# 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 109.91 7.15 12.94 21.36 112.65 -160.37 -97.57 125.61 99.88 0.12 0.00 99.87 0.05 0.01 0.00 0.00 0.00 0.07 0.01 1 K C C 118.31 5.76 13.65 21.06 119.62 -153.36 -101.99 137.18 74.34 25.44 0.22 73.89 0.45 0.43 0.05 0.11 0.00 23.92 1.15 2 T E E 77.44 7.80 13.78 23.10 122.93 -159.01 -114.49 138.91 48.25 51.42 0.33 42.93 3.81 0.73 0.10 0.26 0.00 49.16 3.01 3 F E E 48.14 16.30 11.58 28.07 120.24 -155.80 -107.59 134.81 44.54 55.29 0.17 41.98 1.83 0.30 0.05 0.12 0.00 51.87 3.84 4 R C C 146.15 4.09 20.51 25.33 115.61 -151.50 -103.69 123.97 60.68 39.18 0.14 55.31 3.92 0.34 0.03 0.11 0.00 39.01 1.28 5 W C C 52.76 19.53 11.90 30.54 124.00 -156.48 -110.85 143.05 75.47 24.35 0.18 65.79 8.01 0.66 0.04 0.17 0.00 24.17 1.16 6 K C C 121.67 4.18 23.15 27.82 120.65 -153.93 -111.68 133.76 70.94 28.94 0.12 68.85 2.02 0.27 0.03 0.09 0.00 26.37 2.37 7 V C C 35.36 20.83 10.86 30.52 115.64 -128.87 -84.88 132.60 70.05 29.88 0.07 71.07 1.32 0.05 0.04 0.03 0.00 16.12 11.38 8 K C C 99.64 6.59 17.43 25.16 117.80 -142.96 -94.59 140.14 98.93 1.06 0.01 98.62 0.57 0.03 0.00 0.00 0.00 0.60 0.16 9 P C T 101.96 3.63 14.26 19.69 111.40 -96.89 -62.30 141.05 98.45 1.14 0.40 1.75 4.87 92.01 0.03 0.36 0.00 0.80 0.19 10 G C T 60.36 1.32 16.01 16.94 96.38 22.17 84.31 -1.97 98.79 0.92 0.29 2.94 5.03 90.82 0.02 0.30 0.00 0.82 0.07 11 M C C 52.60 16.22 8.23 23.62 118.29 133.89 -80.87 141.10 84.45 15.40 0.15 81.06 2.52 0.26 0.02 0.14 0.00 15.39 0.60 12 D E E 106.80 2.46 19.09 22.14 118.80 -152.25 -107.85 132.19 28.23 71.66 0.11 27.02 0.97 0.17 0.03 0.08 0.00 69.72 2.01 13 V E E 53.44 17.58 10.54 26.94 125.11 -161.74 -120.34 137.67 14.55 85.38 0.07 13.49 0.78 0.11 0.02 0.04 0.00 83.98 1.57 14 A E E 59.10 5.52 18.24 24.53 122.41 -155.03 -107.34 146.95 15.62 84.32 0.06 14.15 1.38 0.16 0.02 0.04 0.00 83.62 0.64 15 S E E 56.08 12.37 13.90 26.39 118.54 -127.29 -97.26 135.53 24.59 75.33 0.08 21.66 2.43 0.21 0.02 0.06 0.00 73.82 1.80 16 V E E 76.36 7.55 17.18 25.87 122.74 -172.01 -123.46 129.99 46.23 53.74 0.03 42.41 2.89 0.09 0.01 0.02 0.00 53.79 0.80 17 P C C 59.98 12.10 14.20 26.89 114.60 -109.89 -66.91 147.02 59.12 40.69 0.20 52.55 4.09 0.56 0.03 0.17 0.00 42.14 0.47 18 S C C 48.24 9.30 16.20 26.53 116.61 -149.06 -101.17 137.72 59.04 40.62 0.34 44.47 12.19 1.13 0.04 0.31 0.00 41.19 0.67 19 V E E 65.43 11.94 13.79 26.38 122.86 -144.05 -116.68 134.21 18.05 81.86 0.08 16.20 1.51 0.12 0.01 0.06 0.00 81.59 0.50 20 R E E 105.87 7.78 16.19 25.42 124.49 -171.28 -121.18 138.32 2.48 97.50 0.01 2.23 0.15 0.01 0.00 0.01 0.00 97.53 0.06 21 K E E 117.09 7.18 14.91 23.81 119.21 -146.78 -107.21 130.71 1.03 98.96 0.00 0.97 0.02 0.00 0.00 0.00 0.00 98.98 0.02 22 V E E 45.43 10.60 12.63 25.06 124.29 -170.80 -120.42 138.53 0.77 99.22 0.00 0.72 0.02 0.00 0.00 0.00 0.00 99.25 0.01 23 R E E 153.05 3.27 14.20 19.10 113.47 -131.44 -90.37 125.23 2.47 97.53 0.01 2.32 0.09 0.01 0.00 0.00 0.00 97.43 0.14 24 F E E 84.94 10.02 9.15 20.07 106.50 -176.54 -101.97 18.71 48.89 50.91 0.20 45.36 1.87 0.33 0.04 0.15 0.00 51.36 0.89 25 G C T 51.24 2.40 12.12 15.46 115.00 -75.68 86.45 -156.93 75.72 18.31 5.97 4.81 15.69 56.31 0.17 6.45 0.00 15.49 1.08 26 D C T 130.73 0.68 11.72 11.62 97.45 23.82 -72.91 16.24 93.72 0.58 5.70 1.30 11.53 79.58 0.09 6.96 0.00 0.37 0.16 27 G C S 56.49 2.03 11.35 14.26 97.12 -65.76 86.58 3.27 93.26 1.47 5.27 5.83 49.97 37.25 0.20 5.40 0.00 1.04 0.32 28 Y C C 109.90 5.60 10.44 18.27 120.23 120.33 -92.03 144.94 57.34 42.54 0.11 53.53 2.43 0.39 0.02 0.09 0.00 42.68 0.86 29 S E E 59.29 7.98 11.79 21.77 129.53 -171.61 -131.90 149.71 3.84 96.15 0.01 3.39 0.22 0.02 0.00 0.00 0.00 96.18 0.18 30 Q E E 79.05 8.88 15.73 26.03 128.88 -170.06 -131.43 145.70 0.99 99.00 0.00 0.84 0.05 0.01 0.00 0.00 0.00 99.06 0.03 31 R E E 126.50 8.54 16.77 26.49 119.16 -141.92 -103.20 134.97 4.41 95.57 0.02 3.70 0.54 0.04 0.00 0.01 0.00 95.56 0.14 32 A E E 25.33 14.49 14.25 29.47 128.10 -173.48 -127.11 146.83 32.14 67.73 0.13 27.97 3.57 0.23 0.03 0.09 0.00 67.64 0.46 33 P C E 61.03 7.46 18.25 26.66 114.02 -103.11 -66.43 150.72 50.44 47.26 2.31 38.18 9.09 4.45 0.45 1.95 0.00 44.55 1.33 34 A C T 54.63 11.33 15.34 27.00 111.09 -97.05 -66.38 139.48 77.18 10.48 12.34 14.08 19.76 44.38 1.77 10.11 0.08 7.60 2.23 35 G C T 35.21 8.50 18.82 27.68 104.61 30.87 88.31 -9.92 78.43 7.37 14.20 20.31 19.73 39.52 2.37 11.21 0.05 4.69 2.12 36 L C C 62.17 13.32 16.11 29.20 96.56 87.19 -72.81 -26.03 68.71 7.53 23.76 27.40 16.88 25.92 5.03 17.60 0.09 4.32 2.76 37 N C C 74.49 11.75 16.87 28.33 97.36 56.31 -84.87 6.54 70.53 5.14 24.33 30.64 13.93 27.13 4.31 19.19 0.02 3.07 1.70 38 A C T 48.54 11.62 14.96 27.08 97.97 103.16 -75.11 -12.71 67.18 5.09 27.73 22.62 16.72 29.35 4.18 22.37 0.05 3.22 1.48 39 N C T 102.26 4.62 19.63 24.80 100.94 56.26 -92.05 25.50 66.09 10.71 23.20 25.74 13.87 28.32 3.15 18.94 0.03 8.44 1.50 40 L C C 54.32 18.23 12.27 29.46 117.04 131.33 -79.59 137.00 72.81 24.76 2.44 59.56 10.24 2.31 0.55 1.81 0.00 24.31 1.21 41 K E E 90.35 9.09 20.04 29.67 123.23 -158.48 -111.56 142.08 26.07 73.67 0.26 23.72 2.01 0.30 0.08 0.16 0.00 72.81 0.91 42 T E E 69.84 12.54 17.29 30.05 124.51 -155.66 -118.32 138.43 5.07 94.90 0.03 4.62 0.36 0.03 0.01 0.01 0.00 94.33 0.63 43 Y E E 44.95 15.61 16.34 32.63 131.12 -176.65 -132.72 147.30 3.33 96.66 0.01 3.09 0.22 0.02 0.00 0.00 0.00 96.48 0.18 44 S E E 60.80 7.73 21.43 29.98 120.49 -138.39 -105.07 136.68 6.42 93.57 0.01 5.76 0.49 0.03 0.00 0.00 0.00 93.60 0.11 45 V E E 14.22 22.18 14.45 36.54 126.37 -170.48 -124.55 138.16 10.15 89.83 0.02 9.68 0.51 0.03 0.00 0.01 0.00 89.64 0.12 46 T E E 70.06 7.55 23.04 31.35 122.03 -162.41 -117.24 133.21 4.81 95.18 0.01 4.63 0.20 0.02 0.00 0.00 0.00 94.99 0.16 47 L E E 21.32 21.01 14.81 35.35 130.00 -175.90 -132.04 143.92 5.66 94.33 0.01 5.35 0.22 0.02 0.00 0.00 0.00 94.04 0.37 48 S E E 65.66 5.43 23.32 28.90 113.04 -145.00 -101.30 119.37 27.38 72.59 0.02 19.07 8.04 0.21 0.00 0.02 0.00 72.26 0.40 49 V C E 17.08 20.20 11.90 31.86 132.29 163.35 -134.74 150.85 57.38 42.61 0.02 33.62 23.64 0.14 0.00 0.01 0.00 41.86 0.71 50 P C C 62.51 3.97 20.15 24.31 114.98 -100.85 -64.62 150.60 81.63 18.23 0.14 80.69 1.34 0.11 0.07 0.04 0.00 16.92 0.84 51 R H H 134.81 8.43 13.46 23.21 91.46 -112.97 -57.69 -38.67 3.43 0.02 96.55 0.82 0.64 1.93 95.32 1.27 0.00 0.01 0.01 52 E H H 137.26 1.31 19.73 19.69 91.54 53.93 -63.81 -39.36 1.86 0.01 98.14 0.29 0.19 1.26 96.63 1.61 0.00 0.00 0.00 53 E H H 62.28 11.70 17.98 30.12 92.25 48.40 -67.27 -38.58 1.08 0.01 98.92 0.28 0.10 0.64 97.34 1.63 0.00 0.01 0.00 54 A H H 8.52 20.53 14.69 35.42 91.38 52.69 -63.01 -42.20 0.71 0.00 99.29 0.24 0.08 0.36 99.02 0.31 0.00 0.00 0.00 55 T H H 71.26 3.84 23.54 26.99 91.72 50.91 -64.84 -40.71 0.49 0.00 99.51 0.10 0.03 0.29 99.47 0.12 0.00 0.00 0.00 56 V H H 59.12 6.51 22.83 29.80 91.67 50.53 -63.99 -42.54 0.38 0.00 99.62 0.05 0.02 0.25 99.61 0.08 0.00 0.00 0.00 57 L H H 5.05 24.59 18.30 43.00 91.57 49.67 -64.23 -43.36 0.23 0.00 99.77 0.03 0.01 0.14 99.79 0.04 0.00 0.00 0.00 58 E H H 62.55 14.69 21.43 35.30 91.45 51.97 -62.08 -42.25 0.15 0.00 99.85 0.01 0.00 0.08 99.89 0.01 0.00 0.00 0.00 59 S H H 52.80 2.68 24.20 25.72 91.32 50.28 -63.37 -42.24 0.38 0.00 99.62 0.03 0.01 0.25 99.68 0.03 0.00 0.00 0.00 60 F H H 27.01 14.34 19.51 34.81 91.66 50.63 -63.65 -43.26 0.41 0.00 99.59 0.05 0.02 0.27 99.62 0.05 0.00 0.00 0.00 61 L H H 10.27 22.66 14.58 37.12 91.62 50.29 -63.94 -42.29 0.47 0.00 99.53 0.06 0.03 0.31 99.50 0.10 0.00 0.00 0.00 62 E H H 125.01 3.57 19.37 23.86 91.87 49.63 -64.67 -40.38 1.03 0.00 98.96 0.07 0.05 0.85 98.81 0.22 0.00 0.00 0.00 63 E H H 129.95 2.25 19.21 21.30 92.50 48.39 -69.49 -34.05 4.01 0.01 95.99 0.10 0.16 3.77 95.63 0.33 0.01 0.00 0.00 64 H H H 60.01 13.61 13.86 27.83 97.75 36.05 -101.48 2.00 28.71 0.15 71.15 1.27 2.80 24.32 70.52 0.87 0.08 0.04 0.10 65 G C T 42.79 5.96 19.14 25.94 97.15 -118.66 69.15 22.87 79.79 0.68 19.53 15.75 8.58 54.47 2.47 18.01 0.00 0.39 0.33 66 G C T 25.28 12.60 18.10 30.60 100.39 -58.80 84.03 -1.16 73.79 1.21 24.99 8.87 14.34 48.46 1.26 25.88 0.00 0.69 0.49 67 W C G 48.19 19.96 15.80 34.81 114.35 114.87 -80.09 131.96 61.86 6.77 31.37 29.51 11.58 20.67 1.57 30.87 0.01 4.90 0.89 68 K C S 106.47 8.17 23.25 31.81 100.18 -172.49 -96.77 -24.88 79.60 15.54 4.86 26.01 43.77 9.80 0.38 4.67 0.00 14.36 1.02 69 S E E 24.88 12.66 23.93 36.96 142.47 5.83 -154.65 155.89 30.36 64.80 4.84 19.17 6.95 5.37 0.48 4.17 0.00 63.41 0.46 70 F E E 9.49 23.61 18.99 42.67 135.84 -171.23 -143.84 152.11 3.46 96.48 0.06 3.13 0.25 0.04 0.01 0.03 0.00 96.37 0.17 71 L E E 38.64 13.31 25.61 39.38 117.79 -131.13 -103.81 129.95 0.79 99.21 0.00 0.74 0.03 0.00 0.00 0.00 0.00 99.17 0.05 72 W E E 13.20 23.00 18.68 41.56 129.44 -172.93 -125.56 146.60 4.05 95.94 0.01 3.63 0.27 0.02 0.00 0.00 0.00 95.87 0.20 73 T E E 36.17 10.92 23.29 35.19 117.49 -139.45 -109.42 125.80 41.08 58.90 0.02 37.31 2.16 0.08 0.00 0.02 0.00 59.91 0.51 74 P C C 14.52 17.05 16.15 34.24 114.34 -121.19 -68.73 143.66 89.54 10.05 0.41 85.64 2.96 0.62 0.06 0.38 0.00 9.82 0.52 75 P C T 49.02 12.47 16.49 29.70 94.43 -115.39 -64.88 -23.41 87.88 0.49 11.64 3.52 12.08 70.40 0.39 13.10 0.00 0.31 0.19 76 Y C T 136.17 5.92 15.60 22.31 99.76 42.89 -88.60 -13.05 86.70 0.89 12.41 3.38 12.17 69.51 0.55 13.47 0.00 0.56 0.35 77 E C T 96.46 5.76 13.21 20.18 112.81 43.38 -108.18 100.02 82.27 3.73 14.01 22.23 29.18 30.25 0.91 14.08 0.00 2.21 1.14 78 W C T 180.72 4.79 12.74 19.17 97.64 -130.69 -43.82 20.33 93.45 4.68 1.88 27.62 31.63 34.40 0.19 1.88 0.00 3.64 0.64 79 R C C 122.44 4.42 15.67 21.57 120.37 120.81 -94.38 143.79 65.09 34.19 0.73 44.26 16.20 4.24 0.10 0.72 0.00 33.50 0.97 80 Q E E 96.41 9.42 15.42 25.79 116.94 -120.92 -85.60 135.31 24.95 74.99 0.06 22.85 1.29 0.15 0.01 0.04 0.00 75.33 0.33 81 I E E 24.82 17.41 15.26 33.23 127.22 -170.98 -123.67 142.75 1.25 98.75 0.00 1.12 0.07 0.01 0.00 0.00 0.00 98.77 0.03 82 K E E 90.75 9.15 23.18 32.69 117.18 -137.60 -100.49 130.50 0.27 99.73 0.00 0.25 0.01 0.00 0.00 0.00 0.00 99.74 0.00 83 V E E 6.66 23.90 16.90 41.15 123.76 -170.35 -119.09 135.74 0.22 99.78 0.00 0.20 0.00 0.00 0.00 0.00 0.00 99.79 0.00 84 T E E 42.31 9.75 26.01 36.42 121.90 -156.93 -111.31 135.82 0.50 99.50 0.00 0.46 0.01 0.00 0.00 0.00 0.00 99.51 0.02 85 C E E 7.79 23.96 13.97 38.15 113.43 -140.48 -91.94 128.11 7.47 92.51 0.01 7.02 0.22 0.02 0.00 0.01 0.00 92.59 0.13 86 A E E 52.96 6.79 21.81 28.98 99.17 -161.07 -79.07 -36.67 24.48 75.43 0.10 9.21 13.33 1.44 0.01 0.09 0.00 75.75 0.17 87 K E E 115.84 3.80 23.05 27.20 130.88 -2.98 -140.19 145.99 17.56 82.38 0.06 10.32 5.96 0.75 0.00 0.06 0.00 82.77 0.14 88 W E E 67.19 21.47 11.65 31.53 127.01 -167.70 -126.28 139.37 10.51 89.42 0.06 9.28 0.88 0.12 0.01 0.04 0.00 89.29 0.37 89 S E E 52.76 5.35 22.26 28.15 131.67 163.96 -131.91 153.07 8.83 91.14 0.04 7.70 0.80 0.09 0.01 0.02 0.00 91.21 0.18 90 S E E 45.59 17.31 12.69 28.95 130.24 -166.86 -135.58 145.53 10.06 89.89 0.05 8.37 1.15 0.13 0.01 0.03 0.00 90.20 0.10 91 R E E 128.87 4.38 19.71 25.23 123.83 -169.32 -126.31 134.95 6.35 93.60 0.05 5.47 0.53 0.09 0.01 0.03 0.00 93.66 0.21 92 V E E 68.94 13.21 11.65 25.01 119.43 -158.28 -110.99 128.45 12.29 87.64 0.07 10.48 1.14 0.19 0.01 0.04 0.00 87.70 0.45 93 S C E 56.08 4.08 15.46 20.74 128.94 172.20 -126.05 154.93 51.68 48.13 0.19 44.25 4.07 1.08 0.03 0.15 0.00 49.90 0.52 94 M C T 135.12 3.25 15.53 19.62 97.77 -58.74 -27.33 -40.89 97.83 1.70 0.48 25.08 31.26 41.45 0.06 0.45 0.00 1.53 0.17 95 L C T 78.24 11.77 13.90 25.57 100.80 -6.69 -101.65 5.63 96.92 2.50 0.58 18.10 33.14 45.67 0.06 0.58 0.00 2.24 0.21 96 R E E 88.43 9.39 18.26 28.55 131.12 70.20 -130.42 144.52 25.16 74.74 0.10 19.37 4.62 0.86 0.01 0.09 0.00 74.52 0.53 97 V E E 11.82 20.74 15.00 36.27 122.61 -157.47 -117.59 132.38 4.71 95.28 0.01 4.19 0.22 0.03 0.00 0.00 0.00 95.49 0.08 98 E E E 61.65 8.76 25.09 34.56 118.96 -161.13 -110.75 129.30 1.32 98.67 0.01 1.13 0.08 0.01 0.00 0.00 0.00 98.75 0.02 99 F E E 8.65 24.07 16.21 40.63 129.17 -174.94 -127.37 144.45 0.92 99.08 0.00 0.82 0.04 0.01 0.00 0.00 0.00 99.11 0.01 100 S E E 34.09 9.65 25.95 36.28 129.95 -170.21 -129.64 145.70 1.34 98.65 0.01 1.14 0.08 0.01 0.00 0.00 0.00 98.75 0.01 101 A E E 5.04 23.85 16.25 40.47 133.82 -176.12 -138.33 150.07 1.25 98.75 0.01 1.10 0.05 0.00 0.00 0.00 0.00 98.83 0.01 102 E E E 76.82 7.59 26.36 34.57 120.63 -146.78 -111.59 133.45 0.98 99.02 0.00 0.85 0.04 0.00 0.00 0.00 0.00 99.10 0.01 103 F E E 10.07 24.27 15.50 39.96 127.52 -170.90 -122.69 144.73 0.80 99.19 0.01 0.73 0.02 0.00 0.00 0.00 0.00 99.23 0.01 104 E E E 70.78 8.76 24.69 33.79 123.18 -162.56 -119.23 134.78 0.56 99.43 0.01 0.53 0.02 0.00 0.00 0.00 0.00 99.43 0.01 105 Q E E 48.20 16.53 17.35 33.64 118.33 -141.42 -98.17 133.21 1.83 98.16 0.01 1.70 0.08 0.02 0.00 0.01 0.00 98.14 0.06 106 V E E 43.79 10.84 17.65 29.99 117.10 -156.12 -105.97 127.75 14.79 85.15 0.07 13.78 0.70 0.14 0.02 0.04 0.00 84.97 0.36 107 V E E 58.25 11.34 12.72 25.12 117.35 -158.38 -102.91 132.33 44.28 55.61 0.11 42.31 0.76 0.22 0.03 0.06 0.00 55.36 1.26 108 N C C 111.54 3.69 16.38 21.13 107.08 -147.06 -91.36 93.24 99.66 0.34 0.00 99.56 0.12 0.04 0.00 0.00 0.00 0.27 0.01