#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1o1c s ASP 20 N 0.00 6.38 0.48 4.37 -4.77 -1.26 -4.93 116.67 116.94 1o1c s ASP 20 Ca 0.00 1.45 0.26 0.00 -3.30 0.00 0.00 52.55 50.96 1o1c s ASP 20 Cb 0.00 -2.47 1.16 0.00 -1.09 0.00 0.00 42.92 40.52 1o1c s ASP 20 CO 0.00 -0.74 1.93 -0.08 0.70 0.00 0.00 175.17 176.98 1o1c h GLU 21 N 0.20 0.00 0.00 2.11 4.81 -2.06 -1.71 114.58 117.94 1o1c h GLU 21 Ca -0.45 0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 58.68 1o1c h GLU 21 Cb 1.19 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.55 1o1c h GLU 21 CO 0.62 0.17 -0.48 1.15 -0.73 0.00 0.00 179.01 179.74 1o1c h THR 22 N 0.00 0.83 -0.00 0.32 2.02 -1.99 -0.71 112.91 113.39 1o1c h THR 22 Ca -0.00 -2.16 -0.17 0.00 0.77 0.00 0.00 66.41 64.85 1o1c h THR 22 Cb 0.58 2.40 -0.02 0.00 -1.74 0.00 0.00 68.15 69.37 1o1c h THR 22 CO 0.02 0.47 -0.79 -0.08 0.37 0.00 0.00 175.52 175.51 1o1c h GLU 23 N 0.00 0.06 0.00 6.66 4.81 -1.72 0.01 114.58 124.41 1o1c h GLU 23 Ca -0.00 -0.07 -0.14 0.00 -0.13 0.00 0.00 59.36 59.02 1o1c h GLU 23 Cb 1.36 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 30.74 1o1c h GLU 23 CO 0.06 0.82 -0.64 0.82 -0.73 0.00 0.00 179.01 179.34 1o1c h ILE 24 N 0.04 1.19 0.00 2.32 2.04 -0.91 -1.79 117.51 120.40 1o1c h ILE 24 Ca -0.02 -2.45 -0.09 0.00 1.00 0.00 0.00 64.86 63.30 1o1c h ILE 24 Cb 1.39 2.43 -0.01 0.00 -0.74 0.00 0.00 36.82 39.89 1o1c h ILE 24 CO 0.11 0.63 -0.44 -0.33 0.00 0.00 0.00 178.15 178.12 1o1c h GLU 25 N 0.00 0.00 -0.03 2.37 5.08 -0.47 -0.86 114.58 120.66 1o1c h GLU 25 Ca -0.01 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 58.17 1o1c h GLU 25 Cb 1.38 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.62 1o1c h GLU 25 CO 0.08 0.44 -0.77 -0.44 -1.00 0.00 0.00 179.01 177.33 1o1c h ASP 26 N 0.00 0.31 1.63 1.42 3.45 -0.58 -1.22 116.42 121.44 1o1c h ASP 26 Ca -0.00 -0.22 -0.04 0.00 0.43 0.00 0.00 57.03 57.20 1o1c h ASP 26 Cb 1.20 -0.09 -0.01 0.00 -0.56 0.00 0.00 39.33 39.87 1o1c h ASP 26 CO 0.06 0.96 -0.19 -0.26 -1.57 0.00 0.00 179.24 178.24 1o1c h PHE 27 N 0.16 0.00 0.00 4.55 0.04 -0.98 -1.01 116.94 119.70 1o1c h PHE 27 Ca -0.03 0.00 -0.19 0.00 2.80 0.00 0.00 57.97 60.55 1o1c h PHE 27 Cb 1.35 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 39.48 1o1c h PHE 27 CO 0.03 0.19 -0.85 -0.22 -0.60 0.00 0.00 178.31 176.86 1o1c h LYS 28 N 0.00 0.12 0.02 1.51 3.64 -0.78 -0.37 116.57 120.71 1o1c h LYS 28 Ca -0.00 -0.14 -0.21 0.00 -1.27 0.00 0.00 60.65 59.03 1o1c h LYS 28 Cb 1.06 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.91 1o1c h LYS 28 CO 0.03 0.90 -0.95 0.93 -2.27 0.00 0.00 179.45 178.08 1o1c h GLU 29 N 0.07 0.17 0.00 1.90 5.08 -0.83 -1.56 114.58 119.41 1o1c h GLU 29 Ca -0.03 -0.22 -0.15 0.00 -1.00 0.00 0.00 59.36 57.96 1o1c h GLU 29 Cb 1.48 0.07 -0.02 0.00 0.50 0.00 0.00 28.75 30.78 1o1c h GLU 29 CO 0.12 1.00 -0.71 0.00 -1.00 0.00 0.00 179.01 178.42 1o1c h ALA 30 N 0.92 0.81 -0.05 3.43 0.00 -1.09 -1.66 119.26 121.62 1o1c h ALA 30 Ca -0.05 -0.64 -0.12 0.00 0.00 0.00 0.00 54.91 54.09 1o1c h ALA 30 Cb 1.62 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 19.28 1o1c h ALA 30 CO 0.14 0.89 -0.52 0.35 0.00 0.00 0.00 179.25 180.11 1o1c h PHE 31 N 0.00 0.16 0.00 0.00 3.04 -0.82 -1.73 116.94 117.60 1o1c h PHE 31 Ca -0.01 -0.05 -0.12 0.00 3.98 0.00 0.00 57.97 61.77 1o1c h PHE 31 Cb 1.27 -0.03 -0.02 0.00 2.56 0.00 0.00 35.95 39.73 1o1c h PHE 31 CO 0.00 0.62 -0.58 1.15 -2.02 0.00 0.00 178.31 177.48 1o1c h THR 32 N 0.10 0.98 0.00 4.41 2.02 -0.78 0.22 112.91 119.86 1o1c h THR 32 Ca 0.00 -2.39 -0.07 0.00 0.77 0.00 0.00 66.41 64.73 1o1c h THR 32 Cb 0.95 2.48 -0.01 0.00 -1.74 0.00 0.00 68.15 69.83 1o1c h THR 32 CO 0.07 0.56 -0.47 0.58 0.37 0.00 0.00 175.52 176.63 1o1c h VAL 33 N 0.00 0.47 0.00 3.16 2.07 -0.87 -3.10 116.25 117.97 1o1c h VAL 33 Ca -0.01 -1.69 -0.12 0.00 0.82 0.00 0.00 66.70 65.70 1o1c h VAL 33 Cb 1.44 2.16 -0.02 0.00 -1.52 0.00 0.00 31.29 33.35 1o1c h VAL 33 CO 0.07 0.27 -1.51 -0.38 0.02 0.00 0.00 177.57 176.04 1o1c n ILE 34 N -3.10 0.88 -3.16 4.57 5.41 -0.69 -4.48 119.36 118.79 1o1c n ILE 34 Ca 0.01 -0.64 -0.45 0.00 1.00 0.00 0.00 62.75 62.67 1o1c n ILE 34 Cb 0.66 -0.50 -0.00 0.00 -0.71 0.00 0.00 39.64 39.09 1o1c n ILE 34 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 1o1c s ASP 35 N -5.45 7.12 0.00 4.38 2.15 0.05 -4.37 116.67 120.56 1o1c s ASP 35 Ca -0.04 -3.16 0.29 0.00 0.43 0.00 0.00 52.55 50.07 1o1c s ASP 35 Cb 0.09 -2.30 1.41 0.00 -0.30 0.00 0.00 42.92 41.83 1o1c s ASP 35 CO 0.82 -0.55 2.00 0.00 -0.17 0.00 0.00 175.17 177.28 1o1c n GLN 36 N 4.25 0.28 0.00 4.34 6.02 -1.26 -1.57 117.38 129.44 1o1c n GLN 36 Ca 0.28 0.00 0.13 0.00 -0.01 0.00 0.00 57.00 57.40 1o1c n GLN 36 Cb 0.42 -1.50 0.43 0.00 1.02 0.00 0.00 30.24 30.61 1o1c n GLN 36 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.06 176.32 1o1c n ASN 37 N -1.36 0.45 -4.15 1.08 0.23 -1.26 -4.98 115.26 105.27 1o1c n ASN 37 Ca 0.12 -0.24 -0.31 0.00 -0.53 0.00 0.00 54.58 53.61 1o1c n ASN 37 Cb 0.27 -0.01 -0.04 0.00 -2.08 0.00 0.00 39.78 37.92 1o1c n ASN 37 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1o1c n ALA 38 N -1.26 -1.71 0.51 -2.53 0.00 -0.61 -4.88 120.51 110.03 1o1c n ALA 38 Ca 0.09 -0.21 0.05 0.00 0.00 0.00 0.00 53.44 53.37 1o1c n ALA 38 Cb 0.32 -2.07 -0.05 0.00 0.00 0.00 0.00 19.45 17.65 1o1c n ALA 38 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1o1c n ASP 39 N -2.82 0.68 0.00 0.00 5.68 -1.26 -5.00 116.55 113.82 1o1c n ASP 39 Ca -0.16 -0.84 0.00 0.00 -0.50 0.00 0.00 54.79 53.29 1o1c n ASP 39 Cb 0.61 0.89 0.00 0.00 -1.14 0.00 0.00 41.12 41.48 1o1c n ASP 39 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1o1c n GLY 40 N 1.20 0.58 2.83 6.12 0.00 -1.26 -5.06 105.19 109.60 1o1c n GLY 40 Ca 0.03 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.78 1o1c n GLY 40 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1o1c s ILE 41 N -2.00 0.82 -0.50 -0.61 1.01 -1.26 -3.94 121.20 114.72 1o1c s ILE 41 Ca 0.00 -0.42 -0.28 0.00 0.00 0.00 0.00 60.65 59.94 1o1c s ILE 41 Cb 0.00 -1.05 0.02 0.00 0.01 0.00 0.00 42.46 41.44 1o1c s ILE 41 CO 0.00 0.10 1.35 -0.63 0.00 0.00 0.00 174.94 175.77 1o1c s ILE 42 N 1.76 3.91 0.59 2.92 1.01 0.27 -4.93 121.20 126.73 1o1c s ILE 42 Ca 0.02 0.86 0.01 0.00 0.00 0.00 0.00 60.65 61.53 1o1c s ILE 42 Cb -0.15 -4.41 0.12 0.00 0.01 0.00 0.00 42.46 38.03 1o1c s ILE 42 CO -0.07 -1.02 0.81 -0.90 0.00 0.00 0.00 174.94 173.75 1o1c n ASP 43 N 8.97 1.19 0.25 3.58 5.68 -1.26 -4.02 116.55 130.94 1o1c n ASP 43 Ca 0.13 -1.98 0.12 0.00 -0.50 0.00 0.00 54.79 52.57 1o1c n ASP 43 Cb 0.49 -0.52 0.61 0.00 -1.14 0.00 0.00 41.12 40.56 1o1c n ASP 43 CO 0.00 0.00 0.00 0.50 -1.33 0.00 0.00 177.20 176.37 1o1c h LYS 44 N 0.00 0.00 -0.01 0.11 3.64 -1.94 -1.64 116.57 116.72 1o1c h LYS 44 Ca -0.27 0.00 -0.19 0.00 -1.27 0.00 0.00 60.65 58.92 1o1c h LYS 44 Cb 1.02 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.82 1o1c h LYS 44 CO 0.30 0.15 -0.82 -0.44 -2.27 0.00 0.00 179.45 176.36 1o1c h ASP 45 N 0.00 0.25 -0.10 4.20 5.19 -1.99 -1.58 116.42 122.39 1o1c h ASP 45 Ca -0.00 -0.19 -0.15 0.00 -0.62 0.00 0.00 57.03 56.06 1o1c h ASP 45 Cb 0.55 -0.08 -0.01 0.00 0.18 0.00 0.00 39.33 39.97 1o1c h ASP 45 CO 0.02 0.97 -0.47 0.44 -3.12 0.00 0.00 179.24 177.08 1o1c h ASP 46 N 0.12 0.72 -0.49 6.45 5.19 -1.58 0.19 116.42 127.02 1o1c h ASP 46 Ca -0.04 -0.35 -0.06 0.00 -0.62 0.00 0.00 57.03 55.96 1o1c h ASP 46 Cb 1.43 -0.20 -0.02 0.00 0.18 0.00 0.00 39.33 40.72 1o1c h ASP 46 CO 0.13 1.07 0.06 -0.07 -3.12 0.00 0.00 179.24 177.31 1o1c h LEU 47 N 0.53 0.79 -0.59 1.55 3.38 -1.14 0.03 115.31 119.86 1o1c h LEU 47 Ca 0.03 -0.27 -0.16 0.00 0.09 0.00 0.00 57.88 57.57 1o1c h LEU 47 Cb 1.01 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.54 1o1c h LEU 47 CO 0.09 0.87 -0.63 -0.09 0.09 0.00 0.00 178.44 178.77 1o1c h ARG 48 N 0.69 0.30 0.00 1.13 2.43 -0.88 -1.40 114.38 116.64 1o1c h ARG 48 Ca 0.14 -0.21 0.00 0.00 -0.81 0.00 0.00 59.98 59.10 1o1c h ARG 48 Cb 0.43 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.01 1o1c h ARG 48 CO 0.01 0.83 -0.31 0.93 -1.51 0.00 0.00 179.97 179.92 1o1c h GLU 49 N 0.22 0.00 0.10 0.20 5.08 -0.64 -0.13 114.58 119.40 1o1c h GLU 49 Ca -0.01 0.00 -0.27 0.00 -1.00 0.00 0.00 59.36 58.08 1o1c h GLU 49 Cb 1.15 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.39 1o1c h GLU 49 CO 0.10 0.00 -1.26 1.15 -1.00 0.00 0.00 179.01 178.00 1o1c h THR 50 N 0.00 1.46 -0.07 1.13 2.02 -0.66 -2.45 112.91 114.34 1o1c h THR 50 Ca 0.00 -3.08 -0.17 0.00 0.77 0.00 0.00 66.41 63.92 1o1c h THR 50 Cb 0.95 2.88 -0.01 0.00 -1.74 0.00 0.00 68.15 70.24 1o1c h THR 50 CO 0.00 0.89 -0.71 -0.26 0.37 0.00 0.00 175.52 175.81 1o1c h PHE 51 N 0.06 0.46 0.00 3.16 0.04 -1.04 -1.95 116.94 117.66 1o1c h PHE 51 Ca -0.13 -0.20 -0.10 0.00 2.80 0.00 0.00 57.97 60.34 1o1c h PHE 51 Cb 1.94 -0.07 -0.01 0.00 2.20 0.00 0.00 35.95 40.01 1o1c h PHE 51 CO 0.05 0.94 -0.48 0.00 -0.60 0.00 0.00 178.31 178.22 1o1c h ALA 52 N 1.01 1.05 0.00 2.45 0.00 -1.06 0.66 119.26 123.37 1o1c h ALA 52 Ca -0.02 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1o1c h ALA 52 Cb 1.27 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1o1c h ALA 52 CO 0.12 0.60 -0.05 0.00 0.00 0.00 0.00 179.25 179.91 1o1c n ALA 53 N -2.38 2.38 1.03 0.00 0.00 -0.92 -2.02 120.51 118.61 1o1c n ALA 53 Ca -0.01 -0.08 0.11 0.00 0.00 0.00 0.00 53.44 53.46 1o1c n ALA 53 Cb 0.53 -1.44 0.08 0.00 0.00 0.00 0.00 19.45 18.63 1o1c n ALA 53 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1o1c n MET 54 N -1.90 0.27 0.00 0.00 2.00 -0.54 -4.95 117.12 111.99 1o1c n MET 54 Ca 0.06 -0.20 0.00 0.00 0.00 0.00 0.00 57.70 57.56 1o1c n MET 54 Cb 0.39 -1.50 0.00 0.00 0.00 0.00 0.00 33.22 32.11 1o1c n MET 54 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1o1c n GLY 55 N 1.47 1.00 3.46 3.03 0.00 -0.78 -5.07 105.19 108.30 1o1c n GLY 55 Ca 0.06 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.65 1o1c n GLY 55 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1o1c s ARG 56 N -0.02 3.44 0.28 1.61 0.52 0.12 -4.78 118.95 120.12 1o1c s ARG 56 Ca 0.00 -1.41 0.22 0.00 -0.52 0.00 0.00 55.73 54.03 1o1c s ARG 56 Cb 0.00 -4.73 0.11 0.00 0.52 0.00 0.00 34.95 30.85 1o1c s ARG 56 CO 0.00 -1.82 1.24 1.25 0.02 0.00 0.00 175.30 175.99 1o1c h LEU 57 N 10.92 0.00 -3.50 2.53 5.85 -1.85 -3.26 115.31 126.00 1o1c h LEU 57 Ca 0.02 0.00 -0.06 0.00 0.84 0.00 0.00 57.88 58.67 1o1c h LEU 57 Cb 1.04 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 42.03 1o1c h LEU 57 CO 1.16 0.04 0.06 -0.46 -0.34 0.00 0.00 178.44 178.91 1o1c n ASN 58 N -2.85 4.72 -4.62 1.25 0.23 -1.26 -4.98 115.26 107.75 1o1c n ASN 58 Ca 0.01 -3.09 -0.43 0.00 -0.53 0.00 0.00 54.58 50.55 1o1c n ASN 58 Cb 0.56 -0.65 -0.03 0.00 -2.08 0.00 0.00 39.78 37.58 1o1c n ASN 58 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 1o1c s VAL 59 N -2.88 3.45 0.65 3.53 0.11 -1.25 -4.96 120.40 119.04 1o1c s VAL 59 Ca 0.50 0.49 -0.15 0.00 -2.93 0.00 0.00 61.98 59.90 1o1c s VAL 59 Cb 0.40 -3.49 -0.01 0.00 -1.53 0.00 0.00 36.38 31.75 1o1c s VAL 59 CO 0.12 -0.23 1.10 -0.54 -3.33 0.00 0.00 175.10 172.21 1o1c s LYS 60 N 5.15 2.91 0.49 1.54 1.02 -1.26 -4.94 119.74 124.65 1o1c s LYS 60 Ca 0.80 1.34 0.30 0.00 0.02 0.00 0.00 55.97 58.43 1o1c s LYS 60 Cb -0.28 -1.97 1.03 0.00 -0.52 0.00 0.00 37.83 36.10 1o1c s LYS 60 CO 0.33 -1.16 1.86 -0.91 -0.92 0.00 0.00 175.35 174.55 1o1c h ASN 61 N 0.09 0.00 1.64 2.83 4.21 -2.00 -1.68 115.58 120.67 1o1c h ASN 61 Ca -0.47 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.04 1o1c h ASN 61 Cb 1.24 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.44 1o1c h ASN 61 CO 0.55 0.00 0.00 -0.33 -1.29 0.00 0.00 177.43 176.36 1o1c h GLU 62 N 0.00 0.00 0.10 0.81 3.07 -1.98 0.09 114.58 116.67 1o1c h GLU 62 Ca 0.00 0.00 -0.26 0.00 -0.50 0.00 0.00 59.36 58.60 1o1c h GLU 62 Cb 0.65 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.56 1o1c h GLU 62 CO 0.00 0.00 -1.22 0.93 -1.40 0.00 0.00 179.01 177.32 1o1c h GLU 63 N 0.00 0.21 -0.03 2.33 5.08 -1.69 -1.58 114.58 118.91 1o1c h GLU 63 Ca 0.00 -0.36 -0.18 0.00 -1.00 0.00 0.00 59.36 57.81 1o1c h GLU 63 Cb 0.82 0.13 -0.01 0.00 0.50 0.00 0.00 28.75 30.20 1o1c h GLU 63 CO 0.00 1.16 -0.78 -0.07 -1.00 0.00 0.00 179.01 178.31 1o1c h LEU 64 N 0.06 0.32 -0.70 1.33 3.38 -1.37 -2.01 115.31 116.31 1o1c h LEU 64 Ca -0.12 -0.23 -0.10 0.00 0.09 0.00 0.00 57.88 57.52 1o1c h LEU 64 Cb 1.94 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 42.58 1o1c h LEU 64 CO 0.18 0.98 -0.47 0.44 0.09 0.00 0.00 178.44 179.66 1o1c h ASP 65 N 0.16 0.00 1.57 -0.43 3.32 -0.93 -1.86 116.42 118.25 1o1c h ASP 65 Ca -0.03 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 56.93 1o1c h ASP 65 Cb 1.37 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.91 1o1c h ASP 65 CO 0.12 0.47 -0.39 0.00 -1.72 0.00 0.00 179.24 177.72 1o1c h ALA 66 N 1.53 0.75 0.04 3.45 0.00 -0.62 -0.35 119.26 124.06 1o1c h ALA 66 Ca -0.00 -0.36 -0.24 0.00 0.00 0.00 0.00 54.91 54.30 1o1c h ALA 66 Cb 1.06 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 18.80 1o1c h ALA 66 CO 0.06 0.49 -1.04 0.52 0.00 0.00 0.00 179.25 179.28 1o1c h MET 67 N 0.00 0.40 0.00 0.00 2.86 -0.92 -3.05 114.93 114.22 1o1c h MET 67 Ca -0.00 -0.49 -0.01 0.00 -2.06 0.00 0.00 59.70 57.14 1o1c h MET 67 Cb 1.28 0.15 -0.00 0.00 0.06 0.00 0.00 31.60 33.09 1o1c h MET 67 CO 0.05 1.16 -0.04 0.82 1.06 0.00 0.00 176.91 179.96 1o1c h ILE 68 N 0.20 0.07 0.00 -1.22 2.04 -1.14 -2.51 117.51 114.95 1o1c h ILE 68 Ca -0.10 -0.99 0.00 0.00 1.00 0.00 0.00 64.86 64.77 1o1c h ILE 68 Cb 1.70 1.93 0.00 0.00 -0.74 0.00 0.00 36.82 39.71 1o1c h ILE 68 CO 0.18 0.04 0.00 1.17 0.00 0.00 0.00 178.15 179.54 1o1c n LYS 69 N -3.11 0.49 0.00 2.37 4.81 -0.16 -1.83 118.16 120.73 1o1c n LYS 69 Ca 0.03 0.01 0.12 0.00 -0.87 0.00 0.00 58.31 57.60 1o1c n LYS 69 Cb 0.50 -1.50 0.29 0.00 0.02 0.00 0.00 35.03 34.34 1o1c n LYS 69 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 1o1c n GLU 70 N -1.25 0.04 -4.21 1.64 1.02 -0.95 -4.87 120.64 112.06 1o1c n GLU 70 Ca 0.15 -0.02 -0.26 0.00 -0.02 0.00 0.00 57.16 57.01 1o1c n GLU 70 Cb 0.22 -1.50 -0.07 0.00 -0.02 0.00 0.00 31.44 30.06 1o1c n GLU 70 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1o1c s ALA 71 N -2.98 3.23 -0.76 0.62 0.00 -0.76 -5.02 121.76 116.08 1o1c s ALA 71 Ca 0.12 -1.41 0.23 0.00 0.00 0.00 0.00 51.96 50.90 1o1c s ALA 71 Cb 0.18 -0.98 0.12 0.00 0.00 0.00 0.00 23.12 22.44 1o1c s ALA 71 CO 0.68 0.44 1.11 0.45 0.00 0.00 0.00 175.76 178.43 1o1c n SER 72 N -0.30 0.65 -1.17 0.00 2.88 -1.26 -4.99 113.62 109.42 1o1c n SER 72 Ca -0.09 -0.33 -0.01 0.00 -1.33 0.00 0.00 58.87 57.11 1o1c n SER 72 Cb 0.56 0.68 -0.00 0.00 -0.75 0.00 0.00 64.21 64.69 1o1c n SER 72 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1o1c n GLY 73 N 1.42 3.39 3.75 0.46 0.00 -1.26 -5.14 105.19 107.81 1o1c n GLY 73 Ca 0.03 -1.50 -0.38 0.00 0.00 0.00 0.00 46.02 44.17 1o1c n GLY 73 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1o1c s PRO 74 N -2.08 3.31 -1.28 1.61 0.04 -1.26 -4.90 135.00 130.44 1o1c s PRO 74 Ca 0.03 2.16 -0.17 0.00 0.04 0.00 0.00 61.00 63.05 1o1c s PRO 74 Cb 0.00 -2.32 0.09 0.00 0.04 0.00 0.00 34.50 32.32 1o1c s PRO 74 CO 0.02 -1.03 1.67 0.42 0.04 0.00 0.00 177.00 178.11 1o1c s ILE 75 N -1.34 4.34 0.62 0.56 -1.09 -1.26 -4.80 121.20 118.24 1o1c s ILE 75 Ca 0.69 -2.10 -0.04 0.00 -2.23 0.00 0.00 60.65 56.97 1o1c s ILE 75 Cb -0.38 -5.13 0.13 0.00 -1.58 0.00 0.00 42.46 35.50 1o1c s ILE 75 CO 0.46 -1.93 0.85 -0.46 -1.23 0.00 0.00 174.94 172.62 1o1c n ASN 76 N 7.72 0.74 0.09 3.58 0.23 -1.26 -0.57 115.26 125.80 1o1c n ASN 76 Ca 0.46 -1.72 0.02 0.00 -0.53 0.00 0.00 54.58 52.81 1o1c n ASN 76 Cb 0.45 -0.58 0.36 0.00 -2.08 0.00 0.00 39.78 37.93 1o1c n ASN 76 CO 0.00 0.00 0.00 0.15 -0.93 0.00 0.00 177.26 176.48 1o1c h PHE 77 N -0.88 0.31 0.00 -2.53 3.57 -1.93 -1.00 116.94 114.48 1o1c h PHE 77 Ca -0.28 -0.04 -0.04 0.00 3.53 0.00 0.00 57.97 61.15 1o1c h PHE 77 Cb 0.93 -0.09 -0.01 0.00 2.79 0.00 0.00 35.95 39.58 1o1c h PHE 77 CO 0.00 0.42 -0.65 1.79 -2.23 0.00 0.00 178.31 177.65 1o1c h THR 78 N 0.28 0.19 0.00 4.41 1.35 -1.94 -1.13 112.91 116.07 1o1c h THR 78 Ca 0.06 -1.31 -0.16 0.00 -0.55 0.00 0.00 66.41 64.44 1o1c h THR 78 Cb 0.40 1.87 -0.02 0.00 -1.73 0.00 0.00 68.15 68.67 1o1c h THR 78 CO 0.02 0.11 -0.78 0.58 -0.25 0.00 0.00 175.52 175.20 1o1c h VAL 79 N 0.00 1.30 0.04 6.82 2.07 -1.73 -1.01 116.25 123.75 1o1c h VAL 79 Ca -0.02 -2.85 -0.22 0.00 0.82 0.00 0.00 66.70 64.42 1o1c h VAL 79 Cb 1.13 2.64 -0.01 0.00 -1.52 0.00 0.00 31.29 33.54 1o1c h VAL 79 CO 0.02 0.74 -1.02 0.15 0.02 0.00 0.00 177.57 177.48 1o1c h PHE 80 N 0.00 0.31 -0.10 1.57 -0.00 -0.96 -1.57 116.94 116.19 1o1c h PHE 80 Ca -0.01 -0.20 -0.19 0.00 -0.00 0.00 0.00 57.97 57.57 1o1c h PHE 80 Cb 1.59 -0.02 -0.00 0.00 -0.00 0.00 0.00 35.95 37.52 1o1c h PHE 80 CO 0.00 1.08 -0.71 -0.07 -0.00 0.00 0.00 178.31 178.61 1o1c h LEU 81 N 0.08 0.57 -0.43 0.59 3.38 -1.08 -1.57 115.31 116.85 1o1c h LEU 81 Ca -0.07 -0.36 -0.13 0.00 0.09 0.00 0.00 57.88 57.41 1o1c h LEU 81 Cb 1.70 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 42.27 1o1c h LEU 81 CO 0.16 1.11 -0.63 0.71 0.09 0.00 0.00 178.44 179.88 1o1c h THR 82 N 0.33 1.23 -0.10 0.22 1.35 -1.07 0.46 112.91 115.34 1o1c h THR 82 Ca -0.03 -2.33 -0.23 0.00 -0.55 0.00 0.00 66.41 63.28 1o1c h THR 82 Cb 1.29 2.34 0.01 0.00 -1.73 0.00 0.00 68.15 70.06 1o1c h THR 82 CO 0.13 0.61 -0.84 -0.03 -0.25 0.00 0.00 175.52 175.14 1o1c h MET 83 N 0.00 0.69 0.00 4.72 1.85 -1.12 -1.38 114.93 119.69 1o1c h MET 83 Ca -0.01 -0.61 -0.14 0.00 -0.61 0.00 0.00 59.70 58.34 1o1c h MET 83 Cb 1.29 0.14 -0.02 0.00 0.43 0.00 0.00 31.60 33.44 1o1c h MET 83 CO 0.08 1.22 -0.65 0.74 -0.40 0.00 0.00 176.91 177.90 1o1c h PHE 84 N 0.45 0.00 -0.43 1.39 -1.00 -1.15 -2.45 116.94 113.74 1o1c h PHE 84 Ca -0.07 0.00 -0.05 0.00 2.81 0.00 0.00 57.97 60.66 1o1c h PHE 84 Cb 1.47 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 41.01 1o1c h PHE 84 CO 0.08 0.65 0.06 0.78 -1.61 0.00 0.00 178.31 178.27 1o1c h GLY 85 N 2.08 0.78 2.00 -1.45 0.00 -0.65 0.23 103.07 106.06 1o1c h GLY 85 Ca -0.01 -0.53 0.00 0.00 0.00 0.00 0.00 47.33 46.79 1o1c h GLY 85 CO 0.08 0.49 0.00 0.83 0.00 0.00 0.00 176.54 177.95 1o1c h GLU 86 N 0.58 0.00 0.00 4.80 5.08 -0.95 -2.46 114.58 121.63 1o1c h GLU 86 Ca 0.13 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.38 1o1c h GLU 86 Cb 0.40 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.63 1o1c h GLU 86 CO 0.01 0.00 -1.95 1.63 -1.00 0.00 0.00 179.01 177.70 1o1c n LYS 87 N -2.35 0.66 -2.39 2.33 5.02 -0.95 -4.51 118.16 115.96 1o1c n LYS 87 Ca 0.04 -0.08 -0.32 0.00 -2.02 0.00 0.00 58.31 55.93 1o1c n LYS 87 Cb 0.33 -1.58 0.01 0.00 -0.02 0.00 0.00 35.03 33.77 1o1c n LYS 87 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1o1c n LEU 88 N -2.49 5.79 0.00 -0.35 4.77 0.04 -4.76 117.00 119.99 1o1c n LEU 88 Ca -0.12 -5.19 0.14 0.00 -0.03 0.00 0.00 56.01 50.82 1o1c n LEU 88 Cb 0.75 -0.73 0.81 0.00 -2.33 0.00 0.00 43.42 41.92 1o1c n LEU 88 CO 0.44 2.09 1.01 0.29 -1.33 0.00 0.00 177.39 179.90 1o1c n LYS 89 N -0.42 0.76 -0.76 3.23 5.02 -1.13 -2.12 118.16 122.73 1o1c n LYS 89 Ca 0.43 0.01 0.03 0.00 -2.02 0.00 0.00 58.31 56.76 1o1c n LYS 89 Cb 0.45 -1.50 0.05 0.00 -0.02 0.00 0.00 35.03 34.01 1o1c n LYS 89 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1o1c n GLY 90 N 0.88 1.77 3.71 0.72 0.00 -1.26 -5.08 105.19 105.93 1o1c n GLY 90 Ca 0.19 -0.57 -0.42 0.00 0.00 0.00 0.00 46.02 45.23 1o1c n GLY 90 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1o1c s ALA 91 N -0.75 3.47 -0.08 4.61 0.00 -0.90 -5.02 121.76 123.09 1o1c s ALA 91 Ca 0.19 0.91 0.03 0.00 0.00 0.00 0.00 51.96 53.09 1o1c s ALA 91 Cb 0.20 -3.49 0.01 0.00 0.00 0.00 0.00 23.12 19.84 1o1c s ALA 91 CO -0.06 -0.54 -0.16 0.34 0.00 0.00 0.00 175.76 175.34 1o1c s ASP 92 N 1.17 2.23 0.81 0.00 2.15 -1.26 -5.04 116.67 116.73 1o1c s ASP 92 Ca 0.60 -0.39 -0.13 0.00 0.43 0.00 0.00 52.55 53.07 1o1c s ASP 92 Cb -0.31 -1.02 0.09 0.00 -0.30 0.00 0.00 42.92 41.38 1o1c s ASP 92 CO 0.29 0.08 1.18 -2.16 -0.17 0.00 0.00 175.17 174.38 1o1c s PRO 93 N 0.54 1.65 0.47 4.34 0.04 -1.26 -4.64 135.00 136.14 1o1c s PRO 93 Ca -0.16 1.64 0.17 0.00 0.04 0.00 0.00 61.00 62.69 1o1c s PRO 93 Cb -0.16 -1.79 1.11 0.00 0.04 0.00 0.00 34.50 33.69 1o1c s PRO 93 CO 0.06 -2.18 2.03 0.93 0.04 0.00 0.00 177.00 177.87 1o1c h GLU 94 N -1.03 0.00 0.00 4.56 5.08 -1.98 -1.20 114.58 120.01 1o1c h GLU 94 Ca -0.45 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 57.85 1o1c h GLU 94 Cb 1.28 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.52 1o1c h GLU 94 CO 0.46 0.15 -0.24 -0.44 -1.00 0.00 0.00 179.01 177.94 1o1c h ASP 95 N 0.00 0.00 0.74 1.42 5.19 -1.96 -0.59 116.42 121.23 1o1c h ASP 95 Ca -0.00 0.00 -0.06 0.00 -0.62 0.00 0.00 57.03 56.35 1o1c h ASP 95 Cb 0.28 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.78 1o1c h ASP 95 CO 0.02 0.24 -1.30 0.52 -3.12 0.00 0.00 179.24 175.60 1o1c n VAL 96 N -3.27 0.71 0.08 -1.35 0.31 -0.49 -1.31 118.33 113.02 1o1c n VAL 96 Ca 0.01 -0.59 -0.13 0.00 -0.01 0.00 0.00 64.34 63.62 1o1c n VAL 96 Cb 0.52 -0.40 -0.06 0.00 -0.91 0.00 0.00 33.84 32.99 1o1c n VAL 96 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 1o1c h ILE 97 N 0.00 1.44 0.00 2.52 2.04 -1.06 -1.74 117.51 120.72 1o1c h ILE 97 Ca -0.06 -2.64 -0.08 0.00 1.00 0.00 0.00 64.86 63.07 1o1c h ILE 97 Cb 1.20 2.57 -0.01 0.00 -0.74 0.00 0.00 36.82 39.83 1o1c h ILE 97 CO 0.01 0.78 -0.39 0.24 0.00 0.00 0.00 178.15 178.80 1o1c h MET 98 N 0.17 0.00 0.01 2.37 2.86 -1.12 -1.16 114.93 118.05 1o1c h MET 98 Ca -0.09 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.55 1o1c h MET 98 Cb 1.67 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.33 1o1c h MET 98 CO 0.17 0.39 -0.00 0.78 1.06 0.00 0.00 176.91 179.30 1o1c h GLY 99 N 2.99 -0.01 1.82 8.32 0.00 -0.91 -0.43 103.07 114.85 1o1c h GLY 99 Ca -0.00 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.25 1o1c h GLY 99 CO 0.05 -0.00 -0.31 0.00 0.00 0.00 0.00 176.54 176.27 1o1c h ALA 100 N 0.86 1.28 0.00 3.60 0.00 -1.02 -1.76 119.26 122.21 1o1c h ALA 100 Ca -0.00 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.57 1o1c h ALA 100 Cb 0.13 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1o1c h ALA 100 CO 0.00 0.50 0.00 0.74 0.00 0.00 0.00 179.25 180.49 1o1c h PHE 101 N 0.18 0.00 0.00 0.00 0.05 -1.04 -1.47 116.94 114.66 1o1c h PHE 101 Ca 0.02 0.00 -0.04 0.00 3.82 0.00 0.00 57.97 61.77 1o1c h PHE 101 Cb 0.65 0.00 -0.01 0.00 2.00 0.00 0.00 35.95 38.59 1o1c h PHE 101 CO 0.01 0.00 -0.69 -0.22 -0.18 0.00 0.00 178.31 177.23 1o1c h LYS 102 N 0.00 0.00 0.00 1.51 1.63 -0.25 -0.65 116.57 118.81 1o1c h LYS 102 Ca 0.00 0.00 -0.10 0.00 -0.85 0.00 0.00 60.65 59.70 1o1c h LYS 102 Cb 0.77 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.38 1o1c h LYS 102 CO 0.00 0.12 -0.65 0.28 -3.45 0.00 0.00 179.45 175.75 1o1c h VAL 103 N 0.00 0.64 0.00 2.00 2.07 -0.85 -2.71 116.25 117.40 1o1c h VAL 103 Ca -0.03 -1.96 -0.17 0.00 0.82 0.00 0.00 66.70 65.36 1o1c h VAL 103 Cb 1.15 2.24 -0.03 0.00 -1.52 0.00 0.00 31.29 33.14 1o1c h VAL 103 CO 0.02 0.37 -0.93 -0.07 0.02 0.00 0.00 177.57 176.97 1o1c h LEU 104 N 0.00 0.00 -7.12 2.57 3.38 -1.14 -3.35 115.31 109.65 1o1c h LEU 104 Ca -0.03 0.00 -0.62 0.00 0.09 0.00 0.00 57.88 57.31 1o1c h LEU 104 Cb 1.35 0.00 -0.42 0.00 0.09 0.00 0.00 40.66 41.69 1o1c h LEU 104 CO 0.05 0.73 -0.57 -0.62 0.09 0.00 0.00 178.44 178.12 1o1c s ASP 105 N -6.41 4.80 0.00 -0.43 2.15 -0.26 -4.96 116.67 111.56 1o1c s ASP 105 Ca 0.01 -3.78 0.27 0.00 0.43 0.00 0.00 52.55 49.49 1o1c s ASP 105 Cb 0.09 -1.64 1.28 0.00 -0.30 0.00 0.00 42.92 42.34 1o1c s ASP 105 CO 0.79 -0.10 1.91 -0.81 -0.17 0.00 0.00 175.17 176.79 1o1c n PRO 106 N 2.08 0.19 0.00 4.34 -0.04 -1.03 -1.64 135.00 138.91 1o1c n PRO 106 Ca 0.18 0.03 0.12 0.00 -0.04 0.00 0.00 63.50 63.79 1o1c n PRO 106 Cb 0.35 -1.50 0.26 0.00 -0.04 0.00 0.00 33.50 32.56 1o1c n PRO 106 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1o1c n ASP 107 N -1.40 1.02 -0.04 3.54 5.75 -1.26 -5.03 116.55 119.13 1o1c n ASP 107 Ca 0.10 -0.82 0.00 0.00 -0.01 0.00 0.00 54.79 54.06 1o1c n ASP 107 Cb 0.27 0.28 -0.00 0.00 -1.03 0.00 0.00 41.12 40.63 1o1c n ASP 107 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1o1c n GLY 108 N 1.40 -2.69 5.00 6.12 0.00 -0.65 -4.89 105.19 109.48 1o1c n GLY 108 Ca 0.09 -1.40 0.00 0.00 0.00 0.00 0.00 46.02 44.72 1o1c n GLY 108 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1o1c n LYS 109 N -1.92 0.00 -2.49 1.61 4.76 -1.26 -4.95 118.16 113.91 1o1c n LYS 109 Ca -0.00 0.00 -0.41 0.00 -2.87 0.00 0.00 58.31 55.03 1o1c n LYS 109 Cb 0.02 0.00 -0.04 0.00 -1.84 0.00 0.00 35.03 33.17 1o1c n LYS 109 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 1o1c s GLY 110 N 0.00 2.91 0.20 0.72 0.00 -1.26 -5.02 107.32 104.87 1o1c s GLY 110 Ca 0.00 0.86 -0.30 0.00 0.00 0.00 0.00 44.72 45.28 1o1c s GLY 110 CO 0.00 1.62 1.04 -1.35 0.00 0.00 0.00 173.10 174.41 1o1c s SER 111 N -0.38 7.40 0.40 1.64 1.04 -0.84 -4.89 113.70 118.07 1o1c s SER 111 Ca 0.48 2.05 -0.17 0.00 0.48 0.00 0.00 55.95 58.78 1o1c s SER 111 Cb -0.31 -2.61 -0.09 0.00 0.10 0.00 0.00 66.02 63.11 1o1c s SER 111 CO 0.37 -0.09 0.86 -0.51 0.98 0.00 0.00 173.24 174.85 1o1c s ILE 112 N -0.62 4.56 0.66 -1.02 2.07 0.30 -4.54 121.20 122.61 1o1c s ILE 112 Ca 0.46 1.16 -0.18 0.00 -1.41 0.00 0.00 60.65 60.68 1o1c s ILE 112 Cb -0.28 -3.63 -0.01 0.00 0.13 0.00 0.00 42.46 38.67 1o1c s ILE 112 CO 0.35 -0.34 1.29 0.29 -1.91 0.00 0.00 174.94 174.61 1o1c n LYS 113 N -0.74 1.06 -0.12 3.50 5.02 -1.22 0.19 118.16 125.83 1o1c n LYS 113 Ca 0.05 0.42 -0.08 0.00 -2.02 0.00 0.00 58.31 56.68 1o1c n LYS 113 Cb 0.54 -2.53 -0.00 0.00 -0.02 0.00 0.00 35.03 33.02 1o1c n LYS 113 CO 0.00 0.00 0.00 -0.22 -0.52 0.00 0.00 177.40 176.66 1o1c h LYS 114 N 0.44 0.53 0.00 1.97 3.64 0.40 -2.15 116.57 121.40 1o1c h LYS 114 Ca -0.51 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 58.82 1o1c h LYS 114 Cb 1.34 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 33.05 1o1c h LYS 114 CO 0.53 0.41 0.00 0.66 -2.27 0.00 0.00 179.45 178.78 1o1c h SER 115 N 0.50 0.00 0.50 4.20 4.64 -1.93 -2.49 113.55 118.97 1o1c h SER 115 Ca 0.14 0.00 -0.27 0.00 -0.47 0.00 0.00 61.79 61.19 1o1c h SER 115 Cb 0.03 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.12 1o1c h SER 115 CO -0.02 0.00 -1.18 0.15 -0.87 0.00 0.00 176.83 174.90 1o1c h PHE 116 N 0.00 0.59 0.00 4.77 3.57 -1.70 -1.24 116.94 122.93 1o1c h PHE 116 Ca 0.00 -0.40 -0.11 0.00 3.53 0.00 0.00 57.97 60.99 1o1c h PHE 116 Cb 0.76 -0.04 -0.02 0.00 2.79 0.00 0.00 35.95 39.45 1o1c h PHE 116 CO 0.00 1.28 -0.51 -0.07 -2.23 0.00 0.00 178.31 176.78 1o1c h LEU 117 N 0.13 0.00 -0.17 0.59 3.38 -1.20 -0.45 115.31 117.60 1o1c h LEU 117 Ca -0.13 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.61 1o1c h LEU 117 Cb 1.88 0.00 0.01 0.00 0.09 0.00 0.00 40.66 42.64 1o1c h LEU 117 CO 0.20 0.51 -0.92 -0.33 0.09 0.00 0.00 178.44 177.99 1o1c h GLU 118 N 0.00 0.50 -0.08 1.13 5.08 -1.20 -1.16 114.58 118.85 1o1c h GLU 118 Ca -0.01 -0.51 -0.24 0.00 -1.00 0.00 0.00 59.36 57.60 1o1c h GLU 118 Cb 1.22 0.14 0.02 0.00 0.50 0.00 0.00 28.75 30.62 1o1c h GLU 118 CO 0.07 1.15 -0.88 0.93 -1.00 0.00 0.00 179.01 179.27 1o1c h GLU 119 N 0.30 0.74 0.00 2.33 5.08 -1.01 -2.57 114.58 119.45 1o1c h GLU 119 Ca -0.08 -0.69 -0.02 0.00 -1.00 0.00 0.00 59.36 57.57 1o1c h GLU 119 Cb 1.55 0.17 -0.00 0.00 0.50 0.00 0.00 28.75 30.97 1o1c h GLU 119 CO 0.17 1.28 -0.10 1.25 -1.00 0.00 0.00 179.01 180.61 1o1c h LEU 120 N 0.45 0.00 0.04 1.33 5.85 -1.06 0.76 115.31 122.68 1o1c h LEU 120 Ca -0.09 0.00 -0.17 0.00 0.84 0.00 0.00 57.88 58.47 1o1c h LEU 120 Cb 1.53 0.00 0.02 0.00 0.37 0.00 0.00 40.66 42.57 1o1c h LEU 120 CO 0.18 0.10 -0.67 0.25 -0.34 0.00 0.00 178.44 177.96 1o1c h LEU 121 N 0.00 0.53 0.34 2.25 5.85 -1.15 -3.17 115.31 119.95 1o1c h LEU 121 Ca -0.00 -0.81 -0.02 0.00 0.84 0.00 0.00 57.88 57.89 1o1c h LEU 121 Cb 0.96 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.83 1o1c h LEU 121 CO 0.01 1.27 -0.16 0.74 -0.34 0.00 0.00 178.44 179.97 1o1c h THR 122 N -0.16 0.60 0.00 1.05 2.02 -0.83 -3.05 112.91 112.54 1o1c h THR 122 Ca -0.09 -0.64 0.00 0.00 0.77 0.00 0.00 66.41 66.44 1o1c h THR 122 Cb 1.41 0.88 0.00 0.00 -1.74 0.00 0.00 68.15 68.70 1o1c h THR 122 CO 0.13 0.11 0.00 0.35 0.37 0.00 0.00 175.52 176.48 1o1c n THR 123 N -5.13 0.00 0.00 3.16 -2.24 0.24 -2.78 114.28 107.52 1o1c n THR 123 Ca -0.09 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.69 1o1c n THR 123 Cb 0.27 -0.21 0.00 0.00 -2.10 0.00 0.00 70.33 68.29 1o1c n THR 123 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1o1c n GLY 124 N 0.21 0.00 3.11 3.38 0.00 -1.20 -5.01 105.19 105.69 1o1c n GLY 124 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 1o1c n GLY 124 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1o1c s GLY 125 N -3.70 0.54 0.24 -0.02 0.00 -1.12 -5.04 107.32 98.23 1o1c s GLY 125 Ca 0.00 -1.22 0.25 0.00 0.00 0.00 0.00 44.72 43.75 1o1c s GLY 125 CO 0.00 -1.30 1.64 -1.33 0.00 0.00 0.00 173.10 172.12 1o1c h GLY 126 N 3.07 0.00 1.89 0.20 0.00 -1.81 -3.15 103.07 103.27 1o1c h GLY 126 Ca -0.34 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.99 1o1c h GLY 126 CO 0.64 0.00 -0.08 0.54 0.00 0.00 0.00 176.54 177.64 1o1c n ARG 127 N -2.42 0.24 -0.39 4.80 1.74 -1.26 -3.00 116.66 116.36 1o1c n ARG 127 Ca 0.05 0.18 0.09 0.00 -0.77 0.00 0.00 57.85 57.40 1o1c n ARG 127 Cb 0.46 -1.76 0.29 0.00 -1.02 0.00 0.00 32.46 30.43 1o1c n ARG 127 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 1o1c n PHE 128 N -2.16 0.98 -0.95 -1.55 3.01 -1.19 -4.96 117.46 110.64 1o1c n PHE 128 Ca 0.05 -0.55 -0.35 0.00 1.01 0.00 0.00 57.45 57.62 1o1c n PHE 128 Cb 0.42 -0.09 0.08 0.00 -0.01 0.00 0.00 39.48 39.88 1o1c n PHE 128 CO 0.00 0.00 0.00 0.25 1.01 0.00 0.00 176.76 178.02 1o1c n THR 129 N 1.12 0.21 0.00 4.37 -2.24 -1.16 -1.47 114.28 115.11 1o1c n THR 129 Ca 0.21 -0.35 0.00 0.00 -2.27 0.00 0.00 64.05 61.65 1o1c n THR 129 Cb 0.66 -0.37 0.00 0.00 -2.10 0.00 0.00 70.33 68.52 1o1c n THR 129 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 1o1c n PRO 130 N 0.18 0.00 0.00 -0.78 -0.04 -1.26 -3.16 135.00 129.94 1o1c n PRO 130 Ca 0.04 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.50 1o1c n PRO 130 Cb 0.54 -0.83 0.00 0.00 -0.04 0.00 0.00 33.50 33.17 1o1c n PRO 130 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1o1c n GLU 131 N -0.39 0.00 0.19 0.54 2.13 -1.26 0.96 120.64 122.81 1o1c n GLU 131 Ca 0.00 0.00 0.04 0.00 0.66 0.00 0.00 57.16 57.86 1o1c n GLU 131 Cb 0.00 0.00 0.39 0.00 0.27 0.00 0.00 31.44 32.10 1o1c n GLU 131 CO 0.00 0.00 0.00 0.93 -0.41 0.00 0.00 177.13 177.65 1o1c h GLU 132 N 0.00 0.00 0.00 5.31 5.08 -1.93 -2.29 114.58 120.75 1o1c h GLU 132 Ca 0.00 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.26 1o1c h GLU 132 Cb 0.00 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 1o1c h GLU 132 CO 0.00 0.35 -0.48 0.82 -1.00 0.00 0.00 179.01 178.71 1o1c h ILE 133 N 0.00 0.96 -0.00 3.13 2.04 4.67 -0.76 117.51 127.55 1o1c h ILE 133 Ca -0.00 -1.93 -0.18 0.00 1.00 0.00 0.00 64.86 63.75 1o1c h ILE 133 Cb 0.66 2.18 -0.02 0.00 -0.74 0.00 0.00 36.82 38.90 1o1c h ILE 133 CO 0.05 0.47 -0.81 0.11 0.00 0.00 0.00 178.15 177.96 1o1c h LYS 134 N 0.00 0.06 0.00 2.37 1.57 -1.37 -1.77 116.57 117.44 1o1c h LYS 134 Ca -0.00 -0.07 -0.11 0.00 -1.87 0.00 0.00 60.65 58.60 1o1c h LYS 134 Cb 1.14 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 33.45 1o1c h LYS 134 CO 0.06 0.84 -0.52 -0.91 -0.57 0.00 0.00 179.45 178.35 1o1c h ASN 135 N 0.04 0.00 -0.15 0.86 2.35 -1.14 -1.49 115.58 116.05 1o1c h ASN 135 Ca -0.02 0.00 -0.16 0.00 -0.55 0.00 0.00 56.30 55.57 1o1c h ASN 135 Cb 1.43 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.79 1o1c h ASN 135 CO 0.11 0.52 -0.50 0.24 -1.65 0.00 0.00 177.43 176.16 1o1c h MET 136 N 0.00 0.72 0.00 0.81 2.86 -0.67 -2.45 114.93 116.20 1o1c h MET 136 Ca -0.01 -0.43 -0.06 0.00 -2.06 0.00 0.00 59.70 57.15 1o1c h MET 136 Cb 1.19 0.04 -0.01 0.00 0.06 0.00 0.00 31.60 32.88 1o1c h MET 136 CO 0.07 1.05 -0.29 -1.49 1.06 0.00 0.00 176.91 177.31 1o1c h TRP 137 N 0.57 0.00 0.00 -0.22 4.06 -1.00 -3.11 115.95 116.25 1o1c h TRP 137 Ca 0.02 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.97 1o1c h TRP 137 Cb 1.06 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.22 1o1c h TRP 137 CO 0.05 0.29 0.00 0.00 -3.56 0.00 0.00 178.44 175.22 1o1c n ALA 138 N -2.21 2.01 0.00 1.49 0.00 -0.59 -3.78 120.51 117.42 1o1c n ALA 138 Ca 0.01 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.41 1o1c n ALA 138 Cb 0.53 -1.39 0.00 0.00 0.00 0.00 0.00 19.45 18.59 1o1c n ALA 138 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1o1c n ALA 139 N -1.60 0.07 -2.79 0.00 0.00 -1.24 -4.84 120.51 110.11 1o1c n ALA 139 Ca 0.05 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.06 1o1c n ALA 139 Cb 0.29 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.73 1o1c n ALA 139 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1o1c s PHE 140 N -0.05 3.09 0.00 0.00 2.99 -1.17 -5.00 117.98 117.83 1o1c s PHE 140 Ca 0.00 -1.65 0.00 0.00 0.00 0.00 0.00 56.93 55.28 1o1c s PHE 140 Cb 0.00 -4.48 0.00 0.00 0.00 0.00 0.00 43.02 38.54 1o1c s PHE 140 CO 0.00 -1.60 0.00 -2.30 -0.00 0.00 0.00 175.22 171.32 1o1c n PRO 141 N 7.03 2.91 0.19 0.24 -0.01 -1.25 -1.51 135.00 142.60 1o1c n PRO 141 Ca 0.36 0.00 -0.08 0.00 -0.01 0.00 0.00 63.50 63.78 1o1c n PRO 141 Cb 0.46 0.00 -0.04 0.00 -0.01 0.00 0.00 33.50 33.92 1o1c n PRO 141 CO 0.00 0.00 0.00 -1.00 -0.01 0.00 0.00 175.50 174.49 1o1c h PRO 142 N 0.00 -0.49 -0.22 0.52 0.13 -1.95 1.59 132.00 131.58 1o1c h PRO 142 Ca 0.00 0.03 0.06 0.00 -0.87 0.00 0.00 66.00 65.22 1o1c h PRO 142 Cb 0.00 0.11 -0.07 0.00 0.13 0.00 0.00 31.00 31.17 1o1c h PRO 142 CO 0.00 -0.33 -0.33 -0.44 -0.23 0.00 0.00 178.00 176.68 1o1c h ASP 143 N -0.72 -1.04 0.41 1.44 3.32 -1.97 4.37 116.42 122.23 1o1c h ASP 143 Ca -0.05 0.16 -0.01 0.00 0.02 0.00 0.00 57.03 57.15 1o1c h ASP 143 Cb 0.39 0.46 -0.01 0.00 0.22 0.00 0.00 39.33 40.39 1o1c h ASP 143 CO 0.09 -0.35 -0.27 0.58 -1.72 0.00 0.00 179.24 177.57 1o1c h VAL 144 N -0.36 0.44 0.04 -1.35 2.07 -1.74 0.20 116.25 115.56 1o1c h VAL 144 Ca 0.12 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.66 1o1c h VAL 144 Cb 0.55 0.44 -0.03 0.00 -1.52 0.00 0.00 31.29 30.72 1o1c h VAL 144 CO -0.41 0.00 -0.18 0.00 0.02 0.00 0.00 177.57 176.99 1o1c h ALA 145 N -0.13 -0.26 -0.98 1.67 0.00 0.34 -2.70 119.26 117.20 1o1c h ALA 145 Ca -0.04 -0.01 0.09 0.00 0.00 0.00 0.00 54.91 54.95 1o1c h ALA 145 Cb 0.55 0.31 -0.07 0.00 0.00 0.00 0.00 17.79 18.58 1o1c h ALA 145 CO 0.03 -0.69 0.63 0.78 0.00 0.00 0.00 179.25 180.00 1o1c h GLY 146 N -0.32 1.52 0.00 0.00 0.00 0.87 -3.45 103.07 101.68 1o1c h GLY 146 Ca 0.04 -0.43 0.00 0.00 0.00 0.00 0.00 47.33 46.94 1o1c h GLY 146 CO -0.15 0.25 0.00 0.70 0.00 0.00 0.00 176.54 177.34 1o1c n ASN 147 N -4.55 0.00 -0.06 0.19 3.02 0.58 0.29 115.26 114.74 1o1c n ASN 147 Ca 0.17 0.00 -0.02 0.00 -0.03 0.00 0.00 54.58 54.70 1o1c n ASN 147 Cb 0.27 0.00 -0.01 0.00 -0.61 0.00 0.00 39.78 39.44 1o1c n ASN 147 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 1o1c h VAL 148 N 0.00 0.00 -2.92 2.41 2.07 0.33 0.86 116.25 119.00 1o1c h VAL 148 Ca 0.00 -0.98 -0.26 0.00 0.82 0.00 0.00 66.70 66.28 1o1c h VAL 148 Cb 0.00 0.00 0.12 0.00 -1.52 0.00 0.00 31.29 29.89 1o1c h VAL 148 CO 0.00 0.00 0.18 -0.67 0.02 0.00 0.00 177.57 177.10 1o1c n ASP 149 N -4.65 -0.73 -3.64 0.57 4.64 -1.16 -1.98 116.55 109.59 1o1c n ASP 149 Ca -0.03 -1.12 -0.05 0.00 -1.38 0.00 0.00 54.79 52.21 1o1c n ASP 149 Cb 0.12 -0.63 -0.07 0.00 -1.04 0.00 0.00 41.12 39.50 1o1c n ASP 149 CO 0.00 0.00 0.00 -0.47 -0.82 0.00 0.00 177.20 175.91 1o1c s TYR 150 N -2.55 -0.21 0.00 -0.67 5.04 -1.26 -4.54 117.35 113.16 1o1c s TYR 150 Ca 0.46 0.50 0.00 0.00 -2.44 0.00 0.00 57.07 55.59 1o1c s TYR 150 Cb -0.03 0.43 0.00 0.00 0.35 0.00 0.00 41.96 42.72 1o1c s TYR 150 CO 0.33 -0.10 0.00 1.63 -1.34 0.00 0.00 175.55 176.07 1o1c n LYS 151 N 1.86 0.00 0.17 4.97 5.02 -1.26 -4.79 118.16 124.12 1o1c n LYS 151 Ca -0.11 0.00 0.03 0.00 -2.02 0.00 0.00 58.31 56.21 1o1c n LYS 151 Cb 0.56 0.00 0.26 0.00 -0.02 0.00 0.00 35.03 35.84 1o1c n LYS 151 CO 0.00 0.00 0.00 -0.91 -0.52 0.00 0.00 177.40 175.97 1o1c h ASN 152 N 0.67 0.00 0.74 4.39 2.35 -1.99 -2.35 115.58 119.39 1o1c h ASN 152 Ca 0.00 0.00 -0.17 0.00 -0.55 0.00 0.00 56.30 55.58 1o1c h ASN 152 Cb 0.00 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.35 1o1c h ASN 152 CO 0.00 0.47 -0.80 0.40 -1.65 0.00 0.00 177.43 175.85 1o1c h ILE 153 N 0.00 1.55 -0.06 2.81 2.04 -1.95 -1.83 117.51 120.06 1o1c h ILE 153 Ca -0.00 -2.66 -0.14 0.00 1.00 0.00 0.00 64.86 63.05 1o1c h ILE 153 Cb 0.99 2.44 -0.01 0.00 -0.74 0.00 0.00 36.82 39.50 1o1c h ILE 153 CO 0.06 0.76 -0.60 0.00 0.00 0.00 0.00 178.15 178.37 1o1c h TYR 155 N 0.16 0.08 0.00 0.00 -1.99 -1.23 -2.77 116.97 111.22 1o1c h TYR 155 Ca -0.01 -0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.71 1o1c h TYR 155 Cb 1.10 -0.02 0.00 0.00 2.00 0.00 0.00 36.73 39.81 1o1c h TYR 155 CO 0.02 0.38 0.00 0.28 -0.00 0.00 0.00 178.16 178.84 1o1c n VAL 156 N -4.88 0.31 0.13 -2.88 0.31 -0.71 -0.52 118.33 110.09 1o1c n VAL 156 Ca -0.07 -0.04 0.06 0.00 -0.01 0.00 0.00 64.34 64.27 1o1c n VAL 156 Cb 0.19 -0.61 0.03 0.00 -0.91 0.00 0.00 33.84 32.54 1o1c n VAL 156 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 1o1c h ILE 157 N 0.00 0.41 0.00 2.52 2.04 -1.04 -3.05 117.51 118.38 1o1c h ILE 157 Ca 0.00 -1.64 -0.34 0.00 1.00 0.00 0.00 64.86 63.88 1o1c h ILE 157 Cb 0.53 2.05 -0.06 0.00 -0.74 0.00 0.00 36.82 38.60 1o1c h ILE 157 CO 0.00 0.23 -2.16 0.41 0.00 0.00 0.00 178.15 176.63 1o1c n THR 158 N -3.01 1.48 -3.67 -0.27 -1.04 -0.62 -4.76 114.28 102.39 1o1c n THR 158 Ca -0.01 -0.82 -0.26 0.00 -2.04 0.00 0.00 64.05 60.92 1o1c n THR 158 Cb 0.67 -0.71 -0.17 0.00 -1.82 0.00 0.00 70.33 68.30 1o1c n THR 158 CO 0.00 0.00 0.00 -1.38 -0.64 0.00 0.00 175.07 173.05 1o1c s HIS 159 N -2.53 0.48 0.23 -1.42 -3.43 0.32 -5.11 115.29 103.83 1o1c s HIS 159 Ca -0.09 -0.43 -0.04 0.00 -0.80 0.00 0.00 55.06 53.70 1o1c s HIS 159 Cb 0.07 -0.79 0.06 0.00 -1.43 0.00 0.00 32.58 30.49 1o1c s HIS 159 CO 0.82 -0.50 0.15 0.41 -2.00 0.00 0.00 174.74 173.62 1o1c n GLY 160 N 5.20 -3.43 1.27 -1.38 0.00 -1.15 -3.70 105.19 101.99 1o1c n GLY 160 Ca -0.07 -1.30 0.14 0.00 0.00 0.00 0.00 46.02 44.79 1o1c n GLY 160 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1o1c n GLU 161 N -2.47 -2.65 -1.77 1.61 0.28 -1.26 -4.79 120.64 109.59 1o1c n GLU 161 Ca 0.02 2.14 -0.42 0.00 -0.16 0.00 0.00 57.16 58.75 1o1c n GLU 161 Cb 0.10 -3.22 -0.02 0.00 1.43 0.00 0.00 31.44 29.73 1o1c n GLU 161 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 177.13 176.46 1o1c s ASP 162 N -6.75 6.37 0.00 -1.84 1.11 -1.26 -4.86 116.67 109.45 1o1c s ASP 162 Ca 0.00 2.93 0.28 0.00 0.18 0.00 0.00 52.55 55.94 1o1c s ASP 162 Cb 0.00 -2.63 1.06 0.00 1.07 0.00 0.00 42.92 42.43 1o1c s ASP 162 CO 0.00 -0.93 1.75 0.00 1.18 0.00 0.00 175.17 177.17