#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1y3k n SER 2 N 0.00 -7.20 -3.55 1.20 7.64 -1.24 -4.74 113.62 105.73 1y3k n SER 2 Ca 0.00 0.52 -0.20 0.00 1.01 0.00 0.00 58.87 60.20 1y3k n SER 2 Cb 0.00 -4.02 -0.08 0.00 -1.01 0.00 0.00 64.21 59.10 1y3k n SER 2 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1y3k s SER 3 N -1.95 1.81 -0.17 6.43 0.15 -0.03 -4.79 113.70 115.15 1y3k s SER 3 Ca 0.21 -1.73 -0.16 0.00 0.70 0.00 0.00 55.95 54.97 1y3k s SER 3 Cb -0.04 0.54 -0.04 0.00 -1.71 0.00 0.00 66.02 64.77 1y3k s SER 3 CO 0.72 -1.03 0.42 -0.54 1.20 0.00 0.00 173.24 174.01 1y3k s LYS 4 N -3.54 4.24 -0.13 5.44 1.02 -1.26 -0.72 119.74 124.79 1y3k s LYS 4 Ca 0.37 0.28 -0.02 0.00 0.02 0.00 0.00 55.97 56.62 1y3k s LYS 4 Cb 0.03 -3.49 -0.03 0.00 -0.52 0.00 0.00 37.83 33.82 1y3k s LYS 4 CO 0.24 0.05 -0.06 0.00 -0.92 0.00 0.00 175.35 174.66 1y3k s TYR 6 N 0.01 3.45 0.03 0.00 1.51 0.07 -1.15 117.35 121.27 1y3k s TYR 6 Ca -0.00 0.73 -0.03 0.00 -1.01 0.00 0.00 57.07 56.75 1y3k s TYR 6 Cb -0.14 -2.14 -0.02 0.00 -0.11 0.00 0.00 41.96 39.55 1y3k s TYR 6 CO 0.03 0.35 0.04 0.42 -1.11 0.00 0.00 175.55 175.27 1y3k s ILE 7 N -1.74 0.14 0.08 2.71 1.01 0.46 -0.34 121.20 123.52 1y3k s ILE 7 Ca 0.44 -1.18 0.06 0.00 0.00 0.00 0.00 60.65 59.98 1y3k s ILE 7 Cb -0.12 -0.84 -0.03 0.00 0.01 0.00 0.00 42.46 41.48 1y3k s ILE 7 CO 0.23 -0.65 -0.17 -1.10 0.00 0.00 0.00 174.94 173.24 1y3k s GLN 8 N -2.54 0.99 -0.08 2.79 -0.21 0.38 -0.01 119.66 120.97 1y3k s GLN 8 Ca -0.06 -1.01 0.01 0.00 0.02 0.00 0.00 55.36 54.32 1y3k s GLN 8 Cb -0.02 -1.11 0.02 0.00 1.00 0.00 0.00 33.01 32.90 1y3k s GLN 8 CO -0.05 0.26 -0.10 0.14 -2.12 0.00 0.00 175.29 173.43 1y3k s VAL 9 N -1.14 1.03 -1.11 1.09 -7.23 -1.26 -0.75 120.40 111.02 1y3k s VAL 9 Ca 0.02 -0.36 -0.19 0.00 -1.81 0.00 0.00 61.98 59.64 1y3k s VAL 9 Cb -0.10 -0.99 -0.06 0.00 0.56 0.00 0.00 36.38 35.80 1y3k s VAL 9 CO 0.03 0.35 1.99 0.35 -0.31 0.00 0.00 175.10 177.50 1y3k n THR 10 N 4.30 2.61 0.00 5.32 -2.24 -0.21 -2.30 114.28 121.76 1y3k n THR 10 Ca -0.19 -2.42 0.00 0.00 -2.27 0.00 0.00 64.05 59.17 1y3k n THR 10 Cb 0.51 -2.38 0.00 0.00 -2.10 0.00 0.00 70.33 66.36 1y3k n THR 10 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1y3k n GLY 11 N 4.74 0.00 0.33 3.38 0.00 -1.26 -4.49 105.19 107.88 1y3k n GLY 11 Ca 0.49 0.00 0.22 0.00 0.00 0.00 0.00 46.02 46.73 1y3k n GLY 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1y3k h MET 12 N 0.00 0.13 0.00 1.61 3.00 -1.85 0.11 114.93 117.93 1y3k h MET 12 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 59.70 59.69 1y3k h MET 12 Cb 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 31.60 31.57 1y3k h MET 12 CO 0.00 0.09 0.24 1.79 0.00 0.00 0.00 176.91 179.03 1y3k h THR 13 N 0.14 0.00 0.00 -0.10 1.35 -1.89 -3.31 112.91 109.10 1y3k h THR 13 Ca 0.69 0.00 -0.13 0.00 -0.55 0.00 0.00 66.41 66.42 1y3k h THR 13 Cb 1.60 0.70 -0.05 0.00 -1.73 0.00 0.00 68.15 68.68 1y3k h THR 13 CO -0.73 0.00 -0.26 0.00 -0.25 0.00 0.00 175.52 174.28 1y3k n ALA 15 N 2.22 0.00 -0.29 0.00 0.00 -1.25 -0.63 120.51 120.56 1y3k n ALA 15 Ca 0.29 0.00 0.34 0.00 0.00 0.00 0.00 53.44 54.08 1y3k n ALA 15 Cb 0.78 0.00 0.74 0.00 0.00 0.00 0.00 19.45 20.96 1y3k n ALA 15 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1y3k h SER 16 N 0.00 0.00 -0.54 0.00 0.02 -1.92 0.36 113.55 111.47 1y3k h SER 16 Ca 0.00 0.00 0.10 0.00 -0.84 0.00 0.00 61.79 61.05 1y3k h SER 16 Cb 0.00 0.00 -0.08 0.00 0.14 0.00 0.00 62.40 62.46 1y3k h SER 16 CO 0.00 0.00 0.07 0.00 -1.14 0.00 0.00 176.83 175.76 1y3k h VAL 18 N 0.20 1.17 -0.91 0.00 2.07 -1.12 -0.75 116.25 116.90 1y3k h VAL 18 Ca 0.27 -0.50 0.08 0.00 0.82 0.00 0.00 66.70 67.38 1y3k h VAL 18 Cb 0.40 1.02 -0.06 0.00 -1.52 0.00 0.00 31.29 31.12 1y3k h VAL 18 CO -0.39 0.17 0.59 0.00 0.02 0.00 0.00 177.57 177.96 1y3k h ALA 19 N 0.96 1.56 0.50 1.67 0.00 -1.35 0.31 119.26 122.92 1y3k h ALA 19 Ca 0.09 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 1y3k h ALA 19 Cb 0.16 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1y3k h ALA 19 CO -0.01 0.27 -0.24 -0.97 0.00 0.00 0.00 179.25 178.30 1y3k h ASN 20 N 0.97 -0.57 -0.53 0.00 -1.24 -0.34 -2.68 115.58 111.19 1y3k h ASN 20 Ca 0.41 -0.03 0.10 0.00 0.71 0.00 0.00 56.30 57.49 1y3k h ASN 20 Cb 0.32 0.15 -0.08 0.00 0.73 0.00 0.00 38.32 39.43 1y3k h ASN 20 CO -0.17 -0.33 0.05 0.40 -1.29 0.00 0.00 177.43 176.09 1y3k h ILE 21 N -0.79 0.62 -0.11 2.57 2.04 -0.18 -0.74 117.51 120.93 1y3k h ILE 21 Ca -0.07 -0.06 0.01 0.00 1.00 0.00 0.00 64.86 65.75 1y3k h ILE 21 Cb 0.57 0.44 -0.02 0.00 -0.74 0.00 0.00 36.82 37.07 1y3k h ILE 21 CO 0.11 0.03 -0.16 -0.33 0.00 0.00 0.00 178.15 177.80 1y3k h GLU 22 N 0.17 -0.12 -0.58 2.37 5.08 -0.32 0.61 114.58 121.78 1y3k h GLU 22 Ca 0.27 0.01 0.11 0.00 -1.00 0.00 0.00 59.36 58.75 1y3k h GLU 22 Cb 0.41 0.03 -0.11 0.00 0.50 0.00 0.00 28.75 29.57 1y3k h GLU 22 CO -0.41 -0.08 -0.29 0.00 -1.00 0.00 0.00 179.01 177.23 1y3k h ARG 23 N -0.12 -0.13 0.01 2.33 2.47 -1.20 0.32 114.38 118.06 1y3k h ARG 23 Ca 0.02 0.01 0.03 0.00 -1.26 0.00 0.00 59.98 58.78 1y3k h ARG 23 Cb 0.18 0.03 -0.05 0.00 -1.65 0.00 0.00 29.97 28.48 1y3k h ARG 23 CO -0.17 -0.08 -0.30 -0.91 0.56 0.00 0.00 179.97 179.07 1y3k h ASN 24 N -0.13 -0.89 -0.58 7.04 2.35 -0.66 -1.86 115.58 120.85 1y3k h ASN 24 Ca 0.25 0.12 0.01 0.00 -0.55 0.00 0.00 56.30 56.13 1y3k h ASN 24 Cb 0.53 0.36 -0.03 0.00 0.05 0.00 0.00 38.32 39.23 1y3k h ASN 24 CO -0.66 -0.37 0.38 -0.07 -1.65 0.00 0.00 177.43 175.06 1y3k h LEU 25 N -0.45 0.64 -0.87 1.61 4.07 -0.35 -3.16 115.31 116.80 1y3k h LEU 25 Ca 0.06 -0.01 0.18 0.00 0.08 0.00 0.00 57.88 58.19 1y3k h LEU 25 Cb 0.54 -0.16 -0.11 0.00 1.08 0.00 0.00 40.66 42.01 1y3k h LEU 25 CO -0.25 0.46 0.42 -0.09 -1.08 0.00 0.00 178.44 177.90 1y3k h ARG 26 N 0.76 0.51 0.00 1.13 1.12 0.47 0.32 114.38 118.69 1y3k h ARG 26 Ca 0.22 -0.03 -0.04 0.00 -1.11 0.00 0.00 59.98 59.02 1y3k h ARG 26 Cb -0.06 -0.11 -0.01 0.00 -0.01 0.00 0.00 29.97 29.78 1y3k h ARG 26 CO -0.06 0.34 -0.17 0.00 -3.11 0.00 0.00 179.97 176.96 1y3k h ARG 27 N 0.52 0.00 -6.87 0.20 3.08 -1.45 -3.46 114.38 106.40 1y3k h ARG 27 Ca 0.51 0.00 -0.50 0.00 0.07 0.00 0.00 59.98 60.06 1y3k h ARG 27 Cb 0.85 0.00 0.03 0.00 0.08 0.00 0.00 29.97 30.93 1y3k h ARG 27 CO -0.44 0.17 0.49 -1.21 -1.07 0.00 0.00 179.97 177.92 1y3k s GLU 28 N -3.92 4.39 -1.24 0.04 0.41 0.10 -4.86 118.70 113.62 1y3k s GLU 28 Ca -0.01 1.82 -0.20 0.00 -0.41 0.00 0.00 54.97 56.17 1y3k s GLU 28 Cb 0.12 -2.95 -0.01 0.00 -1.78 0.00 0.00 34.13 29.50 1y3k s GLU 28 CO 0.61 -0.02 1.85 -1.91 -0.49 0.00 0.00 175.26 175.29 1y3k n GLU 29 N 0.67 2.37 0.00 1.61 2.13 -1.26 -1.01 120.64 125.16 1y3k n GLU 29 Ca 0.01 -2.84 0.00 0.00 0.66 0.00 0.00 57.16 54.99 1y3k n GLU 29 Cb 0.46 -3.60 0.00 0.00 0.27 0.00 0.00 31.44 28.57 1y3k n GLU 29 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1y3k n GLY 30 N 5.54 0.65 3.66 8.31 0.00 -1.26 -3.65 105.19 118.43 1y3k n GLY 30 Ca 0.47 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 46.06 1y3k n GLY 30 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1y3k s ILE 31 N 0.00 4.71 -0.11 -0.61 1.01 -0.18 -1.90 121.20 124.13 1y3k s ILE 31 Ca 0.00 1.98 0.16 0.00 0.00 0.00 0.00 60.65 62.78 1y3k s ILE 31 Cb 0.00 -4.29 -0.22 0.00 0.01 0.00 0.00 42.46 37.96 1y3k s ILE 31 CO 0.00 -0.16 0.53 -1.22 0.00 0.00 0.00 174.94 174.10 1y3k n TYR 32 N 6.20 0.67 -3.69 3.97 4.02 0.06 -4.75 117.16 123.63 1y3k n TYR 32 Ca 0.11 0.24 -0.14 0.00 -0.01 0.00 0.00 57.90 58.09 1y3k n TYR 32 Cb 0.46 -1.08 -0.08 0.00 -0.02 0.00 0.00 39.34 38.62 1y3k n TYR 32 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 1y3k s SER 33 N -5.77 -0.38 0.95 7.72 0.15 -1.08 -4.96 113.70 110.34 1y3k s SER 33 Ca -0.06 0.46 -0.15 0.00 0.70 0.00 0.00 55.95 56.90 1y3k s SER 33 Cb 0.08 0.54 0.18 0.00 -1.71 0.00 0.00 66.02 65.11 1y3k s SER 33 CO 0.83 -0.40 1.28 0.27 1.20 0.00 0.00 173.24 176.41 1y3k s ILE 34 N -0.86 1.97 0.35 6.45 -0.00 -1.26 -0.72 121.20 127.13 1y3k s ILE 34 Ca -0.09 0.00 -0.25 0.00 -0.00 0.00 0.00 60.65 60.31 1y3k s ILE 34 Cb -0.03 -2.95 -0.10 0.00 -0.00 0.00 0.00 42.46 39.37 1y3k s ILE 34 CO 0.05 0.00 0.95 -1.48 -0.00 0.00 0.00 174.94 174.46 1y3k s LEU 35 N -5.93 4.23 -0.29 0.37 -0.00 -1.23 -4.31 118.68 111.52 1y3k s LEU 35 Ca 0.71 1.81 0.03 0.00 -0.00 0.00 0.00 54.13 56.68 1y3k s LEU 35 Cb -0.06 -4.15 0.20 0.00 -0.00 0.00 0.00 46.19 42.18 1y3k s LEU 35 CO 0.53 -0.16 0.62 0.54 -0.00 0.00 0.00 176.35 177.87 1y3k s VAL 36 N -1.76 -0.96 -0.32 1.48 0.11 -1.26 -4.78 120.40 112.91 1y3k s VAL 36 Ca 0.53 0.00 0.17 0.00 -2.93 0.00 0.00 61.98 59.75 1y3k s VAL 36 Cb -0.16 -0.98 0.45 0.00 -1.53 0.00 0.00 36.38 34.16 1y3k s VAL 36 CO 0.21 0.00 1.34 0.00 -3.33 0.00 0.00 175.10 173.32 1y3k n ALA 37 N 5.42 2.68 -0.23 1.54 0.00 -0.67 -4.64 120.51 124.62 1y3k n ALA 37 Ca 0.03 -1.78 0.02 0.00 0.00 0.00 0.00 53.44 51.71 1y3k n ALA 37 Cb 0.53 -0.86 0.12 0.00 0.00 0.00 0.00 19.45 19.24 1y3k n ALA 37 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1y3k h LEU 38 N 1.78 -0.32 -0.21 0.00 6.46 -1.90 0.81 115.31 121.93 1y3k h LEU 38 Ca -0.30 0.17 0.03 0.00 -0.12 0.00 0.00 57.88 57.66 1y3k h LEU 38 Cb 1.28 0.31 -0.03 0.00 -0.73 0.00 0.00 40.66 41.48 1y3k h LEU 38 CO -0.01 -0.14 -0.09 0.23 -0.62 0.00 0.00 178.44 177.82 1y3k n MET 39 N -5.31 -0.05 -0.00 1.25 2.81 -1.26 -0.59 117.12 113.96 1y3k n MET 39 Ca 0.11 0.33 0.01 0.00 -1.81 0.00 0.00 57.70 56.34 1y3k n MET 39 Cb 0.40 -0.49 0.01 0.00 -0.71 0.00 0.00 33.22 32.43 1y3k n MET 39 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1y3k n ALA 40 N -3.88 2.44 -1.87 3.04 0.00 -0.77 -5.03 120.51 114.44 1y3k n ALA 40 Ca 0.02 -0.58 -0.03 0.00 0.00 0.00 0.00 53.44 52.85 1y3k n ALA 40 Cb 0.08 -0.07 0.01 0.00 0.00 0.00 0.00 19.45 19.48 1y3k n ALA 40 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1y3k n GLY 41 N 0.06 0.48 3.29 0.00 0.00 0.24 -5.10 105.19 104.16 1y3k n GLY 41 Ca 0.01 -0.10 -0.18 0.00 0.00 0.00 0.00 46.02 45.75 1y3k n GLY 41 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1y3k s LYS 42 N -3.30 1.63 -0.05 1.61 1.02 0.08 -4.69 119.74 116.05 1y3k s LYS 42 Ca 0.09 -1.94 -0.05 0.00 0.02 0.00 0.00 55.97 54.09 1y3k s LYS 42 Cb -0.01 0.18 0.01 0.00 -0.52 0.00 0.00 37.83 37.49 1y3k s LYS 42 CO 0.15 -0.55 0.14 0.00 -0.92 0.00 0.00 175.35 174.17 1y3k s ALA 43 N -3.60 -0.35 -0.29 5.17 0.00 0.98 -1.66 121.76 122.01 1y3k s ALA 43 Ca 0.38 0.32 -0.03 0.00 0.00 0.00 0.00 51.96 52.63 1y3k s ALA 43 Cb 0.04 -0.19 0.10 0.00 0.00 0.00 0.00 23.12 23.07 1y3k s ALA 43 CO 0.22 -0.09 0.12 -2.00 0.00 0.00 0.00 175.76 174.00 1y3k s GLU 44 N -0.16 0.37 -0.11 0.00 2.12 -1.26 -0.40 118.70 119.25 1y3k s GLU 44 Ca -0.02 -0.70 -0.12 0.00 0.36 0.00 0.00 54.97 54.48 1y3k s GLU 44 Cb -0.02 -1.47 -0.05 0.00 0.26 0.00 0.00 34.13 32.85 1y3k s GLU 44 CO 0.00 -1.00 0.27 0.54 -0.54 0.00 0.00 175.26 174.54 1y3k s VAL 45 N 1.93 5.29 -0.38 3.70 0.11 -0.30 -3.57 120.40 127.19 1y3k s VAL 45 Ca 0.09 0.52 -0.25 0.00 -2.93 0.00 0.00 61.98 59.40 1y3k s VAL 45 Cb -0.16 -3.58 0.02 0.00 -1.53 0.00 0.00 36.38 31.12 1y3k s VAL 45 CO -0.32 0.50 0.91 -0.60 -3.33 0.00 0.00 175.10 172.26 1y3k s ARG 46 N -0.30 3.80 0.26 1.54 3.52 0.10 -0.93 118.95 126.95 1y3k s ARG 46 Ca 0.17 0.51 0.07 0.00 -0.13 0.00 0.00 55.73 56.36 1y3k s ARG 46 Cb -0.14 -3.82 -0.05 0.00 -1.56 0.00 0.00 34.95 29.39 1y3k s ARG 46 CO 0.06 -0.96 -0.09 1.52 -0.81 0.00 0.00 175.30 175.01 1y3k s TYR 47 N 3.46 1.93 -0.48 5.12 1.13 0.10 -0.76 117.35 127.85 1y3k s TYR 47 Ca 0.37 -0.63 0.03 0.00 -1.41 0.00 0.00 57.07 55.43 1y3k s TYR 47 Cb -0.12 -1.03 0.16 0.00 -1.10 0.00 0.00 41.96 39.87 1y3k s TYR 47 CO 0.19 0.34 0.33 1.21 -2.51 0.00 0.00 175.55 175.11 1y3k s ASN 48 N -3.42 2.98 -1.04 -0.18 2.47 -0.80 -0.85 114.94 114.10 1y3k s ASN 48 Ca 0.28 -3.00 -0.21 0.00 0.42 0.00 0.00 52.86 50.34 1y3k s ASN 48 Cb 0.02 -0.86 -0.09 0.00 -1.45 0.00 0.00 41.25 38.87 1y3k s ASN 48 CO 0.11 -0.20 1.94 -0.81 -3.72 0.00 0.00 177.10 174.42 1y3k n PRO 49 N 3.00 1.85 0.10 0.43 -0.04 -1.26 -3.63 135.00 135.46 1y3k n PRO 49 Ca 0.19 -2.30 0.00 0.00 -0.04 0.00 0.00 63.50 61.36 1y3k n PRO 49 Cb 0.40 -3.30 0.00 0.00 -0.04 0.00 0.00 33.50 30.56 1y3k n PRO 49 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1y3k n ALA 50 N 9.88 3.00 0.04 0.55 0.00 -1.26 -4.89 120.51 127.84 1y3k n ALA 50 Ca 0.48 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.90 1y3k n ALA 50 Cb 0.43 0.03 -0.01 0.00 0.00 0.00 0.00 19.45 19.90 1y3k n ALA 50 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1y3k h VAL 51 N 0.00 0.00 0.31 0.00 2.07 -1.84 -3.42 116.25 113.37 1y3k h VAL 51 Ca 0.00 -0.46 -0.02 0.00 0.82 0.00 0.00 66.70 67.04 1y3k h VAL 51 Cb 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 29.77 1y3k h VAL 51 CO 0.00 0.00 -0.15 -0.29 0.02 0.00 0.00 177.57 177.15 1y3k h ILE 52 N -0.62 0.67 -0.81 4.57 2.10 -1.69 -3.50 117.51 118.23 1y3k h ILE 52 Ca -0.02 -0.63 0.00 0.00 1.08 0.00 0.00 64.86 65.30 1y3k h ILE 52 Cb 0.12 0.98 0.00 0.00 -1.09 0.00 0.00 36.82 36.83 1y3k h ILE 52 CO 0.03 0.12 -0.14 0.00 -1.08 0.00 0.00 178.15 177.07 1y3k n GLN 53 N -5.12 -0.80 -0.24 2.19 1.13 -1.26 -4.51 117.38 108.76 1y3k n GLN 53 Ca -0.09 0.67 0.04 0.00 -1.94 0.00 0.00 57.00 55.68 1y3k n GLN 53 Cb 0.27 -0.63 0.17 0.00 0.11 0.00 0.00 30.24 30.15 1y3k n GLN 53 CO 0.00 0.00 0.00 -1.00 -1.44 0.00 0.00 177.06 174.62 1y3k h PRO 54 N 0.50 0.36 -0.85 -1.09 0.13 -1.96 -0.65 132.00 128.43 1y3k h PRO 54 Ca 0.00 -0.02 0.09 0.00 -0.87 0.00 0.00 66.00 65.20 1y3k h PRO 54 Cb 0.00 -0.08 -0.06 0.00 0.13 0.00 0.00 31.00 30.99 1y3k h PRO 54 CO 0.00 0.24 0.55 -1.00 -0.23 0.00 0.00 178.00 177.56 1y3k h PRO 55 N 0.37 0.83 -0.42 1.56 0.13 -2.00 -1.74 132.00 130.73 1y3k h PRO 55 Ca 0.39 -0.05 -0.09 0.00 -0.87 0.00 0.00 66.00 65.38 1y3k h PRO 55 Cb 0.60 -0.19 -0.02 0.00 0.13 0.00 0.00 31.00 31.52 1y3k h PRO 55 CO -0.42 0.55 -0.11 0.52 -0.23 0.00 0.00 178.00 178.31 1y3k h MET 56 N 0.85 0.75 0.03 0.86 2.86 -1.35 0.11 114.93 119.05 1y3k h MET 56 Ca 0.39 -0.25 0.03 0.00 -2.06 0.00 0.00 59.70 57.81 1y3k h MET 56 Cb 0.38 -0.06 -0.04 0.00 0.06 0.00 0.00 31.60 31.93 1y3k h MET 56 CO -0.16 0.83 -0.26 0.82 1.06 0.00 0.00 176.91 179.21 1y3k h ILE 57 N 0.68 0.42 -0.18 -1.22 2.04 -1.20 -0.02 117.51 118.03 1y3k h ILE 57 Ca 0.12 0.00 0.04 0.00 1.00 0.00 0.00 64.86 66.02 1y3k h ILE 57 Cb 0.58 0.42 -0.04 0.00 -0.74 0.00 0.00 36.82 37.03 1y3k h ILE 57 CO 0.04 0.00 -0.08 0.00 0.00 0.00 0.00 178.15 178.10 1y3k h ALA 58 N 0.39 0.07 -0.40 1.87 0.00 -0.61 -2.26 119.26 118.30 1y3k h ALA 58 Ca 0.05 0.07 0.08 0.00 0.00 0.00 0.00 54.91 55.11 1y3k h ALA 58 Cb 0.49 0.20 -0.09 0.00 0.00 0.00 0.00 17.79 18.39 1y3k h ALA 58 CO -0.21 -0.52 -0.34 0.93 0.00 0.00 0.00 179.25 179.11 1y3k h GLU 59 N -0.06 -0.25 -1.00 0.00 4.39 -0.60 -1.13 114.58 115.91 1y3k h GLU 59 Ca 0.10 0.02 0.31 0.00 0.34 0.00 0.00 59.36 60.12 1y3k h GLU 59 Cb 0.21 0.06 -0.14 0.00 -0.10 0.00 0.00 28.75 28.77 1y3k h GLU 59 CO -0.22 -0.17 0.58 0.35 -1.16 0.00 0.00 179.01 178.39 1y3k h PHE 60 N -0.26 0.95 -0.02 4.33 3.04 -0.42 0.17 116.94 124.72 1y3k h PHE 60 Ca 0.17 0.04 -0.03 0.00 3.98 0.00 0.00 57.97 62.13 1y3k h PHE 60 Cb 0.55 -0.26 0.00 0.00 2.56 0.00 0.00 35.95 38.80 1y3k h PHE 60 CO -0.55 -0.13 -0.10 0.82 -2.02 0.00 0.00 178.31 176.33 1y3k h ILE 61 N 0.37 1.49 -0.18 1.41 2.04 -0.93 -3.24 117.51 118.47 1y3k h ILE 61 Ca 0.72 -1.59 0.05 0.00 1.00 0.00 0.00 64.86 65.04 1y3k h ILE 61 Cb 1.59 2.48 -0.01 0.00 -0.74 0.00 0.00 36.82 40.14 1y3k h ILE 61 CO -0.58 0.43 0.16 0.03 0.00 0.00 0.00 178.15 178.19 1y3k h ARG 62 N -0.49 0.00 -0.89 2.37 3.08 0.38 -2.66 114.38 116.17 1y3k h ARG 62 Ca -0.01 0.00 0.24 0.00 0.07 0.00 0.00 59.98 60.29 1y3k h ARG 62 Cb 0.75 0.00 -0.14 0.00 0.08 0.00 0.00 29.97 30.66 1y3k h ARG 62 CO 0.02 0.00 0.29 0.93 -1.07 0.00 0.00 179.97 180.14 1y3k h GLU 63 N 0.00 0.23 -0.90 0.04 4.39 -1.00 0.26 114.58 117.61 1y3k h GLU 63 Ca 0.09 -0.01 -0.09 0.00 0.34 0.00 0.00 59.36 59.68 1y3k h GLU 63 Cb 0.41 -0.05 -0.05 0.00 -0.10 0.00 0.00 28.75 28.96 1y3k h GLU 63 CO -0.00 0.15 0.11 1.47 -1.16 0.00 0.00 179.01 179.58 1y3k n LEU 64 N -5.19 3.59 0.00 1.33 -0.00 -1.00 -4.85 117.00 110.88 1y3k n LEU 64 Ca 0.22 -1.84 0.00 0.00 -0.00 0.00 0.00 56.01 54.39 1y3k n LEU 64 Cb 0.71 -0.60 0.00 0.00 -0.00 0.00 0.00 43.42 43.53 1y3k n LEU 64 CO 0.07 0.54 0.00 0.61 -0.00 0.00 0.00 177.39 178.61 1y3k n GLY 65 N 0.08 0.44 3.74 1.47 0.00 0.92 -5.00 105.19 106.83 1y3k n GLY 65 Ca 0.17 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.79 1y3k n GLY 65 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1y3k s PHE 66 N -1.90 3.71 -1.17 1.61 0.40 -1.25 -4.97 117.98 114.41 1y3k s PHE 66 Ca 0.00 1.48 -0.20 0.00 -0.60 0.00 0.00 56.93 57.61 1y3k s PHE 66 Cb 0.00 -2.86 0.06 0.00 0.51 0.00 0.00 43.02 40.73 1y3k s PHE 66 CO 0.00 0.21 1.60 0.20 0.70 0.00 0.00 175.22 177.94 1y3k s GLY 67 N 0.18 1.47 0.26 4.36 0.00 -1.26 -4.00 107.32 108.33 1y3k s GLY 67 Ca 0.40 -2.62 -0.24 0.00 0.00 0.00 0.00 44.72 42.26 1y3k s GLY 67 CO 0.23 2.71 0.85 0.00 0.00 0.00 0.00 173.10 176.89 1y3k s ALA 68 N 4.57 3.32 -0.01 3.20 0.00 -1.26 -1.04 121.76 130.53 1y3k s ALA 68 Ca 0.50 0.39 0.02 0.00 0.00 0.00 0.00 51.96 52.87 1y3k s ALA 68 Cb 0.02 -3.03 -0.00 0.00 0.00 0.00 0.00 23.12 20.11 1y3k s ALA 68 CO -0.00 0.25 -0.06 -0.08 0.00 0.00 0.00 175.76 175.87 1y3k s THR 69 N -1.48 0.46 -0.02 0.00 -1.32 0.07 -5.00 115.64 108.35 1y3k s THR 69 Ca 0.45 -0.23 0.06 0.00 -1.21 0.00 0.00 61.69 60.77 1y3k s THR 69 Cb -0.19 -0.41 -0.02 0.00 -1.51 0.00 0.00 72.50 70.38 1y3k s THR 69 CO 0.24 0.14 -0.21 0.54 -2.21 0.00 0.00 174.62 173.12 1y3k s VAL 70 N 0.01 1.66 -0.40 5.08 0.11 -1.26 -0.47 120.40 125.12 1y3k s VAL 70 Ca 0.00 -0.90 0.01 0.00 -2.93 0.00 0.00 61.98 58.17 1y3k s VAL 70 Cb -0.04 -1.38 0.13 0.00 -1.53 0.00 0.00 36.38 33.57 1y3k s VAL 70 CO -0.00 0.47 0.22 -0.63 -3.33 0.00 0.00 175.10 171.83 1y3k s ILE 71 N -0.49 0.90 0.14 7.04 1.01 0.54 -4.98 121.20 125.36 1y3k s ILE 71 Ca 0.08 -2.16 -0.31 0.00 0.00 0.00 0.00 60.65 58.26 1y3k s ILE 71 Cb -0.08 -1.64 -0.09 0.00 0.01 0.00 0.00 42.46 40.66 1y3k s ILE 71 CO -0.01 -0.91 1.42 -0.70 0.00 0.00 0.00 174.94 174.74 1y3k s GLU 72 N 0.71 4.30 -0.09 2.79 2.12 -1.26 -0.76 118.70 126.52 1y3k s GLU 72 Ca 0.17 2.15 -0.03 0.00 0.36 0.00 0.00 54.97 57.62 1y3k s GLU 72 Cb -0.24 -3.21 -0.01 0.00 0.26 0.00 0.00 34.13 30.93 1y3k s GLU 72 CO -0.01 -0.46 -0.06 -0.91 -0.54 0.00 0.00 175.26 173.28 1y3k h ASN 73 N 6.57 0.00 -5.03 -1.70 2.35 -1.94 -3.48 115.58 112.35 1y3k h ASN 73 Ca -0.43 0.00 0.30 0.00 -0.55 0.00 0.00 56.30 55.63 1y3k h ASN 73 Cb 1.21 0.00 -0.16 0.00 0.05 0.00 0.00 38.32 39.42 1y3k h ASN 73 CO 0.86 0.44 0.85 -0.51 -1.65 0.00 0.00 177.43 177.43 1y3k s ILE 74 N -1.63 0.00 -1.76 2.81 2.07 -1.26 -5.04 121.20 116.39 1y3k s ILE 74 Ca -0.05 -0.10 0.18 0.00 -1.41 0.00 0.00 60.65 59.27 1y3k s ILE 74 Cb 0.01 -1.52 0.43 0.00 0.13 0.00 0.00 42.46 41.51 1y3k s ILE 74 CO 0.08 0.00 1.51 1.21 -1.91 0.00 0.00 174.94 175.83 1y3k n GLU 75 N -0.29 0.44 0.00 3.50 2.13 -1.26 -4.65 120.64 120.51 1y3k n GLU 75 Ca -0.04 0.05 0.00 0.00 0.66 0.00 0.00 57.16 57.83 1y3k n GLU 75 Cb 0.60 -1.50 0.00 0.00 0.27 0.00 0.00 31.44 30.81 1y3k n GLU 75 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1y3k n GLY 76 N 0.18 1.52 0.00 8.31 0.00 -1.26 0.34 105.19 114.28 1y3k n GLY 76 Ca 0.12 0.46 0.00 0.00 0.00 0.00 0.00 46.02 46.59 1y3k n GLY 76 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86