# 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 58.15 8.33 19.64 28.14 111.41 -145.14 -91.06 125.10 99.87 0.12 0.01 99.86 0.06 0.01 0.00 0.00 0.00 0.06 0.01 1 I C C 53.12 17.62 11.56 28.24 116.62 -142.82 -95.10 129.40 85.59 13.54 0.87 85.91 0.69 0.53 0.41 0.25 0.00 7.53 4.69 2 Q C C 96.65 6.30 16.47 23.98 119.35 -153.19 -96.96 140.26 81.25 15.31 3.44 75.25 3.63 2.24 0.64 2.71 0.00 13.12 2.41 3 K C T 122.87 6.78 15.98 23.97 113.29 -106.57 -72.87 138.93 74.85 18.42 6.73 14.38 25.00 37.02 0.44 6.45 0.01 15.25 1.46 4 M C T 97.22 8.98 18.65 27.79 97.71 13.15 63.22 34.60 63.84 30.06 6.10 17.68 14.17 32.94 0.33 6.03 0.00 28.18 0.67 5 T C E 23.04 17.04 16.34 33.62 118.77 152.50 -87.06 142.71 52.14 47.59 0.27 46.32 4.31 0.35 0.04 0.21 0.00 48.32 0.46 6 R E E 97.27 10.44 24.15 34.63 119.61 -140.67 -104.39 133.79 4.29 95.66 0.05 4.10 0.21 0.02 0.03 0.02 0.00 94.81 0.80 7 V E E 6.09 24.79 17.60 42.66 126.01 -169.91 -121.86 139.60 3.38 96.58 0.04 3.07 0.16 0.02 0.02 0.01 0.00 96.62 0.10 8 R E E 88.20 10.39 26.39 37.02 116.43 -142.91 -101.88 129.07 4.76 95.13 0.11 4.15 0.31 0.07 0.05 0.03 0.00 95.28 0.12 9 V E E 10.51 23.10 17.62 40.73 115.54 -152.25 -100.64 125.18 14.54 85.06 0.40 13.58 0.74 0.19 0.21 0.14 0.00 84.50 0.64 10 V C E 46.77 11.98 22.23 34.48 104.81 -165.63 -98.30 -11.98 50.11 48.73 1.16 37.04 11.00 2.49 0.38 0.74 0.00 46.97 1.36 11 D C C 57.94 10.28 20.73 31.26 119.08 29.03 -118.76 118.24 75.85 21.47 2.67 40.55 28.32 8.23 0.82 1.76 0.02 18.27 2.03 12 N C C 56.54 15.49 14.80 30.13 100.96 -166.15 -96.34 19.71 77.35 6.98 15.67 42.88 20.17 15.06 5.93 9.38 0.04 3.98 2.55 13 S C T 62.50 5.51 18.26 24.51 95.53 109.35 -71.55 -26.79 61.96 2.79 35.26 20.28 15.24 27.56 11.05 22.94 0.07 1.40 1.46 14 A C T 57.48 6.84 17.24 24.87 95.78 55.84 -73.64 -13.61 59.26 3.18 37.56 21.33 11.95 26.96 12.49 23.96 0.07 1.65 1.59 15 L C T 41.03 17.72 11.40 28.05 99.50 73.61 -80.41 -3.19 62.66 2.89 34.46 20.74 12.87 29.74 10.35 23.11 0.08 1.41 1.70 16 G C T 45.54 6.19 16.37 23.38 102.39 -29.49 77.67 -5.21 80.64 1.51 17.85 21.65 15.34 44.01 5.88 11.42 0.01 0.74 0.94 17 N C T 116.04 2.95 15.15 18.97 102.60 57.44 -93.06 10.31 85.57 2.27 12.16 28.36 28.02 29.84 2.96 8.52 0.01 1.05 1.25 18 S C C 52.41 7.57 12.34 21.38 120.46 100.71 -101.69 143.43 93.03 4.25 2.72 49.47 40.07 3.52 1.06 1.51 0.00 1.73 2.63 19 P C C 89.39 5.43 13.97 20.75 100.36 -110.59 -67.79 -12.30 77.33 3.61 19.06 41.08 12.84 21.99 1.90 18.88 0.00 2.22 1.10 20 Y C C 113.72 9.56 13.21 23.46 109.25 74.04 -90.58 104.01 73.44 6.19 20.36 30.08 15.85 28.02 1.92 18.66 0.02 3.69 1.75 21 H C C 102.64 10.10 15.87 26.35 105.34 115.79 -89.47 60.05 73.50 8.00 18.50 39.73 16.62 16.71 1.88 17.87 0.01 5.13 2.04 22 R C C 104.97 9.61 19.68 29.80 121.26 108.00 -105.13 137.23 85.69 11.55 2.75 61.37 21.52 2.93 0.63 2.30 0.00 7.13 4.14 23 A C C 39.91 14.24 21.77 35.43 116.07 -106.64 -70.51 146.80 91.83 8.09 0.08 87.83 4.10 0.20 0.02 0.06 0.00 6.91 0.89 24 P C C 6.13 24.74 16.77 42.23 116.54 -106.95 -68.78 149.32 83.10 16.87 0.03 81.27 1.42 0.08 0.01 0.02 0.00 16.64 0.56 25 R E E 83.78 12.08 27.38 39.77 121.68 -140.09 -104.99 137.73 8.12 91.85 0.03 6.84 1.26 0.07 0.01 0.03 0.00 90.77 1.03 26 C E E 9.98 23.62 21.10 44.47 117.43 -137.85 -96.09 131.98 1.14 98.86 0.00 1.03 0.05 0.00 0.00 0.00 0.00 98.81 0.10 27 I E E 15.25 20.55 24.11 43.74 121.14 -168.32 -113.68 131.65 1.27 98.72 0.00 1.10 0.10 0.01 0.00 0.00 0.00 98.75 0.04 28 H E E 62.64 13.41 26.12 39.11 123.52 -146.27 -115.18 136.89 3.12 96.87 0.01 2.74 0.19 0.02 0.00 0.01 0.00 96.95 0.10 29 V E E 13.58 21.90 16.28 38.26 113.07 -137.27 -91.89 124.31 16.53 83.26 0.22 16.16 0.62 0.12 0.09 0.10 0.00 81.37 1.53 30 Y C C 94.77 9.63 20.25 30.43 99.76 -167.21 -86.26 -23.95 67.88 31.25 0.88 39.65 26.87 3.51 0.25 0.70 0.01 26.44 2.56 31 K C S 92.03 6.75 16.56 24.52 127.84 41.64 -124.00 150.70 79.38 18.90 1.72 35.93 36.15 8.40 0.40 1.39 0.02 13.56 4.16 32 K C T 146.06 5.03 13.19 20.21 98.17 -124.81 -68.14 -16.90 91.54 4.85 3.62 13.97 37.07 40.96 0.44 3.06 0.00 3.15 1.36 33 N C T 123.23 1.56 17.29 18.27 102.36 54.96 -90.56 35.17 94.09 2.41 3.50 8.86 37.88 47.67 0.34 3.03 0.00 1.49 0.73 34 G C S 33.88 10.18 15.20 25.75 102.32 -83.58 86.97 0.65 89.83 8.12 2.05 19.99 56.37 13.74 0.23 1.95 0.00 5.42 2.28 35 V C C 59.57 10.04 20.25 30.78 118.15 105.66 -96.47 136.97 82.72 16.55 0.73 62.25 16.39 3.66 0.25 0.62 0.00 10.00 6.84 36 G C C 7.47 23.08 14.10 36.34 120.30 -153.08 -99.06 145.28 84.97 14.63 0.40 72.65 9.96 1.72 0.13 0.34 0.00 9.47 5.73 37 K C C 98.31 5.63 25.49 31.99 134.50 -166.59 -129.87 160.19 86.87 12.63 0.50 73.15 11.88 1.63 0.17 0.37 0.00 6.10 6.71 38 V C T 67.73 14.42 17.63 31.70 108.99 -74.28 -59.77 133.11 98.26 1.33 0.41 0.24 2.42 96.23 0.01 0.23 0.00 0.69 0.17 39 G C T 32.41 7.84 21.87 30.64 96.89 25.49 89.81 -5.68 99.55 0.32 0.13 0.43 2.30 96.86 0.00 0.13 0.00 0.26 0.01 40 D C C 21.22 17.01 18.09 35.90 116.86 136.45 -70.03 144.97 96.16 3.82 0.02 95.13 1.29 0.06 0.00 0.02 0.00 3.37 0.13 41 Q E E 65.85 12.11 25.18 37.28 120.10 -131.29 -104.12 135.05 2.04 97.95 0.00 2.14 0.05 0.00 0.00 0.00 0.00 97.62 0.20 42 I E E 2.78 25.50 19.30 45.57 131.78 -172.35 -131.55 148.88 0.10 99.90 0.00 0.09 0.00 0.00 0.00 0.00 0.00 99.90 0.00 43 L E E 30.03 13.17 26.62 40.73 115.93 -133.86 -99.20 128.11 0.05 99.95 0.00 0.05 0.00 0.00 0.00 0.00 0.00 99.95 0.00 44 L E E 3.29 25.12 18.59 44.35 131.03 -175.60 -127.03 149.66 0.05 99.95 0.00 0.04 0.00 0.00 0.00 0.00 0.00 99.96 0.00 45 A E E 21.37 10.87 23.43 35.81 117.56 -135.64 -103.69 130.94 0.17 99.83 0.00 0.15 0.00 0.00 0.00 0.00 0.00 99.85 0.00 46 I E E 15.56 20.80 13.54 34.30 118.37 -175.05 -126.53 118.71 3.02 96.97 0.01 2.35 0.32 0.05 0.00 0.01 0.00 97.16 0.11 47 K C T 133.61 5.56 15.71 22.79 94.26 -18.52 52.01 46.99 98.97 0.84 0.19 1.98 4.48 92.61 0.01 0.16 0.00 0.72 0.04 48 G C T 64.24 1.01 15.16 15.55 95.17 -47.73 80.83 0.56 99.71 0.17 0.12 1.55 4.71 93.47 0.01 0.11 0.00 0.13 0.01 49 Q E E 99.08 4.28 14.81 20.99 123.92 104.95 -112.13 143.42 8.13 91.85 0.02 5.80 1.85 0.18 0.00 0.02 0.00 91.93 0.21 50 K E E 117.50 8.88 14.36 24.81 117.77 -138.00 -95.93 132.05 3.02 96.98 0.00 2.63 0.12 0.01 0.00 0.00 0.00 97.22 0.03 51 K E E 58.61 13.23 17.78 31.64 132.48 176.67 -135.19 149.46 1.48 98.52 0.00 1.30 0.04 0.00 0.00 0.00 0.00 98.65 0.01 52 K E E 90.95 10.62 23.65 34.27 117.49 -125.30 -90.41 137.83 0.98 99.02 0.00 0.81 0.03 0.00 0.00 0.00 0.00 99.15 0.01 53 A E E 3.45 23.96 19.50 43.67 137.90 175.98 -141.10 158.99 0.92 99.08 0.00 0.79 0.02 0.00 0.00 0.00 0.00 99.19 0.00 54 L E E 19.40 17.27 27.25 44.69 119.29 -122.89 -106.16 132.57 0.10 99.90 0.00 0.08 0.00 0.00 0.00 0.00 0.00 99.92 0.00 55 I E E 6.93 24.22 23.41 47.84 110.08 -126.45 -80.32 123.62 0.19 99.81 0.00 0.17 0.00 0.00 0.00 0.00 0.00 99.82 0.00 56 V E E 11.68 20.74 25.01 45.36 102.55 175.12 -104.18 -20.97 8.33 91.62 0.05 5.54 2.11 0.42 0.00 0.04 0.00 91.78 0.10 57 G E E 7.77 16.19 25.60 41.51 146.58 -19.64 -173.97 170.36 37.66 62.22 0.12 13.42 22.10 2.42 0.01 0.12 0.00 61.42 0.50 58 H E E 59.72 16.35 21.16 36.65 130.00 -115.53 -127.37 144.63 48.56 51.14 0.29 43.26 3.95 0.49 0.10 0.21 0.00 48.29 3.70 59 C C C 44.74 14.34 16.65 31.12 114.50 -127.60 -89.40 131.20 74.83 24.93 0.24 55.53 18.20 1.21 0.07 0.24 0.00 20.26 4.49 60 M C C 92.36 7.54 15.66 24.49 120.36 -155.82 -107.70 135.87 85.26 14.62 0.11 58.54 26.38 1.01 0.03 0.12 0.00 11.42 2.51 61 P C C 95.29 4.85 12.84 19.55 112.51 -106.37 -68.27 142.80 90.91 8.84 0.25 72.39 15.23 3.12 0.05 0.28 0.00 7.12 1.82 62 G C C 37.73 5.28 10.05 17.20 131.68 155.34 -146.58 172.54 92.44 7.24 0.32 61.73 27.56 3.34 0.07 0.33 0.00 3.70 3.28 63 P C C 112.56 1.58 12.25 14.23 110.36 -59.11 -75.30 136.14 94.77 4.13 1.11 60.32 23.58 10.71 0.17 1.19 0.00 2.17 1.85 64 R C C 161.74 3.03 10.38 15.01 111.40 13.53 -82.65 140.27 97.19 1.56 1.25 33.60 29.95 33.60 0.16 1.25 0.00 0.87 0.56 65 M C C 125.21 4.82 12.23 18.35 100.43 -84.21 -81.00 -1.18 94.36 4.50 1.14 33.68 31.54 29.41 0.14 1.21 0.00 2.80 1.22 66 T C S 64.92 7.87 14.79 24.03 117.57 96.05 -110.47 124.39 85.72 13.99 0.30 41.14 44.91 1.09 0.09 0.22 0.00 8.19 4.36 67 P C C 32.13 17.13 13.37 30.44 115.43 -119.50 -70.35 145.81 88.04 11.66 0.30 82.08 4.67 0.96 0.08 0.23 0.00 9.73 2.25 68 R C C 123.33 7.16 21.45 29.18 116.16 -143.43 -101.42 132.10 68.01 31.51 0.48 59.78 6.19 1.11 0.19 0.36 0.00 21.05 11.33 69 F C C 37.51 21.03 12.84 32.68 121.43 -162.75 -109.39 139.95 59.27 40.18 0.54 52.57 4.82 0.87 0.24 0.36 0.00 26.07 15.07 70 D C C 88.77 5.96 21.70 27.97 101.69 -164.34 -96.49 -12.44 79.31 19.49 1.20 51.78 23.53 4.03 0.24 1.15 0.00 16.75 2.52 71 S C S 50.49 8.63 22.05 30.65 128.88 19.11 -128.54 159.83 77.41 19.95 2.64 13.25 41.44 23.69 0.23 2.46 0.01 17.24 1.67 72 N C C 42.32 17.56 20.11 36.45 108.89 -49.71 -86.50 102.05 72.73 24.94 2.33 39.41 18.27 15.33 0.19 2.28 0.00 23.48 1.05 73 N E E 18.25 19.72 23.85 42.67 117.88 -165.58 -106.49 136.76 39.63 59.82 0.56 34.51 4.10 0.55 0.08 0.47 0.00 59.20 1.09 74 V E E 5.93 23.90 25.09 48.40 125.14 -160.90 -119.09 137.95 3.37 96.61 0.02 3.23 0.19 0.02 0.01 0.01 0.00 96.11 0.44 75 V E E 4.72 23.30 27.02 49.67 124.01 -165.27 -119.95 134.77 0.62 99.38 0.00 0.60 0.02 0.00 0.00 0.00 0.00 99.35 0.03 76 L E E 8.88 21.38 25.81 46.96 115.11 -138.49 -94.84 127.23 0.72 99.28 0.00 0.65 0.03 0.00 0.00 0.00 0.00 99.30 0.02 77 I E E 11.79 19.98 18.93 39.34 127.31 -169.11 -119.43 144.20 0.72 99.28 0.00 0.79 0.02 0.00 0.00 0.00 0.00 95.64 3.55 78 E C C 62.08 8.71 19.16 28.76 123.07 -124.22 -79.43 171.97 89.50 10.48 0.02 90.35 0.33 0.05 0.00 0.01 0.00 8.55 0.70 79 D C T 105.28 6.68 15.03 23.48 91.30 -90.37 -63.47 -22.04 99.39 0.23 0.37 0.21 2.16 97.08 0.00 0.36 0.00 0.16 0.03 80 N C T 117.09 1.51 18.64 18.99 92.87 54.99 -89.64 1.82 99.49 0.05 0.46 0.14 2.14 97.21 0.00 0.48 0.00 0.02 0.01 81 G C S 16.97 16.77 12.65 29.30 95.56 -105.73 84.39 7.30 99.21 0.34 0.45 13.69 84.87 0.84 0.03 0.30 0.00 0.12 0.15 82 N C C 86.80 3.61 22.59 26.68 117.68 137.32 -85.32 139.02 98.26 1.71 0.03 91.47 6.88 0.11 0.01 0.01 0.00 0.78 0.74 83 P E B 38.57 20.32 12.72 32.17 112.61 -108.15 -66.36 139.20 4.52 95.44 0.04 3.59 0.17 0.01 0.05 0.00 0.00 19.19 76.98 84 V C C 74.89 8.29 19.74 28.61 106.74 -168.78 -100.88 7.11 77.37 21.85 0.77 56.00 15.34 5.53 0.12 0.91 0.00 19.56 2.55 85 G C S 29.76 9.89 17.53 27.90 131.59 1.76 118.98 -166.71 85.22 14.06 0.72 30.68 46.70 8.00 0.08 0.79 0.00 12.23 1.52 86 T C C 80.71 8.81 18.19 27.55 103.11 -97.60 -98.63 7.74 87.75 11.64 0.60 59.47 25.50 2.68 0.09 0.64 0.00 10.33 1.30 87 R C C 127.11 7.38 20.66 28.84 118.84 95.57 -96.48 135.11 75.49 24.05 0.45 67.11 6.94 0.94 0.13 0.38 0.00 19.81 4.69 88 I C C 22.73 22.48 11.93 33.80 114.73 -128.04 -95.52 124.22 54.06 45.74 0.20 52.69 1.77 0.23 0.10 0.10 0.00 27.78 17.33 89 K C C 131.88 4.63 22.70 28.16 100.95 -172.06 -100.63 -4.56 78.34 21.58 0.08 59.64 18.50 0.54 0.02 0.08 0.00 18.10 3.12 90 T C S 38.08 12.78 19.70 33.03 129.65 56.87 -122.79 150.98 87.00 12.96 0.05 27.21 59.65 0.68 0.01 0.04 0.00 11.57 0.83 91 P C C 57.90 11.31 23.92 35.14 115.05 -94.05 -66.26 148.34 87.48 12.44 0.07 77.12 10.35 0.44 0.02 0.07 0.00 10.15 1.85 92 I C C 7.22 25.24 15.80 41.54 114.18 -117.95 -85.26 131.05 72.44 27.46 0.10 69.61 3.10 0.10 0.07 0.04 0.00 18.33 8.76 93 P C C 21.21 14.90 19.88 35.79 112.99 -109.12 -64.63 143.85 78.76 20.98 0.27 79.41 0.74 0.13 0.15 0.07 0.00 16.36 3.14 94 T H H 73.14 7.51 19.50 28.09 92.07 -124.49 -61.14 -34.23 12.99 0.26 86.76 2.82 1.80 7.19 53.90 34.02 0.03 0.15 0.08 95 S H H 50.76 5.62 19.76 26.40 91.13 59.99 -64.86 -32.78 7.70 0.19 92.10 1.27 0.85 4.83 57.60 35.25 0.02 0.14 0.03 96 L H H 12.22 20.37 13.13 33.55 92.23 53.59 -69.44 -31.08 4.59 0.12 95.28 1.01 0.59 2.59 57.29 38.40 0.00 0.10 0.01 97 R H H 84.66 14.27 14.10 28.15 92.14 63.47 -68.28 -25.34 18.39 0.63 80.98 4.12 2.78 9.99 55.81 26.62 0.09 0.37 0.23 98 K C T 150.33 1.71 17.59 18.81 95.65 57.23 -79.10 -11.93 53.36 1.78 44.85 13.28 8.55 31.18 30.90 13.95 0.16 0.88 1.10 99 R C C 119.03 7.35 11.30 19.91 112.59 83.59 -84.04 135.86 78.70 1.47 19.83 32.56 25.42 20.77 16.27 3.49 0.02 0.55 0.93 100 E C C 136.68 3.12 13.87 17.92 113.07 -90.52 -92.62 133.30 86.23 0.65 13.12 37.45 22.38 26.46 9.62 3.40 0.00 0.26 0.43 101 G C T 48.68 2.77 15.56 18.88 113.53 4.22 77.26 -145.65 73.18 0.67 26.15 20.54 22.48 30.81 19.10 6.33 0.02 0.27 0.44 102 E C H 100.01 8.14 16.11 24.86 98.28 2.15 -74.95 -10.63 57.54 2.32 40.13 31.22 10.90 16.65 32.24 6.74 0.06 1.15 1.03 103 Y H H 41.74 19.50 12.54 31.06 95.56 82.97 -78.49 -13.75 39.92 1.47 58.61 31.26 4.29 6.09 53.18 3.90 0.01 0.72 0.55 104 S H H 57.92 5.84 19.69 26.43 92.42 84.01 -62.68 -38.11 8.90 0.20 90.90 6.89 1.09 1.72 88.97 1.17 0.00 0.10 0.06 105 K H H 106.62 5.09 22.49 27.84 92.09 51.41 -65.48 -39.81 2.28 0.16 97.56 1.26 0.29 0.85 96.55 0.90 0.00 0.12 0.03 106 V H H 7.90 22.67 17.48 40.01 92.24 49.68 -65.12 -43.04 1.29 0.36 98.35 0.61 0.14 0.53 97.67 0.68 0.00 0.33 0.04 107 L H H 39.57 16.18 19.99 35.67 91.42 51.49 -62.84 -41.41 1.42 0.54 98.05 0.64 0.15 0.54 97.55 0.54 0.00 0.49 0.08 108 A H H 55.06 3.05 23.79 26.04 91.27 51.06 -63.65 -40.95 2.84 0.50 96.65 1.26 0.36 1.21 95.88 0.76 0.01 0.40 0.11 109 I H H 35.68 12.39 19.46 32.75 92.11 50.07 -65.94 -40.68 3.71 0.43 95.86 1.40 0.42 1.87 94.75 1.11 0.01 0.34 0.11 110 A H H 7.61 22.80 13.85 36.38 91.90 54.94 -65.42 -36.55 7.46 0.38 92.16 2.46 0.75 4.22 90.15 2.03 0.02 0.26 0.11 111 Q H H 106.70 6.62 18.74 26.21 92.28 57.79 -70.12 -24.39 31.16 0.69 68.14 4.46 2.46 24.02 65.05 3.30 0.06 0.40 0.26 112 N C H 105.80 3.27 17.73 21.51 96.56 56.80 -84.56 -11.60 50.44 1.34 48.22 8.81 4.94 35.65 45.55 3.72 0.08 0.75 0.50 113 F C C 73.98 14.43 12.15 26.15 105.21 71.01 -92.50 19.18 65.64 8.39 25.97 46.05 2.93 15.43 24.19 2.93 0.02 4.88 3.57 114 V C C 61.69 13.87 14.94 28.45 112.77 88.69 -96.22 117.49 99.54 0.43 0.03 99.56 0.08 0.04 0.02 0.00 0.00 0.27 0.03