#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fb1 n GLU 56 N 0.00 0.00 -0.34 1.61 2.13 -1.26 -5.03 120.64 117.76 1fb1 n GLU 56 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 1fb1 n GLU 56 Cb 0.00 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.71 1fb1 n GLU 56 CO 0.00 0.00 0.00 2.89 -0.41 0.00 0.00 177.13 179.61 1fb1 n ARG 57 N 12.18 0.00 -1.48 5.31 1.85 -1.26 -4.80 116.66 128.47 1fb1 n ARG 57 Ca 0.00 0.00 -0.44 0.00 -1.00 0.00 0.00 57.85 56.41 1fb1 n ARG 57 Cb 0.00 -0.09 -0.01 0.00 -1.05 0.00 0.00 32.46 31.31 1fb1 n ARG 57 CO 0.00 0.00 0.00 -2.30 -0.01 0.00 0.00 177.63 175.32 1fb1 n PRO 58 N 1.25 0.65 -3.76 2.89 -0.02 -1.26 -4.98 135.00 129.76 1fb1 n PRO 58 Ca 0.00 0.23 -0.38 0.00 -2.02 0.00 0.00 63.50 61.33 1fb1 n PRO 58 Cb 0.00 -1.46 -0.12 0.00 -0.02 0.00 0.00 33.50 31.89 1fb1 n PRO 58 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 1fb1 s ARG 59 N -1.41 2.54 0.00 -0.52 6.06 -1.26 -5.02 118.95 119.35 1fb1 s ARG 59 Ca 0.62 -1.28 0.00 0.00 -2.50 0.00 0.00 55.73 52.56 1fb1 s ARG 59 Cb -0.71 -3.47 0.00 0.00 0.06 0.00 0.00 34.95 30.82 1fb1 s ARG 59 CO 0.58 -0.73 0.00 -1.13 -2.50 0.00 0.00 175.30 171.52 1fb1 n SER 60 N 4.78 0.00 -0.26 -2.12 3.41 -1.26 -4.61 113.62 113.55 1fb1 n SER 60 Ca -0.11 -0.57 0.07 0.00 -0.26 0.00 0.00 58.87 57.99 1fb1 n SER 60 Cb 0.44 0.00 0.21 0.00 -0.26 0.00 0.00 64.21 64.59 1fb1 n SER 60 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 1fb1 h GLU 61 N 0.00 0.31 -0.67 4.33 4.81 -1.98 1.00 114.58 122.37 1fb1 h GLU 61 Ca 0.00 -0.02 0.19 0.00 -0.13 0.00 0.00 59.36 59.41 1fb1 h GLU 61 Cb 0.00 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.28 1fb1 h GLU 61 CO 0.00 0.20 0.50 1.49 -0.73 0.00 0.00 179.01 180.47 1fb1 h GLU 62 N 0.31 0.00 0.05 1.92 4.81 -1.99 0.72 114.58 120.40 1fb1 h GLU 62 Ca 0.44 0.00 -0.36 0.00 -0.13 0.00 0.00 59.36 59.31 1fb1 h GLU 62 Cb 0.76 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 30.10 1fb1 h GLU 62 CO -0.50 0.00 -2.16 -0.25 -0.73 0.00 0.00 179.01 175.37 1fb1 n ASP 63 N -4.25 1.65 0.08 1.04 10.43 0.13 -3.65 116.55 121.98 1fb1 n ASP 63 Ca 0.13 0.10 -0.00 0.00 2.57 0.00 0.00 54.79 57.59 1fb1 n ASP 63 Cb 0.76 -0.38 0.30 0.00 1.84 0.00 0.00 41.12 43.63 1fb1 n ASP 63 CO 0.00 0.00 0.00 0.78 -1.07 0.00 0.00 177.20 176.91 1fb1 h ASN 64 N 0.03 0.31 0.15 -2.24 4.21 0.04 -1.85 115.58 116.22 1fb1 h ASN 64 Ca -0.47 -0.09 -0.01 0.00 1.21 0.00 0.00 56.30 56.94 1fb1 h ASN 64 Cb 2.01 -0.08 0.00 0.00 -1.12 0.00 0.00 38.32 39.13 1fb1 h ASN 64 CO 0.02 0.54 -0.07 -0.08 -1.29 0.00 0.00 177.43 176.55 1fb1 h GLU 65 N 0.29 -0.19 0.00 0.81 4.81 0.25 -0.33 114.58 120.22 1fb1 h GLU 65 Ca 0.05 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.29 1fb1 h GLU 65 Cb 0.54 0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.96 1fb1 h GLU 65 CO 0.04 0.03 0.00 1.28 -0.73 0.00 0.00 179.01 179.62 1fb1 n LEU 66 N -5.09 0.00 -0.05 1.64 4.77 -1.08 -1.88 117.00 115.31 1fb1 n LEU 66 Ca -0.09 0.35 -0.04 0.00 -0.03 0.00 0.00 56.01 56.21 1fb1 n LEU 66 Cb 0.17 -0.35 -0.14 0.00 -2.33 0.00 0.00 43.42 40.77 1fb1 n LEU 66 CO 0.33 -0.26 -0.82 0.59 -1.33 0.00 0.00 177.39 175.90 1fb1 n ASN 67 N -1.35 0.29 0.19 -1.43 3.02 -0.37 -4.55 115.26 111.06 1fb1 n ASN 67 Ca 0.03 0.13 0.18 0.00 -0.03 0.00 0.00 54.58 54.89 1fb1 n ASN 67 Cb 0.07 0.86 0.82 0.00 -0.61 0.00 0.00 39.78 40.93 1fb1 n ASN 67 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 1fb1 h LEU 68 N 0.00 0.00 0.00 3.41 5.85 -0.39 -2.72 115.31 121.46 1fb1 h LEU 68 Ca -0.34 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.38 1fb1 h LEU 68 Cb 1.85 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.88 1fb1 h LEU 68 CO 0.03 0.00 -1.06 -0.81 -0.34 0.00 0.00 178.44 176.26 1fb1 n PRO 69 N -3.73 0.27 0.01 5.25 -0.04 -1.26 -2.08 135.00 133.42 1fb1 n PRO 69 Ca 0.02 -0.01 0.12 0.00 -0.04 0.00 0.00 63.50 63.59 1fb1 n PRO 69 Cb 0.38 -1.58 0.19 0.00 -0.04 0.00 0.00 33.50 32.45 1fb1 n PRO 69 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1fb1 n ASN 70 N -1.92 0.57 -0.13 3.54 4.13 -1.04 -2.36 115.26 118.05 1fb1 n ASN 70 Ca 0.02 -0.27 -0.27 0.00 1.68 0.00 0.00 54.58 55.74 1fb1 n ASN 70 Cb 0.43 0.34 -0.11 0.00 -1.54 0.00 0.00 39.78 38.91 1fb1 n ASN 70 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 1fb1 n LEU 71 N -1.60 2.05 -0.29 3.41 4.77 -1.15 -3.05 117.00 121.14 1fb1 n LEU 71 Ca 0.05 0.31 0.12 0.00 -0.03 0.00 0.00 56.01 56.45 1fb1 n LEU 71 Cb 0.35 -0.87 0.28 0.00 -2.33 0.00 0.00 43.42 40.85 1fb1 n LEU 71 CO 0.36 0.56 1.00 0.00 -1.33 0.00 0.00 177.39 177.98 1fb1 h ALA 72 N -0.77 1.30 -0.08 -1.18 0.00 -1.44 0.41 119.26 117.51 1fb1 h ALA 72 Ca -0.61 0.17 -0.21 0.00 0.00 0.00 0.00 54.91 54.27 1fb1 h ALA 72 Cb 1.59 0.20 0.01 0.00 0.00 0.00 0.00 17.79 19.59 1fb1 h ALA 72 CO -0.34 -0.36 -0.75 0.00 0.00 0.00 0.00 179.25 177.80 1fb1 h ALA 73 N 1.70 0.19 0.00 0.00 0.00 -1.66 -1.11 119.26 118.38 1fb1 h ALA 73 Ca 0.53 -0.60 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1fb1 h ALA 73 Cb 0.99 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.80 1fb1 h ALA 73 CO -0.55 0.56 0.20 0.00 0.00 0.00 0.00 179.25 179.46 1fb1 h ALA 74 N 0.45 1.18 0.00 0.00 0.00 -0.25 0.75 119.26 121.40 1fb1 h ALA 74 Ca -0.07 0.00 -0.32 0.00 0.00 0.00 0.00 54.91 54.52 1fb1 h ALA 74 Cb 1.41 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 19.14 1fb1 h ALA 74 CO 0.15 -0.18 -2.20 0.66 0.00 0.00 0.00 179.25 177.68 1fb1 n TYR 75 N -2.60 0.00 0.57 0.00 0.53 0.35 -3.39 117.16 112.62 1fb1 n TYR 75 Ca -0.02 0.00 0.08 0.00 -1.02 0.00 0.00 57.90 56.95 1fb1 n TYR 75 Cb 0.25 -0.86 0.37 0.00 -1.03 0.00 0.00 39.34 38.07 1fb1 n TYR 75 CO 0.00 0.00 0.00 0.45 -1.02 0.00 0.00 176.86 176.29 1fb1 n SER 76 N -2.70 0.06 -0.06 7.72 2.88 0.09 -0.29 113.62 121.32 1fb1 n SER 76 Ca -0.30 0.51 -0.17 0.00 -1.33 0.00 0.00 58.87 57.59 1fb1 n SER 76 Cb 1.05 -0.52 -0.14 0.00 -0.75 0.00 0.00 64.21 63.85 1fb1 n SER 76 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1fb1 n SER 77 N -1.56 1.57 -0.13 -3.46 2.88 -0.22 -3.58 113.62 109.11 1fb1 n SER 77 Ca 0.04 0.11 0.13 0.00 -1.33 0.00 0.00 58.87 57.82 1fb1 n SER 77 Cb 0.20 -0.33 0.43 0.00 -0.75 0.00 0.00 64.21 63.76 1fb1 n SER 77 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1fb1 n ILE 78 N -3.24 0.00 0.03 2.46 3.06 -1.01 -0.37 119.36 120.29 1fb1 n ILE 78 Ca -0.34 -0.07 -0.15 0.00 -2.50 0.00 0.00 62.75 59.69 1fb1 n ILE 78 Cb 1.05 0.16 -0.14 0.00 0.54 0.00 0.00 39.64 41.25 1fb1 n ILE 78 CO 0.00 0.00 0.00 -0.07 -2.50 0.00 0.00 176.55 173.98 1fb1 h LEU 79 N 0.65 0.29 0.00 9.51 3.38 -0.80 -3.28 115.31 125.05 1fb1 h LEU 79 Ca 0.00 -0.47 -0.01 0.00 0.09 0.00 0.00 57.88 57.48 1fb1 h LEU 79 Cb 0.46 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.12 1fb1 h LEU 79 CO 0.00 1.41 -0.23 0.28 0.09 0.00 0.00 178.44 179.99 1fb1 h SER 80 N 0.05 0.00 0.00 -0.43 0.02 -1.60 -3.05 113.55 108.54 1fb1 h SER 80 Ca -0.28 -0.13 0.00 0.00 -0.84 0.00 0.00 61.79 60.54 1fb1 h SER 80 Cb 2.01 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.55 1fb1 h SER 80 CO 0.13 0.69 0.00 -1.20 -1.14 0.00 0.00 176.83 175.30 1fb1 n SER 81 N -4.69 0.09 -0.10 3.07 7.64 0.50 -0.59 113.62 119.54 1fb1 n SER 81 Ca -0.05 -0.32 -0.12 0.00 1.01 0.00 0.00 58.87 59.39 1fb1 n SER 81 Cb 0.17 -0.04 -0.12 0.00 -1.01 0.00 0.00 64.21 63.20 1fb1 n SER 81 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 1fb1 n LEU 82 N -0.00 1.24 0.00 -3.43 -0.00 -1.24 -4.96 117.00 108.61 1fb1 n LEU 82 Ca 0.00 -0.05 0.00 0.00 -0.00 0.00 0.00 56.01 55.96 1fb1 n LEU 82 Cb 0.02 -0.07 0.00 0.00 -0.00 0.00 0.00 43.42 43.37 1fb1 n LEU 82 CO 0.00 0.62 0.00 0.61 -0.00 0.00 0.00 177.39 178.62 1fb1 n GLY 83 N 2.13 0.98 3.97 -3.96 0.00 0.24 -5.09 105.19 103.46 1fb1 n GLY 83 Ca -0.33 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.48 1fb1 n GLY 83 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1fb1 s GLU 84 N 0.00 3.23 -0.78 1.61 2.56 -1.15 -5.06 118.70 119.11 1fb1 s GLU 84 Ca 0.00 -0.71 -0.07 0.00 0.00 0.00 0.00 54.97 54.20 1fb1 s GLU 84 Cb 0.00 -2.74 0.20 0.00 2.00 0.00 0.00 34.13 33.59 1fb1 s GLU 84 CO 0.00 0.07 0.66 1.21 -0.56 0.00 0.00 175.26 176.64 1fb1 s ASN 85 N -4.12 6.01 -0.75 -1.70 2.47 -1.26 -4.20 114.94 111.38 1fb1 s ASN 85 Ca 0.43 -3.05 -0.27 0.00 0.42 0.00 0.00 52.86 50.39 1fb1 s ASN 85 Cb -0.10 -2.00 -0.24 0.00 -1.45 0.00 0.00 41.25 37.46 1fb1 s ASN 85 CO 0.33 -0.38 1.90 -0.81 -3.72 0.00 0.00 177.10 174.42 1fb1 n PRO 86 N 3.33 0.56 0.00 0.43 -0.04 -1.26 -3.11 135.00 134.90 1fb1 n PRO 86 Ca 0.14 -1.67 0.00 0.00 -0.04 0.00 0.00 63.50 61.92 1fb1 n PRO 86 Cb 0.40 -3.35 0.00 0.00 -0.04 0.00 0.00 33.50 30.52 1fb1 n PRO 86 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 1fb1 n GLN 87 N 7.97 1.28 0.00 0.54 -0.06 -1.26 -4.85 117.38 120.99 1fb1 n GLN 87 Ca 0.45 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.45 1fb1 n GLN 87 Cb 0.45 -0.12 0.00 0.00 -4.06 0.00 0.00 30.24 26.51 1fb1 n GLN 87 CO 0.00 0.00 0.00 0.54 -0.20 0.00 0.00 177.06 177.40 1fb1 n ARG 88 N -0.05 2.26 -0.08 3.69 1.74 -1.18 -4.51 116.66 118.53 1fb1 n ARG 88 Ca 0.00 0.00 -0.21 0.00 -0.77 0.00 0.00 57.85 56.87 1fb1 n ARG 88 Cb 0.00 0.00 -0.12 0.00 -1.02 0.00 0.00 32.46 31.32 1fb1 n ARG 88 CO 0.00 0.00 0.00 0.94 -1.52 0.00 0.00 177.63 177.05 1fb1 n GLN 89 N -0.08 0.67 -0.04 5.56 7.27 -1.26 -3.03 117.38 126.47 1fb1 n GLN 89 Ca 0.00 0.26 -0.15 0.00 0.07 0.00 0.00 57.00 57.18 1fb1 n GLN 89 Cb 0.00 -1.61 -0.08 0.00 2.41 0.00 0.00 30.24 30.96 1fb1 n GLN 89 CO 0.00 0.00 0.00 0.78 0.07 0.00 0.00 177.06 177.91 1fb1 h GLY 90 N 0.89 0.46 1.65 1.69 0.00 -2.00 -3.26 103.07 102.50 1fb1 h GLY 90 Ca -0.52 -0.58 0.00 0.00 0.00 0.00 0.00 47.33 46.23 1fb1 h GLY 90 CO -0.09 0.52 -0.25 1.04 0.00 0.00 0.00 176.54 177.76 1fb1 n LEU 91 N -4.39 0.69 -0.33 3.11 4.32 -1.26 -4.13 117.00 115.01 1fb1 n LEU 91 Ca -0.07 0.42 0.28 0.00 -0.02 0.00 0.00 56.01 56.61 1fb1 n LEU 91 Cb 0.49 -0.28 0.53 0.00 -1.62 0.00 0.00 43.42 42.53 1fb1 n LEU 91 CO 0.42 -0.11 1.07 0.25 -1.22 0.00 0.00 177.39 177.81 1fb1 h LEU 92 N 0.00 0.37 -2.78 2.23 5.85 -1.58 -1.77 115.31 117.62 1fb1 h LEU 92 Ca 0.00 0.23 0.00 0.00 0.84 0.00 0.00 57.88 58.95 1fb1 h LEU 92 Cb 0.71 0.22 0.00 0.00 0.37 0.00 0.00 40.66 41.96 1fb1 h LEU 92 CO 0.00 -0.31 0.00 0.29 -0.34 0.00 0.00 178.44 178.08 1fb1 n LYS 93 N -5.18 2.62 -0.26 1.25 5.02 -1.26 -4.75 118.16 115.60 1fb1 n LYS 93 Ca 0.35 -1.60 0.00 0.00 -2.02 0.00 0.00 58.31 55.03 1fb1 n LYS 93 Cb 1.13 -1.09 0.21 0.00 -0.02 0.00 0.00 35.03 35.26 1fb1 n LYS 93 CO 0.00 0.00 0.00 1.15 -0.52 0.00 0.00 177.40 178.03 1fb1 h THR 94 N 0.73 1.20 0.00 -0.18 2.02 -1.48 -0.38 112.91 114.82 1fb1 h THR 94 Ca 0.00 -0.38 0.00 0.00 0.77 0.00 0.00 66.41 66.80 1fb1 h THR 94 Cb 0.54 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 66.95 1fb1 h THR 94 CO 0.00 0.20 0.00 -0.81 0.37 0.00 0.00 175.52 175.28 1fb1 n PRO 95 N -4.42 0.15 -0.07 6.66 -0.04 -1.26 -0.84 135.00 135.18 1fb1 n PRO 95 Ca 0.09 0.50 -0.08 0.00 -0.04 0.00 0.00 63.50 63.97 1fb1 n PRO 95 Cb 0.04 -1.86 -0.10 0.00 -0.04 0.00 0.00 33.50 31.54 1fb1 n PRO 95 CO 0.00 0.00 0.00 0.91 -0.04 0.00 0.00 175.50 176.37 1fb1 n TRP 96 N -2.15 0.00 0.11 0.54 7.02 -0.80 -3.01 117.44 119.15 1fb1 n TRP 96 Ca 0.01 0.00 -0.13 0.00 -1.02 0.00 0.00 57.50 56.35 1fb1 n TRP 96 Cb 0.14 -0.65 -0.08 0.00 -2.42 0.00 0.00 31.31 28.29 1fb1 n TRP 96 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1fb1 h ARG 97 N 0.00 -0.23 0.00 -0.99 3.08 -0.97 -0.85 114.38 114.43 1fb1 h ARG 97 Ca -0.37 0.02 -0.03 0.00 0.07 0.00 0.00 59.98 59.67 1fb1 h ARG 97 Cb 1.74 0.05 -0.00 0.00 0.08 0.00 0.00 29.97 31.84 1fb1 h ARG 97 CO -0.01 -0.02 -0.15 0.00 -1.07 0.00 0.00 179.97 178.73 1fb1 h ALA 98 N 0.38 1.09 0.24 0.04 0.00 -1.22 -1.94 119.26 117.85 1fb1 h ALA 98 Ca -0.02 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 1fb1 h ALA 98 Cb 0.32 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1fb1 h ALA 98 CO 0.04 0.19 -0.12 0.00 0.00 0.00 0.00 179.25 179.36 1fb1 h ALA 99 N 1.85 -0.32 0.00 0.00 0.00 -1.23 -2.58 119.26 116.98 1fb1 h ALA 99 Ca -0.00 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 54.72 1fb1 h ALA 99 Cb 0.56 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 1fb1 h ALA 99 CO 0.02 -0.59 -0.25 1.03 0.00 0.00 0.00 179.25 179.46 1fb1 h SER 100 N -0.51 0.00 0.16 0.00 0.87 -1.00 -2.99 113.55 110.08 1fb1 h SER 100 Ca -0.03 0.00 -0.09 0.00 -1.23 0.00 0.00 61.79 60.44 1fb1 h SER 100 Cb 0.38 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.33 1fb1 h SER 100 CO 0.05 0.25 -0.32 0.00 -0.53 0.00 0.00 176.83 176.28 1fb1 h ALA 101 N 1.75 1.21 -0.11 6.23 0.00 -1.18 -2.70 119.26 124.46 1fb1 h ALA 101 Ca -0.00 -0.35 -0.17 0.00 0.00 0.00 0.00 54.91 54.38 1fb1 h ALA 101 Cb 0.88 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.59 1fb1 h ALA 101 CO 0.03 0.52 -0.61 1.98 0.00 0.00 0.00 179.25 181.18 1fb1 h MET 102 N 0.22 0.61 0.00 0.00 4.05 -1.31 -2.00 114.93 116.50 1fb1 h MET 102 Ca 0.03 -0.51 0.00 0.00 -0.28 0.00 0.00 59.70 58.94 1fb1 h MET 102 Cb 0.69 0.11 0.00 0.00 -0.80 0.00 0.00 31.60 31.59 1fb1 h MET 102 CO 0.05 1.13 0.00 1.96 0.23 0.00 0.00 176.91 180.28 1fb1 h GLN 103 N 0.25 0.00 0.04 0.39 4.20 -1.54 -2.75 115.11 115.71 1fb1 h GLN 103 Ca -0.04 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.66 1fb1 h GLN 103 Cb 1.25 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.03 1fb1 h GLN 103 CO 0.13 0.00 -0.02 0.35 -0.67 0.00 0.00 178.83 178.62 1fb1 h PHE 104 N 0.00 -0.05 0.00 2.96 3.57 -1.09 -3.13 116.94 119.20 1fb1 h PHE 104 Ca 0.00 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1fb1 h PHE 104 Cb 0.18 0.02 0.00 0.00 2.79 0.00 0.00 35.95 38.93 1fb1 h PHE 104 CO 0.00 -0.03 0.00 1.19 -2.23 0.00 0.00 178.31 177.24 1fb1 n PHE 105 N -2.98 0.00 -1.84 0.41 3.01 -0.80 -0.70 117.46 114.56 1fb1 n PHE 105 Ca -0.01 0.00 0.05 0.00 1.01 0.00 0.00 57.45 58.50 1fb1 n PHE 105 Cb 0.02 0.00 0.10 0.00 -0.01 0.00 0.00 39.48 39.59 1fb1 n PHE 105 CO 0.00 0.00 0.00 0.25 1.01 0.00 0.00 176.76 178.02 1fb1 n THR 106 N -0.91 1.05 0.18 4.37 -2.24 -1.06 -2.64 114.28 113.03 1fb1 n THR 106 Ca 0.00 -1.74 0.07 0.00 -2.27 0.00 0.00 64.05 60.11 1fb1 n THR 106 Cb 0.00 0.28 0.14 0.00 -2.10 0.00 0.00 70.33 68.64 1fb1 n THR 106 CO 0.00 0.00 0.00 0.07 -0.57 0.00 0.00 175.07 174.57 1fb1 h LYS 107 N 0.60 0.00 0.00 -0.78 2.10 -0.85 -3.22 116.57 114.43 1fb1 h LYS 107 Ca -0.07 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.58 1fb1 h LYS 107 Cb 1.35 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.68 1fb1 h LYS 107 CO 0.03 0.27 0.10 0.41 -2.00 0.00 0.00 179.45 178.26 1fb1 n GLY 108 N 1.05 -0.77 0.30 0.07 0.00 0.15 -2.13 105.19 103.85 1fb1 n GLY 108 Ca 0.03 0.17 -0.11 0.00 0.00 0.00 0.00 46.02 46.11 1fb1 n GLY 108 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1fb1 h TYR 109 N 0.00 -0.66 0.00 1.61 0.99 -1.61 -3.25 116.97 114.05 1fb1 h TYR 109 Ca 0.00 -0.02 0.00 0.00 2.00 0.00 0.00 58.73 60.71 1fb1 h TYR 109 Cb 0.19 0.22 0.00 0.00 1.00 0.00 0.00 36.73 38.14 1fb1 h TYR 109 CO 0.00 -0.41 0.00 0.00 -0.00 0.00 0.00 178.16 177.75 1fb1 n GLN 110 N -5.17 0.46 -4.49 4.88 10.64 -0.91 -4.69 117.38 118.10 1fb1 n GLN 110 Ca -0.09 0.00 -0.24 0.00 -1.83 0.00 0.00 57.00 54.84 1fb1 n GLN 110 Cb 0.28 -1.25 -0.17 0.00 -0.86 0.00 0.00 30.24 28.24 1fb1 n GLN 110 CO 0.00 0.00 0.00 -1.21 -1.83 0.00 0.00 177.06 174.02 1fb1 s GLU 111 N -0.13 1.61 -0.11 2.61 2.02 -1.23 -4.66 118.70 118.82 1fb1 s GLU 111 Ca 0.00 -0.37 -0.01 0.00 0.02 0.00 0.00 54.97 54.61 1fb1 s GLU 111 Cb 0.00 -1.38 -0.03 0.00 0.10 0.00 0.00 34.13 32.83 1fb1 s GLU 111 CO 0.00 -0.01 -0.08 0.99 0.02 0.00 0.00 175.26 176.18 1fb1 s THR 112 N 0.78 3.58 -1.39 3.63 2.01 -1.26 -5.00 115.64 117.99 1fb1 s THR 112 Ca -0.12 -0.49 0.00 0.00 0.31 0.00 0.00 61.69 61.38 1fb1 s THR 112 Cb -0.15 -2.51 0.00 0.00 0.01 0.00 0.00 72.50 69.85 1fb1 s THR 112 CO 0.02 0.54 0.29 2.30 -0.69 0.00 0.00 174.62 177.09 1fb1 n ILE 113 N 2.98 0.00 -0.04 1.82 -5.35 -1.26 -2.02 119.36 115.49 1fb1 n ILE 113 Ca -0.18 0.00 -0.12 0.00 -0.27 0.00 0.00 62.75 62.18 1fb1 n ILE 113 Cb 0.53 -0.24 -0.14 0.00 -1.74 0.00 0.00 39.64 38.04 1fb1 n ILE 113 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 1fb1 n SER 114 N -0.02 1.06 0.01 7.28 7.64 -1.26 -2.25 113.62 126.08 1fb1 n SER 114 Ca 0.00 0.24 0.11 0.00 1.01 0.00 0.00 58.87 60.23 1fb1 n SER 114 Cb 0.06 -0.05 0.03 0.00 -1.01 0.00 0.00 64.21 63.24 1fb1 n SER 114 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1fb1 n ASP 115 N -3.10 0.68 -0.01 6.43 10.43 -0.85 -4.27 116.55 125.86 1fb1 n ASP 115 Ca -0.26 -0.46 -0.19 0.00 2.57 0.00 0.00 54.79 56.46 1fb1 n ASP 115 Cb 1.07 0.77 -0.14 0.00 1.84 0.00 0.00 41.12 44.66 1fb1 n ASP 115 CO 0.00 0.00 0.00 0.52 -1.07 0.00 0.00 177.20 176.65 1fb1 n VAL 116 N -1.72 1.74 0.00 2.53 0.31 -1.10 -4.78 118.33 115.31 1fb1 n VAL 116 Ca 0.03 -0.68 0.00 0.00 -0.01 0.00 0.00 64.34 63.68 1fb1 n VAL 116 Cb 0.38 -1.58 0.00 0.00 -0.91 0.00 0.00 33.84 31.73 1fb1 n VAL 116 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 1fb1 n LEU 117 N -3.39 0.00 -1.18 7.52 4.32 -0.95 -4.97 117.00 118.35 1fb1 n LEU 117 Ca -0.30 0.00 0.15 0.00 -0.02 0.00 0.00 56.01 55.84 1fb1 n LEU 117 Cb 1.05 0.00 -0.06 0.00 -1.62 0.00 0.00 43.42 42.79 1fb1 n LEU 117 CO 0.43 0.00 -0.37 -3.20 -1.22 0.00 0.00 177.39 173.02 1fb1 n ASN 118 N 0.00 -7.09 -4.21 -1.43 5.15 -1.26 -4.78 115.26 101.64 1fb1 n ASN 118 Ca 0.00 0.84 -0.36 0.00 -0.60 0.00 0.00 54.58 54.46 1fb1 n ASN 118 Cb 0.00 -3.81 -0.04 0.00 -0.53 0.00 0.00 39.78 35.39 1fb1 n ASN 118 CO 0.00 0.00 0.00 0.47 1.40 0.00 0.00 177.26 179.13 1fb1 n ASP 119 N -3.98 -2.72 -2.52 1.20 10.43 -1.26 -4.79 116.55 112.91 1fb1 n ASP 119 Ca -0.03 -0.99 -0.24 0.00 2.57 0.00 0.00 54.79 56.10 1fb1 n ASP 119 Cb 0.55 -2.27 -0.10 0.00 1.84 0.00 0.00 41.12 41.14 1fb1 n ASP 119 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1fb1 n ALA 120 N -4.11 6.64 -0.66 2.24 0.00 -1.26 -3.83 120.51 119.52 1fb1 n ALA 120 Ca 0.09 -2.71 -0.26 0.00 0.00 0.00 0.00 53.44 50.56 1fb1 n ALA 120 Cb 0.48 -2.49 -0.03 0.00 0.00 0.00 0.00 19.45 17.41 1fb1 n ALA 120 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1fb1 n ILE 121 N 2.11 0.09 -1.84 0.00 5.41 -1.25 -4.64 119.36 119.23 1fb1 n ILE 121 Ca 0.53 -0.02 -0.37 0.00 1.00 0.00 0.00 62.75 63.88 1fb1 n ILE 121 Cb 0.63 0.00 -0.02 0.00 -0.71 0.00 0.00 39.64 39.54 1fb1 n ILE 121 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 176.55 176.88 1fb1 n PHE 122 N 0.60 2.34 0.10 1.39 7.35 -1.26 -1.83 117.46 126.15 1fb1 n PHE 122 Ca 0.09 -2.64 -0.11 0.00 -0.76 0.00 0.00 57.45 54.03 1fb1 n PHE 122 Cb 0.04 -1.77 -0.07 0.00 0.35 0.00 0.00 39.48 38.03 1fb1 n PHE 122 CO 0.00 0.00 0.00 0.22 -0.76 0.00 0.00 176.76 176.22 1fb1 h ASP 123 N 4.27 -0.27 0.00 -2.13 3.58 -1.84 -3.47 116.42 116.56 1fb1 h ASP 123 Ca 0.64 -0.25 0.00 0.00 0.42 0.00 0.00 57.03 57.84 1fb1 h ASP 123 Cb 0.41 0.07 0.00 0.00 1.72 0.00 0.00 39.33 41.53 1fb1 h ASP 123 CO 1.35 0.21 0.00 1.21 -2.88 0.00 0.00 179.24 179.12 1fb1 n GLU 124 N -5.02 0.00 -0.55 0.28 2.13 -1.26 -4.74 120.64 111.49 1fb1 n GLU 124 Ca -0.08 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.74 1fb1 n GLU 124 Cb 0.26 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.97 1fb1 n GLU 124 CO 0.00 0.00 0.00 -3.47 -0.41 0.00 0.00 177.13 173.25 1fb1 n ASP 125 N 3.16 -0.23 0.01 4.31 4.64 -1.26 -2.66 116.55 124.52 1fb1 n ASP 125 Ca 0.00 -0.43 0.00 0.00 -1.38 0.00 0.00 54.79 52.98 1fb1 n ASP 125 Cb 0.00 0.00 0.00 0.00 -1.04 0.00 0.00 41.12 40.08 1fb1 n ASP 125 CO 0.00 0.00 0.00 1.57 -0.82 0.00 0.00 177.20 177.95 1fb1 n HIS 126 N 2.39 -0.57 -1.14 -0.67 -0.00 -1.26 -5.02 115.22 108.94 1fb1 n HIS 126 Ca 0.00 0.03 0.00 0.00 0.46 0.00 0.00 57.72 58.21 1fb1 n HIS 126 Cb 0.06 0.53 0.00 0.00 -0.12 0.00 0.00 29.99 30.46 1fb1 n HIS 126 CO 0.00 0.00 0.00 -0.40 0.46 0.00 0.00 176.34 176.40 1fb1 n ASP 127 N -2.54 -0.19 -4.33 0.26 5.68 -1.09 -4.85 116.55 109.49 1fb1 n ASP 127 Ca 0.00 0.10 -0.32 0.00 -0.50 0.00 0.00 54.79 54.06 1fb1 n ASP 127 Cb 0.00 -0.51 -0.15 0.00 -1.14 0.00 0.00 41.12 39.32 1fb1 n ASP 127 CO 0.00 0.00 0.00 -1.61 -1.33 0.00 0.00 177.20 174.26 1fb1 s GLU 128 N -2.24 3.04 0.13 0.11 0.41 -1.26 -4.77 118.70 114.12 1fb1 s GLU 128 Ca 0.00 -0.78 -0.25 0.00 -0.41 0.00 0.00 54.97 53.54 1fb1 s GLU 128 Cb 0.00 -2.43 -0.14 0.00 -1.78 0.00 0.00 34.13 29.78 1fb1 s GLU 128 CO 0.00 0.29 0.51 -0.12 -0.49 0.00 0.00 175.26 175.45 1fb1 n MET 129 N 3.26 0.00 -4.49 1.61 0.00 -1.26 -4.46 117.12 111.78 1fb1 n MET 129 Ca -0.18 0.00 -0.27 0.00 0.00 0.00 0.00 57.70 57.25 1fb1 n MET 129 Cb 0.53 -0.90 -0.17 0.00 0.00 0.00 0.00 33.22 32.68 1fb1 n MET 129 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 175.97 176.05 1fb1 s VAL 130 N -0.67 1.30 -0.08 1.12 1.01 -0.22 -5.00 120.40 117.87 1fb1 s VAL 130 Ca 0.57 -0.55 0.04 0.00 0.00 0.00 0.00 61.98 62.04 1fb1 s VAL 130 Cb -0.81 -1.20 0.00 0.00 0.00 0.00 0.00 36.38 34.37 1fb1 s VAL 130 CO 0.46 0.40 -0.21 -0.63 0.00 0.00 0.00 175.10 175.12 1fb1 s ILE 131 N 0.89 1.78 -0.43 2.22 1.01 -1.26 -1.55 121.20 123.86 1fb1 s ILE 131 Ca -0.10 -0.87 0.03 0.00 0.00 0.00 0.00 60.65 59.71 1fb1 s ILE 131 Cb -0.15 -1.55 0.12 0.00 0.01 0.00 0.00 42.46 40.89 1fb1 s ILE 131 CO 0.01 0.50 0.18 -0.69 0.00 0.00 0.00 174.94 174.94 1fb1 s VAL 132 N 0.32 1.98 0.72 2.92 1.01 0.34 -5.00 120.40 122.69 1fb1 s VAL 132 Ca -0.14 -2.65 0.01 0.00 0.00 0.00 0.00 61.98 59.19 1fb1 s VAL 132 Cb -0.16 -2.41 0.13 0.00 0.00 0.00 0.00 36.38 33.94 1fb1 s VAL 132 CO 0.06 -0.76 0.99 -1.59 0.00 0.00 0.00 175.10 173.80 1fb1 s LYS 133 N 0.40 1.67 -1.76 2.72 -2.85 -1.26 -1.24 119.74 117.42 1fb1 s LYS 133 Ca 0.15 -1.25 -0.19 0.00 -1.00 0.00 0.00 55.97 53.68 1fb1 s LYS 133 Cb -0.23 -2.37 0.18 0.00 -2.06 0.00 0.00 37.83 33.35 1fb1 s LYS 133 CO -0.05 -1.44 0.66 -0.25 0.10 0.00 0.00 175.35 174.38 1fb1 n ASP 134 N -2.79 -2.42 -4.63 0.03 8.00 -1.25 -4.89 116.55 108.59 1fb1 n ASP 134 Ca 0.16 -1.11 -0.43 0.00 0.71 0.00 0.00 54.79 54.12 1fb1 n ASP 134 Cb 0.61 -2.28 -0.02 0.00 -0.02 0.00 0.00 41.12 39.41 1fb1 n ASP 134 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1fb1 s ILE 135 N -3.36 4.48 0.05 0.53 1.01 -0.71 -4.84 121.20 118.37 1fb1 s ILE 135 Ca 0.71 1.66 -0.31 0.00 0.00 0.00 0.00 60.65 62.71 1fb1 s ILE 135 Cb -0.40 -4.44 -0.08 0.00 0.01 0.00 0.00 42.46 37.56 1fb1 s ILE 135 CO 0.97 -0.54 1.60 -1.81 0.00 0.00 0.00 174.94 175.15 1fb1 s ASP 136 N 1.76 6.66 -0.01 3.58 1.01 -1.26 0.81 116.67 129.22 1fb1 s ASP 136 Ca 0.45 2.40 0.02 0.00 0.71 0.00 0.00 52.55 56.14 1fb1 s ASP 136 Cb -0.12 -2.56 -0.00 0.00 1.01 0.00 0.00 42.92 41.25 1fb1 s ASP 136 CO 0.17 -0.85 -0.08 -0.32 0.21 0.00 0.00 175.17 174.31 1fb1 s MET 137 N 2.58 0.68 -0.05 8.23 -2.45 -0.57 -4.89 119.30 122.82 1fb1 s MET 137 Ca 0.72 -0.27 -0.01 0.00 -1.25 0.00 0.00 55.69 54.87 1fb1 s MET 137 Cb -0.38 -0.65 0.03 0.00 1.25 0.00 0.00 34.83 35.08 1fb1 s MET 137 CO 0.31 0.14 0.03 -0.59 1.05 0.00 0.00 175.02 175.96 1fb1 s PHE 138 N -0.06 0.35 0.28 4.11 -0.12 -1.26 0.98 117.98 122.26 1fb1 s PHE 138 Ca 0.01 0.05 0.02 0.00 -0.05 0.00 0.00 56.93 56.96 1fb1 s PHE 138 Cb -0.04 -0.60 -0.01 0.00 -0.63 0.00 0.00 43.02 41.74 1fb1 s PHE 138 CO -0.00 -0.24 0.06 0.45 -0.05 0.00 0.00 175.22 175.44 1fb1 n SER 139 N 5.07 1.75 -4.29 1.98 2.88 -0.77 -4.54 113.62 115.71 1fb1 n SER 139 Ca -0.08 -2.40 -0.31 0.00 -1.33 0.00 0.00 58.87 54.74 1fb1 n SER 139 Cb 0.50 0.51 -0.16 0.00 -0.75 0.00 0.00 64.21 64.31 1fb1 n SER 139 CO 0.00 0.00 0.00 -0.04 -1.23 0.00 0.00 175.04 173.77 1fb1 s MET 140 N -3.06 2.36 -0.49 -1.46 -1.94 -1.24 -1.80 119.30 111.66 1fb1 s MET 140 Ca 0.09 -0.91 -0.29 0.00 -1.71 0.00 0.00 55.69 52.86 1fb1 s MET 140 Cb 0.00 -2.11 0.03 0.00 2.01 0.00 0.00 34.83 34.76 1fb1 s MET 140 CO 0.06 0.46 1.14 0.00 -0.01 0.00 0.00 175.02 176.68 1fb1 n GLU 142 N 7.93 0.04 0.09 0.00 0.28 -1.00 0.30 120.64 128.29 1fb1 n GLU 142 Ca 0.11 0.45 -0.23 0.00 -0.16 0.00 0.00 57.16 57.34 1fb1 n GLU 142 Cb 0.49 -1.61 -0.15 0.00 1.43 0.00 0.00 31.44 31.59 1fb1 n GLU 142 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 1fb1 h HIS 143 N 0.00 0.78 0.00 -1.84 3.86 -1.89 -3.40 115.15 112.66 1fb1 h HIS 143 Ca 0.00 -0.57 0.00 0.00 -1.16 0.00 0.00 60.37 58.64 1fb1 h HIS 143 Cb 0.10 -0.03 0.00 0.00 1.06 0.00 0.00 27.41 28.54 1fb1 h HIS 143 CO 0.00 1.62 0.00 0.72 0.86 0.00 0.00 177.93 181.13 1fb1 n HIS 144 N -3.62 0.00 -3.75 2.45 8.25 -0.69 -5.01 115.22 112.84 1fb1 n HIS 144 Ca -0.22 -0.12 -0.26 0.00 -0.26 0.00 0.00 57.72 56.86 1fb1 n HIS 144 Cb 1.08 -0.01 0.05 0.00 1.12 0.00 0.00 29.99 32.23 1fb1 n HIS 144 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1fb1 n LEU 145 N -0.12 -3.00 -4.33 2.41 4.77 0.86 -4.96 117.00 112.64 1fb1 n LEU 145 Ca 0.00 -0.71 -0.32 0.00 -0.03 0.00 0.00 56.01 54.95 1fb1 n LEU 145 Cb 0.19 -2.75 -0.16 0.00 -2.33 0.00 0.00 43.42 38.38 1fb1 n LEU 145 CO 0.00 0.50 -0.54 -0.69 -1.33 0.00 0.00 177.39 175.33 1fb1 s VAL 146 N -3.38 2.27 0.71 4.08 1.01 -1.22 -4.82 120.40 119.05 1fb1 s VAL 146 Ca 0.46 -1.01 -0.10 0.00 0.00 0.00 0.00 61.98 61.32 1fb1 s VAL 146 Cb -0.22 -1.82 0.16 0.00 0.00 0.00 0.00 36.38 34.50 1fb1 s VAL 146 CO 0.79 0.58 0.37 -2.65 0.00 0.00 0.00 175.10 174.19 1fb1 n PRO 147 N 2.58 -2.07 0.00 2.72 -0.02 -1.26 0.45 135.00 137.40 1fb1 n PRO 147 Ca -0.17 -0.62 0.00 0.00 -2.02 0.00 0.00 63.50 60.70 1fb1 n PRO 147 Cb 0.52 -0.98 0.00 0.00 -0.02 0.00 0.00 33.50 33.01 1fb1 n PRO 147 CO 0.00 0.00 0.00 1.97 1.98 0.00 0.00 175.50 179.45 1fb1 n PHE 148 N -4.09 0.00 -3.59 6.00 1.16 -0.74 -3.24 117.46 112.95 1fb1 n PHE 148 Ca 0.06 0.00 -0.27 0.00 -1.87 0.00 0.00 57.45 55.37 1fb1 n PHE 148 Cb 0.25 0.00 -0.03 0.00 -1.61 0.00 0.00 39.48 38.10 1fb1 n PHE 148 CO 0.00 0.00 0.00 0.14 -1.87 0.00 0.00 176.76 175.03 1fb1 s VAL 149 N 0.00 5.16 0.00 1.97 -7.23 -1.24 -1.85 120.40 117.21 1fb1 s VAL 149 Ca 0.00 -0.31 0.00 0.00 -1.81 0.00 0.00 61.98 59.86 1fb1 s VAL 149 Cb 0.00 -3.75 0.00 0.00 0.56 0.00 0.00 36.38 33.19 1fb1 s VAL 149 CO 0.00 -0.26 0.00 0.61 -0.31 0.00 0.00 175.10 175.14 1fb1 n GLY 150 N -0.88 1.81 3.02 2.32 0.00 0.28 -1.91 105.19 109.82 1fb1 n GLY 150 Ca -0.04 -0.24 -0.13 0.00 0.00 0.00 0.00 46.02 45.61 1fb1 n GLY 150 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fb1 s LYS 151 N 2.77 0.17 -0.16 1.61 1.02 0.80 -1.51 119.74 124.45 1fb1 s LYS 151 Ca 0.00 0.24 -0.01 0.00 0.02 0.00 0.00 55.97 56.22 1fb1 s LYS 151 Cb 0.00 0.05 -0.01 0.00 -0.52 0.00 0.00 37.83 37.35 1fb1 s LYS 151 CO 0.00 -0.04 -0.12 0.08 -0.92 0.00 0.00 175.35 174.34 1fb1 s VAL 152 N 0.25 2.98 -0.11 3.17 1.01 0.24 -1.53 120.40 126.41 1fb1 s VAL 152 Ca -0.01 -0.67 0.00 0.00 0.00 0.00 0.00 61.98 61.30 1fb1 s VAL 152 Cb -0.03 -2.27 -0.02 0.00 0.00 0.00 0.00 36.38 34.06 1fb1 s VAL 152 CO -0.01 0.50 -0.12 -1.00 0.00 0.00 0.00 175.10 174.48 1fb1 s HIS 153 N 0.72 2.82 -0.06 5.22 0.09 -0.26 -1.74 115.29 122.09 1fb1 s HIS 153 Ca -0.06 -0.48 0.04 0.00 -0.00 0.00 0.00 55.06 54.57 1fb1 s HIS 153 Cb -0.15 -1.81 -0.00 0.00 -0.00 0.00 0.00 32.58 30.62 1fb1 s HIS 153 CO 0.02 -0.09 -0.19 0.42 -0.00 0.00 0.00 174.74 174.90 1fb1 s ILE 154 N 0.09 1.60 -0.02 0.60 1.01 -0.38 -1.94 121.20 122.17 1fb1 s ILE 154 Ca -0.05 -0.79 0.02 0.00 0.00 0.00 0.00 60.65 59.83 1fb1 s ILE 154 Cb -0.15 -1.38 0.00 0.00 0.01 0.00 0.00 42.46 40.94 1fb1 s ILE 154 CO 0.04 0.46 -0.08 -0.83 0.00 0.00 0.00 174.94 174.53 1fb1 s GLY 155 N 0.16 0.47 0.14 6.18 0.00 0.37 -0.50 107.32 114.12 1fb1 s GLY 155 Ca -0.08 -0.31 -0.10 0.00 0.00 0.00 0.00 44.72 44.22 1fb1 s GLY 155 CO 0.04 -0.13 0.29 -2.52 0.00 0.00 0.00 173.10 170.78 1fb1 s TYR 156 N 0.10 0.21 -0.32 1.90 -0.85 -0.60 0.25 117.35 118.04 1fb1 s TYR 156 Ca -0.01 -0.59 -0.07 0.00 -0.52 0.00 0.00 57.07 55.89 1fb1 s TYR 156 Cb -0.07 0.01 0.03 0.00 0.38 0.00 0.00 41.96 42.31 1fb1 s TYR 156 CO 0.00 -0.68 0.09 -0.51 -1.52 0.00 0.00 175.55 172.94 1fb1 s LEU 157 N -2.91 4.08 0.82 -3.49 1.43 -1.20 -1.06 118.68 116.37 1fb1 s LEU 157 Ca 0.11 -0.94 -0.12 0.00 -1.03 0.00 0.00 54.13 52.15 1fb1 s LEU 157 Cb 0.03 -1.87 0.09 0.00 0.03 0.00 0.00 46.19 44.47 1fb1 s LEU 157 CO -0.05 -0.26 1.18 -2.84 0.23 0.00 0.00 176.35 174.60 1fb1 s PRO 158 N 1.45 1.59 0.00 1.29 0.02 -1.26 -2.21 135.00 135.88 1fb1 s PRO 158 Ca 0.00 1.65 0.00 0.00 0.02 0.00 0.00 61.00 62.67 1fb1 s PRO 158 Cb -0.18 -1.78 0.00 0.00 0.02 0.00 0.00 34.50 32.55 1fb1 s PRO 158 CO 0.02 -2.23 0.00 -1.71 -0.33 0.00 0.00 177.00 172.76 1fb1 n ASN 159 N -3.49 0.00 -0.47 2.53 5.15 -1.26 -4.20 115.26 113.52 1fb1 n ASN 159 Ca 0.13 0.00 0.05 0.00 -0.60 0.00 0.00 54.58 54.16 1fb1 n ASN 159 Cb 0.51 0.00 0.08 0.00 -0.53 0.00 0.00 39.78 39.84 1fb1 n ASN 159 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 1fb1 n LYS 160 N -0.25 1.37 -3.70 1.20 5.02 -1.26 -4.52 118.16 116.02 1fb1 n LYS 160 Ca 0.00 -1.45 -0.14 0.00 -2.02 0.00 0.00 58.31 54.70 1fb1 n LYS 160 Cb 0.00 -1.21 -0.09 0.00 -0.02 0.00 0.00 35.03 33.71 1fb1 n LYS 160 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 1fb1 s GLN 161 N -0.90 0.63 -0.20 1.97 -0.21 -1.26 -4.02 119.66 115.68 1fb1 s GLN 161 Ca 0.15 0.50 -0.01 0.00 0.02 0.00 0.00 55.36 56.02 1fb1 s GLN 161 Cb 0.09 0.30 0.05 0.00 1.00 0.00 0.00 33.01 34.46 1fb1 s GLN 161 CO 0.13 -0.11 -0.02 0.08 -2.12 0.00 0.00 175.29 173.25 1fb1 s VAL 162 N -0.14 1.01 0.39 1.09 1.01 -0.76 -4.68 120.40 118.32 1fb1 s VAL 162 Ca -0.03 -0.78 -0.26 0.00 0.00 0.00 0.00 61.98 60.91 1fb1 s VAL 162 Cb -0.03 -1.34 -0.09 0.00 0.00 0.00 0.00 36.38 34.92 1fb1 s VAL 162 CO 0.02 -0.07 1.20 -0.22 0.00 0.00 0.00 175.10 176.03 1fb1 s LEU 163 N 1.65 4.22 0.21 3.92 2.96 -1.26 -3.88 118.68 126.49 1fb1 s LEU 163 Ca -0.02 2.41 -0.30 0.00 -0.22 0.00 0.00 54.13 56.00 1fb1 s LEU 163 Cb -0.17 -3.97 -0.09 0.00 0.50 0.00 0.00 46.19 42.45 1fb1 s LEU 163 CO -0.07 -0.69 1.43 -0.83 -1.32 0.00 0.00 176.35 174.87 1fb1 s GLY 164 N -1.03 2.17 0.25 7.98 0.00 -1.25 -4.91 107.32 110.54 1fb1 s GLY 164 Ca 0.56 1.26 -0.03 0.00 0.00 0.00 0.00 44.72 46.51 1fb1 s GLY 164 CO 0.41 2.31 1.71 1.41 0.00 0.00 0.00 173.10 178.94 1fb1 h LEU 165 N 5.63 0.22 -0.73 0.66 4.07 -1.96 0.08 115.31 123.29 1fb1 h LEU 165 Ca -0.45 0.12 0.16 0.00 0.08 0.00 0.00 57.88 57.80 1fb1 h LEU 165 Cb 1.21 0.12 -0.12 0.00 1.08 0.00 0.00 40.66 42.96 1fb1 h LEU 165 CO 0.81 0.06 0.12 0.28 -1.08 0.00 0.00 178.44 178.63 1fb1 h SER 166 N 0.40 -0.10 0.30 -0.43 0.02 -2.02 0.62 113.55 112.34 1fb1 h SER 166 Ca 0.43 0.16 -0.03 0.00 -0.84 0.00 0.00 61.79 61.52 1fb1 h SER 166 Cb 0.70 0.24 -0.00 0.00 0.14 0.00 0.00 62.40 63.48 1fb1 h SER 166 CO -0.45 -0.09 -0.13 0.11 -1.14 0.00 0.00 176.83 175.14 1fb1 h LYS 167 N 0.21 0.00 -0.32 3.45 1.79 -1.35 -2.76 116.57 117.59 1fb1 h LYS 167 Ca 0.41 0.00 -0.09 0.00 -2.18 0.00 0.00 60.65 58.79 1fb1 h LYS 167 Cb 0.72 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.35 1fb1 h LYS 167 CO -0.55 0.13 -0.20 -0.07 -1.08 0.00 0.00 179.45 177.68 1fb1 h LEU 168 N 0.00 0.59 -0.26 2.94 3.38 -0.74 -2.78 115.31 118.44 1fb1 h LEU 168 Ca -0.00 -0.19 -0.20 0.00 0.09 0.00 0.00 57.88 57.58 1fb1 h LEU 168 Cb 0.32 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.91 1fb1 h LEU 168 CO 0.02 0.79 -0.65 0.00 0.09 0.00 0.00 178.44 178.69 1fb1 h ALA 169 N 1.26 0.42 -0.01 1.53 0.00 -1.45 -3.04 119.26 117.97 1fb1 h ALA 169 Ca 0.08 -0.55 -0.01 0.00 0.00 0.00 0.00 54.91 54.43 1fb1 h ALA 169 Cb 0.63 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.37 1fb1 h ALA 169 CO 0.04 0.69 -0.04 -0.09 0.00 0.00 0.00 179.25 179.85 1fb1 h ARG 170 N 0.60 0.02 -0.16 0.00 9.65 -1.51 -2.12 114.38 120.85 1fb1 h ARG 170 Ca -0.01 -0.00 -0.21 0.00 -1.10 0.00 0.00 59.98 58.66 1fb1 h ARG 170 Cb 1.26 -0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.84 1fb1 h ARG 170 CO 0.14 0.06 -0.72 0.82 2.80 0.00 0.00 179.97 183.07 1fb1 h ILE 171 N 0.02 1.30 -0.10 1.20 2.04 -1.39 -2.96 117.51 117.62 1fb1 h ILE 171 Ca 0.00 -1.96 -0.03 0.00 1.00 0.00 0.00 64.86 63.87 1fb1 h ILE 171 Cb 0.08 1.94 -0.01 0.00 -0.74 0.00 0.00 36.82 38.10 1fb1 h ILE 171 CO 0.01 0.62 -0.08 0.58 0.00 0.00 0.00 178.15 179.27 1fb1 h VAL 172 N 0.50 1.12 -0.31 1.67 2.07 -1.31 -3.03 116.25 116.96 1fb1 h VAL 172 Ca -0.03 -0.53 -0.11 0.00 0.82 0.00 0.00 66.70 66.85 1fb1 h VAL 172 Cb 1.33 1.14 -0.01 0.00 -1.52 0.00 0.00 31.29 32.24 1fb1 h VAL 172 CO 0.14 0.17 -0.22 -0.08 0.02 0.00 0.00 177.57 177.60 1fb1 h GLU 173 N 0.14 0.70 -0.77 1.57 4.81 -1.42 -0.12 114.58 119.50 1fb1 h GLU 173 Ca 0.03 -0.34 0.18 0.00 -0.13 0.00 0.00 59.36 59.11 1fb1 h GLU 173 Cb 0.25 -0.00 -0.05 0.00 0.63 0.00 0.00 28.75 29.58 1fb1 h GLU 173 CO 0.01 0.95 0.53 0.82 -0.73 0.00 0.00 179.01 180.59 1fb1 h ILE 174 N 0.46 0.71 0.00 2.32 2.04 -1.39 -1.10 117.51 120.55 1fb1 h ILE 174 Ca 0.06 -0.09 -0.18 0.00 1.00 0.00 0.00 64.86 65.65 1fb1 h ILE 174 Cb 0.78 0.43 -0.03 0.00 -0.74 0.00 0.00 36.82 37.26 1fb1 h ILE 174 CO 0.06 0.05 -2.00 -1.22 0.00 0.00 0.00 178.15 175.03 1fb1 n TYR 175 N -4.43 0.00 0.25 1.37 4.02 -1.22 -4.36 117.16 112.80 1fb1 n TYR 175 Ca 0.15 0.00 0.14 0.00 -0.01 0.00 0.00 57.90 58.18 1fb1 n TYR 175 Cb 0.66 -0.65 0.59 0.00 -0.02 0.00 0.00 39.34 39.92 1fb1 n TYR 175 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 176.86 176.88 1fb1 h SER 176 N 0.00 0.00 -2.98 7.72 0.87 -0.65 -3.33 113.55 115.19 1fb1 h SER 176 Ca -0.27 0.00 -0.76 0.00 -1.23 0.00 0.00 61.79 59.53 1fb1 h SER 176 Cb 1.54 0.00 -0.31 0.00 -0.44 0.00 0.00 62.40 63.19 1fb1 h SER 176 CO 0.01 0.10 0.37 0.54 -0.53 0.00 0.00 176.83 177.32 1fb1 n ARG 177 N -3.24 3.71 -3.83 2.24 3.00 -0.45 -3.90 116.66 114.20 1fb1 n ARG 177 Ca 0.00 -4.55 -0.07 0.00 -0.01 0.00 0.00 57.85 53.23 1fb1 n ARG 177 Cb 0.36 -2.46 0.01 0.00 0.00 0.00 0.00 32.46 30.36 1fb1 n ARG 177 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.63 178.66 1fb1 s ARG 178 N -2.26 1.84 -0.50 5.56 0.52 -1.08 0.30 118.95 123.34 1fb1 s ARG 178 Ca 0.32 -1.13 -0.26 0.00 -0.52 0.00 0.00 55.73 54.14 1fb1 s ARG 178 Cb 0.02 0.55 0.03 0.00 0.52 0.00 0.00 34.95 36.07 1fb1 s ARG 178 CO 0.02 -0.86 0.99 -0.51 0.02 0.00 0.00 175.30 174.96 1fb1 s LEU 179 N -3.07 3.91 0.50 2.53 1.43 -1.26 -3.72 118.68 119.00 1fb1 s LEU 179 Ca 0.15 0.05 0.01 0.00 -1.03 0.00 0.00 54.13 53.31 1fb1 s LEU 179 Cb -0.04 -3.16 -0.01 0.00 0.03 0.00 0.00 46.19 43.01 1fb1 s LEU 179 CO 0.08 -1.17 0.04 -1.10 0.23 0.00 0.00 176.35 174.43 1fb1 s GLN 180 N 4.03 2.17 -0.08 1.70 -1.52 -0.52 -4.70 119.66 120.75 1fb1 s GLN 180 Ca 0.38 -2.40 0.00 0.00 -1.95 0.00 0.00 55.36 51.39 1fb1 s GLN 180 Cb -0.10 -1.28 0.02 0.00 -0.22 0.00 0.00 33.01 31.43 1fb1 s GLN 180 CO 0.25 -0.44 -0.05 0.08 -0.25 0.00 0.00 175.29 174.88 1fb1 s VAL 181 N -2.97 0.72 0.18 1.09 1.01 -1.26 -2.36 120.40 116.80 1fb1 s VAL 181 Ca 0.06 -0.15 -0.19 0.00 0.00 0.00 0.00 61.98 61.70 1fb1 s VAL 181 Cb 0.01 -0.76 0.11 0.00 0.00 0.00 0.00 36.38 35.74 1fb1 s VAL 181 CO 0.04 0.30 1.62 -0.61 0.00 0.00 0.00 175.10 176.45 1fb1 h GLN 182 N 7.78 -0.13 -1.05 2.72 4.15 -1.99 0.49 115.11 127.09 1fb1 h GLN 182 Ca -0.29 0.01 0.27 0.00 0.77 0.00 0.00 58.65 59.41 1fb1 h GLN 182 Cb 1.14 0.03 -0.09 0.00 0.21 0.00 0.00 27.48 28.77 1fb1 h GLN 182 CO 0.39 -0.09 0.68 0.93 -1.93 0.00 0.00 178.83 178.81 1fb1 h GLU 183 N -0.13 0.36 0.01 1.69 3.07 -1.98 -3.00 114.58 114.59 1fb1 h GLU 183 Ca 0.21 -0.02 -0.00 0.00 -0.50 0.00 0.00 59.36 59.05 1fb1 h GLU 183 Cb 0.46 -0.08 0.00 0.00 -0.84 0.00 0.00 28.75 28.29 1fb1 h GLU 183 CO -0.53 0.24 -0.00 -0.09 -1.40 0.00 0.00 179.01 177.23 1fb1 h ARG 184 N 0.37 -0.01 -1.07 2.33 2.43 -0.63 -3.34 114.38 114.46 1fb1 h ARG 184 Ca 0.59 0.00 0.31 0.00 -0.81 0.00 0.00 59.98 60.07 1fb1 h ARG 184 Cb 1.55 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 31.06 1fb1 h ARG 184 CO -0.28 -0.01 1.09 -0.11 -1.51 0.00 0.00 179.97 179.16 1fb1 n LEU 185 N -4.38 0.00 0.00 3.80 0.00 0.83 -1.33 117.00 115.92 1fb1 n LEU 185 Ca -0.00 0.70 0.00 0.00 0.00 0.00 0.00 56.01 56.71 1fb1 n LEU 185 Cb 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 43.42 43.16 1fb1 n LEU 185 CO 0.00 -0.70 0.08 0.41 0.00 0.00 0.00 177.39 177.19 1fb1 n THR 186 N -3.11 0.00 -0.14 1.96 -1.04 -1.16 -3.17 114.28 107.61 1fb1 n THR 186 Ca 0.24 0.35 0.05 0.00 -2.04 0.00 0.00 64.05 62.65 1fb1 n THR 186 Cb 1.42 -0.73 0.11 0.00 -1.82 0.00 0.00 70.33 69.30 1fb1 n THR 186 CO 0.00 0.00 0.00 1.17 -0.64 0.00 0.00 175.07 175.60 1fb1 n LYS 187 N -0.71 -0.03 0.11 -2.82 4.81 -0.44 0.12 118.16 119.20 1fb1 n LYS 187 Ca 0.00 0.61 -0.13 0.00 -0.87 0.00 0.00 58.31 57.92 1fb1 n LYS 187 Cb 0.00 -0.96 -0.08 0.00 0.02 0.00 0.00 35.03 34.01 1fb1 n LYS 187 CO 0.00 0.00 0.00 1.96 1.17 0.00 0.00 177.40 180.53 1fb1 h GLN 188 N 0.00 -0.20 -0.97 1.64 4.20 -1.68 0.25 115.11 118.35 1fb1 h GLN 188 Ca 0.24 0.01 0.03 0.00 0.06 0.00 0.00 58.65 58.99 1fb1 h GLN 188 Cb 0.46 0.05 -0.05 0.00 0.30 0.00 0.00 27.48 28.23 1fb1 h GLN 188 CO -0.39 -0.09 0.64 0.82 -0.67 0.00 0.00 178.83 179.14 1fb1 h ILE 189 N -0.26 1.19 -0.44 2.54 2.04 1.00 0.63 117.51 124.21 1fb1 h ILE 189 Ca -0.02 -0.43 -0.13 0.00 1.00 0.00 0.00 64.86 65.28 1fb1 h ILE 189 Cb 0.21 -0.17 -0.01 0.00 -0.74 0.00 0.00 36.82 36.10 1fb1 h ILE 189 CO 0.03 0.23 -0.24 0.00 0.00 0.00 0.00 178.15 178.18 1fb1 h ALA 190 N 1.39 0.62 0.36 1.87 0.00 -1.18 -3.27 119.26 119.05 1fb1 h ALA 190 Ca 0.38 -0.40 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1fb1 h ALA 190 Cb -0.05 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.60 1fb1 h ALA 190 CO -0.11 0.62 -0.19 0.28 0.00 0.00 0.00 179.25 179.85 1fb1 h VAL 191 N 0.78 0.00 -0.94 0.00 2.07 0.41 -2.73 116.25 115.83 1fb1 h VAL 191 Ca 0.10 0.00 0.36 0.00 0.82 0.00 0.00 66.70 67.98 1fb1 h VAL 191 Cb 0.82 0.00 -0.14 0.00 -1.52 0.00 0.00 31.29 30.45 1fb1 h VAL 191 CO 0.07 0.00 0.55 0.00 0.02 0.00 0.00 177.57 178.21 1fb1 n ALA 192 N -2.30 0.95 0.05 1.67 0.00 0.13 0.18 120.51 121.20 1fb1 n ALA 192 Ca -0.06 0.79 -0.05 0.00 0.00 0.00 0.00 53.44 54.12 1fb1 n ALA 192 Cb 0.20 -0.85 0.15 0.00 0.00 0.00 0.00 19.45 18.95 1fb1 n ALA 192 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1fb1 h ILE 193 N 0.00 1.33 0.00 0.00 2.04 -1.54 0.21 117.51 119.55 1fb1 h ILE 193 Ca 0.71 -1.67 -0.05 0.00 1.00 0.00 0.00 64.86 64.85 1fb1 h ILE 193 Cb 2.04 1.73 -0.01 0.00 -0.74 0.00 0.00 36.82 39.84 1fb1 h ILE 193 CO -0.54 0.51 -0.22 0.74 0.00 0.00 0.00 178.15 178.64 1fb1 h THR 194 N 0.29 0.44 0.08 -0.27 2.02 0.21 -2.66 112.91 113.02 1fb1 h THR 194 Ca 0.02 -1.31 -0.33 0.00 0.77 0.00 0.00 66.41 65.55 1fb1 h THR 194 Cb 0.94 1.96 -0.03 0.00 -1.74 0.00 0.00 68.15 69.28 1fb1 h THR 194 CO 0.08 0.22 -1.84 -0.33 0.37 0.00 0.00 175.52 174.02 1fb1 h GLU 195 N 0.00 0.16 -0.00 6.66 5.08 -1.26 -1.79 114.58 123.44 1fb1 h GLU 195 Ca -0.00 -0.28 0.00 0.00 -1.00 0.00 0.00 59.36 58.08 1fb1 h GLU 195 Cb 0.95 0.10 0.00 0.00 0.50 0.00 0.00 28.75 30.30 1fb1 h GLU 195 CO 0.03 0.93 -0.07 0.00 -1.00 0.00 0.00 179.01 178.90 1fb1 n ALA 196 N -2.79 2.68 -0.08 3.43 0.00 0.71 -4.23 120.51 120.22 1fb1 n ALA 196 Ca -0.24 -0.23 0.00 0.00 0.00 0.00 0.00 53.44 52.97 1fb1 n ALA 196 Cb 1.05 -1.39 0.00 0.00 0.00 0.00 0.00 19.45 19.11 1fb1 n ALA 196 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1fb1 n LEU 197 N -1.06 0.00 -3.83 0.00 4.77 -1.01 -5.02 117.00 110.86 1fb1 n LEU 197 Ca 0.15 0.00 -0.32 0.00 -0.03 0.00 0.00 56.01 55.81 1fb1 n LEU 197 Cb 0.26 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.36 1fb1 n LEU 197 CO 0.23 0.00 -0.15 0.54 -1.33 0.00 0.00 177.39 176.68 1fb1 n ARG 198 N 0.00 -1.01 -0.20 3.23 1.74 -0.67 -4.63 116.66 115.11 1fb1 n ARG 198 Ca 0.00 0.52 0.00 0.00 -0.77 0.00 0.00 57.85 57.60 1fb1 n ARG 198 Cb 0.00 -2.88 0.00 0.00 -1.02 0.00 0.00 32.46 28.56 1fb1 n ARG 198 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 1fb1 n PRO 199 N -3.66 0.28 0.00 5.56 -0.04 -1.26 -4.70 135.00 131.18 1fb1 n PRO 199 Ca -0.19 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 63.38 1fb1 n PRO 199 Cb 0.62 0.00 0.09 0.00 -0.04 0.00 0.00 33.50 34.16 1fb1 n PRO 199 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1fb1 n ALA 200 N -3.00 3.95 0.00 0.55 0.00 -0.94 -4.95 120.51 116.12 1fb1 n ALA 200 Ca 0.00 -0.45 0.00 0.00 0.00 0.00 0.00 53.44 52.99 1fb1 n ALA 200 Cb 0.00 -0.97 0.00 0.00 0.00 0.00 0.00 19.45 18.48 1fb1 n ALA 200 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1fb1 n GLY 201 N 1.48 3.80 3.98 0.00 0.00 -1.26 -0.34 105.19 112.85 1fb1 n GLY 201 Ca 0.04 -0.30 -0.20 0.00 0.00 0.00 0.00 46.02 45.56 1fb1 n GLY 201 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1fb1 s VAL 202 N -0.24 4.12 -0.31 1.61 1.01 -1.24 -3.22 120.40 122.14 1fb1 s VAL 202 Ca 0.00 -0.82 0.02 0.00 0.00 0.00 0.00 61.98 61.18 1fb1 s VAL 202 Cb 0.00 -3.46 0.15 0.00 0.00 0.00 0.00 36.38 33.07 1fb1 s VAL 202 CO 0.00 -0.23 0.39 -0.83 0.00 0.00 0.00 175.10 174.43 1fb1 s GLY 203 N -4.18 -0.39 -0.06 4.51 0.00 0.14 -1.57 107.32 105.78 1fb1 s GLY 203 Ca 0.45 -0.18 -0.00 0.00 0.00 0.00 0.00 44.72 44.99 1fb1 s GLY 203 CO 0.33 2.92 -0.01 0.14 0.00 0.00 0.00 173.10 176.48 1fb1 s VAL 204 N 2.22 4.16 -0.08 1.40 1.01 -1.08 -0.48 120.40 127.55 1fb1 s VAL 204 Ca 0.11 -0.39 -0.03 0.00 0.00 0.00 0.00 61.98 61.67 1fb1 s VAL 204 Cb -0.13 -2.77 0.04 0.00 0.00 0.00 0.00 36.38 33.52 1fb1 s VAL 204 CO -0.24 0.54 0.17 0.54 0.00 0.00 0.00 175.10 176.11 1fb1 s VAL 205 N -0.93 -0.07 0.17 2.92 0.11 -0.82 -2.25 120.40 119.54 1fb1 s VAL 205 Ca 0.15 0.19 0.11 0.00 -2.93 0.00 0.00 61.98 59.50 1fb1 s VAL 205 Cb -0.11 -0.27 -0.04 0.00 -1.53 0.00 0.00 36.38 34.42 1fb1 s VAL 205 CO 0.04 0.08 -0.24 -0.69 -3.33 0.00 0.00 175.10 170.97 1fb1 s VAL 206 N 1.29 2.41 -0.16 2.04 1.01 -0.55 -1.10 120.40 125.35 1fb1 s VAL 206 Ca -0.08 -1.89 -0.08 0.00 0.00 0.00 0.00 61.98 59.93 1fb1 s VAL 206 Cb -0.11 -2.13 0.06 0.00 0.00 0.00 0.00 36.38 34.19 1fb1 s VAL 206 CO -0.06 -0.04 0.37 -1.83 0.00 0.00 0.00 175.10 173.54 1fb1 s GLU 207 N -2.46 0.34 0.01 2.72 -1.05 -0.58 -1.69 118.70 115.99 1fb1 s GLU 207 Ca 0.19 0.75 -0.25 0.00 -0.15 0.00 0.00 54.97 55.51 1fb1 s GLU 207 Cb -0.09 -0.02 0.06 0.00 -0.44 0.00 0.00 34.13 33.63 1fb1 s GLU 207 CO 0.09 -0.17 0.56 0.00 0.95 0.00 0.00 175.26 176.69 1fb1 s ALA 208 N 1.48 -1.43 -0.36 -0.84 0.00 -1.22 -0.14 121.76 119.25 1fb1 s ALA 208 Ca -0.09 0.83 -0.13 0.00 0.00 0.00 0.00 51.96 52.57 1fb1 s ALA 208 Cb -0.09 0.22 -0.00 0.00 0.00 0.00 0.00 23.12 23.25 1fb1 s ALA 208 CO -0.12 -0.43 0.25 0.95 0.00 0.00 0.00 175.76 176.41 1fb1 s THR 209 N -1.89 5.20 0.02 0.00 -4.23 -0.80 -2.77 115.64 111.17 1fb1 s THR 209 Ca -0.08 -0.42 -0.30 0.00 -1.18 0.00 0.00 61.69 59.71 1fb1 s THR 209 Cb -0.01 -3.76 -0.04 0.00 1.34 0.00 0.00 72.50 70.03 1fb1 s THR 209 CO 0.03 -0.12 1.08 -1.00 -0.54 0.00 0.00 174.62 174.07 1fb1 s HIS 210 N 1.69 3.55 -1.79 3.99 3.76 -1.26 -3.63 115.29 121.61 1fb1 s HIS 210 Ca 0.05 1.52 0.26 0.00 -0.15 0.00 0.00 55.06 56.74 1fb1 s HIS 210 Cb -0.18 -3.26 1.48 0.00 1.11 0.00 0.00 32.58 31.73 1fb1 s HIS 210 CO 0.10 -0.59 1.91 -0.12 -0.85 0.00 0.00 174.74 175.19 1fb1 n MET 211 N 3.96 0.66 0.21 1.40 1.56 -1.20 -3.42 117.12 120.29 1fb1 n MET 211 Ca 0.07 0.02 0.12 0.00 -0.27 0.00 0.00 57.70 57.65 1fb1 n MET 211 Cb 0.49 -1.50 0.23 0.00 2.15 0.00 0.00 33.22 34.59 1fb1 n MET 211 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 1fb1 n MET 213 N -3.00 0.70 -0.25 0.00 2.00 -1.22 -3.90 117.12 111.44 1fb1 n MET 213 Ca 0.04 0.08 0.04 0.00 0.00 0.00 0.00 57.70 57.86 1fb1 n MET 213 Cb 0.50 -1.33 0.18 0.00 0.00 0.00 0.00 33.22 32.57 1fb1 n MET 213 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 175.97 175.73 1fb1 h VAL 214 N 0.00 0.69 0.00 2.03 3.04 -1.63 -1.41 116.25 118.97 1fb1 h VAL 214 Ca -0.37 -0.16 0.00 0.00 -1.01 0.00 0.00 66.70 65.17 1fb1 h VAL 214 Cb 1.62 0.18 0.00 0.00 -2.01 0.00 0.00 31.29 31.08 1fb1 h VAL 214 CO -0.04 0.08 0.00 0.23 -1.01 0.00 0.00 177.57 176.83 1fb1 n MET 215 N -4.98 0.00 -1.07 4.17 2.81 -1.20 -3.28 117.12 113.57 1fb1 n MET 215 Ca 0.14 0.00 -0.31 0.00 -1.81 0.00 0.00 57.70 55.72 1fb1 n MET 215 Cb 0.39 -0.01 0.13 0.00 -0.71 0.00 0.00 33.22 33.02 1fb1 n MET 215 CO 0.00 0.00 0.00 -0.98 1.51 0.00 0.00 175.97 176.50 1fb1 s ARG 216 N 0.00 1.57 0.00 0.03 1.70 -1.25 -2.89 118.95 118.11 1fb1 s ARG 216 Ca 0.00 1.17 0.00 0.00 -0.47 0.00 0.00 55.73 56.43 1fb1 s ARG 216 Cb 0.00 -1.82 0.00 0.00 -0.57 0.00 0.00 34.95 32.56 1fb1 s ARG 216 CO 0.00 -2.13 0.00 0.41 -1.08 0.00 0.00 175.30 172.50 1fb1 n GLY 217 N -0.74 1.89 0.00 3.88 0.00 -1.26 -3.71 105.19 105.25 1fb1 n GLY 217 Ca 0.09 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.58 1fb1 n GLY 217 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1fb1 n VAL 218 N 0.00 0.00 -3.35 1.61 0.24 -1.25 -5.08 118.33 110.50 1fb1 n VAL 218 Ca 0.00 0.00 -0.16 0.00 -2.04 0.00 0.00 64.34 62.14 1fb1 n VAL 218 Cb 0.00 0.41 0.08 0.00 -1.47 0.00 0.00 33.84 32.86 1fb1 n VAL 218 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1fb1 n GLN 219 N 0.00 -4.49 -3.54 7.34 10.64 -0.57 -5.02 117.38 121.75 1fb1 n GLN 219 Ca 0.00 0.85 -0.41 0.00 -1.83 0.00 0.00 57.00 55.61 1fb1 n GLN 219 Cb 0.12 -5.83 -0.11 0.00 -0.86 0.00 0.00 30.24 23.56 1fb1 n GLN 219 CO 0.00 0.00 0.00 0.15 -1.83 0.00 0.00 177.06 175.38 1fb1 s LYS 220 N -4.91 3.13 0.65 2.61 1.02 -1.00 -4.91 119.74 116.33 1fb1 s LYS 220 Ca 0.22 -0.89 0.01 0.00 0.02 0.00 0.00 55.97 55.33 1fb1 s LYS 220 Cb -0.03 -3.81 0.09 0.00 -0.52 0.00 0.00 37.83 33.56 1fb1 s LYS 220 CO 0.74 -0.61 0.90 1.41 -0.92 0.00 0.00 175.35 176.87 1fb1 s MET 221 N 1.65 2.02 0.00 1.68 1.75 -1.26 -3.69 119.30 121.45 1fb1 s MET 221 Ca 0.04 -1.07 0.00 0.00 -1.25 0.00 0.00 55.69 53.42 1fb1 s MET 221 Cb -0.18 -2.42 0.00 0.00 2.84 0.00 0.00 34.83 35.07 1fb1 s MET 221 CO 0.09 -1.15 0.00 0.09 -0.65 0.00 0.00 175.02 173.40 1fb1 n ASN 222 N -2.61 0.00 -2.47 1.11 5.03 -1.26 -4.85 115.26 110.21 1fb1 n ASN 222 Ca 0.13 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.58 1fb1 n ASN 222 Cb 0.60 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 39.36 1fb1 n ASN 222 CO 0.00 0.00 0.00 -1.54 -1.83 0.00 0.00 177.26 173.89 1fb1 n SER 223 N 1.62 -0.71 -4.78 6.41 3.41 -1.26 -4.84 113.62 113.48 1fb1 n SER 223 Ca 0.00 -0.39 -0.39 0.00 -0.26 0.00 0.00 58.87 57.83 1fb1 n SER 223 Cb 0.00 -0.06 -0.06 0.00 -0.26 0.00 0.00 64.21 63.83 1fb1 n SER 223 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1fb1 s LYS 224 N 2.04 4.59 -0.24 4.33 1.02 -1.26 -4.39 119.74 125.83 1fb1 s LYS 224 Ca 0.00 1.20 0.02 0.00 0.02 0.00 0.00 55.97 57.21 1fb1 s LYS 224 Cb 0.00 -3.19 0.05 0.00 -0.52 0.00 0.00 37.83 34.18 1fb1 s LYS 224 CO 0.00 0.52 -0.10 0.95 -0.92 0.00 0.00 175.35 175.80 1fb1 s THR 225 N -1.23 1.88 -0.10 2.17 -4.23 -1.11 -4.99 115.64 108.02 1fb1 s THR 225 Ca 0.38 -1.36 -0.12 0.00 -1.18 0.00 0.00 61.69 59.41 1fb1 s THR 225 Cb -0.23 -2.01 -0.05 0.00 1.34 0.00 0.00 72.50 71.55 1fb1 s THR 225 CO 0.27 0.02 0.29 -0.69 -0.54 0.00 0.00 174.62 173.96 1fb1 s VAL 226 N 1.25 5.27 -0.04 2.29 1.01 -1.26 -3.38 120.40 125.54 1fb1 s VAL 226 Ca -0.06 0.55 0.02 0.00 0.00 0.00 0.00 61.98 62.50 1fb1 s VAL 226 Cb -0.19 -3.60 0.01 0.00 0.00 0.00 0.00 36.38 32.60 1fb1 s VAL 226 CO -0.06 0.50 -0.10 0.42 0.00 0.00 0.00 175.10 175.85 1fb1 s THR 227 N -0.34 0.92 0.25 3.92 -4.23 -0.68 -5.00 115.64 110.48 1fb1 s THR 227 Ca 0.18 -0.40 0.05 0.00 -1.18 0.00 0.00 61.69 60.34 1fb1 s THR 227 Cb -0.14 -0.83 -0.05 0.00 1.34 0.00 0.00 72.50 72.81 1fb1 s THR 227 CO 0.07 0.29 -0.04 -0.94 -0.54 0.00 0.00 174.62 173.46 1fb1 s SER 228 N 0.39 2.28 -0.26 3.99 1.04 -1.26 -1.48 113.70 118.39 1fb1 s SER 228 Ca -0.07 -1.19 -0.04 0.00 0.48 0.00 0.00 55.95 55.13 1fb1 s SER 228 Cb -0.12 -0.08 0.15 0.00 0.10 0.00 0.00 66.02 66.07 1fb1 s SER 228 CO 0.01 -0.42 0.50 0.28 0.98 0.00 0.00 173.24 174.60 1fb1 s THR 229 N -3.22 -0.81 -0.01 2.02 -1.32 -0.95 -4.97 115.64 106.38 1fb1 s THR 229 Ca 0.28 0.00 -0.00 0.00 -1.21 0.00 0.00 61.69 60.76 1fb1 s THR 229 Cb 0.05 -0.88 -0.04 0.00 -1.51 0.00 0.00 72.50 70.12 1fb1 s THR 229 CO 0.10 -0.03 0.06 -0.04 -2.21 0.00 0.00 174.62 172.50 1fb1 s MET 230 N 2.72 3.01 0.26 7.08 -1.94 -1.26 -2.64 119.30 126.52 1fb1 s MET 230 Ca 0.11 -0.49 0.02 0.00 -1.71 0.00 0.00 55.69 53.61 1fb1 s MET 230 Cb -0.14 -2.82 -0.04 0.00 2.01 0.00 0.00 34.83 33.83 1fb1 s MET 230 CO -0.18 0.65 0.17 -0.51 -0.01 0.00 0.00 175.02 175.14 1fb1 s LEU 231 N -1.60 1.46 0.00 -0.03 1.43 -0.61 -4.36 118.68 114.97 1fb1 s LEU 231 Ca 0.21 -1.51 0.00 0.00 -1.03 0.00 0.00 54.13 51.80 1fb1 s LEU 231 Cb -0.12 0.33 0.00 0.00 0.03 0.00 0.00 46.19 46.44 1fb1 s LEU 231 CO 0.12 -0.89 0.00 0.61 0.23 0.00 0.00 176.35 176.42 1fb1 n GLY 232 N -0.45 2.10 0.17 -3.19 0.00 -1.26 -1.07 105.19 101.49 1fb1 n GLY 232 Ca 0.03 -0.16 -0.06 0.00 0.00 0.00 0.00 46.02 45.82 1fb1 n GLY 232 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1fb1 h VAL 233 N 0.00 0.61 -0.72 1.61 2.07 -0.98 -1.32 116.25 117.52 1fb1 h VAL 233 Ca 0.00 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.66 1fb1 h VAL 233 Cb 0.00 0.61 -0.14 0.00 -1.52 0.00 0.00 31.29 30.24 1fb1 h VAL 233 CO 0.00 0.00 -0.17 -0.26 0.02 0.00 0.00 177.57 177.16 1fb1 h PHE 234 N -0.04 -0.37 0.26 1.57 -1.00 -1.32 2.18 116.94 118.21 1fb1 h PHE 234 Ca 0.16 0.06 -0.01 0.00 2.81 0.00 0.00 57.97 60.99 1fb1 h PHE 234 Cb 0.29 0.28 0.00 0.00 3.61 0.00 0.00 35.95 40.13 1fb1 h PHE 234 CO -0.33 -0.31 -0.12 -0.09 -1.61 0.00 0.00 178.31 175.85 1fb1 h ARG 235 N 0.00 -0.33 -0.08 1.51 2.43 -0.30 -3.38 114.38 114.24 1fb1 h ARG 235 Ca 0.35 0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.52 1fb1 h ARG 235 Cb 0.53 0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 30.16 1fb1 h ARG 235 CO -0.74 -0.22 -0.02 0.93 -1.51 0.00 0.00 179.97 178.41 1fb1 h GLU 236 N -0.34 0.16 -5.00 0.20 5.08 -0.68 -3.42 114.58 110.57 1fb1 h GLU 236 Ca -0.03 -0.06 -0.68 0.00 -1.00 0.00 0.00 59.36 57.58 1fb1 h GLU 236 Cb 0.26 -0.01 -0.18 0.00 0.50 0.00 0.00 28.75 29.33 1fb1 h GLU 236 CO 0.06 0.48 0.05 0.34 -1.00 0.00 0.00 179.01 178.94 1fb1 s ASP 237 N -5.74 6.23 0.08 1.42 2.15 0.73 -4.95 116.67 116.60 1fb1 s ASP 237 Ca -0.15 -0.85 -0.21 0.00 0.43 0.00 0.00 52.55 51.77 1fb1 s ASP 237 Cb 0.04 -2.29 -0.11 0.00 -0.30 0.00 0.00 42.92 40.26 1fb1 s ASP 237 CO 0.70 -0.87 1.59 1.55 -0.17 0.00 0.00 175.17 177.96 1fb1 h PRO 238 N 8.98 0.24 -0.59 4.34 0.13 -1.79 -1.91 132.00 141.39 1fb1 h PRO 238 Ca -0.27 -0.05 0.17 0.00 -0.87 0.00 0.00 66.00 64.98 1fb1 h PRO 238 Cb 1.10 -0.04 -0.02 0.00 0.13 0.00 0.00 31.00 32.17 1fb1 h PRO 238 CO 0.95 0.36 0.70 0.87 -0.23 0.00 0.00 178.00 180.66 1fb1 h LYS 239 N 0.07 0.00 0.00 0.86 1.79 -1.95 0.76 116.57 118.11 1fb1 h LYS 239 Ca 0.05 0.00 -0.00 0.00 -2.18 0.00 0.00 60.65 58.52 1fb1 h LYS 239 Cb 0.22 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 30.87 1fb1 h LYS 239 CO -0.00 0.00 -0.34 1.15 -1.08 0.00 0.00 179.45 179.18 1fb1 h THR 240 N 0.00 0.01 -0.99 -0.16 2.02 -1.85 -3.07 112.91 108.86 1fb1 h THR 240 Ca 0.28 -1.01 0.23 0.00 0.77 0.00 0.00 66.41 66.68 1fb1 h THR 240 Cb 1.68 0.02 -0.19 0.00 -1.74 0.00 0.00 68.15 67.92 1fb1 h THR 240 CO -0.00 0.00 -0.14 -0.09 0.37 0.00 0.00 175.52 175.66 1fb1 h ARG 241 N -1.00 0.00 0.00 6.66 2.43 -0.22 0.20 114.38 122.46 1fb1 h ARG 241 Ca -0.00 -0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1fb1 h ARG 241 Cb 0.34 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.89 1fb1 h ARG 241 CO -0.00 0.00 -0.00 1.49 -1.51 0.00 0.00 179.97 179.95 1fb1 h GLU 242 N 0.00 -0.00 -1.51 0.20 4.81 0.29 -2.06 114.58 116.31 1fb1 h GLU 242 Ca 0.52 0.00 0.44 0.00 -0.13 0.00 0.00 59.36 60.19 1fb1 h GLU 242 Cb 0.93 0.00 -0.06 0.00 0.63 0.00 0.00 28.75 30.25 1fb1 h GLU 242 CO -0.98 -0.00 1.25 1.49 -0.73 0.00 0.00 179.01 180.04 1fb1 h GLU 243 N -0.00 0.00 0.19 1.92 4.81 -1.16 0.39 114.58 120.73 1fb1 h GLU 243 Ca -0.00 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 1fb1 h GLU 243 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.39 1fb1 h GLU 243 CO 0.00 0.00 -0.09 0.35 -0.73 0.00 0.00 179.01 178.54 1fb1 h PHE 244 N 0.00 -0.24 -0.36 0.92 3.57 -0.11 -2.66 116.94 118.07 1fb1 h PHE 244 Ca 0.72 -0.01 0.07 0.00 3.53 0.00 0.00 57.97 62.28 1fb1 h PHE 244 Cb 3.21 0.08 -0.09 0.00 2.79 0.00 0.00 35.95 41.95 1fb1 h PHE 244 CO 0.00 -0.15 -0.34 -0.07 -2.23 0.00 0.00 178.31 175.51 1fb1 h LEU 245 N -0.35 -1.13 -2.28 0.59 3.38 0.43 0.23 115.31 116.17 1fb1 h LEU 245 Ca -0.03 0.19 0.04 0.00 0.09 0.00 0.00 57.88 58.17 1fb1 h LEU 245 Cb 0.20 0.52 -0.00 0.00 0.09 0.00 0.00 40.66 41.46 1fb1 h LEU 245 CO 0.04 -0.34 0.13 0.71 0.09 0.00 0.00 178.44 179.08 1fb1 h THR 246 N -0.29 0.53 -0.00 0.22 1.35 -1.52 -1.14 112.91 112.06 1fb1 h THR 246 Ca 0.15 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.01 1fb1 h THR 246 Cb 0.55 0.89 0.00 0.00 -1.73 0.00 0.00 68.15 67.87 1fb1 h THR 246 CO -0.52 0.00 -0.14 -0.11 -0.25 0.00 0.00 175.52 174.51 1fb1 n LEU 247 N -3.88 0.23 -0.78 3.87 7.94 0.79 -3.53 117.00 121.64 1fb1 n LEU 247 Ca 0.00 0.24 0.07 0.00 -1.11 0.00 0.00 56.01 55.21 1fb1 n LEU 247 Cb 0.24 -0.34 0.18 0.00 0.53 0.00 0.00 43.42 44.03 1fb1 n LEU 247 CO 0.28 0.05 0.64 2.30 -1.11 0.00 0.00 177.39 179.55 1fb1 n ILE 248 N -1.34 0.87 0.49 1.96 -5.35 -0.44 -4.30 119.36 111.25 1fb1 n ILE 248 Ca 0.09 -0.93 0.11 0.00 -0.27 0.00 0.00 62.75 61.75 1fb1 n ILE 248 Cb 0.31 0.60 0.05 0.00 -1.74 0.00 0.00 39.64 38.87 1fb1 n ILE 248 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1fb1 n ARG 249 N 0.78 0.34 0.00 6.28 1.74 -1.21 -4.95 116.66 119.65 1fb1 n ARG 249 Ca 0.14 0.03 0.09 0.00 -0.77 0.00 0.00 57.85 57.33 1fb1 n ARG 249 Cb 0.46 -1.64 0.50 0.00 -1.02 0.00 0.00 32.46 30.76 1fb1 n ARG 249 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98