# AA SS3 SS8 ASA HSEa-u HSEa-d CN13 theta tau phi psi P(3-C) P(3-E) P(3-H) P(8-C) P(8-S) P(8-T) P(8-H) P(8-G) P(8-I) P(8-E) P(8-B) 0 M C C 87.96 8.48 12.28 21.81 113.93 -152.74 -90.40 134.97 99.87 0.08 0.05 99.82 0.07 0.03 0.03 0.00 0.00 0.03 0.01 1 T C C 75.44 4.14 12.52 17.87 113.51 -134.96 -81.93 152.58 74.07 5.05 20.89 70.83 1.00 2.23 20.70 0.78 0.00 1.62 2.83 2 R H H 132.98 5.68 11.59 18.50 96.59 -121.75 -67.69 -37.94 14.38 0.31 85.31 9.30 2.54 3.17 83.94 0.83 0.00 0.12 0.10 3 Q H H 112.58 4.05 13.45 18.69 93.81 53.85 -64.81 -39.51 3.52 0.05 96.43 1.66 0.56 1.33 95.84 0.56 0.00 0.02 0.01 4 E H H 117.93 1.66 16.56 17.46 92.59 50.34 -65.66 -40.38 1.28 0.02 98.70 0.54 0.17 0.54 98.32 0.41 0.00 0.01 0.00 5 E H H 84.09 6.33 16.15 23.69 92.26 50.06 -65.29 -40.25 0.67 0.01 99.32 0.25 0.07 0.30 99.16 0.21 0.00 0.00 0.00 6 L H H 34.73 13.83 14.36 29.09 91.92 51.00 -64.14 -41.66 0.32 0.00 99.68 0.08 0.03 0.16 99.66 0.07 0.00 0.00 0.00 7 A H H 56.38 3.04 21.22 23.79 91.63 50.84 -63.62 -41.48 0.20 0.00 99.80 0.05 0.01 0.10 99.80 0.03 0.00 0.00 0.00 8 A H H 56.84 2.93 21.84 24.03 91.62 49.73 -64.52 -41.27 0.21 0.00 99.79 0.03 0.01 0.13 99.80 0.03 0.00 0.00 0.00 9 A H H 15.78 16.17 16.08 33.00 91.86 51.15 -64.03 -42.16 0.16 0.00 99.84 0.02 0.01 0.09 99.86 0.02 0.00 0.00 0.00 10 R H H 111.00 8.49 21.25 29.99 91.49 51.37 -63.16 -41.67 0.09 0.00 99.91 0.01 0.00 0.05 99.92 0.01 0.00 0.00 0.00 11 A H H 60.39 2.06 23.70 23.84 91.43 49.95 -63.80 -41.55 0.11 0.00 99.89 0.01 0.00 0.07 99.91 0.01 0.00 0.00 0.00 12 A H H 22.97 10.83 18.20 30.56 91.67 50.62 -64.17 -41.67 0.19 0.00 99.81 0.02 0.01 0.10 99.86 0.02 0.00 0.00 0.00 13 L H H 40.55 15.14 17.56 32.81 91.59 51.53 -63.07 -42.44 0.28 0.00 99.72 0.04 0.01 0.14 99.78 0.03 0.00 0.00 0.00 14 H H H 105.59 2.72 21.94 23.84 91.54 49.93 -63.52 -41.79 0.52 0.00 99.48 0.05 0.04 0.32 99.53 0.06 0.00 0.00 0.00 15 D H H 69.80 3.79 19.51 23.54 91.74 49.68 -64.77 -41.07 1.31 0.02 98.68 0.18 0.11 0.89 98.54 0.26 0.01 0.01 0.00 16 L H H 31.08 15.66 13.11 29.17 91.99 50.62 -64.11 -41.35 2.02 0.02 97.96 0.25 0.14 1.55 97.15 0.87 0.01 0.01 0.01 17 M H H 96.59 7.96 16.38 25.24 91.49 50.46 -66.85 -33.35 6.78 0.04 93.18 0.32 0.36 6.22 92.19 0.85 0.03 0.02 0.01 18 T C T 95.34 1.40 18.04 17.73 93.46 47.72 -85.32 -9.40 53.23 0.18 46.59 0.80 2.85 48.54 45.93 1.61 0.08 0.06 0.14 19 G C T 41.63 8.49 11.73 21.33 96.00 -112.49 80.19 9.82 98.10 0.20 1.70 5.23 12.21 80.90 0.92 0.55 0.00 0.11 0.08 20 K C C 146.63 1.76 15.92 17.83 97.19 117.83 -86.37 -14.06 98.45 1.01 0.54 51.57 41.30 5.71 0.12 0.40 0.00 0.64 0.25 21 R C S 108.71 7.15 13.51 22.13 130.51 41.39 -130.82 149.46 92.15 7.60 0.24 42.44 48.20 1.75 0.04 0.20 0.00 6.92 0.45 22 V E E 86.16 7.14 14.12 22.96 121.24 -144.11 -111.45 135.29 32.15 67.77 0.09 29.65 1.67 0.15 0.02 0.05 0.00 68.07 0.39 23 A E E 35.66 11.52 13.05 25.92 126.74 -168.53 -121.31 145.18 2.91 97.07 0.02 2.74 0.13 0.01 0.01 0.00 0.00 97.03 0.07 24 T E E 84.47 5.57 14.38 22.04 123.25 -156.26 -119.80 136.05 0.79 99.20 0.00 0.72 0.03 0.00 0.00 0.00 0.00 99.23 0.01 25 V E E 57.39 8.85 11.09 21.79 128.96 -177.55 -132.13 147.55 1.10 98.88 0.01 0.93 0.07 0.01 0.00 0.00 0.00 98.97 0.02 26 Q E E 125.29 2.98 11.41 16.44 118.15 -145.09 -110.05 128.10 5.23 94.71 0.05 4.37 0.43 0.10 0.01 0.02 0.00 95.00 0.05 27 K E E 104.06 5.42 8.07 15.67 121.96 170.84 -134.08 124.80 12.65 86.96 0.39 7.37 3.38 2.17 0.06 0.33 0.00 86.28 0.42 28 D C T 137.29 0.41 10.72 10.06 93.94 -15.00 51.33 43.09 98.95 0.49 0.56 1.23 7.94 89.75 0.02 0.61 0.00 0.39 0.06 29 G C T 68.89 0.34 9.83 8.96 95.17 -48.52 79.75 2.50 99.33 0.20 0.47 1.45 8.79 89.01 0.02 0.54 0.00 0.16 0.03 30 R E E 146.24 2.10 9.05 13.08 123.61 104.90 -113.52 144.49 12.43 87.51 0.06 9.23 2.76 0.41 0.01 0.05 0.00 87.14 0.40 31 R E E 159.65 3.09 9.76 15.14 117.76 -139.51 -100.75 132.29 4.24 95.75 0.01 3.64 0.20 0.02 0.00 0.00 0.00 96.09 0.05 32 V E E 60.47 8.29 10.26 20.55 124.94 -171.79 -123.02 140.31 1.57 98.43 0.00 1.38 0.05 0.00 0.00 0.00 0.00 98.55 0.01 33 E E E 123.51 3.63 14.71 20.14 119.09 -151.16 -105.80 133.41 0.77 99.23 0.00 0.70 0.02 0.00 0.00 0.00 0.00 99.26 0.01 34 F E E 66.44 13.49 10.92 24.89 129.55 -174.55 -127.16 148.76 3.04 96.95 0.01 2.89 0.11 0.01 0.00 0.00 0.00 96.85 0.14 35 T E E 77.35 4.61 18.51 24.13 123.25 -151.89 -117.19 150.58 30.89 69.01 0.10 26.95 3.04 0.20 0.03 0.06 0.00 69.19 0.53 36 A C C 55.96 11.23 14.13 25.80 113.37 -107.66 -70.99 139.35 69.85 28.73 1.42 53.43 13.85 1.91 0.51 0.86 0.00 28.23 1.22 37 T C C 43.75 12.48 12.73 25.93 121.72 -151.94 -103.09 153.11 94.26 3.83 1.91 74.79 17.77 1.95 1.13 0.71 0.00 2.83 0.81 38 S C C 57.68 3.47 19.53 22.60 120.17 -112.40 -86.28 158.67 93.73 3.48 2.78 83.77 8.72 1.08 2.55 0.44 0.00 1.28 2.17 39 V H H 69.59 11.80 12.33 24.70 92.54 -109.59 -60.26 -37.73 3.26 0.02 96.73 0.81 0.69 1.53 96.43 0.52 0.00 0.00 0.00 40 S H H 71.47 1.65 18.45 18.97 92.05 53.43 -63.68 -40.72 1.99 0.01 98.00 0.34 0.23 1.26 97.56 0.60 0.00 0.00 0.00 41 D H H 70.26 4.47 17.64 22.95 91.94 49.33 -66.03 -39.61 0.93 0.01 99.07 0.23 0.10 0.51 98.61 0.55 0.00 0.00 0.00 42 L H H 19.85 18.37 12.68 31.18 91.71 51.64 -64.32 -42.12 0.33 0.00 99.66 0.07 0.03 0.17 99.61 0.13 0.00 0.00 0.00 43 K H H 106.54 6.49 18.78 26.16 91.35 51.57 -62.90 -41.10 0.18 0.00 99.82 0.03 0.01 0.10 99.83 0.04 0.00 0.00 0.00 44 K H H 126.07 1.58 21.57 21.24 91.96 49.93 -64.71 -41.58 0.15 0.00 99.85 0.02 0.01 0.09 99.86 0.03 0.00 0.00 0.00 45 Y H H 64.60 10.31 18.57 29.84 91.80 49.29 -64.71 -42.54 0.13 0.00 99.87 0.01 0.01 0.08 99.88 0.02 0.00 0.00 0.00 46 I H H 32.51 15.62 16.68 32.56 91.73 50.13 -63.88 -42.42 0.09 0.00 99.91 0.01 0.00 0.05 99.92 0.01 0.00 0.00 0.00 47 A H H 52.29 3.73 20.13 24.06 91.34 50.87 -63.03 -41.33 0.12 0.00 99.88 0.01 0.00 0.07 99.89 0.02 0.00 0.00 0.00 48 E H H 101.82 2.63 20.78 22.66 91.82 49.81 -64.71 -41.04 0.23 0.00 99.77 0.02 0.01 0.14 99.80 0.03 0.00 0.00 0.00 49 L H H 31.57 12.48 15.56 29.29 91.83 50.06 -64.50 -42.18 0.36 0.00 99.64 0.04 0.02 0.22 99.63 0.08 0.00 0.00 0.00 50 E H H 67.69 9.31 15.24 25.74 91.94 50.81 -63.60 -41.02 0.98 0.01 99.01 0.17 0.07 0.61 98.88 0.27 0.00 0.00 0.00 51 V H H 97.09 1.84 16.46 17.84 92.50 49.77 -65.66 -40.29 2.86 0.02 97.13 0.40 0.19 2.05 96.54 0.80 0.00 0.01 0.00 52 Q H H 116.28 3.04 14.82 18.68 92.12 51.52 -68.00 -31.93 8.82 0.03 91.15 0.54 0.48 7.50 90.67 0.78 0.01 0.01 0.01 53 T C T 56.32 9.72 10.95 21.61 95.28 50.30 -86.67 -8.73 58.62 0.14 41.24 1.69 2.99 51.89 41.84 1.43 0.03 0.04 0.10 54 G C T 59.81 1.26 15.09 16.01 97.55 -115.62 76.33 14.47 94.53 0.20 5.27 11.84 6.72 76.00 4.31 0.93 0.00 0.10 0.10 55 M C C 87.94 8.36 8.58 18.19 111.43 131.95 -91.68 122.39 91.96 1.13 6.91 71.42 12.64 7.92 3.46 3.29 0.00 0.54 0.74 56 T C C 103.18 2.46 11.53 15.33 111.28 113.97 -100.63 90.37 87.76 2.65 9.59 58.41 17.71 11.58 3.88 5.73 0.00 1.43 1.28 57 Q C C 125.15 3.24 10.31 15.41 119.16 116.68 -102.70 137.92 86.60 4.92 8.47 54.40 22.55 9.80 2.77 5.71 0.00 2.80 1.96 58 R C C 164.44 3.08 9.71 14.84 116.70 -134.12 -95.30 134.81 87.83 6.85 5.32 63.85 17.33 6.46 1.84 3.63 0.00 4.23 2.66 59 R C C 160.16 3.37 8.35 13.96 117.10 -140.73 -94.67 137.02 89.58 7.62 2.80 71.80 13.02 4.33 1.12 1.76 0.00 4.61 3.36 60 R C C 177.44 1.81 8.94 12.44 115.15 -134.77 -92.93 135.33 92.75 5.97 1.29 66.57 22.50 3.57 0.49 0.84 0.00 3.27 2.75 61 G C C 50.32 2.43 8.67 12.84 123.87 -108.64 -95.62 164.82 95.19 3.23 1.58 58.76 31.38 5.08 0.35 1.36 0.00 1.79 1.27 62 P C C 117.57 1.35 8.45 11.09 110.39 -80.59 -70.08 143.96 89.80 2.64 7.55 50.97 17.52 20.50 1.06 7.44 0.00 1.63 0.88 63 A C C 94.05 1.31 7.10 9.76 111.17 -120.89 -90.49 120.12 85.51 5.49 8.99 41.91 18.17 25.12 1.18 8.60 0.00 3.65 1.36 64 G C C 58.19 1.58 7.55 10.65 115.34 -111.25 -105.25 157.80 81.13 10.58 8.29 44.50 18.80 18.01 1.09 7.80 0.00 8.16 1.63 65 F C C 167.68 1.60 6.53 9.84 115.88 -127.70 -99.83 132.81 72.34 23.07 4.59 56.50 9.28 6.21 1.22 3.53 0.00 19.56 3.69 66 Y C C 178.60 1.68 7.65 11.09 118.38 -162.37 -107.11 134.62 73.77 25.00 1.23 69.50 1.76 2.27 0.43 0.65 0.00 21.51 3.90 67 V C C 108.58 3.71 9.69 15.31 113.35 -152.60 -97.81 125.35 99.29 0.70 0.00 99.39 0.07 0.01 0.00 0.00 0.00 0.50 0.02