# 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 L C C 71.37 13.10 16.74 29.54 113.29 -158.38 -87.44 121.00 99.82 0.18 0.00 99.82 0.05 0.02 0.00 0.00 0.00 0.10 0.01 1 G C C 40.09 6.98 19.05 26.27 105.03 -129.67 73.81 7.25 89.85 9.97 0.18 87.91 1.05 1.22 0.04 0.10 0.00 8.61 1.07 2 L C C 38.71 19.18 11.20 29.19 114.66 134.32 -88.20 127.46 67.67 32.02 0.31 62.25 3.63 0.83 0.06 0.28 0.00 31.52 1.44 3 R C E 125.03 5.93 20.13 26.81 101.13 175.52 -95.20 -30.06 61.30 38.60 0.10 35.33 24.97 0.73 0.01 0.10 0.00 38.49 0.37 4 E E E 64.52 10.19 21.91 32.61 135.01 9.27 -146.73 146.69 10.37 89.52 0.11 8.38 1.45 0.13 0.01 0.09 0.00 89.81 0.14 5 I E E 9.75 24.12 16.72 41.12 122.28 -159.55 -119.29 130.01 1.96 98.03 0.00 1.80 0.05 0.00 0.00 0.00 0.00 98.12 0.02 6 R E E 72.53 10.41 26.62 37.54 119.23 -161.46 -113.11 124.74 0.45 99.55 0.00 0.40 0.01 0.00 0.00 0.00 0.00 99.58 0.01 7 I E E 5.09 25.36 19.33 45.34 119.10 -164.81 -112.13 127.07 0.20 99.80 0.00 0.19 0.00 0.00 0.00 0.00 0.00 99.81 0.00 8 H E E 43.69 12.38 27.63 40.65 115.86 -164.00 -108.78 122.19 0.84 99.16 0.00 0.78 0.02 0.00 0.00 0.00 0.00 99.16 0.04 9 L E E 8.04 23.96 19.74 43.49 124.53 -170.09 -111.05 142.07 21.14 78.85 0.01 19.67 0.70 0.03 0.00 0.01 0.00 79.07 0.50 10 C C C 16.97 15.53 20.47 36.72 113.74 -131.16 -94.29 126.55 87.76 12.18 0.06 87.10 1.20 0.17 0.01 0.04 0.00 10.72 0.75 11 Q C S 80.89 12.38 18.21 30.78 97.62 -157.28 -79.13 -9.08 99.11 0.66 0.23 14.90 54.11 30.20 0.04 0.20 0.00 0.38 0.17 12 R C S 157.87 3.13 18.92 22.50 100.04 62.27 -92.01 -6.89 99.38 0.32 0.31 7.36 65.39 26.71 0.04 0.20 0.00 0.13 0.17 13 S C S 36.59 10.08 12.82 24.40 126.69 76.51 -110.36 152.40 99.32 0.37 0.31 35.17 63.48 0.66 0.11 0.12 0.00 0.08 0.37 14 P H G 105.45 2.53 17.69 20.82 92.65 -112.54 -61.52 -29.99 20.39 0.06 79.55 1.10 1.86 15.79 2.66 78.53 0.00 0.03 0.02 15 G H G 27.45 12.01 16.05 28.75 91.53 62.29 -70.00 -20.28 18.06 0.06 81.89 0.87 1.33 14.55 3.03 80.17 0.00 0.03 0.02 16 S H G 8.09 21.37 12.61 34.24 95.93 55.96 -90.96 -1.67 17.11 0.12 82.77 6.35 2.27 7.27 5.82 78.19 0.00 0.07 0.03 17 Q H H 99.75 6.01 21.59 28.90 92.82 98.08 -60.77 -40.07 4.86 0.01 95.13 0.72 0.58 3.41 93.91 1.36 0.01 0.00 0.00 18 G H H 27.57 7.15 22.91 30.72 92.21 49.46 -62.97 -39.84 2.99 0.00 97.01 0.18 0.22 2.55 96.19 0.86 0.00 0.00 0.00 19 V H H 6.93 23.54 18.46 41.75 92.11 50.39 -65.65 -42.11 0.58 0.00 99.41 0.08 0.04 0.36 99.07 0.44 0.00 0.00 0.00 20 R H H 64.22 16.50 20.90 36.36 91.55 52.60 -62.00 -42.55 0.16 0.00 99.84 0.02 0.01 0.08 99.81 0.08 0.00 0.00 0.00 21 D H H 77.19 2.68 25.21 26.72 91.32 50.05 -63.75 -41.92 0.27 0.00 99.73 0.03 0.01 0.14 99.76 0.05 0.00 0.00 0.00 22 F H H 24.16 14.58 19.75 35.33 91.73 50.60 -63.73 -43.63 0.34 0.00 99.66 0.03 0.02 0.21 99.68 0.06 0.00 0.00 0.00 23 I H H 5.32 24.94 15.73 40.75 91.56 48.95 -63.93 -42.61 0.57 0.00 99.43 0.05 0.03 0.39 99.43 0.10 0.00 0.00 0.00 24 E H H 102.04 7.85 19.72 28.08 92.33 48.91 -66.36 -38.34 1.76 0.00 98.24 0.07 0.07 1.56 97.93 0.37 0.00 0.00 0.00 25 K H H 133.87 1.95 20.97 21.85 98.01 37.39 -84.16 -34.29 12.26 0.00 87.74 0.11 0.27 12.92 85.89 0.80 0.01 0.00 0.00 26 R H H 71.53 12.79 16.87 29.97 104.02 25.65 -109.97 -18.64 33.80 0.02 66.18 0.44 0.85 32.43 65.28 0.97 0.01 0.00 0.01 27 Y H H 20.93 22.50 13.99 35.75 93.08 67.65 -62.98 -43.74 5.94 0.06 94.01 2.09 0.76 2.77 93.26 1.07 0.00 0.02 0.02 28 V H H 67.31 5.54 20.11 26.30 91.98 51.49 -63.13 -41.58 1.13 0.00 98.87 0.30 0.10 0.58 98.58 0.44 0.00 0.00 0.00 29 E H H 101.96 2.59 22.08 23.67 92.03 49.71 -64.75 -40.65 0.49 0.00 99.51 0.10 0.03 0.27 99.21 0.38 0.00 0.00 0.00 30 L H H 13.78 17.98 14.51 33.07 92.23 50.12 -65.14 -41.62 0.27 0.00 99.73 0.04 0.02 0.16 99.50 0.29 0.00 0.00 0.00 31 K H H 72.16 13.88 14.33 28.16 91.67 52.68 -64.60 -36.28 0.76 0.00 99.23 0.08 0.05 0.55 98.95 0.38 0.00 0.00 0.00 32 K H H 155.88 1.11 17.92 17.85 92.50 51.00 -67.07 -35.91 3.78 0.00 96.21 0.10 0.16 3.45 95.94 0.34 0.00 0.00 0.00 33 A H H 67.94 4.03 15.64 20.49 95.29 43.40 -78.04 -30.14 8.22 0.02 91.77 0.24 0.96 6.84 91.73 0.21 0.01 0.00 0.01 34 N C C 41.72 12.41 10.80 24.21 113.91 21.30 -135.89 81.06 99.87 0.08 0.05 89.48 10.18 0.18 0.03 0.01 0.00 0.02 0.10 35 P C T 94.43 4.96 13.00 20.47 92.77 175.52 -65.35 -19.76 99.72 0.04 0.24 0.96 2.82 95.98 0.02 0.18 0.00 0.02 0.01 36 D C T 121.66 1.17 17.76 18.03 92.40 60.59 -85.40 -4.84 99.79 0.04 0.17 0.55 3.73 95.54 0.01 0.14 0.00 0.03 0.01 37 L C S 21.30 20.22 9.61 29.28 115.43 101.92 -83.40 131.99 99.36 0.62 0.02 21.59 77.85 0.15 0.00 0.01 0.00 0.29 0.11 38 P C C 68.94 4.91 23.64 28.52 113.00 -120.01 -70.30 139.30 96.06 3.94 0.00 95.34 0.99 0.03 0.00 0.00 0.00 3.49 0.15 39 I E E 29.88 23.39 11.99 34.56 121.68 -157.53 -116.14 130.06 8.08 91.92 0.00 7.74 0.27 0.01 0.00 0.00 0.00 91.49 0.50 40 L E E 67.89 7.11 23.92 31.45 119.11 -164.43 -111.64 129.91 0.60 99.40 0.00 0.57 0.01 0.00 0.00 0.00 0.00 99.41 0.01 41 I E E 60.96 19.09 14.71 32.68 120.80 -159.33 -113.29 129.62 0.37 99.63 0.00 0.37 0.00 0.00 0.00 0.00 0.00 99.62 0.01 42 R E E 104.45 6.45 20.93 28.50 129.49 176.58 -132.77 144.38 0.63 99.37 0.00 0.64 0.01 0.00 0.00 0.00 0.00 99.33 0.02 43 E E E 108.16 8.82 17.12 27.02 115.12 -124.39 -81.10 134.65 5.38 94.61 0.01 5.24 0.14 0.01 0.00 0.00 0.00 94.38 0.23 44 C C C 27.92 16.57 10.83 27.22 119.85 -167.54 -120.43 131.25 78.30 21.55 0.15 77.25 0.96 0.20 0.02 0.11 0.00 20.77 0.69 45 S C T 82.77 2.67 15.80 19.42 105.15 -159.28 -94.02 27.95 93.33 5.93 0.74 29.34 28.83 35.56 0.07 0.84 0.00 4.61 0.76 46 D C S 120.56 1.56 16.90 18.03 99.22 20.14 -84.05 17.14 97.20 2.38 0.43 13.49 45.67 38.13 0.02 0.54 0.00 1.82 0.33 47 V C C 45.02 14.30 12.19 26.92 120.40 108.74 -104.12 136.07 94.53 5.30 0.17 74.03 20.22 0.67 0.04 0.15 0.00 2.89 2.00 48 Q C C 88.35 7.24 22.53 30.06 117.85 -140.17 -95.75 140.37 97.11 2.86 0.03 87.18 9.94 0.25 0.00 0.03 0.00 2.28 0.33 49 P C C 15.20 21.68 15.80 37.48 114.35 -102.40 -68.92 143.44 92.66 7.33 0.02 79.96 12.06 0.23 0.00 0.02 0.00 7.47 0.26 50 K E E 65.79 11.30 25.23 36.79 132.97 -170.37 -135.29 146.32 2.48 97.52 0.00 2.34 0.10 0.00 0.00 0.00 0.00 97.36 0.20 51 L E E 6.15 24.79 18.16 43.55 120.88 -149.85 -111.30 132.21 0.30 99.70 0.00 0.29 0.01 0.00 0.00 0.00 0.00 99.69 0.00 52 W E E 59.10 10.93 25.86 37.53 123.28 -166.81 -117.64 134.82 0.06 99.94 0.00 0.06 0.00 0.00 0.00 0.00 0.00 99.94 0.00 53 A E E 4.77 23.22 16.68 40.20 131.76 -175.27 -131.12 149.69 0.06 99.94 0.00 0.05 0.00 0.00 0.00 0.00 0.00 99.95 0.00 54 R E E 81.49 8.11 22.60 31.59 116.58 -137.77 -104.77 126.05 0.19 99.81 0.00 0.18 0.00 0.00 0.00 0.00 0.00 99.81 0.01 55 Y C C 29.01 16.88 12.52 29.86 124.99 -155.92 -94.39 165.95 50.53 49.38 0.08 50.64 0.43 0.08 0.01 0.04 0.00 48.18 0.62 56 A C T 67.09 6.96 14.33 22.57 92.60 -96.89 -63.04 -25.61 97.51 0.63 1.86 0.30 2.79 94.68 0.02 1.78 0.00 0.37 0.06 57 F C T 148.91 2.23 13.89 16.60 95.62 53.79 -89.15 4.00 97.80 0.09 2.11 0.20 2.16 95.46 0.03 2.08 0.00 0.04 0.02 58 G C S 47.06 3.73 13.44 18.46 102.11 -95.53 92.87 2.12 98.38 0.46 1.16 16.91 77.03 4.54 0.12 0.96 0.00 0.26 0.18 59 Q C C 106.63 3.16 14.70 19.27 117.23 133.70 -79.80 142.75 96.09 3.89 0.02 96.09 0.57 0.05 0.01 0.01 0.00 2.96 0.32 60 E E E 103.95 10.83 12.08 24.00 123.21 -151.66 -113.50 138.85 1.81 98.18 0.00 1.71 0.06 0.00 0.00 0.00 0.00 98.04 0.19 61 T E E 53.03 8.86 17.35 27.71 130.95 -176.08 -132.66 147.95 0.34 99.66 0.00 0.28 0.01 0.00 0.00 0.00 0.00 99.71 0.00 62 N E E 85.44 11.46 16.10 28.53 124.24 -154.21 -121.02 136.15 0.49 99.51 0.00 0.40 0.02 0.00 0.00 0.00 0.00 99.57 0.00 63 V E E 30.96 14.32 17.22 32.69 123.54 -173.23 -128.78 130.05 1.32 98.68 0.00 1.20 0.04 0.00 0.00 0.00 0.00 98.73 0.03 64 P E E 69.42 6.37 22.60 29.38 113.04 -116.01 -70.31 136.54 6.74 93.25 0.01 6.42 0.22 0.02 0.00 0.00 0.00 93.08 0.24 65 L C C 8.30 24.48 12.60 37.56 98.97 -163.86 -96.77 -1.84 85.65 6.34 8.01 72.32 5.46 6.94 0.70 8.50 0.00 5.05 1.04 66 N C T 79.26 9.64 17.99 28.29 112.19 112.03 -70.77 132.37 93.69 0.92 5.39 3.45 8.36 81.19 0.26 5.83 0.00 0.57 0.34 67 N C T 128.68 1.73 20.01 21.12 94.05 10.56 66.45 21.51 94.81 0.40 4.79 4.31 9.95 79.54 0.20 5.62 0.00 0.24 0.13 68 F C C 43.29 16.51 10.45 27.00 121.77 130.10 -92.82 145.94 97.59 2.19 0.22 68.81 28.60 0.28 0.09 0.11 0.00 0.70 1.40 69 S C C 53.45 2.90 22.59 24.32 121.42 -122.65 -79.50 161.12 98.10 1.76 0.14 97.51 0.74 0.06 0.09 0.02 0.00 0.31 1.28 70 A H H 36.81 17.07 13.09 29.84 91.46 -107.48 -57.69 -38.93 1.34 0.00 98.66 0.16 0.16 0.84 98.48 0.35 0.00 0.00 0.00 71 D H H 104.09 1.76 20.47 21.53 91.30 53.29 -63.89 -39.77 0.69 0.00 99.31 0.07 0.05 0.46 99.04 0.38 0.00 0.00 0.00 72 Q H H 82.85 5.34 20.37 26.22 91.83 48.90 -66.38 -40.03 0.30 0.00 99.70 0.06 0.02 0.17 99.38 0.36 0.00 0.00 0.00 73 V H H 4.55 23.93 14.69 38.91 91.74 50.35 -63.68 -44.29 0.26 0.00 99.74 0.07 0.02 0.12 99.71 0.07 0.00 0.00 0.00 74 T H H 37.97 12.89 19.96 33.21 91.46 50.67 -62.64 -42.53 0.43 0.00 99.57 0.11 0.03 0.22 99.59 0.04 0.00 0.00 0.00 75 R H H 139.66 1.72 24.44 24.20 91.77 50.15 -64.02 -41.48 0.57 0.00 99.42 0.14 0.05 0.32 99.44 0.05 0.00 0.00 0.00 76 A H H 18.84 12.37 18.97 32.62 91.78 50.05 -64.18 -42.16 0.74 0.01 99.26 0.20 0.08 0.40 99.24 0.08 0.00 0.00 0.00 77 L H H 9.72 23.36 15.50 38.77 91.96 50.49 -64.58 -42.18 1.05 0.01 98.94 0.26 0.12 0.61 98.83 0.16 0.00 0.00 0.01 78 E H H 99.91 6.24 19.23 26.25 91.55 51.55 -63.14 -39.78 2.68 0.03 97.28 0.54 0.28 1.74 96.96 0.44 0.01 0.01 0.02 79 N H H 103.27 2.07 19.68 21.02 92.32 50.87 -66.84 -36.80 8.17 0.02 91.80 0.67 0.46 6.52 91.48 0.84 0.00 0.01 0.01 80 V H H 38.65 14.97 13.75 28.79 93.58 51.45 -70.25 -34.50 14.29 0.09 85.62 2.24 1.32 10.29 85.04 1.01 0.02 0.03 0.06 81 L H H 63.37 13.13 12.01 25.15 97.01 52.66 -80.96 -14.96 39.47 0.67 59.85 19.30 1.86 17.61 59.53 0.98 0.00 0.18 0.53 82 S C C 78.64 3.23 15.10 19.45 102.71 86.48 -78.26 19.90 99.92 0.03 0.05 99.60 0.13 0.22 0.04 0.00 0.00 0.01 0.00