#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ypi n ARG 3 N 0.00 0.00 -1.48 0.00 1.74 -1.26 -4.16 116.66 111.49 2ypi n ARG 3 Ca 0.00 0.00 -0.49 0.00 -0.77 0.00 0.00 57.85 56.59 2ypi n ARG 3 Cb 0.00 0.00 -0.06 0.00 -1.02 0.00 0.00 32.46 31.38 2ypi n ARG 3 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 2ypi n THR 4 N 0.00 0.23 -1.51 0.55 -1.04 -1.26 -4.85 114.28 106.40 2ypi n THR 4 Ca 0.00 -0.30 -0.56 0.00 -2.04 0.00 0.00 64.05 61.15 2ypi n THR 4 Cb 0.00 -1.84 -0.08 0.00 -1.82 0.00 0.00 70.33 66.58 2ypi n THR 4 CO 0.00 0.00 0.00 0.33 -0.64 0.00 0.00 175.07 174.76 2ypi n PHE 5 N 10.16 1.67 -3.84 -1.42 7.35 -1.26 -4.88 117.46 125.25 2ypi n PHE 5 Ca 0.38 0.52 -0.36 0.00 -0.76 0.00 0.00 57.45 57.23 2ypi n PHE 5 Cb 0.28 -2.44 -0.13 0.00 0.35 0.00 0.00 39.48 37.53 2ypi n PHE 5 CO 0.00 0.00 0.00 0.12 -0.76 0.00 0.00 176.76 176.12 2ypi s PHE 6 N 5.51 3.05 -0.19 -5.13 5.36 -1.02 -2.77 117.98 122.79 2ypi s PHE 6 Ca 1.08 -0.92 0.01 0.00 -0.96 0.00 0.00 56.93 56.14 2ypi s PHE 6 Cb -1.10 -2.17 0.03 0.00 -0.34 0.00 0.00 43.02 39.44 2ypi s PHE 6 CO 0.60 -0.54 -0.18 0.08 -1.46 0.00 0.00 175.22 173.73 2ypi s VAL 7 N 1.49 2.03 0.12 3.12 1.01 -0.62 -0.94 120.40 126.61 2ypi s VAL 7 Ca 0.04 -1.04 0.05 0.00 0.00 0.00 0.00 61.98 61.03 2ypi s VAL 7 Cb -0.15 -1.90 -0.04 0.00 0.00 0.00 0.00 36.38 34.29 2ypi s VAL 7 CO -0.01 0.42 0.06 -0.83 0.00 0.00 0.00 175.10 174.75 2ypi s GLY 8 N 1.28 1.87 -0.26 4.51 0.00 0.63 -2.65 107.32 112.69 2ypi s GLY 8 Ca 0.02 -1.14 -0.03 0.00 0.00 0.00 0.00 44.72 43.57 2ypi s GLY 8 CO -0.11 -1.14 0.09 -0.32 0.00 0.00 0.00 173.10 171.62 2ypi s GLY 9 N -2.64 0.70 -1.24 0.20 0.00 -1.05 -0.29 107.32 103.01 2ypi s GLY 9 Ca 0.28 -1.09 -0.14 0.00 0.00 0.00 0.00 44.72 43.78 2ypi s GLY 9 CO 0.21 1.74 1.55 -2.01 0.00 0.00 0.00 173.10 174.59 2ypi n ASN 10 N 5.08 5.14 0.01 1.64 5.15 -0.52 0.02 115.26 131.79 2ypi n ASN 10 Ca -0.06 -2.98 0.01 0.00 -0.60 0.00 0.00 54.58 50.95 2ypi n ASN 10 Cb 0.44 -1.59 0.04 0.00 -0.53 0.00 0.00 39.78 38.14 2ypi n ASN 10 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 2ypi n PHE 11 N 5.81 0.05 -1.63 1.20 0.99 -1.04 -4.36 117.46 118.49 2ypi n PHE 11 Ca 0.39 0.03 0.00 0.00 -0.00 0.00 0.00 57.45 57.87 2ypi n PHE 11 Cb 0.42 -0.50 0.00 0.00 -1.00 0.00 0.00 39.48 38.41 2ypi n PHE 11 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.76 178.39 2ypi n LYS 12 N -1.51 0.00 -2.54 -1.08 5.02 -1.26 -2.87 118.16 113.93 2ypi n LYS 12 Ca -0.00 0.00 -0.43 0.00 -2.02 0.00 0.00 58.31 55.86 2ypi n LYS 12 Cb 0.05 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.06 2ypi n LYS 12 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 2ypi n LEU 13 N 0.00 6.07 -3.66 -0.35 7.94 -1.26 -4.15 117.00 121.59 2ypi n LEU 13 Ca 0.00 -4.52 -0.11 0.00 -1.11 0.00 0.00 56.01 50.27 2ypi n LEU 13 Cb 0.00 -1.55 -0.11 0.00 0.53 0.00 0.00 43.42 42.29 2ypi n LEU 13 CO 0.00 1.08 -0.04 0.20 -1.11 0.00 0.00 177.39 177.51 2ypi s ASN 14 N 1.84 -0.01 0.00 1.96 0.01 -1.14 -5.14 114.94 112.46 2ypi s ASN 14 Ca 0.42 0.81 0.00 0.00 -0.71 0.00 0.00 52.86 53.38 2ypi s ASN 14 Cb 0.05 1.02 0.00 0.00 0.41 0.00 0.00 41.25 42.73 2ypi s ASN 14 CO 0.00 -0.23 0.00 0.61 -1.51 0.00 0.00 177.10 175.97 2ypi n GLY 15 N 5.28 3.66 3.17 0.66 0.00 -1.26 -4.72 105.19 111.98 2ypi n GLY 15 Ca -0.09 -0.98 -0.14 0.00 0.00 0.00 0.00 46.02 44.81 2ypi n GLY 15 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2ypi s SER 16 N 0.00 1.41 0.20 1.61 1.04 -1.26 -5.00 113.70 111.70 2ypi s SER 16 Ca 0.00 -0.79 -0.05 0.00 0.48 0.00 0.00 55.95 55.59 2ypi s SER 16 Cb 0.00 0.01 0.13 0.00 0.10 0.00 0.00 66.02 66.26 2ypi s SER 16 CO 0.00 -0.25 1.57 0.11 0.98 0.00 0.00 173.24 175.64 2ypi h LYS 17 N 3.65 0.73 -0.96 4.02 1.57 -2.00 -0.46 116.57 123.12 2ypi h LYS 17 Ca -0.37 -0.35 0.20 0.00 -1.87 0.00 0.00 60.65 58.26 2ypi h LYS 17 Cb 1.19 -0.00 -0.08 0.00 0.08 0.00 0.00 32.23 33.41 2ypi h LYS 17 CO 0.52 0.97 0.61 0.37 -0.57 0.00 0.00 179.45 181.35 2ypi h GLN 18 N 0.61 0.53 0.08 3.15 4.15 -2.00 -1.81 115.11 119.81 2ypi h GLN 18 Ca 0.06 -0.03 -0.33 0.00 0.77 0.00 0.00 58.65 59.12 2ypi h GLN 18 Cb 0.88 -0.12 -0.03 0.00 0.21 0.00 0.00 27.48 28.43 2ypi h GLN 18 CO 0.08 0.35 -1.81 1.03 -1.93 0.00 0.00 178.83 176.54 2ypi h SER 19 N 0.54 0.27 1.03 -0.69 0.87 -1.85 -3.37 113.55 110.36 2ypi h SER 19 Ca 0.52 -0.55 0.00 0.00 -1.23 0.00 0.00 61.79 60.53 2ypi h SER 19 Cb 1.10 -0.09 0.00 0.00 -0.44 0.00 0.00 62.40 62.97 2ypi h SER 19 CO -0.26 1.49 0.00 2.30 -0.53 0.00 0.00 176.83 179.83 2ypi n ILE 20 N -3.32 0.68 0.01 2.23 -5.35 -0.22 -1.56 119.36 111.82 2ypi n ILE 20 Ca -0.24 0.00 -0.19 0.00 -0.27 0.00 0.00 62.75 62.06 2ypi n ILE 20 Cb 1.05 -0.86 -0.09 0.00 -1.74 0.00 0.00 39.64 37.99 2ypi n ILE 20 CO 0.00 0.00 0.00 0.07 -1.76 0.00 0.00 176.55 174.86 2ypi h LYS 21 N 0.00 0.67 0.00 6.28 2.10 -1.49 -0.84 116.57 123.29 2ypi h LYS 21 Ca 0.00 -0.65 0.00 0.00 -2.00 0.00 0.00 60.65 58.00 2ypi h LYS 21 Cb 0.52 0.17 0.00 0.00 -0.90 0.00 0.00 32.23 32.02 2ypi h LYS 21 CO 0.00 1.25 0.00 0.39 -2.00 0.00 0.00 179.45 179.09 2ypi n GLU 22 N -3.97 0.00 0.00 0.07 1.02 -0.60 0.20 120.64 117.36 2ypi n GLU 22 Ca -0.10 0.21 0.00 0.00 -0.02 0.00 0.00 57.16 57.26 2ypi n GLU 22 Cb 0.79 -1.19 0.00 0.00 -0.02 0.00 0.00 31.44 31.01 2ypi n GLU 22 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 2ypi n ILE 23 N -1.11 0.00 -0.05 -3.67 2.08 -0.97 0.19 119.36 115.83 2ypi n ILE 23 Ca 0.00 0.10 -0.08 0.00 0.56 0.00 0.00 62.75 63.34 2ypi n ILE 23 Cb 0.00 -0.18 -0.02 0.00 -0.75 0.00 0.00 39.64 38.69 2ypi n ILE 23 CO 0.00 0.00 0.00 0.58 0.56 0.00 0.00 176.55 177.69 2ypi h VAL 24 N 0.00 0.71 0.18 1.39 2.07 -1.23 -0.02 116.25 119.35 2ypi h VAL 24 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 2ypi h VAL 24 Cb 0.00 0.71 -0.03 0.00 -1.52 0.00 0.00 31.29 30.45 2ypi h VAL 24 CO 0.00 0.00 -0.43 -0.08 0.02 0.00 0.00 177.57 177.08 2ypi h GLU 25 N -0.04 -0.65 -0.82 1.57 4.22 0.10 0.13 114.58 119.11 2ypi h GLU 25 Ca 0.12 0.04 0.12 0.00 0.08 0.00 0.00 59.36 59.73 2ypi h GLU 25 Cb 0.22 0.15 -0.13 0.00 0.50 0.00 0.00 28.75 29.49 2ypi h GLU 25 CO -0.26 -0.43 -0.33 -2.13 -2.18 0.00 0.00 179.01 173.68 2ypi n ARG 26 N -4.92 -0.20 -0.31 1.92 0.63 0.13 0.30 116.66 114.20 2ypi n ARG 26 Ca -0.08 1.25 0.04 0.00 -0.92 0.00 0.00 57.85 58.15 2ypi n ARG 26 Cb 0.35 -1.86 0.19 0.00 0.45 0.00 0.00 32.46 31.59 2ypi n ARG 26 CO 0.00 0.00 0.00 1.25 -2.51 0.00 0.00 177.63 176.37 2ypi h LEU 27 N 0.00 0.75 -0.71 6.15 5.85 0.10 -2.92 115.31 124.54 2ypi h LEU 27 Ca 0.28 0.05 -0.11 0.00 0.84 0.00 0.00 57.88 58.94 2ypi h LEU 27 Cb 0.48 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.40 2ypi h LEU 27 CO -0.81 0.42 -0.18 0.78 -0.34 0.00 0.00 178.44 178.31 2ypi h ASN 28 N 0.85 0.81 0.03 1.25 4.21 0.23 -3.06 115.58 119.91 2ypi h ASN 28 Ca 0.43 -0.28 -0.03 0.00 1.21 0.00 0.00 56.30 57.63 2ypi h ASN 28 Cb 0.41 -0.22 -0.01 0.00 -1.12 0.00 0.00 38.32 37.38 2ypi h ASN 28 CO -0.26 0.98 -0.10 0.74 -1.29 0.00 0.00 177.43 177.51 2ypi h THR 29 N 0.71 1.13 -3.59 2.81 2.02 -1.32 -3.45 112.91 111.22 2ypi h THR 29 Ca 0.11 -0.57 -0.52 0.00 0.77 0.00 0.00 66.41 66.19 2ypi h THR 29 Cb 0.69 1.16 0.06 0.00 -1.74 0.00 0.00 68.15 68.32 2ypi h THR 29 CO 0.05 0.18 0.70 0.00 0.37 0.00 0.00 175.52 176.82 2ypi s ALA 30 N -4.81 3.56 -0.47 6.16 0.00 -1.12 -5.03 121.76 120.06 2ypi s ALA 30 Ca -0.05 1.28 -0.24 0.00 0.00 0.00 0.00 51.96 52.95 2ypi s ALA 30 Cb 0.16 -3.52 0.03 0.00 0.00 0.00 0.00 23.12 19.79 2ypi s ALA 30 CO 0.71 -0.68 0.83 -1.12 0.00 0.00 0.00 175.76 175.50 2ypi s SER 31 N 0.01 6.41 0.03 0.00 0.01 -1.26 -4.98 113.70 113.92 2ypi s SER 31 Ca 0.55 -0.13 -0.07 0.00 1.31 0.00 0.00 55.95 57.61 2ypi s SER 31 Cb -0.40 -2.40 -0.01 0.00 0.21 0.00 0.00 66.02 63.42 2ypi s SER 31 CO 0.47 -0.99 0.12 0.27 0.41 0.00 0.00 173.24 173.52 2ypi s ILE 32 N 3.47 0.12 1.21 1.44 -4.36 -1.26 -4.94 121.20 116.88 2ypi s ILE 32 Ca 0.31 -0.99 -0.15 0.00 -0.26 0.00 0.00 60.65 59.57 2ypi s ILE 32 Cb -0.12 -0.82 0.30 0.00 1.25 0.00 0.00 42.46 43.07 2ypi s ILE 32 CO 0.23 -0.54 1.01 -2.16 0.24 0.00 0.00 174.94 173.72 2ypi s PRO 33 N -2.40 -1.28 0.01 0.37 0.04 -1.26 -4.97 135.00 125.51 2ypi s PRO 33 Ca -0.07 0.64 0.22 0.00 0.04 0.00 0.00 61.00 61.84 2ypi s PRO 33 Cb -0.02 -1.53 -0.22 0.00 0.04 0.00 0.00 34.50 32.77 2ypi s PRO 33 CO -0.03 -3.91 0.70 0.39 0.04 0.00 0.00 177.00 174.18 2ypi n GLU 34 N -5.02 0.49 -1.62 4.56 1.02 -1.26 -4.28 120.64 114.52 2ypi n GLU 34 Ca 0.04 -0.10 -0.31 0.00 -0.02 0.00 0.00 57.16 56.77 2ypi n GLU 34 Cb 0.56 -1.56 -0.05 0.00 -0.02 0.00 0.00 31.44 30.37 2ypi n GLU 34 CO 0.00 0.00 0.00 0.27 1.18 0.00 0.00 177.13 178.58 2ypi n ASN 35 N -2.14 7.12 -3.96 1.62 6.94 -1.26 -4.85 115.26 118.73 2ypi n ASN 35 Ca -0.01 -3.07 -0.08 0.00 -0.02 0.00 0.00 54.58 51.40 2ypi n ASN 35 Cb 0.51 -1.32 -0.09 0.00 -2.36 0.00 0.00 39.78 36.52 2ypi n ASN 35 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 2ypi s VAL 36 N -1.21 0.17 -0.25 3.53 0.11 -1.26 -4.41 120.40 117.08 2ypi s VAL 36 Ca 0.59 -1.43 -0.02 0.00 -2.93 0.00 0.00 61.98 58.18 2ypi s VAL 36 Cb 0.29 -1.37 0.14 0.00 -1.53 0.00 0.00 36.38 33.91 2ypi s VAL 36 CO -0.14 -0.79 0.40 -0.70 -3.33 0.00 0.00 175.10 170.54 2ypi s GLU 37 N -3.75 0.38 -0.03 1.54 2.12 -1.11 -4.65 118.70 113.19 2ypi s GLU 37 Ca 0.05 0.52 0.03 0.00 0.36 0.00 0.00 54.97 55.93 2ypi s GLU 37 Cb 0.06 -0.37 0.00 0.00 0.26 0.00 0.00 34.13 34.08 2ypi s GLU 37 CO -0.10 -0.69 -0.11 0.54 -0.54 0.00 0.00 175.26 174.36 2ypi s VAL 38 N 2.57 0.93 0.03 3.70 0.11 -1.24 -1.59 120.40 124.91 2ypi s VAL 38 Ca 0.13 -0.43 0.07 0.00 -2.93 0.00 0.00 61.98 58.82 2ypi s VAL 38 Cb -0.15 -0.83 -0.02 0.00 -1.53 0.00 0.00 36.38 33.85 2ypi s VAL 38 CO -0.18 0.29 -0.21 0.68 -3.33 0.00 0.00 175.10 172.34 2ypi s VAL 39 N 0.23 1.70 -0.35 2.04 -7.23 -1.08 -1.83 120.40 113.88 2ypi s VAL 39 Ca -0.05 -1.14 -0.09 0.00 -1.81 0.00 0.00 61.98 58.90 2ypi s VAL 39 Cb -0.10 -1.46 0.03 0.00 0.56 0.00 0.00 36.38 35.41 2ypi s VAL 39 CO 0.01 0.29 0.15 0.27 -0.31 0.00 0.00 175.10 175.51 2ypi s ILE 40 N -0.72 4.24 -1.13 -0.62 -4.36 -0.10 -2.54 121.20 115.98 2ypi s ILE 40 Ca 0.08 -0.89 -0.08 0.00 -0.26 0.00 0.00 60.65 59.50 2ypi s ILE 40 Cb -0.09 -3.34 0.27 0.00 1.25 0.00 0.00 42.46 40.56 2ypi s ILE 40 CO 0.01 -0.15 1.28 0.00 0.24 0.00 0.00 174.94 176.32 2ypi s PRO 42 N -1.34 2.38 0.39 0.00 0.04 -1.26 -2.49 135.00 132.71 2ypi s PRO 42 Ca 0.33 0.29 -0.25 0.00 0.04 0.00 0.00 61.00 61.41 2ypi s PRO 42 Cb -0.04 -1.98 -0.11 0.00 0.04 0.00 0.00 34.50 32.40 2ypi s PRO 42 CO -0.02 -1.34 0.96 -0.35 0.04 0.00 0.00 177.00 176.29 2ypi n PRO 43 N -3.18 1.26 0.21 0.56 -0.04 -1.26 -4.31 135.00 128.24 2ypi n PRO 43 Ca 0.07 0.45 0.18 0.00 -0.04 0.00 0.00 63.50 64.16 2ypi n PRO 43 Cb 0.59 -1.94 0.84 0.00 -0.04 0.00 0.00 33.50 32.95 2ypi n PRO 43 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2ypi h ALA 44 N 1.55 1.74 0.00 0.55 0.00 -1.95 -2.58 119.26 118.57 2ypi h ALA 44 Ca -0.43 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.47 2ypi h ALA 44 Cb 1.35 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.15 2ypi h ALA 44 CO 0.57 -0.35 0.00 1.79 0.00 0.00 0.00 179.25 181.26 2ypi h THR 45 N 0.00 0.00 0.00 0.00 1.35 -2.03 -3.29 112.91 108.94 2ypi h THR 45 Ca 0.09 -0.64 -0.01 0.00 -0.55 0.00 0.00 66.41 65.31 2ypi h THR 45 Cb 0.59 1.62 -0.02 0.00 -1.73 0.00 0.00 68.15 68.62 2ypi h THR 45 CO -0.00 0.00 -0.21 -1.22 -0.25 0.00 0.00 175.52 173.84 2ypi n TYR 46 N -2.57 0.00 0.59 4.73 4.02 -0.98 -4.68 117.16 118.28 2ypi n TYR 46 Ca 0.05 -0.93 0.08 0.00 -0.01 0.00 0.00 57.90 57.08 2ypi n TYR 46 Cb 0.45 -0.15 0.36 0.00 -0.02 0.00 0.00 39.34 39.97 2ypi n TYR 46 CO 0.00 0.00 0.00 -0.11 -1.01 0.00 0.00 176.86 175.74 2ypi n LEU 47 N -1.09 0.00 -0.01 7.72 0.00 -1.20 -1.43 117.00 120.99 2ypi n LEU 47 Ca 0.14 0.48 0.03 0.00 0.00 0.00 0.00 56.01 56.65 2ypi n LEU 47 Cb 0.68 -0.48 -0.06 0.00 0.00 0.00 0.00 43.42 43.56 2ypi n LEU 47 CO -0.00 -0.21 -0.63 -0.67 0.00 0.00 0.00 177.39 175.88 2ypi n ASP 48 N -1.48 3.07 -0.02 1.96 -0.08 -1.26 -3.75 116.55 114.99 2ypi n ASP 48 Ca 0.04 0.00 -0.13 0.00 -1.51 0.00 0.00 54.79 53.20 2ypi n ASP 48 Cb 0.19 1.24 -0.09 0.00 2.34 0.00 0.00 41.12 44.80 2ypi n ASP 48 CO 0.00 0.00 0.00 0.22 0.12 0.00 0.00 177.20 177.54 2ypi h TYR 49 N 0.00 0.10 0.55 -0.67 -0.00 -1.87 -2.65 116.97 112.42 2ypi h TYR 49 Ca -0.04 -0.02 -0.02 0.00 -0.00 0.00 0.00 58.73 58.64 2ypi h TYR 49 Cb 0.62 -0.02 -0.02 0.00 -0.00 0.00 0.00 36.73 37.30 2ypi h TYR 49 CO 0.00 0.46 -0.50 0.77 -0.00 0.00 0.00 178.16 178.89 2ypi h SER 50 N -0.29 -1.36 -1.13 -2.11 0.02 -1.45 0.12 113.55 107.36 2ypi h SER 50 Ca 0.01 0.10 0.41 0.00 -0.84 0.00 0.00 61.79 61.48 2ypi h SER 50 Cb 0.43 0.44 -0.16 0.00 0.14 0.00 0.00 62.40 63.25 2ypi h SER 50 CO 0.01 -0.68 0.67 0.58 -1.14 0.00 0.00 176.83 176.27 2ypi h VAL 51 N -1.03 0.08 0.00 2.27 2.07 -1.64 3.83 116.25 121.83 2ypi h VAL 51 Ca -0.07 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.42 2ypi h VAL 51 Cb 0.88 -0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.65 2ypi h VAL 51 CO -0.04 0.01 -0.18 -1.20 0.02 0.00 0.00 177.57 176.19 2ypi n SER 52 N -5.02 0.23 -0.06 0.57 7.64 -0.35 -3.63 113.62 113.01 2ypi n SER 52 Ca 0.37 0.25 -0.11 0.00 1.01 0.00 0.00 58.87 60.39 2ypi n SER 52 Cb 1.31 -0.25 -0.15 0.00 -1.01 0.00 0.00 64.21 64.11 2ypi n SER 52 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2ypi n LEU 53 N -1.57 0.87 -4.58 -3.43 4.77 1.26 -4.93 117.00 109.39 2ypi n LEU 53 Ca 0.06 0.18 -0.47 0.00 -0.03 0.00 0.00 56.01 55.75 2ypi n LEU 53 Cb 0.35 0.09 -0.05 0.00 -2.33 0.00 0.00 43.42 41.48 2ypi n LEU 53 CO 0.30 0.53 1.72 0.52 -1.33 0.00 0.00 177.39 179.13 2ypi n VAL 54 N -2.98 0.38 -2.77 4.08 0.31 -0.50 -4.84 118.33 112.00 2ypi n VAL 54 Ca -0.28 -0.28 -0.16 0.00 -0.01 0.00 0.00 64.34 63.62 2ypi n VAL 54 Cb 1.09 -2.04 0.00 0.00 -0.91 0.00 0.00 33.84 31.98 2ypi n VAL 54 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 2ypi n LYS 55 N 7.89 1.76 -3.63 5.55 5.02 -1.26 -5.01 118.16 128.48 2ypi n LYS 55 Ca 0.31 -3.68 -0.08 0.00 -2.02 0.00 0.00 58.31 52.83 2ypi n LYS 55 Cb 0.33 -1.64 -0.09 0.00 -0.02 0.00 0.00 35.03 33.60 2ypi n LYS 55 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2ypi s LYS 56 N -3.08 0.32 0.40 1.97 -0.14 -1.26 -4.86 119.74 113.09 2ypi s LYS 56 Ca 0.36 1.00 0.16 0.00 -1.36 0.00 0.00 55.97 56.13 2ypi s LYS 56 Cb 0.41 0.27 1.05 0.00 -1.68 0.00 0.00 37.83 37.88 2ypi s LYS 56 CO -0.05 -0.28 1.82 -1.35 -0.76 0.00 0.00 175.35 174.73 2ypi h PRO 57 N 8.17 0.44 -0.21 -1.68 0.11 -1.99 -2.77 132.00 134.07 2ypi h PRO 57 Ca -0.16 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.93 2ypi h PRO 57 Cb 1.11 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.11 2ypi h PRO 57 CO 0.13 0.29 0.14 1.96 -0.21 0.00 0.00 178.00 180.31 2ypi h GLN 58 N 0.45 0.27 -6.84 1.05 7.50 -1.92 -3.44 115.11 112.18 2ypi h GLN 58 Ca 0.52 -0.02 -0.50 0.00 0.50 0.00 0.00 58.65 59.15 2ypi h GLN 58 Cb 1.23 -0.06 0.01 0.00 0.05 0.00 0.00 27.48 28.71 2ypi h GLN 58 CO -0.23 0.18 0.44 0.54 -1.50 0.00 0.00 178.83 178.26 2ypi s VAL 59 N -6.18 3.64 0.02 -0.54 0.11 -1.05 -3.60 120.40 112.80 2ypi s VAL 59 Ca -0.13 1.55 -0.08 0.00 -2.93 0.00 0.00 61.98 60.39 2ypi s VAL 59 Cb 0.09 -3.95 0.00 0.00 -1.53 0.00 0.00 36.38 30.99 2ypi s VAL 59 CO 0.69 0.29 0.17 0.42 -3.33 0.00 0.00 175.10 173.34 2ypi s THR 60 N -1.29 0.10 0.16 5.04 -4.23 -0.76 -4.89 115.64 109.77 2ypi s THR 60 Ca 0.47 -0.79 -0.07 0.00 -1.18 0.00 0.00 61.69 60.12 2ypi s THR 60 Cb -0.29 -0.66 -0.06 0.00 1.34 0.00 0.00 72.50 72.84 2ypi s THR 60 CO 0.36 -0.43 0.43 -0.69 -0.54 0.00 0.00 174.62 173.75 2ypi s VAL 61 N -1.90 5.09 0.16 2.29 1.01 -1.26 -0.93 120.40 124.85 2ypi s VAL 61 Ca -0.10 0.23 0.02 0.00 0.00 0.00 0.00 61.98 62.13 2ypi s VAL 61 Cb -0.05 -3.63 -0.01 0.00 0.00 0.00 0.00 36.38 32.70 2ypi s VAL 61 CO -0.01 0.05 0.08 0.61 0.00 0.00 0.00 175.10 175.83 2ypi n GLY 62 N 0.16 3.69 3.29 4.51 0.00 -0.87 0.24 105.19 116.19 2ypi n GLY 62 Ca -0.02 -1.92 -0.16 0.00 0.00 0.00 0.00 46.02 43.92 2ypi n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ypi s ALA 63 N -2.49 1.64 0.06 4.61 0.00 -1.14 -4.25 121.76 120.19 2ypi s ALA 63 Ca 0.11 -1.58 -0.11 0.00 0.00 0.00 0.00 51.96 50.38 2ypi s ALA 63 Cb 0.01 0.11 -0.30 0.00 0.00 0.00 0.00 23.12 22.93 2ypi s ALA 63 CO 0.08 -0.10 1.09 1.96 0.00 0.00 0.00 175.76 178.79 2ypi h GLN 64 N 2.67 0.44 -2.13 0.00 4.20 -1.83 0.87 115.11 119.33 2ypi h GLN 64 Ca -0.37 -0.71 0.12 0.00 0.06 0.00 0.00 58.65 57.75 2ypi h GLN 64 Cb 1.20 0.26 -0.16 0.00 0.30 0.00 0.00 27.48 29.08 2ypi h GLN 64 CO 0.64 1.33 0.53 1.21 -0.67 0.00 0.00 178.83 181.87 2ypi s ASN 65 N -7.37 -0.34 0.12 1.46 3.84 -1.26 -4.24 114.94 107.15 2ypi s ASN 65 Ca -0.07 0.04 -0.08 0.00 0.21 0.00 0.00 52.86 52.96 2ypi s ASN 65 Cb 0.06 0.35 -0.01 0.00 -0.55 0.00 0.00 41.25 41.10 2ypi s ASN 65 CO 0.92 -0.55 0.21 0.00 -2.79 0.00 0.00 177.10 174.88 2ypi s ALA 66 N -2.87 -0.02 0.90 1.71 0.00 -1.26 -4.64 121.76 115.58 2ypi s ALA 66 Ca 0.05 -0.81 -0.11 0.00 0.00 0.00 0.00 51.96 51.09 2ypi s ALA 66 Cb -0.01 0.65 0.19 0.00 0.00 0.00 0.00 23.12 23.95 2ypi s ALA 66 CO -0.08 -0.56 1.23 -0.47 0.00 0.00 0.00 175.76 175.89 2ypi s TYR 67 N -3.92 1.36 -2.60 0.00 5.04 -0.24 -4.89 117.35 112.11 2ypi s TYR 67 Ca 0.11 0.03 0.21 0.00 -2.44 0.00 0.00 57.07 54.98 2ypi s TYR 67 Cb 0.05 -3.77 0.16 0.00 0.35 0.00 0.00 41.96 38.74 2ypi s TYR 67 CO -0.06 -2.44 1.16 1.47 -1.34 0.00 0.00 175.55 174.35 2ypi n LEU 68 N -3.49 2.72 -4.49 6.97 -0.00 -1.26 -4.80 117.00 112.64 2ypi n LEU 68 Ca 0.16 -0.99 -0.30 0.00 -0.00 0.00 0.00 56.01 54.89 2ypi n LEU 68 Cb 0.60 0.00 -0.12 0.00 -0.00 0.00 0.00 43.42 43.90 2ypi n LEU 68 CO 0.43 0.46 -0.48 -0.54 -0.00 0.00 0.00 177.39 177.26 2ypi s LYS 69 N -1.79 1.94 0.00 1.47 -0.14 -1.26 -4.86 119.74 115.10 2ypi s LYS 69 Ca 0.24 -1.08 0.21 0.00 -1.36 0.00 0.00 55.97 53.98 2ypi s LYS 69 Cb 0.18 -2.17 0.10 0.00 -1.68 0.00 0.00 37.83 34.26 2ypi s LYS 69 CO 0.28 0.51 1.11 0.00 -0.76 0.00 0.00 175.35 176.48 2ypi n ALA 70 N 1.08 2.80 -3.62 5.17 0.00 -1.26 -4.74 120.51 119.94 2ypi n ALA 70 Ca -0.16 -0.64 -0.07 0.00 0.00 0.00 0.00 53.44 52.57 2ypi n ALA 70 Cb 0.52 -0.71 -0.06 0.00 0.00 0.00 0.00 19.45 19.21 2ypi n ALA 70 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2ypi s SER 71 N -1.93 -0.26 0.00 0.00 1.04 -1.26 -4.58 113.70 106.71 2ypi s SER 71 Ca 0.22 0.38 0.00 0.00 0.48 0.00 0.00 55.95 57.03 2ypi s SER 71 Cb 0.17 0.35 0.00 0.00 0.10 0.00 0.00 66.02 66.64 2ypi s SER 71 CO 0.35 -0.16 0.00 0.61 0.98 0.00 0.00 173.24 175.02 2ypi n GLY 72 N 1.22 -1.25 3.24 7.32 0.00 -1.26 -5.00 105.19 109.46 2ypi n GLY 72 Ca -0.09 -1.39 -0.43 0.00 0.00 0.00 0.00 46.02 44.12 2ypi n GLY 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ypi n ALA 73 N -0.20 4.38 -3.10 4.61 0.00 -1.26 -4.71 120.51 120.22 2ypi n ALA 73 Ca 0.00 -3.96 -0.21 0.00 0.00 0.00 0.00 53.44 49.27 2ypi n ALA 73 Cb 0.00 -3.45 -0.03 0.00 0.00 0.00 0.00 19.45 15.96 2ypi n ALA 73 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2ypi n PHE 74 N 6.90 1.49 -1.60 0.00 3.01 -1.26 -5.10 117.46 120.89 2ypi n PHE 74 Ca 0.47 -3.88 -0.57 0.00 1.01 0.00 0.00 57.45 54.49 2ypi n PHE 74 Cb 0.42 -0.44 -0.08 0.00 -0.01 0.00 0.00 39.48 39.37 2ypi n PHE 74 CO 0.00 0.00 0.00 2.41 1.01 0.00 0.00 176.76 180.18 2ypi n THR 75 N 0.10 0.23 -0.03 4.37 -1.04 -1.26 -2.14 114.28 114.52 2ypi n THR 75 Ca 0.27 -0.09 0.00 0.00 -2.04 0.00 0.00 64.05 62.19 2ypi n THR 75 Cb 0.57 -1.20 0.00 0.00 -1.82 0.00 0.00 70.33 67.88 2ypi n THR 75 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2ypi n GLY 76 N 5.12 0.36 3.96 3.41 0.00 -1.26 -5.11 105.19 111.67 2ypi n GLY 76 Ca 0.33 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.11 2ypi n GLY 76 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2ypi s GLU 77 N -0.96 1.86 -0.13 1.61 2.56 -0.91 -5.13 118.70 117.61 2ypi s GLU 77 Ca 0.00 -0.67 0.01 0.00 0.00 0.00 0.00 54.97 54.32 2ypi s GLU 77 Cb 0.00 -2.24 -0.01 0.00 2.00 0.00 0.00 34.13 33.89 2ypi s GLU 77 CO 0.00 -1.38 -0.17 -0.80 -0.56 0.00 0.00 175.26 172.35 2ypi s ASN 78 N -4.63 3.60 -0.19 -1.70 0.01 -1.26 -5.00 114.94 105.78 2ypi s ASN 78 Ca 0.64 -0.45 -0.06 0.00 -0.71 0.00 0.00 52.86 52.28 2ypi s ASN 78 Cb -0.08 -1.53 -0.03 0.00 0.41 0.00 0.00 41.25 40.02 2ypi s ASN 78 CO 0.45 0.13 0.02 -0.55 -1.51 0.00 0.00 177.10 175.64 2ypi s SER 79 N 0.51 5.13 0.56 -1.22 0.15 -1.26 -1.08 113.70 116.50 2ypi s SER 79 Ca -0.11 -0.08 0.29 0.00 0.70 0.00 0.00 55.95 56.74 2ypi s SER 79 Cb -0.16 -1.87 1.47 0.00 -1.71 0.00 0.00 66.02 63.74 2ypi s SER 79 CO 0.04 0.12 1.92 0.58 1.20 0.00 0.00 173.24 177.11 2ypi h VAL 80 N 5.15 0.50 -0.01 4.45 2.07 -1.86 -0.60 116.25 125.94 2ypi h VAL 80 Ca -0.35 0.00 -0.15 0.00 0.82 0.00 0.00 66.70 67.02 2ypi h VAL 80 Cb 1.18 0.63 -0.02 0.00 -1.52 0.00 0.00 31.29 31.56 2ypi h VAL 80 CO 0.64 0.00 -0.71 0.44 0.02 0.00 0.00 177.57 177.96 2ypi h ASP 81 N 0.00 0.08 0.04 0.57 5.19 -1.93 -0.95 116.42 119.43 2ypi h ASP 81 Ca 0.27 -0.06 -0.00 0.00 -0.62 0.00 0.00 57.03 56.62 2ypi h ASP 81 Cb 1.26 -0.03 0.00 0.00 0.18 0.00 0.00 39.33 40.75 2ypi h ASP 81 CO -0.00 0.77 -0.02 1.56 -3.12 0.00 0.00 179.24 178.42 2ypi h GLN 82 N 0.05 -0.05 -0.01 3.56 4.20 -1.49 0.14 115.11 121.49 2ypi h GLN 82 Ca -0.01 0.00 0.02 0.00 0.06 0.00 0.00 58.65 58.73 2ypi h GLN 82 Cb 1.26 0.01 -0.06 0.00 0.30 0.00 0.00 27.48 28.99 2ypi h GLN 82 CO 0.10 0.60 -0.51 0.82 -0.67 0.00 0.00 178.83 179.17 2ypi h ILE 83 N -0.82 0.04 0.47 2.54 5.03 -1.21 2.33 117.51 125.89 2ypi h ILE 83 Ca -0.01 0.00 -0.02 0.00 -0.12 0.00 0.00 64.86 64.72 2ypi h ILE 83 Cb 0.68 0.04 -0.01 0.00 -3.03 0.00 0.00 36.82 34.49 2ypi h ILE 83 CO 0.01 0.00 -0.41 0.11 -0.68 0.00 0.00 178.15 177.18 2ypi h LYS 84 N -0.64 -0.82 -0.88 2.37 1.57 -1.25 0.67 116.57 117.58 2ypi h LYS 84 Ca 0.02 0.06 0.28 0.00 -1.87 0.00 0.00 60.65 59.14 2ypi h LYS 84 Cb 0.71 0.19 -0.16 0.00 0.08 0.00 0.00 32.23 33.04 2ypi h LYS 84 CO -0.36 -0.55 0.15 -3.47 -0.57 0.00 0.00 179.45 174.65 2ypi n ASP 85 N -4.90 0.01 -0.03 0.86 4.64 0.47 0.16 116.55 117.77 2ypi n ASP 85 Ca -0.10 1.49 0.15 0.00 -1.38 0.00 0.00 54.79 54.95 2ypi n ASP 85 Cb 0.38 -0.59 0.89 0.00 -1.04 0.00 0.00 41.12 40.76 2ypi n ASP 85 CO 0.00 0.00 0.00 1.33 -0.82 0.00 0.00 177.20 177.71 2ypi n VAL 86 N -5.20 0.00 0.00 5.18 0.24 0.78 -4.97 118.33 114.36 2ypi n VAL 86 Ca 0.24 -0.02 0.00 0.00 -2.04 0.00 0.00 64.34 62.53 2ypi n VAL 86 Cb 0.81 -0.41 0.00 0.00 -1.47 0.00 0.00 33.84 32.77 2ypi n VAL 86 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2ypi n GLY 87 N 1.00 3.57 3.35 7.63 0.00 0.43 -4.67 105.19 116.49 2ypi n GLY 87 Ca 0.23 -0.93 -0.37 0.00 0.00 0.00 0.00 46.02 44.94 2ypi n GLY 87 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ypi n ALA 88 N 0.00 -2.36 0.00 4.61 0.00 -1.16 -4.82 120.51 116.77 2ypi n ALA 88 Ca 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.24 2ypi n ALA 88 Cb 0.00 -1.64 0.00 0.00 0.00 0.00 0.00 19.45 17.81 2ypi n ALA 88 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2ypi n LYS 89 N 0.42 3.22 -4.70 0.00 4.76 0.14 -4.04 118.16 117.96 2ypi n LYS 89 Ca 0.08 0.00 -0.31 0.00 -2.87 0.00 0.00 58.31 55.21 2ypi n LYS 89 Cb 0.49 -0.52 -0.08 0.00 -1.84 0.00 0.00 35.03 33.07 2ypi n LYS 89 CO 0.00 0.00 0.00 -1.58 -1.37 0.00 0.00 177.40 174.45 2ypi s TRP 90 N -0.76 1.97 -0.29 2.13 0.52 -1.25 0.23 118.94 121.50 2ypi s TRP 90 Ca 0.00 -0.95 -0.16 0.00 0.02 0.00 0.00 56.10 55.01 2ypi s TRP 90 Cb 0.00 -1.57 0.12 0.00 -1.15 0.00 0.00 33.47 30.87 2ypi s TRP 90 CO 0.00 0.19 0.85 0.54 0.02 0.00 0.00 176.95 178.56 2ypi s VAL 91 N -2.91 -0.03 0.27 4.03 0.11 0.74 -2.89 120.40 119.72 2ypi s VAL 91 Ca 0.14 0.00 -0.27 0.00 -2.93 0.00 0.00 61.98 58.92 2ypi s VAL 91 Cb 0.03 -1.00 -0.09 0.00 -1.53 0.00 0.00 36.38 33.79 2ypi s VAL 91 CO 0.07 0.00 0.91 -0.63 -3.33 0.00 0.00 175.10 172.13 2ypi s ILE 92 N 1.52 4.19 0.08 7.04 -1.09 0.30 -2.15 121.20 131.09 2ypi s ILE 92 Ca -0.09 1.89 0.04 0.00 -2.23 0.00 0.00 60.65 60.26 2ypi s ILE 92 Cb -0.04 -4.15 -0.03 0.00 -1.58 0.00 0.00 42.46 36.66 2ypi s ILE 92 CO -0.17 0.34 -0.12 -0.76 -1.23 0.00 0.00 174.94 173.00 2ypi s LEU 93 N -1.59 2.32 -1.86 2.97 1.43 -0.43 -4.10 118.68 117.43 2ypi s LEU 93 Ca 0.44 -0.68 0.00 0.00 -1.03 0.00 0.00 54.13 52.86 2ypi s LEU 93 Cb -0.22 -0.38 0.00 0.00 0.03 0.00 0.00 46.19 45.62 2ypi s LEU 93 CO 0.27 -0.17 0.00 0.61 0.23 0.00 0.00 176.35 177.30 2ypi n GLY 94 N 1.03 0.71 3.45 -3.19 0.00 -1.26 -0.33 105.19 105.60 2ypi n GLY 94 Ca -0.19 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.49 2ypi n GLY 94 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 2ypi n HIS 95 N -3.07 -1.08 0.24 1.61 -0.00 -1.26 -4.49 115.22 107.17 2ypi n HIS 95 Ca -0.21 0.28 0.14 0.00 0.46 0.00 0.00 57.72 58.38 2ypi n HIS 95 Cb 0.65 -1.84 0.38 0.00 -0.12 0.00 0.00 29.99 29.07 2ypi n HIS 95 CO 0.00 0.00 0.00 0.66 0.46 0.00 0.00 176.34 177.46 2ypi h SER 96 N -1.22 0.00 0.63 0.26 4.64 -1.92 -1.80 113.55 114.15 2ypi h SER 96 Ca -0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 2ypi h SER 96 Cb 1.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.39 2ypi h SER 96 CO 0.37 0.04 0.00 -0.62 -0.87 0.00 0.00 176.83 175.75 2ypi n GLU 97 N -3.12 0.06 -0.11 4.77 1.02 -1.26 -1.98 120.64 120.01 2ypi n GLU 97 Ca 0.02 0.27 -0.15 0.00 -0.02 0.00 0.00 57.16 57.28 2ypi n GLU 97 Cb 0.45 -1.61 -0.11 0.00 -0.02 0.00 0.00 31.44 30.15 2ypi n GLU 97 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2ypi n ARG 98 N -1.72 0.60 0.24 3.49 5.12 -0.71 -3.51 116.66 120.16 2ypi n ARG 98 Ca 0.03 0.12 0.09 0.00 -1.93 0.00 0.00 57.85 56.17 2ypi n ARG 98 Cb 0.21 -1.46 0.58 0.00 -1.16 0.00 0.00 32.46 30.64 2ypi n ARG 98 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2ypi h ARG 99 N 0.00 0.00 0.00 5.56 3.08 -1.48 -1.19 114.38 120.34 2ypi h ARG 99 Ca -0.51 0.00 -0.09 0.00 0.07 0.00 0.00 59.98 59.46 2ypi h ARG 99 Cb 1.81 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.85 2ypi h ARG 99 CO -0.07 0.20 -1.03 -1.13 -1.07 0.00 0.00 179.97 176.87 2ypi n SER 100 N -3.78 0.86 -0.24 7.04 3.41 -0.84 -4.20 113.62 115.88 2ypi n SER 100 Ca -0.02 0.14 -0.06 0.00 -0.26 0.00 0.00 58.87 58.67 2ypi n SER 100 Cb 0.30 -0.32 0.05 0.00 -0.26 0.00 0.00 64.21 63.98 2ypi n SER 100 CO 0.00 0.00 0.00 1.88 -0.16 0.00 0.00 175.04 176.76 2ypi h TYR 101 N -0.29 0.85 -0.40 7.33 0.05 -1.72 -3.31 116.97 119.49 2ypi h TYR 101 Ca -0.13 0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.66 2ypi h TYR 101 Cb 0.85 -0.28 0.00 0.00 1.01 0.00 0.00 36.73 38.31 2ypi h TYR 101 CO -0.06 0.56 0.00 1.19 -1.05 0.00 0.00 178.16 178.80 2ypi n PHE 102 N -4.59 0.52 -3.90 4.88 3.01 -0.48 -4.98 117.46 111.92 2ypi n PHE 102 Ca 0.05 -0.30 -0.30 0.00 1.01 0.00 0.00 57.45 57.91 2ypi n PHE 102 Cb 0.04 -0.00 0.03 0.00 -0.01 0.00 0.00 39.48 39.53 2ypi n PHE 102 CO 0.00 0.00 0.00 0.72 1.01 0.00 0.00 176.76 178.49 2ypi n HIS 103 N 1.29 -2.33 -2.77 1.38 8.25 -1.05 -4.91 115.22 115.09 2ypi n HIS 103 Ca 0.18 0.91 -0.43 0.00 -0.26 0.00 0.00 57.72 58.12 2ypi n HIS 103 Cb 0.55 -4.03 -0.04 0.00 1.12 0.00 0.00 29.99 27.60 2ypi n HIS 103 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 2ypi s GLU 104 N -6.60 3.67 0.82 -0.41 2.02 -1.07 -5.01 118.70 112.12 2ypi s GLU 104 Ca 0.65 0.38 -0.12 0.00 0.02 0.00 0.00 54.97 55.90 2ypi s GLU 104 Cb -0.32 -3.88 0.08 0.00 0.10 0.00 0.00 34.13 30.11 2ypi s GLU 104 CO 0.83 -1.16 1.16 0.16 0.02 0.00 0.00 175.26 176.27 2ypi s ASP 105 N 2.17 4.40 0.12 -0.19 -4.77 -1.26 -4.22 116.67 112.92 2ypi s ASP 105 Ca 0.40 0.86 -0.21 0.00 -3.30 0.00 0.00 52.55 50.29 2ypi s ASP 105 Cb -0.10 -1.40 -0.05 0.00 -1.09 0.00 0.00 42.92 40.28 2ypi s ASP 105 CO 0.25 -1.98 1.71 0.44 0.70 0.00 0.00 175.17 176.28 2ypi h ASP 106 N -1.11 -0.18 0.15 2.11 3.45 -1.96 -1.59 116.42 117.30 2ypi h ASP 106 Ca -0.47 0.05 0.02 0.00 0.43 0.00 0.00 57.03 57.06 2ypi h ASP 106 Cb 1.32 0.11 -0.04 0.00 -0.56 0.00 0.00 39.33 40.16 2ypi h ASP 106 CO 0.65 -0.07 -0.40 0.50 -1.57 0.00 0.00 179.24 178.35 2ypi h LYS 107 N -0.03 -0.63 0.18 3.56 3.11 -1.95 1.53 116.57 122.35 2ypi h LYS 107 Ca 0.08 0.04 0.00 0.00 -2.81 0.00 0.00 60.65 57.96 2ypi h LYS 107 Cb 0.14 0.14 -0.02 0.00 -1.00 0.00 0.00 32.23 31.49 2ypi h LYS 107 CO -0.17 -0.42 -0.35 0.35 -2.81 0.00 0.00 179.45 176.06 2ypi h PHE 108 N -0.65 -0.99 -1.64 1.91 3.57 -1.89 1.02 116.94 118.27 2ypi h PHE 108 Ca 0.02 0.02 0.48 0.00 3.53 0.00 0.00 57.97 62.02 2ypi h PHE 108 Cb 0.67 0.41 -0.08 0.00 2.79 0.00 0.00 35.95 39.74 2ypi h PHE 108 CO -0.33 -0.42 1.17 0.82 -2.23 0.00 0.00 178.31 177.32 2ypi h ILE 109 N -0.57 0.15 0.00 1.41 2.04 -0.76 0.73 117.51 120.51 2ypi h ILE 109 Ca -0.02 -0.01 -0.01 0.00 1.00 0.00 0.00 64.86 65.82 2ypi h ILE 109 Cb 0.54 0.13 -0.00 0.00 -0.74 0.00 0.00 36.82 36.75 2ypi h ILE 109 CO -0.13 0.00 -0.21 0.00 0.00 0.00 0.00 178.15 177.81 2ypi h ALA 110 N 1.21 0.89 0.13 1.87 0.00 1.01 -2.66 119.26 121.71 2ypi h ALA 110 Ca 0.81 -0.06 -0.33 0.00 0.00 0.00 0.00 54.91 55.32 2ypi h ALA 110 Cb 3.14 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 20.91 2ypi h ALA 110 CO -0.06 0.08 -1.75 -0.44 0.00 0.00 0.00 179.25 177.08 2ypi h ASP 111 N 0.00 0.42 0.03 0.00 3.32 0.30 -3.29 116.42 117.20 2ypi h ASP 111 Ca -0.00 -0.89 0.01 0.00 0.02 0.00 0.00 57.03 56.16 2ypi h ASP 111 Cb 1.05 -0.14 -0.03 0.00 0.22 0.00 0.00 39.33 40.44 2ypi h ASP 111 CO 0.01 1.76 -0.27 0.11 -1.72 0.00 0.00 179.24 179.13 2ypi h LYS 112 N -0.10 -0.35 0.00 3.56 1.57 -1.23 -1.29 116.57 118.73 2ypi h LYS 112 Ca -0.37 0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.43 2ypi h LYS 112 Cb 1.93 0.08 0.00 0.00 0.08 0.00 0.00 32.23 34.32 2ypi h LYS 112 CO 0.08 -0.24 0.00 2.41 -0.57 0.00 0.00 179.45 181.13 2ypi n THR 113 N -4.00 0.00 -0.34 -0.16 -1.04 -1.00 -1.99 114.28 105.75 2ypi n THR 113 Ca -0.04 1.14 0.21 0.00 -2.04 0.00 0.00 64.05 63.32 2ypi n THR 113 Cb 0.21 -1.64 0.46 0.00 -1.82 0.00 0.00 70.33 67.54 2ypi n THR 113 CO 0.00 0.00 0.00 0.07 -0.64 0.00 0.00 175.07 174.50 2ypi h LYS 114 N 0.00 0.44 0.29 -2.82 2.10 -1.62 -2.43 116.57 112.52 2ypi h LYS 114 Ca 0.00 -0.03 -0.01 0.00 -2.00 0.00 0.00 60.65 58.61 2ypi h LYS 114 Cb 0.00 -0.10 0.00 0.00 -0.90 0.00 0.00 32.23 31.23 2ypi h LYS 114 CO 0.00 0.29 -0.14 0.35 -2.00 0.00 0.00 179.45 177.95 2ypi h PHE 115 N 0.45 -0.36 -0.19 0.07 3.04 -0.58 0.13 116.94 119.49 2ypi h PHE 115 Ca 0.63 -0.01 0.02 0.00 3.98 0.00 0.00 57.97 62.60 2ypi h PHE 115 Cb 1.46 0.12 -0.01 0.00 2.56 0.00 0.00 35.95 40.08 2ypi h PHE 115 CO -0.00 -0.17 0.13 0.00 -2.02 0.00 0.00 178.31 176.25 2ypi h ALA 116 N 0.21 1.97 0.00 2.41 0.00 -1.11 2.85 119.26 125.59 2ypi h ALA 116 Ca -0.04 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 2ypi h ALA 116 Cb 0.36 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 2ypi h ALA 116 CO 0.07 -0.00 -0.35 -0.07 0.00 0.00 0.00 179.25 178.89 2ypi h LEU 117 N 0.17 0.00 -0.08 0.00 3.38 -1.34 0.20 115.31 117.63 2ypi h LEU 117 Ca 0.08 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.05 2ypi h LEU 117 Cb 0.11 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.86 2ypi h LEU 117 CO -0.01 0.19 0.05 1.23 0.09 0.00 0.00 178.44 179.99 2ypi h GLY 118 N 3.82 0.12 2.00 0.83 0.00 0.70 -2.24 103.07 108.30 2ypi h GLY 118 Ca -0.01 -0.05 0.00 0.00 0.00 0.00 0.00 47.33 47.27 2ypi h GLY 118 CO 0.02 0.05 0.00 -1.06 0.00 0.00 0.00 176.54 175.55 2ypi n GLN 119 N -5.01 0.15 -1.76 4.80 1.13 0.41 -4.89 117.38 112.22 2ypi n GLN 119 Ca -0.05 0.37 0.00 0.00 -1.94 0.00 0.00 57.00 55.37 2ypi n GLN 119 Cb 0.04 -1.79 0.00 0.00 0.11 0.00 0.00 30.24 28.61 2ypi n GLN 119 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2ypi n GLY 120 N 0.09 0.45 3.62 1.08 0.00 -0.73 -5.08 105.19 104.62 2ypi n GLY 120 Ca 0.03 -0.42 -0.24 0.00 0.00 0.00 0.00 46.02 45.38 2ypi n GLY 120 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ypi s VAL 121 N -2.77 2.71 0.17 1.61 1.01 0.61 -5.01 120.40 118.73 2ypi s VAL 121 Ca 0.00 -2.00 -0.15 0.00 0.00 0.00 0.00 61.98 59.83 2ypi s VAL 121 Cb 0.00 -2.76 -0.07 0.00 0.00 0.00 0.00 36.38 33.55 2ypi s VAL 121 CO 0.00 -0.24 0.58 -0.83 0.00 0.00 0.00 175.10 174.62 2ypi s GLY 122 N -3.69 2.46 -0.17 4.51 0.00 0.64 -4.37 107.32 106.69 2ypi s GLY 122 Ca 0.34 -0.10 0.01 0.00 0.00 0.00 0.00 44.72 44.97 2ypi s GLY 122 CO 0.19 0.18 -0.15 0.14 0.00 0.00 0.00 173.10 173.46 2ypi s VAL 123 N -1.53 1.75 -0.81 1.40 1.01 -1.25 -0.18 120.40 120.78 2ypi s VAL 123 Ca 0.40 -0.84 -0.14 0.00 0.00 0.00 0.00 61.98 61.40 2ypi s VAL 123 Cb -0.15 -1.67 0.21 0.00 0.00 0.00 0.00 36.38 34.78 2ypi s VAL 123 CO 0.20 0.40 0.75 -0.63 0.00 0.00 0.00 175.10 175.82 2ypi s ILE 124 N 1.40 5.58 -0.09 2.22 1.01 -0.91 -1.81 121.20 128.59 2ypi s ILE 124 Ca 0.03 -2.40 -0.30 0.00 0.00 0.00 0.00 60.65 57.99 2ypi s ILE 124 Cb -0.14 -4.46 -0.04 0.00 0.01 0.00 0.00 42.46 37.83 2ypi s ILE 124 CO -0.11 -1.02 1.49 -0.22 0.00 0.00 0.00 174.94 175.08 2ypi s LEU 125 N 0.28 4.27 -0.15 2.97 0.20 -1.15 -1.31 118.68 123.79 2ypi s LEU 125 Ca 0.17 2.02 -0.04 0.00 0.69 0.00 0.00 54.13 56.97 2ypi s LEU 125 Cb -0.11 -3.54 -0.03 0.00 -0.43 0.00 0.00 46.19 42.08 2ypi s LEU 125 CO -0.08 -0.85 -0.01 0.00 -0.29 0.00 0.00 176.35 175.12 2ypi s ILE 127 N 0.21 1.18 0.00 0.00 1.09 -0.98 -4.53 121.20 118.16 2ypi s ILE 127 Ca -0.01 -2.07 0.00 0.00 -1.10 0.00 0.00 60.65 57.48 2ypi s ILE 127 Cb -0.13 -2.02 0.00 0.00 -1.06 0.00 0.00 42.46 39.25 2ypi s ILE 127 CO 0.02 -0.61 0.00 0.61 -0.10 0.00 0.00 174.94 174.87 2ypi n GLY 128 N -0.28 0.16 3.04 6.18 0.00 -1.22 -0.46 105.19 112.60 2ypi n GLY 128 Ca -0.08 -1.31 -0.15 0.00 0.00 0.00 0.00 46.02 44.48 2ypi n GLY 128 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2ypi s GLU 129 N -1.94 0.55 0.42 1.61 1.03 -1.25 -4.73 118.70 114.39 2ypi s GLU 129 Ca 0.00 -0.57 -0.20 0.00 0.03 0.00 0.00 54.97 54.23 2ypi s GLU 129 Cb 0.00 -0.42 -0.11 0.00 -0.80 0.00 0.00 34.13 32.81 2ypi s GLU 129 CO 0.00 0.09 0.92 0.95 -1.33 0.00 0.00 175.26 175.90 2ypi s THR 130 N -0.90 4.43 0.58 1.83 -4.23 -1.26 -0.75 115.64 115.35 2ypi s THR 130 Ca -0.04 1.41 0.29 0.00 -1.18 0.00 0.00 61.69 62.17 2ypi s THR 130 Cb -0.07 -3.61 0.40 0.00 1.34 0.00 0.00 72.50 70.56 2ypi s THR 130 CO 0.00 -0.32 1.87 0.25 -0.54 0.00 0.00 174.62 175.89 2ypi h LEU 131 N 1.92 0.00 -0.18 4.79 5.85 -1.98 0.64 115.31 126.35 2ypi h LEU 131 Ca -0.49 0.00 -0.14 0.00 0.84 0.00 0.00 57.88 58.09 2ypi h LEU 131 Cb 1.18 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.21 2ypi h LEU 131 CO 0.62 0.00 -0.45 -0.08 -0.34 0.00 0.00 178.44 178.18 2ypi h GLU 132 N 0.00 0.62 -0.13 1.25 4.22 -1.99 -2.77 114.58 115.78 2ypi h GLU 132 Ca 0.25 -0.43 -0.18 0.00 0.08 0.00 0.00 59.36 59.09 2ypi h GLU 132 Cb 1.33 0.07 -0.00 0.00 0.50 0.00 0.00 28.75 30.64 2ypi h GLU 132 CO -0.00 1.05 -0.66 1.05 -2.18 0.00 0.00 179.01 178.26 2ypi h GLU 133 N 0.29 0.50 0.00 1.92 9.09 -0.06 -2.99 114.58 123.33 2ypi h GLU 133 Ca -0.01 -0.37 0.00 0.00 0.05 0.00 0.00 59.36 59.03 2ypi h GLU 133 Cb 1.07 0.06 0.00 0.00 -1.65 0.00 0.00 28.75 28.23 2ypi h GLU 133 CO 0.10 0.99 0.00 1.17 0.05 0.00 0.00 179.01 181.32 2ypi n LYS 134 N -3.90 0.00 0.08 1.06 4.81 -0.87 -2.28 118.16 117.07 2ypi n LYS 134 Ca -0.04 0.34 0.15 0.00 -0.87 0.00 0.00 58.31 57.89 2ypi n LYS 134 Cb 0.67 -1.14 0.33 0.00 0.02 0.00 0.00 35.03 34.91 2ypi n LYS 134 CO 0.00 0.00 0.00 0.87 1.17 0.00 0.00 177.40 179.44 2ypi h LYS 135 N 0.00 0.00 -0.21 1.64 1.79 -1.59 4.95 116.57 123.14 2ypi h LYS 135 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2ypi h LYS 135 Cb 0.00 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.65 2ypi h LYS 135 CO 0.00 0.00 0.00 0.00 -1.08 0.00 0.00 179.45 178.37 2ypi n ALA 136 N -1.92 2.50 -0.18 3.86 0.00 -1.12 -5.00 120.51 118.65 2ypi n ALA 136 Ca 0.10 -0.60 0.00 0.00 0.00 0.00 0.00 53.44 52.94 2ypi n ALA 136 Cb 1.13 -1.05 0.00 0.00 0.00 0.00 0.00 19.45 19.53 2ypi n ALA 136 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ypi n GLY 137 N 1.19 1.87 3.59 0.00 0.00 1.62 -4.87 105.19 108.59 2ypi n GLY 137 Ca 0.16 0.08 -0.50 0.00 0.00 0.00 0.00 46.02 45.77 2ypi n GLY 137 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2ypi n LYS 138 N 0.00 1.66 -0.03 1.61 5.02 -1.26 -4.34 118.16 120.83 2ypi n LYS 138 Ca 0.00 0.55 0.01 0.00 -2.02 0.00 0.00 58.31 56.85 2ypi n LYS 138 Cb 0.00 -2.60 -0.10 0.00 -0.02 0.00 0.00 35.03 32.31 2ypi n LYS 138 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 2ypi n THR 139 N 6.13 0.35 0.16 -0.18 -1.04 -1.26 -4.45 114.28 113.99 2ypi n THR 139 Ca 0.30 -0.39 0.12 0.00 -2.04 0.00 0.00 64.05 62.04 2ypi n THR 139 Cb 0.27 -0.17 0.07 0.00 -1.82 0.00 0.00 70.33 68.68 2ypi n THR 139 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 2ypi h LEU 140 N 0.00 0.00 0.00 -4.42 -0.00 -1.94 -3.03 115.31 105.92 2ypi h LEU 140 Ca -0.14 -0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.74 2ypi h LEU 140 Cb 1.09 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.75 2ypi h LEU 140 CO 0.01 0.00 0.00 0.47 -0.00 0.00 0.00 178.44 178.92 2ypi n ASP 141 N -2.84 0.00 -0.28 -0.43 9.92 -1.26 -2.21 116.55 119.44 2ypi n ASP 141 Ca 0.02 0.61 0.11 0.00 -0.53 0.00 0.00 54.79 55.00 2ypi n ASP 141 Cb 0.54 -0.27 0.22 0.00 -0.64 0.00 0.00 41.12 40.97 2ypi n ASP 141 CO 0.00 0.00 0.00 0.52 0.13 0.00 0.00 177.20 177.85 2ypi n VAL 142 N -1.32 -0.34 0.27 2.53 0.31 -1.25 0.34 118.33 118.87 2ypi n VAL 142 Ca 0.00 1.80 0.14 0.00 -0.01 0.00 0.00 64.34 66.27 2ypi n VAL 142 Cb 0.00 -2.61 0.39 0.00 -0.91 0.00 0.00 33.84 30.71 2ypi n VAL 142 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 2ypi h VAL 143 N 0.00 0.00 0.00 2.52 2.07 -1.61 -1.94 116.25 117.29 2ypi h VAL 143 Ca 0.48 -0.76 -0.34 0.00 0.82 0.00 0.00 66.70 66.90 2ypi h VAL 143 Cb 0.95 1.75 -0.06 0.00 -1.52 0.00 0.00 31.29 32.41 2ypi h VAL 143 CO -0.78 0.00 -2.14 -0.62 0.02 0.00 0.00 177.57 174.06 2ypi n GLU 144 N -3.02 0.67 -0.18 1.57 1.02 1.03 -1.42 120.64 120.30 2ypi n GLU 144 Ca 0.03 0.11 -0.08 0.00 -0.02 0.00 0.00 57.16 57.20 2ypi n GLU 144 Cb 0.43 -1.62 0.06 0.00 -0.02 0.00 0.00 31.44 30.29 2ypi n GLU 144 CO 0.00 0.00 0.00 -0.09 1.18 0.00 0.00 177.13 178.22 2ypi h ARG 145 N 0.00 1.00 0.00 3.49 2.43 0.25 -1.84 114.38 119.71 2ypi h ARG 145 Ca -0.45 -0.31 -0.12 0.00 -0.81 0.00 0.00 59.98 58.28 2ypi h ARG 145 Cb 2.15 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 31.59 2ypi h ARG 145 CO 0.05 0.99 -0.68 1.96 -1.51 0.00 0.00 179.97 180.77 2ypi h GLN 146 N 0.92 0.00 0.00 0.20 4.20 -1.46 -2.73 115.11 116.23 2ypi h GLN 146 Ca 0.16 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.87 2ypi h GLN 146 Cb 0.55 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.33 2ypi h GLN 146 CO 0.03 0.52 -0.73 1.25 -0.67 0.00 0.00 178.83 179.23 2ypi h LEU 147 N 0.00 0.00 0.18 1.46 5.85 -1.05 -3.32 115.31 118.44 2ypi h LEU 147 Ca -0.03 -0.19 -0.01 0.00 0.84 0.00 0.00 57.88 58.50 2ypi h LEU 147 Cb 1.45 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.48 2ypi h LEU 147 CO 0.07 0.09 -0.09 0.78 -0.34 0.00 0.00 178.44 178.96 2ypi h ASN 148 N 0.00 -0.20 -0.67 1.25 2.35 -1.43 -2.87 115.58 114.00 2ypi h ASN 148 Ca 0.00 0.01 0.20 0.00 -0.55 0.00 0.00 56.30 55.95 2ypi h ASN 148 Cb 0.79 0.05 -0.03 0.00 0.05 0.00 0.00 38.32 39.19 2ypi h ASN 148 CO 0.00 0.16 0.82 0.00 -1.65 0.00 0.00 177.43 176.76 2ypi n ALA 149 N -2.60 0.65 -0.05 -0.83 0.00 -1.03 0.83 120.51 117.48 2ypi n ALA 149 Ca -0.03 0.22 -0.22 0.00 0.00 0.00 0.00 53.44 53.41 2ypi n ALA 149 Cb 0.10 -0.39 -0.13 0.00 0.00 0.00 0.00 19.45 19.03 2ypi n ALA 149 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2ypi n VAL 150 N -2.57 1.66 -0.34 0.00 0.31 -1.16 -4.38 118.33 111.85 2ypi n VAL 150 Ca 0.15 -0.40 0.13 0.00 -0.01 0.00 0.00 64.34 64.21 2ypi n VAL 150 Cb 1.02 -1.84 0.33 0.00 -0.91 0.00 0.00 33.84 32.44 2ypi n VAL 150 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 2ypi h LEU 151 N -0.40 0.77 -1.53 7.52 -0.00 0.65 0.33 115.31 122.65 2ypi h LEU 151 Ca -0.42 0.08 0.11 0.00 -0.00 0.00 0.00 57.88 57.64 2ypi h LEU 151 Cb 1.73 -0.06 -0.05 0.00 -0.00 0.00 0.00 40.66 42.28 2ypi h LEU 151 CO -0.07 0.30 0.46 -0.33 -0.00 0.00 0.00 178.44 178.81 2ypi h GLU 152 N 0.76 0.50 0.03 1.13 3.07 -1.64 -3.28 114.58 115.16 2ypi h GLU 152 Ca 0.55 -0.03 -0.38 0.00 -0.50 0.00 0.00 59.36 59.00 2ypi h GLU 152 Cb 0.86 -0.11 -0.06 0.00 -0.84 0.00 0.00 28.75 28.60 2ypi h GLU 152 CO -0.33 0.33 -2.36 0.39 -1.40 0.00 0.00 179.01 175.64 2ypi n GLU 153 N -4.48 0.68 -3.51 2.33 -0.58 0.19 -4.90 120.64 110.36 2ypi n GLU 153 Ca 0.12 0.17 -0.42 0.00 -0.42 0.00 0.00 57.16 56.61 2ypi n GLU 153 Cb 0.39 -1.57 -0.10 0.00 -0.57 0.00 0.00 31.44 29.59 2ypi n GLU 153 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 2ypi s VAL 154 N -2.53 5.15 -0.02 2.62 1.01 0.92 -4.96 120.40 122.58 2ypi s VAL 154 Ca -0.31 -0.52 -0.01 0.00 0.00 0.00 0.00 61.98 61.14 2ypi s VAL 154 Cb 0.08 -3.78 -0.00 0.00 0.00 0.00 0.00 36.38 32.68 2ypi s VAL 154 CO 0.65 -0.18 -0.02 0.11 0.00 0.00 0.00 175.10 175.66 2ypi h LYS 155 N 8.54 0.00 -6.29 2.72 1.79 -1.88 -3.40 116.57 118.06 2ypi h LYS 155 Ca -0.29 0.00 -0.57 0.00 -2.18 0.00 0.00 60.65 57.62 2ypi h LYS 155 Cb 1.13 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 31.74 2ypi h LYS 155 CO 0.68 0.00 0.96 0.34 -1.08 0.00 0.00 179.45 180.36 2ypi s ASP 156 N -3.73 6.73 0.00 0.86 2.15 -1.26 -4.87 116.67 116.54 2ypi s ASP 156 Ca -0.02 1.39 0.17 0.00 0.43 0.00 0.00 52.55 54.52 2ypi s ASP 156 Cb 0.00 -2.54 0.13 0.00 -0.30 0.00 0.00 42.92 40.21 2ypi s ASP 156 CO 0.02 -1.00 1.03 0.79 -0.17 0.00 0.00 175.17 175.84 2ypi n TRP 157 N 7.39 0.00 -0.42 -5.34 7.02 -1.26 -4.64 117.44 120.20 2ypi n TRP 157 Ca 0.15 0.00 0.34 0.00 -1.02 0.00 0.00 57.50 56.97 2ypi n TRP 157 Cb 0.46 0.00 0.52 0.00 -2.42 0.00 0.00 31.31 29.87 2ypi n TRP 157 CO 0.00 0.00 0.00 -2.37 -2.02 0.00 0.00 177.69 173.30 2ypi n THR 158 N 0.91 0.00 0.06 -0.99 5.66 -1.26 -0.38 114.28 118.28 2ypi n THR 158 Ca 0.10 1.05 0.10 0.00 -3.05 0.00 0.00 64.05 62.24 2ypi n THR 158 Cb 0.42 -1.78 -0.15 0.00 -1.55 0.00 0.00 70.33 67.27 2ypi n THR 158 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 175.07 172.61 2ypi n ASN 159 N -3.21 0.44 -4.77 1.09 5.03 -1.26 -5.01 115.26 107.58 2ypi n ASN 159 Ca 0.28 -0.08 -0.39 0.00 0.87 0.00 0.00 54.58 55.27 2ypi n ASN 159 Cb 1.39 1.85 -0.04 0.00 -1.02 0.00 0.00 39.78 41.96 2ypi n ASN 159 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 2ypi s VAL 160 N -3.35 3.45 -0.27 2.41 1.01 0.49 -3.92 120.40 120.21 2ypi s VAL 160 Ca -0.06 1.32 0.03 0.00 0.00 0.00 0.00 61.98 63.26 2ypi s VAL 160 Cb 0.13 -3.78 0.07 0.00 0.00 0.00 0.00 36.38 32.79 2ypi s VAL 160 CO 0.83 0.21 -0.08 0.68 0.00 0.00 0.00 175.10 176.74 2ypi s VAL 161 N -1.34 2.09 0.31 2.92 -7.23 -0.75 -4.45 120.40 111.96 2ypi s VAL 161 Ca 0.50 -1.68 -0.28 0.00 -1.81 0.00 0.00 61.98 58.72 2ypi s VAL 161 Cb -0.29 -2.27 -0.09 0.00 0.56 0.00 0.00 36.38 34.28 2ypi s VAL 161 CO 0.38 -0.12 1.04 -0.69 -0.31 0.00 0.00 175.10 175.39 2ypi s VAL 162 N 1.12 3.73 -0.20 1.32 1.01 0.18 -2.92 120.40 124.63 2ypi s VAL 162 Ca -0.06 1.58 0.01 0.00 0.00 0.00 0.00 61.98 63.52 2ypi s VAL 162 Cb -0.20 -3.94 0.04 0.00 0.00 0.00 0.00 36.38 32.28 2ypi s VAL 162 CO -0.06 0.26 -0.13 0.00 0.00 0.00 0.00 175.10 175.17 2ypi s ALA 163 N -1.36 2.18 -0.31 5.51 0.00 -0.22 0.29 121.76 127.85 2ypi s ALA 163 Ca 0.48 -1.29 -0.20 0.00 0.00 0.00 0.00 51.96 50.95 2ypi s ALA 163 Cb -0.27 -1.30 -0.01 0.00 0.00 0.00 0.00 23.12 21.55 2ypi s ALA 163 CO 0.34 -0.74 0.63 -0.47 0.00 0.00 0.00 175.76 175.52 2ypi s TYR 164 N 1.32 3.21 -0.26 0.00 5.04 0.50 -2.33 117.35 124.83 2ypi s TYR 164 Ca -0.01 0.57 -0.04 0.00 -2.44 0.00 0.00 57.07 55.16 2ypi s TYR 164 Cb -0.16 -3.00 0.09 0.00 0.35 0.00 0.00 41.96 39.24 2ypi s TYR 164 CO -0.09 -0.49 0.11 -1.21 -1.34 0.00 0.00 175.55 172.54 2ypi s GLU 165 N 2.62 0.25 0.00 4.97 2.02 0.39 -1.93 118.70 127.03 2ypi s GLU 165 Ca 0.25 -0.48 -0.30 0.00 0.02 0.00 0.00 54.97 54.46 2ypi s GLU 165 Cb -0.15 -1.48 -0.06 0.00 0.10 0.00 0.00 34.13 32.55 2ypi s GLU 165 CO 0.12 -0.91 1.43 -2.14 0.02 0.00 0.00 175.26 173.78 2ypi s PRO 166 N 2.04 4.27 0.54 0.39 0.02 -1.26 -3.42 135.00 137.58 2ypi s PRO 166 Ca 0.07 2.00 0.29 0.00 0.02 0.00 0.00 61.00 63.38 2ypi s PRO 166 Cb -0.16 -3.59 1.56 0.00 0.02 0.00 0.00 34.50 32.34 2ypi s PRO 166 CO -0.27 -0.60 2.11 0.28 -0.33 0.00 0.00 177.00 178.19 2ypi h VAL 167 N 4.92 0.49 0.00 3.83 2.07 -1.28 -1.13 116.25 125.15 2ypi h VAL 167 Ca -0.38 -0.42 0.00 0.00 0.82 0.00 0.00 66.70 66.71 2ypi h VAL 167 Cb 1.18 1.28 0.00 0.00 -1.52 0.00 0.00 31.29 32.23 2ypi h VAL 167 CO 0.91 0.09 -0.04 -2.67 0.02 0.00 0.00 177.57 175.87 2ypi n TRP 168 N -3.60 0.78 -0.05 1.57 4.27 -1.25 -3.72 117.44 115.45 2ypi n TRP 168 Ca -0.02 0.23 0.01 0.00 -3.89 0.00 0.00 57.50 53.83 2ypi n TRP 168 Cb 0.21 -0.86 -0.16 0.00 -1.36 0.00 0.00 31.31 29.14 2ypi n TRP 168 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 2ypi n ALA 169 N -1.75 2.16 -1.63 -1.67 0.00 -0.47 -4.64 120.51 112.52 2ypi n ALA 169 Ca 0.06 -0.87 -0.55 0.00 0.00 0.00 0.00 53.44 52.07 2ypi n ALA 169 Cb 0.42 -0.44 -0.07 0.00 0.00 0.00 0.00 19.45 19.36 2ypi n ALA 169 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2ypi n ILE 170 N -2.46 0.30 -4.11 0.00 5.41 -0.98 -2.26 119.36 115.26 2ypi n ILE 170 Ca -0.17 -0.10 -0.35 0.00 1.00 0.00 0.00 62.75 63.12 2ypi n ILE 170 Cb 0.82 -1.35 -0.07 0.00 -0.71 0.00 0.00 39.64 38.33 2ypi n ILE 170 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2ypi n GLY 171 N 4.91 -0.30 0.00 7.39 0.00 -1.26 -4.80 105.19 111.12 2ypi n GLY 171 Ca 0.31 0.07 0.01 0.00 0.00 0.00 0.00 46.02 46.42 2ypi n GLY 171 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2ypi n THR 172 N -3.63 0.00 -0.56 2.61 -2.24 -0.96 -5.01 114.28 104.48 2ypi n THR 172 Ca 0.04 -0.39 0.00 0.00 -2.27 0.00 0.00 64.05 61.43 2ypi n THR 172 Cb 0.42 0.94 0.00 0.00 -2.10 0.00 0.00 70.33 69.59 2ypi n THR 172 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2ypi n GLY 173 N 1.21 0.76 3.24 3.38 0.00 -1.26 -4.97 105.19 107.55 2ypi n GLY 173 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 2ypi n GLY 173 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ypi s LEU 174 N 0.00 6.02 1.09 0.99 2.01 -1.26 -5.08 118.68 122.45 2ypi s LEU 174 Ca 0.00 -3.66 -0.13 0.00 0.01 0.00 0.00 54.13 50.36 2ypi s LEU 174 Cb 0.00 -2.09 0.24 0.00 0.01 0.00 0.00 46.19 44.35 2ypi s LEU 174 CO 0.00 -0.24 1.06 0.00 1.01 0.00 0.00 176.35 178.18 2ypi s ALA 175 N -1.31 0.22 0.12 4.21 0.00 -1.26 -4.28 121.76 119.46 2ypi s ALA 175 Ca 0.29 -0.27 0.02 0.00 0.00 0.00 0.00 51.96 52.01 2ypi s ALA 175 Cb -0.09 -3.17 -0.04 0.00 0.00 0.00 0.00 23.12 19.82 2ypi s ALA 175 CO -0.10 -3.36 0.24 0.00 0.00 0.00 0.00 175.76 172.54 2ypi s ALA 176 N -2.72 3.93 0.23 0.00 0.00 -1.26 -5.01 121.76 116.93 2ypi s ALA 176 Ca 0.67 -0.99 -0.30 0.00 0.00 0.00 0.00 51.96 51.34 2ypi s ALA 176 Cb -0.22 -1.75 -0.09 0.00 0.00 0.00 0.00 23.12 21.07 2ypi s ALA 176 CO 0.61 0.63 1.19 0.95 0.00 0.00 0.00 175.76 179.14 2ypi s THR 177 N -1.66 3.42 0.32 0.00 -4.23 -1.26 -4.82 115.64 107.41 2ypi s THR 177 Ca 0.34 1.28 0.16 0.00 -1.18 0.00 0.00 61.69 62.29 2ypi s THR 177 Cb -0.12 -3.81 0.32 0.00 1.34 0.00 0.00 72.50 70.23 2ypi s THR 177 CO 0.28 0.24 1.40 -2.65 -0.54 0.00 0.00 174.62 173.35 2ypi n PRO 178 N 1.94 -0.06 0.04 3.99 -0.02 -1.26 -0.67 135.00 138.96 2ypi n PRO 178 Ca 0.02 1.24 -0.19 0.00 -2.02 0.00 0.00 63.50 62.55 2ypi n PRO 178 Cb 0.44 -2.19 -0.14 0.00 -0.02 0.00 0.00 33.50 31.59 2ypi n PRO 178 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 2ypi h GLU 179 N 0.00 0.31 0.00 -0.52 9.09 -1.94 0.26 114.58 121.78 2ypi h GLU 179 Ca 0.72 -0.49 -0.14 0.00 0.05 0.00 0.00 59.36 59.51 2ypi h GLU 179 Cb 1.87 0.17 -0.02 0.00 -1.65 0.00 0.00 28.75 29.12 2ypi h GLU 179 CO -0.71 1.21 -0.65 0.38 0.05 0.00 0.00 179.01 179.30 2ypi h ASP 180 N -0.33 0.00 0.24 3.06 3.04 -1.52 -2.84 116.42 118.07 2ypi h ASP 180 Ca -0.13 0.00 -0.01 0.00 -3.24 0.00 0.00 57.03 53.65 2ypi h ASP 180 Cb 1.57 0.00 -0.00 0.00 -1.04 0.00 0.00 39.33 39.86 2ypi h ASP 180 CO 0.14 0.65 -0.12 0.00 -2.04 0.00 0.00 179.24 177.86 2ypi h ALA 181 N 1.35 -0.33 0.00 4.15 0.00 -0.90 -1.33 119.26 122.21 2ypi h ALA 181 Ca -0.01 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.79 2ypi h ALA 181 Cb 1.18 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 19.11 2ypi h ALA 181 CO 0.08 -0.69 -0.21 0.37 0.00 0.00 0.00 179.25 178.81 2ypi h GLN 182 N -0.34 0.00 -0.04 0.00 5.75 -0.51 -2.82 115.11 117.16 2ypi h GLN 182 Ca -0.03 0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 58.46 2ypi h GLN 182 Cb 0.27 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 28.82 2ypi h GLN 182 CO 0.04 0.21 -0.03 -0.44 -2.65 0.00 0.00 178.83 175.96 2ypi h ASP 183 N 0.00 0.10 -0.91 -0.69 3.32 -1.18 -2.94 116.42 114.11 2ypi h ASP 183 Ca -0.00 -0.44 -0.01 0.00 0.02 0.00 0.00 57.03 56.60 2ypi h ASP 183 Cb 0.47 -0.03 -0.04 0.00 0.22 0.00 0.00 39.33 39.94 2ypi h ASP 183 CO 0.03 0.52 0.54 0.40 -1.72 0.00 0.00 179.24 179.01 2ypi h ILE 184 N -0.32 1.25 -0.22 0.35 2.04 -1.07 -3.01 117.51 116.53 2ypi h ILE 184 Ca 0.01 -0.56 -0.03 0.00 1.00 0.00 0.00 64.86 65.27 2ypi h ILE 184 Cb 0.49 -0.02 -0.01 0.00 -0.74 0.00 0.00 36.82 36.54 2ypi h ILE 184 CO 0.01 0.27 0.01 0.45 0.00 0.00 0.00 178.15 178.88 2ypi h HIS 185 N 1.26 0.41 0.23 1.37 3.86 -1.39 -2.21 115.15 118.68 2ypi h HIS 185 Ca 0.33 -0.07 -0.00 0.00 -1.16 0.00 0.00 60.37 59.46 2ypi h HIS 185 Cb -0.04 -0.11 -0.02 0.00 1.06 0.00 0.00 27.41 28.30 2ypi h HIS 185 CO 0.00 0.55 -0.34 0.00 0.86 0.00 0.00 177.93 179.01 2ypi h ALA 186 N 0.81 -0.95 -0.84 2.45 0.00 -1.53 0.76 119.26 119.96 2ypi h ALA 186 Ca 0.06 -0.10 0.11 0.00 0.00 0.00 0.00 54.91 54.98 2ypi h ALA 186 Cb 0.38 0.64 -0.12 0.00 0.00 0.00 0.00 17.79 18.69 2ypi h ALA 186 CO 0.01 -0.99 -0.38 0.43 0.00 0.00 0.00 179.25 178.31 2ypi n SER 187 N -4.40 -0.66 -0.13 0.00 7.64 -1.14 0.61 113.62 115.55 2ypi n SER 187 Ca -0.07 1.47 -0.04 0.00 1.01 0.00 0.00 58.87 61.24 2ypi n SER 187 Cb 0.29 -0.29 0.02 0.00 -1.01 0.00 0.00 64.21 63.22 2ypi n SER 187 CO 0.00 0.00 0.00 0.40 -3.01 0.00 0.00 175.04 172.43 2ypi h ILE 188 N 0.00 0.58 -0.38 0.44 2.04 -0.69 2.56 117.51 122.06 2ypi h ILE 188 Ca 0.24 -0.00 -0.11 0.00 1.00 0.00 0.00 64.86 65.99 2ypi h ILE 188 Cb 0.45 0.58 -0.01 0.00 -0.74 0.00 0.00 36.82 37.10 2ypi h ILE 188 CO -0.82 0.00 -0.21 -0.09 0.00 0.00 0.00 178.15 177.03 2ypi h ARG 189 N 0.00 0.74 0.73 2.37 2.43 0.36 0.44 114.38 121.45 2ypi h ARG 189 Ca 0.20 -0.29 -0.04 0.00 -0.81 0.00 0.00 59.98 59.05 2ypi h ARG 189 Cb 0.31 -0.04 0.01 0.00 -0.42 0.00 0.00 29.97 29.82 2ypi h ARG 189 CO -0.43 0.89 -0.35 -0.22 -1.51 0.00 0.00 179.97 178.35 2ypi h LYS 190 N 0.65 -0.95 0.00 0.20 3.64 2.13 -0.51 116.57 121.74 2ypi h LYS 190 Ca 0.09 0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.54 2ypi h LYS 190 Cb 0.71 0.22 0.00 0.00 -0.41 0.00 0.00 32.23 32.74 2ypi h LYS 190 CO 0.05 -0.61 0.00 0.34 -2.27 0.00 0.00 179.45 176.96 2ypi n PHE 191 N -5.46 0.00 -0.12 1.91 7.35 0.82 0.15 117.46 122.11 2ypi n PHE 191 Ca -0.13 0.00 0.27 0.00 -0.76 0.00 0.00 57.45 56.82 2ypi n PHE 191 Cb 0.40 0.00 0.60 0.00 0.35 0.00 0.00 39.48 40.83 2ypi n PHE 191 CO 0.00 0.00 0.00 -0.07 -0.76 0.00 0.00 176.76 175.93 2ypi h LEU 192 N 0.00 0.00 0.19 -2.13 3.38 -1.03 -0.57 115.31 115.15 2ypi h LEU 192 Ca 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 2ypi h LEU 192 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 2ypi h LEU 192 CO 0.00 0.00 -0.09 0.00 0.09 0.00 0.00 178.44 178.44 2ypi h ALA 193 N 0.99 -0.26 0.00 1.53 0.00 0.31 2.37 119.26 124.19 2ypi h ALA 193 Ca 0.40 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.24 2ypi h ALA 193 Cb 2.19 0.10 0.00 0.00 0.00 0.00 0.00 17.79 20.09 2ypi h ALA 193 CO -0.00 -0.63 0.00 -1.13 0.00 0.00 0.00 179.25 177.48 2ypi n SER 194 N -5.19 0.00 0.02 0.00 3.41 -0.22 -1.64 113.62 110.00 2ypi n SER 194 Ca -0.09 0.25 0.00 0.00 -0.26 0.00 0.00 58.87 58.77 2ypi n SER 194 Cb 0.14 -0.32 0.00 0.00 -0.26 0.00 0.00 64.21 63.77 2ypi n SER 194 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2ypi n LYS 195 N -1.32 0.00 0.00 4.33 4.76 -1.03 -4.86 118.16 120.04 2ypi n LYS 195 Ca 0.03 0.00 0.08 0.00 -2.87 0.00 0.00 58.31 55.54 2ypi n LYS 195 Cb 0.06 -0.07 0.37 0.00 -1.84 0.00 0.00 35.03 33.54 2ypi n LYS 195 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 2ypi n LEU 196 N -2.72 0.00 0.00 -0.35 4.77 0.80 -4.95 117.00 114.54 2ypi n LEU 196 Ca 0.00 0.39 0.00 0.00 -0.03 0.00 0.00 56.01 56.37 2ypi n LEU 196 Cb 0.00 -0.39 0.00 0.00 -2.33 0.00 0.00 43.42 40.70 2ypi n LEU 196 CO 0.00 -0.18 0.00 0.61 -1.33 0.00 0.00 177.39 176.49 2ypi n GLY 197 N 0.10 -2.03 0.19 -0.72 0.00 -0.65 -4.38 105.19 97.70 2ypi n GLY 197 Ca 0.06 -1.33 0.06 0.00 0.00 0.00 0.00 46.02 44.80 2ypi n GLY 197 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 2ypi h ASP 198 N 0.00 0.00 0.20 1.61 2.03 -1.86 0.19 116.42 118.59 2ypi h ASP 198 Ca 0.00 0.00 -0.02 0.00 -0.73 0.00 0.00 57.03 56.28 2ypi h ASP 198 Cb 0.00 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 38.50 2ypi h ASP 198 CO 0.00 0.37 -0.09 0.50 -1.03 0.00 0.00 179.24 178.99 2ypi h LYS 199 N 0.00 0.00 0.29 4.15 3.64 -1.94 -1.08 116.57 121.63 2ypi h LYS 199 Ca -0.00 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.36 2ypi h LYS 199 Cb 0.90 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.72 2ypi h LYS 199 CO 0.05 0.09 -0.14 0.00 -2.27 0.00 0.00 179.45 177.18 2ypi h ALA 200 N 1.91 -0.38 0.00 5.00 0.00 -0.90 -2.82 119.26 122.06 2ypi h ALA 200 Ca -0.00 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2ypi h ALA 200 Cb 0.22 0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.16 2ypi h ALA 200 CO 0.01 -0.36 0.25 0.00 0.00 0.00 0.00 179.25 179.15 2ypi h ALA 201 N -1.05 1.17 0.00 0.00 0.00 -1.09 0.65 119.26 118.95 2ypi h ALA 201 Ca -0.04 0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.69 2ypi h ALA 201 Cb 0.33 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 2ypi h ALA 201 CO 0.06 -0.17 -1.02 0.66 0.00 0.00 0.00 179.25 178.78 2ypi h SER 202 N 0.00 0.00 0.11 0.00 4.64 -1.11 -3.30 113.55 113.89 2ypi h SER 202 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2ypi h SER 202 Cb 0.50 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.59 2ypi h SER 202 CO 0.00 0.76 -1.82 -0.62 -0.87 0.00 0.00 176.83 174.28 2ypi n GLU 203 N -3.18 0.61 -2.03 4.77 1.02 0.66 -4.45 120.64 118.05 2ypi n GLU 203 Ca -0.04 -0.15 -0.39 0.00 -0.02 0.00 0.00 57.16 56.56 2ypi n GLU 203 Cb 0.87 -1.55 -0.00 0.00 -0.02 0.00 0.00 31.44 30.74 2ypi n GLU 203 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 2ypi s LEU 204 N -4.51 4.17 -0.25 -4.62 0.20 0.20 -4.73 118.68 109.13 2ypi s LEU 204 Ca -0.06 2.66 -0.10 0.00 0.69 0.00 0.00 54.13 57.32 2ypi s LEU 204 Cb 0.14 -3.95 -0.05 0.00 -0.43 0.00 0.00 46.19 41.89 2ypi s LEU 204 CO 0.89 -0.93 0.16 -0.60 -0.29 0.00 0.00 176.35 175.58 2ypi s ARG 205 N -2.34 3.98 -0.19 1.98 6.06 -1.26 -4.55 118.95 122.64 2ypi s ARG 205 Ca 0.59 -0.31 0.01 0.00 -2.50 0.00 0.00 55.73 53.52 2ypi s ARG 205 Cb -0.38 -3.54 0.03 0.00 0.06 0.00 0.00 34.95 31.12 2ypi s ARG 205 CO 0.48 -0.03 -0.18 -1.50 -2.50 0.00 0.00 175.30 171.57 2ypi s ILE 206 N 1.31 1.98 0.33 4.11 1.10 -1.26 -0.65 121.20 128.12 2ypi s ILE 206 Ca 0.07 -0.97 -0.01 0.00 -0.51 0.00 0.00 60.65 59.23 2ypi s ILE 206 Cb -0.14 -1.84 -0.04 0.00 0.15 0.00 0.00 42.46 40.59 2ypi s ILE 206 CO 0.06 0.45 0.54 -0.76 -2.11 0.00 0.00 174.94 173.12 2ypi s LEU 207 N 1.30 4.03 -0.11 8.50 1.43 0.84 -3.04 118.68 131.64 2ypi s LEU 207 Ca 0.03 0.51 0.01 0.00 -1.03 0.00 0.00 54.13 53.65 2ypi s LEU 207 Cb -0.14 -3.36 -0.02 0.00 0.03 0.00 0.00 46.19 42.71 2ypi s LEU 207 CO -0.12 -0.26 -0.15 -0.47 0.23 0.00 0.00 176.35 175.58 2ypi s TYR 208 N -2.24 2.74 0.04 0.29 5.04 -0.78 0.19 117.35 122.62 2ypi s TYR 208 Ca 0.41 -0.59 -0.00 0.00 -2.44 0.00 0.00 57.07 54.45 2ypi s TYR 208 Cb -0.10 -1.77 -0.03 0.00 0.35 0.00 0.00 41.96 40.41 2ypi s TYR 208 CO 0.35 -0.15 -0.04 0.20 -1.34 0.00 0.00 175.55 174.57 2ypi s GLY 209 N 0.09 0.40 0.00 8.97 0.00 -0.81 -2.78 107.32 113.19 2ypi s GLY 209 Ca -0.07 -0.92 0.00 0.00 0.00 0.00 0.00 44.72 43.73 2ypi s GLY 209 CO 0.05 -1.01 0.00 0.61 0.00 0.00 0.00 173.10 172.75 2ypi n GLY 210 N 0.84 0.46 3.40 0.20 0.00 -1.26 -4.23 105.19 104.61 2ypi n GLY 210 Ca -0.19 -0.35 -0.18 0.00 0.00 0.00 0.00 46.02 45.30 2ypi n GLY 210 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2ypi n SER 211 N 0.00 -4.58 -4.69 1.61 7.64 -1.12 -4.04 113.62 108.44 2ypi n SER 211 Ca 0.00 -0.73 -0.38 0.00 1.01 0.00 0.00 58.87 58.77 2ypi n SER 211 Cb 0.00 -4.85 -0.07 0.00 -1.01 0.00 0.00 64.21 58.28 2ypi n SER 211 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2ypi s ALA 212 N -3.42 3.54 0.11 -0.43 0.00 -1.26 -4.35 121.76 115.93 2ypi s ALA 212 Ca 0.28 -0.40 0.04 0.00 0.00 0.00 0.00 51.96 51.88 2ypi s ALA 212 Cb -0.05 -2.63 -0.04 0.00 0.00 0.00 0.00 23.12 20.40 2ypi s ALA 212 CO 0.76 -0.18 -0.10 0.54 0.00 0.00 0.00 175.76 176.78 2ypi s ASN 213 N 0.86 1.52 0.04 0.00 2.20 -1.26 -4.77 114.94 113.53 2ypi s ASN 213 Ca 0.21 -0.86 -0.07 0.00 -0.94 0.00 0.00 52.86 51.21 2ypi s ASN 213 Cb -0.15 0.01 -0.02 0.00 -2.00 0.00 0.00 41.25 39.09 2ypi s ASN 213 CO 0.08 -0.28 0.94 0.61 -2.94 0.00 0.00 177.10 175.51 2ypi n GLY 214 N 0.40 -2.43 0.35 0.45 0.00 -1.22 -1.97 105.19 100.77 2ypi n GLY 214 Ca -0.15 0.61 0.01 0.00 0.00 0.00 0.00 46.02 46.50 2ypi n GLY 214 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2ypi h SER 215 N 0.00 -1.12 0.45 1.61 0.02 -1.94 -2.38 113.55 110.18 2ypi h SER 215 Ca 0.04 0.28 0.00 0.00 -0.84 0.00 0.00 61.79 61.27 2ypi h SER 215 Cb 0.09 0.64 0.00 0.00 0.14 0.00 0.00 62.40 63.27 2ypi h SER 215 CO -0.21 -0.30 -0.05 -0.46 -1.14 0.00 0.00 176.83 174.67 2ypi n ASN 216 N -5.52 0.22 -0.23 3.07 0.23 -0.83 -4.09 115.26 108.10 2ypi n ASN 216 Ca 0.11 -0.38 -0.01 0.00 -0.53 0.00 0.00 54.58 53.77 2ypi n ASN 216 Cb 0.42 -0.17 0.11 0.00 -2.08 0.00 0.00 39.78 38.06 2ypi n ASN 216 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2ypi h ALA 217 N 3.54 0.90 0.00 -2.53 0.00 -1.24 -2.52 119.26 117.41 2ypi h ALA 217 Ca 0.00 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 2ypi h ALA 217 Cb 0.31 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 2ypi h ALA 217 CO 0.00 0.00 -0.14 -0.39 0.00 0.00 0.00 179.25 178.73 2ypi h VAL 218 N 0.64 0.36 0.00 0.00 -1.51 -1.75 -2.84 116.25 111.14 2ypi h VAL 218 Ca 0.31 -0.86 0.00 0.00 -1.23 0.00 0.00 66.70 64.92 2ypi h VAL 218 Cb 0.24 1.65 0.00 0.00 -2.13 0.00 0.00 31.29 31.05 2ypi h VAL 218 CO -0.21 0.13 0.00 1.07 -1.23 0.00 0.00 177.57 177.34 2ypi n THR 219 N -3.30 1.46 0.23 7.19 5.66 -0.95 -3.00 114.28 121.57 2ypi n THR 219 Ca 0.00 0.37 0.02 0.00 -3.05 0.00 0.00 64.05 61.39 2ypi n THR 219 Cb 0.37 -1.24 -0.00 0.00 -1.55 0.00 0.00 70.33 67.91 2ypi n THR 219 CO 0.00 0.00 0.00 0.49 -3.05 0.00 0.00 175.07 172.51 2ypi n PHE 220 N -1.49 0.00 0.00 1.09 3.01 -1.07 -4.78 117.46 114.22 2ypi n PHE 220 Ca 0.02 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.48 2ypi n PHE 220 Cb 0.08 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.55 2ypi n PHE 220 CO 0.00 0.00 0.00 1.17 1.01 0.00 0.00 176.76 178.94 2ypi n LYS 221 N -0.44 0.00 -0.18 -1.08 4.81 -1.16 -2.78 118.16 117.33 2ypi n LYS 221 Ca 0.02 0.13 0.00 0.00 -0.87 0.00 0.00 58.31 57.59 2ypi n LYS 221 Cb 0.10 -1.57 0.00 0.00 0.02 0.00 0.00 35.03 33.58 2ypi n LYS 221 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 2ypi n ASP 222 N -1.03 0.00 -4.74 3.14 10.43 -1.26 -4.11 116.55 118.98 2ypi n ASP 222 Ca 0.00 -1.20 -0.41 0.00 2.57 0.00 0.00 54.79 55.76 2ypi n ASP 222 Cb 0.07 -0.04 -0.05 0.00 1.84 0.00 0.00 41.12 42.94 2ypi n ASP 222 CO 0.00 0.00 0.00 -0.54 -1.07 0.00 0.00 177.20 175.59 2ypi s LYS 223 N 0.00 4.73 0.20 -1.24 -0.14 -1.12 -4.98 119.74 117.20 2ypi s LYS 223 Ca 0.00 1.53 0.02 0.00 -1.36 0.00 0.00 55.97 56.17 2ypi s LYS 223 Cb 0.00 -3.31 0.12 0.00 -1.68 0.00 0.00 37.83 32.96 2ypi s LYS 223 CO 0.00 0.30 1.47 0.00 -0.76 0.00 0.00 175.35 176.36 2ypi h ALA 224 N 4.89 0.68 -0.02 5.17 0.00 -1.95 -3.31 119.26 124.73 2ypi h ALA 224 Ca -0.44 -0.62 0.00 0.00 0.00 0.00 0.00 54.91 53.85 2ypi h ALA 224 Cb 1.21 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.92 2ypi h ALA 224 CO 0.70 0.80 -0.27 -0.25 0.00 0.00 0.00 179.25 180.23 2ypi n ASP 225 N -3.79 2.14 -4.30 0.00 10.43 -1.26 -3.79 116.55 115.98 2ypi n ASP 225 Ca -0.03 -1.57 -0.45 0.00 2.57 0.00 0.00 54.79 55.30 2ypi n ASP 225 Cb 0.70 0.31 -0.03 0.00 1.84 0.00 0.00 41.12 43.94 2ypi n ASP 225 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 2ypi s VAL 226 N -2.03 5.35 -1.45 2.53 1.01 -1.25 -4.57 120.40 119.99 2ypi s VAL 226 Ca 0.19 -2.56 0.13 0.00 0.00 0.00 0.00 61.98 59.74 2ypi s VAL 226 Cb 0.16 -4.32 0.49 0.00 0.00 0.00 0.00 36.38 32.71 2ypi s VAL 226 CO 0.41 -1.01 1.37 0.47 0.00 0.00 0.00 175.10 176.34 2ypi n ASP 227 N 3.87 3.29 0.00 3.32 8.00 -1.17 -4.79 116.55 129.07 2ypi n ASP 227 Ca 0.13 -2.23 0.00 0.00 0.71 0.00 0.00 54.79 53.40 2ypi n ASP 227 Cb 0.46 -0.45 0.00 0.00 -0.02 0.00 0.00 41.12 41.11 2ypi n ASP 227 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2ypi n GLY 228 N 0.99 -1.07 3.11 0.44 0.00 -1.26 -2.42 105.19 104.98 2ypi n GLY 228 Ca 0.18 -1.02 -0.11 0.00 0.00 0.00 0.00 46.02 45.07 2ypi n GLY 228 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2ypi s PHE 229 N -3.00 0.06 -0.33 1.61 2.99 -0.12 -1.87 117.98 117.32 2ypi s PHE 229 Ca 0.00 -0.19 0.01 0.00 0.00 0.00 0.00 56.93 56.75 2ypi s PHE 229 Cb 0.00 -0.06 0.10 0.00 0.00 0.00 0.00 43.02 43.06 2ypi s PHE 229 CO 0.00 -0.30 0.09 -1.17 -0.00 0.00 0.00 175.22 173.84 2ypi s LEU 230 N -1.50 3.12 -0.26 -0.37 2.96 -1.12 0.23 118.68 121.74 2ypi s LEU 230 Ca -0.13 -1.86 -0.11 0.00 -0.22 0.00 0.00 54.13 51.81 2ypi s LEU 230 Cb -0.07 -1.13 -0.05 0.00 0.50 0.00 0.00 46.19 45.44 2ypi s LEU 230 CO 0.01 -0.40 0.17 -0.69 -1.32 0.00 0.00 176.35 174.12 2ypi s VAL 231 N 1.32 5.28 0.00 1.68 1.01 0.61 -4.16 120.40 126.14 2ypi s VAL 231 Ca 0.11 0.16 0.00 0.00 0.00 0.00 0.00 61.98 62.24 2ypi s VAL 231 Cb -0.18 -3.50 0.00 0.00 0.00 0.00 0.00 36.38 32.70 2ypi s VAL 231 CO -0.18 0.29 0.00 0.61 0.00 0.00 0.00 175.10 175.81 2ypi n GLY 232 N 4.77 0.38 0.35 4.51 0.00 -1.26 -1.44 105.19 112.50 2ypi n GLY 232 Ca -0.14 0.00 0.30 0.00 0.00 0.00 0.00 46.02 46.18 2ypi n GLY 232 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ypi n GLY 233 N 2.94 -0.64 0.12 -0.02 0.00 -1.26 -0.86 105.19 105.47 2ypi n GLY 233 Ca 0.00 0.59 0.02 0.00 0.00 0.00 0.00 46.02 46.62 2ypi n GLY 233 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ypi n ALA 234 N -2.53 2.48 0.27 4.61 0.00 -1.26 -4.13 120.51 119.95 2ypi n ALA 234 Ca 0.31 -0.48 0.10 0.00 0.00 0.00 0.00 53.44 53.37 2ypi n ALA 234 Cb 1.19 -0.11 0.48 0.00 0.00 0.00 0.00 19.45 21.01 2ypi n ALA 234 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2ypi n SER 235 N 0.06 0.53 0.10 0.00 3.41 -0.04 -0.33 113.62 117.35 2ypi n SER 235 Ca 0.02 0.68 -0.23 0.00 -0.26 0.00 0.00 58.87 59.08 2ypi n SER 235 Cb 0.08 -0.78 -0.15 0.00 -0.26 0.00 0.00 64.21 63.10 2ypi n SER 235 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 2ypi h LEU 236 N 0.00 0.69-10.36 1.04 3.38 -1.72 -3.46 115.31 104.88 2ypi h LEU 236 Ca 0.00 -0.89 -0.51 0.00 0.09 0.00 0.00 57.88 56.57 2ypi h LEU 236 Cb 0.18 -0.22 0.06 0.00 0.09 0.00 0.00 40.66 40.76 2ypi h LEU 236 CO 0.00 1.73 0.42 -0.54 0.09 0.00 0.00 178.44 180.14 2ypi s LYS 237 N -2.59 3.57 0.60 1.13 1.02 0.55 -4.88 119.74 119.13 2ypi s LYS 237 Ca -0.13 0.76 0.30 0.00 0.02 0.00 0.00 55.97 56.92 2ypi s LYS 237 Cb 0.05 -2.08 1.79 0.00 -0.52 0.00 0.00 37.83 37.08 2ypi s LYS 237 CO 0.89 -0.59 2.19 -1.35 -0.92 0.00 0.00 175.35 175.57 2ypi h PRO 238 N -0.34 0.00 0.00 -1.68 0.11 -1.91 -2.30 132.00 125.88 2ypi h PRO 238 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 2ypi h PRO 238 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2ypi h PRO 238 CO 0.62 0.00 0.00 -1.91 -0.21 0.00 0.00 178.00 176.50 2ypi n GLU 239 N -3.75 0.24 0.09 1.05 2.13 -1.26 -2.41 120.64 116.73 2ypi n GLU 239 Ca -0.01 0.13 -0.06 0.00 0.66 0.00 0.00 57.16 57.88 2ypi n GLU 239 Cb 0.19 -1.50 0.07 0.00 0.27 0.00 0.00 31.44 30.47 2ypi n GLU 239 CO 0.00 0.00 0.00 0.35 -0.41 0.00 0.00 177.13 177.07 2ypi h PHE 240 N 0.00 0.26 0.00 4.31 3.57 -1.38 -2.95 116.94 120.76 2ypi h PHE 240 Ca 0.00 -0.12 -0.11 0.00 3.53 0.00 0.00 57.97 61.27 2ypi h PHE 240 Cb 0.10 -0.04 -0.02 0.00 2.79 0.00 0.00 35.95 38.79 2ypi h PHE 240 CO 0.00 0.85 -0.50 -0.24 -2.23 0.00 0.00 178.31 176.18 2ypi h VAL 241 N 0.13 1.02 -0.50 1.41 3.04 -1.71 -2.62 116.25 117.03 2ypi h VAL 241 Ca -0.02 -1.99 -0.05 0.00 -1.01 0.00 0.00 66.70 63.62 2ypi h VAL 241 Cb 1.28 2.19 -0.02 0.00 -2.01 0.00 0.00 31.29 32.73 2ypi h VAL 241 CO 0.11 0.49 0.09 0.44 -1.01 0.00 0.00 177.57 177.69 2ypi h ASP 242 N 0.00 0.73 -0.73 3.17 3.32 -1.65 -2.56 116.42 118.70 2ypi h ASP 242 Ca -0.01 -0.14 -0.03 0.00 0.02 0.00 0.00 57.03 56.87 2ypi h ASP 242 Cb 1.15 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 40.48 2ypi h ASP 242 CO 0.07 0.74 0.32 0.40 -1.72 0.00 0.00 179.24 179.05 2ypi h ILE 243 N 0.74 1.24 0.00 0.35 2.04 -1.49 -3.14 117.51 117.26 2ypi h ILE 243 Ca 0.16 -0.72 -0.19 0.00 1.00 0.00 0.00 64.86 65.11 2ypi h ILE 243 Cb 0.33 0.36 -0.03 0.00 -0.74 0.00 0.00 36.82 36.74 2ypi h ILE 243 CO 0.00 0.30 -0.92 0.16 0.00 0.00 0.00 178.15 177.69 2ypi h ILE 244 N 1.03 1.55 -0.28 -0.67 3.07 -1.46 -3.20 117.51 117.54 2ypi h ILE 244 Ca 0.25 -3.19 0.00 0.00 1.55 0.00 0.00 64.86 63.47 2ypi h ILE 244 Cb 0.16 2.76 0.00 0.00 -0.27 0.00 0.00 36.82 39.47 2ypi h ILE 244 CO -0.03 0.88 0.00 0.59 -1.05 0.00 0.00 178.15 178.54 2ypi n ASN 245 N -3.32 2.18 -0.85 2.16 5.03 -0.97 -4.23 115.26 115.26 2ypi n ASN 245 Ca 0.00 -2.15 0.12 0.00 0.87 0.00 0.00 54.58 53.42 2ypi n ASN 245 Cb 0.90 -0.35 0.28 0.00 -1.02 0.00 0.00 39.78 39.59 2ypi n ASN 245 CO 0.00 0.00 0.00 -1.54 -1.83 0.00 0.00 177.26 173.89 2ypi n SER 246 N 0.35 2.57 -3.68 6.41 3.41 -1.20 -5.04 113.62 116.45 2ypi n SER 246 Ca 0.11 -1.85 -0.21 0.00 -0.26 0.00 0.00 58.87 56.66 2ypi n SER 246 Cb 0.41 -0.12 0.04 0.00 -0.26 0.00 0.00 64.21 64.28 2ypi n SER 246 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2ypi n ARG 247 N 0.94 -5.22 0.00 4.33 5.12 -1.26 -4.67 116.66 115.89 2ypi n ARG 247 Ca 0.17 0.65 0.11 0.00 -1.93 0.00 0.00 57.85 56.85 2ypi n ARG 247 Cb 0.49 -5.30 0.09 0.00 -1.16 0.00 0.00 32.46 26.58 2ypi n ARG 247 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79