# 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 97.50 8.30 12.96 22.38 117.96 -160.82 -99.27 136.25 99.88 0.10 0.02 99.86 0.05 0.02 0.01 0.00 0.00 0.04 0.01 1 S C C 65.09 5.78 11.62 18.98 116.43 -157.98 -96.59 142.04 80.81 4.24 14.95 75.85 1.17 4.68 11.57 2.58 0.00 2.37 1.78 2 S C C 68.16 5.88 10.80 18.08 103.47 -143.83 -79.94 -5.75 65.16 5.29 29.55 43.41 11.56 9.94 21.77 8.26 0.03 3.26 1.76 3 Q C C 112.13 3.26 13.75 17.92 97.38 79.56 -72.24 -26.03 53.52 5.15 41.33 35.79 9.65 8.43 27.01 14.28 0.03 3.43 1.38 4 I H G 55.89 12.17 11.59 24.20 94.80 62.94 -70.70 -30.88 31.85 4.28 63.88 17.80 6.11 8.76 30.71 32.61 0.06 3.01 0.94 5 I H G 74.75 11.29 12.31 24.04 93.82 63.52 -71.15 -23.27 35.77 2.84 61.39 10.11 7.44 17.76 29.26 32.55 0.19 1.85 0.84 6 D C G 111.77 1.96 16.20 18.30 96.98 54.62 -89.63 0.10 50.14 1.65 48.20 11.60 10.27 28.71 15.24 32.38 0.07 0.92 0.81 7 R C S 86.99 9.05 10.06 20.74 118.67 106.11 -82.70 142.33 99.49 0.33 0.18 25.19 74.10 0.30 0.08 0.04 0.00 0.09 0.20 8 P C C 70.06 3.39 15.27 19.61 113.50 -102.45 -63.95 147.65 98.87 0.74 0.39 98.41 0.53 0.15 0.14 0.10 0.00 0.20 0.47 9 K H G 111.85 10.23 9.93 20.91 92.24 -115.29 -58.75 -33.68 11.35 0.12 88.53 2.31 1.28 5.81 1.50 89.01 0.00 0.09 0.01 10 H H G 159.22 1.10 14.21 15.00 91.62 61.78 -69.99 -16.00 10.64 0.08 89.27 0.79 0.96 7.41 1.10 89.68 0.00 0.06 0.01 11 E H G 132.38 2.09 13.60 16.21 94.97 56.07 -88.78 -4.60 11.17 0.12 88.71 1.69 1.52 6.15 1.17 89.38 0.00 0.08 0.01 12 L C S 36.47 15.68 5.99 20.41 118.25 97.74 -83.83 142.51 97.55 0.83 1.62 44.79 51.99 0.65 1.06 0.34 0.00 0.14 1.02 13 S C C 59.29 2.01 15.71 17.30 120.63 -126.77 -80.44 163.81 98.84 0.49 0.67 97.33 1.38 0.15 0.59 0.05 0.00 0.11 0.39 14 R H H 170.58 2.24 11.78 15.59 91.45 -103.01 -58.49 -38.29 1.98 0.01 98.02 0.43 0.31 1.05 97.75 0.45 0.00 0.00 0.00 15 A H H 73.07 1.23 14.07 14.58 92.12 53.19 -64.26 -40.26 1.18 0.00 98.81 0.20 0.10 0.73 98.43 0.53 0.00 0.00 0.00 16 E H H 87.25 4.36 13.58 19.46 92.10 49.08 -65.70 -40.00 0.70 0.01 99.29 0.21 0.06 0.35 98.83 0.54 0.00 0.00 0.00 17 L H H 53.07 8.96 12.12 22.80 92.00 51.24 -64.13 -41.45 0.54 0.00 99.45 0.15 0.05 0.26 99.34 0.21 0.00 0.00 0.00 18 E H H 106.81 2.15 16.75 18.68 91.72 50.42 -64.24 -40.32 1.31 0.01 98.68 0.29 0.10 0.71 98.75 0.15 0.00 0.00 0.00 19 E H H 106.53 1.98 17.18 18.60 92.01 50.09 -65.17 -40.72 2.05 0.01 97.94 0.39 0.14 1.24 98.03 0.20 0.00 0.00 0.00 20 L H H 54.18 8.31 14.07 24.13 92.30 50.95 -64.82 -40.78 1.67 0.01 98.32 0.50 0.16 0.80 98.12 0.41 0.00 0.00 0.00 21 E H H 87.20 6.56 15.60 23.40 91.94 51.81 -64.05 -39.89 2.19 0.02 97.79 0.68 0.18 1.09 97.44 0.59 0.00 0.01 0.00 22 E H H 110.00 2.05 17.34 18.86 92.36 50.55 -65.37 -40.35 3.94 0.03 96.03 0.95 0.34 2.35 95.41 0.92 0.00 0.01 0.01 23 F H H 99.83 3.96 16.00 20.88 92.76 49.59 -66.75 -39.36 8.04 0.08 91.88 2.20 0.99 4.63 90.71 1.39 0.01 0.03 0.04 24 E H H 72.32 9.36 13.53 24.06 92.75 53.45 -66.68 -35.57 14.81 0.18 85.02 5.34 1.85 7.54 82.01 3.08 0.01 0.09 0.07 25 F H H 106.27 7.06 13.79 22.10 93.81 53.75 -71.33 -27.37 23.96 0.27 75.77 6.99 2.86 14.09 69.35 6.42 0.03 0.13 0.13 26 K H H 143.61 2.00 16.06 18.00 96.38 51.81 -79.08 -24.72 35.18 0.31 64.52 6.85 4.90 23.61 59.20 5.07 0.05 0.14 0.18 27 H C H 120.11 3.98 15.09 19.98 104.10 42.15 -101.15 -2.60 50.84 0.44 48.73 9.57 14.81 26.90 45.04 3.18 0.06 0.14 0.32 28 G C S 24.67 7.71 15.94 24.91 128.25 -107.40 95.32 175.11 82.11 0.37 17.52 36.50 37.36 6.73 17.42 1.61 0.00 0.09 0.27 29 P H H 56.37 12.40 15.66 28.37 93.68 -52.14 -64.12 -32.99 28.41 0.16 71.44 6.40 4.16 18.21 67.52 3.52 0.03 0.06 0.10 30 M H H 71.97 12.06 16.97 29.23 92.35 54.64 -65.64 -35.79 15.18 0.12 84.70 3.73 1.80 9.67 81.15 3.50 0.03 0.06 0.06 31 S H H 48.18 4.94 19.89 25.57 91.99 55.58 -64.46 -39.05 5.96 0.09 93.95 3.08 0.84 2.27 90.74 2.98 0.00 0.05 0.03 32 L H H 48.28 11.74 19.55 31.81 92.20 51.03 -64.63 -42.01 2.04 0.05 97.91 0.90 0.26 0.89 96.97 0.94 0.00 0.03 0.01 33 I H H 20.39 20.35 17.53 37.50 92.23 50.06 -64.58 -42.42 1.17 0.03 98.80 0.42 0.13 0.55 98.42 0.45 0.00 0.02 0.00 34 N H H 70.71 7.50 21.52 29.49 91.55 51.15 -63.07 -41.45 1.42 0.03 98.55 0.47 0.15 0.70 98.31 0.34 0.00 0.02 0.01 35 D H H 69.84 3.90 22.15 25.90 91.63 49.89 -64.48 -40.98 1.96 0.05 97.99 0.58 0.24 1.09 97.60 0.45 0.01 0.02 0.01 36 A H H 10.48 15.91 14.83 31.90 91.65 51.20 -64.37 -41.39 2.27 0.07 97.66 0.60 0.25 1.32 97.14 0.63 0.01 0.04 0.02 37 M H H 63.25 13.67 15.93 29.52 92.95 49.21 -66.65 -40.36 3.15 0.08 96.77 0.72 0.30 2.00 96.06 0.83 0.01 0.05 0.02 38 V H H 105.24 2.34 18.14 20.44 93.64 46.15 -69.39 -37.64 7.21 0.06 92.73 0.66 0.63 5.56 92.46 0.62 0.02 0.03 0.03 39 T H H 79.68 3.40 16.37 20.28 96.41 37.75 -92.99 -4.66 30.88 0.13 68.99 2.20 3.73 23.94 69.24 0.72 0.03 0.04 0.09 40 R C T 144.70 7.41 15.18 24.26 93.86 -126.63 58.00 38.13 98.71 0.25 1.04 24.99 6.00 67.95 0.62 0.24 0.00 0.13 0.07 41 T C C 47.97 9.56 17.56 28.42 119.97 150.86 -100.75 140.60 96.91 3.06 0.03 81.67 15.05 0.21 0.01 0.02 0.00 2.86 0.18 42 P C C 53.17 10.97 21.72 32.91 114.71 -108.26 -69.95 144.52 79.63 20.35 0.02 78.24 0.76 0.06 0.00 0.01 0.00 20.76 0.16 43 V E E 5.45 24.03 17.00 41.69 125.03 -162.82 -119.17 138.15 4.11 95.89 0.00 4.07 0.10 0.00 0.00 0.00 0.00 95.71 0.11 44 I E E 38.17 11.46 26.17 38.65 116.38 -144.33 -104.52 126.20 0.23 99.77 0.00 0.22 0.00 0.00 0.00 0.00 0.00 99.77 0.00 45 I E E 4.90 24.61 18.68 43.95 119.22 -165.90 -113.18 127.90 0.18 99.82 0.00 0.16 0.00 0.00 0.00 0.00 0.00 99.83 0.00 46 S E E 30.98 9.35 24.38 34.66 114.54 -155.30 -103.29 122.99 1.19 98.81 0.00 1.11 0.03 0.00 0.00 0.00 0.00 98.83 0.02 47 L E E 17.05 19.75 13.51 33.04 123.21 -167.79 -100.72 164.27 31.43 68.36 0.21 28.94 1.48 0.27 0.03 0.15 0.00 68.75 0.38 48 R C T 115.08 8.76 16.53 25.61 106.57 -84.62 -64.02 135.32 68.90 11.96 19.14 3.62 9.33 56.90 0.45 18.84 0.00 10.01 0.83 49 N C T 111.22 3.55 16.27 20.77 94.79 11.19 57.37 24.53 82.44 0.38 17.18 1.59 7.17 71.29 0.29 19.31 0.00 0.23 0.13 50 N C T 111.17 4.63 15.83 21.72 94.31 -88.01 69.51 19.35 81.96 1.44 16.60 8.22 26.75 44.97 0.35 18.43 0.00 0.90 0.37 51 H E E 68.18 10.66 15.39 27.31 118.77 139.60 -88.42 141.23 45.68 54.19 0.13 40.36 2.05 0.71 0.02 0.09 0.00 56.31 0.46 52 K E E 81.11 12.76 20.52 33.26 126.82 -159.29 -121.35 139.47 1.67 98.33 0.00 1.43 0.08 0.00 0.00 0.00 0.00 98.46 0.02 53 I E E 7.10 23.11 19.43 42.75 125.41 -167.63 -122.45 137.31 0.10 99.90 0.00 0.09 0.00 0.00 0.00 0.00 0.00 99.91 0.00 54 I E E 33.19 13.35 26.53 40.45 117.31 -145.81 -104.01 128.86 0.10 99.90 0.00 0.08 0.00 0.00 0.00 0.00 0.00 99.91 0.00 55 A E E 3.18 23.43 20.80 44.24 140.48 159.36 -149.44 166.62 0.81 99.19 0.00 0.67 0.04 0.00 0.00 0.00 0.00 99.28 0.00 56 R E E 69.81 10.81 27.08 38.93 120.23 -115.77 -110.69 133.80 1.17 98.83 0.00 1.02 0.05 0.00 0.00 0.00 0.00 98.91 0.02 57 V E E 5.44 24.94 15.98 41.91 110.80 -118.95 -77.22 125.61 1.67 98.32 0.01 1.55 0.06 0.01 0.00 0.00 0.00 98.35 0.03 58 K E E 89.84 7.30 23.99 32.00 99.78 178.01 -94.01 -30.46 3.47 96.50 0.03 2.35 0.80 0.09 0.00 0.02 0.00 96.71 0.02 59 A E E 34.37 7.78 25.36 34.23 143.17 -2.93 -159.86 156.75 1.87 98.11 0.02 1.38 0.28 0.04 0.00 0.01 0.00 98.26 0.02 60 F E E 42.35 22.47 12.80 34.15 132.18 -168.24 -140.27 145.55 3.21 96.77 0.02 2.95 0.24 0.02 0.01 0.01 0.00 95.29 1.49 61 D C C 55.53 6.88 19.99 27.37 127.90 -149.87 -101.22 176.27 87.55 12.41 0.05 86.72 0.97 0.16 0.01 0.03 0.00 11.55 0.57 62 R C T 158.45 5.36 16.98 23.72 91.64 -91.18 -65.11 -21.99 98.99 0.16 0.85 0.35 6.49 92.10 0.02 0.91 0.00 0.10 0.04 63 H C T 105.71 5.98 18.94 25.62 95.08 52.78 -92.88 3.11 99.03 0.08 0.89 0.49 6.46 91.99 0.02 0.97 0.00 0.05 0.02 64 C C S 18.62 19.02 16.14 35.03 94.52 -110.84 71.62 23.07 95.57 3.15 1.28 39.04 47.15 9.24 0.12 1.41 0.00 2.13 0.89 65 N C C 37.52 11.03 23.23 35.26 115.77 149.17 -81.51 139.10 87.92 12.02 0.06 82.55 3.95 0.78 0.01 0.06 0.00 11.91 0.74 66 M E E 9.71 24.04 18.66 42.61 122.41 -154.75 -112.36 134.53 1.82 98.18 0.00 1.79 0.05 0.00 0.00 0.00 0.00 98.06 0.09 67 V E E 27.11 12.58 26.50 39.85 122.27 -166.63 -118.32 132.29 0.10 99.90 0.00 0.09 0.00 0.00 0.00 0.00 0.00 99.90 0.00 68 L E E 8.50 23.88 18.50 42.57 118.02 -160.07 -109.04 126.79 0.13 99.87 0.00 0.13 0.00 0.00 0.00 0.00 0.00 99.87 0.00 69 E E E 65.29 8.99 23.14 32.57 130.39 -173.10 -123.67 153.16 1.47 98.52 0.00 0.97 0.24 0.02 0.00 0.00 0.00 98.76 0.01 70 N E E 89.02 4.54 23.54 28.83 92.80 8.81 58.64 44.07 2.28 97.72 0.01 1.43 0.38 0.04 0.00 0.00 0.00 98.14 0.01 71 V E E 11.86 23.21 12.68 35.76 116.82 169.87 -85.38 135.32 1.41 98.59 0.00 1.27 0.04 0.00 0.00 0.00 0.00 98.67 0.01 72 K E E 82.68 8.22 24.43 32.91 126.54 -166.27 -123.29 140.18 1.74 98.25 0.01 1.42 0.15 0.02 0.00 0.01 0.00 98.36 0.04 73 E E E 47.55 16.15 17.28 33.52 119.00 -145.28 -103.64 132.14 2.21 97.76 0.03 1.79 0.17 0.03 0.01 0.01 0.00 97.95 0.03 74 L E E 42.86 11.03 18.19 30.81 119.59 -162.38 -110.58 132.12 3.78 96.08 0.14 3.22 0.24 0.07 0.05 0.05 0.00 96.28 0.09 75 W E E 74.83 12.32 15.24 28.69 124.45 -164.21 -116.49 141.39 6.98 92.56 0.46 5.90 0.66 0.23 0.20 0.18 0.00 92.48 0.36 76 T E E 50.89 8.68 15.24 25.55 124.48 -162.77 -119.80 142.75 17.57 81.14 1.29 14.34 2.45 0.90 0.48 0.64 0.00 80.60 0.58 77 E E E 96.83 7.45 11.76 20.82 117.30 -145.27 -102.56 132.47 33.79 63.28 2.93 26.31 5.39 2.52 1.03 1.61 0.00 62.06 1.08 78 K C C 116.22 4.51 10.70 17.04 118.12 -162.28 -105.56 134.54 59.86 35.93 4.21 41.66 11.15 7.34 1.19 2.62 0.01 34.53 1.49 79 K C T 161.52 1.76 9.58 12.83 108.42 -95.95 -66.94 126.17 82.85 11.52 5.63 24.29 15.62 43.57 1.14 4.01 0.01 10.05 1.31 80 G C T 66.49 0.52 11.15 10.52 100.03 9.96 79.34 -5.22 94.85 1.28 3.87 23.25 17.14 54.69 0.63 3.06 0.00 0.91 0.32 81 K C C 141.11 2.59 8.63 12.92 115.20 85.99 -103.89 143.04 89.69 7.19 3.12 38.18 29.58 22.30 0.43 2.81 0.00 5.83 0.86 82 N C C 119.58 1.56 12.10 14.31 116.99 -103.63 -93.93 136.20 68.89 30.13 0.98 49.90 14.17 3.54 0.20 0.79 0.00 30.32 1.09 83 V E E 76.57 9.90 9.15 19.92 113.54 -113.12 -75.91 134.56 41.17 58.27 0.56 36.40 2.98 0.86 0.16 0.39 0.00 58.00 1.21 84 I E E 82.85 5.92 12.67 20.36 115.93 -157.94 -105.19 133.63 23.86 75.65 0.49 19.36 3.54 1.07 0.15 0.34 0.00 74.80 0.74 85 N E E 94.67 6.92 12.56 20.81 116.56 -117.86 -97.93 125.95 18.20 81.35 0.45 14.12 2.91 0.99 0.11 0.31 0.00 81.15 0.40 86 R E E 115.49 7.10 13.60 22.32 125.15 -176.39 -124.72 140.69 17.05 82.56 0.39 13.59 2.25 0.76 0.08 0.26 0.00 82.78 0.28 87 E E E 108.80 8.43 13.70 23.45 120.24 -145.98 -105.97 134.21 11.22 88.54 0.24 9.47 1.15 0.38 0.06 0.16 0.00 88.56 0.23 88 R E E 97.29 9.70 15.87 26.66 126.70 -175.64 -127.94 140.99 8.47 91.38 0.15 7.41 0.76 0.21 0.04 0.10 0.00 91.22 0.25 89 F E E 105.32 8.72 18.31 27.86 117.17 -138.30 -95.78 132.04 11.66 88.26 0.09 10.45 0.90 0.11 0.03 0.06 0.00 87.93 0.53 90 I E E 21.56 19.37 13.61 32.94 119.33 -163.98 -111.34 127.18 22.16 77.74 0.11 21.54 0.61 0.08 0.02 0.06 0.00 77.36 0.33 91 S E E 54.75 6.61 21.66 28.88 97.04 -162.58 -79.60 -33.57 36.27 63.59 0.14 16.99 17.89 0.79 0.01 0.12 0.00 64.07 0.13 92 K E E 77.15 9.64 22.84 32.89 133.73 13.48 -142.53 142.65 6.18 93.71 0.10 4.59 1.11 0.20 0.01 0.07 0.00 93.96 0.06 93 L E E 13.15 23.48 17.69 40.92 127.67 -171.25 -131.08 138.36 0.67 99.32 0.01 0.58 0.04 0.00 0.00 0.00 0.00 99.36 0.01 94 F E E 41.11 12.47 26.34 39.58 120.69 -160.59 -113.93 130.67 0.19 99.81 0.00 0.16 0.01 0.00 0.00 0.00 0.00 99.82 0.01 95 L E E 14.50 23.11 18.44 41.62 118.37 -161.13 -109.51 126.74 2.15 97.84 0.01 1.77 0.13 0.01 0.00 0.00 0.00 98.03 0.05 96 R E E 91.99 9.55 23.39 33.03 119.56 174.20 -127.02 117.40 26.62 73.21 0.17 21.47 4.01 0.87 0.03 0.15 0.00 72.89 0.57 97 G C T 29.87 9.21 21.40 31.09 112.63 -49.56 61.87 -134.88 94.09 3.45 2.46 2.60 27.75 63.92 0.05 2.59 0.00 2.77 0.33 98 D C T 78.96 10.73 19.64 30.75 96.79 -18.23 -93.12 7.42 96.04 1.76 2.20 2.96 27.25 65.58 0.06 2.50 0.00 1.46 0.20 99 S E E 26.94 14.22 21.01 35.71 124.92 93.97 -105.13 142.49 28.39 70.58 1.04 14.58 9.31 6.19 0.09 1.06 0.00 68.20 0.56 100 V E E 16.23 21.26 19.63 40.59 121.35 -157.51 -115.93 128.51 2.58 97.41 0.01 2.32 0.14 0.01 0.00 0.00 0.00 97.44 0.08 101 I E E 32.54 15.66 23.84 39.38 117.56 -164.42 -109.42 125.78 1.01 98.98 0.01 0.88 0.04 0.01 0.00 0.00 0.00 99.05 0.01 102 V E E 31.54 16.06 23.09 38.87 121.02 -162.44 -114.85 129.67 0.58 99.42 0.01 0.53 0.02 0.00 0.00 0.00 0.00 99.43 0.01 103 V E E 24.39 17.66 20.59 38.34 118.57 -164.19 -111.55 125.75 1.34 98.65 0.01 1.28 0.06 0.01 0.00 0.00 0.00 98.62 0.03 104 L E E 40.30 13.71 18.92 33.28 124.81 -167.89 -114.23 142.63 9.46 90.50 0.04 8.65 0.54 0.07 0.01 0.02 0.00 90.43 0.27 105 K C E 103.04 9.58 17.91 27.85 114.21 -129.54 -86.66 135.14 50.56 49.29 0.15 36.32 13.34 0.79 0.03 0.14 0.00 48.71 0.68 106 T C C 65.96 8.34 14.32 23.82 117.18 -94.83 -93.68 133.98 86.96 12.76 0.29 50.79 33.95 1.98 0.04 0.28 0.00 12.29 0.67 107 P C C 75.58 7.63 12.67 21.54 111.20 -110.91 -68.40 144.91 93.50 5.36 1.14 71.45 13.77 7.83 0.16 1.22 0.00 4.92 0.66 108 V C C 84.98 7.97 8.99 18.16 111.06 -132.10 -87.94 122.26 94.52 3.96 1.52 88.44 1.80 4.70 0.33 0.94 0.00 2.69 1.10 109 E C C 149.04 1.91 13.82 16.61 109.48 -139.91 -88.74 117.75 99.88 0.11 0.01 99.84 0.06 0.03 0.00 0.00 0.00 0.06 0.01