#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yck s SER 10 N 0.00 6.24 0.24 0.00 1.04 -1.26 -4.99 113.70 114.97 1yck s SER 10 Ca 0.00 1.42 -0.30 0.00 0.48 0.00 0.00 55.95 57.54 1yck s SER 10 Cb 0.00 -2.47 -0.10 0.00 0.10 0.00 0.00 66.02 63.55 1yck s SER 10 CO 0.00 -0.86 1.47 -2.84 0.98 0.00 0.00 173.24 172.00 1yck s PRO 11 N -5.13 4.24 -0.03 4.02 0.02 -1.26 -5.03 135.00 131.83 1yck s PRO 11 Ca 0.55 2.34 0.05 0.00 0.02 0.00 0.00 61.00 63.95 1yck s PRO 11 Cb -0.11 -3.11 -0.01 0.00 0.02 0.00 0.00 34.50 31.29 1yck s PRO 11 CO 0.53 -0.47 -0.17 0.42 -0.33 0.00 0.00 177.00 176.98 1yck s ILE 12 N 0.17 1.40 -0.25 2.83 1.01 -1.26 -4.40 121.20 120.69 1yck s ILE 12 Ca 0.61 -0.73 -0.29 0.00 0.00 0.00 0.00 60.65 60.24 1yck s ILE 12 Cb -0.43 -1.19 0.00 0.00 0.01 0.00 0.00 42.46 40.86 1yck s ILE 12 CO 0.42 0.40 1.22 -0.69 0.00 0.00 0.00 174.94 176.29 1yck s VAL 13 N -0.19 4.31 0.66 2.92 1.01 0.93 -4.91 120.40 125.13 1yck s VAL 13 Ca 0.02 1.53 -0.15 0.00 0.00 0.00 0.00 61.98 63.38 1yck s VAL 13 Cb -0.09 -4.17 0.00 0.00 0.00 0.00 0.00 36.38 32.12 1yck s VAL 13 CO 0.01 -0.33 1.11 -2.16 0.00 0.00 0.00 175.10 173.72 1yck s PRO 14 N 3.75 2.78 0.23 2.72 0.04 -1.26 -1.49 135.00 141.77 1yck s PRO 14 Ca 0.52 1.36 -0.09 0.00 0.04 0.00 0.00 61.00 62.83 1yck s PRO 14 Cb -0.17 -1.95 0.35 0.00 0.04 0.00 0.00 34.50 32.77 1yck s PRO 14 CO 0.17 -1.26 1.66 0.00 0.04 0.00 0.00 177.00 177.61 1yck h ARG 15 N -0.05 0.13 0.00 4.56 3.08 -1.94 -0.15 114.38 120.01 1yck h ARG 15 Ca -0.46 -0.01 -0.03 0.00 0.07 0.00 0.00 59.98 59.55 1yck h ARG 15 Cb 1.24 -0.03 -0.00 0.00 0.08 0.00 0.00 29.97 31.26 1yck h ARG 15 CO 0.54 0.08 -0.12 -0.91 -1.07 0.00 0.00 179.97 178.49 1yck h ASN 16 N 0.13 0.00 0.21 7.04 4.21 -1.91 -1.48 115.58 123.79 1yck h ASN 16 Ca 0.36 0.00 -0.15 0.00 1.21 0.00 0.00 56.30 57.71 1yck h ASN 16 Cb 0.59 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.79 1yck h ASN 16 CO -0.56 0.12 -0.58 -0.08 -1.29 0.00 0.00 177.43 175.04 1yck h GLU 17 N 0.00 0.38 -0.22 0.81 4.81 -1.37 -2.35 114.58 116.64 1yck h GLU 17 Ca -0.00 -0.25 0.00 0.00 -0.13 0.00 0.00 59.36 58.98 1yck h GLU 17 Cb 0.24 0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.66 1yck h GLU 17 CO 0.02 0.86 0.00 -2.67 -0.73 0.00 0.00 179.01 176.48 1yck n TRP 18 N -3.91 0.29 -3.20 0.92 4.27 -0.89 -4.93 117.44 109.99 1yck n TRP 18 Ca -0.03 -0.15 -0.16 0.00 -3.89 0.00 0.00 57.50 53.28 1yck n TRP 18 Cb 0.61 0.00 0.05 0.00 -1.36 0.00 0.00 31.31 30.61 1yck n TRP 18 CO 0.00 0.00 0.00 1.63 -2.29 0.00 0.00 177.69 177.03 1yck n LYS 19 N 0.40 -5.18 -1.94 -2.67 4.76 -0.62 -4.76 118.16 108.15 1yck n LYS 19 Ca 0.15 0.55 -0.40 0.00 -2.87 0.00 0.00 58.31 55.74 1yck n LYS 19 Cb 0.33 -4.73 -0.00 0.00 -1.84 0.00 0.00 35.03 28.78 1yck n LYS 19 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1yck s ALA 20 N -3.20 3.38 0.72 7.82 0.00 -0.80 -5.00 121.76 124.68 1yck s ALA 20 Ca 0.38 1.38 -0.16 0.00 0.00 0.00 0.00 51.96 53.56 1yck s ALA 20 Cb -0.17 -3.54 0.01 0.00 0.00 0.00 0.00 23.12 19.42 1yck s ALA 20 CO 0.47 -0.93 1.01 1.28 0.00 0.00 0.00 175.76 177.59 1yck n LEU 21 N 0.28 3.79 -4.76 0.00 4.77 -1.26 -4.86 117.00 114.96 1yck n LEU 21 Ca 0.03 0.68 -0.38 0.00 -0.03 0.00 0.00 56.01 56.30 1yck n LEU 21 Cb 0.42 -1.43 0.01 0.00 -2.33 0.00 0.00 43.42 40.09 1yck n LEU 21 CO 0.59 -1.92 0.94 0.00 -1.33 0.00 0.00 177.39 175.67 1yck s ALA 22 N -1.79 3.05 0.35 -1.18 0.00 -1.26 -4.98 121.76 115.95 1yck s ALA 22 Ca 0.74 1.19 -0.27 0.00 0.00 0.00 0.00 51.96 53.62 1yck s ALA 22 Cb -0.35 -3.49 -0.09 0.00 0.00 0.00 0.00 23.12 19.19 1yck s ALA 22 CO 0.49 -0.96 1.21 0.45 0.00 0.00 0.00 175.76 176.96 1yck s SER 23 N -0.96 6.77 -0.06 0.00 0.15 -1.26 -4.93 113.70 113.40 1yck s SER 23 Ca 0.63 2.47 0.15 0.00 0.70 0.00 0.00 55.95 59.90 1yck s SER 23 Cb -0.36 -2.63 0.49 0.00 -1.71 0.00 0.00 66.02 61.81 1yck s SER 23 CO 0.45 -0.51 1.41 -0.62 1.20 0.00 0.00 173.24 175.17 1yck n GLU 24 N 0.59 3.08 -2.66 5.44 1.02 0.52 -5.04 120.64 123.60 1yck n GLU 24 Ca 0.01 -2.48 -0.36 0.00 -0.02 0.00 0.00 57.16 54.31 1yck n GLU 24 Cb 0.44 -1.57 -0.05 0.00 -0.02 0.00 0.00 31.44 30.24 1yck n GLU 24 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1yck n ALA 26 N -0.10 1.95 -2.45 0.00 0.00 -1.26 -5.04 120.51 113.61 1yck n ALA 26 Ca 0.05 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.06 1yck n ALA 26 Cb 0.51 0.07 -0.02 0.00 0.00 0.00 0.00 19.45 20.00 1yck n ALA 26 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 1yck s GLN 27 N -1.95 4.31 0.06 0.00 -0.44 -1.26 -5.02 119.66 115.36 1yck s GLN 27 Ca 0.00 1.66 -0.07 0.00 -2.50 0.00 0.00 55.36 54.44 1yck s GLN 27 Cb 0.00 -3.64 -0.05 0.00 -1.64 0.00 0.00 33.01 27.68 1yck s GLN 27 CO 0.00 -0.55 0.34 -1.01 0.50 0.00 0.00 175.29 174.58 1yck s HIS 28 N 2.71 3.56 0.47 1.67 3.76 -1.26 -1.15 115.29 125.05 1yck s HIS 28 Ca 0.55 0.66 -0.21 0.00 -0.15 0.00 0.00 55.06 55.91 1yck s HIS 28 Cb -0.23 -2.06 -0.09 0.00 1.11 0.00 0.00 32.58 31.31 1yck s HIS 28 CO 0.19 0.54 1.04 -0.51 -0.85 0.00 0.00 174.74 175.14 1yck s LEU 29 N -2.00 3.88 -0.63 0.89 1.43 0.36 -4.64 118.68 117.97 1yck s LEU 29 Ca 0.32 1.93 -0.16 0.00 -1.03 0.00 0.00 54.13 55.19 1yck s LEU 29 Cb -0.13 -4.52 0.15 0.00 0.03 0.00 0.00 46.19 41.71 1yck s LEU 29 CO 0.19 -0.73 0.62 -0.55 0.23 0.00 0.00 176.35 176.10 1yck s SER 30 N -1.94 6.33 0.71 2.29 0.15 -1.26 -4.92 113.70 115.05 1yck s SER 30 Ca 0.66 -1.93 -0.11 0.00 0.70 0.00 0.00 55.95 55.26 1yck s SER 30 Cb -0.17 -2.23 0.02 0.00 -1.71 0.00 0.00 66.02 61.93 1yck s SER 30 CO 0.20 -0.85 1.08 -0.76 1.20 0.00 0.00 173.24 174.12 1yck s LEU 31 N 1.51 2.91 0.54 3.45 1.43 -1.26 -4.49 118.68 122.78 1yck s LEU 31 Ca 0.09 1.27 -0.13 0.00 -1.03 0.00 0.00 54.13 54.33 1yck s LEU 31 Cb -0.24 -4.08 -0.06 0.00 0.03 0.00 0.00 46.19 41.85 1yck s LEU 31 CO 0.01 -1.41 0.97 -2.16 0.23 0.00 0.00 176.35 173.98 1yck s PRO 32 N -5.25 3.76 0.10 1.29 0.04 -1.26 -5.12 135.00 128.56 1yck s PRO 32 Ca 0.58 0.77 0.01 0.00 0.04 0.00 0.00 61.00 62.40 1yck s PRO 32 Cb -0.12 -2.16 -0.04 0.00 0.04 0.00 0.00 34.50 32.22 1yck s PRO 32 CO 0.53 -0.36 0.23 -0.51 0.04 0.00 0.00 177.00 176.92 1yck s LEU 33 N -4.55 4.30 0.05 -3.56 1.43 0.22 -4.74 118.68 111.83 1yck s LEU 33 Ca 0.56 0.20 0.24 0.00 -1.03 0.00 0.00 54.13 54.10 1yck s LEU 33 Cb -0.10 -2.89 0.36 0.00 0.03 0.00 0.00 46.19 43.58 1yck s LEU 33 CO 0.41 0.12 1.31 -1.14 0.23 0.00 0.00 176.35 177.29 1yck n ARG 34 N -0.03 0.16 -4.13 1.70 0.63 -1.25 -1.62 116.66 112.13 1yck n ARG 34 Ca -0.06 0.03 -0.15 0.00 -0.92 0.00 0.00 57.85 56.75 1yck n ARG 34 Cb 0.52 -1.59 -0.12 0.00 0.45 0.00 0.00 32.46 31.72 1yck n ARG 34 CO 0.00 0.00 0.00 0.71 -2.51 0.00 0.00 177.63 175.83 1yck s TYR 35 N -3.10 0.77 -0.03 -0.14 1.51 -1.21 -0.32 117.35 114.84 1yck s TYR 35 Ca 0.08 -0.41 0.08 0.00 -1.01 0.00 0.00 57.07 55.81 1yck s TYR 35 Cb 0.15 -0.46 -0.02 0.00 -0.11 0.00 0.00 41.96 41.53 1yck s TYR 35 CO 0.73 -0.04 -0.26 0.08 -1.11 0.00 0.00 175.55 174.95 1yck s VAL 36 N -1.08 2.04 -0.17 0.71 1.01 -0.60 -1.74 120.40 120.57 1yck s VAL 36 Ca -0.05 -1.10 0.01 0.00 0.00 0.00 0.00 61.98 60.84 1yck s VAL 36 Cb -0.08 -1.70 0.01 0.00 0.00 0.00 0.00 36.38 34.61 1yck s VAL 36 CO 0.01 0.58 -0.19 -0.69 0.00 0.00 0.00 175.10 174.80 1yck s VAL 37 N -0.54 2.25 -0.23 2.92 1.01 -0.54 -0.55 120.40 124.71 1yck s VAL 37 Ca 0.08 -0.89 -0.11 0.00 0.00 0.00 0.00 61.98 61.05 1yck s VAL 37 Cb -0.11 -1.94 -0.05 0.00 0.00 0.00 0.00 36.38 34.29 1yck s VAL 37 CO -0.00 0.53 0.19 -0.69 0.00 0.00 0.00 175.10 175.13 1yck s VAL 38 N 1.08 5.34 0.38 2.92 1.01 -0.28 -2.11 120.40 128.74 1yck s VAL 38 Ca -0.00 0.25 0.05 0.00 0.00 0.00 0.00 61.98 62.28 1yck s VAL 38 Cb -0.14 -3.53 -0.07 0.00 0.00 0.00 0.00 36.38 32.64 1yck s VAL 38 CO -0.07 0.34 0.03 -0.94 0.00 0.00 0.00 175.10 174.47 1yck s SER 39 N 0.98 3.26 0.26 3.32 1.04 -0.43 -0.73 113.70 121.40 1yck s SER 39 Ca 0.09 -1.40 0.11 0.00 0.48 0.00 0.00 55.95 55.22 1yck s SER 39 Cb -0.13 -0.18 -0.05 0.00 0.10 0.00 0.00 66.02 65.76 1yck s SER 39 CO 0.04 -0.56 -0.10 -1.38 0.98 0.00 0.00 173.24 172.22 1yck s HIS 40 N -2.97 2.51 -0.35 5.02 -3.43 -1.26 -1.24 115.29 113.57 1yck s HIS 40 Ca 0.33 -0.27 0.20 0.00 -0.80 0.00 0.00 55.06 54.53 1yck s HIS 40 Cb 0.09 -1.12 0.25 0.00 -1.43 0.00 0.00 32.58 30.36 1yck s HIS 40 CO 0.16 0.64 1.56 1.79 -2.00 0.00 0.00 174.74 176.88 1yck h THR 41 N 2.21 0.29 -0.44 -5.38 1.35 -1.19 -3.46 112.91 106.28 1yck h THR 41 Ca -0.43 -1.40 -0.19 0.00 -0.55 0.00 0.00 66.41 63.84 1yck h THR 41 Cb 1.25 2.14 -0.08 0.00 -1.73 0.00 0.00 68.15 69.73 1yck h THR 41 CO 0.59 0.16 -0.17 0.00 -0.25 0.00 0.00 175.52 175.85 1yck n ALA 42 N -2.14 -0.14 -2.00 6.62 0.00 0.11 -4.92 120.51 118.04 1yck n ALA 42 Ca 0.03 0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.62 1yck n ALA 42 Cb 0.60 -1.66 0.00 0.00 0.00 0.00 0.00 19.45 18.39 1yck n ALA 42 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yck n GLY 43 N 0.09 1.91 3.81 0.00 0.00 -1.24 -4.75 105.19 105.00 1yck n GLY 43 Ca -0.09 -1.91 -0.33 0.00 0.00 0.00 0.00 46.02 43.68 1yck n GLY 43 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1yck s SER 44 N -1.00 6.39 0.67 1.61 0.01 -1.26 -3.66 113.70 116.46 1yck s SER 44 Ca 0.00 1.84 0.02 0.00 1.31 0.00 0.00 55.95 59.12 1yck s SER 44 Cb 0.00 -2.55 0.12 0.00 0.21 0.00 0.00 66.02 63.80 1yck s SER 44 CO 0.00 -0.75 0.88 -0.24 0.41 0.00 0.00 173.24 173.54 1yck n SER 45 N -1.11 1.39 -3.57 2.44 2.88 -1.26 -2.92 113.62 111.47 1yck n SER 45 Ca 0.09 -2.12 -0.15 0.00 -1.33 0.00 0.00 58.87 55.36 1yck n SER 45 Cb 0.53 -0.55 -0.06 0.00 -0.75 0.00 0.00 64.21 63.38 1yck n SER 45 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1yck n ASN 47 N 1.44 0.43 -4.10 0.00 6.94 -1.26 -2.08 115.26 116.63 1yck n ASN 47 Ca -0.15 -2.12 -0.10 0.00 -0.02 0.00 0.00 54.58 52.18 1yck n ASN 47 Cb 0.57 -0.25 -0.10 0.00 -2.36 0.00 0.00 39.78 37.64 1yck n ASN 47 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 1yck s THR 48 N -0.28 0.47 0.20 5.53 -4.23 -1.26 -4.31 115.64 111.75 1yck s THR 48 Ca 0.11 -1.60 -0.11 0.00 -1.18 0.00 0.00 61.69 58.90 1yck s THR 48 Cb 0.11 -1.25 0.13 0.00 1.34 0.00 0.00 72.50 72.83 1yck s THR 48 CO -0.04 -0.76 1.73 -0.65 -0.54 0.00 0.00 174.62 174.37 1yck h PRO 49 N 3.53 0.32 -0.19 3.99 0.11 -1.97 0.22 132.00 138.01 1yck h PRO 49 Ca -0.35 -0.02 0.03 0.00 0.11 0.00 0.00 66.00 65.77 1yck h PRO 49 Cb 1.17 -0.07 -0.03 0.00 0.11 0.00 0.00 31.00 32.18 1yck h PRO 49 CO 0.57 0.21 0.04 0.00 -0.21 0.00 0.00 178.00 178.61 1yck h ALA 50 N 1.40 0.19 -0.12 -0.75 0.00 -2.00 0.33 119.26 118.31 1yck h ALA 50 Ca 0.28 0.04 -0.14 0.00 0.00 0.00 0.00 54.91 55.09 1yck h ALA 50 Cb 0.35 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1yck h ALA 50 CO -0.31 -0.40 -0.52 0.66 0.00 0.00 0.00 179.25 178.68 1yck h SER 51 N 0.11 0.38 0.33 0.00 4.64 -1.87 -2.53 113.55 114.60 1yck h SER 51 Ca 0.09 -0.19 -0.19 0.00 -0.47 0.00 0.00 61.79 61.03 1yck h SER 51 Cb 0.08 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 62.06 1yck h SER 51 CO -0.12 0.83 -0.77 0.00 -0.87 0.00 0.00 176.83 175.90 1yck h GLN 53 N 0.23 0.50 -0.60 0.00 4.20 -0.90 0.87 115.11 119.40 1yck h GLN 53 Ca -0.04 -0.03 -0.04 0.00 0.06 0.00 0.00 58.65 58.60 1yck h GLN 53 Cb 1.36 -0.11 -0.03 0.00 0.30 0.00 0.00 27.48 29.00 1yck h GLN 53 CO 0.13 0.33 0.21 0.37 -0.67 0.00 0.00 178.83 179.19 1yck h GLN 54 N 0.51 0.90 -0.37 1.46 5.75 -1.30 -1.90 115.11 120.17 1yck h GLN 54 Ca 0.15 -0.16 -0.14 0.00 -0.15 0.00 0.00 58.65 58.34 1yck h GLN 54 Cb -0.05 -0.15 -0.01 0.00 1.07 0.00 0.00 27.48 28.35 1yck h GLN 54 CO -0.04 0.76 -0.34 0.37 -2.65 0.00 0.00 178.83 176.93 1yck h GLN 55 N 0.88 0.84 -0.84 1.69 5.75 -0.39 0.70 115.11 123.75 1yck h GLN 55 Ca 0.20 -0.41 0.03 0.00 -0.15 0.00 0.00 58.65 58.32 1yck h GLN 55 Cb 0.23 -0.00 -0.05 0.00 1.07 0.00 0.00 27.48 28.73 1yck h GLN 55 CO -0.01 1.05 0.54 0.00 -2.65 0.00 0.00 178.83 177.76 1yck h ALA 56 N 0.90 1.10 -0.56 3.38 0.00 -0.58 -1.28 119.26 122.21 1yck h ALA 56 Ca 0.07 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.87 1yck h ALA 56 Cb 0.91 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 1yck h ALA 56 CO 0.08 0.38 0.05 0.00 0.00 0.00 0.00 179.25 179.76 1yck h ARG 57 N 1.05 0.93 -0.69 0.00 3.08 -0.79 -0.34 114.38 117.62 1yck h ARG 57 Ca 0.33 -0.25 -0.01 0.00 0.07 0.00 0.00 59.98 60.12 1yck h ARG 57 Cb -0.00 -0.11 -0.03 0.00 0.08 0.00 0.00 29.97 29.90 1yck h ARG 57 CO -0.11 0.89 0.38 -0.91 -1.07 0.00 0.00 179.97 179.15 1yck h ASN 58 N 0.87 0.86 -0.33 7.04 2.35 -0.23 0.83 115.58 126.96 1yck h ASN 58 Ca 0.17 -0.10 -0.06 0.00 -0.55 0.00 0.00 56.30 55.77 1yck h ASN 58 Cb 0.45 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.59 1yck h ASN 58 CO 0.02 0.71 -0.03 0.58 -1.65 0.00 0.00 177.43 177.06 1yck h VAL 59 N 0.94 1.27 -0.73 2.81 2.07 -0.87 -1.39 116.25 120.35 1yck h VAL 59 Ca 0.24 -1.02 -0.02 0.00 0.82 0.00 0.00 66.70 66.72 1yck h VAL 59 Cb 0.04 1.27 -0.03 0.00 -1.52 0.00 0.00 31.29 31.04 1yck h VAL 59 CO -0.04 0.33 0.37 -0.61 0.02 0.00 0.00 177.57 177.64 1yck h GLN 60 N 0.40 1.04 -0.55 1.57 4.15 -0.83 -0.42 115.11 120.47 1yck h GLN 60 Ca 0.09 -0.14 -0.04 0.00 0.77 0.00 0.00 58.65 59.33 1yck h GLN 60 Cb 0.49 -0.19 -0.02 0.00 0.21 0.00 0.00 27.48 27.96 1yck h GLN 60 CO 0.02 0.80 0.19 1.25 -1.93 0.00 0.00 178.83 179.17 1yck h HIS 61 N 1.01 0.86 0.02 3.99 2.76 -0.63 0.18 115.15 123.34 1yck h HIS 61 Ca 0.25 -0.08 0.02 0.00 -2.20 0.00 0.00 60.37 58.37 1yck h HIS 61 Cb 0.09 -0.25 -0.03 0.00 1.55 0.00 0.00 27.41 28.77 1yck h HIS 61 CO 0.00 0.72 -0.17 -0.92 -1.30 0.00 0.00 177.93 176.27 1yck h TYR 62 N 0.76 -0.43 -0.65 5.26 3.20 -0.82 0.20 116.97 124.49 1yck h TYR 62 Ca 0.18 0.01 -0.07 0.00 3.14 0.00 0.00 58.73 62.00 1yck h TYR 62 Cb 0.24 0.19 -0.03 0.00 1.54 0.00 0.00 36.73 38.68 1yck h TYR 62 CO 0.01 -0.24 0.14 0.45 -1.64 0.00 0.00 178.16 176.88 1yck h HIS 63 N -0.28 1.10 0.00 -3.82 3.86 -0.61 -1.18 115.15 114.22 1yck h HIS 63 Ca 0.05 -0.14 -0.16 0.00 -1.16 0.00 0.00 60.37 58.96 1yck h HIS 63 Cb 0.34 -0.31 -0.02 0.00 1.06 0.00 0.00 27.41 28.48 1yck h HIS 63 CO -0.21 0.92 -0.86 0.52 0.86 0.00 0.00 177.93 179.16 1yck h MET 64 N 0.97 0.00 0.18 2.45 2.86 -0.61 -0.06 114.93 120.72 1yck h MET 64 Ca 0.20 -0.01 -0.26 0.00 -2.06 0.00 0.00 59.70 57.57 1yck h MET 64 Cb 0.39 0.00 0.02 0.00 0.06 0.00 0.00 31.60 32.07 1yck h MET 64 CO 0.01 1.00 -1.20 -0.22 1.06 0.00 0.00 176.91 177.56 1yck h LYS 65 N -0.99 0.38 0.03 1.72 1.63 -0.72 -1.85 116.57 116.79 1yck h LYS 65 Ca -0.24 -0.65 -0.11 0.00 -0.85 0.00 0.00 60.65 58.80 1yck h LYS 65 Cb 1.22 0.24 -0.01 0.00 -0.60 0.00 0.00 32.23 33.08 1yck h LYS 65 CO -0.14 1.31 -0.58 1.15 -3.45 0.00 0.00 179.45 177.75 1yck h THR 66 N -0.15 1.46 0.00 1.00 2.02 -1.37 -3.37 112.91 112.49 1yck h THR 66 Ca -0.22 -2.34 0.00 0.00 0.77 0.00 0.00 66.41 64.61 1yck h THR 66 Cb 1.87 3.02 0.00 0.00 -1.74 0.00 0.00 68.15 71.30 1yck h THR 66 CO 0.18 0.57 -0.53 0.18 0.37 0.00 0.00 175.52 176.28 1yck n LEU 67 N -4.42 0.57 -0.65 2.58 4.77 -0.49 -4.98 117.00 114.38 1yck n LEU 67 Ca -0.17 0.16 -0.08 0.00 -0.03 0.00 0.00 56.01 55.88 1yck n LEU 67 Cb 0.63 -0.23 -0.03 0.00 -2.33 0.00 0.00 43.42 41.45 1yck n LEU 67 CO 0.33 0.02 -0.08 0.61 -1.33 0.00 0.00 177.39 176.94 1yck n GLY 68 N 1.41 0.99 3.87 -0.72 0.00 -0.69 -4.95 105.19 105.09 1yck n GLY 68 Ca 0.04 -0.66 -0.30 0.00 0.00 0.00 0.00 46.02 45.10 1yck n GLY 68 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1yck s TRP 69 N -2.31 3.34 -0.75 1.61 0.51 -0.06 -4.96 118.94 116.31 1yck s TRP 69 Ca 0.00 1.13 0.24 0.00 -2.12 0.00 0.00 56.10 55.35 1yck s TRP 69 Cb 0.00 -2.98 0.92 0.00 -0.81 0.00 0.00 33.47 30.59 1yck s TRP 69 CO 0.00 -1.12 1.74 0.00 -0.51 0.00 0.00 176.95 177.06 1yck s ASP 71 N -3.89 -0.10 0.22 0.00 2.15 -1.26 -0.35 116.67 113.43 1yck s ASP 71 Ca 0.09 -0.32 -0.30 0.00 0.43 0.00 0.00 52.55 52.45 1yck s ASP 71 Cb 0.12 0.34 -0.15 0.00 -0.30 0.00 0.00 42.92 42.93 1yck s ASP 71 CO 0.47 -0.64 0.99 0.55 -0.17 0.00 0.00 175.17 176.38 1yck n VAL 72 N -0.53 1.47 -0.01 1.11 3.14 -1.26 -4.61 118.33 117.65 1yck n VAL 72 Ca -0.06 -0.37 -0.05 0.00 -2.96 0.00 0.00 64.34 60.90 1yck n VAL 72 Cb 0.61 -0.74 0.17 0.00 -1.06 0.00 0.00 33.84 32.82 1yck n VAL 72 CO 0.00 0.00 0.00 1.23 -6.46 0.00 0.00 176.83 171.60 1yck h GLY 73 N 2.43 0.60 -2.35 7.55 0.00 -1.92 -3.40 103.07 105.99 1yck h GLY 73 Ca -0.40 -0.51 -0.45 0.00 0.00 0.00 0.00 47.33 45.98 1yck h GLY 73 CO 0.64 0.46 0.35 -0.19 0.00 0.00 0.00 176.54 177.80 1yck s TYR 74 N -4.50 3.40 0.17 5.60 1.51 -1.26 -0.43 117.35 121.84 1yck s TYR 74 Ca -0.07 1.66 -0.10 0.00 -1.01 0.00 0.00 57.07 57.55 1yck s TYR 74 Cb 0.13 -2.89 0.04 0.00 -0.11 0.00 0.00 41.96 39.13 1yck s TYR 74 CO 0.80 -0.08 1.60 -0.91 -1.11 0.00 0.00 175.55 175.85 1yck h ASN 75 N 2.26 1.04 -5.00 2.29 2.35 -1.38 -0.62 115.58 116.52 1yck h ASN 75 Ca -0.48 -0.34 -0.14 0.00 -0.55 0.00 0.00 56.30 54.78 1yck h ASN 75 Cb 1.19 -0.28 -0.20 0.00 0.05 0.00 0.00 38.32 39.07 1yck h ASN 75 CO 0.62 1.14 -0.49 -0.36 -1.65 0.00 0.00 177.43 176.69 1yck s PHE 76 N -4.88 0.06 0.06 1.19 0.40 -1.10 -0.84 117.98 112.88 1yck s PHE 76 Ca -0.12 -0.19 0.09 0.00 -0.60 0.00 0.00 56.93 56.11 1yck s PHE 76 Cb 0.13 -0.06 -0.03 0.00 0.51 0.00 0.00 43.02 43.57 1yck s PHE 76 CO 0.86 -0.31 -0.23 -0.51 0.70 0.00 0.00 175.22 175.74 1yck s LEU 77 N -1.52 2.39 -0.16 -0.37 1.02 -0.25 -1.71 118.68 118.08 1yck s LEU 77 Ca -0.13 -0.56 -0.00 0.00 0.02 0.00 0.00 54.13 53.46 1yck s LEU 77 Cb -0.07 -1.38 -0.00 0.00 0.02 0.00 0.00 46.19 44.76 1yck s LEU 77 CO 0.01 0.24 -0.14 -0.63 0.02 0.00 0.00 176.35 175.85 1yck s ILE 78 N -0.92 2.82 0.22 -0.59 -1.09 0.42 -0.12 121.20 121.94 1yck s ILE 78 Ca 0.14 -0.72 0.01 0.00 -2.23 0.00 0.00 60.65 57.85 1yck s ILE 78 Cb -0.10 -2.20 -0.04 0.00 -1.58 0.00 0.00 42.46 38.54 1yck s ILE 78 CO 0.04 0.51 0.39 -0.83 -1.23 0.00 0.00 174.94 173.82 1yck s GLY 79 N 0.80 1.60 0.00 6.18 0.00 -0.67 -1.26 107.32 113.96 1yck s GLY 79 Ca -0.05 -0.96 0.14 0.00 0.00 0.00 0.00 44.72 43.86 1yck s GLY 79 CO 0.00 -0.93 1.54 1.18 0.00 0.00 0.00 173.10 174.89 1yck n GLU 80 N -0.94 1.01 0.00 2.90 1.02 -0.88 -1.64 120.64 122.11 1yck n GLU 80 Ca -0.06 -0.02 0.12 0.00 -0.02 0.00 0.00 57.16 57.18 1yck n GLU 80 Cb 0.55 -1.22 0.60 0.00 -0.02 0.00 0.00 31.44 31.34 1yck n GLU 80 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 1yck n ASP 81 N -0.70 0.00 0.00 1.62 3.85 -1.22 -4.66 116.55 115.44 1yck n ASP 81 Ca 0.11 -0.07 0.00 0.00 -0.71 0.00 0.00 54.79 54.12 1yck n ASP 81 Cb 0.05 -0.28 0.00 0.00 -1.35 0.00 0.00 41.12 39.55 1yck n ASP 81 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1yck n GLY 82 N 0.70 0.69 3.80 6.12 0.00 -0.65 -4.91 105.19 110.95 1yck n GLY 82 Ca 0.11 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.84 1yck n GLY 82 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1yck s LEU 83 N 0.00 3.88 -0.18 0.99 1.43 -1.25 -4.68 118.68 118.87 1yck s LEU 83 Ca 0.00 -0.01 -0.08 0.00 -1.03 0.00 0.00 54.13 53.01 1yck s LEU 83 Cb 0.00 -2.53 -0.04 0.00 0.03 0.00 0.00 46.19 43.65 1yck s LEU 83 CO 0.00 0.14 0.10 -0.69 0.23 0.00 0.00 176.35 176.14 1yck s VAL 84 N -1.50 5.18 -0.21 -1.59 1.01 -1.26 -1.67 120.40 120.35 1yck s VAL 84 Ca 0.30 0.10 -0.06 0.00 0.00 0.00 0.00 61.98 62.33 1yck s VAL 84 Cb -0.12 -3.33 -0.03 0.00 0.00 0.00 0.00 36.38 32.91 1yck s VAL 84 CO 0.23 0.48 0.02 -0.31 0.00 0.00 0.00 175.10 175.53 1yck s TYR 85 N 0.08 3.06 0.04 5.22 1.51 0.83 -0.05 117.35 128.04 1yck s TYR 85 Ca 0.08 -0.46 -0.30 0.00 -1.01 0.00 0.00 57.07 55.38 1yck s TYR 85 Cb -0.12 -2.13 -0.08 0.00 -0.11 0.00 0.00 41.96 39.52 1yck s TYR 85 CO -0.00 -0.28 1.73 -2.00 -1.11 0.00 0.00 175.55 173.89 1yck s GLU 86 N 1.18 4.18 0.00 -0.62 2.12 -0.56 -1.09 118.70 123.91 1yck s GLU 86 Ca 0.03 2.38 0.00 0.00 0.36 0.00 0.00 54.97 57.74 1yck s GLU 86 Cb -0.14 -3.78 0.00 0.00 0.26 0.00 0.00 34.13 30.46 1yck s GLU 86 CO 0.02 -0.81 0.00 0.41 -0.54 0.00 0.00 175.26 174.34 1yck n GLY 87 N 4.15 0.56 0.21 -1.50 0.00 -0.02 -4.51 105.19 104.09 1yck n GLY 87 Ca 0.17 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.34 1yck n GLY 87 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1yck h ARG 88 N 0.00 0.00 0.00 1.61 3.08 -0.82 -3.48 114.38 114.77 1yck h ARG 88 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1yck h ARG 88 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 1yck h ARG 88 CO 0.00 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 179.31 1yck n GLY 89 N -0.21 -2.04 0.21 0.04 0.00 -0.27 -3.85 105.19 99.07 1yck n GLY 89 Ca 0.01 -1.43 0.10 0.00 0.00 0.00 0.00 46.02 44.69 1yck n GLY 89 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 1yck h TRP 90 N 0.00 0.00 0.00 1.61 4.06 -1.94 -3.35 115.95 116.32 1yck h TRP 90 Ca 0.00 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.95 1yck h TRP 90 Cb 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.16 1yck h TRP 90 CO 0.00 0.19 -1.26 0.09 -3.56 0.00 0.00 178.44 173.91 1yck n ASN 91 N -3.23 0.73 -4.41 -3.49 3.02 -1.26 -4.81 115.26 101.82 1yck n ASN 91 Ca 0.02 -0.67 -0.33 0.00 -0.03 0.00 0.00 54.58 53.57 1yck n ASN 91 Cb 0.51 1.30 -0.14 0.00 -0.61 0.00 0.00 39.78 40.83 1yck n ASN 91 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1yck s PHE 92 N -3.06 2.71 0.20 3.10 0.08 -1.25 -0.49 117.98 119.26 1yck s PHE 92 Ca 0.03 -0.41 -0.32 0.00 0.12 0.00 0.00 56.93 56.35 1yck s PHE 92 Cb 0.15 -1.70 -0.12 0.00 -0.57 0.00 0.00 43.02 40.78 1yck s PHE 92 CO 0.83 -0.01 1.71 0.99 -0.10 0.00 0.00 175.22 178.65 1yck s THR 93 N -0.26 2.12 0.90 0.64 2.01 -0.30 -4.70 115.64 116.05 1yck s THR 93 Ca 0.01 0.06 -0.14 0.00 0.31 0.00 0.00 61.69 61.94 1yck s THR 93 Cb -0.13 -3.04 0.20 0.00 0.01 0.00 0.00 72.50 69.54 1yck s THR 93 CO 0.03 0.00 1.22 0.61 -0.69 0.00 0.00 174.62 175.80 1yck n GLY 94 N 3.97 -1.19 2.47 4.40 0.00 -1.26 -4.93 105.19 108.65 1yck n GLY 94 Ca 0.16 -1.75 -0.28 0.00 0.00 0.00 0.00 46.02 44.15 1yck n GLY 94 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yck s ALA 95 N -3.86 1.45 0.00 4.61 0.00 0.43 -4.82 121.76 119.57 1yck s ALA 95 Ca 0.71 -2.35 0.00 0.00 0.00 0.00 0.00 51.96 50.32 1yck s ALA 95 Cb -0.02 -1.66 0.00 0.00 0.00 0.00 0.00 23.12 21.44 1yck s ALA 95 CO 0.49 -2.03 0.00 -2.39 0.00 0.00 0.00 175.76 171.83 1yck n HIS 96 N 3.26 0.00 -1.50 0.00 1.44 -1.26 -4.36 115.22 112.80 1yck n HIS 96 Ca 0.21 0.00 0.01 0.00 -2.01 0.00 0.00 57.72 55.94 1yck n HIS 96 Cb 0.42 0.00 0.02 0.00 0.12 0.00 0.00 29.99 30.55 1yck n HIS 96 CO 0.00 0.00 0.00 0.43 -2.81 0.00 0.00 176.34 173.96 1yck n SER 97 N -0.30 0.42 0.00 4.39 7.64 -1.26 -5.08 113.62 119.43 1yck n SER 97 Ca 0.00 -1.87 0.00 0.00 1.01 0.00 0.00 58.87 58.01 1yck n SER 97 Cb 0.00 -0.16 0.00 0.00 -1.01 0.00 0.00 64.21 63.04 1yck n SER 97 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1yck n GLY 98 N -0.21 0.95 0.38 0.23 0.00 -1.26 -4.33 105.19 100.95 1yck n GLY 98 Ca 0.02 -1.66 0.20 0.00 0.00 0.00 0.00 46.02 44.57 1yck n GLY 98 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 1yck h HIS 99 N 0.00 0.05 0.00 1.61 -0.00 -1.99 -0.68 115.15 114.14 1yck h HIS 99 Ca 0.00 0.00 -0.17 0.00 -0.00 0.00 0.00 60.37 60.20 1yck h HIS 99 Cb 0.00 -0.02 -0.03 0.00 -0.00 0.00 0.00 27.41 27.37 1yck h HIS 99 CO 0.00 0.02 -1.09 -0.07 -0.00 0.00 0.00 177.93 176.79 1yck h LEU 100 N 0.04 0.00 0.07 2.43 3.38 -2.00 -3.37 115.31 115.85 1yck h LEU 100 Ca 0.26 0.00 -0.32 0.00 0.09 0.00 0.00 57.88 57.92 1yck h LEU 100 Cb 0.99 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.71 1yck h LEU 100 CO -0.01 0.69 -1.74 -0.50 0.09 0.00 0.00 178.44 176.97 1yck h TRP 101 N 0.00 0.25 -0.63 1.13 4.06 -1.38 -3.39 115.95 115.98 1yck h TRP 101 Ca -0.10 -0.18 0.12 0.00 2.06 0.00 0.00 58.89 60.78 1yck h TRP 101 Cb 1.62 -0.01 -0.12 0.00 -1.00 0.00 0.00 29.16 29.65 1yck h TRP 101 CO 0.00 1.34 -0.29 -0.91 -3.56 0.00 0.00 178.44 175.01 1yck h ASN 102 N 0.04 -1.04 0.55 -3.49 2.35 -1.35 -0.32 115.58 112.33 1yck h ASN 102 Ca -0.31 0.23 0.00 0.00 -0.55 0.00 0.00 56.30 55.66 1yck h ASN 102 Cb 2.01 0.55 0.00 0.00 0.05 0.00 0.00 38.32 40.93 1yck h ASN 102 CO 0.10 -0.29 0.00 -0.81 -1.65 0.00 0.00 177.43 174.79 1yck n PRO 103 N -5.45 0.09 -0.07 0.81 -0.04 -1.26 -3.30 135.00 125.78 1yck n PRO 103 Ca 0.06 0.16 0.06 0.00 -0.04 0.00 0.00 63.50 63.73 1yck n PRO 103 Cb 0.36 -1.50 0.08 0.00 -0.04 0.00 0.00 33.50 32.40 1yck n PRO 103 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1yck n MET 104 N -1.43 1.75 -3.99 0.54 0.00 -0.19 -4.61 117.12 109.19 1yck n MET 104 Ca 0.06 -2.06 -0.08 0.00 0.00 0.00 0.00 57.70 55.62 1yck n MET 104 Cb 0.20 -1.24 -0.09 0.00 0.00 0.00 0.00 33.22 32.08 1yck n MET 104 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 175.97 174.43 1yck s SER 105 N -2.05 0.33 -0.21 3.17 1.04 -0.84 -3.34 113.70 111.80 1yck s SER 105 Ca 0.18 -0.84 -0.11 0.00 0.48 0.00 0.00 55.95 55.67 1yck s SER 105 Cb 0.16 0.25 -0.05 0.00 0.10 0.00 0.00 66.02 66.48 1yck s SER 105 CO 0.02 -0.64 0.18 -0.63 0.98 0.00 0.00 173.24 173.15 1yck s ILE 106 N -3.78 5.36 -0.29 -1.02 -1.09 -0.71 -4.80 121.20 114.87 1yck s ILE 106 Ca 0.05 0.27 -0.10 0.00 -2.23 0.00 0.00 60.65 58.64 1yck s ILE 106 Cb 0.06 -3.52 -0.03 0.00 -1.58 0.00 0.00 42.46 37.39 1yck s ILE 106 CO -0.10 0.39 0.16 -0.83 -1.23 0.00 0.00 174.94 173.33 1yck s GLY 107 N 0.67 1.89 -0.08 6.18 0.00 -1.26 -1.47 107.32 113.25 1yck s GLY 107 Ca 0.10 -1.20 0.02 0.00 0.00 0.00 0.00 44.72 43.63 1yck s GLY 107 CO 0.02 0.65 -0.12 -0.26 0.00 0.00 0.00 173.10 173.39 1yck s ILE 108 N 1.69 3.24 -0.07 0.90 -4.36 -0.90 -1.04 121.20 120.66 1yck s ILE 108 Ca 0.06 -0.64 0.02 0.00 -0.26 0.00 0.00 60.65 59.84 1yck s ILE 108 Cb -0.16 -2.31 0.01 0.00 1.25 0.00 0.00 42.46 41.25 1yck s ILE 108 CO 0.08 0.57 -0.13 -0.55 0.24 0.00 0.00 174.94 175.15 1yck s SER 109 N -0.41 1.86 -0.12 4.36 0.15 -0.69 -1.31 113.70 117.54 1yck s SER 109 Ca 0.05 -0.31 -0.30 0.00 0.70 0.00 0.00 55.95 56.09 1yck s SER 109 Cb -0.12 -0.84 -0.01 0.00 -1.71 0.00 0.00 66.02 63.34 1yck s SER 109 CO 0.02 0.05 1.04 -0.36 1.20 0.00 0.00 173.24 175.19 1yck s PHE 110 N 0.61 3.44 -0.29 3.44 0.40 -0.37 -0.44 117.98 124.76 1yck s PHE 110 Ca -0.14 1.52 -0.29 0.00 -0.60 0.00 0.00 56.93 57.42 1yck s PHE 110 Cb -0.16 -3.23 -0.01 0.00 0.51 0.00 0.00 43.02 40.13 1yck s PHE 110 CO 0.04 -0.42 1.41 -1.64 0.70 0.00 0.00 175.22 175.32 1yck s MET 111 N 2.22 3.84 0.00 0.44 -1.94 -0.39 -1.56 119.30 121.90 1yck s MET 111 Ca 0.49 1.34 0.00 0.00 -1.71 0.00 0.00 55.69 55.81 1yck s MET 111 Cb -0.19 -3.95 0.00 0.00 2.01 0.00 0.00 34.83 32.71 1yck s MET 111 CO 0.17 -1.23 0.00 0.41 -0.01 0.00 0.00 175.02 174.36 1yck n GLY 112 N 4.51 0.92 3.04 -0.03 0.00 -1.15 -4.23 105.19 108.26 1yck n GLY 112 Ca 0.16 -2.00 -0.31 0.00 0.00 0.00 0.00 46.02 43.87 1yck n GLY 112 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1yck s ASN 113 N -2.12 3.10 -0.36 1.61 3.04 -1.24 -0.71 114.94 118.27 1yck s ASN 113 Ca 0.00 -0.69 0.06 0.00 0.04 0.00 0.00 52.86 52.27 1yck s ASN 113 Cb 0.00 -1.30 0.49 0.00 -1.54 0.00 0.00 41.25 38.90 1yck s ASN 113 CO 0.00 -0.07 1.49 -1.22 -3.04 0.00 0.00 177.10 174.25 1yck n TYR 114 N 4.69 1.94 -0.20 0.43 4.02 -1.26 -4.60 117.16 122.18 1yck n TYR 114 Ca -0.17 -2.03 -0.10 0.00 -0.01 0.00 0.00 57.90 55.59 1yck n TYR 114 Cb 0.49 -0.61 0.02 0.00 -0.02 0.00 0.00 39.34 39.21 1yck n TYR 114 CO 0.00 0.00 0.00 0.52 -1.01 0.00 0.00 176.86 176.37 1yck h MET 115 N 1.50 1.06 -0.02 -0.72 2.86 -1.83 -2.23 114.93 115.55 1yck h MET 115 Ca 0.33 -0.38 0.00 0.00 -2.06 0.00 0.00 59.70 57.60 1yck h MET 115 Cb 1.50 -0.07 0.00 0.00 0.06 0.00 0.00 31.60 33.08 1yck h MET 115 CO 0.70 1.08 0.00 -0.25 1.06 0.00 0.00 176.91 179.50 1yck n ASP 116 N -4.15 1.41 -3.52 1.22 8.00 -1.26 -3.01 116.55 115.24 1yck n ASP 116 Ca 0.02 -1.29 -0.11 0.00 0.71 0.00 0.00 54.79 54.12 1yck n ASP 116 Cb 0.39 -0.01 -0.03 0.00 -0.02 0.00 0.00 41.12 41.45 1yck n ASP 116 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1yck s ARG 117 N -0.37 1.25 0.32 -1.24 1.70 -1.26 -5.00 118.95 114.35 1yck s ARG 117 Ca 0.03 -0.58 0.01 0.00 -0.47 0.00 0.00 55.73 54.72 1yck s ARG 117 Cb 0.02 0.55 -0.03 0.00 -0.57 0.00 0.00 34.95 34.92 1yck s ARG 117 CO 0.03 -0.53 0.51 0.14 -1.08 0.00 0.00 175.30 174.37 1yck s VAL 118 N -3.78 5.13 0.77 4.99 -7.23 -1.26 -4.36 120.40 114.66 1yck s VAL 118 Ca 0.02 -0.50 -0.13 0.00 -1.81 0.00 0.00 61.98 59.56 1yck s VAL 118 Cb -0.00 -3.84 0.06 0.00 0.56 0.00 0.00 36.38 33.15 1yck s VAL 118 CO -0.11 -0.48 1.17 -2.84 -0.31 0.00 0.00 175.10 172.52 1yck s PRO 119 N -4.15 1.97 0.76 4.82 0.02 -1.26 -4.98 135.00 132.18 1yck s PRO 119 Ca 0.39 1.61 -0.13 0.00 0.02 0.00 0.00 61.00 62.89 1yck s PRO 119 Cb -0.10 -1.83 0.05 0.00 0.02 0.00 0.00 34.50 32.65 1yck s PRO 119 CO 0.34 -1.93 1.14 0.95 -0.33 0.00 0.00 177.00 177.17 1yck s THR 120 N -2.27 2.76 0.32 0.99 -4.23 -1.26 -4.74 115.64 107.21 1yck s THR 120 Ca 0.70 0.31 0.06 0.00 -1.18 0.00 0.00 61.69 61.58 1yck s THR 120 Cb -0.26 -2.73 0.31 0.00 1.34 0.00 0.00 72.50 71.16 1yck s THR 120 CO 0.49 -0.26 1.84 -0.65 -0.54 0.00 0.00 174.62 175.50 1yck h PRO 121 N -0.72 0.78 0.00 3.99 0.11 -1.97 -0.28 132.00 133.91 1yck h PRO 121 Ca -0.45 -0.05 -0.04 0.00 0.11 0.00 0.00 66.00 65.57 1yck h PRO 121 Cb 1.26 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 1yck h PRO 121 CO 0.50 0.52 -0.19 -0.56 -0.21 0.00 0.00 178.00 178.05 1yck h GLN 122 N 0.80 0.00 -0.24 1.05 -0.00 -1.91 0.06 115.11 114.88 1yck h GLN 122 Ca 0.48 0.00 -0.11 0.00 -0.00 0.00 0.00 58.65 59.02 1yck h GLN 122 Cb 0.67 0.00 -0.00 0.00 -0.00 0.00 0.00 27.48 28.15 1yck h GLN 122 CO -0.25 0.19 -0.30 0.00 -0.00 0.00 0.00 178.83 178.47 1yck h ALA 123 N 1.81 0.36 -0.41 0.06 0.00 -1.27 -2.22 119.26 117.59 1yck h ALA 123 Ca -0.00 -0.41 -0.01 0.00 0.00 0.00 0.00 54.91 54.50 1yck h ALA 123 Cb 0.35 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 1yck h ALA 123 CO 0.02 0.38 0.23 0.82 0.00 0.00 0.00 179.25 180.70 1yck h ILE 124 N 0.32 1.15 -0.85 0.00 1.08 -1.02 -1.41 117.51 116.78 1yck h ILE 124 Ca 0.03 -0.37 0.02 0.00 -0.39 0.00 0.00 64.86 64.15 1yck h ILE 124 Cb 0.87 0.66 -0.05 0.00 -3.07 0.00 0.00 36.82 35.23 1yck h ILE 124 CO 0.07 0.15 0.55 0.03 -0.69 0.00 0.00 178.15 178.27 1yck h ARG 125 N 0.53 1.06 -0.52 2.37 3.08 -1.01 -0.66 114.38 119.25 1yck h ARG 125 Ca 0.14 -0.06 -0.02 0.00 0.07 0.00 0.00 59.98 60.11 1yck h ARG 125 Cb 0.04 -0.24 -0.02 0.00 0.08 0.00 0.00 29.97 29.83 1yck h ARG 125 CO -0.02 0.70 0.24 0.00 -1.07 0.00 0.00 179.97 179.82 1yck h ALA 126 N 1.34 0.67 -0.60 0.04 0.00 -1.02 0.01 119.26 119.69 1yck h ALA 126 Ca 0.33 -0.13 -0.06 0.00 0.00 0.00 0.00 54.91 55.05 1yck h ALA 126 Cb -0.04 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 1yck h ALA 126 CO -0.10 0.24 0.12 0.00 0.00 0.00 0.00 179.25 179.52 1yck h ALA 127 N 1.08 0.80 -0.28 0.00 0.00 -0.79 -1.60 119.26 118.46 1yck h ALA 127 Ca 0.18 -0.24 -0.14 0.00 0.00 0.00 0.00 54.91 54.71 1yck h ALA 127 Cb 0.14 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1yck h ALA 127 CO -0.02 0.53 -0.38 1.96 0.00 0.00 0.00 179.25 181.34 1yck h GLN 128 N 0.89 0.66 -0.67 0.00 4.20 -0.82 -1.99 115.11 117.37 1yck h GLN 128 Ca 0.19 -0.33 -0.01 0.00 0.06 0.00 0.00 58.65 58.56 1yck h GLN 128 Cb 0.39 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.14 1yck h GLN 128 CO 0.01 0.93 0.38 0.78 -0.67 0.00 0.00 178.83 180.25 1yck h GLY 129 N 0.99 1.00 1.00 3.46 0.00 -0.88 -1.29 103.07 107.34 1yck h GLY 129 Ca 0.05 -0.44 -0.00 0.00 0.00 0.00 0.00 47.33 46.94 1yck h GLY 129 CO 0.08 0.43 0.37 -2.00 0.00 0.00 0.00 176.54 175.41 1yck h LEU 130 N 0.92 0.70 -0.43 3.11 5.85 -0.83 0.60 115.31 125.24 1yck h LEU 130 Ca 0.24 -0.05 -0.15 0.00 0.84 0.00 0.00 57.88 58.76 1yck h LEU 130 Cb 0.02 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 40.87 1yck h LEU 130 CO -0.04 0.54 -0.36 -0.07 -0.34 0.00 0.00 178.44 178.18 1yck h LEU 131 N 0.80 0.99 -0.81 2.25 3.38 -1.09 0.62 115.31 121.45 1yck h LEU 131 Ca 0.21 -0.44 0.03 0.00 0.09 0.00 0.00 57.88 57.78 1yck h LEU 131 Cb -0.04 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 40.38 1yck h LEU 131 CO -0.04 1.23 0.52 0.00 0.09 0.00 0.00 178.44 180.24 1yck h ALA 132 N 0.81 1.07 -0.68 1.53 0.00 -0.88 -0.95 119.26 120.17 1yck h ALA 132 Ca 0.07 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 1yck h ALA 132 Cb 0.94 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.43 1yck h ALA 132 CO 0.09 0.34 0.15 0.00 0.00 0.00 0.00 179.25 179.83 1yck h GLY 134 N 1.07 1.08 0.87 0.00 0.00 -0.03 0.31 103.07 106.37 1yck h GLY 134 Ca 0.21 -0.28 -0.11 0.00 0.00 0.00 0.00 47.33 47.14 1yck h GLY 134 CO 0.01 0.16 -0.33 -2.08 0.00 0.00 0.00 176.54 174.29 1yck h VAL 135 N 0.74 1.34 -0.91 4.60 2.07 -0.93 -0.02 116.25 123.14 1yck h VAL 135 Ca 0.33 -1.57 0.04 0.00 0.82 0.00 0.00 66.70 66.32 1yck h VAL 135 Cb 0.23 1.91 -0.05 0.00 -1.52 0.00 0.00 31.29 31.85 1yck h VAL 135 CO -0.20 0.48 0.59 0.00 0.02 0.00 0.00 177.57 178.46 1yck h ALA 136 N 0.58 1.20 -0.02 1.67 0.00 -0.59 -3.11 119.26 118.99 1yck h ALA 136 Ca 0.01 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1yck h ALA 136 Cb 0.93 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1yck h ALA 136 CO 0.07 0.45 -0.12 1.04 0.00 0.00 0.00 179.25 180.69 1yck n GLN 137 N -4.51 1.68 -0.38 0.00 6.02 0.06 -4.96 117.38 115.28 1yck n GLN 137 Ca 0.12 -1.22 0.00 0.00 -0.01 0.00 0.00 57.00 55.89 1yck n GLN 137 Cb 0.09 -1.47 0.00 0.00 1.02 0.00 0.00 30.24 29.88 1yck n GLN 137 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1yck n GLY 138 N 1.30 0.80 0.10 1.08 0.00 -1.03 -4.95 105.19 102.50 1yck n GLY 138 Ca 0.15 -0.07 -0.12 0.00 0.00 0.00 0.00 46.02 45.97 1yck n GLY 138 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yck h ALA 139 N 0.00 0.25 -4.34 4.61 0.00 -1.30 -3.37 119.26 115.11 1yck h ALA 139 Ca 0.00 -0.84 -0.70 0.00 0.00 0.00 0.00 54.91 53.37 1yck h ALA 139 Cb 0.00 -0.04 -0.29 0.00 0.00 0.00 0.00 17.79 17.46 1yck h ALA 139 CO 0.00 1.00 -0.86 -0.51 0.00 0.00 0.00 179.25 178.88 1yck s LEU 140 N -7.17 2.20 0.39 0.00 1.43 -0.82 -0.61 118.68 114.10 1yck s LEU 140 Ca -0.03 -0.42 -0.26 0.00 -1.03 0.00 0.00 54.13 52.39 1yck s LEU 140 Cb 0.08 -1.39 -0.11 0.00 0.03 0.00 0.00 46.19 44.80 1yck s LEU 140 CO 0.86 0.30 1.17 0.54 0.23 0.00 0.00 176.35 179.45 1yck n ARG 141 N 2.56 1.73 -0.04 1.70 1.74 -0.64 -4.36 116.66 119.34 1yck n ARG 141 Ca -0.17 0.61 0.18 0.00 -0.77 0.00 0.00 57.85 57.70 1yck n ARG 141 Cb 0.51 -2.21 0.63 0.00 -1.02 0.00 0.00 32.46 30.37 1yck n ARG 141 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1yck h SER 142 N 1.99 0.13 -0.63 0.55 4.64 -1.92 -0.54 113.55 117.77 1yck h SER 142 Ca -0.46 0.01 -0.29 0.00 -0.47 0.00 0.00 61.79 60.58 1yck h SER 142 Cb 1.31 -0.02 -0.17 0.00 -0.31 0.00 0.00 62.40 63.21 1yck h SER 142 CO 0.59 0.07 0.24 -0.46 -0.87 0.00 0.00 176.83 176.40 1yck n ASN 143 N -4.42 3.39 -4.42 4.97 0.23 -1.26 -5.06 115.26 108.70 1yck n ASN 143 Ca 0.10 -3.58 -0.33 0.00 -0.53 0.00 0.00 54.58 50.24 1yck n ASN 143 Cb 0.54 -0.72 0.11 0.00 -2.08 0.00 0.00 39.78 37.64 1yck n ASN 143 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1yck n TYR 144 N -0.94 -1.41 -3.79 -2.53 0.18 -0.21 -4.97 117.16 103.49 1yck n TYR 144 Ca 0.43 0.24 -0.36 0.00 1.88 0.00 0.00 57.90 60.09 1yck n TYR 144 Cb 1.30 -1.80 -0.10 0.00 -0.38 0.00 0.00 39.34 38.36 1yck n TYR 144 CO 0.00 0.00 0.00 0.08 -2.08 0.00 0.00 176.86 174.86 1yck s VAL 145 N -2.33 4.99 -0.06 -3.48 1.01 0.57 -4.69 120.40 116.42 1yck s VAL 145 Ca 0.58 0.05 -0.21 0.00 0.00 0.00 0.00 61.98 62.40 1yck s VAL 145 Cb -0.23 -3.31 -0.04 0.00 0.00 0.00 0.00 36.38 32.80 1yck s VAL 145 CO 0.66 0.38 0.60 -0.22 0.00 0.00 0.00 175.10 176.52 1yck s LEU 146 N 0.96 4.34 0.08 3.92 2.96 0.33 -1.56 118.68 129.71 1yck s LEU 146 Ca 0.06 1.07 0.07 0.00 -0.22 0.00 0.00 54.13 55.10 1yck s LEU 146 Cb -0.14 -2.91 -0.03 0.00 0.50 0.00 0.00 46.19 43.61 1yck s LEU 146 CO 0.03 -0.00 -0.17 -0.54 -1.32 0.00 0.00 176.35 174.35 1yck s LYS 147 N 0.39 0.96 0.36 1.98 1.02 0.28 -3.84 119.74 120.91 1yck s LYS 147 Ca 0.32 -1.05 -0.14 0.00 0.02 0.00 0.00 55.97 55.13 1yck s LYS 147 Cb -0.17 -1.09 -0.08 0.00 -0.52 0.00 0.00 37.83 35.97 1yck s LYS 147 CO 0.16 0.25 0.76 0.20 -0.92 0.00 0.00 175.35 175.80 1yck s GLY 148 N -1.81 2.18 0.26 -3.33 0.00 -1.26 -1.13 107.32 102.24 1yck s GLY 148 Ca 0.02 -0.03 -0.02 0.00 0.00 0.00 0.00 44.72 44.69 1yck s GLY 148 CO 0.03 0.17 1.73 0.84 0.00 0.00 0.00 173.10 175.88 1yck h HIS 149 N 1.83 0.62 0.00 1.90 2.76 -1.04 0.14 115.15 121.36 1yck h HIS 149 Ca -0.48 0.04 0.00 0.00 -2.20 0.00 0.00 60.37 57.73 1yck h HIS 149 Cb 1.18 -0.15 0.00 0.00 1.55 0.00 0.00 27.41 29.99 1yck h HIS 149 CO 0.61 0.08 0.00 0.07 -1.30 0.00 0.00 177.93 177.39 1yck h ARG 150 N 0.49 0.00 0.00 5.26 0.11 -1.11 -0.91 114.38 118.22 1yck h ARG 150 Ca 0.46 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.54 1yck h ARG 150 Cb 0.72 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.80 1yck h ARG 150 CO -0.42 0.00 0.00 -0.25 0.10 0.00 0.00 179.97 179.40 1yck n ASP 151 N -2.64 0.78 0.00 0.08 8.00 0.50 -4.04 116.55 119.22 1yck n ASP 151 Ca -0.00 0.60 0.00 0.00 0.71 0.00 0.00 54.79 56.10 1yck n ASP 151 Cb 0.16 -0.80 0.00 0.00 -0.02 0.00 0.00 41.12 40.46 1yck n ASP 151 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 1yck n VAL 152 N -2.26 0.00 -4.01 2.53 0.24 -0.70 -5.00 118.33 109.14 1yck n VAL 152 Ca 0.05 -0.25 -0.09 0.00 -2.04 0.00 0.00 64.34 62.01 1yck n VAL 152 Cb 0.38 1.19 -0.08 0.00 -1.47 0.00 0.00 33.84 33.86 1yck n VAL 152 CO 0.00 0.00 0.00 -1.10 -2.14 0.00 0.00 176.83 173.59 1yck s GLN 153 N -0.31 0.94 -0.84 7.34 -1.52 -0.43 -4.91 119.66 119.92 1yck s GLN 153 Ca 0.00 -1.20 -0.24 0.00 -1.95 0.00 0.00 55.36 51.97 1yck s GLN 153 Cb 0.00 0.31 0.06 0.00 -0.22 0.00 0.00 33.01 33.15 1yck s GLN 153 CO 0.00 -0.30 1.27 1.03 -0.25 0.00 0.00 175.29 177.04 1yck s ARG 154 N -3.96 3.36 -0.08 2.91 0.52 -1.26 -4.37 118.95 116.07 1yck s ARG 154 Ca 0.15 -0.81 -0.31 0.00 -0.52 0.00 0.00 55.73 54.23 1yck s ARG 154 Cb 0.05 -4.67 0.12 0.00 0.52 0.00 0.00 34.95 30.97 1yck s ARG 154 CO -0.04 -2.07 1.05 -0.08 0.02 0.00 0.00 175.30 174.18 1yck s THR 155 N 4.85 0.00 -0.84 0.02 -1.32 -1.26 -5.02 115.64 112.07 1yck s THR 155 Ca 0.36 -0.05 0.23 0.00 -1.21 0.00 0.00 61.69 61.03 1yck s THR 155 Cb -0.06 -1.11 -0.08 0.00 -1.51 0.00 0.00 72.50 69.73 1yck s THR 155 CO 0.03 0.00 1.17 0.18 -2.21 0.00 0.00 174.62 173.79 1yck n LEU 156 N -0.21 0.65 -4.60 9.08 7.99 -1.26 -4.44 117.00 124.21 1yck n LEU 156 Ca -0.05 -0.09 -0.44 0.00 -0.01 0.00 0.00 56.01 55.42 1yck n LEU 156 Cb 0.60 -0.14 -0.01 0.00 -0.11 0.00 0.00 43.42 43.75 1yck n LEU 156 CO 0.10 0.11 0.60 -0.24 -1.51 0.00 0.00 177.39 176.45 1yck n SER 157 N -1.70 1.43 -1.47 -1.43 2.88 -1.26 -0.27 113.62 111.80 1yck n SER 157 Ca 0.04 1.18 -0.05 0.00 -1.33 0.00 0.00 58.87 58.70 1yck n SER 157 Cb 0.38 -1.31 0.15 0.00 -0.75 0.00 0.00 64.21 62.68 1yck n SER 157 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1yck n PRO 158 N 0.69 2.30 0.00 -1.46 -0.04 -1.26 -0.70 135.00 134.53 1yck n PRO 158 Ca 0.09 -1.64 0.00 0.00 -0.04 0.00 0.00 63.50 61.91 1yck n PRO 158 Cb 0.33 -1.75 0.00 0.00 -0.04 0.00 0.00 33.50 32.03 1yck n PRO 158 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1yck n GLY 159 N -0.06 1.53 0.29 0.55 0.00 0.63 -4.22 105.19 103.92 1yck n GLY 159 Ca 0.24 -1.53 -0.02 0.00 0.00 0.00 0.00 46.02 44.72 1yck n GLY 159 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1yck h ASN 160 N 0.00 -0.84 -0.13 1.61 -0.26 -1.65 0.17 115.58 114.48 1yck h ASN 160 Ca 0.00 0.22 -0.15 0.00 -0.56 0.00 0.00 56.30 55.81 1yck h ASN 160 Cb 0.00 0.49 0.01 0.00 -1.06 0.00 0.00 38.32 37.75 1yck h ASN 160 CO 0.00 -0.26 -0.50 1.56 -1.06 0.00 0.00 177.43 177.17 1yck h GLN 161 N -0.06 0.57 -0.69 0.81 4.20 -1.31 -1.61 115.11 117.03 1yck h GLN 161 Ca 0.30 -0.44 -0.07 0.00 0.06 0.00 0.00 58.65 58.50 1yck h GLN 161 Cb 0.53 0.08 -0.03 0.00 0.30 0.00 0.00 27.48 28.36 1yck h GLN 161 CO -0.70 1.06 0.17 1.25 -0.67 0.00 0.00 178.83 179.94 1yck h LEU 162 N 0.21 1.05 -0.47 1.46 5.85 -1.38 -1.93 115.31 120.10 1yck h LEU 162 Ca -0.03 -0.23 0.05 0.00 0.84 0.00 0.00 57.88 58.51 1yck h LEU 162 Cb 1.13 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 41.84 1yck h LEU 162 CO 0.11 1.01 0.21 0.22 -0.34 0.00 0.00 178.44 179.65 1yck h TYR 163 N 1.04 0.38 -0.91 1.25 3.20 -0.57 -1.08 116.97 120.29 1yck h TYR 163 Ca 0.22 0.02 0.01 0.00 3.14 0.00 0.00 58.73 62.11 1yck h TYR 163 Cb 0.37 -0.10 -0.04 0.00 1.54 0.00 0.00 36.73 38.49 1yck h TYR 163 CO 0.03 0.17 0.59 0.45 -1.64 0.00 0.00 178.16 177.76 1yck h HIS 164 N 0.42 1.15 0.30 -3.82 3.86 -0.98 -1.66 115.15 114.42 1yck h HIS 164 Ca 0.21 0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.43 1yck h HIS 164 Cb 0.15 -0.39 -0.01 0.00 1.06 0.00 0.00 27.41 28.23 1yck h HIS 164 CO -0.12 0.73 -0.21 1.25 0.86 0.00 0.00 177.93 180.45 1yck h LEU 165 N 1.23 -0.53 -1.40 2.43 5.85 -0.74 -3.07 115.31 119.09 1yck h LEU 165 Ca 0.33 0.04 -0.03 0.00 0.84 0.00 0.00 57.88 59.06 1yck h LEU 165 Cb -0.12 0.16 -0.00 0.00 0.37 0.00 0.00 40.66 41.07 1yck h LEU 165 CO -0.07 -0.33 -0.14 0.16 -0.34 0.00 0.00 178.44 177.72 1yck h ILE 166 N -0.50 0.40 0.00 4.05 -0.00 -0.83 -1.71 117.51 118.92 1yck h ILE 166 Ca -0.03 -0.83 0.00 0.00 -0.00 0.00 0.00 64.86 64.00 1yck h ILE 166 Cb 0.43 1.60 0.00 0.00 -0.00 0.00 0.00 36.82 38.85 1yck h ILE 166 CO 0.01 0.14 0.00 1.56 -0.00 0.00 0.00 178.15 179.86 1yck h GLN 167 N 0.00 0.00 -0.04 0.16 4.20 -1.21 0.17 115.11 118.39 1yck h GLN 167 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1yck h GLN 167 Cb 0.59 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.37 1yck h GLN 167 CO 0.02 0.00 0.00 0.09 -0.67 0.00 0.00 178.83 178.27 1yck n ASN 168 N -2.65 2.95 -4.83 1.46 3.02 -0.64 -4.84 115.26 109.72 1yck n ASN 168 Ca -0.02 -1.97 -0.32 0.00 -0.03 0.00 0.00 54.58 52.25 1yck n ASN 168 Cb 0.06 -0.01 0.02 0.00 -0.61 0.00 0.00 39.78 39.25 1yck n ASN 168 CO 0.00 0.00 0.00 0.26 -2.62 0.00 0.00 177.26 174.90 1yck s TRP 169 N -1.92 3.23 0.61 3.10 0.52 0.05 -4.98 118.94 119.54 1yck s TRP 169 Ca 0.27 1.42 -0.19 0.00 0.02 0.00 0.00 56.10 57.62 1yck s TRP 169 Cb 0.19 -2.87 -0.03 0.00 -1.15 0.00 0.00 33.47 29.62 1yck s TRP 169 CO 0.29 -0.99 1.27 -1.25 0.02 0.00 0.00 176.95 176.29 1yck s PRO 170 N -4.74 2.82 0.00 4.98 0.04 -1.26 -2.29 135.00 134.56 1yck s PRO 170 Ca 0.59 1.99 0.00 0.00 0.04 0.00 0.00 61.00 63.62 1yck s PRO 170 Cb -0.13 -1.95 0.00 0.00 0.04 0.00 0.00 34.50 32.46 1yck s PRO 170 CO 0.48 -1.37 0.00 0.72 0.04 0.00 0.00 177.00 176.87 1yck n HIS 171 N -1.62 0.00 -2.24 0.56 8.25 -1.26 -4.79 115.22 114.12 1yck n HIS 171 Ca 0.14 0.00 -0.38 0.00 -0.26 0.00 0.00 57.72 57.22 1yck n HIS 171 Cb 0.48 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.58 1yck n HIS 171 CO 0.00 0.00 0.00 -0.47 0.64 0.00 0.00 176.34 176.51 1yck s TYR 172 N -2.21 2.98 -0.27 4.41 5.04 -0.97 -0.52 117.35 125.82 1yck s TYR 172 Ca 0.00 1.52 -0.19 0.00 -2.44 0.00 0.00 57.07 55.96 1yck s TYR 172 Cb 0.00 -3.45 0.08 0.00 0.35 0.00 0.00 41.96 38.94 1yck s TYR 172 CO 0.00 -1.51 0.69 -0.98 -1.34 0.00 0.00 175.55 172.41 1yck s ARG 173 N -2.35 0.74 4.19 4.97 1.70 -1.25 -4.90 118.95 122.06 1yck s ARG 173 Ca 0.58 1.12 0.00 0.00 -0.47 0.00 0.00 55.73 56.96 1yck s ARG 173 Cb -0.32 0.23 0.00 0.00 -0.57 0.00 0.00 34.95 34.29 1yck s ARG 173 CO 0.40 -0.13 0.00 0.43 -1.08 0.00 0.00 175.30 174.92 1yck n SER 174 N 3.72 0.00 -0.19 -2.89 7.64 -1.26 -4.96 113.62 115.68 1yck n SER 174 Ca -0.18 0.00 0.15 0.00 1.01 0.00 0.00 58.87 59.85 1yck n SER 174 Cb 0.57 0.00 0.78 0.00 -1.01 0.00 0.00 64.21 64.55 1yck n SER 174 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22