# 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 N C C 84.86 8.99 15.50 25.13 107.00 -154.34 -87.94 96.75 99.90 0.04 0.06 99.81 0.07 0.05 0.04 0.00 0.00 0.01 0.01 1 T C C 67.81 7.69 14.40 23.20 105.22 167.11 -86.17 13.82 64.78 0.73 34.50 59.03 0.90 3.82 34.81 0.82 0.00 0.23 0.38 2 A H H 47.61 8.01 16.59 25.74 95.02 69.41 -65.34 -37.98 12.95 0.11 86.94 7.12 2.00 3.50 86.65 0.64 0.00 0.04 0.05 3 L H H 26.87 19.51 14.97 33.78 92.41 52.41 -65.03 -41.19 3.12 0.02 96.85 1.33 0.44 1.25 96.52 0.44 0.00 0.01 0.01 4 Q H H 74.94 10.45 18.67 29.52 91.45 51.73 -64.04 -40.42 1.18 0.01 98.81 0.48 0.15 0.50 98.54 0.32 0.00 0.01 0.00 5 E H H 100.31 3.22 22.55 25.22 92.14 50.32 -64.90 -41.41 0.72 0.00 99.27 0.24 0.08 0.34 99.17 0.17 0.00 0.00 0.00 6 V H H 24.61 15.83 19.62 35.64 91.72 50.00 -64.01 -43.20 0.46 0.00 99.54 0.11 0.04 0.22 99.55 0.07 0.00 0.00 0.00 7 L H H 15.63 22.17 18.40 39.99 91.65 49.94 -64.23 -41.64 0.42 0.00 99.58 0.09 0.03 0.20 99.62 0.05 0.00 0.00 0.00 8 K H H 106.53 5.82 23.42 29.72 91.37 51.13 -63.26 -41.51 0.58 0.00 99.41 0.13 0.04 0.30 99.45 0.09 0.00 0.00 0.00 9 T H H 55.21 5.93 22.72 29.07 91.92 49.55 -65.10 -41.30 0.79 0.01 99.21 0.12 0.06 0.49 99.12 0.20 0.00 0.00 0.00 10 A H H 7.47 20.44 15.30 36.23 91.60 51.47 -64.20 -40.93 1.67 0.02 98.31 0.25 0.13 1.13 97.89 0.58 0.01 0.01 0.00 11 L H H 61.55 13.87 17.68 31.22 92.37 51.61 -66.42 -38.06 4.90 0.06 95.04 0.60 0.37 3.75 93.84 1.37 0.02 0.03 0.02 12 I H H 111.76 3.64 19.74 23.66 93.15 51.12 -70.00 -30.72 11.43 0.10 88.47 0.81 0.87 9.67 87.55 0.95 0.06 0.04 0.05 13 H C T 94.91 7.86 15.93 24.74 102.31 52.62 -90.59 8.56 65.90 0.37 33.73 2.75 7.70 52.79 34.52 1.78 0.04 0.13 0.29 14 D C T 100.98 5.75 19.42 26.04 97.81 -98.91 34.78 36.98 96.03 0.30 3.67 5.65 15.87 74.66 2.67 0.85 0.00 0.18 0.12 15 G C C 16.85 15.70 18.69 33.87 100.84 -58.81 82.37 6.63 88.33 10.69 0.98 60.94 15.91 10.73 0.21 0.77 0.00 10.90 0.54 16 L E E 23.36 21.08 19.58 40.03 118.79 138.19 -90.54 133.62 26.18 73.56 0.26 23.12 2.54 0.30 0.16 0.15 0.00 70.35 3.39 17 A E E 13.54 19.25 21.61 40.43 126.68 -165.09 -117.13 144.13 13.35 86.53 0.12 12.94 0.52 0.06 0.09 0.05 0.00 82.46 3.87 18 R E E 97.66 13.25 24.08 36.69 127.19 -163.93 -123.91 140.73 29.60 70.32 0.08 26.71 2.49 0.12 0.05 0.04 0.00 69.13 1.46 19 G C S 17.26 9.99 25.44 36.50 124.04 10.75 92.78 167.00 93.73 2.72 3.54 14.98 75.64 2.77 4.22 0.29 0.00 1.31 0.78 20 I H H 27.57 22.08 16.73 38.14 91.91 -85.20 -60.65 -39.38 1.36 0.00 98.63 0.12 0.24 0.88 98.56 0.20 0.00 0.00 0.00 21 R H H 142.52 4.21 24.13 29.11 91.46 51.79 -63.44 -41.44 0.68 0.00 99.32 0.06 0.06 0.49 99.17 0.23 0.00 0.00 0.00 22 E H H 79.41 7.55 24.44 32.25 91.80 47.84 -66.27 -40.46 0.22 0.00 99.77 0.03 0.01 0.14 99.63 0.19 0.00 0.00 0.00 23 A H H 1.38 26.36 16.65 43.65 91.33 51.24 -63.59 -43.32 0.10 0.00 99.90 0.01 0.00 0.05 99.89 0.04 0.00 0.00 0.00 24 A H H 17.38 16.20 22.03 38.15 91.35 51.05 -62.38 -42.65 0.07 0.00 99.93 0.00 0.00 0.04 99.94 0.01 0.00 0.00 0.00 25 K H H 110.45 2.43 26.78 27.85 91.70 49.98 -63.68 -41.92 0.07 0.00 99.93 0.00 0.00 0.05 99.92 0.02 0.00 0.00 0.00 26 A H H 9.53 14.95 18.54 34.94 91.18 50.44 -63.95 -42.11 0.14 0.00 99.86 0.01 0.01 0.10 99.84 0.05 0.00 0.00 0.00 27 L H H 8.64 23.76 14.57 38.07 91.82 50.45 -64.49 -42.21 0.52 0.00 99.48 0.02 0.02 0.41 99.34 0.21 0.00 0.00 0.00 28 D H H 93.88 5.03 19.18 25.40 91.46 51.14 -65.50 -31.71 4.31 0.00 95.68 0.06 0.11 4.18 95.42 0.23 0.00 0.00 0.00 29 K C T 131.41 2.45 18.95 20.92 93.65 49.16 -87.81 -2.89 81.39 0.02 18.59 0.35 1.60 78.58 18.97 0.48 0.00 0.00 0.02 30 R C T 130.51 11.06 16.03 27.22 94.90 -115.69 66.36 27.30 98.77 0.01 1.21 0.72 4.36 93.98 0.77 0.15 0.00 0.00 0.01 31 Q C C 94.64 7.25 22.52 30.11 98.10 125.85 -88.57 -4.36 99.31 0.60 0.08 63.52 31.83 4.07 0.02 0.07 0.00 0.32 0.19 32 A C C 4.56 25.41 13.70 39.03 118.41 84.95 -93.52 132.14 85.25 14.67 0.07 82.31 2.65 0.21 0.01 0.06 0.00 14.22 0.54 33 H C S 68.61 11.97 26.81 39.48 101.07 176.87 -98.57 -28.36 81.31 18.67 0.02 22.42 57.71 0.39 0.00 0.02 0.00 19.28 0.18 34 L E E 8.84 21.93 26.76 47.92 135.04 13.66 -145.13 143.67 3.21 96.78 0.01 2.61 0.55 0.04 0.00 0.01 0.00 96.60 0.19 35 C E E 1.31 26.93 26.56 53.18 124.31 -164.81 -122.35 133.39 0.27 99.73 0.00 0.27 0.01 0.00 0.00 0.00 0.00 99.72 0.01 36 V E E 3.22 24.74 29.09 52.99 119.56 -162.84 -112.53 127.80 0.09 99.91 0.00 0.08 0.00 0.00 0.00 0.00 0.00 99.91 0.00 37 Q E E 6.58 24.28 26.07 49.25 127.89 -170.61 -115.98 144.67 1.00 99.00 0.00 0.97 0.02 0.00 0.00 0.00 0.00 98.97 0.04 38 A E E 7.30 20.57 21.26 42.09 114.03 -111.70 -72.68 141.72 27.46 72.45 0.09 26.04 1.02 0.12 0.02 0.06 0.00 72.29 0.46 39 S C T 49.58 12.03 21.16 33.42 93.44 -130.59 -67.03 -25.46 90.97 7.05 1.98 4.97 21.37 64.67 0.09 2.14 0.00 6.16 0.59 40 N C T 90.24 5.45 22.28 28.43 96.95 59.35 -92.11 10.72 96.37 1.84 1.79 15.13 20.44 60.47 0.11 2.22 0.00 1.26 0.37 41 C C C 15.91 22.14 10.06 31.02 111.29 130.59 -79.46 122.97 96.51 1.65 1.84 81.20 10.39 4.66 0.41 1.58 0.00 0.74 1.02 42 D C C 109.34 3.18 18.66 22.65 101.65 171.99 -97.20 0.49 99.32 0.25 0.42 84.07 12.47 2.74 0.13 0.26 0.00 0.09 0.24 43 E C C 85.75 7.18 13.88 22.81 113.81 98.99 -84.81 129.63 98.01 0.13 1.86 62.07 34.74 0.82 2.03 0.15 0.00 0.02 0.16 44 P H H 91.46 4.13 14.23 20.07 93.28 -133.92 -59.43 -36.98 6.99 0.01 93.01 0.66 0.75 5.30 90.23 3.04 0.01 0.00 0.00 45 M H H 106.85 3.31 17.58 21.26 91.82 54.64 -64.55 -37.25 4.07 0.00 95.92 0.34 0.31 3.22 92.39 3.72 0.01 0.00 0.00 46 Y H H 39.86 17.03 15.29 32.15 92.78 49.02 -66.87 -40.20 2.02 0.01 97.97 0.33 0.18 1.33 94.20 3.95 0.00 0.00 0.00 47 V H H 30.11 16.92 16.36 33.08 91.93 52.07 -62.75 -42.43 0.69 0.00 99.31 0.16 0.07 0.35 99.11 0.32 0.00 0.00 0.00 48 K H H 123.04 2.34 23.89 25.31 91.67 50.77 -64.03 -41.05 0.53 0.00 99.47 0.06 0.02 0.37 99.42 0.12 0.00 0.00 0.00 49 L H H 51.58 10.25 21.94 32.71 91.72 50.07 -64.68 -42.34 0.29 0.00 99.71 0.02 0.01 0.21 99.68 0.06 0.00 0.00 0.00 50 V H H 1.89 26.67 17.32 44.55 91.39 48.87 -63.93 -43.51 0.08 0.00 99.92 0.01 0.00 0.06 99.92 0.02 0.00 0.00 0.00 51 E H H 78.33 12.26 22.22 33.94 91.54 51.53 -62.58 -42.19 0.03 0.00 99.97 0.00 0.00 0.02 99.97 0.01 0.00 0.00 0.00 52 A H H 50.40 2.88 24.18 26.10 91.31 50.26 -63.21 -42.17 0.03 0.00 99.97 0.00 0.00 0.02 99.97 0.01 0.00 0.00 0.00 53 L H H 19.97 15.14 19.31 35.21 91.87 48.98 -64.83 -42.58 0.05 0.00 99.95 0.00 0.00 0.03 99.95 0.01 0.00 0.00 0.00 54 L H H 9.61 21.51 14.06 35.67 91.79 49.90 -63.54 -42.53 0.13 0.00 99.87 0.01 0.00 0.09 99.86 0.04 0.00 0.00 0.00 55 A H H 73.63 3.05 18.98 22.49 92.07 49.64 -64.63 -40.66 0.52 0.00 99.48 0.02 0.01 0.43 99.37 0.18 0.00 0.00 0.00 56 E H H 131.19 2.14 18.34 20.40 92.15 48.76 -66.57 -35.66 3.81 0.00 96.19 0.05 0.09 3.69 95.93 0.24 0.00 0.00 0.00 57 H C T 65.10 12.50 13.54 26.80 98.03 37.48 -102.37 3.93 54.81 0.03 45.16 0.59 1.74 51.23 45.70 0.71 0.01 0.01 0.03 58 Q C T 142.61 1.86 20.76 22.58 93.24 -123.12 57.51 40.93 99.83 0.02 0.15 4.22 1.31 94.38 0.05 0.03 0.00 0.01 0.00 59 I C C 11.00 23.62 11.66 35.26 118.11 155.19 -100.38 132.63 98.37 1.62 0.01 97.38 1.03 0.04 0.00 0.00 0.00 1.49 0.05 60 N C C 66.31 7.96 26.32 35.00 110.40 -121.15 -76.09 129.18 54.30 45.67 0.03 52.60 0.79 0.07 0.00 0.02 0.00 46.27 0.25 61 L E E 22.71 23.82 16.57 39.90 122.24 -161.49 -115.66 131.83 6.09 93.90 0.00 6.03 0.15 0.01 0.00 0.00 0.00 93.65 0.16 62 I E E 27.34 16.02 23.95 39.96 118.19 -162.98 -110.35 126.58 0.49 99.51 0.00 0.48 0.01 0.00 0.00 0.00 0.00 99.50 0.02 63 K E E 87.82 13.42 23.77 36.43 116.72 -149.90 -99.48 126.96 0.69 99.31 0.00 0.71 0.01 0.00 0.00 0.00 0.00 99.24 0.04 64 V E E 13.46 19.68 14.93 34.99 128.75 -175.68 -127.78 144.34 28.06 71.91 0.02 28.36 0.37 0.03 0.01 0.01 0.00 70.76 0.45 65 D C S 101.87 4.57 21.28 26.78 98.16 -156.89 -93.89 -10.30 97.68 2.28 0.04 26.96 70.32 0.54 0.01 0.02 0.00 2.04 0.10 66 D C C 60.97 5.53 23.35 29.28 135.07 32.15 -139.84 155.35 98.03 0.89 1.08 52.51 44.59 1.05 0.86 0.20 0.00 0.27 0.52 67 N H H 42.76 20.32 14.56 34.13 92.32 -118.07 -62.51 -34.41 5.57 0.03 94.40 0.71 1.04 3.80 92.86 1.55 0.01 0.01 0.01 68 K H H 116.98 6.32 21.94 29.04 91.61 56.75 -63.58 -40.33 3.23 0.03 96.74 0.57 0.43 2.22 95.24 1.51 0.01 0.01 0.01 69 K H H 82.84 7.78 23.31 31.31 92.14 49.44 -66.19 -40.67 1.33 0.03 98.64 0.43 0.19 0.71 96.97 1.68 0.00 0.02 0.00 70 L H H 2.94 25.42 17.65 43.50 91.16 52.14 -62.85 -43.66 0.59 0.01 99.41 0.13 0.06 0.34 98.60 0.87 0.00 0.00 0.00 71 G H H 5.42 19.64 19.44 39.26 91.53 51.18 -63.13 -41.57 0.97 0.00 99.03 0.10 0.06 0.73 96.80 2.31 0.00 0.00 0.00 72 E H H 107.29 4.59 25.39 30.29 91.89 51.02 -65.11 -40.71 1.77 0.00 98.23 0.09 0.07 1.55 94.78 3.50 0.00 0.00 0.00 73 W H H 55.15 17.04 21.46 37.75 92.32 49.87 -66.45 -37.96 4.74 0.01 95.24 0.17 0.21 4.39 92.58 2.64 0.01 0.00 0.00 74 V H H 6.38 23.83 18.43 42.51 93.11 44.47 -85.18 -13.02 45.04 0.14 54.82 0.88 1.85 42.10 52.76 2.22 0.04 0.05 0.09 75 G C T 32.48 8.44 24.00 33.31 95.02 -120.14 73.81 21.28 98.81 0.15 1.04 7.04 4.37 87.67 0.53 0.26 0.00 0.07 0.06 76 L C C 31.39 16.62 18.32 35.19 97.19 125.52 -88.22 -11.75 95.33 3.46 1.21 48.46 36.89 10.17 0.23 1.05 0.00 2.24 0.95 77 C C C 23.88 18.28 14.82 32.66 124.88 55.62 -117.38 143.48 70.04 29.05 0.91 39.31 25.09 6.27 0.14 0.97 0.00 25.88 2.33 78 K E E 108.80 6.14 19.45 26.46 122.05 -149.97 -104.12 143.80 41.72 58.11 0.17 34.95 5.53 0.61 0.03 0.16 0.00 57.77 0.96 79 I E E 83.06 9.85 11.71 22.75 119.82 -134.98 -106.28 135.53 7.48 92.47 0.04 6.61 0.41 0.02 0.05 0.01 0.00 53.26 39.64 80 D C C 56.10 5.88 10.00 18.00 123.66 -133.20 -83.77 173.11 97.79 2.19 0.02 97.91 0.34 0.05 0.00 0.01 0.00 1.33 0.36 81 R C T 204.82 0.56 9.72 10.22 90.48 -91.89 -63.97 -22.59 99.49 0.18 0.33 0.64 5.25 93.58 0.01 0.36 0.00 0.13 0.03 82 E C T 156.79 0.56 10.44 10.05 93.81 54.49 -87.79 0.17 99.55 0.05 0.40 0.31 4.75 94.48 0.01 0.42 0.00 0.02 0.01 83 G C S 47.25 3.98 9.59 15.50 97.01 -104.87 82.77 6.81 99.29 0.33 0.38 11.37 86.75 1.28 0.02 0.30 0.00 0.13 0.13 84 N C C 95.27 2.36 12.75 16.41 117.59 135.61 -87.12 139.69 98.47 1.50 0.03 87.59 10.87 0.20 0.01 0.02 0.00 0.89 0.43 85 P E B 71.65 8.56 11.12 21.12 113.55 -106.20 -65.56 144.70 9.85 90.04 0.11 8.52 0.52 0.04 0.11 0.02 0.00 35.29 55.51 86 R C C 109.98 8.59 13.40 23.18 121.53 -161.00 -107.49 145.34 65.21 34.60 0.19 54.80 8.30 0.81 0.03 0.18 0.00 34.89 0.98 87 K C C 129.58 4.60 18.07 23.91 116.78 -110.38 -89.96 134.58 61.04 38.70 0.26 46.36 13.20 1.07 0.05 0.25 0.00 37.56 1.52 88 V C C 52.57 15.87 14.49 29.95 114.45 -137.65 -89.46 128.13 51.81 47.87 0.33 46.94 3.07 0.47 0.13 0.22 0.00 43.22 5.94 89 V C C 43.13 13.47 19.55 33.28 118.23 -168.84 -111.85 132.64 55.02 44.58 0.40 44.28 8.05 1.54 0.12 0.36 0.00 40.66 4.98 90 G C C 19.06 13.78 23.31 36.64 118.55 -112.53 -83.39 151.56 61.99 37.58 0.44 40.95 18.62 3.10 0.08 0.46 0.00 34.44 2.34 91 C C E 10.44 23.08 19.99 42.54 127.81 -160.00 -120.63 145.59 49.90 49.86 0.25 43.34 4.70 0.62 0.05 0.23 0.00 48.41 2.64 92 S E E 17.31 18.42 26.37 43.85 104.63 -171.64 -102.62 -18.69 38.46 61.37 0.17 25.56 13.43 0.71 0.03 0.15 0.00 59.32 0.80 93 C E E 5.43 23.66 26.13 48.94 136.30 14.41 -142.73 146.48 7.41 92.52 0.07 6.21 0.94 0.09 0.02 0.04 0.00 92.51 0.19 94 V E E 2.93 25.35 27.32 52.01 122.66 -160.39 -120.16 131.61 0.77 99.23 0.01 0.70 0.03 0.00 0.00 0.00 0.00 99.23 0.03 95 V E E 9.06 21.50 27.91 48.53 119.28 -160.43 -109.88 127.85 0.32 99.68 0.00 0.31 0.01 0.00 0.00 0.00 0.00 99.67 0.02 96 V E E 6.43 23.54 21.46 44.96 116.16 -160.81 -108.83 123.09 1.86 98.13 0.01 1.84 0.05 0.01 0.00 0.00 0.00 97.97 0.12 97 K E E 82.43 11.76 23.60 34.81 103.27 -171.27 -95.34 -25.44 32.24 67.46 0.30 15.57 15.21 1.95 0.05 0.23 0.00 66.61 0.37 98 D C C 78.01 7.00 22.76 30.01 111.09 16.49 -121.52 95.14 76.00 23.31 0.69 42.64 27.80 4.99 0.10 0.63 0.00 23.20 0.64 99 Y C C 54.12 19.23 13.13 31.34 101.85 172.29 -91.77 0.09 86.31 9.70 3.98 66.70 9.98 9.34 1.01 2.97 0.00 8.33 1.67 100 G C C 31.47 7.89 17.76 26.55 115.57 -148.87 80.35 -159.18 87.00 4.05 8.95 45.68 22.71 19.00 2.45 6.32 0.00 2.06 1.78 101 K C S 144.35 3.91 16.27 21.25 97.98 -31.50 -76.03 -17.89 77.67 1.52 20.81 21.33 29.26 28.64 6.91 12.14 0.02 0.67 1.04 102 E C C 124.30 5.04 15.21 21.29 99.94 57.04 -87.66 6.34 77.09 1.28 21.63 31.96 21.28 24.67 9.43 11.21 0.01 0.53 0.91 103 S C C 33.49 11.94 11.81 24.72 119.18 116.60 -91.03 156.02 68.90 0.86 30.24 40.99 21.17 6.95 25.87 4.24 0.00 0.29 0.50 104 Q H H 116.12 3.38 20.13 23.78 93.56 -117.66 -65.60 -31.47 19.35 0.20 80.45 7.31 4.21 8.44 76.77 3.07 0.02 0.09 0.10 105 A H H 11.49 19.28 15.11 34.37 91.99 56.59 -64.74 -39.99 10.84 0.11 89.05 4.00 1.66 5.21 86.66 2.36 0.01 0.06 0.04 106 K H H 68.67 14.42 17.97 32.04 91.56 52.89 -62.66 -40.97 4.64 0.08 95.27 2.31 0.83 1.66 93.66 1.47 0.00 0.05 0.02 107 D H H 84.77 2.35 23.28 24.28 91.72 50.69 -64.55 -40.69 3.87 0.11 96.03 2.11 0.65 1.29 95.08 0.78 0.00 0.06 0.02 108 V H H 36.18 10.58 20.10 31.82 92.04 50.06 -64.58 -42.76 2.23 0.09 97.68 1.04 0.37 0.86 97.18 0.45 0.00 0.07 0.01 109 I H H 8.26 22.98 15.97 38.90 91.71 49.66 -63.76 -42.97 1.20 0.04 98.76 0.48 0.17 0.53 98.43 0.36 0.00 0.03 0.00 110 E H H 85.42 8.00 20.17 28.82 91.44 51.09 -62.83 -41.06 1.16 0.03 98.82 0.36 0.13 0.59 98.40 0.48 0.00 0.02 0.00 111 E H H 103.06 2.40 21.51 22.76 91.69 50.08 -64.70 -41.20 1.90 0.03 98.07 0.42 0.19 1.17 97.37 0.81 0.00 0.02 0.00 112 Y H H 47.79 13.33 16.29 30.45 92.50 48.98 -65.80 -41.02 3.95 0.04 96.01 0.67 0.39 2.72 95.10 1.08 0.01 0.02 0.01 113 F H H 42.62 15.75 13.54 29.50 92.88 49.53 -66.77 -37.28 10.24 0.17 89.59 2.34 1.29 6.56 88.11 1.52 0.02 0.09 0.06 114 K H H 136.54 2.44 16.74 19.59 92.79 54.56 -68.80 -28.42 23.95 0.26 75.79 4.88 2.91 16.06 74.24 1.64 0.03 0.12 0.13 115 C H H 78.49 4.38 11.92 17.79 97.60 58.37 -80.49 -8.92 48.90 0.60 50.50 13.08 7.06 28.67 48.68 1.93 0.03 0.23 0.32 116 K C C 112.11 7.70 9.31 18.24 105.70 86.32 -82.72 77.76 77.11 0.70 22.18 53.98 1.88 19.06 23.11 1.26 0.00 0.30 0.41 117 K C C 149.58 2.80 13.33 17.77 108.87 -155.03 -85.67 114.55 99.96 0.03 0.02 99.89 0.05 0.03 0.01 0.00 0.00 0.01 0.00