#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2w2n s THR 61 N 0.00 2.37 0.32 4.28 2.01 -1.26 -5.15 115.64 118.22 2w2n s THR 61 Ca 0.00 -1.44 -0.29 0.00 0.31 0.00 0.00 61.69 60.27 2w2n s THR 61 Cb 0.00 -1.99 -0.10 0.00 0.01 0.00 0.00 72.50 70.43 2w2n s THR 61 CO 0.00 0.27 1.24 0.00 -0.69 0.00 0.00 174.62 175.44 2w2n s ALA 62 N -0.92 3.45 0.19 7.40 0.00 -1.26 -4.99 121.76 125.63 2w2n s ALA 62 Ca 0.13 1.15 0.11 0.00 0.00 0.00 0.00 51.96 53.35 2w2n s ALA 62 Cb -0.10 -3.43 -0.04 0.00 0.00 0.00 0.00 23.12 19.54 2w2n s ALA 62 CO 0.04 -0.51 -0.19 0.95 0.00 0.00 0.00 175.76 176.06 2w2n s THR 63 N -1.16 2.64 -0.10 0.00 -4.23 -1.22 -4.98 115.64 106.58 2w2n s THR 63 Ca 0.48 -1.92 -0.03 0.00 -1.18 0.00 0.00 61.69 59.04 2w2n s THR 63 Cb -0.37 -2.29 -0.03 0.00 1.34 0.00 0.00 72.50 71.15 2w2n s THR 63 CO 0.49 -0.13 0.03 0.12 -0.54 0.00 0.00 174.62 174.59 2w2n s PHE 64 N -1.71 3.23 0.03 3.99 5.36 -1.26 -1.07 117.98 126.55 2w2n s PHE 64 Ca 0.22 0.21 0.04 0.00 -0.96 0.00 0.00 56.93 56.45 2w2n s PHE 64 Cb -0.08 -1.85 -0.02 0.00 -0.34 0.00 0.00 43.02 40.73 2w2n s PHE 64 CO 0.12 0.46 -0.13 -1.01 -1.46 0.00 0.00 175.22 173.20 2w2n s HIS 65 N -0.72 1.10 0.13 10.12 3.76 0.18 -4.97 115.29 124.89 2w2n s HIS 65 Ca 0.12 -0.32 -0.09 0.00 -0.15 0.00 0.00 55.06 54.62 2w2n s HIS 65 Cb -0.12 -0.66 -0.01 0.00 1.11 0.00 0.00 32.58 32.90 2w2n s HIS 65 CO 0.02 0.01 0.23 -0.98 -0.85 0.00 0.00 174.74 173.18 2w2n s ARG 66 N -0.96 0.99 0.26 1.40 1.70 -1.26 -0.27 118.95 120.82 2w2n s ARG 66 Ca 0.01 -1.07 -0.30 0.00 -0.47 0.00 0.00 55.73 53.90 2w2n s ARG 66 Cb -0.07 0.36 -0.11 0.00 -0.57 0.00 0.00 34.95 34.56 2w2n s ARG 66 CO 0.01 -0.34 1.50 0.00 -1.08 0.00 0.00 175.30 175.39 2w2n h ALA 68 N 5.02 1.00 -2.16 0.00 0.00 -2.00 -3.40 119.26 117.72 2w2n h ALA 68 Ca -0.46 0.00 -0.73 0.00 0.00 0.00 0.00 54.91 53.71 2w2n h ALA 68 Cb 1.22 0.00 -0.22 0.00 0.00 0.00 0.00 17.79 18.79 2w2n h ALA 68 CO 0.79 0.00 -0.19 0.21 0.00 0.00 0.00 179.25 180.06 2w2n s LYS 69 N -3.41 3.01 0.24 0.00 2.47 -1.26 -4.98 119.74 115.80 2w2n s LYS 69 Ca 0.04 -1.40 -0.08 0.00 -1.56 0.00 0.00 55.97 52.98 2w2n s LYS 69 Cb 0.09 -4.20 0.39 0.00 -1.46 0.00 0.00 37.83 32.65 2w2n s LYS 69 CO 0.54 -1.22 1.65 0.22 0.16 0.00 0.00 175.35 176.70 2w2n h ASP 70 N 8.89 -0.31 -0.23 1.43 3.58 -1.99 0.18 116.42 127.97 2w2n h ASP 70 Ca -0.29 0.18 0.07 0.00 0.42 0.00 0.00 57.03 57.41 2w2n h ASP 70 Cb 1.10 0.32 -0.01 0.00 1.72 0.00 0.00 39.33 42.46 2w2n h ASP 70 CO 0.97 -0.15 0.24 -0.65 -2.88 0.00 0.00 179.24 176.76 2w2n h PRO 71 N 0.11 0.00 -0.10 0.28 0.11 -1.96 -2.83 132.00 127.61 2w2n h PRO 71 Ca 0.38 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.49 2w2n h PRO 71 Cb 0.66 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.77 2w2n h PRO 71 CO -0.62 0.00 0.00 0.91 -0.21 0.00 0.00 178.00 178.08 2w2n n TRP 72 N -3.87 0.11 -2.41 0.65 8.01 0.05 -4.93 117.44 115.05 2w2n n TRP 72 Ca 0.03 -0.05 -0.37 0.00 -1.31 0.00 0.00 57.50 55.79 2w2n n TRP 72 Cb 0.37 0.00 -0.03 0.00 -2.01 0.00 0.00 31.31 29.64 2w2n n TRP 72 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.69 177.71 2w2n s ARG 73 N -1.89 4.08 -0.61 -0.99 0.52 -1.07 -0.29 118.95 118.69 2w2n s ARG 73 Ca 0.33 1.68 0.06 0.00 -0.52 0.00 0.00 55.73 57.28 2w2n s ARG 73 Cb 0.20 -2.59 0.22 0.00 0.52 0.00 0.00 34.95 33.30 2w2n s ARG 73 CO 0.31 -0.26 0.60 1.28 0.02 0.00 0.00 175.30 177.25 2w2n n LEU 74 N -0.04 2.65 -4.69 2.53 4.77 -0.48 -4.83 117.00 116.91 2w2n n LEU 74 Ca 0.05 -5.17 -0.41 0.00 -0.03 0.00 0.00 56.01 50.45 2w2n n LEU 74 Cb 0.48 -0.41 0.01 0.00 -2.33 0.00 0.00 43.42 41.17 2w2n n LEU 74 CO 0.48 1.94 0.84 -2.65 -1.33 0.00 0.00 177.39 176.67 2w2n n PRO 75 N 1.47 1.85 0.00 3.23 -0.02 -1.26 -3.44 135.00 136.83 2w2n n PRO 75 Ca 0.26 0.66 0.00 0.00 -2.02 0.00 0.00 63.50 62.39 2w2n n PRO 75 Cb 0.41 -2.33 0.00 0.00 -0.02 0.00 0.00 33.50 31.56 2w2n n PRO 75 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2w2n n GLY 76 N 0.86 0.09 3.13 -1.23 0.00 -1.26 -5.04 105.19 101.74 2w2n n GLY 76 Ca 0.07 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.80 2w2n n GLY 76 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2w2n s THR 77 N -2.00 1.68 -0.01 2.61 2.01 -1.22 -0.99 115.64 117.72 2w2n s THR 77 Ca 0.00 -0.79 0.02 0.00 0.31 0.00 0.00 61.69 61.23 2w2n s THR 77 Cb 0.00 -1.48 -0.00 0.00 0.01 0.00 0.00 72.50 71.03 2w2n s THR 77 CO 0.00 0.47 -0.06 -0.31 -0.69 0.00 0.00 174.62 174.04 2w2n s TYR 78 N 0.51 0.54 -0.36 4.92 2.02 0.16 -1.02 117.35 124.12 2w2n s TYR 78 Ca -0.16 -0.10 -0.18 0.00 -0.37 0.00 0.00 57.07 56.26 2w2n s TYR 78 Cb -0.17 -0.35 -0.00 0.00 -0.40 0.00 0.00 41.96 41.04 2w2n s TYR 78 CO 0.06 -0.02 0.48 0.08 -1.57 0.00 0.00 175.55 174.58 2w2n s VAL 79 N -0.09 5.05 -0.46 0.71 1.01 0.21 -0.99 120.40 125.84 2w2n s VAL 79 Ca 0.02 0.21 -0.20 0.00 0.00 0.00 0.00 61.98 62.00 2w2n s VAL 79 Cb -0.03 -3.95 0.03 0.00 0.00 0.00 0.00 36.38 32.43 2w2n s VAL 79 CO -0.00 -0.23 0.63 -0.69 0.00 0.00 0.00 175.10 174.81 2w2n s VAL 80 N 2.31 4.85 -0.32 2.92 1.01 0.14 -1.12 120.40 130.18 2w2n s VAL 80 Ca 0.17 -0.08 -0.14 0.00 0.00 0.00 0.00 61.98 61.93 2w2n s VAL 80 Cb -0.16 -4.22 -0.02 0.00 0.00 0.00 0.00 36.38 31.98 2w2n s VAL 80 CO 0.13 -0.65 0.30 -0.69 0.00 0.00 0.00 175.10 174.19 2w2n s VAL 81 N 2.74 5.23 0.61 2.92 1.01 0.05 -1.76 120.40 131.20 2w2n s VAL 81 Ca 0.20 0.03 -0.04 0.00 0.00 0.00 0.00 61.98 62.17 2w2n s VAL 81 Cb -0.16 -3.73 0.03 0.00 0.00 0.00 0.00 36.38 32.52 2w2n s VAL 81 CO 0.17 0.01 0.90 -0.76 0.00 0.00 0.00 175.10 175.42 2w2n s LEU 82 N 1.89 3.14 0.79 3.92 1.43 -0.09 -0.38 118.68 129.37 2w2n s LEU 82 Ca 0.09 0.48 -0.11 0.00 -1.03 0.00 0.00 54.13 53.57 2w2n s LEU 82 Cb -0.17 -3.26 0.07 0.00 0.03 0.00 0.00 46.19 42.86 2w2n s LEU 82 CO 0.11 -1.22 1.10 -0.54 0.23 0.00 0.00 176.35 176.02 2w2n s LYS 83 N -5.00 2.11 0.20 1.70 1.02 0.11 -4.56 119.74 115.31 2w2n s LYS 83 Ca 0.56 1.18 -0.17 0.00 0.02 0.00 0.00 55.97 57.55 2w2n s LYS 83 Cb -0.11 -1.88 0.18 0.00 -0.52 0.00 0.00 37.83 35.50 2w2n s LYS 83 CO 0.43 -1.75 1.61 1.49 -0.92 0.00 0.00 175.35 176.21 2w2n h GLU 84 N -1.21 -0.09 -0.87 1.68 4.81 -1.95 -2.29 114.58 114.66 2w2n h GLU 84 Ca -0.44 0.01 -0.37 0.00 -0.13 0.00 0.00 59.36 58.43 2w2n h GLU 84 Cb 1.24 0.02 -0.22 0.00 0.63 0.00 0.00 28.75 30.42 2w2n h GLU 84 CO 0.51 -0.06 0.46 0.39 -0.73 0.00 0.00 179.01 179.58 2w2n n GLU 85 N -5.44 3.00 -2.41 1.92 1.02 -1.26 -4.78 120.64 112.69 2w2n n GLU 85 Ca 0.06 -3.06 -0.42 0.00 -0.02 0.00 0.00 57.16 53.71 2w2n n GLU 85 Cb 0.34 -2.20 -0.03 0.00 -0.02 0.00 0.00 31.44 29.54 2w2n n GLU 85 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 2w2n s THR 86 N -3.15 4.16 0.65 2.62 2.01 -0.86 -5.02 115.64 116.04 2w2n s THR 86 Ca 0.56 1.48 -0.13 0.00 0.31 0.00 0.00 61.69 63.91 2w2n s THR 86 Cb 0.46 -3.95 -0.01 0.00 0.01 0.00 0.00 72.50 69.01 2w2n s THR 86 CO 0.12 -0.03 1.05 -2.28 -0.69 0.00 0.00 174.62 172.80 2w2n s HIS 87 N 2.53 3.11 0.28 4.92 2.46 -1.26 -4.83 115.29 122.49 2w2n s HIS 87 Ca 0.57 1.45 0.01 0.00 0.47 0.00 0.00 55.06 57.56 2w2n s HIS 87 Cb -0.25 -2.91 0.59 0.00 -0.13 0.00 0.00 32.58 29.87 2w2n s HIS 87 CO 0.21 -1.13 1.79 1.25 -2.47 0.00 0.00 174.74 174.40 2w2n h LEU 88 N -0.24 0.73 -1.27 8.88 5.85 -1.95 -1.58 115.31 125.72 2w2n h LEU 88 Ca -0.45 0.08 -0.03 0.00 0.84 0.00 0.00 57.88 58.32 2w2n h LEU 88 Cb 1.21 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 42.16 2w2n h LEU 88 CO 0.57 0.33 0.16 0.77 -0.34 0.00 0.00 178.44 179.93 2w2n h SER 89 N 0.78 0.60 0.16 1.25 4.64 -1.99 -0.88 113.55 118.11 2w2n h SER 89 Ca 0.50 -0.08 -0.17 0.00 -0.47 0.00 0.00 61.79 61.58 2w2n h SER 89 Cb 0.65 -0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 62.58 2w2n h SER 89 CO -0.33 0.57 -0.63 1.56 -0.87 0.00 0.00 176.83 177.13 2w2n h GLN 90 N 0.66 0.46 -0.36 4.77 4.20 -1.69 -1.82 115.11 121.33 2w2n h GLN 90 Ca 0.16 -0.33 -0.04 0.00 0.06 0.00 0.00 58.65 58.50 2w2n h GLN 90 Cb 0.17 0.05 -0.01 0.00 0.30 0.00 0.00 27.48 27.99 2w2n h GLN 90 CO -0.01 0.94 0.07 1.03 -0.67 0.00 0.00 178.83 180.20 2w2n h SER 91 N 0.34 0.56 -0.61 1.46 0.87 -0.78 -0.81 113.55 114.59 2w2n h SER 91 Ca -0.01 -0.25 -0.10 0.00 -1.23 0.00 0.00 61.79 60.20 2w2n h SER 91 Cb 1.18 -0.15 -0.02 0.00 -0.44 0.00 0.00 62.40 62.97 2w2n h SER 91 CO 0.11 0.66 -0.02 -0.33 -0.53 0.00 0.00 176.83 176.73 2w2n h GLU 92 N 0.44 1.08 -0.58 2.24 5.08 -1.16 -1.03 114.58 120.64 2w2n h GLU 92 Ca 0.11 -0.35 -0.02 0.00 -1.00 0.00 0.00 59.36 58.10 2w2n h GLU 92 Cb 0.33 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.46 2w2n h GLU 92 CO 0.00 1.06 0.29 -0.09 -1.00 0.00 0.00 179.01 179.28 2w2n h ARG 93 N 0.98 0.83 -0.66 2.33 2.43 -1.25 -0.82 114.38 118.23 2w2n h ARG 93 Ca 0.17 -0.12 -0.07 0.00 -0.81 0.00 0.00 59.98 59.16 2w2n h ARG 93 Cb 0.58 -0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 29.95 2w2n h ARG 93 CO 0.03 0.67 0.14 1.15 -1.51 0.00 0.00 179.97 180.45 2w2n h THR 94 N 0.79 1.26 -0.35 0.20 2.02 -0.93 -1.37 112.91 114.53 2w2n h THR 94 Ca 0.20 -0.96 -0.04 0.00 0.77 0.00 0.00 66.41 66.38 2w2n h THR 94 Cb 0.10 0.60 -0.01 0.00 -1.74 0.00 0.00 68.15 67.09 2w2n h THR 94 CO -0.03 0.36 0.07 0.00 0.37 0.00 0.00 175.52 176.30 2w2n h ALA 95 N 1.15 0.47 -0.58 6.16 0.00 -0.96 -2.27 119.26 123.22 2w2n h ALA 95 Ca 0.21 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2w2n h ALA 95 Cb 0.38 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 2w2n h ALA 95 CO 0.00 0.15 0.36 0.00 0.00 0.00 0.00 179.25 179.77 2w2n h ARG 96 N 0.42 0.77 -0.34 0.00 3.08 -0.95 -2.10 114.38 115.26 2w2n h ARG 96 Ca 0.11 -0.06 -0.04 0.00 0.07 0.00 0.00 59.98 60.06 2w2n h ARG 96 Cb 0.33 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 30.20 2w2n h ARG 96 CO 0.00 0.53 0.05 -0.09 -1.07 0.00 0.00 179.97 179.39 2w2n h ARG 97 N 0.79 0.57 -0.44 0.04 2.43 -1.10 -0.62 114.38 116.06 2w2n h ARG 97 Ca 0.21 -0.16 0.08 0.00 -0.81 0.00 0.00 59.98 59.30 2w2n h ARG 97 Cb -0.06 -0.06 -0.07 0.00 -0.42 0.00 0.00 29.97 29.36 2w2n h ARG 97 CO -0.04 0.66 0.06 1.25 -1.51 0.00 0.00 179.97 180.38 2w2n h LEU 98 N 0.40 -0.07 -0.50 3.80 5.85 -1.08 0.15 115.31 123.87 2w2n h LEU 98 Ca 0.10 0.09 -0.03 0.00 0.84 0.00 0.00 57.88 58.88 2w2n h LEU 98 Cb 0.37 0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.51 2w2n h LEU 98 CO 0.01 0.00 0.18 1.56 -0.34 0.00 0.00 178.44 179.85 2w2n h GLN 99 N 0.18 0.76 -0.16 1.25 4.20 -1.24 -1.47 115.11 118.63 2w2n h GLN 99 Ca 0.22 -0.15 -0.04 0.00 0.06 0.00 0.00 58.65 58.74 2w2n h GLN 99 Cb 0.30 -0.12 -0.00 0.00 0.30 0.00 0.00 27.48 27.95 2w2n h GLN 99 CO -0.32 0.70 -0.04 0.00 -0.67 0.00 0.00 178.83 178.50 2w2n h ALA 100 N 1.03 0.22 -0.52 3.87 0.00 -0.78 -1.33 119.26 121.75 2w2n h ALA 100 Ca 0.16 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 2w2n h ALA 100 Cb 0.24 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 2w2n h ALA 100 CO -0.01 -0.01 0.23 1.96 0.00 0.00 0.00 179.25 181.42 2w2n h GLN 101 N 0.01 0.76 -0.10 0.00 4.20 -0.70 -2.57 115.11 116.72 2w2n h GLN 101 Ca 0.04 -0.13 -0.01 0.00 0.06 0.00 0.00 58.65 58.62 2w2n h GLN 101 Cb 0.48 -0.13 -0.00 0.00 0.30 0.00 0.00 27.48 28.13 2w2n h GLN 101 CO 0.02 0.65 0.03 0.00 -0.67 0.00 0.00 178.83 178.86 2w2n h ALA 102 N 1.07 0.13 -0.85 3.87 0.00 -1.28 -2.81 119.26 119.39 2w2n h ALA 102 Ca 0.18 -0.12 0.09 0.00 0.00 0.00 0.00 54.91 55.06 2w2n h ALA 102 Cb 0.16 -0.04 -0.07 0.00 0.00 0.00 0.00 17.79 17.84 2w2n h ALA 102 CO -0.02 -0.25 0.51 0.00 0.00 0.00 0.00 179.25 179.49 2w2n h ALA 103 N 0.84 1.22 0.00 0.00 0.00 -1.08 -0.50 119.26 119.74 2w2n h ALA 103 Ca 0.03 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 2w2n h ALA 103 Cb 0.22 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 2w2n h ALA 103 CO -0.00 0.15 -0.06 0.00 0.00 0.00 0.00 179.25 179.34 2w2n h ARG 104 N 0.86 0.00 -0.01 0.00 3.08 -1.38 -2.12 114.38 114.80 2w2n h ARG 104 Ca 0.41 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.46 2w2n h ARG 104 Cb 0.34 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.39 2w2n h ARG 104 CO -0.23 0.06 -0.15 0.54 -1.07 0.00 0.00 179.97 179.12 2w2n n ARG 105 N -3.19 1.41 0.00 0.04 1.74 -0.33 -4.96 116.66 111.37 2w2n n ARG 105 Ca 0.00 -0.94 0.00 0.00 -0.77 0.00 0.00 57.85 56.14 2w2n n ARG 105 Cb 0.34 -1.48 0.00 0.00 -1.02 0.00 0.00 32.46 30.30 2w2n n ARG 105 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2w2n n GLY 106 N 1.29 1.51 3.22 -0.13 0.00 -0.65 -5.08 105.19 105.35 2w2n n GLY 106 Ca 0.15 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.88 2w2n n GLY 106 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2w2n s TYR 107 N -2.00 2.00 0.11 1.61 2.02 -0.41 -4.98 117.35 115.69 2w2n s TYR 107 Ca 0.00 -0.47 -0.24 0.00 -0.37 0.00 0.00 57.07 55.99 2w2n s TYR 107 Cb 0.00 -1.30 -0.07 0.00 -0.40 0.00 0.00 41.96 40.19 2w2n s TYR 107 CO 0.00 -0.10 0.74 -1.17 -1.57 0.00 0.00 175.55 173.45 2w2n s LEU 108 N -0.33 4.53 0.04 -1.29 0.20 -1.26 -2.84 118.68 117.73 2w2n s LEU 108 Ca 0.03 1.51 0.04 0.00 0.69 0.00 0.00 54.13 56.41 2w2n s LEU 108 Cb -0.10 -3.21 -0.02 0.00 -0.43 0.00 0.00 46.19 42.43 2w2n s LEU 108 CO 0.01 0.15 -0.13 0.42 -0.29 0.00 0.00 176.35 176.51 2w2n s THR 109 N -0.73 0.98 -0.22 3.68 -4.23 -1.26 -4.59 115.64 109.28 2w2n s THR 109 Ca 0.36 -1.01 0.02 0.00 -1.18 0.00 0.00 61.69 59.87 2w2n s THR 109 Cb -0.22 -0.92 0.05 0.00 1.34 0.00 0.00 72.50 72.75 2w2n s THR 109 CO 0.24 -0.08 -0.11 -0.54 -0.54 0.00 0.00 174.62 173.59 2w2n s LYS 110 N -1.23 2.18 -0.44 3.99 1.02 -0.13 -4.99 119.74 120.14 2w2n s LYS 110 Ca -0.01 -1.01 -0.29 0.00 0.02 0.00 0.00 55.97 54.68 2w2n s LYS 110 Cb -0.08 -2.60 0.02 0.00 -0.52 0.00 0.00 37.83 34.65 2w2n s LYS 110 CO 0.01 -0.46 1.20 0.42 -0.92 0.00 0.00 175.35 175.60 2w2n s ILE 111 N 1.29 4.17 0.01 2.17 -1.09 -1.26 -0.44 121.20 126.05 2w2n s ILE 111 Ca -0.03 1.22 0.11 0.00 -2.23 0.00 0.00 60.65 59.71 2w2n s ILE 111 Cb -0.17 -4.48 -0.21 0.00 -1.58 0.00 0.00 42.46 36.02 2w2n s ILE 111 CO -0.08 -0.88 0.95 -0.07 -1.23 0.00 0.00 174.94 173.63 2w2n h LEU 112 N 11.30 0.00 -7.00 2.97 3.38 -0.95 -3.48 115.31 121.53 2w2n h LEU 112 Ca -0.24 0.00 0.05 0.00 0.09 0.00 0.00 57.88 57.78 2w2n h LEU 112 Cb 1.07 0.00 -0.24 0.00 0.09 0.00 0.00 40.66 41.58 2w2n h LEU 112 CO 1.11 0.96 0.27 -2.28 0.09 0.00 0.00 178.44 178.58 2w2n s HIS 113 N -2.68 -0.71 -0.20 1.13 5.04 -1.20 -4.99 115.29 111.69 2w2n s HIS 113 Ca -0.02 1.54 -0.06 0.00 -1.54 0.00 0.00 55.06 54.97 2w2n s HIS 113 Cb 0.09 0.41 -0.03 0.00 0.04 0.00 0.00 32.58 33.09 2w2n s HIS 113 CO 0.82 -0.35 0.04 0.08 -2.34 0.00 0.00 174.74 172.99 2w2n s VAL 114 N 0.94 4.40 0.07 0.89 1.01 -1.26 -0.11 120.40 126.34 2w2n s VAL 114 Ca -0.04 -0.16 -0.30 0.00 0.00 0.00 0.00 61.98 61.48 2w2n s VAL 114 Cb -0.05 -3.00 -0.05 0.00 0.00 0.00 0.00 36.38 33.29 2w2n s VAL 114 CO -0.11 0.42 0.96 -0.36 0.00 0.00 0.00 175.10 176.01 2w2n s PHE 115 N 0.84 3.76 -0.33 5.22 0.08 -0.11 -4.98 117.98 122.45 2w2n s PHE 115 Ca 0.02 1.75 0.00 0.00 0.12 0.00 0.00 56.93 58.83 2w2n s PHE 115 Cb -0.14 -3.07 0.14 0.00 -0.57 0.00 0.00 43.02 39.38 2w2n s PHE 115 CO 0.02 0.14 0.28 -3.38 -0.10 0.00 0.00 175.22 172.18 2w2n s HIS 116 N 0.34 -0.06 0.00 0.36 -3.43 -1.26 -4.15 115.29 107.09 2w2n s HIS 116 Ca 0.48 -0.76 0.00 0.00 -0.80 0.00 0.00 55.06 53.98 2w2n s HIS 116 Cb -0.22 -0.60 0.00 0.00 -1.43 0.00 0.00 32.58 30.33 2w2n s HIS 116 CO 0.29 -0.90 0.00 0.41 -2.00 0.00 0.00 174.74 172.53 2w2n n GLY 117 N 4.73 -1.22 0.03 -1.38 0.00 -1.26 -5.01 105.19 101.07 2w2n n GLY 117 Ca 0.04 0.49 -0.01 0.00 0.00 0.00 0.00 46.02 46.54 2w2n n GLY 117 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2w2n h LEU 118 N 0.00 0.00 -8.89 0.99 3.38 -2.03 -3.49 115.31 105.27 2w2n h LEU 118 Ca 0.00 0.00 -0.48 0.00 0.09 0.00 0.00 57.88 57.49 2w2n h LEU 118 Cb 0.00 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 40.60 2w2n h LEU 118 CO 0.00 0.31 -0.75 -1.48 0.09 0.00 0.00 178.44 176.62 2w2n s LEU 119 N -6.28 2.53 0.02 1.67 0.05 -1.26 -5.13 118.68 110.28 2w2n s LEU 119 Ca -0.04 -0.98 -0.20 0.00 0.05 0.00 0.00 54.13 52.96 2w2n s LEU 119 Cb 0.01 -0.73 -0.06 0.00 -2.05 0.00 0.00 46.19 43.36 2w2n s LEU 119 CO 0.06 -0.12 0.60 -2.16 -0.55 0.00 0.00 176.35 174.17 2w2n s PRO 120 N -3.40 4.29 0.00 1.48 0.04 -1.26 -4.34 135.00 131.81 2w2n s PRO 120 Ca 0.21 0.75 0.00 0.00 0.04 0.00 0.00 61.00 62.00 2w2n s PRO 120 Cb -0.02 -3.31 0.00 0.00 0.04 0.00 0.00 34.50 31.21 2w2n s PRO 120 CO 0.07 0.45 0.00 0.41 0.04 0.00 0.00 177.00 177.97 2w2n n GLY 121 N 2.22 0.02 3.51 0.56 0.00 -1.26 -0.92 105.19 109.33 2w2n n GLY 121 Ca -0.08 -1.44 -0.11 0.00 0.00 0.00 0.00 46.02 44.40 2w2n n GLY 121 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2w2n s PHE 122 N -2.94 -0.45 -0.23 1.61 -0.71 -0.72 -0.94 117.98 113.60 2w2n s PHE 122 Ca 0.00 0.20 -0.08 0.00 -1.04 0.00 0.00 56.93 56.01 2w2n s PHE 122 Cb 0.00 0.59 -0.04 0.00 -1.21 0.00 0.00 43.02 42.36 2w2n s PHE 122 CO 0.00 -0.90 0.08 -1.17 -1.34 0.00 0.00 175.22 171.89 2w2n s LEU 123 N -2.77 3.65 -0.02 -1.99 2.96 0.84 -0.68 118.68 120.67 2w2n s LEU 123 Ca 0.03 -0.08 0.06 0.00 -0.22 0.00 0.00 54.13 53.92 2w2n s LEU 123 Cb -0.02 -1.96 -0.01 0.00 0.50 0.00 0.00 46.19 44.69 2w2n s LEU 123 CO -0.09 0.04 -0.20 0.54 -1.32 0.00 0.00 176.35 175.32 2w2n s VAL 124 N 1.20 1.56 -0.22 1.68 0.11 -0.16 -0.21 120.40 124.36 2w2n s VAL 124 Ca 0.05 -0.84 -0.05 0.00 -2.93 0.00 0.00 61.98 58.21 2w2n s VAL 124 Cb -0.14 -1.29 -0.02 0.00 -1.53 0.00 0.00 36.38 33.39 2w2n s VAL 124 CO 0.04 0.44 0.00 -0.75 -3.33 0.00 0.00 175.10 171.50 2w2n s LYS 125 N -0.43 3.56 0.29 1.54 2.20 0.41 -0.67 119.74 126.64 2w2n s LYS 125 Ca 0.07 -0.54 -0.19 0.00 -0.36 0.00 0.00 55.97 54.95 2w2n s LYS 125 Cb -0.08 -3.12 0.07 0.00 -1.51 0.00 0.00 37.83 33.19 2w2n s LYS 125 CO -0.01 -0.10 0.91 0.00 -0.36 0.00 0.00 175.35 175.80 2w2n s MET 126 N 1.29 1.82 0.36 4.03 0.23 -0.16 -0.95 119.30 125.91 2w2n s MET 126 Ca 0.04 -1.17 -0.26 0.00 -1.03 0.00 0.00 55.69 53.27 2w2n s MET 126 Cb -0.15 0.51 -0.09 0.00 -1.53 0.00 0.00 34.83 33.57 2w2n s MET 126 CO 0.01 -0.85 1.09 0.45 -2.03 0.00 0.00 175.02 173.69 2w2n s SER 127 N -3.24 6.88 0.18 -1.18 0.15 -1.26 -4.41 113.70 110.82 2w2n s SER 127 Ca 0.19 2.17 0.19 0.00 0.70 0.00 0.00 55.95 59.20 2w2n s SER 127 Cb -0.04 -2.60 0.84 0.00 -1.71 0.00 0.00 66.02 62.50 2w2n s SER 127 CO 0.09 -0.41 1.58 0.61 1.20 0.00 0.00 173.24 176.31 2w2n n GLY 128 N 0.69 -1.08 0.39 9.45 0.00 -1.26 -2.07 105.19 111.32 2w2n n GLY 128 Ca 0.03 0.06 0.21 0.00 0.00 0.00 0.00 46.02 46.32 2w2n n GLY 128 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2w2n h ASP 129 N 0.00 0.00 -0.41 1.61 5.19 -2.04 -2.94 116.42 117.84 2w2n h ASP 129 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2w2n h ASP 129 Cb 0.25 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.76 2w2n h ASP 129 CO 0.00 0.00 0.00 0.18 -3.12 0.00 0.00 179.24 176.30 2w2n n LEU 130 N -4.19 2.18 -0.15 1.55 4.77 -0.88 -4.35 117.00 115.93 2w2n n LEU 130 Ca 0.10 -1.09 -0.12 0.00 -0.03 0.00 0.00 56.01 54.87 2w2n n LEU 130 Cb 0.63 -0.27 -0.01 0.00 -2.33 0.00 0.00 43.42 41.44 2w2n n LEU 130 CO 0.35 0.54 0.65 -0.07 -1.33 0.00 0.00 177.39 177.53 2w2n h LEU 131 N 2.38 1.01 -0.67 2.23 3.38 -1.72 -0.99 115.31 120.93 2w2n h LEU 131 Ca 0.00 -0.40 0.03 0.00 0.09 0.00 0.00 57.88 57.60 2w2n h LEU 131 Cb 0.54 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.97 2w2n h LEU 131 CO 0.00 1.19 0.41 -0.33 0.09 0.00 0.00 178.44 179.80 2w2n h GLU 132 N 0.83 0.77 -0.16 1.13 5.08 -1.84 0.18 114.58 120.57 2w2n h GLU 132 Ca 0.10 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.42 2w2n h GLU 132 Cb 0.81 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.88 2w2n h GLU 132 CO 0.07 0.51 0.09 1.25 -1.00 0.00 0.00 179.01 179.93 2w2n h LEU 133 N 0.79 0.19 -0.79 1.33 5.85 -1.79 -2.84 115.31 118.05 2w2n h LEU 133 Ca 0.28 -0.06 -0.07 0.00 0.84 0.00 0.00 57.88 58.87 2w2n h LEU 133 Cb 0.05 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.01 2w2n h LEU 133 CO -0.12 0.19 0.13 0.00 -0.34 0.00 0.00 178.44 178.30 2w2n h ALA 134 N 1.01 1.01 0.00 1.25 0.00 -0.85 -2.62 119.26 119.05 2w2n h ALA 134 Ca 0.06 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.70 2w2n h ALA 134 Cb 0.04 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.58 2w2n h ALA 134 CO -0.01 0.64 -0.06 -0.07 0.00 0.00 0.00 179.25 179.75 2w2n h LEU 135 N 0.98 0.00 -1.66 0.00 3.38 -0.52 -2.60 115.31 114.90 2w2n h LEU 135 Ca 0.20 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.17 2w2n h LEU 135 Cb 0.39 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.14 2w2n h LEU 135 CO 0.01 0.06 0.00 0.29 0.09 0.00 0.00 178.44 178.89 2w2n n LYS 136 N -4.02 2.09 -1.99 1.13 5.02 -1.00 -4.60 118.16 114.78 2w2n n LYS 136 Ca -0.03 -1.64 -0.33 0.00 -2.02 0.00 0.00 58.31 54.29 2w2n n LYS 136 Cb 0.15 -1.45 0.02 0.00 -0.02 0.00 0.00 35.03 33.74 2w2n n LYS 136 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2w2n s LEU 137 N -1.54 3.53 0.52 -0.35 1.43 -0.98 -5.00 118.68 116.28 2w2n s LEU 137 Ca 0.35 1.99 -0.20 0.00 -1.03 0.00 0.00 54.13 55.24 2w2n s LEU 137 Cb 0.20 -4.55 -0.07 0.00 0.03 0.00 0.00 46.19 41.79 2w2n s LEU 137 CO 0.28 -1.37 1.10 -2.16 0.23 0.00 0.00 176.35 174.43 2w2n s PRO 138 N -3.85 3.54 0.00 1.29 0.04 -1.26 -3.43 135.00 131.33 2w2n s PRO 138 Ca 0.67 1.53 0.00 0.00 0.04 0.00 0.00 61.00 63.24 2w2n s PRO 138 Cb -0.20 -2.06 0.00 0.00 0.04 0.00 0.00 34.50 32.29 2w2n s PRO 138 CO 0.36 -0.68 0.00 0.72 0.04 0.00 0.00 177.00 177.44 2w2n n HIS 139 N -1.14 0.00 -2.40 0.56 8.25 -1.26 -4.92 115.22 114.32 2w2n n HIS 139 Ca 0.11 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.14 2w2n n HIS 139 Cb 0.51 -0.38 -0.03 0.00 1.12 0.00 0.00 29.99 31.22 2w2n n HIS 139 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2w2n s VAL 140 N -3.02 4.04 -0.23 1.59 1.01 -1.22 0.07 120.40 122.64 2w2n s VAL 140 Ca 0.00 1.43 -0.17 0.00 0.00 0.00 0.00 61.98 63.24 2w2n s VAL 140 Cb 0.00 -3.92 -0.13 0.00 0.00 0.00 0.00 36.38 32.33 2w2n s VAL 140 CO 0.00 0.06 -0.10 -0.67 0.00 0.00 0.00 175.10 174.40 2w2n n ASP 141 N 4.49 1.90 -3.64 3.32 2.03 0.48 -4.58 116.55 120.56 2w2n n ASP 141 Ca 0.10 0.41 -0.10 0.00 0.52 0.00 0.00 54.79 55.72 2w2n n ASP 141 Cb 0.46 -0.88 -0.02 0.00 -0.72 0.00 0.00 41.12 39.96 2w2n n ASP 141 CO 0.00 0.00 0.00 -0.72 -1.92 0.00 0.00 177.20 174.56 2w2n s TYR 142 N -2.45 -0.37 -0.06 -0.67 1.13 -0.95 -3.43 117.35 110.55 2w2n s TYR 142 Ca -0.31 0.03 0.04 0.00 -1.41 0.00 0.00 57.07 55.43 2w2n s TYR 142 Cb 0.09 0.63 -0.00 0.00 -1.10 0.00 0.00 41.96 41.58 2w2n s TYR 142 CO 0.50 -1.04 -0.19 0.42 -2.51 0.00 0.00 175.55 172.72 2w2n s ILE 143 N -3.83 1.65 -0.09 -3.49 1.01 -0.23 -0.77 121.20 115.44 2w2n s ILE 143 Ca 0.06 -0.82 0.04 0.00 0.00 0.00 0.00 60.65 59.94 2w2n s ILE 143 Cb -0.03 -1.43 -0.00 0.00 0.01 0.00 0.00 42.46 41.00 2w2n s ILE 143 CO -0.03 0.47 -0.24 -0.70 0.00 0.00 0.00 174.94 174.44 2w2n s GLU 144 N 0.19 2.97 0.16 2.79 2.12 -0.28 -0.65 118.70 126.01 2w2n s GLU 144 Ca -0.10 -0.88 -0.30 0.00 0.36 0.00 0.00 54.97 54.05 2w2n s GLU 144 Cb -0.14 -2.28 -0.07 0.00 0.26 0.00 0.00 34.13 31.89 2w2n s GLU 144 CO 0.04 0.21 1.15 -2.00 -0.54 0.00 0.00 175.26 174.13 2w2n s GLU 145 N 0.25 4.53 0.93 4.30 2.12 0.63 -0.62 118.70 130.85 2w2n s GLU 145 Ca -0.16 1.78 -0.10 0.00 0.36 0.00 0.00 54.97 56.85 2w2n s GLU 145 Cb -0.17 -3.27 0.15 0.00 0.26 0.00 0.00 34.13 31.09 2w2n s GLU 145 CO 0.08 -0.04 1.09 -3.47 -0.54 0.00 0.00 175.26 172.38 2w2n n ASP 146 N 2.66 0.08 -3.79 -1.70 -0.08 -0.19 -4.54 116.55 108.99 2w2n n ASP 146 Ca 0.04 0.39 -0.08 0.00 -1.51 0.00 0.00 54.79 53.63 2w2n n ASP 146 Cb 0.46 -1.45 -0.02 0.00 2.34 0.00 0.00 41.12 42.44 2w2n n ASP 146 CO 0.00 0.00 0.00 -0.94 0.12 0.00 0.00 177.20 176.38 2w2n s SER 147 N -2.58 -0.31 0.20 1.67 1.04 -1.26 -1.39 113.70 111.07 2w2n s SER 147 Ca 0.66 -0.51 -0.14 0.00 0.48 0.00 0.00 55.95 56.44 2w2n s SER 147 Cb -0.23 0.70 -0.07 0.00 0.10 0.00 0.00 66.02 66.52 2w2n s SER 147 CO 0.59 -1.27 0.59 -0.44 0.98 0.00 0.00 173.24 173.68 2w2n s SER 148 N -2.89 6.79 0.15 7.02 0.01 0.60 -4.88 113.70 120.50 2w2n s SER 148 Ca 0.10 1.10 0.09 0.00 1.31 0.00 0.00 55.95 58.54 2w2n s SER 148 Cb -0.05 -2.30 -0.04 0.00 0.21 0.00 0.00 66.02 63.84 2w2n s SER 148 CO 0.03 0.02 -0.21 0.68 0.41 0.00 0.00 173.24 174.17 2w2n s VAL 149 N -1.62 1.93 0.02 3.43 -7.23 -1.26 -5.01 120.40 110.67 2w2n s VAL 149 Ca 0.43 -1.83 0.02 0.00 -1.81 0.00 0.00 61.98 58.79 2w2n s VAL 149 Cb -0.14 -1.84 -0.02 0.00 0.56 0.00 0.00 36.38 34.95 2w2n s VAL 149 CO 0.20 -0.18 -0.08 -0.36 -0.31 0.00 0.00 175.10 174.37 2w2n s PHE 150 N -1.67 0.68 0.33 2.82 0.08 -1.26 -5.13 117.98 113.84 2w2n s PHE 150 Ca 0.14 -0.31 -0.29 0.00 0.12 0.00 0.00 56.93 56.60 2w2n s PHE 150 Cb -0.08 -0.42 -0.12 0.00 -0.57 0.00 0.00 43.02 41.84 2w2n s PHE 150 CO 0.07 -0.03 1.47 0.00 -0.10 0.00 0.00 175.22 176.63 2w2n n ALA 151 N 2.16 2.08 0.43 5.36 0.00 -1.26 -5.37 120.51 123.91 2w2n n ALA 151 Ca -0.18 0.36 0.05 0.00 0.00 0.00 0.00 53.44 53.68 2w2n n ALA 151 Cb 0.56 -2.39 0.04 0.00 0.00 0.00 0.00 19.45 17.67 2w2n n ALA 151 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54