# 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 D C C 98.30 4.37 19.78 24.62 106.51 -149.07 -83.51 91.28 99.85 0.14 0.00 99.73 0.14 0.02 0.00 0.00 0.00 0.10 0.00 1 I C C 45.92 18.25 11.46 28.86 117.60 -155.06 -101.10 128.14 55.26 44.66 0.08 54.29 0.55 0.14 0.02 0.04 0.00 44.17 0.79 2 V E E 74.54 6.72 19.36 27.17 120.33 -166.04 -114.05 131.56 15.46 84.46 0.08 14.15 0.99 0.13 0.03 0.04 0.00 83.84 0.82 3 M E E 50.04 18.39 13.74 31.60 122.10 -163.26 -112.20 132.80 9.75 90.20 0.05 9.18 0.54 0.08 0.02 0.02 0.00 89.59 0.57 4 T E E 67.95 7.50 20.56 28.97 124.66 -172.08 -123.43 140.05 17.20 82.73 0.08 15.38 1.34 0.17 0.02 0.05 0.00 82.06 0.97 5 Q E E 64.38 15.77 14.57 29.87 127.50 -170.09 -126.06 143.11 46.16 53.71 0.12 37.25 8.09 0.55 0.03 0.12 0.00 52.60 1.37 6 S C C 56.56 8.03 18.19 26.99 120.37 -138.10 -98.11 144.74 86.64 13.22 0.14 73.12 12.19 0.67 0.02 0.14 0.00 13.10 0.76 7 P C S 58.63 10.26 15.89 26.74 114.14 -33.94 -71.98 155.91 79.16 8.82 12.02 24.34 27.93 26.81 0.65 11.86 0.00 7.72 0.68 8 D C S 92.56 7.73 17.70 26.07 98.32 -138.26 -85.43 -10.43 71.35 17.98 10.67 15.40 29.88 27.18 0.62 9.75 0.01 16.26 0.91 9 S E E 51.22 8.70 19.59 29.06 136.74 19.77 -146.70 151.56 36.63 54.20 9.17 25.19 7.69 5.19 0.75 8.01 0.00 52.38 0.78 10 L E E 29.71 19.48 15.67 34.72 129.08 -171.24 -135.36 140.12 7.49 92.44 0.07 6.49 0.84 0.08 0.02 0.04 0.00 92.17 0.37 11 A E E 57.28 8.78 23.65 32.92 119.65 -149.01 -107.09 132.62 2.21 97.77 0.01 2.02 0.12 0.01 0.00 0.00 0.00 97.76 0.09 12 V E E 15.42 20.43 14.94 35.32 133.92 177.51 -137.40 153.01 5.14 94.85 0.01 4.88 0.19 0.01 0.00 0.01 0.00 94.67 0.22 13 S E E 49.88 5.65 23.47 29.08 120.22 -117.19 -82.07 155.16 29.67 70.22 0.11 27.89 1.32 0.18 0.04 0.07 0.00 67.23 3.27 14 L C T 66.56 15.26 14.00 29.08 109.19 -84.65 -60.05 134.92 98.64 0.90 0.46 0.45 3.30 95.28 0.03 0.30 0.00 0.54 0.10 15 G C T 47.21 3.86 19.58 24.18 95.80 22.65 88.87 -6.68 99.41 0.28 0.31 0.50 3.80 95.23 0.02 0.23 0.00 0.19 0.04 16 E C C 83.02 8.04 17.32 26.63 122.88 118.75 -84.96 151.61 96.31 3.48 0.21 59.56 36.46 0.68 0.04 0.17 0.00 2.51 0.58 17 R C C 131.98 8.08 18.40 27.95 121.71 -129.55 -104.09 139.70 79.29 20.69 0.03 79.52 0.66 0.04 0.00 0.01 0.00 18.99 0.77 18 V E E 15.88 20.95 14.70 35.51 130.02 -173.00 -130.38 147.79 2.99 97.01 0.00 3.07 0.05 0.00 0.00 0.00 0.00 96.64 0.23 19 T E E 67.15 7.89 24.19 32.73 120.08 -148.55 -113.13 130.70 0.67 99.33 0.00 0.65 0.02 0.00 0.00 0.00 0.00 99.30 0.03 20 L E E 7.29 24.93 15.88 41.28 120.03 -166.80 -114.65 128.08 4.03 95.96 0.01 3.76 0.17 0.01 0.00 0.00 0.00 95.92 0.13 21 N E E 75.77 7.10 26.52 34.10 115.07 -156.39 -104.35 123.69 30.04 69.92 0.03 27.59 1.28 0.08 0.00 0.02 0.00 70.79 0.22 22 C E E 6.69 25.26 15.30 40.62 126.01 -173.67 -123.46 138.96 44.47 55.35 0.18 42.10 1.67 0.20 0.05 0.10 0.00 55.04 0.85 23 K E E 99.70 7.11 26.24 33.92 120.75 -160.22 -108.26 135.03 25.61 73.56 0.83 21.11 2.52 0.56 0.61 0.40 0.01 60.85 13.94 24 S C C 16.21 22.32 15.50 36.81 123.51 -163.12 -109.07 148.52 51.89 44.47 3.64 44.09 5.02 1.63 2.36 1.66 0.02 39.76 5.47 25 S C C 42.31 9.53 21.10 30.97 114.77 -138.07 -90.49 155.93 70.22 14.41 15.37 53.83 11.18 4.68 10.91 5.01 0.02 12.05 2.32 26 Q H H 96.90 10.54 16.94 27.59 95.09 -121.42 -67.30 -24.83 36.35 3.01 60.65 13.26 9.02 14.28 36.25 24.19 0.18 1.94 0.87 27 S H H 64.53 5.29 19.72 25.55 95.04 64.89 -70.02 -28.46 31.44 3.40 65.16 12.13 6.07 12.77 37.51 28.19 0.13 2.44 0.76 28 L H H 39.27 16.42 16.16 32.10 96.04 56.48 -77.39 -25.16 28.56 5.64 65.80 11.18 6.20 11.44 38.30 27.40 0.26 4.07 1.15 29 L H H 42.57 17.02 15.38 31.70 100.45 59.97 -86.09 -7.00 39.06 11.94 49.01 17.41 9.29 14.37 31.50 15.52 0.73 7.98 3.20 30 A C C 62.14 7.14 16.29 24.35 103.22 75.22 -85.52 -2.81 63.70 11.87 24.43 33.38 17.45 13.99 17.94 6.11 0.27 6.54 4.33 31 S C C 55.25 6.77 13.37 21.50 118.43 80.83 -98.18 151.74 82.69 7.73 9.57 48.90 19.72 14.39 5.71 3.72 0.02 4.17 3.36 32 S C T 81.73 4.18 13.07 18.50 96.82 -114.69 -74.34 -15.19 90.72 1.66 7.62 20.62 23.70 46.96 2.35 4.66 0.00 0.91 0.79 33 N C T 111.20 3.32 14.92 19.15 99.31 50.27 -89.60 7.93 92.63 1.15 6.22 18.03 25.30 49.48 1.36 4.64 0.00 0.63 0.56 34 N C C 68.68 11.54 13.66 25.65 109.00 93.19 -94.21 91.29 88.19 6.12 5.70 36.32 34.58 17.72 1.03 4.62 0.00 3.39 2.35 35 K C C 92.78 9.63 19.63 29.53 114.89 -132.02 -96.73 129.92 85.04 12.24 2.72 57.61 18.47 8.87 0.54 2.35 0.00 9.94 2.22 36 N C C 31.51 19.05 18.86 36.97 113.25 -159.64 -98.32 118.49 68.03 30.51 1.46 50.54 12.76 4.01 0.26 1.23 0.00 29.67 1.52 37 Y E E 38.50 16.26 25.01 41.22 132.38 166.10 -131.93 151.54 21.69 78.17 0.13 18.90 2.45 0.26 0.03 0.10 0.00 77.46 0.81 38 L E E 3.45 26.04 22.12 48.53 124.14 -154.66 -118.39 136.64 3.16 96.83 0.01 2.83 0.23 0.02 0.00 0.00 0.00 96.83 0.09 39 A E E 9.69 19.02 27.22 45.78 131.44 -171.23 -128.50 148.12 0.71 99.29 0.00 0.66 0.02 0.00 0.00 0.00 0.00 99.30 0.01 40 W E E 10.50 23.80 22.65 46.23 125.25 -153.79 -116.40 140.57 0.48 99.52 0.00 0.45 0.01 0.00 0.00 0.00 0.00 99.53 0.01 41 Y E E 24.21 17.27 23.65 40.89 132.50 -173.34 -132.27 149.55 0.44 99.56 0.00 0.38 0.01 0.00 0.00 0.00 0.00 99.59 0.01 42 Y E E 51.18 14.68 21.46 36.40 121.74 -145.68 -112.00 134.63 1.50 98.50 0.00 1.27 0.09 0.00 0.00 0.00 0.00 98.59 0.05 43 Q E E 48.22 14.36 15.65 30.57 120.39 -156.47 -108.34 135.97 22.05 77.94 0.01 20.37 1.05 0.04 0.00 0.01 0.00 77.56 0.96 44 K C C 96.96 6.28 15.78 23.33 119.14 -136.69 -88.92 145.38 97.72 2.26 0.02 96.25 1.63 0.13 0.00 0.02 0.00 1.65 0.32 45 P C T 100.80 4.45 11.46 17.91 109.72 -87.74 -58.84 134.43 99.72 0.08 0.20 0.27 3.17 96.30 0.01 0.19 0.00 0.05 0.01 46 G C T 69.20 0.27 13.12 10.63 94.70 18.61 83.04 -3.21 99.74 0.06 0.20 0.34 3.07 96.32 0.01 0.21 0.00 0.03 0.01 47 Q C S 88.65 5.40 9.92 17.51 128.02 99.83 -112.28 155.35 95.42 4.36 0.23 33.00 62.02 0.72 0.04 0.17 0.00 1.49 2.56 48 A C C 78.16 1.97 17.44 19.18 116.57 -96.41 -66.94 149.40 98.14 1.84 0.02 91.31 6.85 0.15 0.00 0.02 0.00 1.42 0.25 49 P C C 45.02 17.96 10.96 28.14 115.11 -101.87 -64.44 144.96 93.80 6.19 0.02 92.10 1.71 0.11 0.00 0.02 0.00 5.86 0.21 50 K E E 94.77 7.69 21.34 29.78 125.03 -157.46 -122.00 138.96 10.00 89.97 0.03 8.75 1.05 0.08 0.01 0.02 0.00 89.54 0.57 51 L E E 61.31 15.80 18.22 33.61 110.72 -115.36 -74.86 127.26 0.71 99.28 0.00 0.65 0.02 0.00 0.00 0.00 0.00 99.30 0.02 52 L E E 22.65 17.90 20.73 38.77 101.39 176.50 -97.09 -35.70 1.71 98.29 0.00 1.12 0.46 0.01 0.00 0.00 0.00 98.40 0.01 53 I E E 11.56 21.04 21.20 42.33 137.13 5.03 -148.65 143.28 0.20 99.80 0.00 0.17 0.01 0.00 0.00 0.00 0.00 99.82 0.00 54 Y E E 58.83 16.73 23.75 39.59 127.75 -169.13 -130.09 134.98 0.56 99.44 0.01 0.49 0.02 0.00 0.00 0.00 0.00 99.47 0.01 55 W E E 29.83 20.18 21.23 40.79 122.24 -165.30 -116.85 133.79 11.69 88.11 0.20 10.21 0.94 0.16 0.09 0.07 0.00 88.21 0.32 56 A E E 28.53 14.60 22.23 36.64 123.43 -171.56 -120.42 142.19 48.17 48.17 3.66 33.96 11.27 3.95 1.19 2.13 0.01 46.36 1.12 57 S C C 29.29 14.32 19.45 33.78 127.39 -154.76 -126.21 147.82 72.56 20.78 6.66 45.59 19.27 8.50 2.50 3.81 0.02 18.14 2.18 58 T C C 59.17 11.52 17.28 29.12 106.39 -146.12 -97.76 25.41 72.28 13.72 14.00 46.24 16.51 9.90 7.50 6.48 0.06 9.29 4.02 59 R C C 123.89 8.03 15.37 24.19 108.96 93.72 -87.84 102.62 70.48 9.79 19.73 38.73 17.99 14.95 8.71 10.35 0.07 5.96 3.24 60 E C C 120.09 5.71 14.44 21.42 107.38 -118.69 -87.10 89.05 73.01 6.85 20.14 33.51 18.51 22.79 6.53 12.15 0.05 3.95 2.52 61 S C T 66.73 7.02 13.66 21.82 108.21 47.84 -88.60 96.67 82.48 3.33 14.19 24.00 20.24 39.26 4.09 9.11 0.02 1.82 1.45 62 G C T 51.05 4.36 16.29 21.54 102.83 -38.87 84.33 2.35 92.12 4.04 3.83 31.84 27.80 32.97 0.67 3.13 0.00 2.36 1.23 63 V C C 42.87 15.02 11.14 26.35 115.80 121.43 -98.10 128.16 88.69 10.67 0.64 60.93 26.44 1.70 0.23 0.44 0.00 5.00 5.26 64 P C C 68.75 7.20 17.10 25.34 111.89 -119.26 -66.37 148.00 90.86 6.29 2.84 57.97 16.03 16.68 0.55 2.57 0.00 4.60 1.60 65 N C C 95.02 9.15 17.35 26.90 103.28 -102.20 -75.46 66.05 90.42 6.15 3.43 48.40 20.49 21.61 0.43 3.37 0.00 4.70 1.00 66 R C S 83.64 12.74 18.73 31.37 101.78 121.02 -95.79 3.21 78.53 18.93 2.53 35.36 35.39 8.02 0.35 2.21 0.00 17.55 1.11 67 F E E 25.12 22.42 14.45 36.33 125.97 100.25 -120.42 138.73 17.55 81.94 0.52 14.19 3.43 0.75 0.19 0.32 0.00 79.80 1.31 68 S E E 51.36 7.73 23.89 32.73 134.34 -176.61 -137.36 154.66 5.96 93.94 0.10 5.26 0.55 0.10 0.04 0.04 0.00 93.57 0.43 69 G E E 20.94 19.17 15.56 33.45 140.59 155.75 -153.69 163.68 7.29 92.65 0.06 6.21 0.83 0.15 0.02 0.03 0.00 92.50 0.25 70 S E E 62.92 5.23 22.26 29.13 136.19 -166.50 -145.95 157.14 13.26 86.66 0.08 11.41 1.51 0.22 0.02 0.05 0.00 86.33 0.47 71 G E E 30.50 10.95 15.90 27.46 139.14 132.93 121.48 -164.96 32.56 67.28 0.15 23.34 8.89 1.15 0.02 0.16 0.00 65.49 0.94 72 S C E 76.04 3.50 21.07 25.12 115.76 -118.73 -120.14 116.98 54.30 45.03 0.66 35.34 16.30 4.39 0.12 0.72 0.00 39.69 3.44 73 G C S 33.17 10.32 19.07 29.54 108.37 -47.52 65.96 -128.07 97.66 1.28 1.07 2.70 49.11 46.05 0.03 1.05 0.00 0.87 0.19 74 S C S 41.78 15.34 16.40 31.54 97.75 -11.07 -97.30 -0.37 97.66 1.38 0.96 2.59 49.74 45.57 0.03 0.90 0.00 1.00 0.18 75 D E E 65.04 8.27 22.66 32.03 119.73 86.24 -107.95 130.25 40.89 58.72 0.38 27.81 12.39 1.94 0.06 0.43 0.00 54.93 2.44 76 F E E 9.11 24.53 15.57 40.40 130.33 -176.62 -131.28 145.74 19.56 80.43 0.01 18.49 0.61 0.04 0.00 0.01 0.00 80.50 0.36 77 T E E 41.30 9.85 27.18 37.96 123.65 -162.00 -120.55 135.25 4.27 95.73 0.00 3.93 0.12 0.00 0.00 0.00 0.00 95.89 0.06 78 L E E 3.55 26.08 18.41 45.33 119.58 -163.14 -112.75 128.60 0.32 99.68 0.00 0.35 0.00 0.00 0.00 0.00 0.00 99.64 0.01 79 T E E 44.75 9.72 27.10 37.46 121.24 -165.71 -116.31 129.41 0.10 99.90 0.00 0.11 0.00 0.00 0.00 0.00 0.00 99.88 0.00 80 I E E 8.70 24.11 15.92 40.46 118.33 -166.31 -114.76 123.16 2.04 97.96 0.00 2.09 0.02 0.00 0.00 0.00 0.00 97.68 0.21 81 S C C 52.66 6.41 23.01 29.69 127.05 -172.94 -118.01 150.68 90.14 9.77 0.09 47.05 30.06 11.02 0.00 0.13 0.00 11.42 0.30 82 G C S 45.33 3.70 23.93 27.75 95.41 13.95 65.64 41.92 99.10 0.87 0.03 7.65 80.22 11.24 0.00 0.05 0.00 0.77 0.07 83 L C C 17.74 24.08 10.28 33.66 114.63 -154.73 -74.74 137.08 99.29 0.71 0.01 98.36 1.08 0.02 0.00 0.00 0.00 0.30 0.24 84 Q C C 81.75 4.38 24.76 28.97 132.64 -173.52 -127.42 160.63 97.65 2.33 0.02 97.28 0.44 0.01 0.01 0.01 0.00 0.29 1.97 85 A H G 51.58 14.36 15.42 29.59 91.00 -100.76 -58.99 -33.25 3.24 0.02 96.74 0.17 0.22 2.08 0.25 97.27 0.00 0.02 0.00 86 E H G 124.60 4.01 22.08 26.89 90.19 62.67 -70.71 -16.71 2.87 0.04 97.09 0.10 0.17 1.93 0.17 97.60 0.00 0.03 0.00 87 D H G 14.36 20.73 17.43 38.52 93.97 61.07 -88.07 -1.75 3.72 0.05 96.23 0.40 0.35 1.81 0.21 97.18 0.00 0.04 0.00 88 V C C 28.16 18.09 21.33 39.50 115.81 105.82 -79.16 134.28 88.25 11.67 0.08 85.56 2.77 0.07 0.01 0.06 0.00 11.27 0.26 89 A E E 10.00 19.62 23.63 42.19 143.88 158.49 -152.51 170.64 3.67 96.33 0.00 3.53 0.19 0.01 0.00 0.00 0.00 96.02 0.25 90 V E E 29.27 15.79 26.32 42.00 118.89 -101.85 -107.58 130.85 0.38 99.61 0.00 0.37 0.01 0.00 0.00 0.00 0.00 99.61 0.01 91 Y E E 5.84 25.57 21.15 46.88 122.18 -165.16 -113.60 134.72 0.26 99.74 0.00 0.22 0.01 0.00 0.00 0.00 0.00 99.76 0.00 92 Y E E 29.53 17.05 27.60 44.34 128.11 -172.69 -122.66 145.13 0.81 99.19 0.00 0.71 0.03 0.00 0.00 0.00 0.00 99.24 0.01 93 C E E 2.64 25.57 21.72 47.52 124.87 -162.66 -118.90 138.69 3.53 96.46 0.02 3.09 0.23 0.02 0.00 0.01 0.00 96.59 0.06 94 Q E E 31.73 15.26 26.36 41.49 130.24 -171.84 -126.68 142.87 3.89 96.08 0.03 3.49 0.25 0.03 0.01 0.01 0.00 96.10 0.11 95 Q E E 23.30 19.86 19.77 39.15 121.96 -154.09 -111.92 133.95 7.09 92.85 0.06 5.93 0.89 0.12 0.01 0.03 0.00 92.80 0.22 96 Y E E 70.78 11.68 19.79 32.24 118.29 -154.95 -106.22 128.87 18.44 81.44 0.13 15.26 2.56 0.41 0.03 0.09 0.00 80.79 0.87 97 Y C E 79.34 12.20 13.77 26.67 119.26 174.82 -117.07 142.87 51.50 48.14 0.36 39.16 10.26 2.12 0.07 0.33 0.00 46.66 1.41 98 T C S 93.91 3.53 15.38 19.70 110.44 -85.60 -99.60 56.63 93.01 6.43 0.56 21.85 52.77 18.24 0.06 0.59 0.00 5.91 0.59 99 T C S 90.32 3.06 14.29 18.50 119.44 3.26 -107.42 137.89 96.09 3.35 0.57 20.76 58.46 16.89 0.06 0.59 0.00 2.77 0.48 100 P C C 78.49 5.57 15.77 22.41 114.92 -29.87 -72.55 149.07 79.24 20.20 0.56 50.73 21.93 5.45 0.08 0.54 0.00 20.40 0.86 101 L E E 57.11 15.75 13.36 28.94 115.05 -115.58 -80.85 136.17 47.39 52.32 0.29 41.78 3.39 0.82 0.06 0.22 0.00 52.84 0.89 102 T E E 55.16 10.62 20.23 31.33 124.31 -165.42 -118.57 138.91 16.91 82.91 0.17 14.86 1.43 0.28 0.06 0.10 0.00 80.42 2.86 103 F E E 61.94 18.08 16.57 33.76 119.07 -152.10 -103.84 132.23 21.76 78.02 0.22 18.00 3.08 0.64 0.08 0.15 0.00 74.69 3.36 104 G C C 23.83 12.93 19.42 32.04 120.79 -154.65 -86.73 -168.83 62.35 37.43 0.23 45.34 13.91 2.47 0.03 0.23 0.00 37.06 0.97 105 G C C 41.67 7.92 22.18 29.85 104.12 -72.26 -76.19 8.12 76.42 23.40 0.18 57.74 14.85 2.10 0.02 0.19 0.00 24.50 0.59 106 G C C 18.16 17.35 16.56 32.85 127.97 -136.77 98.95 175.54 67.76 32.15 0.09 58.72 6.12 0.54 0.01 0.09 0.00 33.94 0.57 107 T E E 34.17 15.44 19.78 35.26 127.94 -104.13 -122.99 144.98 11.86 88.13 0.01 10.80 0.55 0.03 0.00 0.01 0.00 88.35 0.25 108 K E E 102.20 9.95 22.56 32.80 119.36 -138.36 -100.73 134.54 1.09 98.91 0.00 0.97 0.05 0.00 0.00 0.00 0.00 98.95 0.03 109 V E E 12.86 22.34 14.93 37.17 122.08 -166.13 -117.05 132.05 0.67 99.33 0.00 0.66 0.01 0.00 0.00 0.00 0.00 99.30 0.02 110 E E E 97.15 5.56 23.62 29.57 117.07 -153.48 -104.25 128.43 2.05 97.94 0.00 2.02 0.07 0.01 0.00 0.00 0.00 97.80 0.10 111 I E E 25.95 20.99 10.94 31.17 115.37 -153.62 -98.56 126.90 20.06 79.91 0.04 20.27 0.20 0.03 0.01 0.01 0.00 78.83 0.64 112 K C C 128.91 3.99 19.75 24.55 113.81 -155.36 -94.54 130.63 99.45 0.55 0.00 99.50 0.05 0.01 0.00 0.00 0.00 0.42 0.01