# 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 A C C 35.53 12.37 21.90 33.96 118.84 -162.94 -99.23 136.01 99.65 0.34 0.00 99.67 0.07 0.01 0.00 0.00 0.00 0.24 0.01 1 V E E 14.66 22.04 15.55 37.22 123.47 -154.76 -116.39 136.32 19.27 80.70 0.03 19.51 0.29 0.03 0.01 0.01 0.00 79.63 0.53 2 K E E 82.74 8.68 24.80 33.71 120.07 -158.22 -111.13 132.00 5.98 94.01 0.01 5.20 0.47 0.04 0.00 0.01 0.00 94.18 0.10 3 I E E 7.87 24.82 16.48 41.71 120.25 -160.52 -110.31 130.65 1.92 98.07 0.01 1.74 0.09 0.01 0.00 0.00 0.00 98.13 0.03 4 K E E 65.91 9.83 26.40 36.60 123.99 -169.94 -118.90 135.94 0.93 99.07 0.00 0.84 0.03 0.00 0.00 0.00 0.00 99.11 0.01 5 L E E 14.14 23.50 17.45 40.70 121.56 -154.16 -108.33 134.79 0.98 99.02 0.00 0.89 0.02 0.00 0.00 0.00 0.00 99.08 0.01 6 T E E 38.20 10.90 23.59 34.97 129.96 -174.24 -128.74 147.17 0.52 99.48 0.00 0.47 0.02 0.00 0.00 0.00 0.00 99.50 0.00 7 R E E 95.44 14.45 18.36 32.26 114.79 -122.78 -85.55 130.96 1.21 98.79 0.00 1.12 0.03 0.00 0.00 0.00 0.00 98.81 0.03 8 L E E 51.17 12.55 17.13 30.34 124.66 -176.28 -121.90 148.23 14.05 85.92 0.03 12.30 1.10 0.10 0.01 0.02 0.00 86.24 0.24 9 G E E 31.15 5.18 17.29 23.84 134.37 15.52 124.62 -169.83 41.71 58.20 0.09 26.98 14.50 1.03 0.01 0.09 0.00 56.78 0.60 10 K C C 124.50 3.38 16.34 20.61 124.09 -52.12 -109.35 152.74 61.52 38.15 0.33 46.60 13.43 1.66 0.07 0.34 0.00 34.56 3.34 11 I C T 105.74 8.16 11.06 20.26 98.84 -103.13 -63.63 -34.51 96.04 2.44 1.52 4.27 45.59 46.44 0.07 1.45 0.00 1.79 0.39 12 R C T 185.51 1.27 15.38 16.20 95.76 31.65 -75.53 -12.71 97.47 0.92 1.61 4.11 44.22 49.15 0.06 1.63 0.00 0.62 0.20 13 N C S 81.15 5.39 15.04 21.79 112.49 35.86 -128.00 80.18 74.90 24.43 0.68 18.66 49.79 6.34 0.05 0.73 0.00 23.00 1.42 14 P C C 30.81 16.21 13.01 29.71 116.26 -166.54 -70.46 144.32 60.49 39.45 0.06 55.84 1.88 0.23 0.01 0.05 0.00 41.65 0.34 15 Q E E 47.72 11.45 21.58 33.87 127.13 -167.55 -121.68 144.30 4.61 95.38 0.00 4.00 0.31 0.02 0.00 0.00 0.00 95.53 0.14 16 Y E E 25.93 21.11 18.84 39.39 126.42 -158.14 -117.74 142.95 0.40 99.60 0.00 0.35 0.01 0.00 0.00 0.00 0.00 99.63 0.01 17 R E E 52.25 14.59 26.11 40.36 132.01 -175.09 -131.93 147.98 0.14 99.86 0.00 0.12 0.00 0.00 0.00 0.00 0.00 99.87 0.00 18 I E E 5.08 24.58 21.74 46.65 118.52 -142.44 -107.94 130.04 0.06 99.94 0.00 0.05 0.00 0.00 0.00 0.00 0.00 99.94 0.00 19 I E E 13.83 18.57 26.56 44.77 125.11 -169.57 -119.42 138.88 0.08 99.92 0.00 0.08 0.00 0.00 0.00 0.00 0.00 99.92 0.00 20 V E E 8.47 22.31 24.07 46.04 118.59 -153.10 -107.29 128.35 0.45 99.55 0.00 0.40 0.01 0.00 0.00 0.00 0.00 99.58 0.01 21 A E E 8.37 17.47 20.89 38.99 135.33 173.85 -134.06 157.59 5.16 94.83 0.01 4.78 0.21 0.01 0.01 0.00 0.00 94.75 0.25 22 D E E 38.04 9.96 20.79 31.88 114.11 -101.80 -70.61 145.30 31.17 68.58 0.25 28.47 2.21 0.23 0.09 0.13 0.00 67.89 0.98 23 A C T 46.84 12.63 14.66 27.94 92.27 -116.33 -62.21 -29.59 69.38 1.20 29.42 3.94 17.32 49.89 10.92 16.38 0.18 0.79 0.59 24 R C T 168.75 1.67 18.35 19.40 93.53 58.61 -76.46 -21.22 68.30 0.97 30.73 4.71 18.06 47.08 10.83 17.99 0.16 0.55 0.61 25 T C C 53.33 8.93 12.89 23.09 104.78 48.25 -99.31 25.42 60.98 6.59 32.42 24.73 21.32 16.62 12.22 18.68 0.11 3.36 2.96 26 R C C 98.13 13.05 11.76 24.46 98.42 116.85 -68.93 -31.18 72.94 5.50 21.57 52.70 7.88 12.18 11.55 9.82 0.01 2.89 2.95 27 R C T 151.71 4.63 14.53 20.61 95.57 59.46 -68.75 -25.84 73.93 2.53 23.54 12.21 12.97 48.52 9.57 13.80 0.07 1.39 1.47 28 D C T 107.06 2.41 16.22 18.85 97.14 43.66 -89.16 1.46 79.27 0.68 20.05 5.60 12.35 61.28 7.12 12.73 0.03 0.36 0.54 29 G C S 33.00 11.63 13.27 25.18 97.80 -99.68 85.28 5.90 89.35 2.55 8.09 28.03 37.96 23.74 1.52 6.34 0.00 1.40 1.00 30 R C C 120.28 5.54 19.56 26.07 114.55 140.13 -85.23 133.95 88.35 10.76 0.89 73.53 11.57 2.99 0.22 0.79 0.00 8.84 2.05 31 A E C 33.54 17.57 13.99 30.82 114.13 -124.65 -77.57 135.36 49.75 50.05 0.20 47.14 2.00 0.27 0.07 0.14 0.00 46.69 3.70 32 I E E 66.43 11.84 19.30 31.32 100.87 -171.48 -92.78 -33.01 43.35 56.57 0.08 24.41 18.96 0.45 0.01 0.06 0.00 55.85 0.26 33 E E E 72.44 9.47 22.23 31.99 137.83 -3.61 -147.92 148.84 4.46 95.47 0.07 3.58 0.68 0.07 0.01 0.04 0.00 95.55 0.06 34 V E E 66.32 14.18 19.81 33.38 111.76 -125.79 -86.95 122.49 0.91 99.07 0.01 0.96 0.03 0.00 0.00 0.01 0.00 98.96 0.04 35 I E E 17.42 19.97 18.78 38.97 100.49 176.03 -98.85 -22.99 2.07 97.91 0.02 1.47 0.49 0.08 0.00 0.01 0.00 97.92 0.03 36 G E E 7.05 14.10 22.35 37.36 145.50 -44.07 166.48 177.13 2.47 97.52 0.01 1.46 0.77 0.10 0.00 0.01 0.00 97.64 0.02 37 R E E 88.47 12.12 23.07 35.47 132.81 -105.31 -133.97 149.15 3.32 96.67 0.01 3.01 0.23 0.02 0.00 0.01 0.00 96.60 0.13 38 Y E E 32.52 19.43 16.16 35.73 121.52 -147.78 -112.65 134.69 10.31 89.66 0.03 9.39 0.83 0.06 0.02 0.02 0.00 86.93 2.76 39 H C C 61.89 8.35 19.24 29.11 111.61 -160.95 -115.09 111.14 80.54 19.42 0.04 77.62 2.19 0.14 0.01 0.03 0.00 19.40 0.61 40 P C T 54.61 13.04 12.52 26.35 94.71 -161.03 -65.26 -22.99 92.38 3.14 4.48 17.52 25.25 48.75 0.19 5.27 0.00 2.59 0.43 41 K C T 155.86 1.58 14.86 16.39 97.12 56.85 -82.13 -13.15 95.09 0.83 4.09 8.32 34.85 51.21 0.18 4.66 0.00 0.51 0.28 42 E C S 116.06 3.64 12.16 17.36 118.25 55.28 -107.73 141.82 92.59 1.92 5.49 26.52 44.19 21.04 0.36 6.06 0.00 1.05 0.78 43 E C C 132.29 3.55 12.97 18.12 112.35 -98.60 -83.94 126.61 95.70 2.92 1.39 59.48 29.44 6.71 0.18 1.49 0.00 1.87 0.83 44 P C T 78.07 7.35 12.63 21.16 103.83 47.27 -70.87 79.13 93.86 2.73 3.41 20.97 22.75 49.41 0.19 4.19 0.00 2.17 0.32 45 S C T 58.27 8.00 14.54 23.50 106.98 91.87 -86.43 79.27 83.80 11.98 4.22 31.39 14.42 37.34 0.25 4.92 0.00 10.99 0.69 46 L C C 71.78 10.77 15.96 27.41 115.88 108.85 -96.71 133.48 55.30 42.78 1.92 45.59 7.63 1.99 0.32 1.77 0.00 41.18 1.51 47 I E E 32.31 18.55 15.04 33.23 121.75 -161.60 -114.08 132.54 17.80 81.99 0.21 16.04 1.43 0.21 0.09 0.12 0.00 80.50 1.61 48 Q E E 101.05 6.50 23.58 31.10 120.81 -155.50 -109.14 133.92 9.96 89.91 0.13 9.07 0.86 0.15 0.07 0.06 0.00 88.28 1.51 49 I E E 14.94 23.69 12.40 35.93 121.41 -157.17 -109.61 134.49 28.67 71.23 0.10 27.75 0.99 0.07 0.06 0.05 0.00 68.57 2.50 50 D C C 69.72 6.05 21.90 28.41 106.83 -129.38 -85.34 109.97 86.69 13.15 0.16 86.31 0.91 0.08 0.08 0.04 0.00 12.06 0.51 51 S H H 43.19 15.16 14.16 29.16 94.36 -164.55 -64.55 -35.15 3.84 0.01 96.15 1.08 0.55 1.92 95.81 0.64 0.00 0.00 0.00 52 E H H 132.86 1.64 21.80 22.23 91.69 54.90 -63.67 -40.29 1.13 0.00 98.87 0.13 0.08 0.79 98.51 0.48 0.00 0.00 0.00 53 R H H 82.77 10.42 19.70 30.50 92.10 48.89 -66.12 -40.28 0.34 0.00 99.66 0.05 0.02 0.21 99.34 0.38 0.00 0.00 0.00 54 A H H 2.62 25.16 14.18 39.77 91.16 51.41 -63.41 -42.82 0.13 0.00 99.87 0.02 0.01 0.07 99.82 0.08 0.00 0.00 0.00 55 Q H H 84.62 9.17 22.06 31.36 91.43 52.04 -63.06 -41.45 0.14 0.00 99.86 0.01 0.00 0.09 99.82 0.07 0.00 0.00 0.00 56 Y H H 113.89 4.05 23.97 27.73 91.73 50.61 -63.91 -42.57 0.19 0.00 99.80 0.01 0.01 0.15 99.73 0.10 0.00 0.00 0.00 57 W H H 24.87 19.29 18.93 38.00 92.04 49.23 -64.93 -42.49 0.45 0.00 99.55 0.03 0.02 0.36 99.32 0.27 0.00 0.00 0.00 58 L H H 25.33 20.49 17.18 36.88 91.95 50.47 -64.78 -38.17 1.57 0.00 98.43 0.06 0.06 1.49 97.59 0.80 0.00 0.00 0.00 59 G H H 48.09 4.65 21.00 26.52 90.69 57.52 -68.02 -23.79 13.33 0.01 86.65 0.23 0.37 13.41 84.99 0.96 0.02 0.00 0.01 60 V C T 72.44 8.83 18.36 27.86 94.94 54.78 -89.41 -0.39 79.24 0.04 20.72 0.33 1.64 76.63 20.47 0.88 0.00 0.01 0.04 61 G C T 38.60 7.30 21.72 29.26 100.67 -95.17 95.30 6.55 94.53 0.04 5.43 2.27 2.58 89.07 5.84 0.21 0.00 0.01 0.02 62 A C C 13.02 21.76 12.84 34.30 116.82 149.98 -73.44 144.04 98.43 1.49 0.08 95.85 2.47 0.24 0.03 0.03 0.00 0.80 0.57 63 Q C C 113.26 4.53 25.21 30.68 115.29 -140.44 -101.02 126.98 91.05 8.93 0.02 89.54 2.41 0.06 0.01 0.01 0.00 6.30 1.67 64 P C C 25.59 22.51 13.24 35.01 116.58 -117.17 -69.04 147.34 85.61 14.37 0.03 87.22 0.79 0.04 0.01 0.01 0.00 7.47 4.47 65 T C C 42.16 10.74 18.79 30.24 121.85 -121.91 -79.20 163.85 98.33 1.61 0.06 98.02 0.63 0.02 0.03 0.01 0.00 0.52 0.76 66 E H H 138.52 2.69 19.47 23.07 90.94 -101.14 -58.92 -37.33 0.75 0.00 99.25 0.09 0.10 0.39 99.33 0.08 0.00 0.00 0.00 67 P H H 52.96 9.10 19.81 29.67 91.41 53.11 -64.00 -39.38 0.33 0.00 99.67 0.03 0.02 0.22 99.64 0.10 0.00 0.00 0.00 68 V H H 4.02 24.78 16.50 41.56 91.62 48.56 -64.90 -42.28 0.07 0.00 99.93 0.01 0.00 0.04 99.90 0.05 0.00 0.00 0.00 69 L H H 39.73 15.58 19.96 35.21 91.37 51.60 -62.29 -42.29 0.02 0.00 99.98 0.00 0.00 0.01 99.98 0.01 0.00 0.00 0.00 70 A H H 50.89 3.88 24.41 28.00 91.24 50.66 -63.33 -42.10 0.09 0.00 99.91 0.00 0.00 0.06 99.92 0.01 0.00 0.00 0.00 71 L H H 21.72 16.08 20.38 36.76 91.63 49.98 -64.43 -42.46 0.16 0.00 99.83 0.01 0.00 0.13 99.82 0.03 0.00 0.00 0.00 72 L H H 6.37 23.20 16.18 39.47 91.52 49.80 -64.23 -41.49 0.40 0.00 99.60 0.04 0.02 0.28 99.56 0.10 0.00 0.00 0.00 73 K H H 112.63 7.20 19.59 27.70 91.58 52.66 -63.64 -38.87 2.16 0.01 97.83 0.23 0.14 1.60 97.39 0.62 0.01 0.00 0.01 74 I H H 91.47 6.60 19.05 26.12 92.76 51.32 -68.42 -33.84 5.19 0.01 94.80 0.19 0.24 4.65 94.34 0.57 0.01 0.00 0.01 75 T H H 46.55 12.20 15.59 28.32 96.41 43.10 -91.43 -9.52 29.79 0.06 70.15 0.72 1.64 26.78 69.98 0.81 0.02 0.01 0.04 76 G C T 35.97 7.42 17.92 26.28 99.08 -110.25 82.87 11.25 95.05 0.36 4.59 12.39 18.91 63.80 2.39 2.16 0.00 0.16 0.20 77 D C C 52.01 9.86 17.13 28.21 99.28 118.98 -94.50 24.06 71.05 1.22 27.73 51.12 8.61 10.60 8.45 19.93 0.00 0.65 0.64 78 W H G 42.65 20.07 11.55 30.80 93.18 102.04 -70.49 -21.42 28.52 0.65 70.83 13.41 4.15 11.00 15.95 54.91 0.00 0.43 0.15 79 Q H G 119.67 3.73 17.79 23.00 90.67 68.95 -63.17 -30.54 10.28 0.18 89.53 2.21 1.28 6.20 20.08 70.07 0.00 0.13 0.02 80 K H G 131.65 3.42 18.61 22.68 91.43 58.74 -72.82 -18.92 12.95 0.20 86.85 1.82 1.49 8.99 21.14 66.38 0.01 0.14 0.04 81 F H G 35.28 18.24 11.24 29.31 98.16 49.05 -99.98 3.99 31.86 1.15 66.99 6.66 5.34 20.06 15.22 51.54 0.03 0.68 0.47 82 K C T 117.70 7.69 14.83 24.54 111.15 120.28 -65.55 131.63 89.67 1.81 8.52 8.68 7.08 73.87 4.44 3.79 0.01 0.90 1.22 83 G C T 56.83 2.12 17.75 20.18 95.87 20.03 83.33 -0.69 95.88 0.57 3.55 9.77 9.14 76.95 0.78 2.73 0.00 0.33 0.30 84 L C C 43.51 14.89 9.97 25.15 114.15 131.73 -80.99 132.38 98.22 1.39 0.39 70.96 26.24 0.82 0.14 0.22 0.00 0.42 1.20 85 P C T 94.69 3.82 15.45 20.54 110.58 -103.70 -62.36 139.34 94.94 1.17 3.89 11.27 9.47 73.88 0.64 3.40 0.00 0.66 0.68 86 G C T 55.73 2.80 15.35 19.06 97.69 17.07 83.56 -2.51 95.29 0.80 3.91 7.93 10.60 76.31 0.49 3.82 0.00 0.49 0.36 87 A C C 36.92 13.84 9.49 23.27 112.55 122.18 -85.59 133.00 89.74 3.75 6.51 63.58 16.88 8.19 1.28 5.95 0.00 1.65 2.48 88 E C C 142.23 2.63 15.10 18.71 114.05 -152.09 -95.97 132.92 86.96 5.32 7.72 41.97 23.43 21.88 1.64 5.85 0.01 2.51 2.71 89 G C S 46.06 4.38 14.75 20.36 114.46 12.87 89.07 -158.09 90.71 4.31 4.99 22.67 43.29 25.14 0.59 4.44 0.00 2.82 1.04 90 T C C 96.19 3.68 16.20 20.98 113.90 -27.80 -98.43 127.84 82.08 14.09 3.83 61.79 13.87 6.16 0.90 3.30 0.00 11.06 2.92 91 L C C 54.86 16.20 9.62 25.12 115.74 -145.19 -92.95 129.80 70.18 28.54 1.29 62.92 5.28 1.02 0.64 0.70 0.00 23.85 5.59 92 K C C 138.91 2.97 17.97 21.79 113.75 -148.86 -98.47 124.95 64.81 34.13 1.06 60.33 2.95 0.74 0.55 0.52 0.00 30.19 4.73 93 V C C 64.64 13.68 9.82 23.36 117.41 -163.69 -101.28 129.44 73.29 25.49 1.22 67.73 3.99 0.91 0.63 0.61 0.00 21.47 4.65 94 K C C 136.26 3.04 14.62 19.01 118.72 -155.53 -101.12 137.50 87.98 11.23 0.79 80.07 6.81 0.95 0.34 0.45 0.00 8.90 2.48 95 E C C 128.44 4.87 11.73 18.74 114.72 -110.26 -76.70 136.28 98.29 1.58 0.14 90.06 8.11 0.30 0.05 0.07 0.00 1.08 0.34 96 P C C 71.87 8.16 9.96 19.57 115.09 -108.15 -67.16 150.71 98.87 0.80 0.33 94.15 4.03 0.83 0.11 0.15 0.00 0.40 0.32 97 K C C 156.93 2.02 13.61 16.79 113.65 -112.16 -84.33 136.37 99.21 0.40 0.39 89.45 9.18 0.63 0.23 0.11 0.00 0.15 0.25 98 P C C 65.25 9.05 9.48 19.75 115.38 -101.85 -69.86 152.73 96.09 0.40 3.51 87.23 6.42 2.51 2.71 0.72 0.00 0.15 0.27 99 S C C 60.18 3.11 14.17 18.04 117.47 -113.71 -77.70 163.44 92.32 1.02 6.66 85.51 4.33 2.29 5.95 0.88 0.00 0.35 0.69 100 K H H 132.25 4.56 12.88 19.15 92.91 -105.15 -60.40 -37.90 7.22 0.06 92.71 3.28 1.70 2.57 91.31 1.08 0.00 0.02 0.03 101 L H H 85.95 5.84 13.45 20.62 92.52 52.97 -65.13 -39.93 3.28 0.03 96.69 1.26 0.48 1.50 95.68 1.05 0.00 0.02 0.01 102 D H H 81.23 3.04 15.92 19.47 92.32 50.04 -66.27 -38.47 1.94 0.04 98.02 0.93 0.27 0.81 96.84 1.12 0.00 0.02 0.01 103 L H H 68.23 5.76 14.90 22.29 92.27 51.92 -64.60 -41.99 0.78 0.01 99.21 0.31 0.10 0.32 98.95 0.31 0.00 0.00 0.00 104 F H H 75.32 8.29 15.02 24.67 92.24 49.34 -64.49 -42.05 0.62 0.01 99.37 0.21 0.06 0.29 99.28 0.16 0.00 0.00 0.00 105 N H H 89.77 3.17 17.69 21.19 91.97 50.36 -64.37 -40.97 0.72 0.01 99.27 0.22 0.06 0.35 99.22 0.14 0.00 0.00 0.00 106 A H H 52.10 2.81 17.01 20.09 92.03 50.52 -64.19 -41.74 0.98 0.01 99.01 0.27 0.09 0.51 98.94 0.19 0.00 0.00 0.00 107 A H H 39.22 5.71 14.85 22.41 91.86 50.55 -64.51 -41.31 1.62 0.01 98.36 0.41 0.14 0.89 98.25 0.29 0.00 0.00 0.00 108 L H H 68.05 6.21 13.38 21.26 92.43 50.39 -65.09 -40.24 3.10 0.03 96.88 0.86 0.32 1.69 96.57 0.53 0.00 0.01 0.01 109 A H H 69.08 1.97 13.77 16.04 92.43 52.38 -65.45 -38.60 8.17 0.05 91.79 1.77 0.81 5.09 91.35 0.94 0.01 0.02 0.02 110 E H H 139.19 1.39 12.73 14.25 93.03 51.56 -69.90 -29.74 23.95 0.12 75.93 4.21 2.18 16.66 75.58 1.24 0.01 0.04 0.07 111 A C H 66.98 4.80 9.02 15.44 96.29 58.99 -76.27 -18.60 50.86 0.27 48.87 23.62 1.42 23.15 50.46 1.09 0.00 0.09 0.18 112 E C C 136.01 2.97 11.98 16.45 103.03 95.47 -75.49 43.15 99.93 0.02 0.05 99.76 0.09 0.10 0.03 0.00 0.00 0.01 0.00