -0.64 -0.22 0.00 0.00 0.00 0.00 61.98 61.24 2p76 s VAL 226 Cb -0.10 -1.39 -0.01 0.00 0.00 0.00 0.00 36.38 34.88 2p76 s VAL 226 CO 0.02 0.44 0.72 -0.75 0.00 0.00 0.00 175.10 175.53 2p76 s LYS 227 N 1.12 4.08 -0.22 2.72 2.47 -0.25 -1.61 119.74 128.05 2p76 s LYS 227 Ca -0.04 0.64 -0.22 0.00 -1.56 0.00 0.00 55.97 54.80 2p76 s LYS 227 Cb -0.14 -3.67 -0.02 0.00 -1.46 0.00 0.00 37.83 32.54 2p76 s LYS 227 CO -0.04 -0.51 0.71 -0.51 0.16 0.00 0.00 175.35 175.17 2p76 s LEU 228 N 2.69 4.10 0.02 5.43 1.43 0.69 -0.18 118.68 132.86 2p76 s LEU 228 Ca 0.30 0.90 -0.09 0.00 -1.03 0.00 0.00 54.13 54.20 2p76 s LEU 228 Cb -0.15 -3.01 -0.05 0.00 0.03 0.00 0.00 46.19 43.01 2p76 s LEU 228 CO 0.09 -0.39 0.32 -0.69 0.23 0.00 0.00 176.35 175.91 2p76 s VAL 229 N 2.40 5.21 0.74 -1.59 1.01 -0.55 -4.39 120.40 123.23 2p76 s VAL 229 Ca 0.31 0.38 -0.08 0.00 0.00 0.00 0.00 61.98 62.58 2p76 s VAL 229 Cb -0.16 -3.60 0.07 0.00 0.00 0.00 0.00 36.38 32.70 2p76 s VAL 229 CO 0.09 0.40 1.07 -0.62 0.00 0.00 0.00 175.10 176.04 2p76 s ASP 230 N -1.54 4.64 -0.10 3.32 -1.08 -1.26 -3.57 116.67 117.07 2p76 s ASP 230 Ca 0.27 0.49 -0.29 0.00 -0.52 0.00 0.00 52.55 52.50 2p76 s ASP 230 Cb -0.14 -1.06 -0.06 0.00 -1.46 0.00 0.00 42.92 40.20 2p76 s ASP 230 CO 0.15 -1.74 1.82 -0.75 0.52 0.00 0.00 175.17 175.17 2p76 s LYS 231 N -5.35 3.90 0.00 4.34 2.47 -1.26 -1.80 119.74 122.04 2p76 s LYS 231 Ca 0.61 2.13 0.00 0.00 -1.56 0.00 0.00 55.97 57.16 2p76 s LYS 231 Cb -0.10 -4.11 0.00 0.00 -1.46 0.00 0.00 37.83 32.16 2p76 s LYS 231 CO 0.46 -1.20 0.00 0.41 0.16 0.00 0.00 175.35 175.18 2p76 n GLY 232 N 4.65 3.00 0.24 5.54 0.00 -1.26 -4.85 105.19 112.51 2p76 n GLY 232 Ca 0.20 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.32 2p76 n GLY 232 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2p76 h GLU 233 N 1.06 0.00 -0.46 1.61 4.81 -1.73 -3.18 114.58 116.70 2p76 h GLU 233 Ca 0.00 0.00 0.08 0.00 -0.13 0.00 0.00 59.36 59.31 2p76 h GLU 233 Cb 0.00 0.00 -0.07 0.00 0.63 0.00 0.00 28.75 29.31 2p76 h GLU 233 CO 0.00 0.18 0.04 1.25 -0.73 0.00 0.00 179.01 179.75 2p76 h LEU 234 N 0.00 -0.11 0.35 1.64 5.85 -1.89 -2.49 115.31 118.66 2p76 h LEU 234 Ca -0.00 0.10 -0.02 0.00 0.84 0.00 0.00 57.88 58.80 2p76 h LEU 234 Cb 0.41 0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.60 2p76 h LEU 234 CO 0.02 -0.02 -0.17 1.56 -0.34 0.00 0.00 178.44 179.49 2p76 h GLN 235 N 0.16 -0.45 -1.62 1.25 7.50 -1.92 -3.16 115.11 116.88 2p76 h GLN 235 Ca 0.23 0.03 0.49 0.00 0.50 0.00 0.00 58.65 59.90 2p76 h GLN 235 Cb 0.32 0.10 -0.08 0.00 0.05 0.00 0.00 27.48 27.87 2p76 h GLN 235 CO -0.35 -0.26 1.14 1.04 -1.50 0.00 0.00 178.83 178.90 2p76 n GLN 236 N -5.27 -0.01 -4.70 1.46 6.02 -0.94 -4.40 117.38 109.54 2p76 n GLN 236 Ca -0.10 1.00 -0.33 0.00 -0.01 0.00 0.00 57.00 57.55 2p76 n GLN 236 Cb 0.22 -2.21 -0.14 0.00 1.02 0.00 0.00 30.24 29.14 2p76 n GLN 236 CO 0.00 0.00 0.00 -0.59 -1.01 0.00 0.00 177.06 175.46 2p76 s PHE 237 N -4.75 2.86 0.08 1.08 -0.71 -1.19 -5.10 117.98 110.24 2p76 s PHE 237 Ca -0.05 -0.56 -0.01 0.00 -1.04 0.00 0.00 56.93 55.27 2p76 s PHE 237 Cb 0.25 -1.86 0.02 0.00 -1.21 0.00 0.00 43.02 40.22 2p76 s PHE 237 CO 0.77 -0.16 0.06 0.27 -1.34 0.00 0.00 175.22 174.82 2p76 n ASN 238 N 3.49 -1.80 -0.08 1.98 0.23 -1.26 -4.74 115.26 113.08 2p76 n ASN 238 Ca -0.18 -0.20 -0.15 0.00 -0.53 0.00 0.00 54.58 53.52 2p76 n ASN 238 Cb 0.53 -0.06 -0.05 0.00 -2.08 0.00 0.00 39.78 38.12 2p76 n ASN 238 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 2p76 h ASP 239 N -1.79 0.91 -0.89 0.53 3.45 -1.98 -2.01 116.42 114.64 2p76 h ASP 239 Ca -0.02 -0.53 0.01 0.00 0.43 0.00 0.00 57.03 56.92 2p76 h ASP 239 Cb 0.08 -0.26 -0.05 0.00 -0.56 0.00 0.00 39.33 38.54 2p76 h ASP 239 CO 0.01 1.27 0.59 -0.61 -1.57 0.00 0.00 179.24 178.93 2p76 h GLN 240 N 0.58 1.16 0.39 3.56 4.15 -1.98 0.55 115.11 123.52 2p76 h GLN 240 Ca 0.01 -0.07 -0.02 0.00 0.77 0.00 0.00 58.65 59.35 2p76 h GLN 240 Cb 1.11 -0.26 0.00 0.00 0.21 0.00 0.00 27.48 28.54 2p76 h GLN 240 CO 0.11 0.77 -0.19 -0.09 -1.93 0.00 0.00 178.83 177.50 2p76 h ARG 241 N 1.19 -0.51 -0.76 1.69 9.65 -1.89 -1.94 114.38 121.82 2p76 h ARG 241 Ca 0.33 0.03 0.05 0.00 -1.10 0.00 0.00 59.98 59.29 2p76 h ARG 241 Cb -0.12 0.11 -0.05 0.00 -1.39 0.00 0.00 29.97 28.53 2p76 h ARG 241 CO -0.08 -0.32 0.47 -0.07 2.80 0.00 0.00 179.97 182.77 2p76 h LEU 242 N -0.55 0.74 -0.92 3.80 3.38 -0.90 -0.30 115.31 120.56 2p76 h LEU 242 Ca -0.05 0.01 0.11 0.00 0.09 0.00 0.00 57.88 58.04 2p76 h LEU 242 Cb 0.42 -0.14 -0.08 0.00 0.09 0.00 0.00 40.66 40.94 2p76 h LEU 242 CO 0.09 0.49 0.55 0.11 0.09 0.00 0.00 178.44 179.77 2p76 h LYS 243 N 0.88 0.86 0.08 1.13 1.79 0.39 0.19 116.57 121.89 2p76 h LYS 243 Ca 0.32 -0.05 -0.28 0.00 -2.18 0.00 0.00 60.65 58.46 2p76 h LYS 243 Cb 0.11 -0.19 0.03 0.00 -1.58 0.00 0.00 32.23 30.59 2p76 h LYS 243 CO -0.15 0.57 -1.16 1.05 -1.08 0.00 0.00 179.45 178.68 2p76 h GLU 244 N 0.88 0.64 -0.82 3.15 4.11 -0.59 -2.97 114.58 118.98 2p76 h GLU 244 Ca 0.46 -0.80 0.05 0.00 0.07 0.00 0.00 59.36 59.13 2p76 h GLU 244 Cb 0.45 0.25 -0.05 0.00 0.50 0.00 0.00 28.75 29.90 2p76 h GLU 244 CO -0.27 1.36 0.51 0.82 0.07 0.00 0.00 179.01 181.50 2p76 h ILE 245 N 0.29 1.08 0.00 -1.06 2.04 -0.51 0.11 117.51 119.46 2p76 h ILE 245 Ca -0.17 -0.33 0.00 0.00 1.00 0.00 0.00 64.86 65.36 2p76 h ILE 245 Cb 1.83 0.03 0.00 0.00 -0.74 0.00 0.00 36.82 37.94 2p76 h ILE 245 CO 0.22 0.18 0.00 -1.14 0.00 0.00 0.00 178.15 177.41 2p76 n ARG 246 N -4.61 0.16 0.19 2.37 3.00 0.61 -1.28 116.66 117.10 2p76 n ARG 246 Ca 0.11 0.55 0.13 0.00 -0.00 0.00 0.00 57.85 58.63 2p76 n ARG 246 Cb 0.13 -1.91 0.35 0.00 0.00 0.00 0.00 32.46 31.03 2p76 n ARG 246 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.63 178.29 2p76 h SER 247 N 0.00 0.00 0.00 6.15 4.64 -0.60 -3.35 113.55 120.39 2p76 h SER 247 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2p76 h SER 247 Cb 0.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.24 2p76 h SER 247 CO 0.00 0.00 -0.54 0.00 -0.87 0.00 0.00 176.83 175.42 2p76 n TYR 248 N -2.80 0.00 -4.75 4.77 0.18 -0.88 -5.04 117.16 108.65 2p76 n TYR 248 Ca 0.04 0.00 -0.30 0.00 1.88 0.00 0.00 57.90 59.51 2p76 n TYR 248 Cb 0.44 0.00 -0.17 0.00 -0.38 0.00 0.00 39.34 39.23 2p76 n TYR 248 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 2p76 s ALA 249 N -1.28 1.96 -0.12 -3.48 0.00 -0.41 -4.41 121.76 114.02 2p76 s ALA 249 Ca 0.00 -0.88 0.17 0.00 0.00 0.00 0.00 51.96 51.24 2p76 s ALA 249 Cb 0.00 -0.85 0.21 0.00 0.00 0.00 0.00 23.12 22.47 2p76 s ALA 249 CO 0.00 0.06 1.51 0.97 0.00 0.00 0.00 175.76 178.30 2p76 h ILE 250 N 5.85 0.78 -2.60 0.00 6.09 -1.54 -3.38 117.51 122.71 2p76 h ILE 250 Ca -0.28 -1.99 -0.59 0.00 -1.37 0.00 0.00 64.86 60.62 2p76 h ILE 250 Cb 1.20 2.30 -0.15 0.00 0.47 0.00 0.00 36.82 40.64 2p76 h ILE 250 CO 0.50 0.43 -0.77 -0.83 -3.07 0.00 0.00 178.15 174.41 2p76 s GLY 251 N -4.42 1.75 -0.07 8.18 0.00 -0.87 -2.09 107.32 109.80 2p76 s GLY 251 Ca 0.04 -1.77 0.00 0.00 0.00 0.00 0.00 44.72 42.99 2p76 s GLY 251 CO 0.73 -1.84 -0.05 -2.27 0.00 0.00 0.00 173.10 169.67 2p76 s LEU 252 N -3.23 1.14 -0.58 0.66 2.96 -0.19 -1.09 118.68 118.34 2p76 s LEU 252 Ca 0.26 -0.17 0.03 0.00 -0.22 0.00 0.00 54.13 54.03 2p76 s LEU 252 Cb -0.05 -0.56 0.15 0.00 0.50 0.00 0.00 46.19 46.23 2p76 s LEU 252 CO 0.12 -0.09 0.35 -0.83 -1.32 0.00 0.00 176.35 174.58 2p76 s GLY 253 N 1.30 2.58 0.54 7.98 0.00 0.74 -2.45 107.32 118.02 2p76 s GLY 253 Ca -0.04 -3.42 -0.06 0.00 0.00 0.00 0.00 44.72 41.20 2p76 s GLY 253 CO -0.02 1.04 0.86 2.56 0.00 0.00 0.00 173.10 177.54 2p76 s PRO 254 N -0.55 3.33 0.16 2.90 0.04 -1.26 -1.49 135.00 138.13 2p76 s PRO 254 Ca 0.19 0.21 -0.32 0.00 0.04 0.00 0.00 61.00 61.12 2p76 s PRO 254 Cb -0.20 -2.29 -0.10 0.00 0.04 0.00 0.00 34.50 31.94 2p76 s PRO 254 CO -0.04 -0.44 1.60 0.34 0.04 0.00 0.00 177.00 178.50 2p76 s ASP 255 N -4.19 6.55 0.56 6.66 -1.08 -1.23 -0.81 116.67 123.13 2p76 s ASP 255 Ca 0.51 2.65 0.27 0.00 -0.52 0.00 0.00 52.55 55.45 2p76 s ASP 255 Cb -0.10 -2.59 1.48 0.00 -1.46 0.00 0.00 42.92 40.25 2p76 s ASP 255 CO 0.46 -0.85 2.01 0.10 0.52 0.00 0.00 175.17 177.41 2p76 h TYR 256 N 6.96 0.00 0.00 -5.34 -0.00 -1.86 -1.65 116.97 115.08 2p76 h TYR 256 Ca -0.43 0.00 -0.01 0.00 0.00 0.00 0.00 58.73 58.29 2p76 h TYR 256 Cb 1.20 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 37.93 2p76 h TYR 256 CO 0.66 0.00 -0.05 1.79 -0.00 0.00 0.00 178.16 180.56 2p76 h THR 257 N 0.00 0.16 -0.00 -0.90 1.35 -1.89 -2.40 112.91 109.24 2p76 h THR 257 Ca 0.19 -0.57 0.00 0.00 -0.55 0.00 0.00 66.41 65.48 2p76 h THR 257 Cb 0.86 1.49 0.00 0.00 -1.73 0.00 0.00 68.15 68.77 2p76 h THR 257 CO -0.00 0.05 -0.13 0.47 -0.25 0.00 0.00 175.52 175.66 2p76 n ASP 258 N -3.20 0.34 -4.83 5.36 8.00 -0.62 -4.87 116.55 116.73 2p76 n ASP 258 Ca -0.00 -0.29 -0.34 0.00 0.71 0.00 0.00 54.79 54.86 2p76 n ASP 258 Cb 0.30 -0.13 -0.06 0.00 -0.02 0.00 0.00 41.12 41.20 2p76 n ASP 258 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2p76 s LEU 259 N -2.65 4.19 0.02 0.64 1.43 -0.90 -4.95 118.68 116.46 2p76 s LEU 259 Ca 0.24 1.42 -0.10 0.00 -1.03 0.00 0.00 54.13 54.66 2p76 s LEU 259 Cb 0.20 -3.92 0.01 0.00 0.03 0.00 0.00 46.19 42.51 2p76 s LEU 259 CO 0.51 -0.11 0.21 0.42 0.23 0.00 0.00 176.35 177.61 2p76 s THR 260 N -1.78 0.09 0.38 5.49 -4.23 -1.26 -5.04 115.64 109.28 2p76 s THR 260 Ca 0.50 -0.77 0.17 0.00 -1.18 0.00 0.00 61.69 60.42 2p76 s THR 260 Cb -0.13 -0.75 0.38 0.00 1.34 0.00 0.00 72.50 73.33 2p76 s THR 260 CO 0.19 -0.42 1.74 -0.08 -0.54 0.00 0.00 174.62 175.50 2p76 h GLU 261 N 3.69 0.39 0.31 3.99 4.81 -1.97 -1.82 114.58 123.98 2p76 h GLU 261 Ca -0.31 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 58.88 2p76 h GLU 261 Cb 1.19 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 30.48 2p76 h GLU 261 CO 0.45 0.26 -0.15 -0.56 -0.73 0.00 0.00 179.01 178.28 2p76 h GLN 262 N 0.40 -0.39 -0.61 1.92 -0.00 -1.97 -2.18 115.11 112.28 2p76 h GLN 262 Ca 0.64 0.03 0.03 0.00 -0.00 0.00 0.00 58.65 59.35 2p76 h GLN 262 Cb 1.56 0.09 -0.03 0.00 -0.00 0.00 0.00 27.48 29.10 2p76 h GLN 262 CO -0.38 -0.07 0.41 -2.95 -0.00 0.00 0.00 178.83 175.83 2p76 h ASN 263 N -0.95 0.64 -0.43 0.06 7.08 -1.91 0.66 115.58 120.73 2p76 h ASN 263 Ca -0.04 -0.01 0.01 0.00 -3.08 0.00 0.00 56.30 53.18 2p76 h ASN 263 Cb 0.50 -0.15 -0.02 0.00 -2.08 0.00 0.00 38.32 36.57 2p76 h ASN 263 CO 0.07 0.45 0.27 0.74 -2.08 0.00 0.00 177.43 176.88 2p76 h THR 264 N 0.75 1.08 -0.41 6.14 2.02 -1.37 0.21 112.91 121.33 2p76 h THR 264 Ca 0.24 -0.19 -0.02 0.00 0.77 0.00 0.00 66.41 67.21 2p76 h THR 264 Cb 0.04 0.48 -0.02 0.00 -1.74 0.00 0.00 68.15 66.91 2p76 h THR 264 CO -0.06 0.10 0.18 0.45 0.37 0.00 0.00 175.52 176.56 2p76 h HIS 265 N 0.55 0.60 -0.08 3.16 3.86 -0.55 -1.02 115.15 121.67 2p76 h HIS 265 Ca 0.16 -0.04 0.03 0.00 -1.16 0.00 0.00 60.37 59.37 2p76 h HIS 265 Cb -0.03 -0.18 -0.04 0.00 1.06 0.00 0.00 27.41 28.22 2p76 h HIS 265 CO -0.06 0.51 -0.13 1.25 0.86 0.00 0.00 177.93 180.36 2p76 h HIS 266 N 0.52 -0.34 -0.21 2.45 6.17 -0.11 0.16 115.15 123.79 2p76 h HIS 266 Ca 0.14 0.02 0.03 0.00 0.71 0.00 0.00 60.37 61.26 2p76 h HIS 266 Cb 0.15 0.16 -0.03 0.00 2.52 0.00 0.00 27.41 30.22 2p76 h HIS 266 CO -0.01 -0.20 0.04 -0.07 0.71 0.00 0.00 177.93 178.40 2p76 h LEU 267 N -0.19 0.01 -1.28 0.26 3.38 -0.48 -0.43 115.31 116.58 2p76 h LEU 267 Ca 0.07 0.03 0.10 0.00 0.09 0.00 0.00 57.88 58.18 2p76 h LEU 267 Cb 0.29 0.04 -0.06 0.00 0.09 0.00 0.00 40.66 41.02 2p76 h LEU 267 CO -0.19 0.03 0.55 0.11 0.09 0.00 0.00 178.44 179.03 2p76 h LYS 268 N 0.12 0.76 -0.43 1.13 1.79 -0.69 -0.28 116.57 118.97 2p76 h LYS 268 Ca 0.09 -0.05 -0.09 0.00 -2.18 0.00 0.00 60.65 58.43 2p76 h LYS 268 Cb 0.09 -0.17 -0.02 0.00 -1.58 0.00 0.00 32.23 30.55 2p76 h LYS 268 CO -0.13 0.50 -0.09 -0.44 -1.08 0.00 0.00 179.45 178.22 2p76 h ASP 269 N 0.78 0.75 0.00 0.86 3.32 0.54 -2.08 116.42 120.59 2p76 h ASP 269 Ca 0.40 -0.21 0.00 0.00 0.02 0.00 0.00 57.03 57.23 2p76 h ASP 269 Cb 0.47 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 39.82 2p76 h ASP 269 CO -0.16 0.87 0.00 0.18 -1.72 0.00 0.00 179.24 178.40 2p76 n LEU 270 N -4.18 0.00 0.00 1.55 4.77 -0.15 -4.82 117.00 114.17 2p76 n LEU 270 Ca 0.02 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.00 2p76 n LEU 270 Cb 0.35 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.44 2p76 n LEU 270 CO 0.42 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.09 2p76 n GLY 271 N 0.25 0.76 3.82 -0.72 0.00 -0.78 -5.01 105.19 103.51 2p76 n GLY 271 Ca 0.05 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.77 2p76 n GLY 271 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2p76 s PHE 272 N -2.65 3.11 -0.13 1.61 0.08 -0.96 -4.73 117.98 114.31 2p76 s PHE 272 Ca 0.00 1.33 -0.00 0.00 0.12 0.00 0.00 56.93 58.38 2p76 s PHE 272 Cb 0.00 -2.93 -0.02 0.00 -0.57 0.00 0.00 43.02 39.51 2p76 s PHE 272 CO 0.00 -1.30 -0.13 0.42 -0.10 0.00 0.00 175.22 174.12 2p76 s ILE 273 N -3.09 3.10 -0.16 0.64 1.01 -0.89 -4.48 121.20 117.32 2p76 s ILE 273 Ca 0.58 -0.64 -0.02 0.00 0.00 0.00 0.00 60.65 60.57 2p76 s ILE 273 Cb -0.14 -2.30 -0.02 0.00 0.01 0.00 0.00 42.46 40.01 2p76 s ILE 273 CO 0.55 0.52 -0.09 -0.69 0.00 0.00 0.00 174.94 175.23 2p76 s VAL 274 N 0.35 3.33 -0.47 2.92 1.01 -1.26 -1.02 120.40 125.26 2p76 s VAL 274 Ca -0.11 -0.55 0.03 0.00 0.00 0.00 0.00 61.98 61.36 2p76 s VAL 274 Cb -0.16 -2.45 0.16 0.00 0.00 0.00 0.00 36.38 33.94 2p76 s VAL 274 CO 0.06 0.49 0.34 -1.00 0.00 0.00 0.00 175.10 174.99 2p76 s HIS 275 N 0.66 1.75 0.71 5.22 3.76 -1.02 -1.16 115.29 125.22 2p76 s HIS 275 Ca -0.05 -2.49 -0.16 0.00 -0.15 0.00 0.00 55.06 52.22 2p76 s HIS 275 Cb -0.15 -1.48 0.02 0.00 1.11 0.00 0.00 32.58 32.07 2p76 s HIS 275 CO 0.02 -0.76 1.14 -0.35 -0.85 0.00 0.00 174.74 173.95 2p76 n PRO 276 N 2.92 0.65 -4.61 8.40 -0.04 -1.25 -4.25 135.00 136.81 2p76 n PRO 276 Ca 0.22 0.28 -0.33 0.00 -0.04 0.00 0.00 63.50 63.63 2p76 n PRO 276 Cb 0.41 -2.39 -0.11 0.00 -0.04 0.00 0.00 33.50 31.38 2p76 n PRO 276 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 2p76 s TYR 277 N -1.73 2.87 -0.59 0.54 1.13 0.01 -2.55 117.35 117.03 2p76 s TYR 277 Ca 0.77 -0.03 -0.11 0.00 -1.41 0.00 0.00 57.07 56.28 2p76 s TYR 277 Cb -0.35 -1.66 0.02 0.00 -1.10 0.00 0.00 41.96 38.87 2p76 s TYR 277 CO 0.47 0.32 0.65 2.41 -2.51 0.00 0.00 175.55 176.88 2p76 n THR 278 N 2.00 -9.04 -3.64 -3.49 -1.04 -1.04 -3.63 114.28 94.40 2p76 n THR 278 Ca -0.17 0.28 -0.40 0.00 -2.04 0.00 0.00 64.05 61.72 2p76 n THR 278 Cb 0.53 -6.23 -0.11 0.00 -1.82 0.00 0.00 70.33 62.69 2p76 n THR 278 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 2p76 s VAL 279 N -2.66 4.48 -0.52 12.58 1.01 -0.46 -4.94 120.40 129.88 2p76 s VAL 279 Ca 0.15 -0.76 0.04 0.00 0.00 0.00 0.00 61.98 61.41 2p76 s VAL 279 Cb -0.03 -3.43 0.04 0.00 0.00 0.00 0.00 36.38 32.95 2p76 s VAL 279 CO 0.79 -0.13 0.67 0.59 0.00 0.00 0.00 175.10 177.02 2p76 n ASN 280 N 4.97 1.43 -4.54 3.32 3.02 -1.26 -4.48 115.26 117.73 2p76 n ASN 280 Ca -0.13 -1.24 -0.37 0.00 -0.03 0.00 0.00 54.58 52.82 2p76 n ASN 280 Cb 0.47 -0.01 -0.11 0.00 -0.61 0.00 0.00 39.78 39.52 2p76 n ASN 280 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2p76 s GLU 281 N -0.40 3.83 0.31 3.52 0.41 -1.26 -4.94 118.70 120.17 2p76 s GLU 281 Ca 0.05 -0.39 0.08 0.00 -0.41 0.00 0.00 54.97 54.30 2p76 s GLU 281 Cb 0.04 -3.45 0.86 0.00 -1.78 0.00 0.00 34.13 29.79 2p76 s GLU 281 CO 0.05 -0.11 1.70 0.87 -0.49 0.00 0.00 175.26 177.27 2p76 h LYS 282 N 8.06 0.42 -0.10 1.61 1.57 -1.93 -0.44 116.57 125.75 2p76 h LYS 282 Ca -0.37 -0.03 0.04 0.00 -1.87 0.00 0.00 60.65 58.42 2p76 h LYS 282 Cb 1.18 -0.09 -0.04 0.00 0.08 0.00 0.00 32.23 33.36 2p76 h LYS 282 CO 0.59 0.28 -0.13 0.00 -0.57 0.00 0.00 179.45 179.61 2p76 h ALA 283 N 1.75 -0.06 -0.61 3.86 0.00 -2.00 -0.96 119.26 121.25 2p76 h ALA 283 Ca 0.63 0.04 -0.05 0.00 0.00 0.00 0.00 54.91 55.53 2p76 h ALA 283 Cb 1.25 0.26 -0.03 0.00 0.00 0.00 0.00 17.79 19.28 2p76 h ALA 283 CO -0.54 -0.59 0.19 -0.44 0.00 0.00 0.00 179.25 177.87 2p76 h ASP 284 N -0.17 0.88 -0.35 0.00 3.32 -1.57 -1.40 116.42 117.13 2p76 h ASP 284 Ca 0.08 -0.21 0.07 0.00 0.02 0.00 0.00 57.03 56.99 2p76 h ASP 284 Cb 0.28 -0.23 -0.07 0.00 0.22 0.00 0.00 39.33 39.54 2p76 h ASP 284 CO -0.20 0.86 -0.08 0.24 -1.72 0.00 0.00 179.24 178.34 2p76 h MET 285 N 0.86 0.01 -0.21 3.56 2.86 -0.68 0.82 114.93 122.15 2p76 h MET 285 Ca 0.19 -0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.82 2p76 h MET 285 Cb 0.29 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.94 2p76 h MET 285 CO -0.01 0.01 0.08 1.25 1.06 0.00 0.00 176.91 179.30 2p76 h LEU 286 N 0.01 0.29 0.26 1.22 5.85 -0.94 -1.62 115.31 120.38 2p76 h LEU 286 Ca 0.17 -0.17 0.01 0.00 0.84 0.00 0.00 57.88 58.73 2p76 h LEU 286 Cb 0.26 -0.08 -0.04 0.00 0.37 0.00 0.00 40.66 41.17 2p76 h LEU 286 CO -0.35 0.38 -0.46 -0.09 -0.34 0.00 0.00 178.44 177.57 2p76 h ARG 287 N 0.19 -0.77 -0.62 1.25 2.43 -0.59 -1.76 114.38 114.50 2p76 h ARG 287 Ca 0.07 0.05 0.09 0.00 -0.81 0.00 0.00 59.98 59.39 2p76 h ARG 287 Cb 0.18 0.17 -0.07 0.00 -0.42 0.00 0.00 29.97 29.83 2p76 h ARG 287 CO -0.01 -0.51 0.25 -0.07 -1.51 0.00 0.00 179.97 178.12 2p76 h LEU 288 N -0.80 0.26 -1.32 3.80 3.38 -0.85 0.31 115.31 120.09 2p76 h LEU 288 Ca -0.01 0.08 0.07 0.00 0.09 0.00 0.00 57.88 58.10 2p76 h LEU 288 Cb 0.76 0.05 -0.05 0.00 0.09 0.00 0.00 40.66 41.51 2p76 h LEU 288 CO -0.18 0.15 0.51 0.78 0.09 0.00 0.00 178.44 179.79 2p76 h ASN 289 N 0.43 0.71 -0.37 -0.43 -0.26 -0.96 0.26 115.58 114.96 2p76 h ASN 289 Ca 0.31 0.01 -0.10 0.00 -0.56 0.00 0.00 56.30 55.97 2p76 h ASN 289 Cb 0.38 -0.14 -0.02 0.00 -1.06 0.00 0.00 38.32 37.48 2p76 h ASN 289 CO -0.30 0.45 -0.11 0.11 -1.06 0.00 0.00 177.43 176.52 2p76 h LYS 290 N 0.81 0.82 -0.82 0.81 1.57 -0.08 -2.25 116.57 117.42 2p76 h LYS 290 Ca 0.34 -0.28 0.05 0.00 -1.87 0.00 0.00 60.65 58.89 2p76 h LYS 290 Cb 0.30 -0.07 -0.05 0.00 0.08 0.00 0.00 32.23 32.49 2p76 h LYS 290 CO -0.12 0.90 0.54 1.88 -0.57 0.00 0.00 179.45 182.07 2p76 h TYR 291 N 0.74 0.94 0.00 -1.35 -1.99 0.08 -3.46 116.97 111.93 2p76 h TYR 291 Ca 0.12 0.02 0.00 0.00 2.00 0.00 0.00 58.73 60.88 2p76 h TYR 291 Cb 0.61 -0.31 0.00 0.00 2.00 0.00 0.00 36.73 39.02 2p76 h TYR 291 CO 0.03 0.52 0.00 0.41 -0.00 0.00 0.00 178.16 179.13 2p76 n GLY 292 N -1.42 0.62 3.36 3.88 0.00 -0.84 -4.55 105.19 106.24 2p76 n GLY 292 Ca 0.11 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.82 2p76 n GLY 292 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2p76 n VAL 293 N 0.00 0.00 0.28 1.61 0.24 -1.18 -4.93 118.33 114.35 2p76 n VAL 293 Ca 0.00 -0.32 0.07 0.00 -2.04 0.00 0.00 64.34 62.06 2p76 n VAL 293 Cb 0.00 -0.72 0.11 0.00 -1.47 0.00 0.00 33.84 31.76 2p76 n VAL 293 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 2p76 n ASP 294 N -2.56 2.55 0.00 -1.34 8.00 -0.31 -4.87 116.55 118.03 2p76 n ASP 294 Ca 0.02 -1.74 0.00 0.00 0.71 0.00 0.00 54.79 53.78 2p76 n ASP 294 Cb 0.59 -0.11 0.00 0.00 -0.02 0.00 0.00 41.12 41.58 2p76 n ASP 294 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2p76 n GLY 295 N 0.79 -1.23 3.34 0.44 0.00 -1.22 -0.60 105.19 106.72 2p76 n GLY 295 Ca 0.11 -1.47 -0.10 0.00 0.00 0.00 0.00 46.02 44.55 2p76 n GLY 295 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2p76 s VAL 296 N -2.20 0.07 -0.05 1.61 -7.23 -1.12 -3.90 120.40 107.57 2p76 s VAL 296 Ca 0.00 -0.66 -0.17 0.00 -1.81 0.00 0.00 61.98 59.34 2p76 s VAL 296 Cb 0.00 -1.26 -0.05 0.00 0.56 0.00 0.00 36.38 35.63 2p76 s VAL 296 CO 0.00 -0.30 0.46 -0.36 -0.31 0.00 0.00 175.10 174.59 2p76 s PHE 297 N -3.82 3.63 -0.02 2.82 0.08 -1.06 -1.42 117.98 118.19 2p76 s PHE 297 Ca 0.05 0.97 -0.22 0.00 0.12 0.00 0.00 56.93 57.84 2p76 s PHE 297 Cb 0.02 -2.44 0.05 0.00 -0.57 0.00 0.00 43.02 40.07 2p76 s PHE 297 CO -0.10 0.40 0.49 -0.08 -0.10 0.00 0.00 175.22 175.83 2p76 s THR 298 N -0.24 0.03 -2.49 0.64 -1.32 -0.32 -1.36 115.64 110.58 2p76 s THR 298 Ca 0.25 -0.26 0.26 0.00 -1.21 0.00 0.00 61.69 60.73 2p76 s THR 298 Cb -0.16 -0.82 0.50 0.00 -1.51 0.00 0.00 72.50 70.51 2p76 s THR 298 CO 0.12 -0.14 1.65 0.59 -2.21 0.00 0.00 174.62 174.63 2p76 n ASN 299 N 1.03 1.72 -3.55 8.08 3.02 -1.26 -1.37 115.26 122.92 2p76 n ASN 299 Ca -0.20 -1.60 -0.27 0.00 -0.03 0.00 0.00 54.58 52.47 2p76 n ASN 299 Cb 0.57 -0.03 -0.11 0.00 -0.61 0.00 0.00 39.78 39.60 2p76 n ASN 299 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 2p76 s PHE 300 N -1.94 1.84 0.19 3.10 0.08 -1.26 -0.93 117.98 119.06 2p76 s PHE 300 Ca 0.36 -2.63 -0.13 0.00 0.12 0.00 0.00 56.93 54.65 2p76 s PHE 300 Cb 0.20 -1.46 0.20 0.00 -0.57 0.00 0.00 43.02 41.39 2p76 s PHE 300 CO 0.32 -0.74 1.68 0.00 -0.10 0.00 0.00 175.22 176.37 2p76 h ALA 301 N 5.58 0.49 -0.33 5.36 0.00 -1.92 -2.50 119.26 125.94 2p76 h ALA 301 Ca 0.23 0.15 0.04 0.00 0.00 0.00 0.00 54.91 55.33 2p76 h ALA 301 Cb 0.86 0.26 -0.04 0.00 0.00 0.00 0.00 17.79 18.88 2p76 h ALA 301 CO 0.48 -0.39 0.09 0.38 0.00 0.00 0.00 179.25 179.81 2p76 h ASP 302 N 0.12 0.08 -0.75 0.00 3.04 -1.94 -0.21 116.42 116.76 2p76 h ASP 302 Ca 0.26 0.04 0.12 0.00 -3.24 0.00 0.00 57.03 54.21 2p76 h ASP 302 Cb 0.40 0.04 -0.08 0.00 -1.04 0.00 0.00 39.33 38.65 2p76 h ASP 302 CO -0.43 0.08 0.35 0.11 -2.04 0.00 0.00 179.24 177.30 2p76 h LYS 303 N 0.22 0.53 -0.29 4.15 1.57 -1.87 0.14 116.57 121.02 2p76 h LYS 303 Ca 0.15 -0.03 -0.18 0.00 -1.87 0.00 0.00 60.65 58.72 2p76 h LYS 303 Cb 0.14 -0.12 -0.00 0.00 0.08 0.00 0.00 32.23 32.33 2p76 h LYS 303 CO -0.17 0.35 -0.51 -0.92 -0.57 0.00 0.00 179.45 177.63 2p76 h TYR 304 N 0.55 1.08 -0.31 -1.35 3.20 -1.25 -1.70 116.97 117.19 2p76 h TYR 304 Ca 0.39 -0.38 -0.03 0.00 3.14 0.00 0.00 58.73 61.85 2p76 h TYR 304 Cb 0.51 -0.20 -0.02 0.00 1.54 0.00 0.00 36.73 38.56 2p76 h TYR 304 CO -0.13 1.20 0.05 0.87 -1.64 0.00 0.00 178.16 178.52 2p76 h LYS 305 N 0.64 0.45 -0.21 1.82 1.57 -0.05 -1.57 116.57 119.23 2p76 h LYS 305 Ca 0.02 -0.07 -0.07 0.00 -1.87 0.00 0.00 60.65 58.66 2p76 h LYS 305 Cb 1.12 -0.08 -0.00 0.00 0.08 0.00 0.00 32.23 33.34 2p76 h LYS 305 CO 0.12 0.43 -0.15 0.93 -0.57 0.00 0.00 179.45 180.21 2p76 h GLU 306 N 0.44 0.47 -0.16 3.15 5.08 -0.61 -0.88 114.58 122.07 2p76 h GLU 306 Ca 0.10 -0.23 0.05 0.00 -1.00 0.00 0.00 59.36 58.28 2p76 h GLU 306 Cb 0.21 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 2p76 h GLU 306 CO -0.00 0.79 0.12 0.28 -1.00 0.00 0.00 179.01 179.19 2p76 h VAL 307 N 0.16 0.88 0.05 3.13 2.07 -0.78 -0.95 116.25 120.81 2p76 h VAL 307 Ca 0.04 0.00 -0.28 0.00 0.82 0.00 0.00 66.70 67.28 2p76 h VAL 307 Cb 0.67 0.92 0.02 0.00 -1.52 0.00 0.00 31.29 31.38 2p76 h VAL 307 CO 0.04 0.00 -1.12 0.40 0.02 0.00 0.00 177.57 176.91 2p76 h ILE 308 N 0.00 1.28 -0.68 4.57 2.04 -0.95 -3.22 117.51 120.56 2p76 h ILE 308 Ca 0.08 -2.32 0.10 0.00 1.00 0.00 0.00 64.86 63.72 2p76 h ILE 308 Cb 0.31 2.50 -0.04 0.00 -0.74 0.00 0.00 36.82 38.85 2p76 h ILE 308 CO -0.00 0.71 0.45 0.50 0.00 0.00 0.00 178.15 179.81 2p76 h LYS 309 N 0.35 0.50 -0.02 2.37 3.64 0.18 -3.52 116.57 120.07 2p76 h LYS 309 Ca -0.15 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.20 2p76 h LYS 309 Cb 1.78 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 33.49 2p76 h LYS 309 CO 0.22 0.33 0.00 0.39 -2.27 0.00 0.00 179.45 178.12