#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2w4y n LEU 2 N 0.00 0.52 0.00 0.00 4.77 -1.26 -5.01 117.00 116.02 2w4y n LEU 2 Ca 0.00 0.56 0.00 0.00 -0.03 0.00 0.00 56.01 56.54 2w4y n LEU 2 Cb 0.00 -0.42 0.00 0.00 -2.33 0.00 0.00 43.42 40.67 2w4y n LEU 2 CO 0.00 -0.20 0.00 0.61 -1.33 0.00 0.00 177.39 176.47 2w4y n GLY 3 N 1.06 3.02 0.15 -0.72 0.00 -1.26 -4.86 105.19 102.58 2w4y n GLY 3 Ca 0.05 -2.00 0.03 0.00 0.00 0.00 0.00 46.02 44.10 2w4y n GLY 3 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2w4y h ASP 4 N 0.00 0.00 -1.97 1.61 1.82 -1.95 -3.46 116.42 112.47 2w4y h ASP 4 Ca 0.00 0.00 -0.60 0.00 -0.39 0.00 0.00 57.03 56.04 2w4y h ASP 4 Cb 0.00 0.00 -0.13 0.00 0.68 0.00 0.00 39.33 39.88 2w4y h ASP 4 CO 0.00 0.48 -0.63 0.42 -1.61 0.00 0.00 179.24 177.90 2w4y s THR 5 N -3.08 1.99 -0.08 2.25 -4.23 -1.26 0.16 115.64 111.39 2w4y s THR 5 Ca 0.03 -2.08 -0.03 0.00 -1.18 0.00 0.00 61.69 58.43 2w4y s THR 5 Cb 0.08 -2.83 0.04 0.00 1.34 0.00 0.00 72.50 71.14 2w4y s THR 5 CO 0.73 -0.09 0.17 -0.22 -0.54 0.00 0.00 174.62 174.68 2w4y s LEU 6 N -3.64 0.47 -0.22 4.79 0.20 -0.16 -4.94 118.68 115.18 2w4y s LEU 6 Ca 0.34 0.36 -0.08 0.00 0.69 0.00 0.00 54.13 55.44 2w4y s LEU 6 Cb 0.07 0.43 -0.04 0.00 -0.43 0.00 0.00 46.19 46.22 2w4y s LEU 6 CO 0.17 -0.17 0.09 -0.89 -0.29 0.00 0.00 176.35 175.25 2w4y s THR 7 N 1.45 4.71 -0.37 3.68 2.01 -1.26 0.12 115.64 125.99 2w4y s THR 7 Ca -0.07 -0.05 -0.13 0.00 0.31 0.00 0.00 61.69 61.76 2w4y s THR 7 Cb -0.11 -3.17 0.00 0.00 0.01 0.00 0.00 72.50 69.23 2w4y s THR 7 CO -0.07 0.38 0.24 -0.63 -0.69 0.00 0.00 174.62 173.86 2w4y s ILE 8 N 1.06 5.04 -0.58 1.82 1.01 0.54 -4.88 121.20 125.21 2w4y s ILE 8 Ca 0.05 -0.51 -0.16 0.00 0.00 0.00 0.00 60.65 60.02 2w4y s ILE 8 Cb -0.14 -3.70 0.13 0.00 0.01 0.00 0.00 42.46 38.76 2w4y s ILE 8 CO 0.03 -0.14 0.56 -0.89 0.00 0.00 0.00 174.94 174.50 2w4y s THR 9 N 1.66 5.19 0.21 2.92 2.01 -1.26 0.37 115.64 126.74 2w4y s THR 9 Ca 0.05 -1.52 -0.32 0.00 0.31 0.00 0.00 61.69 60.21 2w4y s THR 9 Cb -0.18 -4.38 -0.12 0.00 0.01 0.00 0.00 72.50 67.83 2w4y s THR 9 CO 0.09 -0.93 1.70 -0.76 -0.69 0.00 0.00 174.62 174.03 2w4y s LEU 10 N 1.63 4.37 0.00 4.42 1.43 -0.21 -2.06 118.68 128.26 2w4y s LEU 10 Ca 0.06 2.86 0.00 0.00 -1.03 0.00 0.00 54.13 56.02 2w4y s LEU 10 Cb -0.27 -3.60 0.00 0.00 0.03 0.00 0.00 46.19 42.34 2w4y s LEU 10 CO 0.02 -0.96 0.00 0.61 0.23 0.00 0.00 176.35 176.26 2w4y n GLY 11 N 3.77 0.61 5.64 -3.19 0.00 -1.26 -4.07 105.19 106.70 2w4y n GLY 11 Ca 0.15 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.83 2w4y n GLY 11 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2w4y n GLY 12 N -2.70 -1.68 0.15 -0.02 0.00 -0.88 -3.88 105.19 96.18 2w4y n GLY 12 Ca 0.00 -1.47 0.08 0.00 0.00 0.00 0.00 46.02 44.63 2w4y n GLY 12 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2w4y n SER 13 N 0.18 0.41 0.00 1.61 3.41 -1.26 -3.25 113.62 114.71 2w4y n SER 13 Ca 0.00 0.64 0.00 0.00 -0.26 0.00 0.00 58.87 59.25 2w4y n SER 13 Cb 0.00 -0.64 0.00 0.00 -0.26 0.00 0.00 64.21 63.31 2w4y n SER 13 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2w4y n GLY 14 N -1.30 -3.30 0.00 5.00 0.00 -1.25 -4.99 105.19 99.35 2w4y n GLY 14 Ca -0.01 0.47 0.00 0.00 0.00 0.00 0.00 46.02 46.48 2w4y n GLY 14 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2w4y n GLY 15 N -0.86 0.87 2.55 -0.02 0.00 -1.20 -5.06 105.19 101.48 2w4y n GLY 15 Ca 0.00 -0.72 -0.02 0.00 0.00 0.00 0.00 46.02 45.28 2w4y n GLY 15 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2w4y n THR 16 N 0.00 -6.88 -2.95 2.61 -1.04 -1.26 -3.23 114.28 101.52 2w4y n THR 16 Ca 0.00 -0.32 -0.40 0.00 -2.04 0.00 0.00 64.05 61.29 2w4y n THR 16 Cb 0.00 -5.66 -0.05 0.00 -1.82 0.00 0.00 70.33 62.80 2w4y n THR 16 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2w4y s ALA 17 N -3.06 3.35 -0.24 2.41 0.00 -1.26 -1.04 121.76 121.91 2w4y s ALA 17 Ca 0.07 0.31 -0.03 0.00 0.00 0.00 0.00 51.96 52.30 2w4y s ALA 17 Cb -0.01 -3.03 0.01 0.00 0.00 0.00 0.00 23.12 20.09 2w4y s ALA 17 CO 0.49 0.03 -0.04 0.15 0.00 0.00 0.00 175.76 176.39 2w4y s LYS 18 N 0.06 3.02 -0.48 0.00 -0.14 0.16 -4.93 119.74 117.43 2w4y s LYS 18 Ca 0.40 -0.86 -0.19 0.00 -1.36 0.00 0.00 55.97 53.96 2w4y s LYS 18 Cb -0.21 -3.03 0.05 0.00 -1.68 0.00 0.00 37.83 32.97 2w4y s LYS 18 CO 0.23 -0.34 0.57 0.08 -0.76 0.00 0.00 175.35 175.13 2w4y s VAL 19 N 1.39 4.94 0.32 3.17 1.01 -1.26 -0.34 120.40 129.63 2w4y s VAL 19 Ca 0.02 -0.49 -0.15 0.00 0.00 0.00 0.00 61.98 61.36 2w4y s VAL 19 Cb -0.16 -4.23 -0.09 0.00 0.00 0.00 0.00 36.38 31.90 2w4y s VAL 19 CO -0.04 -0.71 0.74 -0.76 0.00 0.00 0.00 175.10 174.34 2w4y s LEU 20 N 2.46 4.08 -0.06 3.92 1.43 0.12 -4.83 118.68 125.79 2w4y s LEU 20 Ca 0.14 1.30 -0.05 0.00 -1.03 0.00 0.00 54.13 54.49 2w4y s LEU 20 Cb -0.19 -4.06 -0.04 0.00 0.03 0.00 0.00 46.19 41.93 2w4y s LEU 20 CO 0.12 -0.19 0.17 -0.13 0.23 0.00 0.00 176.35 176.55 2w4y s ARG 21 N -2.92 3.45 0.21 1.70 1.81 -0.68 -0.99 118.95 121.54 2w4y s ARG 21 Ca 0.54 -0.20 -0.30 0.00 -1.72 0.00 0.00 55.73 54.04 2w4y s ARG 21 Cb -0.11 -3.14 -0.09 0.00 -0.45 0.00 0.00 34.95 31.16 2w4y s ARG 21 CO 0.17 0.73 1.26 0.21 -0.68 0.00 0.00 175.30 176.99 2w4y s LYS 22 N -1.47 4.44 0.00 3.54 2.20 0.12 0.03 119.74 128.60 2w4y s LYS 22 Ca 0.21 1.99 0.00 0.00 -0.36 0.00 0.00 55.97 57.81 2w4y s LYS 22 Cb -0.12 -3.20 0.00 0.00 -1.51 0.00 0.00 37.83 32.99 2w4y s LYS 22 CO 0.11 -0.16 0.10 0.44 -0.36 0.00 0.00 175.35 175.48 2w4y n ILE 23 N 2.36 0.00 -3.56 5.43 -5.35 0.13 -4.89 119.36 113.48 2w4y n ILE 23 Ca 0.05 -0.30 -0.11 0.00 -0.27 0.00 0.00 62.75 62.13 2w4y n ILE 23 Cb 0.43 1.14 -0.05 0.00 -1.74 0.00 0.00 39.64 39.43 2w4y n ILE 23 CO 0.00 0.00 0.00 0.21 -1.76 0.00 0.00 176.55 175.00 2w4y s ASN 24 N -0.39 -0.38 -0.28 7.28 2.47 -1.14 -5.00 114.94 117.50 2w4y s ASN 24 Ca 0.00 0.35 0.00 0.00 0.42 0.00 0.00 52.86 53.64 2w4y s ASN 24 Cb 0.00 0.33 0.17 0.00 -1.45 0.00 0.00 41.25 40.30 2w4y s ASN 24 CO 0.00 -0.40 0.51 -1.58 -3.72 0.00 0.00 177.10 171.91 2w4y s GLN 25 N -1.44 0.48 0.01 0.43 2.00 -1.25 -1.14 119.66 118.74 2w4y s GLN 25 Ca -0.01 0.64 -0.00 0.00 -2.00 0.00 0.00 55.36 53.98 2w4y s GLN 25 Cb -0.01 0.07 -0.01 0.00 0.80 0.00 0.00 33.01 33.87 2w4y s GLN 25 CO 0.00 -0.78 -0.01 -0.51 -0.50 0.00 0.00 175.29 173.49 2w4y s ASP 26 N 2.71 0.08 -1.35 6.67 -0.00 -0.23 -4.91 116.67 119.65 2w4y s ASP 26 Ca 0.15 -0.17 -0.08 0.00 -0.00 0.00 0.00 52.55 52.45 2w4y s ASP 26 Cb -0.14 0.04 0.00 0.00 -0.00 0.00 0.00 42.92 42.83 2w4y s ASP 26 CO -0.22 -0.11 0.47 0.61 -0.00 0.00 0.00 175.17 175.91 2w4y n GLY 27 N 2.53 -0.43 3.57 0.21 0.00 -1.26 -1.64 105.19 108.18 2w4y n GLY 27 Ca -0.16 0.23 -0.20 0.00 0.00 0.00 0.00 46.02 45.89 2w4y n GLY 27 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2w4y n TYR 28 N -4.44 -2.19 -3.71 1.61 4.02 -1.26 -4.76 117.16 106.43 2w4y n TYR 28 Ca -0.25 0.91 -0.11 0.00 -0.01 0.00 0.00 57.90 58.44 2w4y n TYR 28 Cb 0.66 -4.79 -0.12 0.00 -0.02 0.00 0.00 39.34 35.06 2w4y n TYR 28 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 176.86 176.84 2w4y s THR 29 N -3.45 -0.03 0.17 -0.72 2.01 -0.65 -2.50 115.64 110.47 2w4y s THR 29 Ca 0.11 0.11 0.10 0.00 0.31 0.00 0.00 61.69 62.32 2w4y s THR 29 Cb -0.05 -0.50 -0.04 0.00 0.01 0.00 0.00 72.50 71.92 2w4y s THR 29 CO 0.76 0.05 -0.23 -0.44 -0.69 0.00 0.00 174.62 174.07 2w4y s SER 30 N 1.25 3.14 -0.03 3.53 0.01 -0.56 -1.06 113.70 119.98 2w4y s SER 30 Ca -0.09 -0.83 -0.00 0.00 1.31 0.00 0.00 55.95 56.34 2w4y s SER 30 Cb -0.09 -0.21 0.03 0.00 0.21 0.00 0.00 66.02 65.96 2w4y s SER 30 CO -0.10 0.09 0.01 -0.70 0.41 0.00 0.00 173.24 172.95 2w4y s GLU 31 N -2.53 0.26 0.20 12.44 2.12 -0.30 -1.58 118.70 129.32 2w4y s GLU 31 Ca 0.17 0.12 0.09 0.00 0.36 0.00 0.00 54.97 55.71 2w4y s GLU 31 Cb -0.08 -0.50 -0.04 0.00 0.26 0.00 0.00 34.13 33.76 2w4y s GLU 31 CO 0.08 -0.17 -0.08 0.71 -0.54 0.00 0.00 175.26 175.26 2w4y s TYR 32 N 1.22 2.64 -0.11 5.30 1.51 0.03 0.17 117.35 128.12 2w4y s TYR 32 Ca -0.07 -0.22 -0.21 0.00 -1.01 0.00 0.00 57.07 55.56 2w4y s TYR 32 Cb -0.13 -1.26 0.05 0.00 -0.11 0.00 0.00 41.96 40.50 2w4y s TYR 32 CO -0.02 0.54 0.51 -0.47 -1.11 0.00 0.00 175.55 175.00 2w4y s TYR 33 N -1.84 -0.49 -0.27 2.71 5.04 0.10 -1.67 117.35 120.93 2w4y s TYR 33 Ca 0.26 1.02 -0.02 0.00 -2.44 0.00 0.00 57.07 55.89 2w4y s TYR 33 Cb -0.08 0.23 0.11 0.00 0.35 0.00 0.00 41.96 42.57 2w4y s TYR 33 CO 0.16 -0.41 0.23 -1.17 -1.34 0.00 0.00 175.55 173.02 2w4y s LEU 34 N -0.59 0.02 0.09 6.97 2.96 0.28 -1.69 118.68 126.73 2w4y s LEU 34 Ca -0.07 -0.79 -0.27 0.00 -0.22 0.00 0.00 54.13 52.78 2w4y s LEU 34 Cb -0.03 0.22 -0.06 0.00 0.50 0.00 0.00 46.19 46.82 2w4y s LEU 34 CO 0.04 -0.39 0.85 -2.16 -1.32 0.00 0.00 176.35 173.37 2w4y s PRO 35 N 2.27 4.60 0.41 0.98 0.04 -1.26 -0.80 135.00 141.24 2w4y s PRO 35 Ca 0.08 1.24 0.02 0.00 0.04 0.00 0.00 61.00 62.38 2w4y s PRO 35 Cb -0.15 -3.35 -0.01 0.00 0.04 0.00 0.00 34.50 31.03 2w4y s PRO 35 CO -0.29 0.30 0.06 0.39 0.04 0.00 0.00 177.00 177.50 2w4y n GLU 36 N 2.61 0.76 0.15 4.56 1.02 -0.25 -4.97 120.64 124.53 2w4y n GLU 36 Ca -0.01 -3.21 -0.14 0.00 -0.02 0.00 0.00 57.16 53.78 2w4y n GLU 36 Cb 0.49 1.27 -0.06 0.00 -0.02 0.00 0.00 31.44 33.12 2w4y n GLU 36 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2w4y h THR 37 N 1.41 0.42 -0.09 2.62 1.03 -2.02 -3.32 112.91 112.96 2w4y h THR 37 Ca -0.33 0.00 0.00 0.00 -0.01 0.00 0.00 66.41 66.07 2w4y h THR 37 Cb 1.12 0.42 0.00 0.00 -1.07 0.00 0.00 68.15 68.62 2w4y h THR 37 CO 0.54 0.00 0.00 -1.54 -0.01 0.00 0.00 175.52 174.51 2w4y n SER 38 N -5.39 1.98 -3.71 0.00 3.41 -1.26 -5.03 113.62 103.62 2w4y n SER 38 Ca -0.08 -1.58 -0.05 0.00 -0.26 0.00 0.00 58.87 56.90 2w4y n SER 38 Cb 0.30 -0.06 -0.02 0.00 -0.26 0.00 0.00 64.21 64.17 2w4y n SER 38 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2w4y s SER 39 N -0.74 -0.23 0.09 4.04 1.04 -1.25 -2.45 113.70 114.20 2w4y s SER 39 Ca 0.10 -0.34 0.02 0.00 0.48 0.00 0.00 55.95 56.21 2w4y s SER 39 Cb 0.06 0.50 -0.04 0.00 0.10 0.00 0.00 66.02 66.64 2w4y s SER 39 CO 0.09 -0.90 -0.07 -0.94 0.98 0.00 0.00 173.24 172.39 2w4y s SER 40 N -2.86 1.11 0.01 7.02 1.04 -0.26 -1.08 113.70 118.68 2w4y s SER 40 Ca 0.11 -0.89 0.08 0.00 0.48 0.00 0.00 55.95 55.73 2w4y s SER 40 Cb -0.02 0.07 -0.02 0.00 0.10 0.00 0.00 66.02 66.15 2w4y s SER 40 CO 0.00 -0.39 -0.26 -0.36 0.98 0.00 0.00 173.24 173.22 2w4y s PHE 41 N -3.04 2.27 -0.01 5.02 0.40 0.02 -0.57 117.98 122.07 2w4y s PHE 41 Ca 0.07 -0.42 -0.01 0.00 -0.60 0.00 0.00 56.93 55.96 2w4y s PHE 41 Cb 0.01 -1.41 0.00 0.00 0.51 0.00 0.00 43.02 42.13 2w4y s PHE 41 CO -0.03 0.04 0.03 0.50 0.70 0.00 0.00 175.22 176.47 2w4y s ARG 42 N -0.92 0.07 0.00 0.44 3.52 -0.07 -0.55 118.95 121.44 2w4y s ARG 42 Ca 0.11 0.00 0.04 0.00 -0.13 0.00 0.00 55.73 55.75 2w4y s ARG 42 Cb -0.10 0.03 -0.01 0.00 -1.56 0.00 0.00 34.95 33.31 2w4y s ARG 42 CO 0.01 -0.01 -0.14 0.00 -0.81 0.00 0.00 175.30 174.34 2w4y s ALA 43 N -0.10 1.18 -0.03 6.12 0.00 -0.67 -0.40 121.76 127.87 2w4y s ALA 43 Ca -0.01 -0.66 0.02 0.00 0.00 0.00 0.00 51.96 51.31 2w4y s ALA 43 Cb -0.01 -0.27 0.00 0.00 0.00 0.00 0.00 23.12 22.84 2w4y s ALA 43 CO 0.00 0.27 -0.09 0.15 0.00 0.00 0.00 175.76 176.10 2w4y s LYS 44 N -0.52 0.92 -0.15 0.00 1.02 -0.37 -0.79 119.74 119.85 2w4y s LYS 44 Ca 0.05 -0.29 0.01 0.00 0.02 0.00 0.00 55.97 55.76 2w4y s LYS 44 Cb -0.06 -0.87 0.02 0.00 -0.52 0.00 0.00 37.83 36.40 2w4y s LYS 44 CO -0.00 0.10 -0.16 0.08 -0.92 0.00 0.00 175.35 174.45 2w4y s VAL 45 N 0.22 1.73 0.05 3.17 1.01 -0.61 -0.70 120.40 125.26 2w4y s VAL 45 Ca -0.03 -0.74 0.04 0.00 0.00 0.00 0.00 61.98 61.25 2w4y s VAL 45 Cb -0.09 -1.59 -0.02 0.00 0.00 0.00 0.00 36.38 34.68 2w4y s VAL 45 CO 0.00 0.49 -0.13 -0.13 0.00 0.00 0.00 175.10 175.33 2w4y s ARG 46 N 1.35 0.83 -0.02 2.72 3.00 0.35 -1.49 118.95 125.68 2w4y s ARG 46 Ca 0.03 -0.79 0.05 0.00 0.00 0.00 0.00 55.73 55.03 2w4y s ARG 46 Cb -0.13 -0.81 -0.01 0.00 0.00 0.00 0.00 34.95 34.00 2w4y s ARG 46 CO -0.10 0.19 -0.18 -1.01 0.00 0.00 0.00 175.30 174.20 2w4y s HIS 47 N -1.00 1.64 0.04 -0.53 3.76 -1.04 -0.63 115.29 117.54 2w4y s HIS 47 Ca -0.01 -0.34 -0.05 0.00 -0.15 0.00 0.00 55.06 54.51 2w4y s HIS 47 Cb -0.08 -1.07 -0.01 0.00 1.11 0.00 0.00 32.58 32.53 2w4y s HIS 47 CO 0.01 -0.05 0.09 0.99 -0.85 0.00 0.00 174.74 174.93 2w4y s THR 48 N -0.35 0.14 -0.25 1.30 2.01 0.21 -4.88 115.64 113.81 2w4y s THR 48 Ca 0.05 -1.15 -0.00 0.00 0.31 0.00 0.00 61.69 60.90 2w4y s THR 48 Cb -0.08 -0.95 0.04 0.00 0.01 0.00 0.00 72.50 71.52 2w4y s THR 48 CO -0.00 -0.63 -0.08 -0.54 -0.69 0.00 0.00 174.62 172.67 2w4y s LYS 49 N -2.74 2.63 0.44 4.92 1.02 -1.26 -0.70 119.74 124.04 2w4y s LYS 49 Ca -0.04 -1.11 -0.25 0.00 0.02 0.00 0.00 55.97 54.59 2w4y s LYS 49 Cb -0.00 -2.95 -0.08 0.00 -0.52 0.00 0.00 37.83 34.28 2w4y s LYS 49 CO -0.05 -0.46 1.33 -1.21 -0.92 0.00 0.00 175.35 174.04 2w4y s GLU 50 N 1.25 3.77 -0.34 1.68 2.02 0.20 -4.86 118.70 122.41 2w4y s GLU 50 Ca -0.03 2.21 -0.40 0.00 0.02 0.00 0.00 54.97 56.77 2w4y s GLU 50 Cb -0.18 -2.64 -0.16 0.00 0.10 0.00 0.00 34.13 31.26 2w4y s GLU 50 CO -0.05 -0.68 1.86 -1.13 0.02 0.00 0.00 175.26 175.28 2w4y n SER 51 N -0.16 2.04 -4.71 -0.19 3.41 -1.26 -4.55 113.62 108.19 2w4y n SER 51 Ca 0.05 0.93 -0.42 0.00 -0.26 0.00 0.00 58.87 59.17 2w4y n SER 51 Cb 0.44 -1.11 -0.03 0.00 -0.26 0.00 0.00 64.21 63.25 2w4y n SER 51 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2w4y s VAL 52 N 4.45 3.18 0.07 -3.33 1.01 -1.26 -4.94 120.40 119.58 2w4y s VAL 52 Ca 1.04 0.84 0.10 0.00 0.00 0.00 0.00 61.98 63.95 2w4y s VAL 52 Cb -1.13 -3.54 -0.03 0.00 0.00 0.00 0.00 36.38 31.68 2w4y s VAL 52 CO 0.65 0.06 -0.26 -0.54 0.00 0.00 0.00 175.10 175.01 2w4y s LYS 53 N 1.17 1.70 0.00 2.72 -0.14 -1.26 -5.10 119.74 118.83 2w4y s LYS 53 Ca 0.66 -1.17 0.00 0.00 -1.36 0.00 0.00 55.97 54.09 2w4y s LYS 53 Cb -0.38 -1.96 0.00 0.00 -1.68 0.00 0.00 37.83 33.81 2w4y s LYS 53 CO 0.30 0.50 0.00 -0.35 -0.76 0.00 0.00 175.35 175.04 2w4y n PRO 54 N 1.53 0.00 -3.04 -1.68 -0.04 -1.26 -3.58 135.00 126.94 2w4y n PRO 54 Ca -0.17 0.00 -0.45 0.00 -0.04 0.00 0.00 63.50 62.84 2w4y n PRO 54 Cb 0.52 -0.07 -0.02 0.00 -0.04 0.00 0.00 33.50 33.89 2w4y n PRO 54 CO 0.00 0.00 0.00 1.21 -0.04 0.00 0.00 175.50 176.67 2w4y s ASN 55 N -0.75 6.75 0.00 3.54 3.84 -1.26 -4.94 114.94 122.13 2w4y s ASN 55 Ca 0.00 -2.38 0.00 0.00 0.21 0.00 0.00 52.86 50.69 2w4y s ASN 55 Cb 0.00 -2.35 0.00 0.00 -0.55 0.00 0.00 41.25 38.35 2w4y s ASN 55 CO 0.00 -0.88 0.00 0.00 -2.79 0.00 0.00 177.10 173.43 2w4y n GLN 56 N 5.67 0.00 -1.80 0.43 10.64 -1.23 -5.15 117.38 125.94 2w4y n GLN 56 Ca 0.23 0.00 -0.39 0.00 -1.83 0.00 0.00 57.00 55.01 2w4y n GLN 56 Cb 0.47 0.00 0.02 0.00 -0.86 0.00 0.00 30.24 29.88 2w4y n GLN 56 CO 0.00 0.00 0.00 0.08 -1.83 0.00 0.00 177.06 175.31 2w4y s VAL 57 N -2.00 2.07 -0.14 -0.39 1.01 -1.26 -4.69 120.40 115.00 2w4y s VAL 57 Ca 0.00 0.06 -0.03 0.00 0.00 0.00 0.00 61.98 62.01 2w4y s VAL 57 Cb 0.00 -3.04 -0.03 0.00 0.00 0.00 0.00 36.38 33.31 2w4y s VAL 57 CO 0.00 0.01 -0.02 -1.58 0.00 0.00 0.00 175.10 173.51 2w4y s GLN 58 N -2.55 3.51 0.16 2.72 0.74 -1.26 -4.85 119.66 118.13 2w4y s GLN 58 Ca 0.63 -0.48 0.06 0.00 0.05 0.00 0.00 55.36 55.62 2w4y s GLN 58 Cb -0.43 -2.90 -0.04 0.00 1.10 0.00 0.00 33.01 30.74 2w4y s GLN 58 CO 0.54 0.37 0.06 0.71 -0.55 0.00 0.00 175.29 176.42 2w4y s TYR 59 N 0.03 2.99 0.14 1.67 1.51 -1.26 -0.42 117.35 122.01 2w4y s TYR 59 Ca 0.01 -0.07 0.07 0.00 -1.01 0.00 0.00 57.07 56.07 2w4y s TYR 59 Cb -0.13 -1.45 -0.04 0.00 -0.11 0.00 0.00 41.96 40.23 2w4y s TYR 59 CO 0.02 0.52 -0.06 -1.21 -1.11 0.00 0.00 175.55 173.71 2w4y s GLU 60 N -2.94 2.24 -0.04 -0.62 2.02 0.74 -0.63 118.70 119.48 2w4y s GLU 60 Ca 0.29 -1.08 0.00 0.00 0.02 0.00 0.00 54.97 54.20 2w4y s GLU 60 Cb -0.10 -2.31 0.03 0.00 0.10 0.00 0.00 34.13 31.84 2w4y s GLU 60 CO 0.21 0.48 -0.01 0.50 0.02 0.00 0.00 175.26 176.46 2w4y s ARG 61 N -2.58 0.45 -0.05 1.61 3.52 0.12 -1.83 118.95 120.19 2w4y s ARG 61 Ca 0.24 0.05 0.06 0.00 -0.13 0.00 0.00 55.73 55.95 2w4y s ARG 61 Cb -0.10 -0.63 -0.02 0.00 -1.56 0.00 0.00 34.95 32.64 2w4y s ARG 61 CO 0.16 -0.15 -0.22 -1.01 -0.81 0.00 0.00 175.30 173.27 2w4y s HIS 62 N 1.17 2.50 -0.00 5.12 3.76 0.86 -0.62 115.29 128.08 2w4y s HIS 62 Ca -0.07 -0.48 0.00 0.00 -0.15 0.00 0.00 55.06 54.36 2w4y s HIS 62 Cb -0.13 -1.59 -0.00 0.00 1.11 0.00 0.00 32.58 31.96 2w4y s HIS 62 CO -0.02 -0.06 -0.02 1.21 -0.85 0.00 0.00 174.74 175.01 2w4y s ASN 63 N -0.41 0.19 -0.05 1.40 3.84 0.20 -0.32 114.94 119.79 2w4y s ASN 63 Ca 0.04 -0.05 0.02 0.00 0.21 0.00 0.00 52.86 53.09 2w4y s ASN 63 Cb -0.12 -0.02 0.01 0.00 -0.55 0.00 0.00 41.25 40.58 2w4y s ASN 63 CO 0.02 0.01 -0.11 -0.69 -2.79 0.00 0.00 177.10 173.53 2w4y s VAL 64 N -0.09 1.02 -0.04 -5.21 1.01 -0.68 -0.50 120.40 115.91 2w4y s VAL 64 Ca 0.00 -0.43 -0.01 0.00 0.00 0.00 0.00 61.98 61.55 2w4y s VAL 64 Cb -0.01 -0.93 0.03 0.00 0.00 0.00 0.00 36.38 35.47 2w4y s VAL 64 CO -0.00 0.32 0.01 -0.70 0.00 0.00 0.00 175.10 174.74 2w4y s GLU 65 N 0.59 0.30 -0.13 2.72 2.12 0.12 -0.51 118.70 123.90 2w4y s GLU 65 Ca -0.12 0.16 -0.06 0.00 0.36 0.00 0.00 54.97 55.30 2w4y s GLU 65 Cb -0.14 -0.62 -0.04 0.00 0.26 0.00 0.00 34.13 33.58 2w4y s GLU 65 CO 0.03 -0.23 0.10 -0.06 -0.54 0.00 0.00 175.26 174.56 2w4y s PHE 66 N 1.55 3.46 -0.04 5.30 0.08 0.62 -1.24 117.98 127.71 2w4y s PHE 66 Ca -0.02 0.40 -0.01 0.00 0.12 0.00 0.00 56.93 57.41 2w4y s PHE 66 Cb -0.13 -1.95 0.03 0.00 -0.57 0.00 0.00 43.02 40.41 2w4y s PHE 66 CO -0.03 0.58 0.09 0.99 -0.10 0.00 0.00 175.22 176.75 2w4y s THR 67 N -0.71 -0.05 -0.13 0.64 2.01 0.47 -1.39 115.64 116.46 2w4y s THR 67 Ca 0.13 0.20 -0.00 0.00 0.31 0.00 0.00 61.69 62.32 2w4y s THR 67 Cb -0.12 -0.16 -0.01 0.00 0.01 0.00 0.00 72.50 72.22 2w4y s THR 67 CO 0.03 0.08 -0.13 -0.70 -0.69 0.00 0.00 174.62 173.21 2w4y s GLU 68 N 1.10 3.37 -0.28 4.92 2.12 0.10 -0.89 118.70 129.14 2w4y s GLU 68 Ca -0.09 -0.69 -0.05 0.00 0.36 0.00 0.00 54.97 54.50 2w4y s GLU 68 Cb -0.12 -2.64 0.01 0.00 0.26 0.00 0.00 34.13 31.64 2w4y s GLU 68 CO -0.04 0.18 0.04 0.99 -0.54 0.00 0.00 175.26 175.89 2w4y s THR 69 N 0.43 3.65 -0.34 -1.70 2.01 0.27 -1.27 115.64 118.69 2w4y s THR 69 Ca -0.10 -0.80 -0.18 0.00 0.31 0.00 0.00 61.69 60.92 2w4y s THR 69 Cb -0.16 -2.88 -0.01 0.00 0.01 0.00 0.00 72.50 69.47 2w4y s THR 69 CO 0.05 0.11 0.52 -0.69 -0.69 0.00 0.00 174.62 173.92 2w4y s VAL 70 N 1.45 5.02 0.80 3.82 1.01 -0.15 -1.10 120.40 131.24 2w4y s VAL 70 Ca 0.02 0.43 -0.12 0.00 0.00 0.00 0.00 61.98 62.31 2w4y s VAL 70 Cb -0.17 -3.95 0.08 0.00 0.00 0.00 0.00 36.38 32.34 2w4y s VAL 70 CO 0.00 -0.18 1.15 -0.31 0.00 0.00 0.00 175.10 175.77 2w4y s TYR 71 N 2.40 2.05 0.43 5.22 4.12 -1.02 -1.75 117.35 128.80 2w4y s TYR 71 Ca 0.19 1.66 -0.26 0.00 0.02 0.00 0.00 57.07 58.69 2w4y s TYR 71 Cb -0.15 -3.30 -0.09 0.00 -1.52 0.00 0.00 41.96 36.90 2w4y s TYR 71 CO 0.13 -2.43 1.44 0.00 0.02 0.00 0.00 175.55 174.71 2w4y s ALA 72 N -2.48 3.31 -0.31 3.71 0.00 -1.26 -4.64 121.76 120.09 2w4y s ALA 72 Ca 0.68 1.48 0.01 0.00 0.00 0.00 0.00 51.96 54.13 2w4y s ALA 72 Cb -0.23 -3.59 0.09 0.00 0.00 0.00 0.00 23.12 19.39 2w4y s ALA 72 CO 0.52 -1.15 0.06 0.45 0.00 0.00 0.00 175.76 175.64 2w4y s SER 73 N -0.43 4.20 1.83 0.00 0.15 0.97 -4.90 113.70 115.51 2w4y s SER 73 Ca 0.59 -1.72 0.00 0.00 0.70 0.00 0.00 55.95 55.53 2w4y s SER 73 Cb -0.44 -1.13 0.00 0.00 -1.71 0.00 0.00 66.02 62.74 2w4y s SER 73 CO 0.58 -0.38 0.00 0.61 1.20 0.00 0.00 173.24 175.25 2w4y n GLY 74 N 4.65 3.63 0.22 9.45 0.00 -1.26 -1.28 105.19 120.60 2w4y n GLY 74 Ca -0.02 -0.05 0.12 0.00 0.00 0.00 0.00 46.02 46.07 2w4y n GLY 74 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2w4y h SER 75 N 0.00 0.00 -2.97 1.61 4.64 -2.04 -3.43 113.55 111.36 2w4y h SER 75 Ca 0.00 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 60.75 2w4y h SER 75 Cb 0.00 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.05 2w4y h SER 75 CO 0.00 0.13 0.90 -0.89 -0.87 0.00 0.00 176.83 176.11 2w4y s THR 76 N -3.42 4.31 1.03 2.95 2.01 -0.41 -5.02 115.64 117.09 2w4y s THR 76 Ca 0.03 1.56 -0.13 0.00 0.31 0.00 0.00 61.69 63.47 2w4y s THR 76 Cb 0.08 -4.07 0.21 0.00 0.01 0.00 0.00 72.50 68.73 2w4y s THR 76 CO 0.64 -0.20 1.09 -2.16 -0.69 0.00 0.00 174.62 173.29 2w4y s PRO 77 N 3.58 0.19 0.40 4.92 0.04 -1.26 -0.02 135.00 142.85 2w4y s PRO 77 Ca 0.54 0.48 -0.23 0.00 0.04 0.00 0.00 61.00 61.82 2w4y s PRO 77 Cb -0.20 -1.71 -0.09 0.00 0.04 0.00 0.00 34.50 32.54 2w4y s PRO 77 CO 0.15 -2.89 1.02 -2.00 0.04 0.00 0.00 177.00 173.33 2w4y s GLU 78 N -4.95 4.18 0.36 4.56 2.12 -1.26 -4.46 118.70 119.24 2w4y s GLU 78 Ca 0.66 1.43 -0.05 0.00 0.36 0.00 0.00 54.97 57.37 2w4y s GLU 78 Cb -0.19 -2.48 0.01 0.00 0.26 0.00 0.00 34.13 31.74 2w4y s GLU 78 CO 0.58 -0.12 0.54 -0.59 -0.54 0.00 0.00 175.26 175.14 2w4y s PHE 79 N -1.75 0.88 0.18 5.30 -0.12 -0.71 -4.90 117.98 116.85 2w4y s PHE 79 Ca 0.59 -1.20 0.07 0.00 -0.05 0.00 0.00 56.93 56.34 2w4y s PHE 79 Cb -0.19 0.11 -0.04 0.00 -0.63 0.00 0.00 43.02 42.26 2w4y s PHE 79 CO 0.25 -1.24 -0.14 0.08 -0.05 0.00 0.00 175.22 174.12 2w4y s VAL 80 N -2.87 1.61 -0.06 -2.49 1.01 -1.26 -0.98 120.40 115.36 2w4y s VAL 80 Ca 0.27 -2.07 0.01 0.00 0.00 0.00 0.00 61.98 60.20 2w4y s VAL 80 Cb -0.01 -1.91 0.02 0.00 0.00 0.00 0.00 36.38 34.47 2w4y s VAL 80 CO 0.19 -0.55 -0.08 -0.13 0.00 0.00 0.00 175.10 174.53 2w4y s ARG 81 N -3.38 1.32 -0.14 2.72 0.52 -0.40 -4.99 118.95 114.60 2w4y s ARG 81 Ca 0.19 -0.26 -0.13 0.00 -0.52 0.00 0.00 55.73 55.00 2w4y s ARG 81 Cb -0.02 -1.20 0.04 0.00 0.52 0.00 0.00 34.95 34.29 2w4y s ARG 81 CO 0.05 -0.05 0.37 -1.14 0.02 0.00 0.00 175.30 174.55 2w4y s GLN 82 N 0.90 0.44 -0.01 3.54 0.74 -1.26 0.02 119.66 124.02 2w4y s GLN 82 Ca -0.11 0.50 -0.00 0.00 0.05 0.00 0.00 55.36 55.80 2w4y s GLN 82 Cb -0.15 0.21 0.01 0.00 1.10 0.00 0.00 33.01 34.19 2w4y s GLN 82 CO 0.01 -0.05 0.03 0.00 -0.55 0.00 0.00 175.29 174.72 2w4y s ALA 83 N 0.17 0.00 0.13 1.58 0.00 -0.49 -5.02 121.76 118.13 2w4y s ALA 83 Ca -0.00 0.17 -0.12 0.00 0.00 0.00 0.00 51.96 52.01 2w4y s ALA 83 Cb -0.03 -0.13 0.01 0.00 0.00 0.00 0.00 23.12 22.98 2w4y s ALA 83 CO 0.01 -0.05 0.32 1.52 0.00 0.00 0.00 175.76 177.55 2w4y s TYR 84 N 0.48 0.04 0.10 0.00 -0.85 -1.26 -0.27 117.35 115.60 2w4y s TYR 84 Ca -0.04 -0.41 0.07 0.00 -0.52 0.00 0.00 57.07 56.17 2w4y s TYR 84 Cb -0.06 0.11 -0.03 0.00 0.38 0.00 0.00 41.96 42.35 2w4y s TYR 84 CO -0.01 -0.68 -0.17 0.08 -1.52 0.00 0.00 175.55 173.24 2w4y s VAL 85 N -3.86 1.48 -0.04 -3.49 1.01 0.33 -4.99 120.40 110.83 2w4y s VAL 85 Ca 0.07 -1.54 -0.00 0.00 0.00 0.00 0.00 61.98 60.51 2w4y s VAL 85 Cb 0.03 -1.43 0.03 0.00 0.00 0.00 0.00 36.38 35.00 2w4y s VAL 85 CO -0.08 -0.20 0.01 -0.69 0.00 0.00 0.00 175.10 174.14 2w4y s VAL 86 N -1.46 0.17 -0.13 2.92 1.01 -1.26 -1.68 120.40 119.98 2w4y s VAL 86 Ca 0.05 0.16 -0.01 0.00 0.00 0.00 0.00 61.98 62.18 2w4y s VAL 86 Cb -0.09 -0.31 -0.02 0.00 0.00 0.00 0.00 36.38 35.96 2w4y s VAL 86 CO 0.04 0.18 -0.09 -0.63 0.00 0.00 0.00 175.10 174.59 2w4y s ILE 87 N 1.45 3.42 -0.06 2.22 1.09 0.56 -4.96 121.20 124.93 2w4y s ILE 87 Ca -0.04 -0.53 -0.00 0.00 -1.10 0.00 0.00 60.65 58.98 2w4y s ILE 87 Cb -0.13 -2.46 0.02 0.00 -1.06 0.00 0.00 42.46 38.84 2w4y s ILE 87 CO -0.03 0.52 -0.03 -0.60 -0.10 0.00 0.00 174.94 174.71 2w4y s ARG 88 N 0.20 0.75 0.13 2.79 3.52 -1.26 -0.10 118.95 124.98 2w4y s ARG 88 Ca -0.05 -0.02 -0.07 0.00 -0.13 0.00 0.00 55.73 55.46 2w4y s ARG 88 Cb -0.15 -0.92 -0.01 0.00 -1.56 0.00 0.00 34.95 32.31 2w4y s ARG 88 CO 0.04 -0.18 0.19 -3.38 -0.81 0.00 0.00 175.30 171.16 2w4y s HIS 89 N 1.39 0.41 0.57 5.12 -3.43 -0.76 -4.97 115.29 113.62 2w4y s HIS 89 Ca -0.04 -0.81 -0.18 0.00 -0.80 0.00 0.00 55.06 53.23 2w4y s HIS 89 Cb -0.13 -0.16 -0.05 0.00 -1.43 0.00 0.00 32.58 30.81 2w4y s HIS 89 CO -0.03 -0.61 1.10 -1.59 -2.00 0.00 0.00 174.74 171.62 2w4y s LYS 90 N -3.95 3.27 0.09 -0.38 -2.85 -1.26 -0.18 119.74 114.49 2w4y s LYS 90 Ca 0.14 1.48 -0.31 0.00 -1.00 0.00 0.00 55.97 56.28 2w4y s LYS 90 Cb 0.05 -2.01 -0.08 0.00 -2.06 0.00 0.00 37.83 33.73 2w4y s LYS 90 CO -0.04 -0.89 1.48 0.08 0.10 0.00 0.00 175.35 176.08 2w4y s VAL 91 N -2.02 3.19 0.00 1.79 1.01 0.44 -2.37 120.40 122.45 2w4y s VAL 91 Ca 0.70 0.78 0.00 0.00 0.00 0.00 0.00 61.98 63.46 2w4y s VAL 91 Cb -0.21 -3.50 0.00 0.00 0.00 0.00 0.00 36.38 32.67 2w4y s VAL 91 CO 0.31 0.04 0.00 0.61 0.00 0.00 0.00 175.10 176.05 2w4y n GLY 92 N 3.67 0.76 3.67 4.51 0.00 -1.26 -4.97 105.19 111.57 2w4y n GLY 92 Ca 0.13 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.86 2w4y n GLY 92 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2w4y s ASP 93 N -2.30 2.76 -0.68 1.61 -1.08 -1.00 -4.91 116.67 111.07 2w4y s ASP 93 Ca 0.00 1.37 -0.27 0.00 -0.52 0.00 0.00 52.55 53.13 2w4y s ASP 93 Cb 0.00 -2.05 0.03 0.00 -1.46 0.00 0.00 42.92 39.45 2w4y s ASP 93 CO 0.00 -3.07 1.22 -0.69 0.52 0.00 0.00 175.17 173.15 2w4y s VAL 94 N -2.89 3.87 0.27 1.11 1.01 -1.26 -4.91 120.40 117.61 2w4y s VAL 94 Ca 0.65 0.53 -0.05 0.00 0.00 0.00 0.00 61.98 63.11 2w4y s VAL 94 Cb -0.19 -4.83 0.37 0.00 0.00 0.00 0.00 36.38 31.73 2w4y s VAL 94 CO 0.58 -1.64 1.59 0.77 0.00 0.00 0.00 175.10 176.40 2w4y h SER 95 N 9.82 -0.61 -0.84 3.32 4.64 -1.98 0.51 113.55 128.41 2w4y h SER 95 Ca -0.27 0.25 0.13 0.00 -0.47 0.00 0.00 61.79 61.43 2w4y h SER 95 Cb 1.05 0.48 -0.09 0.00 -0.31 0.00 0.00 62.40 63.54 2w4y h SER 95 CO 1.24 -0.29 0.45 0.00 -0.87 0.00 0.00 176.83 177.36 2w4y h ALA 96 N 1.88 1.25 -0.09 5.18 0.00 -1.99 0.55 119.26 126.04 2w4y h ALA 96 Ca 0.48 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.45 2w4y h ALA 96 Cb 0.85 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.58 2w4y h ALA 96 CO -0.86 -0.03 0.03 1.15 0.00 0.00 0.00 179.25 179.54 2w4y h THR 97 N 0.68 1.18 0.04 0.00 2.02 -1.33 -1.82 112.91 113.69 2w4y h THR 97 Ca 0.44 -0.56 0.01 0.00 0.77 0.00 0.00 66.41 67.07 2w4y h THR 97 Cb 0.56 1.38 -0.01 0.00 -1.74 0.00 0.00 68.15 68.34 2w4y h THR 97 CO -0.32 0.16 -0.08 0.58 0.37 0.00 0.00 175.52 176.23 2w4y h VAL 98 N -0.05 0.81 -0.98 3.16 2.07 -0.53 -2.08 116.25 118.65 2w4y h VAL 98 Ca 0.03 0.00 0.20 0.00 0.82 0.00 0.00 66.70 67.75 2w4y h VAL 98 Cb 0.23 0.81 -0.09 0.00 -1.52 0.00 0.00 31.29 30.72 2w4y h VAL 98 CO -0.00 0.00 0.62 -1.28 0.02 0.00 0.00 177.57 176.93 2w4y h SER 99 N -0.16 0.65 -0.18 0.57 0.87 0.20 -0.17 113.55 115.33 2w4y h SER 99 Ca 0.02 0.08 -0.02 0.00 -1.23 0.00 0.00 61.79 60.64 2w4y h SER 99 Cb 0.17 -0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 62.08 2w4y h SER 99 CO -0.05 0.23 0.08 0.44 -0.53 0.00 0.00 176.83 176.99 2w4y h ASP 100 N 0.63 0.29 -0.23 6.23 3.32 -0.60 0.14 116.42 126.19 2w4y h ASP 100 Ca 0.55 -0.02 -0.19 0.00 0.02 0.00 0.00 57.03 57.39 2w4y h ASP 100 Cb 1.04 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 40.53 2w4y h ASP 100 CO -0.32 0.28 -0.61 0.25 -1.72 0.00 0.00 179.24 177.13 2w4y h LEU 101 N 0.32 0.94 -0.35 1.55 5.85 -0.92 -0.81 115.31 121.88 2w4y h LEU 101 Ca 0.08 -0.57 -0.04 0.00 0.84 0.00 0.00 57.88 58.19 2w4y h LEU 101 Cb 0.10 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 40.84 2w4y h LEU 101 CO -0.01 1.34 0.06 1.23 -0.34 0.00 0.00 178.44 180.72 2w4y h GLY 102 N 0.58 0.63 0.44 3.75 0.00 -1.15 -1.95 103.07 105.36 2w4y h GLY 102 Ca -0.01 -0.42 0.10 0.00 0.00 0.00 0.00 47.33 47.00 2w4y h GLY 102 CO 0.13 0.39 0.39 0.83 0.00 0.00 0.00 176.54 178.28 2w4y h GLU 103 N 0.42 0.63 -0.93 4.80 5.08 -0.69 -1.15 114.58 122.74 2w4y h GLU 103 Ca 0.11 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 2w4y h GLU 103 Cb 0.35 -0.14 -0.05 0.00 0.50 0.00 0.00 28.75 29.41 2w4y h GLU 103 CO 0.01 0.42 0.59 0.00 -1.00 0.00 0.00 179.01 179.02 2w4y h ALA 104 N 1.46 1.29 -0.03 3.43 0.00 -0.67 -1.56 119.26 123.18 2w4y h ALA 104 Ca 0.38 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.20 2w4y h ALA 104 Cb 0.41 -0.38 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 2w4y h ALA 104 CO -0.28 0.63 -0.02 1.25 0.00 0.00 0.00 179.25 180.84 2w4y h LEU 105 N 1.27 0.07 -1.00 0.00 5.85 -0.51 -0.95 115.31 120.04 2w4y h LEU 105 Ca 0.34 -0.43 0.08 0.00 0.84 0.00 0.00 57.88 58.71 2w4y h LEU 105 Cb -0.11 -0.02 -0.07 0.00 0.37 0.00 0.00 40.66 40.83 2w4y h LEU 105 CO -0.07 0.49 0.64 0.28 -0.34 0.00 0.00 178.44 179.44 2w4y h SER 106 N -0.35 1.00 -0.58 1.25 0.02 -1.12 -0.19 113.55 113.58 2w4y h SER 106 Ca 0.01 0.02 -0.06 0.00 -0.84 0.00 0.00 61.79 60.92 2w4y h SER 106 Cb 0.46 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.79 2w4y h SER 106 CO 0.00 0.60 0.12 0.15 -1.14 0.00 0.00 176.83 176.57 2w4y h PHE 107 N 1.12 0.99 -0.61 3.45 3.57 -1.19 -3.08 116.94 121.19 2w4y h PHE 107 Ca 0.45 -0.13 -0.10 0.00 3.53 0.00 0.00 57.97 61.73 2w4y h PHE 107 Cb 0.27 -0.28 -0.02 0.00 2.79 0.00 0.00 35.95 38.72 2w4y h PHE 107 CO -0.00 0.85 0.01 -0.92 -2.23 0.00 0.00 178.31 176.02 2w4y h TYR 108 N 0.84 1.17 -1.57 0.41 3.20 -0.01 -3.39 116.97 117.63 2w4y h TYR 108 Ca 0.18 -0.20 -0.63 0.00 3.14 0.00 0.00 58.73 61.22 2w4y h TYR 108 Cb 0.38 -0.31 -0.12 0.00 1.54 0.00 0.00 36.73 38.21 2w4y h TYR 108 CO 0.03 1.02 1.27 -0.51 -1.64 0.00 0.00 178.16 178.33 2w4y s LEU 109 N -9.35 3.99 0.54 2.82 1.43 -0.20 -4.80 118.68 113.11 2w4y s LEU 109 Ca -0.12 -1.61 0.02 0.00 -1.03 0.00 0.00 54.13 51.40 2w4y s LEU 109 Cb 0.14 -2.51 0.02 0.00 0.03 0.00 0.00 46.19 43.86 2w4y s LEU 109 CO 0.86 -1.38 0.17 0.54 0.23 0.00 0.00 176.35 176.77 2w4y s ASN 110 N 4.51 4.34 0.22 2.29 2.20 -1.26 -4.91 114.94 122.33 2w4y s ASN 110 Ca 0.41 -1.53 -0.10 0.00 -0.94 0.00 0.00 52.86 50.70 2w4y s ASN 110 Cb -0.02 0.59 0.31 0.00 -2.00 0.00 0.00 41.25 40.14 2w4y s ASN 110 CO -0.09 -1.01 1.67 -0.08 -2.94 0.00 0.00 177.10 174.65 2w4y h GLU 111 N 1.06 0.14 -0.68 3.55 4.81 -1.98 -0.18 114.58 121.30 2w4y h GLU 111 Ca -0.41 -0.01 0.07 0.00 -0.13 0.00 0.00 59.36 58.89 2w4y h GLU 111 Cb 1.32 -0.03 -0.06 0.00 0.63 0.00 0.00 28.75 30.60 2w4y h GLU 111 CO 0.67 0.09 0.36 0.00 -0.73 0.00 0.00 179.01 179.39 2w4y h ALA 112 N 1.56 0.92 -0.08 2.92 0.00 -1.96 -1.05 119.26 121.56 2w4y h ALA 112 Ca 0.33 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.25 2w4y h ALA 112 Cb 0.54 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.24 2w4y h ALA 112 CO -0.52 -0.00 -0.04 1.25 0.00 0.00 0.00 179.25 179.94 2w4y h LEU 113 N 0.64 0.17 -1.14 0.00 5.85 -1.44 -2.75 115.31 116.63 2w4y h LEU 113 Ca 0.32 -0.43 0.09 0.00 0.84 0.00 0.00 57.88 58.70 2w4y h LEU 113 Cb 0.26 -0.05 -0.07 0.00 0.37 0.00 0.00 40.66 41.18 2w4y h LEU 113 CO -0.22 0.56 0.59 1.88 -0.34 0.00 0.00 178.44 180.92 2w4y h TYR 114 N -0.21 1.03 -0.00 1.25 0.99 -0.86 -0.15 116.97 119.01 2w4y h TYR 114 Ca 0.02 0.03 0.03 0.00 2.00 0.00 0.00 58.73 60.81 2w4y h TYR 114 Cb 0.50 -0.33 -0.04 0.00 1.00 0.00 0.00 36.73 37.85 2w4y h TYR 114 CO 0.07 0.49 -0.25 0.78 -0.00 0.00 0.00 178.16 179.25 2w4y h GLY 115 N 0.96 -0.38 0.79 3.88 0.00 -1.03 -0.95 103.07 106.35 2w4y h GLY 115 Ca 0.42 0.30 0.04 0.00 0.00 0.00 0.00 47.33 48.09 2w4y h GLY 115 CO -0.18 -0.21 0.28 0.50 0.00 0.00 0.00 176.54 176.93 2w4y h LYS 116 N -0.39 0.53 -0.28 4.80 1.57 -0.94 -2.50 116.57 119.36 2w4y h LYS 116 Ca 0.06 -0.03 0.04 0.00 -1.87 0.00 0.00 60.65 58.85 2w4y h LYS 116 Cb 0.47 -0.12 -0.04 0.00 0.08 0.00 0.00 32.23 32.62 2w4y h LYS 116 CO -0.22 0.35 0.03 -0.07 -0.57 0.00 0.00 179.45 178.97 2w4y h LEU 117 N 0.55 -0.05 -2.31 2.94 3.38 -0.59 0.08 115.31 119.31 2w4y h LEU 117 Ca 0.22 0.05 0.01 0.00 0.09 0.00 0.00 57.88 58.25 2w4y h LEU 117 Cb 0.09 0.08 -0.00 0.00 0.09 0.00 0.00 40.66 40.92 2w4y h LEU 117 CO -0.13 0.01 0.02 0.40 0.09 0.00 0.00 178.44 178.83 2w4y h ILE 118 N 0.12 0.67 -0.17 1.22 2.04 -0.97 0.34 117.51 120.75 2w4y h ILE 118 Ca 0.13 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.99 2w4y h ILE 118 Cb 0.15 0.99 0.00 0.00 -0.74 0.00 0.00 36.82 37.22 2w4y h ILE 118 CO -0.20 0.00 0.00 0.61 0.00 0.00 0.00 178.15 178.56 2w4y n GLY 119 N -1.40 -0.18 2.40 5.37 0.00 -0.04 -4.88 105.19 106.46 2w4y n GLY 119 Ca -0.03 -0.19 -0.15 0.00 0.00 0.00 0.00 46.02 45.65 2w4y n GLY 119 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2w4y n TRP 120 N 0.01 -0.14 -2.67 1.61 7.02 0.12 -4.99 117.44 118.39 2w4y n TRP 120 Ca 0.06 0.00 -0.39 0.00 -1.02 0.00 0.00 57.50 56.15 2w4y n TRP 120 Cb 0.15 -2.73 -0.05 0.00 -2.42 0.00 0.00 31.31 26.25 2w4y n TRP 120 CO 0.00 0.00 0.00 -1.21 -2.02 0.00 0.00 177.69 174.46 2w4y s GLU 121 N -3.56 4.69 0.00 -0.99 2.02 -0.87 -5.02 118.70 114.97 2w4y s GLU 121 Ca 0.00 1.54 0.00 0.00 0.02 0.00 0.00 54.97 56.53 2w4y s GLU 121 Cb 0.00 -3.10 0.00 0.00 0.10 0.00 0.00 34.13 31.13 2w4y s GLU 121 CO 0.00 0.34 0.49 0.43 0.02 0.00 0.00 175.26 176.53