# 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 K C C 131.32 4.70 16.04 22.15 115.97 -161.19 -100.77 134.84 99.74 0.25 0.01 99.71 0.09 0.02 0.00 0.00 0.00 0.16 0.01 1 N C C 114.23 3.84 16.32 21.34 108.15 -109.87 -85.38 106.73 89.90 9.84 0.27 88.24 1.23 1.05 0.08 0.14 0.00 6.98 2.28 2 V C C 38.18 17.45 10.68 27.53 116.24 -155.18 -97.91 127.76 88.19 11.52 0.29 76.08 10.67 1.05 0.08 0.25 0.00 8.92 2.95 3 P C C 60.58 7.94 19.22 28.07 112.42 -123.72 -70.33 148.76 92.83 6.80 0.37 81.03 9.04 2.36 0.06 0.39 0.00 6.44 0.68 4 H C C 97.05 11.90 19.02 30.57 117.04 -122.67 -93.23 137.29 80.46 18.89 0.65 41.54 32.18 7.15 0.07 0.71 0.00 17.02 1.33 5 G E E 10.99 14.96 20.27 35.33 140.32 106.40 136.63 -172.79 44.27 55.30 0.43 29.47 12.69 3.30 0.05 0.44 0.00 53.31 0.75 6 A E E 30.75 12.77 25.34 38.46 132.13 -98.92 -134.18 149.85 10.50 89.41 0.10 9.39 0.88 0.11 0.02 0.05 0.00 89.07 0.47 7 A E E 3.21 25.81 19.13 45.27 125.53 -160.34 -120.01 137.29 3.61 96.37 0.02 3.25 0.24 0.02 0.00 0.01 0.00 96.40 0.08 8 H E E 49.80 12.63 27.85 40.86 119.85 -163.76 -115.88 129.46 1.20 98.79 0.00 1.07 0.06 0.00 0.00 0.00 0.00 98.84 0.02 9 I E E 8.10 25.24 19.11 44.52 121.29 -165.50 -116.30 128.56 1.01 98.99 0.00 0.95 0.03 0.00 0.00 0.00 0.00 99.00 0.02 10 K E E 75.99 9.35 26.93 36.70 124.19 -173.00 -122.69 134.54 2.30 97.69 0.00 2.03 0.12 0.01 0.00 0.00 0.00 97.75 0.09 11 S E E 28.19 20.56 16.02 35.13 126.86 -167.46 -119.30 141.71 18.67 81.29 0.04 15.56 2.29 0.16 0.01 0.03 0.00 81.67 0.29 12 T C C 52.48 7.07 21.50 28.77 130.33 166.79 -124.66 171.51 67.59 32.29 0.13 58.47 7.21 0.53 0.03 0.11 0.00 32.66 1.00 13 F C S 131.63 7.10 17.29 25.24 95.23 -89.03 -61.82 -36.02 97.29 1.77 0.94 4.20 56.92 36.60 0.05 0.74 0.00 1.25 0.24 14 N C S 94.61 6.71 18.18 25.49 101.74 16.47 -106.49 -2.75 98.25 0.96 0.79 3.67 54.48 40.28 0.03 0.70 0.00 0.70 0.13 15 N E E 45.46 11.45 20.14 32.12 138.24 27.54 -147.05 156.00 49.02 50.55 0.43 31.47 13.79 3.55 0.04 0.44 0.00 50.14 0.58 16 T E E 7.70 22.92 17.64 40.96 122.76 -150.03 -117.67 133.34 5.76 94.23 0.00 5.21 0.19 0.01 0.00 0.00 0.00 94.51 0.08 17 I E E 27.00 13.45 27.22 41.55 119.37 -162.18 -113.79 127.57 0.24 99.76 0.00 0.20 0.00 0.00 0.00 0.00 0.00 99.79 0.00 18 V E E 2.45 26.15 21.68 48.38 120.55 -166.64 -114.84 129.54 0.07 99.93 0.00 0.07 0.00 0.00 0.00 0.00 0.00 99.93 0.00 19 S E E 13.72 15.59 28.40 44.43 125.38 -169.28 -120.17 139.92 0.06 99.94 0.00 0.06 0.00 0.00 0.00 0.00 0.00 99.94 0.00 20 I E E 2.78 25.79 22.32 48.59 121.33 -161.94 -116.40 130.52 0.12 99.88 0.00 0.10 0.00 0.00 0.00 0.00 0.00 99.89 0.00 21 T E E 18.79 13.95 24.42 38.95 132.46 -175.20 -127.51 154.64 0.63 99.37 0.00 0.60 0.02 0.00 0.00 0.00 0.00 99.18 0.20 22 D C C 24.58 14.12 19.28 33.94 124.13 -124.66 -82.19 172.62 93.63 6.36 0.02 93.76 0.32 0.05 0.00 0.01 0.00 5.55 0.31 23 P C T 71.18 12.80 15.67 28.83 90.48 -93.15 -63.44 -20.16 99.45 0.08 0.46 0.20 2.44 96.89 0.01 0.40 0.00 0.05 0.02 24 Q C T 131.25 1.78 18.60 19.69 92.65 56.12 -87.14 0.00 99.44 0.05 0.51 0.18 2.43 96.91 0.01 0.43 0.00 0.02 0.01 25 G C S 31.26 11.68 13.59 25.70 97.31 -104.84 86.83 6.48 99.22 0.43 0.35 26.02 72.14 1.16 0.04 0.27 0.00 0.19 0.19 26 N C C 83.65 4.16 19.94 25.07 116.81 143.16 -79.90 139.60 97.34 2.59 0.08 94.37 3.03 0.20 0.02 0.04 0.00 1.32 1.02 27 V E E 60.33 15.81 15.30 30.82 110.01 -116.74 -76.81 123.28 1.39 98.61 0.00 1.38 0.06 0.00 0.00 0.00 0.00 97.97 0.58 28 I E E 52.23 12.82 19.99 33.33 101.48 173.73 -98.73 -30.79 0.89 99.11 0.00 0.61 0.17 0.00 0.00 0.00 0.00 99.21 0.01 29 A E E 17.41 15.01 22.38 38.01 143.30 0.70 -157.53 152.95 0.20 99.80 0.00 0.16 0.01 0.00 0.00 0.00 0.00 99.83 0.00 30 W E E 85.64 20.14 20.82 38.85 133.20 -169.45 -141.32 141.63 0.26 99.74 0.00 0.23 0.01 0.00 0.00 0.00 0.00 99.76 0.00 31 A E E 15.21 18.05 24.29 41.83 133.54 -173.00 -138.99 147.19 1.25 98.74 0.00 1.12 0.04 0.00 0.00 0.00 0.00 98.81 0.03 32 S E E 24.91 17.22 24.61 40.77 128.49 -157.10 -120.60 149.77 9.84 90.13 0.03 8.95 0.62 0.06 0.01 0.02 0.00 89.99 0.36 33 S C C 11.08 22.79 18.93 41.16 97.80 -137.54 -78.25 -20.72 60.77 13.63 25.59 42.60 9.93 9.40 7.98 16.79 0.05 11.63 1.63 34 G H G 26.52 13.66 21.10 33.92 94.66 70.37 -49.90 -22.04 45.74 2.34 51.92 10.50 10.65 25.29 12.95 38.20 0.09 1.42 0.91 35 H H G 117.30 6.48 22.89 29.68 94.82 56.06 -86.02 -11.25 44.84 2.22 52.94 9.41 9.43 26.13 15.09 37.55 0.12 1.30 0.96 36 V C G 39.73 16.89 16.17 32.44 103.26 61.27 -88.06 1.62 52.02 5.22 42.77 13.82 14.78 24.76 14.68 25.96 0.60 2.74 2.67 37 G C C 30.72 8.84 20.23 29.46 118.66 -103.20 94.28 46.50 83.35 6.31 10.33 38.20 20.67 25.38 3.79 5.76 0.02 3.00 3.17 38 F C C 66.31 15.40 12.92 27.99 114.40 -62.55 -92.45 126.39 82.79 11.78 5.43 56.34 18.17 7.28 2.41 2.98 0.01 4.83 7.97 39 K C T 150.62 3.18 14.87 19.80 110.02 -114.34 -67.04 131.67 89.18 4.81 6.01 15.31 15.75 58.16 1.58 4.25 0.01 2.66 2.27 40 G C T 64.74 0.85 14.88 14.65 96.99 12.75 80.60 -1.19 92.53 1.31 6.16 10.59 20.45 61.45 1.08 5.03 0.00 0.68 0.72 41 S C C 49.43 9.70 9.42 19.98 121.67 112.95 -101.42 157.14 85.93 3.18 10.89 36.72 32.37 16.68 2.18 8.58 0.01 1.26 2.19 42 R C S 185.17 1.76 15.58 17.89 96.54 -131.66 -80.83 -12.24 82.92 3.41 13.67 21.82 37.80 24.01 2.38 10.42 0.01 1.66 1.90 43 K C C 117.20 5.16 18.18 24.46 120.01 72.90 -102.03 140.71 80.19 6.57 13.25 32.88 29.52 18.30 2.74 9.93 0.04 2.98 3.62 44 S C C 32.59 19.46 13.84 32.04 114.99 -133.80 -84.78 132.09 87.09 5.22 7.68 66.81 13.16 6.14 3.08 4.59 0.00 1.95 4.27 45 T C C 44.08 10.57 22.97 33.70 126.60 -169.39 -111.89 151.40 89.55 0.75 9.70 72.10 14.88 0.98 10.87 0.34 0.00 0.16 0.67 46 P H H 54.14 15.48 19.87 34.63 92.76 -110.46 -60.73 -34.87 9.95 0.04 90.01 1.40 1.34 6.83 89.60 0.77 0.02 0.02 0.02 47 F H H 98.66 6.59 26.70 33.89 91.77 54.42 -64.48 -40.51 4.30 0.02 95.67 0.64 0.43 2.97 95.40 0.54 0.01 0.01 0.01 48 A H H 6.55 20.10 22.65 42.70 91.43 51.51 -64.08 -42.60 0.58 0.00 99.42 0.17 0.05 0.25 99.30 0.22 0.00 0.00 0.00 49 A H H 2.07 26.21 22.31 48.36 91.36 50.76 -63.97 -42.39 0.15 0.00 99.85 0.03 0.01 0.07 99.82 0.07 0.00 0.00 0.00 50 Q H H 64.06 12.99 28.46 41.46 91.56 50.46 -63.87 -42.12 0.09 0.00 99.91 0.01 0.00 0.05 99.90 0.03 0.00 0.00 0.00 51 L H H 51.30 9.08 29.73 40.51 91.57 49.96 -63.98 -42.52 0.09 0.00 99.91 0.01 0.00 0.05 99.91 0.02 0.00 0.00 0.00 52 A H H 2.19 24.75 25.45 49.69 91.77 49.65 -64.04 -43.34 0.11 0.00 99.89 0.01 0.00 0.07 99.90 0.02 0.00 0.00 0.00 53 A H H 2.05 26.31 24.62 50.57 91.51 50.35 -63.39 -42.99 0.11 0.00 99.89 0.01 0.00 0.07 99.90 0.02 0.00 0.00 0.00 54 E H H 80.27 8.98 29.44 39.52 91.46 50.03 -63.51 -42.45 0.15 0.00 99.85 0.01 0.01 0.10 99.86 0.02 0.00 0.00 0.00 55 N H H 49.10 9.10 28.91 39.43 91.76 49.00 -64.78 -41.81 0.34 0.00 99.66 0.04 0.02 0.22 99.69 0.03 0.00 0.00 0.00 56 A H H 1.39 25.98 23.33 49.13 91.64 50.27 -64.21 -43.12 0.25 0.00 99.75 0.03 0.01 0.16 99.77 0.04 0.00 0.00 0.00 57 A H H 8.42 21.97 22.87 44.10 91.32 51.50 -62.51 -42.81 0.14 0.00 99.86 0.01 0.00 0.08 99.87 0.03 0.00 0.00 0.00 58 R H H 123.49 3.30 28.24 31.50 91.36 49.98 -63.46 -42.33 0.13 0.00 99.87 0.01 0.00 0.09 99.87 0.03 0.00 0.00 0.00 59 K H H 60.74 10.60 24.22 35.10 91.78 49.22 -64.87 -41.50 0.18 0.00 99.82 0.01 0.01 0.12 99.80 0.06 0.00 0.00 0.00 60 A H H 1.70 26.07 14.53 41.27 91.12 50.98 -63.46 -42.71 0.40 0.00 99.60 0.04 0.02 0.29 99.47 0.18 0.00 0.00 0.00 61 Q H H 91.52 10.21 19.21 29.70 91.36 50.44 -63.33 -40.00 1.24 0.00 98.76 0.09 0.05 1.01 98.24 0.62 0.00 0.00 0.00 62 E H H 143.89 1.40 21.06 21.38 90.57 53.55 -65.76 -29.15 7.34 0.00 92.66 0.14 0.19 7.14 91.97 0.55 0.01 0.00 0.00 63 H C T 79.13 11.58 15.26 27.50 94.36 49.96 -89.82 0.42 75.03 0.02 24.95 0.40 1.12 72.98 24.68 0.78 0.00 0.01 0.02 64 G C T 45.05 3.59 22.60 26.32 98.57 -102.01 89.66 11.64 99.81 0.01 0.18 2.07 1.04 96.79 0.07 0.03 0.00 0.00 0.00 65 V C C 12.99 23.54 10.51 33.57 113.00 152.61 -78.08 128.84 93.30 6.61 0.09 93.45 0.48 0.08 0.02 0.03 0.00 5.54 0.40 66 K C C 122.90 4.81 23.48 29.23 100.44 177.61 -104.20 -16.81 89.13 10.83 0.04 69.53 18.31 0.39 0.00 0.05 0.00 11.49 0.24 67 K E E 84.36 8.85 25.01 34.74 131.73 31.04 -137.82 141.87 23.82 76.09 0.09 19.31 3.63 0.32 0.01 0.07 0.00 76.31 0.35 68 V E E 2.92 26.90 16.69 44.68 126.03 -170.31 -127.91 136.27 1.50 98.49 0.01 1.38 0.06 0.00 0.00 0.00 0.00 98.49 0.05 69 D E E 32.57 11.74 28.16 41.00 117.81 -157.40 -109.23 127.97 0.48 99.51 0.00 0.41 0.02 0.00 0.00 0.00 0.00 99.56 0.01 70 V E E 2.92 26.38 20.41 47.42 120.30 -164.07 -114.76 128.41 0.27 99.73 0.00 0.25 0.00 0.00 0.00 0.00 0.00 99.74 0.00 71 F E E 44.36 12.94 27.78 41.35 116.88 -163.37 -110.45 123.39 0.27 99.73 0.00 0.25 0.00 0.00 0.00 0.00 0.00 99.73 0.01 72 V E E 5.91 24.82 18.31 43.52 121.14 -168.44 -112.75 129.81 2.17 97.83 0.00 2.15 0.04 0.00 0.00 0.00 0.00 97.71 0.09 73 K E E 90.12 9.58 24.46 34.00 116.99 -167.56 -110.41 127.14 37.07 62.90 0.03 29.65 6.04 0.26 0.00 0.03 0.00 63.60 0.42 74 G C C 20.70 9.77 20.69 31.37 139.56 56.92 153.67 -177.38 87.71 12.21 0.08 47.70 39.05 1.24 0.01 0.08 0.00 11.31 0.61 75 P C C 82.47 6.86 19.06 26.53 115.19 -56.42 -73.63 146.81 96.42 3.20 0.38 54.30 38.41 4.00 0.08 0.34 0.00 2.21 0.66 76 G C S 32.87 5.93 18.60 25.78 135.51 64.51 136.60 -171.55 92.88 1.46 5.66 24.21 61.26 7.72 3.29 1.79 0.00 0.47 1.25 77 S C T 85.41 2.88 20.23 23.42 99.43 -46.04 -68.95 -10.68 77.61 0.45 21.94 4.25 16.47 57.23 14.85 6.49 0.04 0.19 0.48 78 G C T 15.29 16.75 16.24 32.58 95.14 43.17 -70.73 -6.26 75.54 0.29 24.17 12.75 8.44 53.82 20.12 4.50 0.01 0.12 0.25 79 R H H 50.80 20.52 16.26 35.66 92.77 101.32 -61.26 -42.37 5.94 0.03 94.02 2.76 0.98 2.20 92.51 1.52 0.00 0.01 0.01 80 E H H 112.68 4.99 24.20 29.94 91.61 51.23 -63.60 -41.08 1.44 0.01 98.56 0.39 0.16 0.73 98.19 0.53 0.00 0.00 0.00 81 T H H 53.50 6.52 24.90 31.83 91.77 49.29 -64.80 -41.78 0.67 0.00 99.33 0.16 0.06 0.35 99.04 0.39 0.00 0.00 0.00 82 A H H 2.60 24.94 19.28 44.24 91.96 50.44 -64.44 -43.16 0.64 0.00 99.35 0.15 0.05 0.33 99.27 0.19 0.00 0.00 0.00 83 I H H 21.29 20.52 21.97 41.43 91.59 49.63 -63.81 -42.69 0.37 0.00 99.63 0.06 0.02 0.19 99.68 0.04 0.00 0.00 0.00 84 R H H 132.98 2.77 26.86 29.11 91.56 50.63 -63.43 -42.23 0.14 0.00 99.86 0.02 0.01 0.07 99.88 0.02 0.00 0.00 0.00 85 S H H 23.52 12.22 21.59 34.54 91.74 50.03 -64.55 -42.05 0.14 0.00 99.86 0.01 0.00 0.09 99.85 0.04 0.00 0.00 0.00 86 L H H 3.16 26.22 15.19 41.89 91.62 50.03 -64.29 -42.23 0.24 0.00 99.76 0.02 0.01 0.17 99.70 0.10 0.00 0.00 0.00 87 Q H H 100.62 8.53 19.54 28.89 91.30 50.98 -62.60 -40.29 0.67 0.00 99.33 0.04 0.02 0.54 99.15 0.24 0.00 0.00 0.00 88 A H H 83.03 1.97 19.85 21.63 89.87 55.61 -65.20 -25.74 8.18 0.00 91.82 0.14 0.19 8.10 91.19 0.37 0.01 0.00 0.00 89 A C T 36.92 13.24 14.20 28.21 92.92 54.91 -86.61 -1.99 82.33 0.03 17.64 0.31 1.08 80.00 18.05 0.53 0.00 0.01 0.02 90 G C T 53.60 2.04 21.91 23.39 96.29 -104.12 86.73 11.53 99.83 0.02 0.15 1.71 1.28 96.92 0.06 0.02 0.00 0.00 0.00 91 L C C 16.94 23.15 10.03 32.46 118.19 143.20 -89.27 139.11 96.52 3.47 0.01 95.49 1.06 0.06 0.00 0.01 0.00 3.27 0.10 92 E E E 120.87 3.25 24.71 27.96 111.31 -128.40 -88.58 123.34 26.75 73.19 0.06 26.01 0.73 0.08 0.01 0.03 0.00 72.52 0.62 93 V E E 30.82 23.19 12.16 34.14 116.44 -158.11 -98.66 124.40 5.66 94.32 0.02 5.70 0.17 0.01 0.00 0.01 0.00 93.37 0.72 94 G E E 34.14 6.47 21.88 28.68 103.11 175.63 -90.57 -46.20 8.12 91.86 0.02 5.62 2.15 0.11 0.00 0.01 0.00 92.04 0.06 95 T E E 68.56 6.34 23.02 29.98 134.74 -8.85 -143.32 148.40 2.80 97.19 0.01 2.36 0.27 0.02 0.00 0.00 0.00 97.28 0.06 96 I E E 41.77 22.10 13.50 34.47 122.45 -160.84 -121.76 129.15 1.23 98.76 0.00 1.18 0.05 0.00 0.00 0.00 0.00 98.70 0.07 97 S E E 48.81 7.01 22.93 30.53 130.78 -177.77 -131.02 149.30 1.97 98.02 0.00 1.77 0.12 0.01 0.00 0.00 0.00 97.99 0.11 98 D E E 65.73 14.96 16.07 30.43 112.85 -128.79 -91.73 121.96 11.40 88.58 0.02 10.27 0.76 0.05 0.00 0.01 0.00 88.53 0.37 99 V C C 67.84 10.05 16.73 27.52 107.12 -173.75 -104.42 38.82 78.06 21.86 0.08 62.67 13.85 0.51 0.02 0.08 0.00 21.81 1.07 100 T C C 52.32 10.36 13.14 24.73 118.29 119.35 -95.62 136.80 91.98 7.95 0.07 71.59 20.10 0.55 0.02 0.07 0.00 6.36 1.32 101 P C S 93.57 5.13 14.86 21.40 96.83 -123.70 -69.82 -13.61 97.42 2.45 0.13 36.69 59.52 1.64 0.02 0.10 0.00 1.58 0.44 102 Q C S 107.80 4.35 13.99 19.86 120.15 55.71 -111.06 135.27 96.22 3.56 0.22 37.07 58.82 0.95 0.06 0.14 0.00 1.64 1.32 103 P C C 80.06 6.93 12.81 21.39 113.86 -106.76 -65.24 146.42 94.92 3.29 1.79 82.60 7.41 4.67 0.34 1.60 0.00 2.04 1.35 104 H C C 97.68 10.33 10.75 21.81 115.94 -143.24 -103.59 132.35 86.75 7.54 5.71 56.71 15.30 13.89 1.12 5.02 0.00 3.35 4.61 105 N C C 118.73 3.33 14.72 19.05 101.34 -46.82 -33.57 47.44 87.71 4.11 8.18 33.17 23.95 30.51 1.03 7.49 0.00 2.07 1.79 106 G C C 45.44 6.05 13.24 20.43 103.99 -65.01 84.55 2.93 89.70 3.65 6.65 34.44 28.13 26.87 0.79 6.37 0.00 1.84 1.56 107 C C C 63.61 9.62 10.93 21.53 110.30 119.36 -90.35 120.95 89.55 6.63 3.83 57.16 22.76 8.92 0.79 3.41 0.00 2.99 3.98 108 R C C 140.38 4.75 13.34 19.89 119.31 -144.97 -102.19 137.18 95.84 3.85 0.30 66.58 29.02 0.61 0.12 0.16 0.00 1.50 2.02 109 P C C 77.17 6.17 11.52 19.50 116.04 -105.18 -65.97 150.50 98.55 0.65 0.80 92.28 5.18 1.23 0.26 0.44 0.00 0.32 0.30 110 P C C 92.64 4.80 10.23 16.95 110.88 -101.68 -66.94 147.25 90.59 1.18 8.23 71.12 8.32 10.58 1.79 6.90 0.00 0.59 0.69 111 K C C 152.00 2.43 9.12 13.49 112.58 -111.34 -84.36 135.77 86.65 2.62 10.73 55.81 17.20 12.98 2.12 9.19 0.00 1.34 1.35 112 R C C 171.42 2.39 7.85 12.24 113.83 -128.24 -89.22 133.07 86.14 3.58 10.28 63.75 13.56 8.20 2.25 8.64 0.00 2.07 1.53 113 R C C 172.88 2.20 7.45 11.63 112.34 -134.04 -88.42 131.95 92.74 2.73 4.53 87.56 1.85 4.32 1.45 2.18 0.00 1.47 1.17 114 R C C 175.61 2.22 9.98 13.88 109.29 -135.33 -88.56 119.84 99.83 0.10 0.06 99.44 0.24 0.21 0.02 0.02 0.00 0.04 0.03