A0A087YEN5_POEFO Loading...

ATP-binding cassette sub-family F member 1

AlphaFold DB , UniProt , Accession A0A087YEN5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 789 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.3	Very low	36.3	Very low	214 Å²	214	159.9 Å²	159.9	100%	1.054	79%	0.787	S	S	*	*				0	153.9	0	-75.8	-159.9	-168.7	0	0	108.2
2	P	54.3	Low	35.6	Very low	120 Å²	120	157.2 Å²	157.2	78%	0.779	79%	0.786	S	S	*	*			cis	-65.1	151	-3.9	-16.2	32.6	0	0	0	112
3	K	33.7	Very low	35.1	Very low	166 Å²	166	154.7 Å²	154.7	72%	0.722	78%	0.777	S	S	*	*				72.9	100.6	62.7	-62.3	-179.3	177.5	-178.6	0	111.7
4	K	38.2	Very low	34.6	Very low	202 Å²	202	153.9 Å²	153.9	88%	0.878	78%	0.784	S	S	*	*				81.6	144	78.3	-83.5	-167.2	173.8	-167.4	0	112.1
5	A	37.4	Very low	34.3	Very low	91 Å²	91	154.1 Å²	154.1	75%	0.752	79%	0.788	S	S	*	*			cis	-121.7	171.3	8.4	0	0	0	0	0	111
6	K	37.8	Very low	34	Very low	150 Å²	150	153.8 Å²	153.8	65%	0.652	80%	0.795	S	S	*	*			cis	79.7	110.6	19.2	-143.5	-165.6	-161.2	-75.7	0	116.9	E8	K6-E8 WeakPolarHBondContact CE-OE2 3.04Å; K6-E8 IonicContact NZ-OE2 2.74Å; K6-E8 PolarHBondContact NZ-OE2 2.7Å
7	E	33.2	Very low	33.7	Very low	196 Å²	196	149.9 Å²	149.9	92%	0.916	79%	0.791	S	S	*	*			trans	-153.9	151.6	130.6	-125.2	161.4	-145.6	0	0	111
8	E	32.9	Very low	34.8	Very low	135 Å²	135	149.1 Å²	149.1	63%	0.631	80%	0.796	S	S	*	*			trans	-146.9	157.7	-176.6	-70.3	162	104	0	0	107.2	K6	K6-E8 WeakPolarHBondContact CE-OE2 3.04Å; K6-E8 IonicContact NZ-OE2 2.74Å; K6-E8 PolarHBondContact NZ-OE2 2.7Å
9	T	33.7	Very low	34.3	Very low	131 Å²	131	145.2 Å²	145.2	80%	0.804	79%	0.794	S	S	*	*			trans	170.9	153.4	146.4	30	0	0	0	0	112.5
10	E	32.3	Very low	34.1	Very low	147 Å²	147	142.8 Å²	142.8	69%	0.687	80%	0.795	S	S	*	*			cis	-169	130.8	-31.1	-109.8	-153.8	139.6	0	0	111.3
11	W	31.4	Very low	33.8	Very low	207 Å²	207	143.1 Å²	143.1	78%	0.784	79%	0.79	S	S	*	*			trans	55.9	176.2	156.5	-53.8	62.1	0	0	0	119.3
12	V	28.4	Very low	33.5	Very low	127 Å²	127	140.3 Å²	140.3	77%	0.77	77%	0.772	S	S	*	*			cis	-143.1	159	10.1	-171.7	0	0	0	0	111.4
13	D	28.6	Very low	32.2	Very low	125 Å²	125	140.9 Å²	140.9	67%	0.668	77%	0.774	S	S	*	*			trans	-70.4	167.7	179	-42.5	-96.3	0	0	0	117.3
14	T	27.7	Very low	31.8	Very low	144 Å²	144	138.5 Å²	138.5	88%	0.883	77%	0.773	S	S	*	*				178.8	153.9	114.2	26.8	0	0	0	0	115.3
15	D	30.3	Very low	31.3	Very low	156 Å²	156	137.5 Å²	137.5	83%	0.834	77%	0.769	S	S	*	*			trans	-84	169.8	-179.7	-68.4	-76	0	0	0	115.9
16	V	29.6	Very low	30.7	Very low	150 Å²	150	143.2 Å²	143.2	91%	0.909	78%	0.776	S	S	*	*				166.2	159.3	120.3	158.2	0	0	0	0	113.2
17	A	29.3	Very low	30.2	Very low	88 Å²	88	139.5 Å²	139.5	73%	0.727	78%	0.781	S	S	*	*			trans	-94.2	176.5	-165.2	0	0	0	0	0	116.1
18	P	53.9	Low	29.8	Very low	134 Å²	134	140.1 Å²	140.1	87%	0.87	78%	0.781	S	S	*	*			trans	-107.4	176.6	-156.1	41.6	-38.3	0	0	0	117.7
19	G	25.6	Very low	29.6	Very low	75 Å²	75	141.8 Å²	141.8	77%	0.773	79%	0.786	S	S	*	*			trans	-172.6	137.2	165.6	0	0	0	0	0	119.9
20	A	29	Very low	29.3	Very low	97 Å²	97	140.5 Å²	140.5	80%	0.802	77%	0.774	S	S	*	*			trans	76.1	119.2	134.1	0	0	0	0	0	125.9
21	E	28	Very low	29.1	Very low	150 Å²	150	141 Å²	141	70%	0.701	77%	0.774	S	S	*	*				87.4	117.1	124.9	-71.8	-158.3	155.3	0	0	127.8
22	K	28	Very low	28.9	Very low	155 Å²	155	141 Å²	141	67%	0.674	78%	0.779	S	S	*	*				85.8	152.1	124.1	-73.3	177.3	-176.5	147	0	125.1
23	T	27.5	Very low	28.9	Very low	133 Å²	133	138.6 Å²	138.6	82%	0.816	78%	0.78	S	S	*	*			trans	93.8	149	155.8	76.7	0	0	0	0	119.7
24	V	25.8	Very low	28.9	Very low	116 Å²	116	142.4 Å²	142.4	70%	0.703	79%	0.791	S	S	*	*			cis	-162.5	131.8	-18.6	130.3	0	0	0	0	114.7
25	K	27	Very low	29	Very low	180 Å²	180	145 Å²	145	78%	0.783	79%	0.79	S	S	*	*			trans	47.2	148.7	145.6	-55.5	174.1	178.1	169.2	0	127.2
26	K	25.3	Very low	28.9	Very low	211 Å²	211	142.5 Å²	142.5	92%	0.917	78%	0.784	S	S	*	*			trans	82.5	140.6	153.5	-70.2	168.3	177.4	177.8	0	119.5
27	G	25.6	Very low	28.7	Very low	72 Å²	72	144.6 Å²	144.6	74%	0.742	78%	0.781	S	S	*	*			cis	156.2	143.1	-20.6	0	0	0	0	0	118.7
28	K	26.7	Very low	28.5	Very low	210 Å²	210	148 Å²	148	91%	0.913	78%	0.78	S	S	*	*			trans	71.7	157.3	170.1	-63.4	-177.4	173.8	175.6	0	116.6
29	K	26.8	Very low	27.3	Very low	169 Å²	169	148.8 Å²	148.8	74%	0.735	77%	0.772	S	S	*	*			cis	-164.9	150.5	17.3	-152.1	-174.2	175.2	-173.5	0	113.3
30	D	27.5	Very low	27.3	Very low	105 Å²	105	152.9 Å²	152.9	56%	0.561	77%	0.771	S	S	*	*			trans	50.7	153.3	152.1	-73.6	-20.5	0	0	0	121.3
31	K	29.3	Very low	27.1	Very low	157 Å²	157	154.7 Å²	154.7	68%	0.683	77%	0.767	S	S	*	*			cis	-168.3	149.4	-7.5	-112.3	164.5	-170.5	140.2	0	113.4
32	K	27.9	Very low	26.9	Very low	207 Å²	207	152.4 Å²	152.4	90%	0.9	77%	0.767	S	S	*	*			trans	51.5	129.5	149.9	-69.3	-175.3	174.6	-176.4	0	122.7
33	G	27.3	Very low	26.9	Very low	76 Å²	76	150.7 Å²	150.7	78%	0.784	77%	0.77	S	S	*	*			trans	-177.5	155.4	156.6	0	0	0	0	0	114.4
34	K	29.4	Very low	26.8	Very low	206 Å²	206	153 Å²	153	90%	0.896	77%	0.772	S	S	*	*			trans	-151.5	131.1	172.8	-80.1	-172.7	177.2	-176.9	0	111.2
35	K	28.4	Very low	26.8	Very low	199 Å²	199	153.1 Å²	153.1	87%	0.865	78%	0.777	S	S	*	*			trans	151.3	142.7	130.4	-87.5	-177.1	176.4	-176.5	0	115.4
36	S	28.4	Very low	26.8	Very low	103 Å²	103	154 Å²	154	72%	0.72	78%	0.782	S	S	*	*			trans	34.8	113.8	146.3	62.6	0	0	0	0	123.6
37	F	25.1	Very low	27.1	Very low	193 Å²	193	148.9 Å²	148.9	85%	0.846	77%	0.77	S	S	*	*				64.7	116	108.5	-146.7	-97.1	0	0	0	120.9
38	F	26	Very low	27	Very low	160 Å²	160	152.4 Å²	152.4	70%	0.702	77%	0.767	S	S	*	*			trans	91.7	145.3	157.9	-125.1	-101.2	0	0	0	120.8
39	E	27.8	Very low	26.9	Very low	150 Å²	150	149.5 Å²	149.5	70%	0.701	75%	0.754	S	S	*	*			trans	81.1	124.6	166.6	-127.2	92.6	-106.1	0	0	121.9
40	E	26.5	Very low	26.8	Very low	162 Å²	162	147 Å²	147	76%	0.757	75%	0.752	S	S	*	*			trans	64.2	128.2	149.1	-83.1	-173.7	144.9	0	0	127.5
41	L	24.8	Very low	26.7	Very low	135 Å²	135	147.3 Å²	147.3	71%	0.707	75%	0.754	S	S	*	*			trans	75.1	115.8	136	-73.2	165.4	0	0	0	123.7
42	S	24.7	Very low	26.5	Very low	101 Å²	101	147.7 Å²	147.7	71%	0.706	76%	0.759	S	S	*	*			trans	86.4	135.3	132.9	64.9	0	0	0	0	122.5
43	T	27.6	Very low	26.5	Very low	120 Å²	120	142 Å²	142	74%	0.736	75%	0.75	S	S	*	*			trans	65.5	100.7	152.7	47.2	0	0	0	0	122.2
44	E	24.8	Very low	26.5	Very low	181 Å²	181	143.5 Å²	143.5	85%	0.846	76%	0.755	S	S	*	*				80.7	153.9	124.1	-63.5	-165.9	151.9	0	0	123.9
45	S	26	Very low	26.2	Very low	118 Å²	118	137.1 Å²	137.1	83%	0.825	75%	0.748	S	S	*	*			trans	74.1	100.8	165.8	63.9	0	0	0	0	120.6
46	K	26.3	Very low	26	Very low	200 Å²	200	136.3 Å²	136.3	87%	0.87	74%	0.744	S	S	*	*			trans	-41.2	167.7	146.5	-82.1	176.9	-177.7	176.6	0	114.7
47	P	31.6	Very low	25.7	Very low	103 Å²	103	136.9 Å²	136.9	67%	0.669	74%	0.739	S	S	*	*			cis	-139.8	-168.2	-14.6	37.3	-15.8	0	0	0	114.5
48	E	23.3	Very low	25.6	Very low	146 Å²	146	133.2 Å²	133.2	68%	0.682	73%	0.729	S	S	*	*			trans	22.2	149.6	132.8	-66.9	-168.3	142.3	0	0	121.8
49	K	25.3	Very low	25.4	Very low	149 Å²	149	133.1 Å²	133.1	65%	0.648	73%	0.73	S	S	*	*			cis	-160.3	155.5	16.8	-118.7	159.1	179.5	145	0	107.7
50	V	24.6	Very low	25.1	Very low	115 Å²	115	130.9 Å²	130.9	70%	0.697	73%	0.727	S	S	*	*				54.9	128.2	87.2	-179.9	0	0	0	0	111.1
51	N	25.7	Very low	25	Very low	113 Å²	113	132 Å²	132	60%	0.604	73%	0.729	S	S	*	*			cis	-163	176.1	26.1	-134.7	-1.8	0	0	0	115.2
52	E	25.8	Very low	24.9	Very low	165 Å²	165	134.4 Å²	134.4	77%	0.771	74%	0.737	S	S	*	*			trans	51.9	171	138.6	-73.7	161.1	159	0	0	122.9
53	A	28.4	Very low	25.8	Very low	86 Å²	86	133.9 Å²	133.9	71%	0.711	73%	0.731	S	S	*	*			cis	-174.2	-159.1	-38.9	0	0	0	0	0	109.1
54	A	25.3	Very low	25.7	Very low	109 Å²	109	135.2 Å²	135.2	90%	0.901	73%	0.729	S	S	*	*			trans	63.3	153.9	-173.8	0	0	0	0	0	113.8
55	G	23.7	Very low	25.8	Very low	72 Å²	72	135.1 Å²	135.1	74%	0.742	73%	0.726	S	S	*	*			cis	157.8	162.5	5.6	0	0	0	0	0	106.8
56	K	23.7	Very low	25.9	Very low	181 Å²	181	137.5 Å²	137.5	79%	0.787	72%	0.721	S	S	*	*			cis	-165.2	-179.4	4.9	-145.1	-176.1	177.7	-171.5	0	108.6
57	D	22.7	Very low	25.9	Very low	116 Å²	116	135.8 Å²	135.8	62%	0.62	71%	0.714	S	S	*	*			trans	73.8	111.2	149.4	-62.2	-21	0	0	0	123.6
58	N	22.5	Very low	25.8	Very low	116 Å²	116	135.4 Å²	135.4	62%	0.62	70%	0.703	S	S	*	*				83.9	118.9	122.1	-75.3	-49.8	0	0	0	124.9
59	Q	23	Very low	26	Very low	157 Å²	157	137.4 Å²	137.4	73%	0.734	70%	0.704	S	S	*	*			trans	73.4	147	130.3	-64.6	177.6	46	0	0	119.1
60	T	22.1	Very low	26.2	Very low	104 Å²	104	137 Å²	137	64%	0.638	71%	0.705	S	S	*	*			cis	-158.9	163.3	3.9	1.1	0	0	0	0	113.9
61	K	23.7	Very low	26.4	Very low	185 Å²	185	141.5 Å²	141.5	80%	0.804	72%	0.715	S	S	*	*			trans	64.2	114.9	151.7	-66.3	160.1	-176.3	173	0	119.8
62	Q	22.5	Very low	26.4	Very low	185 Å²	185	139.6 Å²	139.6	86%	0.864	72%	0.722	S	S	*	*				64.6	161.1	70.7	-93.1	-161.6	20.8	0	0	116.7
63	P	42.7	Very low	26.5	Very low	90 Å²	90	142.2 Å²	142.2	58%	0.584	73%	0.731	S	S	*	*			cis	-141.3	-172	5.2	28.8	-4.2	0	0	0	118.2
64	Q	26.1	Very low	26.4	Very low	148 Å²	148	141.4 Å²	141.4	69%	0.692	73%	0.732	S	S	*	*			trans	106.5	155.2	157.6	-59.6	174.9	104.3	0	0	114.9
65	K	27.7	Very low	26.5	Very low	179 Å²	179	143.3 Å²	143.3	78%	0.778	73%	0.731	S	S	*	*			cis	-172.3	148	-19.1	-100.5	166.5	-179.1	164	0	104.7
66	K	27.4	Very low	26.7	Very low	168 Å²	168	146.5 Å²	146.5	73%	0.73	73%	0.732	S	S	*	*			cis	-142.5	-168.1	-18.2	-140.5	-169	170.6	-160.7	0	104.2	E68	K66-E68 IonicContact NZ-OE2 2.7Å; K66-E68 PolarHBondContact NZ-OE2 3.39Å
67	K	27.2	Very low	26.9	Very low	164 Å²	164	144.8 Å²	144.8	71%	0.713	74%	0.736	S	S	*	*			cis	-140.7	152.1	10.8	-115.6	-162.7	165	-178.8	0	107.1
68	E	29.6	Very low	27	Very low	96 Å²	96	142.7 Å²	142.7	45%	0.449	74%	0.741	S	S	.	*				55.9	127.5	86.2	-58.7	-166.6	98.8	0	0	116.2	K66	K66-E68 IonicContact NZ-OE2 2.7Å; K66-E68 PolarHBondContact NZ-OE2 3.39Å
69	R	27.4	Very low	27.3	Very low	187 Å²	187	144.9 Å²	144.9	71%	0.706	75%	0.748	S	S	*	*			cis	-162.6	147.3	10.9	-123.9	172	-171.4	-129.8	9.9	114.9
70	Q	28.9	Very low	27.5	Very low	142 Å²	142	144.7 Å²	144.7	66%	0.664	75%	0.745	S	S	*	*			trans	54.8	122.8	149.3	-73.6	163	-54.5	0	0	119.6
71	K	28.5	Very low	27.9	Very low	208 Å²	208	145.9 Å²	145.9	90%	0.904	75%	0.747	S	S	*	*				92.5	132.3	55.3	-86.5	-164.9	177.8	-169.3	0	112.4
72	G	26.6	Very low	28.2	Very low	73 Å²	73	144.7 Å²	144.7	75%	0.753	75%	0.749	S	S	*	*			cis	170.7	157.3	-9.3	0	0	0	0	0	115.7
73	K	27.2	Very low	28.4	Very low	220 Å²	220	144.5 Å²	144.5	96%	0.957	75%	0.749	S	S	*	*			trans	11.9	137.6	165.1	-64.1	-172.5	173.9	-167.7	0	122.2
74	G	25.8	Very low	27.8	Very low	70 Å²	70	147 Å²	147	72%	0.722	76%	0.757	S	S	*	*				154	146.2	112.7	0	0	0	0	0	120.4
75	V	27.6	Very low	27.9	Very low	148 Å²	148	145 Å²	145	90%	0.897	76%	0.755	S	S	*	*			trans	90.4	158.1	150.6	-168.7	0	0	0	0	119
76	D	27.1	Very low	27.9	Very low	140 Å²	140	147.1 Å²	147.1	75%	0.749	76%	0.758	S	S	*	*			trans	-98.3	167.6	-151.1	-73.7	-75.7	0	0	0	117.7
77	V	28	Very low	28.1	Very low	145 Å²	145	146 Å²	146	88%	0.879	76%	0.759	S	S	*	*			trans	47.2	131.5	141.4	173.2	0	0	0	0	120.5
78	G	25.4	Very low	28.2	Very low	71 Å²	71	144.2 Å²	144.2	73%	0.732	76%	0.762	S	S	*	*			trans	154.1	99.2	150.2	0	0	0	0	0	117.4
79	E	28.7	Very low	28.2	Very low	162 Å²	162	146.3 Å²	146.3	76%	0.757	78%	0.776	S	S	*	*			trans	-13.5	149.3	156.5	-113.5	175.8	-132.1	0	0	122
80	K	27.6	Very low	28.2	Very low	154 Å²	154	145.5 Å²	145.5	67%	0.67	78%	0.777	S	S	*	*			trans	103.1	115.3	141.7	-74.6	179.8	168.8	133.3	0	123.8
81	D	29.5	Very low	28.2	Very low	128 Å²	128	145.7 Å²	145.7	68%	0.684	78%	0.783	S	S	*	*				82.9	140.1	122.3	-53.1	-13.3	0	0	0	124.1
82	D	30.5	Very low	28.2	Very low	160 Å²	160	144.4 Å²	144.4	86%	0.856	79%	0.785	S	S	*	*			trans	78.4	162.2	156.9	-61.1	-15.6	0	0	0	124
83	E	28.1	Very low	28.3	Very low	182 Å²	182	145.8 Å²	145.8	85%	0.85	78%	0.783	S	S	*	*			trans	-73.9	177.1	-157.2	-52.3	-176.7	120.5	0	0	114
84	D	28.9	Very low	28.4	Very low	141 Å²	141	141 Å²	141	75%	0.754	77%	0.772	S	S	*	*			cis	-175.2	-176.6	39.6	-171.4	12.8	0	0	0	112.1
85	V	28.1	Very low	28.5	Very low	106 Å²	106	146.6 Å²	146.6	64%	0.642	78%	0.779	S	S	*	*			trans	72.9	82.4	157.6	-161.1	0	0	0	0	120.4
86	R	28.1	Very low	28.4	Very low	224 Å²	224	142.5 Å²	142.5	85%	0.845	77%	0.767	S	S	*	*				28.2	157	107.2	-115.9	179.3	-170.5	-172.6	4.7	122.8
87	L	31.9	Very low	28.3	Very low	145 Å²	145	140.7 Å²	140.7	76%	0.759	77%	0.765	S	S	*	*			trans	87.1	125.6	147.9	-72.4	159.6	0	0	0	122.3
88	T	29.1	Very low	28.3	Very low	127 Å²	127	140.8 Å²	140.8	78%	0.779	76%	0.761	S	S	*	*			trans	-135.5	117.5	139.8	45.1	0	0	0	0	111.2
89	L	29.8	Very low	28.4	Very low	139 Å²	139	145.8 Å²	145.8	73%	0.728	77%	0.765	S	S	*	*			trans	61.5	115.9	151.4	-57.6	171.2	0	0	0	118.1
90	K	28.1	Very low	28.3	Very low	171 Å²	171	146.2 Å²	146.2	74%	0.743	77%	0.767	S	S	*	*				62.7	137.5	79.8	-69.3	-167.2	-176.4	179.3	0	114
91	N	28.7	Very low	28.3	Very low	145 Å²	145	146.6 Å²	146.6	78%	0.775	78%	0.776	S	S	*	*			cis	-161.8	138.1	-9.9	-112.7	11.4	0	0	0	107.2
92	L	27.5	Very low	28.1	Very low	182 Å²	182	148.8 Å²	148.8	95%	0.953	78%	0.783	S	S	*	*			trans	-141.3	134.2	167.7	-96.2	168.5	0	0	0	110.1
93	S	28	Very low	28.4	Very low	102 Å²	102	146.8 Å²	146.8	71%	0.713	78%	0.778	S	S	*	*			trans	-127	115.9	-179.5	53.9	0	0	0	0	108.4
94	V	30.8	Very low	28.2	Very low	118 Å²	118	140.8 Å²	140.8	72%	0.715	77%	0.765	S	S	*	*				98.3	113.6	91.8	163.5	0	0	0	0	111.3
95	Q	26.7	Very low	28.1	Very low	189 Å²	189	141.6 Å²	141.6	88%	0.883	77%	0.768	S	S	*	*			trans	62.2	152.5	160.8	-66.6	157.4	-10.5	0	0	117.5
96	G	26.9	Very low	27.9	Very low	62 Å²	62	142.3 Å²	142.3	64%	0.639	77%	0.772	S	S	*	*			cis	178.6	-176.4	-4.4	0	0	0	0	0	112
97	S	25	Very low	27.8	Very low	101 Å²	101	136.8 Å²	136.8	71%	0.706	77%	0.768	S	S	*	*			trans	56.6	112.4	162.9	56.9	0	0	0	0	121.6
98	D	26.6	Very low	27.4	Very low	147 Å²	147	133.9 Å²	133.9	79%	0.786	76%	0.76	S	S	*	*				72.6	145.1	113.6	-45.7	-31.6	0	0	0	125
99	E	28.6	Very low	27.3	Very low	176 Å²	176	137.4 Å²	137.4	82%	0.822	76%	0.764	S	S	*	*			trans	70.1	120.9	149.7	-73.4	169.4	-174	0	0	124.9
100	E	27.1	Very low	27	Very low	171 Å²	171	134.4 Å²	134.4	80%	0.799	77%	0.768	S	S	*	*			trans	55.2	125.1	132.7	-59	-170.6	164	0	0	125.2
101	D	26.2	Very low	26.9	Very low	162 Å²	162	134.4 Å²	134.4	87%	0.866	78%	0.775	S	S	*	*			trans	73.5	164.1	134.2	-79	13.4	0	0	0	125.8
102	E	26.2	Very low	26.9	Very low	175 Å²	175	136.5 Å²	136.5	82%	0.818	78%	0.778	S	S	*	*			trans	-73.5	175.9	-171.7	-104.6	-154.1	-136.9	0	0	114.1
103	P	36.9	Very low	26.9	Very low	118 Å²	118	136.3 Å²	136.3	77%	0.766	77%	0.769	S	S	*	*			cis	-147.2	-175.9	26.8	43.2	-22.8	0	0	0	118.4
104	G	24.1	Very low	26.9	Very low	55 Å²	55	137.1 Å²	137.1	57%	0.567	77%	0.77	S	S	*	*				114.1	84.9	114.4	0	0	0	0	0	123.9
105	I	25.4	Very low	26.6	Very low	159 Å²	159	138.3 Å²	138.3	82%	0.815	78%	0.778	S	S	*	*			trans	47.8	144.6	134.6	-18.5	-174.9	0	0	0	123.9
106	T	25.3	Very low	26.7	Very low	120 Å²	120	132.3 Å²	132.3	74%	0.736	77%	0.767	S	S	*	*			trans	97.4	116.9	155.7	75.1	0	0	0	0	117.7
107	S	24.6	Very low	26.8	Very low	109 Å²	109	136.5 Å²	136.5	76%	0.762	78%	0.775	S	S	*	*				89.9	150.6	75.2	103	0	0	0	0	113.4
108	S	25.1	Very low	27	Very low	84 Å²	84	138.7 Å²	138.7	59%	0.587	78%	0.777	S	S	*	*			cis	-164.3	177.3	6.3	54.9	0	0	0	0	111.9
109	K	25.9	Very low	27	Very low	200 Å²	200	140.8 Å²	140.8	87%	0.87	78%	0.779	S	S	*	*			trans	74.1	135	169.4	-52.7	161.4	-174	170.1	0	116.6
110	G	23.7	Very low	27	Very low	77 Å²	77	136 Å²	136	79%	0.794	77%	0.77	S	S	*	*			cis	119.1	124	-18.4	0	0	0	0	0	116.5
111	N	25.6	Very low	27.1	Very low	170 Å²	170	132.6 Å²	132.6	91%	0.909	77%	0.771	S	S	*	*			trans	-153.5	165.6	154.7	-141.6	-19.6	0	0	0	113.2
112	K	28.2	Very low	27.1	Very low	190 Å²	190	133.1 Å²	133.1	83%	0.826	77%	0.773	S	S	*	*			trans	-103.7	178.4	-167.4	-77.7	174.2	171.6	170.1	0	112.2
113	K	27.5	Very low	27.1	Very low	177 Å²	177	129.6 Å²	129.6	77%	0.77	77%	0.768	S	S	*	*			cis	-169.2	136.6	32.6	-148.1	174.6	-178.4	-177.3	0	113
114	T	28	Very low	26.6	Very low	120 Å²	120	133.6 Å²	133.6	74%	0.736	78%	0.776	S	S	*	*			trans	41.7	142.5	144.5	58.8	0	0	0	0	121.8
115	T	25.7	Very low	26.7	Very low	142 Å²	142	134.3 Å²	134.3	87%	0.871	78%	0.783	S	S	*	*			cis	-136.7	-178.6	24.6	46.3	0	0	0	0	111.5
116	G	28.9	Very low	26.8	Very low	64 Å²	64	136.4 Å²	136.4	66%	0.66	79%	0.789	S	S	*	*			cis	161.2	167.3	-9.6	0	0	0	0	0	113.1
117	N	27.7	Very low	26.8	Very low	150 Å²	150	135.1 Å²	135.1	80%	0.802	79%	0.785	S	S	*	*			trans	60.2	117	-179.3	-64.2	8.9	0	0	0	117.6
118	I	30	Very low	26.9	Very low	146 Å²	146	136.9 Å²	136.9	75%	0.749	79%	0.786	S	S	*	*			cis	89.7	123.7	46.3	-68.2	166.8	0	0	0	111
119	F	25.6	Very low	26.9	Very low	192 Å²	192	141 Å²	141	84%	0.842	80%	0.801	S	S	*	*			cis	-147	177.8	9.4	-148.3	-130.5	0	0	0	116.1
120	A	29.1	Very low	27.1	Very low	75 Å²	75	140.3 Å²	140.3	62%	0.62	80%	0.801	S	S	*	*			trans	-56.9	-178.9	180	0	0	0	0	0	116.2
121	A	28.6	Very low	27.8	Very low	99 Å²	99	141.6 Å²	141.6	82%	0.818	80%	0.796	S	S	*	*			cis	-148.1	176.2	19.6	0	0	0	0	0	115.5
122	L	27.5	Very low	27.9	Very low	174 Å²	174	140.1 Å²	140.1	91%	0.911	79%	0.788	S	S	*	*			trans	-138.9	172.2	-170.7	-118.7	167.2	0	0	0	111.7
123	S	25.5	Very low	27.8	Very low	101 Å²	101	137.3 Å²	137.3	71%	0.706	78%	0.781	S	S	*	*			trans	-87.8	147.1	-165.7	54.6	0	0	0	0	116.7
124	Q	27	Very low	27.7	Very low	202 Å²	202	135.2 Å²	135.2	94%	0.944	78%	0.779	S	S	*	*			trans	-162.5	148.7	152.9	-99.7	162.4	0.3	0	0	107.3
125	G	26.1	Very low	27.6	Very low	69 Å²	69	138 Å²	138	71%	0.711	78%	0.783	S	S	*	*			cis	126.9	88.2	-13.3	0	0	0	0	0	114.7
126	Q	26.3	Very low	27.6	Very low	203 Å²	203	138.3 Å²	138.3	95%	0.949	78%	0.78	S	S	*	*			trans	-165	177.3	163	-117.3	162.1	-9.9	0	0	112.1
127	S	26.5	Very low	27.4	Very low	94 Å²	94	142.4 Å²	142.4	66%	0.657	79%	0.786	S	S	*	*			trans	-128	158.1	-156	52.5	0	0	0	0	114.9
128	D	27.1	Very low	27.2	Very low	146 Å²	146	142 Å²	142	78%	0.781	78%	0.784	S	S	*	*			trans	38.5	125.7	144.9	-44.6	-19.9	0	0	0	121.4
129	D	25	Very low	26.9	Very low	169 Å²	169	142.5 Å²	142.5	90%	0.904	79%	0.788	S	S	*	*			trans	-169.6	138.8	133	-98.7	-25.7	0	0	0	110.5
130	E	30.5	Very low	27.6	Very low	186 Å²	186	138.2 Å²	138.2	87%	0.869	78%	0.78	S	S	*	*			trans	-135.2	145.6	165.8	-110.8	-171.9	-165.4	0	0	107.1
131	P	38.3	Very low	27.4	Very low	105 Å²	105	140.6 Å²	140.6	68%	0.682	79%	0.787	S	S	*	*				-155.3	164.4	105.8	40.2	-23	0	0	0	116.9
132	D	26.5	Very low	27.1	Very low	139 Å²	139	141.6 Å²	141.6	74%	0.743	78%	0.782	S	S	*	*			trans	57.3	149.5	141.1	-63	-10.4	0	0	0	121.3
133	L	26.2	Very low	26.9	Very low	130 Å²	130	143 Å²	143	68%	0.681	78%	0.781	S	S	*	*			cis	-164.1	-176.2	-9.3	-115.1	170.3	0	0	0	110
134	D	25	Very low	26.7	Very low	134 Å²	134	147.8 Å²	147.8	72%	0.717	79%	0.789	S	S	*	*			trans	70.2	148.7	162.1	-50	-31.4	0	0	0	118.3
135	E	27.2	Very low	26.4	Very low	177 Å²	177	141.4 Å²	141.4	83%	0.827	78%	0.777	S	S	*	*			cis	-151.4	-176	-2	-135.4	176.3	-166.4	0	0	111.4
136	D	25.1	Very low	26.4	Very low	150 Å²	150	148.7 Å²	148.7	80%	0.802	79%	0.789	S	S	*	*			trans	-63.3	174.6	-175.3	-70.7	-63.4	0	0	0	115.9
137	D	24.1	Very low	26.5	Very low	149 Å²	149	142.4 Å²	142.4	80%	0.797	78%	0.779	S	S	*	*			cis	-166.3	171.6	37.6	-169.3	13.6	0	0	0	113.7
138	N	24.4	Very low	26.3	Very low	142 Å²	142	148 Å²	148	76%	0.759	79%	0.791	S	S	*	*			trans	-94.8	133.2	175.7	-96.5	-74.9	0	0	0	113.7
139	N	24	Very low	26.2	Very low	156 Å²	156	145.7 Å²	145.7	83%	0.834	79%	0.793	S	S	*	*			trans	-159.2	147	146.5	-121.6	-53.5	0	0	0	114.2
140	P	40.6	Very low	26.4	Very low	103 Å²	103	141.9 Å²	141.9	67%	0.669	79%	0.785	S	S	*	*			trans	-125.3	-164.7	-171.6	31.2	-8.9	0	0	0	115.7
141	V	23.8	Very low	26.1	Very low	125 Å²	125	142 Å²	142	76%	0.758	79%	0.785	S	S	*	*			trans	86.1	144.3	154.3	-137.9	0	0	0	0	120.8
142	V	22.9	Very low	25.6	Very low	119 Å²	119	144 Å²	144	72%	0.721	79%	0.786	S	S	*	*			trans	72.9	108.6	161.2	-153.9	0	0	0	0	117.3
143	K	22.2	Very low	25.6	Very low	203 Å²	203	143.7 Å²	143.7	88%	0.883	78%	0.78	S	S	*	*				-156	135.9	90.1	-98.5	167.5	-174.9	162.6	0	116
144	K	20.9	Very low	25.5	Very low	203 Å²	203	146.9 Å²	146.9	88%	0.883	78%	0.783	S	S	*	*			trans	-69	157.9	158.7	-56.7	168.5	-178.3	174.9	0	109
145	G	22.4	Very low	25.4	Very low	67 Å²	67	146.7 Å²	146.7	69%	0.691	78%	0.782	S	S	*	*			cis	125.9	112.2	0.8	0	0	0	0	0	112.4
146	K	24.8	Very low	25.2	Very low	222 Å²	222	144.2 Å²	144.2	97%	0.965	78%	0.778	S	S	*	*			trans	65.5	158.7	178.3	-53.3	179.7	-177.7	-178.7	0	114.3
147	G	27.9	Very low	25.1	Very low	71 Å²	71	141.7 Å²	141.7	73%	0.732	78%	0.778	S	S	*	*			cis	145.8	132.5	-5.4	0	0	0	0	0	112.2
148	K	23.8	Very low	25.1	Very low	212 Å²	212	138.6 Å²	138.6	92%	0.922	77%	0.774	S	S	*	*			trans	-147.7	156.7	168.3	-71	-169.2	177.2	179.9	0	107.2
149	A	23.8	Very low	25.1	Very low	98 Å²	98	138.4 Å²	138.4	81%	0.81	77%	0.772	S	S	*	*			cis	-149.7	-178.7	23.8	0	0	0	0	0	110.5
150	A	29.7	Very low	25.1	Very low	89 Å²	89	138.4 Å²	138.4	74%	0.736	77%	0.765	S	S	*	*			cis	-178	150.7	-42.8	0	0	0	0	0	108.3
151	E	23.9	Very low	24.3	Very low	189 Å²	189	138.2 Å²	138.2	88%	0.883	76%	0.758	S	S	*	*			trans	-151.1	-173.4	142	-134.1	168.3	-178.6	0	0	111.7
152	Q	27.6	Very low	24.3	Very low	147 Å²	147	138.2 Å²	138.2	69%	0.687	75%	0.754	S	S	*	*			trans	-113	141.9	-141.2	-61	-171.4	29.8	0	0	117
153	Q	26.9	Very low	24.4	Very low	132 Å²	132	138.9 Å²	138.9	62%	0.617	75%	0.754	S	S	*	*			trans	61.1	143.5	138.2	-68.2	-175.6	85.1	0	0	118.7
154	R	24.5	Very low	24.6	Very low	197 Å²	197	137 Å²	137	74%	0.743	75%	0.748	S	S	*	*			cis	-159.4	158.5	12.5	-131	-179.9	-146.4	-170.3	4.4	112.2
155	N	23.3	Very low	24.9	Very low	130 Å²	130	135.7 Å²	135.7	70%	0.695	75%	0.745	S	S	*	*			trans	73.2	129.3	150.2	-76.4	13.6	0	0	0	123.5
156	T	22.2	Very low	25	Very low	124 Å²	124	139.7 Å²	139.7	76%	0.761	75%	0.751	S	S	*	*			trans	64.6	89.8	137.7	57	0	0	0	0	122.2
157	A	23.6	Very low	25.1	Very low	97 Å²	97	136 Å²	136	80%	0.802	74%	0.742	S	S	*	*				73.4	136.6	102.8	0	0	0	0	0	123
158	A	23.6	Very low	25	Very low	84 Å²	84	140.9 Å²	140.9	69%	0.694	75%	0.745	S	S	*	*			trans	90.5	125	142.5	0	0	0	0	0	120.6
159	N	23.8	Very low	25.3	Very low	138 Å²	138	134.7 Å²	134.7	74%	0.738	74%	0.742	S	S	*	*				75.7	135.9	129.8	-83.1	9.6	0	0	0	122.3
160	K	24.6	Very low	25.5	Very low	156 Å²	156	135.4 Å²	135.4	68%	0.678	74%	0.741	S	S	*	*			trans	71.3	156.8	139.7	-67.8	-173.6	151.9	-66.3	0	116.4
161	D	23.5	Very low	25.8	Very low	99 Å²	99	138.9 Å²	138.9	53%	0.529	75%	0.747	S	S	.	*			cis	-161.1	171.1	-14.5	-104.2	-10	0	0	0	108.4
162	D	25.5	Very low	26	Very low	125 Å²	125	134.7 Å²	134.7	67%	0.668	74%	0.738	S	S	*	*			trans	42.7	131.9	142.7	-53.7	-14.3	0	0	0	122.8
163	N	24.5	Very low	26.1	Very low	134 Å²	134	135.8 Å²	135.8	72%	0.717	75%	0.746	S	S	*	*			trans	68	167.6	141.5	-63.3	13.7	0	0	0	118.4
164	E	25.8	Very low	26.3	Very low	163 Å²	163	138.7 Å²	138.7	76%	0.762	76%	0.762	S	S	*	*			cis	-139.2	-162.2	4.5	-144.9	135.1	-109.8	0	0	111.7
165	E	26.9	Very low	26.8	Very low	176 Å²	176	136.9 Å²	136.9	82%	0.822	76%	0.762	S	S	*	*			trans	-92.7	-164.8	-166.8	-57.8	-179.1	108.7	0	0	114.6
166	D	25.6	Very low	27.5	Very low	150 Å²	150	133.7 Å²	133.7	80%	0.802	75%	0.749	S	S	*	*			trans	81.7	92.8	156.1	-63.8	-10	0	0	0	122.6
167	D	25.5	Very low	28.2	Very low	145 Å²	145	131.3 Å²	131.3	78%	0.775	74%	0.743	S	S	*	*				110.6	154.1	100.8	-149.1	22.9	0	0	0	121.7
168	E	25.7	Very low	29	Very low	173 Å²	173	134 Å²	134	81%	0.808	74%	0.739	S	S	*	*			trans	41.8	120.5	168.2	-81.7	-169.6	169.7	0	0	122.6
169	G	31.7	Very low	29.8	Very low	82 Å²	82	133.6 Å²	133.6	85%	0.845	73%	0.725	S	S	*	*			trans	88.8	94.9	130.8	0	0	0	0	0	118.7
170	S	27.1	Very low	30.7	Very low	114 Å²	114	131.3 Å²	131.3	80%	0.797	72%	0.715	S	S	*	*			trans	-128.6	85.8	162	47.7	0	0	0	0	112.7	S172	S170-S172 PolarHBondContact O-N 2.91Å
171	D	35.2	Very low	31.5	Very low	162 Å²	162	129.4 Å²	129.4	87%	0.866	71%	0.712	S	S	*	*			trans	-71.9	120.2	156.8	-175.1	14.6	0	0	0	108.2
172	S	28.1	Very low	32.3	Very low	100 Å²	100	127.5 Å²	127.5	70%	0.699	71%	0.709	S	S	*	*			trans	-141.3	120.4	177.8	63.2	0	0	0	0	111.4	S170 M174	S170-S172 PolarHBondContact O-N 2.91Å; S172-M174 PolarHBondContact O-N 3.33Å
173	M	29.5	Very low	32.9	Very low	171 Å²	171	128.3 Å²	128.3	84%	0.842	71%	0.709	S	S	*	*			trans	-68.5	123.8	-177	-65	175.8	174.2	0	0	111.2	Q175	M173-Q175 PolarHBondContact O-N 3.39Å; M173-Q175 VanDerWaalsContact O-N 3.08Å
174	M	32.7	Very low	33.5	Very low	193 Å²	193	129.4 Å²	129.4	95%	0.951	71%	0.71	S	S	*	*			trans	-66.5	105.5	157.6	-74.7	-170.2	175	0	0	108.7	S172	S172-M174 PolarHBondContact O-N 3.33Å
175	Q	34.6	Very low	34.1	Very low	158 Å²	158	125.7 Å²	125.7	74%	0.738	71%	0.707	S	S	*	*			trans	-62.5	135.1	175	-72.7	177.3	-21.6	0	0	110.4	M173	M173-Q175 PolarHBondContact O-N 3.39Å; M173-Q175 VanDerWaalsContact O-N 3.08Å
176	S	37.3	Very low	34.6	Very low	63 Å²	63	126.1 Å²	126.1	44%	0.441	71%	0.706	S	S	.	*			trans	-77.9	156.3	-176.9	73.4	0	0	0	0	111.6	E178 D179	S176-E178 PolarHBondContact O-N 3.05Å; S176-D179 PolarHBondContact O-N 3.21Å; S176-D179 VanDerWaalsContact O-N 3.13Å
177	A	37.6	Very low	35.4	Very low	75 Å²	75	127.9 Å²	127.9	62%	0.62	71%	0.709	S	S	*	*	H	α-helix	trans	-61.5	-13.7	-179.2	0	0	0	0	0	114.2	I181	A177-I181 WeakPolarHBondContact O-CG1 3.41Å; A177-I181 PolarHBondContact O-N 2.55Å
178	E	39.4	Very low	35.8	Very low	153 Å²	153	125.4 Å²	125.4	72%	0.715	71%	0.709	S	S	*	*	H	α-helix	trans	-68.9	-33.3	175.8	-60.3	-167	117.2	0	0	112.5	S176 V180 I181 A182	S176-E178 PolarHBondContact O-N 3.05Å; E178-V180 PolarHBondContact O-N 3.03Å; E178-I181 PolarHBondContact O-N 3.48Å; E178-A182 WeakPolarHBondContact O-CB 3.48Å; E178-A182 PolarHBondContact O-N 3.45Å
179	D	40.4	Very low	36.7	Very low	76 Å²	76	122.2 Å²	122.2	41%	0.406	71%	0.712	S	S	.	*	H	α-helix	trans	-66.7	-38.3	178.8	-75.5	-46.4	0	0	0	112.1	S176 I181 A182 Q183	S176-D179 PolarHBondContact O-N 3.21Å; S176-D179 VanDerWaalsContact O-N 3.13Å; D179-I181 VanDerWaalsContact C-N 3.32Å; D179-I181 PolarHBondContact O-N 2.99Å; D179-A182 PolarHBondContact O-N 3.35Å; D179-Q183 WeakPolarHBondContact O-CG 3.3Å; D179-Q183 PolarHBondContact O-N 2.92Å
180	V	43	Very low	37.1	Very low	89 Å²	89	125.7 Å²	125.7	54%	0.539	71%	0.712	S	S	.	*	H	α-helix	trans	-64.8	-39.2	176.7	-176	0	0	0	0	110.8	E178 Q183 Q184	E178-V180 PolarHBondContact O-N 3.03Å; V180-Q183 PolarHBondContact O-N 2.84Å; V180-Q184 PolarHBondContact O-N 3.38Å
181	I	41.4	Very low	38.1	Very low	117 Å²	117	124.8 Å²	124.8	60%	0.6	70%	0.698	S	S	*	*	H	α-helix	trans	-69.2	-39.2	175.7	-63.8	167.1	0	0	0	110.6	A177 E178 D179 Q183 Q184 A185	A177-I181 WeakPolarHBondContact O-CG1 3.41Å; A177-I181 PolarHBondContact O-N 2.55Å; E178-I181 PolarHBondContact O-N 3.48Å; D179-I181 VanDerWaalsContact C-N 3.32Å; D179-I181 PolarHBondContact O-N 2.99Å; I181-Q183 VanDerWaalsContact C-N 3.33Å; I181-Q183 PolarHBondContact O-N 3.21Å; I181-Q184 PolarHBondContact O-N 2.83Å; I181-A185 PolarHBondContact O-N 3.11Å
182	A	40.4	Very low	38.9	Very low	58 Å²	58	122.3 Å²	122.3	48%	0.479	69%	0.691	S	S	.	*	H	α-helix	trans	-66.3	-31.7	177.4	0	0	0	0	0	113.3	E178 D179	E178-A182 WeakPolarHBondContact O-CB 3.48Å; E178-A182 PolarHBondContact O-N 3.45Å; D179-A182 PolarHBondContact O-N 3.35Å
183	Q	37.9	Very low	40.1	Very low	143 Å²	143	120.5 Å²	120.5	67%	0.668	67%	0.67	S	S	*	*	H	α-helix	trans	-73.6	-44.4	175	-71.3	-178.4	16.5	0	0	112.3	D179 V180 I181 A185 K186	D179-Q183 WeakPolarHBondContact O-CG 3.3Å; D179-Q183 PolarHBondContact O-N 2.92Å; V180-Q183 PolarHBondContact O-N 2.84Å; I181-Q183 VanDerWaalsContact C-N 3.33Å; I181-Q183 PolarHBondContact O-N 3.21Å; Q183-A185 PolarHBondContact O-N 2.84Å; Q183-K186 PolarHBondContact O-N 3.26Å
184	Q	37	Very low	41.1	Very low	157 Å²	157	115.7 Å²	115.7	73%	0.734	66%	0.657	S	S	*	*	H	α-helix	trans	-64.3	-20.4	177.6	-70.9	-173.7	-5.1	0	0	113.5	V180 I181 K186	V180-Q184 PolarHBondContact O-N 3.38Å; I181-Q184 PolarHBondContact O-N 2.83Å; Q184-K186 PolarHBondContact O-N 2.81Å
185	A	38.3	Very low	41.9	Very low	84 Å²	84	115.5 Å²	115.5	69%	0.694	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	-0.1	176.8	0	0	0	0	0	115.3	I181 Q183	I181-A185 PolarHBondContact O-N 3.11Å; Q183-A185 PolarHBondContact O-N 2.84Å
186	K	39.3	Very low	42.8	Very low	186 Å²	186	110.6 Å²	110.6	81%	0.809	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.7	-9.7	-175.6	-81.7	-177.9	174.5	174.4	0	116.7	Q183 Q184	Q183-K186 PolarHBondContact O-N 3.26Å; Q184-K186 PolarHBondContact O-N 2.81Å
187	E	41.9	Very low	44.2	Very low	186 Å²	186	110.7 Å²	110.7	87%	0.869	63%	0.633	S	S	*	*	S	Bend	trans	-120.7	55.8	-176.2	-65	-163.5	143.2	0	0	113.8
188	A	34.3	Very low	45.4	Very low	93 Å²	93	116.3 Å²	116.3	77%	0.769	64%	0.643	S	S	*	*			trans	-152.8	82	167.9	0	0	0	0	0	111.9	D190	A188-D190 PolarHBondContact O-N 3.48Å
189	A	42.9	Very low	46.3	Very low	106 Å²	106	117.5 Å²	117.5	88%	0.876	65%	0.646	S	S	*	*			trans	-89.1	66	-178.9	0	0	0	0	0	113.1
190	D	41.2	Very low	47.1	Very low	156 Å²	156	118.7 Å²	118.7	83%	0.834	65%	0.65	S	S	*	*			trans	-154	130	165.7	-121.2	-29.3	0	0	0	110.4	A188 P192	A188-D190 PolarHBondContact O-N 3.48Å; D190-P192 WeakPolarHBondContact O-CD 3.45Å
191	D	47.9	Very low	47.8	Very low	94 Å²	94	117.9 Å²	117.9	50%	0.503	64%	0.639	S	S	.	*			trans	-85.6	105.8	179.9	173.4	13.5	0	0	0	110.7	F193 A194	D191-F193 PolarHBondContact O-N 3.1Å; D191-F193 WeakPolarHBondContact OD1-CB 3.44Å; D191-F193 PolarHBondContact OD1-N 3.4Å; D191-A194 PolarHBondContact O-N 3.27Å
192	P	52.8	Low	49	Very low	110 Å²	110	119.6 Å²	119.6	71%	0.714	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.6	-0.4	-176.3	31.8	-37.2	0	0	0	113.5	D190	D190-P192 WeakPolarHBondContact O-CD 3.45Å
193	F	51.9	Low	50.2	Low	63 Å²	63	124.3 Å²	124.3	28%	0.276	65%	0.652	S	S	.	*	T	Hydrogen-bonded Turn	trans	-103.8	0.4	177.2	-62.7	-78.2	0	0	0	114.3	D191 H195 L196 K201 K204 M208	D191-F193 PolarHBondContact O-N 3.1Å; D191-F193 WeakPolarHBondContact OD1-CB 3.44Å; D191-F193 PolarHBondContact OD1-N 3.4Å; F193-H195 PolarHBondContact O-N 3.01Å; F193-L196 PolarHBondContact O-N 3.48Å; F193-L196 VanDerWaalsContact O-N 3.15Å; F193-K201 HydrophobicContact CB-CD 4.2Å; F193-K201 WeakPolarHBondContact O-CE 3.35Å; F193-K201 PolarHBondContact O-NZ 2.95Å; F193-K204 HydrophobicContact CE1-CD 4.24Å; F193-M208 HydrophobicContact CZ-CE 3.93Å
194	A	50.9	Low	51.1	Low	69 Å²	69	122.8 Å²	122.8	57%	0.57	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-41.4	-45.5	-172.5	0	0	0	0	0	114.9	D191	D191-A194 PolarHBondContact O-N 3.27Å
195	H	49	Very low	52.5	Low	189 Å²	189	121.5 Å²	121.5	88%	0.875	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.3	2.5	-173	-76.3	-74.5	0	0	0	117.6	F193	F193-H195 PolarHBondContact O-N 3.01Å
196	L	54	Low	53.8	Low	56 Å²	56	124.3 Å²	124.3	29%	0.293	63%	0.631	S	S	.	*	S	Bend	trans	-87.7	144.3	-179	-89	74.3	0	0	0	113.8	F193 E200 K201 K204	F193-L196 PolarHBondContact O-N 3.48Å; F193-L196 VanDerWaalsContact O-N 3.15Å; L196-E200 HydrophobicContact CD2-CB 4.32Å; L196-K201 HydrophobicContact CB-CG 3.99Å; L196-K201 VanDerWaalsContact O-CE 3.22Å; L196-K201 WeakPolarHBondContact O-CE 3.33Å; L196-K204 HydrophobicContact CD2-CD 4.06Å
197	S	67.6	Low	54.7	Low	64 Å²	64	120.2 Å²	120.2	45%	0.448	62%	0.615	S	S	.	*			trans	-61.8	147.1	178.3	179.5	0	0	0	0	112.1	K199 E200 K201	S197-K199 PolarHBondContact O-N 3.4Å; S197-E200 WeakPolarHBondContact CB-OE2 3.21Å; S197-E200 PolarHBondContact N-OE2 3.34Å; S197-E200 WeakPolarHBondContact O-CA 3.32Å; S197-E200 WeakPolarHBondContact O-CB 3.46Å; S197-E200 PolarHBondContact O-N 2.86Å; S197-K201 PolarHBondContact O-N 3.48Å
198	K	60.8	Low	55.2	Low	193 Å²	193	116.1 Å²	116.1	84%	0.839	60%	0.597	S	S	*	*	H	α-helix	trans	-53.2	-31.2	177.3	-66.9	-174.6	179.4	-178.9	0	112.9	K202	K198-K202 WeakPolarHBondContact O-CB 3.43Å; K198-K202 PolarHBondContact O-N 3.26Å
199	K	59.1	Low	56.4	Low	178 Å²	178	116.4 Å²	116.4	77%	0.774	58%	0.582	S	S	*	*	H	α-helix	trans	-71.9	-34.5	176.4	-166.3	175.1	-177.2	179.7	0	112.4	S197 K203	S197-K199 PolarHBondContact O-N 3.4Å; K199-K203 PolarHBondContact O-N 3.34Å
200	E	57.3	Low	57.4	Low	102 Å²	102	118.9 Å²	118.9	48%	0.477	57%	0.57	S	S	.	*	H	α-helix	trans	-81.6	-42.3	-179.2	-60.9	171	134.5	0	0	111.5	L196 S197 K202 K203 K204	L196-E200 HydrophobicContact CD2-CB 4.32Å; S197-E200 WeakPolarHBondContact CB-OE2 3.21Å; S197-E200 PolarHBondContact N-OE2 3.34Å; S197-E200 WeakPolarHBondContact O-CA 3.32Å; S197-E200 WeakPolarHBondContact O-CB 3.46Å; S197-E200 PolarHBondContact O-N 2.86Å; E200-K202 PolarHBondContact O-N 3.18Å; E200-K203 PolarHBondContact O-N 3.09Å; E200-K204 PolarHBondContact O-N 3.46Å
201	K	57.7	Low	57.8	Low	72 Å²	72	116.1 Å²	116.1	31%	0.313	55%	0.552	S	S	.	*	H	α-helix	trans	-53.5	-44.6	169.8	-64.4	-161.9	-174	-156.5	0	110.6	F193 L196 S197 K203 K205	F193-K201 HydrophobicContact CB-CD 4.2Å; F193-K201 WeakPolarHBondContact O-CE 3.35Å; F193-K201 PolarHBondContact O-NZ 2.95Å; L196-K201 HydrophobicContact CB-CG 3.99Å; L196-K201 VanDerWaalsContact O-CE 3.22Å; L196-K201 WeakPolarHBondContact O-CE 3.33Å; S197-K201 PolarHBondContact O-N 3.48Å; K201-K203 PolarHBondContact O-N 3.04Å; K201-K205 WeakPolarHBondContact O-CB 3.16Å; K201-K205 PolarHBondContact O-N 2.93Å
202	K	66.5	Low	58.2	Low	152 Å²	152	121.4 Å²	121.4	66%	0.661	57%	0.565	S	S	*	*	H	α-helix	trans	-66.4	-32.1	176.5	-166.7	169.3	-174.6	173.4	0	113.3	K198 E200 K206	K198-K202 WeakPolarHBondContact O-CB 3.43Å; K198-K202 PolarHBondContact O-N 3.26Å; E200-K202 PolarHBondContact O-N 3.18Å; K202-K206 PolarHBondContact O-N 3.17Å
203	K	65.9	Low	58.1	Low	158 Å²	158	120.6 Å²	120.6	69%	0.687	55%	0.552	S	S	*	*	H	α-helix	trans	-73.4	-47.9	175.2	-166.1	-178	179.2	-170.8	0	111.7	K199 E200 K201 K206 Q207	K199-K203 PolarHBondContact O-N 3.34Å; E200-K203 PolarHBondContact O-N 3.09Å; K201-K203 PolarHBondContact O-N 3.04Å; K203-K206 PolarHBondContact O-N 3.2Å; K203-Q207 PolarHBondContact O-N 3.15Å
204	K	57.8	Low	58.3	Low	111 Å²	111	120.4 Å²	120.4	48%	0.483	56%	0.556	S	S	.	*	H	α-helix	trans	-64.1	-38.4	176	-78.6	-165	174.4	-171	0	112.6	F193 L196 E200 Q207 M208	F193-K204 HydrophobicContact CE1-CD 4.24Å; L196-K204 HydrophobicContact CD2-CD 4.06Å; E200-K204 PolarHBondContact O-N 3.46Å; K204-Q207 PolarHBondContact O-N 3.37Å; K204-M208 PolarHBondContact O-N 3.05Å
205	K	65.9	Low	58.1	Low	129 Å²	129	119.8 Å²	119.8	56%	0.561	55%	0.551	S	S	*	*	H	α-helix	trans	-62.1	-47	174.3	-178.4	166.6	174.2	170.3	0	111.7	K201 Q207 M208 E209	K201-K205 WeakPolarHBondContact O-CB 3.16Å; K201-K205 PolarHBondContact O-N 2.93Å; K205-Q207 PolarHBondContact O-N 3.15Å; K205-M208 PolarHBondContact O-N 3.03Å; K205-E209 WeakPolarHBondContact CE-OE1 3.44Å; K205-E209 HydrophobicContact CG-CG 4.44Å; K205-E209 IonicContact NZ-OE1 2.76Å; K205-E209 WeakPolarHBondContact O-CG 3.44Å; K205-E209 PolarHBondContact O-N 3.41Å
206	K	65.6	Low	58.2	Low	143 Å²	143	113.7 Å²	113.7	62%	0.622	53%	0.529	S	S	*	.	H	α-helix	trans	-59.6	-34.7	173.3	-85.4	-159	164.1	-145.8	0	113.2	K202 K203 Y210	K202-K206 PolarHBondContact O-N 3.17Å; K203-K206 PolarHBondContact O-N 3.2Å; K206-Y210 WeakPolarHBondContact O-CB 3.43Å; K206-Y210 PolarHBondContact O-N 3.08Å
207	Q	57.1	Low	58.2	Low	101 Å²	101	114.3 Å²	114.3	47%	0.472	54%	0.535	S	S	.	.	H	α-helix	trans	-69.4	-44.4	177.1	-175.9	171	-12.7	0	0	111.7	K203 K204 K205 Y210 E211	K203-Q207 PolarHBondContact O-N 3.15Å; K204-Q207 PolarHBondContact O-N 3.37Å; K205-Q207 PolarHBondContact O-N 3.15Å; Q207-Y210 PolarHBondContact O-N 3.15Å; Q207-E211 HydrophobicContact CG-CG 4.49Å; Q207-E211 VanDerWaalsContact CG-OE1 3.27Å; Q207-E211 WeakPolarHBondContact CG-OE1 3.22Å; Q207-E211 PolarHBondContact NE2-OE1 2.96Å; Q207-E211 WeakPolarHBondContact O-CB 3.31Å; Q207-E211 WeakPolarHBondContact O-CG 3.47Å; Q207-E211 PolarHBondContact O-N 3.4Å
208	M	52.9	Low	57.2	Low	100 Å²	100	120.3 Å²	120.3	49%	0.493	55%	0.548	S	S	.	.	H	α-helix	trans	-66.1	-34.8	172.8	-81.4	-170.5	-73	0	0	113.2	F193 K204 K205 R212	F193-M208 HydrophobicContact CZ-CE 3.93Å; K204-M208 PolarHBondContact O-N 3.05Å; K205-M208 PolarHBondContact O-N 3.03Å; M208-R212 WeakPolarHBondContact O-CB 3.25Å; M208-R212 PolarHBondContact O-N 2.95Å
209	E	60.6	Low	56.4	Low	99 Å²	99	113.8 Å²	113.8	46%	0.463	53%	0.53	S	S	.	.	H	α-helix	trans	-62.5	-44.4	172.4	-76.9	166.6	160.7	0	0	110.8	K205 R212 Q213	K205-E209 WeakPolarHBondContact CE-OE1 3.44Å; K205-E209 HydrophobicContact CG-CG 4.44Å; K205-E209 IonicContact NZ-OE1 2.76Å; K205-E209 WeakPolarHBondContact O-CG 3.44Å; K205-E209 PolarHBondContact O-N 3.41Å; E209-R212 PolarHBondContact O-N 2.79Å; E209-Q213 WeakPolarHBondContact O-CB 3.37Å; E209-Q213 PolarHBondContact O-N 2.71Å
210	Y	62.3	Low	55.8	Low	157 Å²	157	111.5 Å²	111.5	62%	0.616	52%	0.522	S	S	*	.	H	α-helix	trans	-65.3	-45.6	175	-177.9	-99	0	0	0	112.7	K206 Q207 R212 Q213 V214	K206-Y210 WeakPolarHBondContact O-CB 3.43Å; K206-Y210 PolarHBondContact O-N 3.08Å; Q207-Y210 PolarHBondContact O-N 3.15Å; Y210-R212 VanDerWaalsContact C-N 3.31Å; Y210-R212 PolarHBondContact O-N 3.18Å; Y210-Q213 PolarHBondContact O-N 2.91Å; Y210-V214 HydrophobicContact CD1-CG2 4.25Å; Y210-V214 HydrophobicContact CE1-CG2 3.91Å; Y210-V214 HydrophobicContact CE2-CG2 4.43Å; Y210-V214 WeakPolarHBondContact O-CB 3.41Å; Y210-V214 WeakPolarHBondContact O-CG2 3.03Å; Y210-V214 PolarHBondContact O-N 3.37Å
211	E	50.5	Low	55.1	Low	99 Å²	99	110 Å²	110	46%	0.463	52%	0.517	S	S	.	.	H	α-helix	trans	-63.4	-36.6	177	-74.3	162.4	-178	0	0	111.5	Q207 A215	Q207-E211 HydrophobicContact CG-CG 4.49Å; Q207-E211 VanDerWaalsContact CG-OE1 3.27Å; Q207-E211 WeakPolarHBondContact CG-OE1 3.22Å; Q207-E211 PolarHBondContact NE2-OE1 2.96Å; Q207-E211 WeakPolarHBondContact O-CB 3.31Å; Q207-E211 WeakPolarHBondContact O-CG 3.47Å; Q207-E211 PolarHBondContact O-N 3.4Å; E211-A215 WeakPolarHBondContact O-CB 3.42Å; E211-A215 PolarHBondContact O-N 3.32Å
212	R	55.2	Low	54.2	Low	204 Å²	204	110.5 Å²	110.5	77%	0.77	54%	0.535	S	S	*	.	H	α-helix	trans	-68.1	-39.4	172.6	-172.6	177	-179	-178.6	0.8	112.5	M208 E209 Y210 A215 S216	M208-R212 WeakPolarHBondContact O-CB 3.25Å; M208-R212 PolarHBondContact O-N 2.95Å; E209-R212 PolarHBondContact O-N 2.79Å; Y210-R212 VanDerWaalsContact C-N 3.31Å; Y210-R212 PolarHBondContact O-N 3.18Å; R212-A215 WeakPolarHBondContact O-CB 3.44Å; R212-A215 PolarHBondContact O-N 2.89Å; R212-S216 PolarHBondContact O-N 3.3Å; R212-S216 PolarHBondContact O-OG 3.28Å
213	Q	52.4	Low	53.1	Low	93 Å²	93	110.8 Å²	110.8	44%	0.435	54%	0.543	S	S	.	.	H	α-helix	trans	-67.9	-39	176.5	-165.6	176.2	5	0	0	111.5	E209 Y210 A215 S216 V217	E209-Q213 WeakPolarHBondContact O-CB 3.37Å; E209-Q213 PolarHBondContact O-N 2.71Å; Y210-Q213 PolarHBondContact O-N 2.91Å; Q213-A215 VanDerWaalsContact C-N 3.34Å; Q213-S216 WeakPolarHBondContact CA-OG 3.47Å; Q213-S216 PolarHBondContact O-N 3.49Å; Q213-S216 PolarHBondContact O-OG 3.37Å; Q213-V217 WeakPolarHBondContact O-CG2 3.18Å; Q213-V217 PolarHBondContact O-N 2.87Å; Q213-V217 VanDerWaalsContact O-N 3.1Å
214	V	55.2	Low	52	Low	60 Å²	60	108.8 Å²	108.8	36%	0.364	54%	0.536	S	S	.	.	H	α-helix	trans	-65.7	-36.4	171.2	170.8	0	0	0	0	111.4	Y210 R218	Y210-V214 HydrophobicContact CD1-CG2 4.25Å; Y210-V214 HydrophobicContact CE1-CG2 3.91Å; Y210-V214 HydrophobicContact CE2-CG2 4.43Å; Y210-V214 WeakPolarHBondContact O-CB 3.41Å; Y210-V214 WeakPolarHBondContact O-CG2 3.03Å; Y210-V214 PolarHBondContact O-N 3.37Å; V214-R218 WeakPolarHBondContact O-CB 3.44Å; V214-R218 PolarHBondContact O-N 3.32Å
215	A	46.5	Very low	51.5	Low	56 Å²	56	105.9 Å²	105.9	46%	0.463	54%	0.538	S	S	.	.	H	α-helix	trans	-67.2	-40.8	174.9	0	0	0	0	0	112.7	E211 R212 Q213 R218 A219	E211-A215 WeakPolarHBondContact O-CB 3.42Å; E211-A215 PolarHBondContact O-N 3.32Å; R212-A215 WeakPolarHBondContact O-CB 3.44Å; R212-A215 PolarHBondContact O-N 2.89Å; Q213-A215 VanDerWaalsContact C-N 3.34Å; A215-R218 PolarHBondContact O-N 3.48Å; A215-A219 PolarHBondContact O-N 3.28Å
216	S	50.6	Low	51	Low	60 Å²	60	105.4 Å²	105.4	42%	0.42	54%	0.541	S	S	.	.	H	α-helix	trans	-66.6	-39.1	175.4	50.7	0	0	0	0	112.7	R212 Q213 R218 A219 Q220	R212-S216 PolarHBondContact O-N 3.3Å; R212-S216 PolarHBondContact O-OG 3.28Å; Q213-S216 WeakPolarHBondContact CA-OG 3.47Å; Q213-S216 PolarHBondContact O-N 3.49Å; Q213-S216 PolarHBondContact O-OG 3.37Å; S216-R218 VanDerWaalsContact C-N 3.34Å; S216-A219 PolarHBondContact O-N 3.3Å; S216-Q220 PolarHBondContact O-N 2.85Å
217	V	55.6	Low	50.6	Low	69 Å²	69	102.1 Å²	102.1	42%	0.418	53%	0.527	S	S	.	.	H	α-helix	trans	-63.7	-40.4	172.9	171.4	0	0	0	0	110.9	Q213 A219 Q220 N221	Q213-V217 WeakPolarHBondContact O-CG2 3.18Å; Q213-V217 PolarHBondContact O-N 2.87Å; Q213-V217 VanDerWaalsContact O-N 3.1Å; V217-A219 VanDerWaalsContact C-N 3.33Å; V217-A219 PolarHBondContact O-N 3.22Å; V217-Q220 PolarHBondContact O-N 2.89Å; V217-N221 WeakPolarHBondContact O-CB 3.5Å; V217-N221 PolarHBondContact O-N 2.7Å; V217-N221 PolarHBondContact O-OD1 3.19Å
218	R	45.3	Very low	51.2	Low	191 Å²	191	100 Å²	100	72%	0.721	52%	0.524	S	S	*	.	H	α-helix	trans	-62.9	-36	172.2	-88.3	-176.3	166.8	174.5	-4.1	113.5	V214 A215 S216 A222	V214-R218 WeakPolarHBondContact O-CB 3.44Å; V214-R218 PolarHBondContact O-N 3.32Å; A215-R218 PolarHBondContact O-N 3.48Å; S216-R218 VanDerWaalsContact C-N 3.34Å; R218-A222 WeakPolarHBondContact O-CB 3.33Å; R218-A222 PolarHBondContact O-N 2.87Å; R218-A222 VanDerWaalsContact O-N 3.13Å
219	A	44.6	Very low	52	Low	56 Å²	56	97.5 Å²	97.5	46%	0.463	51%	0.514	S	S	.	.	H	α-helix	trans	-69.3	-37.5	177.4	0	0	0	0	0	112.2	A215 S216 V217 A222	A215-A219 PolarHBondContact O-N 3.28Å; S216-A219 PolarHBondContact O-N 3.3Å; V217-A219 VanDerWaalsContact C-N 3.33Å; V217-A219 PolarHBondContact O-N 3.22Å; A219-A222 PolarHBondContact O-N 2.99Å
220	Q	45.4	Very low	52.5	Low	129 Å²	129	96.1 Å²	96.1	60%	0.603	52%	0.515	S	S	*	.	H	α-helix	trans	-66.3	-45.5	172.5	-69.8	178	-56.2	0	0	111.4	S216 V217 A222 L223 E224	S216-Q220 PolarHBondContact O-N 2.85Å; V217-Q220 PolarHBondContact O-N 2.89Å; Q220-A222 PolarHBondContact O-N 3.04Å; Q220-L223 PolarHBondContact O-N 3.07Å; Q220-E224 PolarHBondContact O-N 3.42Å; Q220-E224 VanDerWaalsContact O-N 3.16Å
221	N	44.3	Very low	52.5	Low	71 Å²	71	91.8 Å²	91.8	38%	0.38	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-2.3	174.5	-61.1	-2	0	0	0	114.2	V217	V217-N221 WeakPolarHBondContact O-CB 3.5Å; V217-N221 PolarHBondContact O-N 2.7Å; V217-N221 PolarHBondContact O-OD1 3.19Å
222	A	38.9	Very low	52.7	Low	82 Å²	82	90.2 Å²	90.2	68%	0.678	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.4	-11.6	171.5	0	0	0	0	0	112.8	R218 A219 Q220	R218-A222 WeakPolarHBondContact O-CB 3.33Å; R218-A222 PolarHBondContact O-N 2.87Å; R218-A222 VanDerWaalsContact O-N 3.13Å; A219-A222 PolarHBondContact O-N 2.99Å; Q220-A222 PolarHBondContact O-N 3.04Å
223	L	42.9	Very low	52.1	Low	159 Å²	159	87.9 Å²	87.9	83%	0.832	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100	-30.7	174.2	-75.7	158.6	0	0	0	111.8	Q220	Q220-L223 PolarHBondContact O-N 3.07Å
224	E	43.5	Very low	52.1	Low	115 Å²	115	88.1 Å²	88.1	54%	0.537	51%	0.506	S	S	.	.	S	Bend	trans	-108.2	105.3	168.1	-62.6	-168.9	163.1	0	0	109.5	Q220	Q220-E224 PolarHBondContact O-N 3.42Å; Q220-E224 VanDerWaalsContact O-N 3.16Å
225	G	46.4	Very low	51.7	Low	51 Å²	51	90.8 Å²	90.8	53%	0.526	53%	0.527	S	S	.	.			trans	-70.9	152.7	-166.6	0	0	0	0	0	116	F227	G225-F227 WeakPolarHBondContact O-CD2 3.32Å; G225-F227 PolarHBondContact O-N 2.95Å
226	D	54.4	Low	52	Low	118 Å²	118	92.6 Å²	92.6	63%	0.631	54%	0.537	S	S	*	.	S	Bend	trans	58.1	-8.8	165.1	-97.4	40.8	0	0	0	120.1	H257	D226-H257 PolarHBondContact O-N 3.01Å; D226-H257 IonicContact OD2-CE1 2.71Å; D226-H257 PolarHBondContact OD2-CE1 3.5Å; D226-H257 IonicContact OD2-CG 3.13Å; D226-H257 IonicContact OD2-ND1 3.84Å; D226-H257 PolarHBondContact OD2-ND1 3.48Å
227	F	57.8	Low	52.2	Low	75 Å²	75	92.9 Å²	92.9	33%	0.329	53%	0.528	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	151.2	177	-63.3	-78.8	0	0	0	112.1	G225 A256 T287 H291	G225-F227 WeakPolarHBondContact O-CD2 3.32Å; G225-F227 PolarHBondContact O-N 2.95Å; F227-A256 HydrophobicContact CD1-CB 3.53Å; F227-A256 HydrophobicContact CE1-CB 3.42Å; F227-A256 VanDerWaalsContact CE1-CB 3.42Å; F227-T287 HydrophobicContact CD1-CG2 4.13Å; F227-T287 HydrophobicContact CE1-CG2 3.67Å; F227-H291 AromaticContact CD1-NE2 3.71Å; F227-H291 AromaticContact CG-CE1 3.96Å; F227-H291 AromaticContact CG-NE2 3.93Å
228	S	69.9	Low	52.1	Low	57 Å²	57	96.8 Å²	96.8	40%	0.399	54%	0.542	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	122.7	168.8	51.3	0	0	0	0	110.2	S255	S228-S255 PolarHBondContact N-O 2.99Å; S228-S255 PolarHBondContact O-N 3.37Å; S228-S255 PolarHBondContact OG-O 3.47Å
229	V	70.8	Confident	52.3	Low	46 Å²	46	91 Å²	91	28%	0.279	54%	0.536	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	139.2	176.4	-178.8	0	0	0	0	108.2	Q231 L297	V229-Q231 HydrophobicContact CG1-CG 4.25Å; V229-L297 HydrophobicContact CG1-CD2 3.95Å
230	S	69.8	Low	52.7	Low	71 Å²	71	95.4 Å²	95.4	50%	0.497	55%	0.548	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	131.9	167.2	50.1	0	0	0	0	110.3	S253	S230-S253 PolarHBondContact N-O 3.14Å; S230-S253 PolarHBondContact O-N 3.42Å
231	Q	62.7	Low	53.3	Low	66 Å²	66	90.3 Å²	90.3	31%	0.308	53%	0.525	S	S	.	.			trans	-127.2	146.8	173.3	-59.6	-157.7	-24.1	0	0	108.4	V229 E233 F252	V229-Q231 HydrophobicContact CG1-CG 4.25Å; Q231-E233 PolarHBondContact O-N 3.05Å; Q231-F252 HydrophobicContact CG-CB 4.31Å
232	A	54	Low	53.8	Low	66 Å²	66	92.7 Å²	92.7	55%	0.545	53%	0.534	S	S	.	.			trans	-74.9	108.7	172.7	0	0	0	0	0	109.8	L234	A232-L234 PolarHBondContact O-N 3.06Å
233	E	43.5	Very low	54.6	Low	154 Å²	154	95.5 Å²	95.5	72%	0.72	54%	0.538	S	S	*	.			trans	-59.5	102.2	174.3	-74.5	-172	161.4	0	0	110.8	Q231	Q231-E233 PolarHBondContact O-N 3.05Å
234	L	51.6	Low	55.7	Low	99 Å²	99	89.1 Å²	89.1	52%	0.518	51%	0.508	S	S	.	.			trans	-107.8	90.1	167.8	-79.9	165.3	0	0	0	107.9	A232 S236 R237	A232-L234 PolarHBondContact O-N 3.06Å; L234-S236 PolarHBondContact O-N 2.75Å; L234-R237 PolarHBondContact O-N 2.8Å
235	S	47.1	Very low	57.2	Low	115 Å²	115	87.1 Å²	87.1	80%	0.804	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-4.1	-171	-36.8	0	0	0	0	115.5
236	S	52.7	Low	59.1	Low	95 Å²	95	87.5 Å²	87.5	66%	0.664	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-12.9	173.5	52.9	0	0	0	0	114.4	L234	L234-S236 PolarHBondContact O-N 2.75Å
237	R	55	Low	60.7	Low	65 Å²	65	82.2 Å²	82.2	25%	0.245	47%	0.468	C	S	.	.	S	Bend	trans	-74.9	-25.3	-172.9	-115.9	178.5	168.3	117.8	5.3	114.4	L234 A239 M240 L241 K248 E250	L234-R237 PolarHBondContact O-N 2.8Å; R237-A239 PolarHBondContact O-N 2.98Å; R237-M240 WeakPolarHBondContact O-CA 3.46Å; R237-M240 WeakPolarHBondContact O-CB 3.24Å; R237-M240 PolarHBondContact O-N 3.39Å; R237-L241 WeakPolarHBondContact O-CG 3.5Å; R237-L241 PolarHBondContact O-N 3.16Å; R237-K248 PolarHBondContact NH2-O 2.78Å; R237-E250 IonicContact CZ-OE2 3.69Å; R237-E250 VanDerWaalsContact CZ-OE2 3.22Å; R237-E250 IonicContact NH1-OE2 3.53Å; R237-E250 PolarHBondContact NH1-OE2 3.42Å; R237-E250 VanDerWaalsContact NH2-CD 3.29Å; R237-E250 IonicContact NH2-OE1 2.7Å; R237-E250 IonicContact NH2-OE2 3.42Å; R237-E250 PolarHBondContact NH2-OE2 2.89Å
238	Q	53.8	Low	62.2	Low	151 Å²	151	83.6 Å²	83.6	71%	0.706	47%	0.474	S	S	*	.	H	α-helix	trans	-62.9	-43	-166	-149.4	157.8	1.1	0	0	113.1	M240 L241	Q238-M240 VanDerWaalsContact C-N 3.29Å; Q238-M240 PolarHBondContact O-N 2.88Å; Q238-L241 PolarHBondContact O-N 3.36Å
239	A	48.4	Very low	63	Low	71 Å²	71	81.5 Å²	81.5	59%	0.587	46%	0.458	S	S	*	.	H	α-helix	trans	-73.9	-15.2	175.2	0	0	0	0	0	114.2	R237	R237-A239 PolarHBondContact O-N 2.98Å
240	M	52.9	Low	63.8	Low	148 Å²	148	82.9 Å²	82.9	73%	0.729	46%	0.461	S	S	*	.	H	α-helix	trans	-83.4	-29	170.8	-76.9	-173	163.3	0	0	112.3	R237 Q238	R237-M240 WeakPolarHBondContact O-CA 3.46Å; R237-M240 WeakPolarHBondContact O-CB 3.24Å; R237-M240 PolarHBondContact O-N 3.39Å; Q238-M240 VanDerWaalsContact C-N 3.29Å; Q238-M240 PolarHBondContact O-N 2.88Å
241	L	58.6	Low	64.6	Low	21 Å²	21	85 Å²	85	11%	0.11	46%	0.462	C	S	.	.	H	α-helix	trans	-66.6	-38.3	178.9	-69.6	167.1	0	0	0	111.5	R237 Q238 N243 A244 P300	R237-L241 WeakPolarHBondContact O-CG 3.5Å; R237-L241 PolarHBondContact O-N 3.16Å; Q238-L241 PolarHBondContact O-N 3.36Å; L241-N243 PolarHBondContact O-N 2.65Å; L241-N243 VanDerWaalsContact O-N 3.13Å; L241-A244 PolarHBondContact O-N 2.75Å; L241-A244 VanDerWaalsContact O-N 3.11Å; L241-P300 HydrophobicContact CB-CG 4.5Å; L241-P300 HydrophobicContact CD2-CG 3.79Å; L241-P300 WeakPolarHBondContact O-CB 3.35Å
242	E	55.2	Low	65.9	Low	122 Å²	122	81.9 Å²	81.9	57%	0.57	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-28.7	-177.4	-65.7	178.1	159.3	0	0	114.5
243	N	56.4	Low	67.5	Low	141 Å²	141	79.6 Å²	79.6	75%	0.754	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.7	4.1	-178.8	-67.9	-78.2	0	0	0	113.4	L241	L241-N243 PolarHBondContact O-N 2.65Å; L241-N243 VanDerWaalsContact O-N 3.13Å
244	A	64.6	Low	69.7	Low	25 Å²	25	72.2 Å²	72.2	21%	0.207	39%	0.393	C	S	.	.			trans	-85	127	-177.4	0	0	0	0	0	111.8	L241 D246 P300 N302	L241-A244 PolarHBondContact O-N 2.75Å; L241-A244 VanDerWaalsContact O-N 3.11Å; A244-D246 VanDerWaalsContact C-N 3.34Å; A244-P300 HydrophobicContact CB-CG 4.27Å; A244-N302 PolarHBondContact O-ND2 3.02Å
245	S	76.1	Confident	71.4	Confident	73 Å²	73	69 Å²	69	51%	0.51	38%	0.379	S	S	.	.	S	Bend	trans	-76.9	-25.8	163.6	59.4	0	0	0	0	112.6	I303	S245-I303 WeakPolarHBondContact O-CD1 3.23Å
246	D	87	Confident	73	Confident	59 Å²	59	64 Å²	64	32%	0.316	34%	0.344	S	S	.	.	S	Bend	trans	-108.8	137.1	-168.3	-66.2	1.3	0	0	0	110.3	A244 K248 I269 A271	A244-D246 VanDerWaalsContact C-N 3.34Å; D246-K248 PolarHBondContact O-N 2.67Å; D246-I269 CarbonylContact C-O 3.55Å; D246-I269 WeakPolarHBondContact CA-O 3.32Å; D246-A271 PolarHBondContact OD1-N 2.77Å
247	I	87.6	Confident	73.9	Confident	6 Å²	6	65.8 Å²	65.8	3%	0.031	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	112.8	176.4	-56.2	168.2	0	0	0	108	L249 L267 L268 I269 I299 I303 L415	I247-L249 HydrophobicContact CG2-CD1 4.44Å; I247-L267 HydrophobicContact CG2-CD2 4.32Å; I247-L268 WeakPolarHBondContact O-CA 3.43Å; I247-I269 HydrophobicContact CB-CB 4.13Å; I247-I269 HydrophobicContact CD1-CB 4.38Å; I247-I269 HydrophobicContact CD1-CD1 4.14Å; I247-I269 PolarHBondContact N-O 3.08Å; I247-I269 PolarHBondContact O-N 2.89Å; I247-I299 HydrophobicContact CD1-CD1 4.38Å; I247-I299 HydrophobicContact CD1-CG2 4.13Å; I247-I299 HydrophobicContact CG1-CG2 4.37Å; I247-I299 HydrophobicContact CG2-CD1 3.73Å; I247-I303 HydrophobicContact CD1-CD1 4.29Å; I247-I303 HydrophobicContact CG1-CD1 3.62Å; I247-L415 HydrophobicContact CD1-CD2 3.69Å
248	K	88.8	Confident	74.6	Confident	105 Å²	105	67 Å²	67	46%	0.457	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	90	174.8	-171.1	174.9	-160.3	-130.3	0	112	R237 D246 E250 L268	R237-K248 PolarHBondContact NH2-O 2.78Å; D246-K248 PolarHBondContact O-N 2.67Å; K248-E250 VanDerWaalsContact CE-OE1 3.22Å; K248-E250 WeakPolarHBondContact CE-OE1 3.49Å; K248-E250 IonicContact NZ-OE1 2.69Å; K248-E250 PolarHBondContact NZ-OE1 3.46Å; K248-L268 HydrophobicContact CB-CD2 4.45Å; K248-L268 HydrophobicContact CD-CD2 4.36Å; K248-L268 HydrophobicContact CG-CD2 3.7Å
249	L	86.6	Confident	75.9	Confident	12 Å²	12	65 Å²	65	6%	0.063	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	135.9	170.1	-75	164.8	0	0	0	110	I247 D266 L267 L297 I299	I247-L249 HydrophobicContact CG2-CD1 4.44Å; L249-D266 CarbonylContact O-C 3.59Å; L249-D266 WeakPolarHBondContact O-CA 3.36Å; L249-L267 HydrophobicContact CB-CB 4.2Å; L249-L267 HydrophobicContact CD1-CD2 4.46Å; L249-L267 PolarHBondContact N-O 3.03Å; L249-L267 PolarHBondContact O-N 3.13Å; L249-L297 HydrophobicContact CD1-CB 3.75Å; L249-L297 HydrophobicContact CD1-CD1 4.41Å; L249-I299 HydrophobicContact CD1-CD1 3.9Å
250	E	86.9	Confident	77.6	Confident	75 Å²	75	67.1 Å²	67.1	35%	0.35	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	141.2	-177.7	-68.2	163	157.2	0	0	109.8	R237 K248 F252 D266	R237-E250 IonicContact CZ-OE2 3.69Å; R237-E250 VanDerWaalsContact CZ-OE2 3.22Å; R237-E250 IonicContact NH1-OE2 3.53Å; R237-E250 PolarHBondContact NH1-OE2 3.42Å; R237-E250 VanDerWaalsContact NH2-CD 3.29Å; R237-E250 IonicContact NH2-OE1 2.7Å; R237-E250 IonicContact NH2-OE2 3.42Å; R237-E250 PolarHBondContact NH2-OE2 2.89Å; K248-E250 VanDerWaalsContact CE-OE1 3.22Å; K248-E250 WeakPolarHBondContact CE-OE1 3.49Å; K248-E250 IonicContact NZ-OE1 2.69Å; K248-E250 PolarHBondContact NZ-OE1 3.46Å; E250-F252 VanDerWaalsContact C-N 3.33Å; E250-F252 PolarHBondContact O-N 3.14Å; E250-D266 WeakPolarHBondContact CA-OD1 3.45Å
251	K	87.3	Confident	79.2	Confident	116 Å²	116	60.8 Å²	60.8	50%	0.504	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	49.5	45.6	177.7	-56.3	-178	179.4	-177.8	0	114.5	A265 D266	K251-A265 CarbonylContact C-O 3.57Å; K251-A265 VanDerWaalsContact CA-O 3.29Å; K251-A265 WeakPolarHBondContact CA-O 3.34Å; K251-A265 PolarHBondContact N-O 2.86Å; K251-D266 PolarHBondContact N-OD1 2.66Å
252	F	89.7	Confident	80.8	Confident	1 Å²	1	59.8 Å²	59.8	0%	0.004	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	150.8	167.4	78.2	-89.1	0	0	0	110.4	Q231 E250 I254 F262 N264 A265 L267 L288 L297 L469	Q231-F252 HydrophobicContact CG-CB 4.31Å; E250-F252 VanDerWaalsContact C-N 3.33Å; E250-F252 PolarHBondContact O-N 3.14Å; F252-I254 HydrophobicContact CD2-CD1 3.92Å; F252-I254 HydrophobicContact CD2-CG1 3.88Å; F252-I254 HydrophobicContact CE2-CD1 3.69Å; F252-I254 HydrophobicContact CE2-CG1 4.05Å; F252-F262 HydrophobicContact CD2-CB 4.47Å; F252-F262 HydrophobicContact CE2-CB 3.9Å; F252-F262 AromaticContact CE2-CD1 3.89Å; F252-F262 HydrophobicContact CE2-CD1 3.89Å; F252-F262 AromaticContact CE2-CG 3.87Å; F252-F262 HydrophobicContact CE2-CG 3.87Å; F252-F262 AromaticContact CZ-CD1 3.9Å; F252-F262 HydrophobicContact CZ-CD1 3.9Å; F252-F262 HydrophobicContact CZ-CE1 4.4Å; F252-F262 HydrophobicContact CZ-CG 4.36Å; F252-N264 PolarHBondContact O-N 3.16Å; F252-A265 HydrophobicContact CD1-CB 4.21Å; F252-A265 WeakPolarHBondContact CD1-O 3.43Å; F252-A265 HydrophobicContact CE1-CB 3.69Å; F252-A265 WeakPolarHBondContact CE1-O 3.46Å; F252-A265 HydrophobicContact CE2-CB 4.22Å; F252-A265 HydrophobicContact CZ-CB 3.7Å; F252-A265 PolarHBondContact N-O 2.77Å; F252-A265 PolarHBondContact O-N 2.96Å; F252-L267 HydrophobicContact CD1-CB 4.36Å; F252-L267 HydrophobicContact CE1-CB 3.8Å; F252-L288 HydrophobicContact CE2-CD1 3.89Å; F252-L288 HydrophobicContact CZ-CD1 3.83Å; F252-L297 HydrophobicContact CB-CD2 4.39Å; F252-L297 HydrophobicContact CD2-CD1 4.47Å; F252-L297 HydrophobicContact CD2-CD2 4.04Å; F252-L297 HydrophobicContact CG-CD2 4.37Å; F252-L469 HydrophobicContact CE1-CD1 4.28Å; F252-L469 HydrophobicContact CZ-CD1 4.07Å
253	S	88.4	Confident	82.5	Confident	17 Å²	17	56 Å²	56	12%	0.119	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	142.3	172.9	-53.4	0	0	0	0	110.6	S230 F262 N264	S230-S253 PolarHBondContact N-O 3.14Å; S230-S253 PolarHBondContact O-N 3.42Å; S253-F262 CarbonylContact C-O 3.6Å; S253-F262 WeakPolarHBondContact CA-O 3.44Å; S253-F262 VanDerWaalsContact CB-O 3.29Å; S253-F262 WeakPolarHBondContact CB-O 3.49Å; S253-N264 PolarHBondContact OG-N 3.31Å
254	I	89.4	Confident	84	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	127.4	-176.2	-54.9	174.8	0	0	0	108.8	F252 L261 F262 T287 L288 H291 L297	F252-I254 HydrophobicContact CD2-CD1 3.92Å; F252-I254 HydrophobicContact CD2-CG1 3.88Å; F252-I254 HydrophobicContact CE2-CD1 3.69Å; F252-I254 HydrophobicContact CE2-CG1 4.05Å; I254-L261 PolarHBondContact O-N 3.01Å; I254-F262 HydrophobicContact CB-CB 4.2Å; I254-F262 HydrophobicContact CB-CD2 4.07Å; I254-F262 HydrophobicContact CD1-CD2 4.13Å; I254-F262 HydrophobicContact CG1-CB 4.42Å; I254-F262 HydrophobicContact CG1-CD2 4.44Å; I254-F262 PolarHBondContact N-O 3.33Å; I254-F262 PolarHBondContact O-N 2.68Å; I254-T287 HydrophobicContact CG2-CG2 4.48Å; I254-L288 HydrophobicContact CD1-CD1 4.23Å; I254-H291 HydrophobicContact CD1-CB 4.31Å; I254-L297 HydrophobicContact CD1-CD2 4.2Å; I254-L297 HydrophobicContact CG1-CD2 4.5Å
255	S	87.3	Confident	85.2	Confident	32 Å²	32	51.1 Å²	51.1	22%	0.224	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	135	175.4	-67.1	0	0	0	0	110.6	S228 K259	S228-S255 PolarHBondContact N-O 2.99Å; S228-S255 PolarHBondContact O-N 3.37Å; S228-S255 PolarHBondContact OG-O 3.47Å; S255-K259 WeakPolarHBondContact CA-O 3.39Å
256	A	79.9	Confident	85.9	Confident	8 Å²	8	50.8 Å²	50.8	7%	0.066	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	130.7	-173.8	0	0	0	0	0	110.3	F227 G258 K259 L261	F227-A256 HydrophobicContact CD1-CB 3.53Å; F227-A256 HydrophobicContact CE1-CB 3.42Å; F227-A256 VanDerWaalsContact CE1-CB 3.42Å; A256-G258 PolarHBondContact O-N 2.79Å; A256-G258 VanDerWaalsContact O-N 3.15Å; A256-K259 PolarHBondContact N-O 3.03Å; A256-K259 WeakPolarHBondContact O-CB 3.41Å; A256-K259 PolarHBondContact O-N 2.86Å; A256-L261 HydrophobicContact CB-CD1 3.63Å; A256-L261 HydrophobicContact CB-CG 4.21Å
257	H	71.2	Confident	86.2	Confident	134 Å²	134	48 Å²	48	62%	0.62	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.6	44.3	179.2	-48.5	-63.4	0	0	0	113.3	D226 K259	D226-H257 PolarHBondContact O-N 3.01Å; D226-H257 IonicContact OD2-CE1 2.71Å; D226-H257 PolarHBondContact OD2-CE1 3.5Å; D226-H257 IonicContact OD2-CG 3.13Å; D226-H257 IonicContact OD2-ND1 3.84Å; D226-H257 PolarHBondContact OD2-ND1 3.48Å; H257-K259 VanDerWaalsContact C-N 3.26Å; H257-K259 PolarHBondContact O-N 3.16Å
258	G	71.4	Confident	86.4	Confident	89 Å²	89	50.7 Å²	50.7	92%	0.918	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.3	2.7	-178.4	0	0	0	0	0	116.2	A256	A256-G258 PolarHBondContact O-N 2.79Å; A256-G258 VanDerWaalsContact O-N 3.15Å
259	K	79.3	Confident	86.5	Confident	110 Å²	110	45.9 Å²	45.9	48%	0.478	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	122.6	178.9	-172.7	-175.2	-177.2	-174.5	0	111	S255 A256 H257 L261 G282	S255-K259 WeakPolarHBondContact CA-O 3.39Å; A256-K259 PolarHBondContact N-O 3.03Å; A256-K259 WeakPolarHBondContact O-CB 3.41Å; A256-K259 PolarHBondContact O-N 2.86Å; H257-K259 VanDerWaalsContact C-N 3.26Å; H257-K259 PolarHBondContact O-N 3.16Å; K259-L261 HydrophobicContact CD-CD2 4.02Å; K259-L261 HydrophobicContact CG-CD2 4.24Å; K259-L261 PolarHBondContact O-N 2.75Å; K259-G282 PolarHBondContact NZ-O 3.32Å
260	E	85.2	Confident	86.8	Confident	115 Å²	115	47.6 Å²	47.6	54%	0.537	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	113.8	169.7	-66.8	175.8	169.2	0	0	110.1	V263 Q467	E260-V263 HydrophobicContact CB-CG2 3.93Å; E260-V263 HydrophobicContact CG-CG2 4.36Å; E260-Q467 VanDerWaalsContact CB-NE2 3.29Å; E260-Q467 PolarHBondContact O-NE2 3.23Å
261	L	87.4	Confident	87	Confident	15 Å²	15	46 Å²	46	8%	0.079	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	-42.8	178.3	-61	-180	0	0	0	111.3	I254 A256 K259 T287 Q467	I254-L261 PolarHBondContact O-N 3.01Å; A256-L261 HydrophobicContact CB-CD1 3.63Å; A256-L261 HydrophobicContact CB-CG 4.21Å; K259-L261 HydrophobicContact CD-CD2 4.02Å; K259-L261 HydrophobicContact CG-CD2 4.24Å; K259-L261 PolarHBondContact O-N 2.75Å; L261-T287 HydrophobicContact CD1-CG2 3.8Å; L261-Q467 WeakPolarHBondContact O-CA 3.36Å; L261-Q467 WeakPolarHBondContact O-CB 3.32Å
262	F	91.1	Very high	87	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	130.6	-179.6	-65.8	-95.1	0	0	0	109.7	F252 S253 I254 A265 L288 L464 Q467 L469	F252-F262 HydrophobicContact CD2-CB 4.47Å; F252-F262 HydrophobicContact CE2-CB 3.9Å; F252-F262 AromaticContact CE2-CD1 3.89Å; F252-F262 HydrophobicContact CE2-CD1 3.89Å; F252-F262 AromaticContact CE2-CG 3.87Å; F252-F262 HydrophobicContact CE2-CG 3.87Å; F252-F262 AromaticContact CZ-CD1 3.9Å; F252-F262 HydrophobicContact CZ-CD1 3.9Å; F252-F262 HydrophobicContact CZ-CE1 4.4Å; F252-F262 HydrophobicContact CZ-CG 4.36Å; S253-F262 CarbonylContact C-O 3.6Å; S253-F262 WeakPolarHBondContact CA-O 3.44Å; S253-F262 VanDerWaalsContact CB-O 3.29Å; S253-F262 WeakPolarHBondContact CB-O 3.49Å; I254-F262 HydrophobicContact CB-CB 4.2Å; I254-F262 HydrophobicContact CB-CD2 4.07Å; I254-F262 HydrophobicContact CD1-CD2 4.13Å; I254-F262 HydrophobicContact CG1-CB 4.42Å; I254-F262 HydrophobicContact CG1-CD2 4.44Å; I254-F262 PolarHBondContact N-O 3.33Å; I254-F262 PolarHBondContact O-N 2.68Å; F262-A265 HydrophobicContact CB-CB 4.3Å; F262-A265 HydrophobicContact CD1-CB 4.04Å; F262-L288 HydrophobicContact CE1-CD2 3.96Å; F262-L288 HydrophobicContact CE2-CB 3.97Å; F262-L288 HydrophobicContact CZ-CB 3.72Å; F262-L288 HydrophobicContact CZ-CD1 4.41Å; F262-L288 HydrophobicContact CZ-CD2 3.84Å; F262-L288 HydrophobicContact CZ-CG 4.2Å; F262-L464 HydrophobicContact CD1-CD1 4.19Å; F262-L464 HydrophobicContact CE1-CD1 3.47Å; F262-L464 VanDerWaalsContact CE1-CD1 3.47Å; F262-L464 HydrophobicContact CE1-CD2 4.45Å; F262-L464 HydrophobicContact CZ-CD1 3.81Å; F262-L464 HydrophobicContact CZ-CD2 3.96Å; F262-Q467 WeakPolarHBondContact CA-O 3.23Å; F262-L469 HydrophobicContact CE1-CD1 4.45Å; F262-L469 HydrophobicContact CE1-CD2 3.88Å; F262-L469 HydrophobicContact CE1-CG 4.08Å
263	V	90	Very high	87.2	Confident	43 Å²	43	46.3 Å²	46.3	26%	0.261	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	113.7	-179.8	-178.1	0	0	0	0	109.3	E260 A265 Q467 K468	E260-V263 HydrophobicContact CB-CG2 3.93Å; E260-V263 HydrophobicContact CG-CG2 4.36Å; V263-A265 VanDerWaalsContact C-N 3.33Å; V263-A265 PolarHBondContact O-N 2.91Å; V263-Q467 HydrophobicContact CB-CB 4.42Å; V263-Q467 HydrophobicContact CG2-CB 4.3Å; V263-Q467 PolarHBondContact N-O 3.31Å; V263-K468 WeakPolarHBondContact O-CE 3.35Å; V263-K468 WeakPolarHBondContact O-CG 3.36Å
264	N	88.7	Confident	87.5	Confident	63 Å²	63	47.9 Å²	47.9	34%	0.337	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	49.1	52.7	-175.3	-68.1	-30.7	0	0	0	111.9	F252 S253 K468	F252-N264 PolarHBondContact O-N 3.16Å; S253-N264 PolarHBondContact OG-N 3.31Å; N264-K468 WeakPolarHBondContact O-CE 3.47Å
265	A	90.4	Very high	87.8	Confident	1 Å²	1	48.2 Å²	48.2	1%	0.008	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	154.7	177.7	0	0	0	0	0	111.5	K251 F252 F262 V263	K251-A265 CarbonylContact C-O 3.57Å; K251-A265 VanDerWaalsContact CA-O 3.29Å; K251-A265 WeakPolarHBondContact CA-O 3.34Å; K251-A265 PolarHBondContact N-O 2.86Å; F252-A265 HydrophobicContact CD1-CB 4.21Å; F252-A265 WeakPolarHBondContact CD1-O 3.43Å; F252-A265 HydrophobicContact CE1-CB 3.69Å; F252-A265 WeakPolarHBondContact CE1-O 3.46Å; F252-A265 HydrophobicContact CE2-CB 4.22Å; F252-A265 HydrophobicContact CZ-CB 3.7Å; F252-A265 PolarHBondContact N-O 2.77Å; F252-A265 PolarHBondContact O-N 2.96Å; F262-A265 HydrophobicContact CB-CB 4.3Å; F262-A265 HydrophobicContact CD1-CB 4.04Å; V263-A265 VanDerWaalsContact C-N 3.33Å; V263-A265 PolarHBondContact O-N 2.91Å
266	D	91.3	Very high	88.1	Confident	66 Å²	66	46.7 Å²	46.7	35%	0.353	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	129.4	178.7	-56.7	-45.6	0	0	0	109.7	L249 E250 K251 Y471	L249-D266 CarbonylContact O-C 3.59Å; L249-D266 WeakPolarHBondContact O-CA 3.36Å; E250-D266 WeakPolarHBondContact CA-OD1 3.45Å; K251-D266 PolarHBondContact N-OD1 2.66Å; D266-Y471 WeakPolarHBondContact O-CE2 3.43Å; D266-Y471 PolarHBondContact O-OH 2.85Å
267	L	91.9	Very high	88.8	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.005	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	115.2	176.4	-173.5	65.7	0	0	0	109.8	I247 L249 F252 I269 I292 L297 L469 Y471	I247-L267 HydrophobicContact CG2-CD2 4.32Å; L249-L267 HydrophobicContact CB-CB 4.2Å; L249-L267 HydrophobicContact CD1-CD2 4.46Å; L249-L267 PolarHBondContact N-O 3.03Å; L249-L267 PolarHBondContact O-N 3.13Å; F252-L267 HydrophobicContact CD1-CB 4.36Å; F252-L267 HydrophobicContact CE1-CB 3.8Å; L267-I269 HydrophobicContact CD1-CD1 4.09Å; L267-I269 HydrophobicContact CD1-CG1 4.16Å; L267-I269 HydrophobicContact CD2-CD1 4.33Å; L267-I269 HydrophobicContact CG-CD1 4.22Å; L267-I269 HydrophobicContact CG-CG1 4.27Å; L267-I292 HydrophobicContact CD2-CD1 3.69Å; L267-I292 HydrophobicContact CD2-CG1 3.95Å; L267-L297 HydrophobicContact CD2-CD1 4.41Å; L267-L469 HydrophobicContact CD1-CD1 3.93Å; L267-Y471 VanDerWaalsContact CA-OH 3.28Å; L267-Y471 WeakPolarHBondContact CA-OH 3.37Å
268	L	91.6	Very high	89.8	Confident	61 Å²	61	40.1 Å²	40.1	32%	0.319	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	100.3	-175.1	-58.2	179.3	0	0	0	110	I247 K248 Y275 Y471	I247-L268 WeakPolarHBondContact O-CA 3.43Å; K248-L268 HydrophobicContact CB-CD2 4.45Å; K248-L268 HydrophobicContact CD-CD2 4.36Å; K248-L268 HydrophobicContact CG-CD2 3.7Å; L268-Y275 PolarHBondContact O-OH 2.69Å; L268-Y471 HydrophobicContact CB-CE1 3.98Å; L268-Y471 HydrophobicContact CB-CE2 4.25Å; L268-Y471 HydrophobicContact CD1-CD2 4.28Å; L268-Y471 HydrophobicContact CD1-CE2 4.18Å; L268-Y471 HydrophobicContact CG-CE2 4.21Å; L268-Y471 PolarHBondContact N-OH 3.39Å; L268-Y471 WeakPolarHBondContact O-CE1 3.37Å
269	I	91.9	Very high	90.5	Very high	4 Å²	4	36.4 Å²	36.4	2%	0.021	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	111.3	178.1	-53.1	175.5	0	0	0	108.5	D246 I247 L267 Y275 L415 T443 L445	D246-I269 CarbonylContact C-O 3.55Å; D246-I269 WeakPolarHBondContact CA-O 3.32Å; I247-I269 HydrophobicContact CB-CB 4.13Å; I247-I269 HydrophobicContact CD1-CB 4.38Å; I247-I269 HydrophobicContact CD1-CD1 4.14Å; I247-I269 PolarHBondContact N-O 3.08Å; I247-I269 PolarHBondContact O-N 2.89Å; L267-I269 HydrophobicContact CD1-CD1 4.09Å; L267-I269 HydrophobicContact CD1-CG1 4.16Å; L267-I269 HydrophobicContact CD2-CD1 4.33Å; L267-I269 HydrophobicContact CG-CD1 4.22Å; L267-I269 HydrophobicContact CG-CG1 4.27Å; I269-Y275 HydrophobicContact CB-CE2 4.2Å; I269-Y275 HydrophobicContact CG2-CD2 3.89Å; I269-Y275 HydrophobicContact CG2-CE2 3.6Å; I269-L415 HydrophobicContact CD1-CD2 4.26Å; I269-L415 HydrophobicContact CG2-CD1 4.42Å; I269-T443 HydrophobicContact CG2-CG2 3.59Å; I269-L445 HydrophobicContact CD1-CD2 4.05Å
270	V	92.1	Very high	90.6	Very high	48 Å²	48	33.4 Å²	33.4	29%	0.291	19%	0.188	S	C	.	.			trans	-88.5	136.3	175.8	176.8	0	0	0	0	109.4	R273 Y275	V270-R273 HydrophobicContact CB-CG 4.21Å; V270-R273 HydrophobicContact CG1-CG 4.35Å; V270-R273 PolarHBondContact O-N 3.04Å; V270-Y275 PolarHBondContact N-OH 2.97Å
271	A	90.5	Very high	90.4	Very high	41 Å²	41	30.3 Å²	30.3	34%	0.339	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	140.1	-178.2	0	0	0	0	0	112.9	D246 R273	D246-A271 PolarHBondContact OD1-N 2.77Å; A271-R273 VanDerWaalsContact C-N 3.26Å; A271-R273 PolarHBondContact O-N 3.04Å
272	G	88.1	Confident	89.9	Confident	41 Å²	41	32 Å²	32	42%	0.423	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.8	4.7	176.3	0	0	0	0	0	115.7	T443	G272-T443 PolarHBondContact N-OG1 3.24Å
273	R	93.2	Very high	89.5	Confident	83 Å²	83	36.2 Å²	36.2	31%	0.313	21%	0.214	S	C	.	.			trans	-90.6	162.3	171	-62.5	-161.4	-171.2	-166.4	9.3	112.4	V270 A271 Y275 T443 L444 D460	V270-R273 HydrophobicContact CB-CG 4.21Å; V270-R273 HydrophobicContact CG1-CG 4.35Å; V270-R273 PolarHBondContact O-N 3.04Å; A271-R273 VanDerWaalsContact C-N 3.26Å; A271-R273 PolarHBondContact O-N 3.04Å; R273-Y275 HydrophobicContact CB-CD2 4.13Å; R273-Y275 HydrophobicContact CB-CE2 3.57Å; R273-T443 WeakPolarHBondContact O-CA 3.48Å; R273-T443 WeakPolarHBondContact O-CG2 3.34Å; R273-L444 PolarHBondContact O-N 3.36Å; R273-D460 WeakPolarHBondContact CD-OD2 3.47Å; R273-D460 IonicContact CZ-OD1 3.48Å; R273-D460 IonicContact NH1-OD1 2.79Å; R273-D460 PolarHBondContact NH1-OD1 2.85Å; R273-D460 IonicContact NH1-OD2 3.76Å
274	R	95	Very high	89.2	Confident	51 Å²	51	34.6 Å²	34.6	19%	0.192	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	103.1	-178.7	-55.2	-172.2	-66.3	-122	9.4	109.5	Q438 W440 L444 V457 C458 T459 D460	R274-Q438 PolarHBondContact NH1-O 2.99Å; R274-W440 PolarHBondContact NH1-O 2.83Å; R274-L444 HydrophobicContact CB-CB 4.17Å; R274-L444 HydrophobicContact CB-CD1 4.45Å; R274-L444 HydrophobicContact CG-CB 4.16Å; R274-L444 HydrophobicContact CG-CD1 3.91Å; R274-L444 HydrophobicContact CG-CG 4.49Å; R274-V457 PolarHBondContact NE-O 2.98Å; R274-C458 CarbonylContact O-C 3.43Å; R274-C458 WeakPolarHBondContact O-CA 3.48Å; R274-T459 HydrophobicContact CB-CG2 4.32Å; R274-T459 PolarHBondContact N-OG1 3.42Å; R274-T459 VanDerWaalsContact N-OG1 3.08Å; R274-T459 PolarHBondContact O-N 3.32Å; R274-T459 PolarHBondContact O-OG1 2.92Å; R274-D460 PolarHBondContact O-N 3.15Å
275	Y	95.4	Very high	89.3	Confident	7 Å²	7	32.1 Å²	32.1	3%	0.027	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	123.2	-172.5	-70	-85.3	0	0	0	112	L268 I269 V270 R273 L444 L445 I446 D460 I462 Y471	L268-Y275 PolarHBondContact O-OH 2.69Å; I269-Y275 HydrophobicContact CB-CE2 4.2Å; I269-Y275 HydrophobicContact CG2-CD2 3.89Å; I269-Y275 HydrophobicContact CG2-CE2 3.6Å; V270-Y275 PolarHBondContact N-OH 2.97Å; R273-Y275 HydrophobicContact CB-CD2 4.13Å; R273-Y275 HydrophobicContact CB-CE2 3.57Å; Y275-L444 PolarHBondContact N-O 2.99Å; Y275-L445 WeakPolarHBondContact O-CA 3.48Å; Y275-I446 PolarHBondContact O-N 2.62Å; Y275-D460 WeakPolarHBondContact CA-O 3.42Å; Y275-D460 HydrophobicContact CD1-CB 3.69Å; Y275-D460 HydrophobicContact CE1-CB 3.75Å; Y275-I462 HydrophobicContact CD1-CD1 3.74Å; Y275-I462 HydrophobicContact CD1-CG1 3.72Å; Y275-I462 HydrophobicContact CG-CD1 4.05Å; Y275-I462 HydrophobicContact CG-CG1 4.38Å; Y275-Y471 HydrophobicContact CE1-CD1 4.47Å
276	G	95.2	Very high	89.2	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	113.3	168.9	0	0	0	0	0	111.2	I446 D460 I461 I462	G276-I446 CarbonylContact C-O 3.54Å; G276-I446 WeakPolarHBondContact CA-O 3.44Å; G276-D460 PolarHBondContact N-O 2.96Å; G276-I461 CarbonylContact O-C 3.55Å; G276-I461 WeakPolarHBondContact O-CA 3.28Å; G276-I462 PolarHBondContact O-N 2.87Å
277	L	93.9	Very high	89.1	Confident	1 Å²	1	32.7 Å²	32.7	1%	0.005	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	106.1	176.6	175.6	56.4	0	0	0	110.3	L288 L445 I446 V447 I462 L464 L469	L277-L288 HydrophobicContact CD2-CD2 4.06Å; L277-L445 HydrophobicContact CB-CD1 4.05Å; L277-I446 PolarHBondContact N-O 3.28Å; L277-V447 HydrophobicContact CB-CG2 3.87Å; L277-V447 HydrophobicContact CD2-CG2 3.73Å; L277-V447 HydrophobicContact CG-CG2 3.9Å; L277-I462 WeakPolarHBondContact CA-O 3.36Å; L277-I462 HydrophobicContact CD1-CB 4.09Å; L277-I462 HydrophobicContact CD1-CG2 4.12Å; L277-L464 HydrophobicContact CD1-CB 4.29Å; L277-L469 HydrophobicContact CD1-CD2 4.06Å
278	V	91.4	Very high	89.1	Confident	3 Å²	3	32.8 Å²	32.8	2%	0.018	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	143.3	-174	-61.3	0	0	0	0	111.7	L454 I461 I462 H463 L464 Y476 F479 I719	V278-L454 HydrophobicContact CG1-CD1 3.53Å; V278-L454 HydrophobicContact CG1-CD2 4.41Å; V278-I461 HydrophobicContact CG2-CG2 3.46Å; V278-I461 VanDerWaalsContact CG2-CG2 3.46Å; V278-I462 PolarHBondContact N-O 2.86Å; V278-H463 HydrophobicContact CG2-CB 4.46Å; V278-H463 CarbonylContact O-C 3.23Å; V278-H463 WeakPolarHBondContact O-CA 3.17Å; V278-H463 PolarHBondContact O-CD2 3.11Å; V278-L464 PolarHBondContact O-N 3.14Å; V278-Y476 HydrophobicContact CB-CE2 4.45Å; V278-Y476 HydrophobicContact CG1-CD2 4.25Å; V278-Y476 HydrophobicContact CG1-CE2 4.06Å; V278-Y476 HydrophobicContact CG2-CE2 4.32Å; V278-F479 HydrophobicContact CG2-CD1 4.47Å; V278-F479 HydrophobicContact CG2-CE1 3.94Å; V278-F479 HydrophobicContact CG2-CZ 4.2Å; V278-I719 HydrophobicContact CB-CD1 4.47Å; V278-I719 HydrophobicContact CG1-CD1 4.33Å
279	G	86.8	Confident	89.1	Confident	10 Å²	10	29.9 Å²	29.9	10%	0.103	18%	0.184	C	C	.	.			trans	169.9	170.5	175.1	0	0	0	0	0	111.8	H449	G279-H449 PolarHBondContact O-CE1 2.8Å
280	P	81.7	Confident	89	Confident	48 Å²	48	33.7 Å²	33.7	31%	0.312	20%	0.201	S	C	.	.			trans	-64.2	159.6	-178.1	-22.2	33.1	0	0	0	113.7	K283	P280-K283 HydrophobicContact CB-CG 3.98Å; P280-K283 HydrophobicContact CG-CG 4.46Å; P280-K283 WeakPolarHBondContact O-CB 3.27Å; P280-K283 WeakPolarHBondContact O-CG 3.28Å
281	N	80.7	Confident	88.9	Confident	49 Å²	49	32 Å²	32	26%	0.262	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73	149.8	-179.7	-70.7	-19.2	0	0	0	112.5	K283 K285 H449 N716	N281-K283 VanDerWaalsContact C-N 3.33Å; N281-K283 PolarHBondContact O-N 2.67Å; N281-K285 PolarHBondContact OD1-NZ 2.73Å; N281-H449 PolarHBondContact OD1-NE2 2.88Å; N281-N716 PolarHBondContact ND2-O 2.72Å
282	G	76.3	Confident	88.9	Confident	52 Å²	52	30 Å²	30	54%	0.536	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.6	19.3	-174.1	0	0	0	0	0	115.7	K259	K259-G282 PolarHBondContact NZ-O 3.32Å
283	K	83.2	Confident	88.9	Confident	87 Å²	87	29.5 Å²	29.5	38%	0.378	17%	0.165	S	C	.	.	S	Bend	trans	-97.6	-10.9	176.8	-58	-65.5	-179.9	-175.6	0	115.2	P280 N281 L464	P280-K283 HydrophobicContact CB-CG 3.98Å; P280-K283 HydrophobicContact CG-CG 4.46Å; P280-K283 WeakPolarHBondContact O-CB 3.27Å; P280-K283 WeakPolarHBondContact O-CG 3.28Å; N281-K283 VanDerWaalsContact C-N 3.33Å; N281-K283 PolarHBondContact O-N 2.67Å; K283-L464 HydrophobicContact CB-CD2 3.8Å; K283-L464 HydrophobicContact CB-CG 4.2Å
284	G	84.7	Confident	88.7	Confident	9 Å²	9	30.7 Å²	30.7	9%	0.093	18%	0.177	C	C	.	.	S	Bend	trans	107.4	21.8	174.4	0	0	0	0	0	117	T287 L288	G284-T287 WeakPolarHBondContact O-CB 3.35Å; G284-T287 PolarHBondContact O-N 3.23Å; G284-L288 PolarHBondContact O-N 3.3Å
285	K	89.2	Confident	88.3	Confident	11 Å²	11	33.6 Å²	33.6	5%	0.048	19%	0.188	C	C	.	.	H	α-helix	trans	-54.6	-61.7	178	-51.7	175	-51.2	-177.4	0	111.6	N281 T287 L288 L289 E420 V447 H449 L464	N281-K285 PolarHBondContact OD1-NZ 2.73Å; K285-T287 VanDerWaalsContact C-N 3.29Å; K285-T287 PolarHBondContact O-N 2.92Å; K285-L288 WeakPolarHBondContact O-CB 3.46Å; K285-L288 PolarHBondContact O-N 3.13Å; K285-L288 VanDerWaalsContact O-N 3.15Å; K285-L289 PolarHBondContact O-N 3.37Å; K285-L289 VanDerWaalsContact O-N 3.15Å; K285-E420 WeakPolarHBondContact CE-OE1 3.49Å; K285-E420 IonicContact NZ-OE1 3.07Å; K285-E420 PolarHBondContact NZ-OE1 2.87Å; K285-V447 HydrophobicContact CB-CG1 4.04Å; K285-V447 HydrophobicContact CB-CG2 4Å; K285-V447 HydrophobicContact CD-CG1 3.76Å; K285-V447 HydrophobicContact CG-CG1 4.45Å; K285-H449 PolarHBondContact NZ-NE2 3.07Å; K285-L464 HydrophobicContact CG-CD2 4.01Å
286	T	88.9	Confident	87.8	Confident	53 Å²	53	34.9 Å²	34.9	33%	0.325	20%	0.2	S	C	.	.	H	α-helix	trans	-53.1	-42.6	172.6	-47.1	0	0	0	0	112.5	L288 L289 K290 D419	T286-L288 VanDerWaalsContact C-N 3.34Å; T286-L288 PolarHBondContact O-N 3.01Å; T286-L289 PolarHBondContact O-N 3.16Å; T286-K290 HydrophobicContact CG2-CD 4.3Å; T286-K290 WeakPolarHBondContact O-CG 3.33Å; T286-K290 PolarHBondContact O-N 2.95Å; T286-D419 WeakPolarHBondContact CA-OD2 3.18Å; T286-D419 WeakPolarHBondContact CB-OD2 3.44Å; T286-D419 WeakPolarHBondContact CG2-OD2 3.32Å; T286-D419 PolarHBondContact OG1-OD2 3.11Å
287	T	89.7	Confident	87.3	Confident	27 Å²	27	34.9 Å²	34.9	17%	0.166	20%	0.2	C	C	.	.	H	α-helix	trans	-62	-40.4	179.7	-42.3	0	0	0	0	111.9	F227 I254 L261 G284 K285 K290 H291	F227-T287 HydrophobicContact CD1-CG2 4.13Å; F227-T287 HydrophobicContact CE1-CG2 3.67Å; I254-T287 HydrophobicContact CG2-CG2 4.48Å; L261-T287 HydrophobicContact CD1-CG2 3.8Å; G284-T287 WeakPolarHBondContact O-CB 3.35Å; G284-T287 PolarHBondContact O-N 3.23Å; K285-T287 VanDerWaalsContact C-N 3.29Å; K285-T287 PolarHBondContact O-N 2.92Å; T287-K290 PolarHBondContact O-N 3.26Å; T287-H291 PolarHBondContact O-CD2 2.84Å; T287-H291 PolarHBondContact O-N 3.15Å
288	L	90.9	Very high	86.8	Confident	2 Å²	2	37.6 Å²	37.6	1%	0.01	22%	0.219	C	C	.	.	H	α-helix	trans	-63.7	-46.2	173.5	178.4	63.1	0	0	0	111.3	F252 I254 F262 L277 G284 K285 T286 K290 H291 I292 L297 L469	F252-L288 HydrophobicContact CE2-CD1 3.89Å; F252-L288 HydrophobicContact CZ-CD1 3.83Å; I254-L288 HydrophobicContact CD1-CD1 4.23Å; F262-L288 HydrophobicContact CE1-CD2 3.96Å; F262-L288 HydrophobicContact CE2-CB 3.97Å; F262-L288 HydrophobicContact CZ-CB 3.72Å; F262-L288 HydrophobicContact CZ-CD1 4.41Å; F262-L288 HydrophobicContact CZ-CD2 3.84Å; F262-L288 HydrophobicContact CZ-CG 4.2Å; L277-L288 HydrophobicContact CD2-CD2 4.06Å; G284-L288 PolarHBondContact O-N 3.3Å; K285-L288 WeakPolarHBondContact O-CB 3.46Å; K285-L288 PolarHBondContact O-N 3.13Å; K285-L288 VanDerWaalsContact O-N 3.15Å; T286-L288 VanDerWaalsContact C-N 3.34Å; T286-L288 PolarHBondContact O-N 3.01Å; L288-K290 VanDerWaalsContact C-N 3.33Å; L288-K290 PolarHBondContact O-N 2.84Å; L288-H291 PolarHBondContact O-N 3.11Å; L288-I292 HydrophobicContact CD1-CD1 4.12Å; L288-I292 HydrophobicContact CD1-CG1 4.39Å; L288-I292 HydrophobicContact CG-CD1 3.92Å; L288-I292 VanDerWaalsContact O-CG1 3.27Å; L288-I292 WeakPolarHBondContact O-CG1 3.45Å; L288-I292 PolarHBondContact O-N 2.76Å; L288-L297 HydrophobicContact CD1-CD1 3.93Å; L288-L469 HydrophobicContact CD2-CD1 3.99Å; L288-L469 HydrophobicContact CD2-CD2 4.29Å
289	L	91.8	Very high	86.5	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-58.9	-43.7	176.7	-62.5	-173.8	0	0	0	111.7	K285 T286 I292 A293 L307 M417 D419 L445 V447	K285-L289 PolarHBondContact O-N 3.37Å; K285-L289 VanDerWaalsContact O-N 3.15Å; T286-L289 PolarHBondContact O-N 3.16Å; L289-I292 PolarHBondContact O-N 3.41Å; L289-A293 WeakPolarHBondContact O-CB 3.44Å; L289-A293 PolarHBondContact O-N 3.32Å; L289-L307 HydrophobicContact CB-CD1 3.91Å; L289-L307 HydrophobicContact CB-CD2 3.88Å; L289-L307 HydrophobicContact CD1-CD1 3.88Å; L289-L307 HydrophobicContact CG-CD1 4.48Å; L289-M417 HydrophobicContact CD2-CB 4.38Å; L289-M417 HydrophobicContact CD2-SD 4.03Å; L289-M417 WeakPolarHBondContact O-CE 3.49Å; L289-D419 HydrophobicContact CD1-CB 3.73Å; L289-L445 HydrophobicContact CD2-CD2 3.55Å; L289-L445 HydrophobicContact CD2-CG 3.96Å; L289-V447 HydrophobicContact CD1-CG2 3.79Å; L289-V447 HydrophobicContact CG-CG2 4.31Å
290	K	90.4	Very high	86.4	Confident	85 Å²	85	37.5 Å²	37.5	37%	0.37	22%	0.216	S	C	.	.	H	α-helix	trans	-58.8	-48.1	175.3	-75.5	-177.2	171.2	-159.7	0	112.9	T286 T287 L288 I292 A293 N294 L307 E309	T286-K290 HydrophobicContact CG2-CD 4.3Å; T286-K290 WeakPolarHBondContact O-CG 3.33Å; T286-K290 PolarHBondContact O-N 2.95Å; T287-K290 PolarHBondContact O-N 3.26Å; L288-K290 VanDerWaalsContact C-N 3.33Å; L288-K290 PolarHBondContact O-N 2.84Å; K290-I292 VanDerWaalsContact C-N 3.28Å; K290-I292 PolarHBondContact O-N 3.36Å; K290-A293 PolarHBondContact O-N 2.72Å; K290-N294 WeakPolarHBondContact O-CB 3.27Å; K290-N294 PolarHBondContact O-N 3.47Å; K290-N294 PolarHBondContact O-OD1 3.5Å; K290-L307 HydrophobicContact CG-CD2 4.33Å; K290-E309 WeakPolarHBondContact CE-OE1 3.38Å; K290-E309 WeakPolarHBondContact CE-OE2 3.24Å; K290-E309 VanDerWaalsContact CG-OE2 3.26Å; K290-E309 WeakPolarHBondContact CG-OE2 3.19Å; K290-E309 IonicContact NZ-OE1 2.79Å; K290-E309 PolarHBondContact NZ-OE1 2.9Å; K290-E309 VanDerWaalsContact NZ-OE1 3.11Å; K290-E309 IonicContact NZ-OE2 2.76Å
291	H	89.7	Confident	86.4	Confident	12 Å²	12	38.7 Å²	38.7	6%	0.056	22%	0.224	C	C	.	.	H	α-helix	trans	-69.2	-23.7	178.1	-71.6	-66.2	0	0	0	113.7	F227 I254 T287 L288 A296 L297	F227-H291 AromaticContact CD1-NE2 3.71Å; F227-H291 AromaticContact CG-CE1 3.96Å; F227-H291 AromaticContact CG-NE2 3.93Å; I254-H291 HydrophobicContact CD1-CB 4.31Å; T287-H291 PolarHBondContact O-CD2 2.84Å; T287-H291 PolarHBondContact O-N 3.15Å; L288-H291 PolarHBondContact O-N 3.11Å; H291-A296 HydrophobicContact CB-CB 4.27Å; H291-A296 PolarHBondContact O-N 2.62Å; H291-A296 VanDerWaalsContact O-N 3.1Å; H291-L297 HydrophobicContact CB-CG 4.07Å; H291-L297 PolarHBondContact O-N 3.3Å
292	I	89.9	Confident	86.5	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-73.5	-47.8	169.3	-64.2	163.3	0	0	0	110.3	L267 L288 L289 K290 R295 L297 I299 V305 M417 L445	L267-I292 HydrophobicContact CD2-CD1 3.69Å; L267-I292 HydrophobicContact CD2-CG1 3.95Å; L288-I292 HydrophobicContact CD1-CD1 4.12Å; L288-I292 HydrophobicContact CD1-CG1 4.39Å; L288-I292 HydrophobicContact CG-CD1 3.92Å; L288-I292 VanDerWaalsContact O-CG1 3.27Å; L288-I292 WeakPolarHBondContact O-CG1 3.45Å; L288-I292 PolarHBondContact O-N 2.76Å; L289-I292 PolarHBondContact O-N 3.41Å; K290-I292 VanDerWaalsContact C-N 3.28Å; K290-I292 PolarHBondContact O-N 3.36Å; I292-R295 PolarHBondContact O-N 2.66Å; I292-R295 VanDerWaalsContact O-N 3.15Å; I292-L297 HydrophobicContact CG1-CD1 3.87Å; I292-I299 HydrophobicContact CG2-CD1 4.06Å; I292-I299 HydrophobicContact CG2-CG1 4.16Å; I292-V305 HydrophobicContact CG2-CG1 4.15Å; I292-M417 HydrophobicContact CB-CE 3.98Å; I292-M417 HydrophobicContact CB-SD 4.03Å; I292-M417 HydrophobicContact CD1-SD 4.33Å; I292-M417 HydrophobicContact CG2-CE 3.81Å; I292-M417 HydrophobicContact CG2-SD 3.56Å; I292-M417 VanDerWaalsContact CG2-SD 3.56Å; I292-L445 HydrophobicContact CD1-CD2 4.15Å
293	A	89.1	Confident	86.9	Confident	30 Å²	30	38.1 Å²	38.1	25%	0.248	21%	0.209	C	C	.	.	H	α-helix	trans	-63.5	-46.3	-177.6	0	0	0	0	0	112.5	L289 K290 R295 L307 M417	L289-A293 WeakPolarHBondContact O-CB 3.44Å; L289-A293 PolarHBondContact O-N 3.32Å; K290-A293 PolarHBondContact O-N 2.72Å; A293-R295 PolarHBondContact O-N 2.78Å; A293-R295 VanDerWaalsContact O-N 3.16Å; A293-L307 HydrophobicContact CB-CB 3.74Å; A293-L307 HydrophobicContact CB-CD2 3.81Å; A293-L307 HydrophobicContact CB-CG 4.46Å; A293-M417 HydrophobicContact CB-CE 3.86Å
294	N	88.2	Confident	87.1	Confident	108 Å²	108	37.8 Å²	37.8	58%	0.578	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-1.4	177.6	-65.5	10.6	0	0	0	113	K290 A296	K290-N294 WeakPolarHBondContact O-CB 3.27Å; K290-N294 PolarHBondContact O-N 3.47Å; K290-N294 PolarHBondContact O-OD1 3.5Å; N294-A296 PolarHBondContact O-N 3.08Å; N294-A296 VanDerWaalsContact O-N 3.13Å
295	R	86.4	Confident	87.3	Confident	112 Å²	112	38.4 Å²	38.4	42%	0.423	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.4	25.6	-173.5	-62	-179.5	165.9	-167.2	-8.2	114	I292 A293 L297 P301 I303	I292-R295 PolarHBondContact O-N 2.66Å; I292-R295 VanDerWaalsContact O-N 3.15Å; A293-R295 PolarHBondContact O-N 2.78Å; A293-R295 VanDerWaalsContact O-N 3.16Å; R295-L297 CarbonylContact C-O 3.56Å; R295-L297 VanDerWaalsContact C-O 3.23Å; R295-L297 PolarHBondContact O-N 2.78Å; R295-P301 PolarHBondContact NH2-O 2.82Å; R295-I303 PolarHBondContact NH2-O 2.87Å
296	A	85.9	Confident	87.4	Confident	33 Å²	33	39.6 Å²	39.6	27%	0.273	22%	0.22	S	C	.	.			trans	-69.3	-22.9	170.8	0	0	0	0	0	112.1	H291 N294	H291-A296 HydrophobicContact CB-CB 4.27Å; H291-A296 PolarHBondContact O-N 2.62Å; H291-A296 VanDerWaalsContact O-N 3.1Å; N294-A296 PolarHBondContact O-N 3.08Å; N294-A296 VanDerWaalsContact O-N 3.13Å
297	L	84.3	Confident	87.4	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.211	C	C	.	.	S	Bend	trans	-88.8	142.2	155.5	-56.5	-179.3	0	0	0	109.3	V229 L249 F252 I254 L267 L288 H291 I292 R295 I299	V229-L297 HydrophobicContact CG1-CD2 3.95Å; L249-L297 HydrophobicContact CD1-CB 3.75Å; L249-L297 HydrophobicContact CD1-CD1 4.41Å; F252-L297 HydrophobicContact CB-CD2 4.39Å; F252-L297 HydrophobicContact CD2-CD1 4.47Å; F252-L297 HydrophobicContact CD2-CD2 4.04Å; F252-L297 HydrophobicContact CG-CD2 4.37Å; I254-L297 HydrophobicContact CD1-CD2 4.2Å; I254-L297 HydrophobicContact CG1-CD2 4.5Å; L267-L297 HydrophobicContact CD2-CD1 4.41Å; L288-L297 HydrophobicContact CD1-CD1 3.93Å; H291-L297 HydrophobicContact CB-CG 4.07Å; H291-L297 PolarHBondContact O-N 3.3Å; I292-L297 HydrophobicContact CG1-CD1 3.87Å; R295-L297 CarbonylContact C-O 3.56Å; R295-L297 VanDerWaalsContact C-O 3.23Å; R295-L297 PolarHBondContact O-N 2.78Å; L297-I299 VanDerWaalsContact C-N 3.31Å; L297-I299 HydrophobicContact CB-CD1 4.38Å; L297-I299 WeakPolarHBondContact O-CG1 3.25Å; L297-I299 PolarHBondContact O-N 3.01Å
298	S	83	Confident	87.2	Confident	58 Å²	58	37.6 Å²	37.6	41%	0.406	21%	0.207	S	C	.	.			trans	-69.3	81.3	179.9	-163.8	0	0	0	0	113
299	I	85.9	Confident	86.3	Confident	10 Å²	10	41.1 Å²	41.1	5%	0.051	22%	0.223	C	C	.	.			trans	-84.2	139.6	175.3	-55.2	-56.4	0	0	0	109.8	I247 L249 I292 L297 V305	I247-I299 HydrophobicContact CD1-CD1 4.38Å; I247-I299 HydrophobicContact CD1-CG2 4.13Å; I247-I299 HydrophobicContact CG1-CG2 4.37Å; I247-I299 HydrophobicContact CG2-CD1 3.73Å; L249-I299 HydrophobicContact CD1-CD1 3.9Å; I292-I299 HydrophobicContact CG2-CD1 4.06Å; I292-I299 HydrophobicContact CG2-CG1 4.16Å; L297-I299 VanDerWaalsContact C-N 3.31Å; L297-I299 HydrophobicContact CB-CD1 4.38Å; L297-I299 WeakPolarHBondContact O-CG1 3.25Å; L297-I299 PolarHBondContact O-N 3.01Å; I299-V305 HydrophobicContact CG2-CG2 4.14Å
300	P	84.6	Confident	85.2	Confident	1 Å²	1	48.4 Å²	48.4	1%	0.006	26%	0.257	C	S	.	.			trans	-48.2	128.4	171.1	-29.5	35.2	0	0	0	113.3	L241 A244 N302 I303	L241-P300 HydrophobicContact CB-CG 4.5Å; L241-P300 HydrophobicContact CD2-CG 3.79Å; L241-P300 WeakPolarHBondContact O-CB 3.35Å; A244-P300 HydrophobicContact CB-CG 4.27Å; P300-N302 VanDerWaalsContact C-N 3.28Å; P300-N302 VanDerWaalsContact C-OD1 3.32Å; P300-N302 WeakPolarHBondContact CB-OD1 3.5Å; P300-N302 PolarHBondContact O-N 2.82Å; P300-I303 HydrophobicContact CB-CD1 3.81Å; P300-I303 HydrophobicContact CB-CG1 4Å; P300-I303 HydrophobicContact CG-CD1 3.85Å; P300-I303 PolarHBondContact O-N 3.26Å; P300-I303 VanDerWaalsContact O-N 3.16Å
301	P	81.3	Confident	84.6	Confident	74 Å²	74	47.7 Å²	47.7	48%	0.481	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-24.6	-170	28.5	-35.5	0	0	0	113.6	R295 I303	R295-P301 PolarHBondContact NH2-O 2.82Å; P301-I303 VanDerWaalsContact C-N 3.31Å
302	N	84.2	Confident	84	Confident	83 Å²	83	48.2 Å²	48.2	44%	0.444	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-20	173.6	62.4	-36	0	0	0	113.8	A244 P300 D304	A244-N302 PolarHBondContact O-ND2 3.02Å; P300-N302 VanDerWaalsContact C-N 3.28Å; P300-N302 VanDerWaalsContact C-OD1 3.32Å; P300-N302 WeakPolarHBondContact CB-OD1 3.5Å; P300-N302 PolarHBondContact O-N 2.82Å; N302-D304 PolarHBondContact O-N 2.93Å
303	I	84.4	Confident	83.6	Confident	6 Å²	6	54.1 Å²	54.1	3%	0.031	29%	0.289	C	S	.	.	S	Bend	trans	-84.4	114.8	176.8	-61.1	175.7	0	0	0	108.6	S245 I247 R295 P300 P301 V305 T414 L415	S245-I303 WeakPolarHBondContact O-CD1 3.23Å; I247-I303 HydrophobicContact CD1-CD1 4.29Å; I247-I303 HydrophobicContact CG1-CD1 3.62Å; R295-I303 PolarHBondContact NH2-O 2.87Å; P300-I303 HydrophobicContact CB-CD1 3.81Å; P300-I303 HydrophobicContact CB-CG1 4Å; P300-I303 HydrophobicContact CG-CD1 3.85Å; P300-I303 PolarHBondContact O-N 3.26Å; P300-I303 VanDerWaalsContact O-N 3.16Å; P301-I303 VanDerWaalsContact C-N 3.31Å; I303-V305 HydrophobicContact CG2-CG2 3.85Å; I303-T414 HydrophobicContact CG2-CG2 4.09Å; I303-L415 HydrophobicContact CG2-CB 4.22Å
304	D	86.3	Confident	83.3	Confident	79 Å²	79	55 Å²	55	42%	0.422	30%	0.297	S	S	.	.			trans	-72.2	125.4	166.7	-177.1	33.3	0	0	0	110	N302 P413 T414 L415	N302-D304 PolarHBondContact O-N 2.93Å; D304-P413 WeakPolarHBondContact OD2-CA 3.37Å; D304-P413 VanDerWaalsContact OD2-CB 3.29Å; D304-P413 WeakPolarHBondContact OD2-CB 3.21Å; D304-T414 PolarHBondContact O-N 3.2Å; D304-L415 PolarHBondContact O-N 2.87Å
305	V	89.3	Confident	83.2	Confident	22 Å²	22	53.4 Å²	53.4	13%	0.133	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	121.4	-172.4	178.1	0	0	0	0	108.2	I292 I299 I303 L415 M417	I292-V305 HydrophobicContact CG2-CG1 4.15Å; I299-V305 HydrophobicContact CG2-CG2 4.14Å; I303-V305 HydrophobicContact CG2-CG2 3.85Å; V305-L415 HydrophobicContact CG1-CD2 4.38Å; V305-L415 HydrophobicContact CG2-CB 4.36Å; V305-L415 HydrophobicContact CG2-CD2 4.29Å; V305-M417 HydrophobicContact CG1-CE 3.65Å; V305-M417 HydrophobicContact CG1-CG 4.48Å; V305-M417 HydrophobicContact CG1-SD 4.11Å
306	L	90.8	Very high	83.4	Confident	36 Å²	36	53.1 Å²	53.1	19%	0.188	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	130.8	175.6	-167.7	63.7	0	0	0	110.3	A408 M411 P413 L415 M417	L306-A408 HydrophobicContact CD2-CB 3.74Å; L306-M411 HydrophobicContact CD1-CE 4.4Å; L306-M411 HydrophobicContact CD2-CB 4.4Å; L306-M411 HydrophobicContact CD2-CE 4.07Å; L306-M411 HydrophobicContact CD2-SD 3.76Å; L306-P413 HydrophobicContact CB-CB 4.04Å; L306-P413 HydrophobicContact CB-CG 3.75Å; L306-P413 HydrophobicContact CD2-CG 4.4Å; L306-L415 PolarHBondContact N-O 3.02Å; L306-L415 VanDerWaalsContact N-O 3.12Å; L306-M417 WeakPolarHBondContact O-CB 3.47Å; L306-M417 PolarHBondContact O-N 2.84Å
307	L	89.8	Confident	83.5	Confident	26 Å²	26	52.7 Å²	52.7	14%	0.136	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	121.5	171.1	178.9	54.8	0	0	0	109.8	L289 K290 A293 E309 M417	L289-L307 HydrophobicContact CB-CD1 3.91Å; L289-L307 HydrophobicContact CB-CD2 3.88Å; L289-L307 HydrophobicContact CD1-CD1 3.88Å; L289-L307 HydrophobicContact CG-CD1 4.48Å; K290-L307 HydrophobicContact CG-CD2 4.33Å; A293-L307 HydrophobicContact CB-CB 3.74Å; A293-L307 HydrophobicContact CB-CD2 3.81Å; A293-L307 HydrophobicContact CB-CG 4.46Å; L307-E309 HydrophobicContact CD2-CB 4.39Å; L307-E309 HydrophobicContact CD2-CG 4.11Å; L307-E309 WeakPolarHBondContact CD2-OE2 3.49Å; L307-E309 HydrophobicContact CG-CB 4.03Å; L307-E309 HydrophobicContact CG-CG 4Å; L307-E309 PolarHBondContact O-N 2.83Å; L307-M417 HydrophobicContact CB-CB 4.49Å; L307-M417 HydrophobicContact CB-CE 3.91Å; L307-M417 HydrophobicContact CD1-CB 3.84Å; L307-M417 HydrophobicContact CD1-CE 4.37Å; L307-M417 HydrophobicContact CD2-CE 4.44Å; L307-M417 HydrophobicContact CG-CE 4.47Å
308	C	84.5	Confident	83.9	Confident	13 Å²	13	54 Å²	54	9%	0.088	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	83.3	173.1	-175.2	0	0	0	0	110.2	L405 A408 M417 L418	C308-L405 VanDerWaalsContact SG-CA 3.6Å; C308-A408 HydrophobicContact CB-CB 4.12Å; C308-M417 PolarHBondContact N-O 2.9Å; C308-L418 HydrophobicContact CB-CD2 3.7Å
309	E	72.1	Confident	84.2	Confident	76 Å²	76	51.3 Å²	51.3	36%	0.355	28%	0.278	S	S	.	.			trans	-124.1	-14.4	177.9	69.3	163	-127	0	0	115.8	K290 L307 M401	K290-E309 WeakPolarHBondContact CE-OE1 3.38Å; K290-E309 WeakPolarHBondContact CE-OE2 3.24Å; K290-E309 VanDerWaalsContact CG-OE2 3.26Å; K290-E309 WeakPolarHBondContact CG-OE2 3.19Å; K290-E309 IonicContact NZ-OE1 2.79Å; K290-E309 PolarHBondContact NZ-OE1 2.9Å; K290-E309 VanDerWaalsContact NZ-OE1 3.11Å; K290-E309 IonicContact NZ-OE2 2.76Å; L307-E309 HydrophobicContact CD2-CB 4.39Å; L307-E309 HydrophobicContact CD2-CG 4.11Å; L307-E309 WeakPolarHBondContact CD2-OE2 3.49Å; L307-E309 HydrophobicContact CG-CB 4.03Å; L307-E309 HydrophobicContact CG-CG 4Å; L307-E309 PolarHBondContact O-N 2.83Å; E309-M401 WeakPolarHBondContact O-CE 3.39Å
310	Q	68.8	Low	84.5	Confident	153 Å²	153	51.1 Å²	51.1	72%	0.715	28%	0.278	S	S	*	.	S	Bend	trans	-115	138.8	-172.7	-164.2	176	17	0	0	111.1	S404	Q310-S404 WeakPolarHBondContact O-CB 3.11Å; Q310-S404 PolarHBondContact O-OG 3.31Å
311	E	78.4	Confident	84.7	Confident	70 Å²	70	55.5 Å²	55.5	33%	0.327	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-62.6	148.6	171.6	-63.7	-173.5	-173	0	0	112.1	G397 R400 M401	E311-G397 VanDerWaalsContact OE1-C 3.26Å; E311-G397 WeakPolarHBondContact OE1-CA 3.49Å; E311-G397 WeakPolarHBondContact OE2-CA 3.17Å; E311-R400 HydrophobicContact CB-CB 3.97Å; E311-R400 HydrophobicContact CG-CB 4.38Å; E311-R400 IonicContact OE2-CZ 2.66Å; E311-R400 IonicContact OE2-NE 3.54Å; E311-R400 PolarHBondContact OE2-NE 3.08Å; E311-R400 IonicContact OE2-NH2 3.45Å; E311-R400 PolarHBondContact OE2-NH2 2.91Å; E311-M401 HydrophobicContact CG-CB 4.28Å; E311-M401 HydrophobicContact CG-CE 3.88Å
312	V	77.4	Confident	85.1	Confident	22 Å²	22	52.7 Å²	52.7	13%	0.133	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-67.6	139.6	172.1	178.2	0	0	0	0	110.5	A322 T392 R400 V403	V312-A322 HydrophobicContact CG1-CB 4.33Å; V312-T392 HydrophobicContact CG1-CG2 4.07Å; V312-R400 PolarHBondContact N-O 3.15Å; V312-V403 HydrophobicContact CB-CB 4.41Å; V312-V403 HydrophobicContact CB-CG1 4.47Å; V312-V403 HydrophobicContact CG2-CB 3.96Å; V312-V403 HydrophobicContact CG2-CG1 3.96Å
313	I	80.4	Confident	85.3	Confident	125 Å²	125	48.8 Å²	48.8	64%	0.641	26%	0.26	S	S	*	.	P	Polyproline II helix	trans	-55.6	141.1	179.7	-51.3	177.8	0	0	0	110.4	D315 T392	I313-D315 VanDerWaalsContact C-N 3.27Å; I313-D315 WeakPolarHBondContact CG2-OD1 3.47Å; I313-D315 PolarHBondContact O-N 3.31Å; I313-T392 PolarHBondContact O-OG1 2.85Å
314	A	83	Confident	85.5	Confident	48 Å²	48	49.6 Å²	49.6	40%	0.397	27%	0.265	S	S	.	.			trans	-80.7	67.5	-173.1	0	0	0	0	0	112.4	K393	A314-K393 HydrophobicContact CB-CB 4.23Å; A314-K393 VanDerWaalsContact O-CB 3.27Å; A314-K393 WeakPolarHBondContact O-CB 3.45Å
315	D	87.4	Confident	85.4	Confident	74 Å²	74	50.3 Å²	50.3	40%	0.396	26%	0.264	S	S	.	.			trans	-96.2	173.4	-175.7	-63.2	-25	0	0	0	113.3	I313 T317 T392 K393	I313-D315 VanDerWaalsContact C-N 3.27Å; I313-D315 WeakPolarHBondContact CG2-OD1 3.47Å; I313-D315 PolarHBondContact O-N 3.31Å; D315-T317 PolarHBondContact O-N 3.23Å; D315-T392 PolarHBondContact N-OG1 2.87Å; D315-T392 VanDerWaalsContact N-OG1 3.17Å; D315-T392 PolarHBondContact O-N 2.98Å; D315-T392 PolarHBondContact O-OG1 3.04Å; D315-K393 WeakPolarHBondContact O-CB 3.48Å; D315-K393 PolarHBondContact O-N 3.42Å
316	D	89.4	Confident	85	Confident	107 Å²	107	49.5 Å²	49.5	57%	0.572	26%	0.26	S	S	*	.	S	Bend	trans	-74.9	-4.3	165	-80.3	-66.8	0	0	0	114	P318 K393	D316-P318 WeakPolarHBondContact O-CD 3.47Å; D316-K393 WeakPolarHBondContact OD1-CE 3.32Å; D316-K393 IonicContact OD1-NZ 2.83Å; D316-K393 PolarHBondContact OD1-NZ 2.63Å; D316-K393 IonicContact OD2-NZ 2.69Å; D316-K393 PolarHBondContact OD2-NZ 2.96Å
317	T	88.4	Confident	84.6	Confident	23 Å²	23	49.7 Å²	49.7	14%	0.141	26%	0.261	C	S	.	.	S	Bend	trans	-63.1	127.5	176.5	-63.9	0	0	0	0	110.6	D315 Q321 A322 K325 T392	D315-T317 PolarHBondContact O-N 3.23Å; T317-Q321 HydrophobicContact CG2-CB 3.7Å; T317-A322 HydrophobicContact CG2-CB 4.09Å; T317-K325 HydrophobicContact CG2-CD 4.02Å; T317-K325 PolarHBondContact OG1-NZ 3.44Å; T317-T392 PolarHBondContact O-N 2.81Å; T317-T392 PolarHBondContact O-OG1 3.48Å
318	P	92.1	Very high	84.2	Confident	29 Å²	29	52.5 Å²	52.5	19%	0.188	28%	0.279	C	S	.	.	B	Isolated β-bridge	trans	-58.6	145.9	172.2	-26.6	35.5	0	0	0	113.2	D316 V320 Q321 A322 R390	D316-P318 WeakPolarHBondContact O-CD 3.47Å; P318-V320 VanDerWaalsContact C-N 3.32Å; P318-V320 HydrophobicContact CB-CG1 4.48Å; P318-V320 PolarHBondContact O-N 2.8Å; P318-Q321 HydrophobicContact CB-CB 4.35Å; P318-Q321 HydrophobicContact CB-CG 4.27Å; P318-Q321 HydrophobicContact CG-CG 4.32Å; P318-Q321 CarbonylContact O-C 3.59Å; P318-Q321 WeakPolarHBondContact O-CA 3.39Å; P318-Q321 WeakPolarHBondContact O-CB 3.35Å; P318-Q321 PolarHBondContact O-N 3.46Å; P318-A322 PolarHBondContact O-N 2.94Å; P318-R390 CarbonylContact C-O 3.51Å; P318-R390 WeakPolarHBondContact CA-O 3.12Å
319	A	90.5	Very high	84	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-53.6	-43.7	-177.8	0	0	0	0	0	113.6	Q321 A322 V323 F383 Q388 R390 F395 V403	A319-Q321 VanDerWaalsContact C-N 3.33Å; A319-Q321 PolarHBondContact O-N 3.19Å; A319-A322 PolarHBondContact O-N 3.2Å; A319-V323 PolarHBondContact O-N 3.08Å; A319-V323 VanDerWaalsContact O-N 3.12Å; A319-F383 HydrophobicContact CB-CE1 4.32Å; A319-Q388 PolarHBondContact N-O 2.84Å; A319-R390 PolarHBondContact N-O 3.13Å; A319-F395 HydrophobicContact CB-CE2 4.22Å; A319-V403 HydrophobicContact CB-CG2 4.08Å
320	V	91.5	Very high	84.5	Confident	6 Å²	6	56.7 Å²	56.7	4%	0.036	29%	0.29	C	S	.	.	H	α-helix	trans	-62.6	-37	175.2	68.4	0	0	0	0	112.7	P318 L324 E371 A374 R375 L378 Q388	P318-V320 VanDerWaalsContact C-N 3.32Å; P318-V320 HydrophobicContact CB-CG1 4.48Å; P318-V320 PolarHBondContact O-N 2.8Å; V320-L324 HydrophobicContact CG2-CD1 4.28Å; V320-L324 WeakPolarHBondContact O-CB 3.24Å; V320-L324 WeakPolarHBondContact O-CG 3.38Å; V320-L324 PolarHBondContact O-N 2.82Å; V320-E371 HydrophobicContact CG2-CG 4.48Å; V320-A374 HydrophobicContact CG2-CB 4.37Å; V320-R375 HydrophobicContact CG2-CG 3.78Å; V320-L378 HydrophobicContact CB-CD1 4.06Å; V320-L378 HydrophobicContact CG2-CD1 4.43Å; V320-Q388 HydrophobicContact CB-CB 4.49Å; V320-Q388 WeakPolarHBondContact CB-O 3.45Å; V320-Q388 WeakPolarHBondContact CG1-O 3.41Å; V320-Q388 PolarHBondContact N-O 2.9Å
321	Q	89.4	Confident	85.2	Confident	93 Å²	93	52.3 Å²	52.3	44%	0.435	27%	0.271	S	S	.	.	H	α-helix	trans	-73.2	-33.1	175.5	-68.5	-171.1	6	0	0	112	T317 P318 A319 V323 L324 K325	T317-Q321 HydrophobicContact CG2-CB 3.7Å; P318-Q321 HydrophobicContact CB-CB 4.35Å; P318-Q321 HydrophobicContact CB-CG 4.27Å; P318-Q321 HydrophobicContact CG-CG 4.32Å; P318-Q321 CarbonylContact O-C 3.59Å; P318-Q321 WeakPolarHBondContact O-CA 3.39Å; P318-Q321 WeakPolarHBondContact O-CB 3.35Å; P318-Q321 PolarHBondContact O-N 3.46Å; A319-Q321 VanDerWaalsContact C-N 3.33Å; A319-Q321 PolarHBondContact O-N 3.19Å; Q321-V323 VanDerWaalsContact C-N 3.32Å; Q321-V323 PolarHBondContact O-N 2.78Å; Q321-L324 PolarHBondContact O-N 3.02Å; Q321-K325 VanDerWaalsContact O-CB 3.26Å; Q321-K325 WeakPolarHBondContact O-CB 3.47Å; Q321-K325 WeakPolarHBondContact O-CG 3.42Å; Q321-K325 PolarHBondContact O-N 2.82Å
322	A	88.9	Confident	85.6	Confident	16 Å²	16	56.1 Å²	56.1	13%	0.132	29%	0.287	C	S	.	.	H	α-helix	trans	-64.7	-37.4	175.5	0	0	0	0	0	111.8	V312 T317 P318 A319 T392 V403	V312-A322 HydrophobicContact CG1-CB 4.33Å; T317-A322 HydrophobicContact CG2-CB 4.09Å; P318-A322 PolarHBondContact O-N 2.94Å; A319-A322 PolarHBondContact O-N 3.2Å; A322-T392 HydrophobicContact CB-CG2 4.03Å; A322-V403 HydrophobicContact CB-CG1 3.95Å
323	V	89.2	Confident	86	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-67.2	-48	171.2	176.3	0	0	0	0	111	A319 Q321 K325 A326 A374 L378 V403 A406 F410	A319-V323 PolarHBondContact O-N 3.08Å; A319-V323 VanDerWaalsContact O-N 3.12Å; Q321-V323 VanDerWaalsContact C-N 3.32Å; Q321-V323 PolarHBondContact O-N 2.78Å; V323-K325 PolarHBondContact O-N 3.5Å; V323-A326 WeakPolarHBondContact O-CB 3.34Å; V323-A326 PolarHBondContact O-N 2.71Å; V323-A374 HydrophobicContact CB-CB 4.4Å; V323-A374 HydrophobicContact CG1-CB 3.81Å; V323-L378 HydrophobicContact CG2-CD1 4.11Å; V323-L378 HydrophobicContact CG2-CD2 4.11Å; V323-L378 HydrophobicContact CG2-CG 4.22Å; V323-V403 HydrophobicContact CG2-CG1 4.12Å; V323-A406 HydrophobicContact CG2-CB 3.69Å; V323-F410 HydrophobicContact CG1-CB 3.57Å; V323-F410 HydrophobicContact CG1-CD1 4Å; V323-F410 HydrophobicContact CG1-CD2 4.16Å; V323-F410 HydrophobicContact CG1-CG 3.64Å; V323-F410 WeakPolarHBondContact O-CD1 3.18Å
324	L	87.8	Confident	86.3	Confident	24 Å²	24	51.1 Å²	51.1	13%	0.126	26%	0.26	C	S	.	.	H	α-helix	trans	-64.9	-36.4	-179.7	-74.5	170.6	0	0	0	113.7	V320 Q321 A326 D327 E371 A374 F410	V320-L324 HydrophobicContact CG2-CD1 4.28Å; V320-L324 WeakPolarHBondContact O-CB 3.24Å; V320-L324 WeakPolarHBondContact O-CG 3.38Å; V320-L324 PolarHBondContact O-N 2.82Å; Q321-L324 PolarHBondContact O-N 3.02Å; L324-A326 PolarHBondContact O-N 2.78Å; L324-D327 PolarHBondContact O-N 2.95Å; L324-E371 HydrophobicContact CD1-CB 4.25Å; L324-E371 HydrophobicContact CD1-CG 4.21Å; L324-A374 HydrophobicContact CD2-CB 4.03Å; L324-A374 HydrophobicContact CG-CB 4.1Å; L324-F410 HydrophobicContact CD2-CE1 4.48Å; L324-F410 HydrophobicContact CD2-CE2 4.25Å; L324-F410 HydrophobicContact CD2-CZ 3.81Å
325	K	84.1	Confident	86.5	Confident	93 Å²	93	52.1 Å²	52.1	40%	0.404	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-12.6	176.5	-75.2	175.4	-174.6	-176.3	0	113.4	T317 Q321 V323 D327 L331	T317-K325 HydrophobicContact CG2-CD 4.02Å; T317-K325 PolarHBondContact OG1-NZ 3.44Å; Q321-K325 VanDerWaalsContact O-CB 3.26Å; Q321-K325 WeakPolarHBondContact O-CB 3.47Å; Q321-K325 WeakPolarHBondContact O-CG 3.42Å; Q321-K325 PolarHBondContact O-N 2.82Å; V323-K325 PolarHBondContact O-N 3.5Å; K325-D327 VanDerWaalsContact C-N 3.3Å; K325-D327 PolarHBondContact O-N 3.2Å; K325-L331 HydrophobicContact CB-CD1 4.15Å; K325-L331 HydrophobicContact CG-CD1 4.22Å
326	A	81.1	Confident	86.6	Confident	5 Å²	5	51.1 Å²	51.1	4%	0.041	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-33.9	177.7	0	0	0	0	0	113	V323 L324 T328 R407 M411	V323-A326 WeakPolarHBondContact O-CB 3.34Å; V323-A326 PolarHBondContact O-N 2.71Å; L324-A326 PolarHBondContact O-N 2.78Å; A326-T328 VanDerWaalsContact C-N 3.35Å; A326-T328 PolarHBondContact O-N 3.38Å; A326-R407 HydrophobicContact CB-CB 4.24Å; A326-R407 HydrophobicContact CB-CG 3.53Å; A326-M411 HydrophobicContact CB-CG 3.74Å; A326-M411 HydrophobicContact CB-SD 3.84Å
327	D	82.3	Confident	86.5	Confident	40 Å²	40	47.8 Å²	47.8	21%	0.214	23%	0.233	C	C	.	.			trans	-80.5	85.3	173.8	-173.8	-9.9	0	0	0	110.1	L324 K325 R329 R330 L331 F410	L324-D327 PolarHBondContact O-N 2.95Å; K325-D327 VanDerWaalsContact C-N 3.3Å; K325-D327 PolarHBondContact O-N 3.2Å; D327-R329 PolarHBondContact O-N 2.88Å; D327-R329 WeakPolarHBondContact OD1-CA 3.42Å; D327-R329 WeakPolarHBondContact OD1-CB 3.33Å; D327-R329 PolarHBondContact OD1-N 2.73Å; D327-R330 HydrophobicContact CB-CB 3.93Å; D327-R330 PolarHBondContact O-N 3.49Å; D327-R330 PolarHBondContact OD1-N 3.35Å; D327-R330 VanDerWaalsContact OD2-CB 3.23Å; D327-R330 WeakPolarHBondContact OD2-CB 3.5Å; D327-L331 PolarHBondContact O-N 3.32Å; D327-F410 HydrophobicContact CB-CE1 4.09Å
328	T	80.7	Confident	86.5	Confident	85 Å²	85	52.1 Å²	52.1	52%	0.521	25%	0.25	S	C	.	.	H	α-helix	trans	-65.8	-19	177	66.7	0	0	0	0	113.3	A326 K332	A326-T328 VanDerWaalsContact C-N 3.35Å; A326-T328 PolarHBondContact O-N 3.38Å; T328-K332 WeakPolarHBondContact O-CB 3.43Å; T328-K332 WeakPolarHBondContact O-CD 3.41Å; T328-K332 WeakPolarHBondContact O-CG 3.47Å; T328-K332 PolarHBondContact O-N 3.11Å
329	R	80.5	Confident	86.4	Confident	145 Å²	145	56 Å²	56	55%	0.547	27%	0.267	S	S	.	.	H	α-helix	trans	-75.9	-48.3	174.1	-177.5	-179.2	179.3	175.4	-0.1	110	D327 L331 K332 L333 E361 I365	D327-R329 PolarHBondContact O-N 2.88Å; D327-R329 WeakPolarHBondContact OD1-CA 3.42Å; D327-R329 WeakPolarHBondContact OD1-CB 3.33Å; D327-R329 PolarHBondContact OD1-N 2.73Å; R329-L331 VanDerWaalsContact C-N 3.34Å; R329-L331 PolarHBondContact O-N 3.05Å; R329-K332 PolarHBondContact O-N 3.35Å; R329-L333 HydrophobicContact CG-CD1 4.01Å; R329-L333 WeakPolarHBondContact O-CG 3.02Å; R329-L333 PolarHBondContact O-N 3.36Å; R329-E361 IonicContact CZ-OE2 2.79Å; R329-E361 IonicContact NE-OE2 3.27Å; R329-E361 IonicContact NH2-OE2 3.69Å; R329-E361 PolarHBondContact NH2-OE2 2.81Å; R329-I365 HydrophobicContact CG-CD1 4.17Å
330	R	82.4	Confident	86.3	Confident	32 Å²	32	57 Å²	57	12%	0.121	27%	0.272	C	S	.	.	H	α-helix	trans	-55.7	-47.7	172.9	176.9	-166.7	162.8	144	12.1	111.2	D327 K332 L333 L334 I365 A367	D327-R330 HydrophobicContact CB-CB 3.93Å; D327-R330 PolarHBondContact O-N 3.49Å; D327-R330 PolarHBondContact OD1-N 3.35Å; D327-R330 VanDerWaalsContact OD2-CB 3.23Å; D327-R330 WeakPolarHBondContact OD2-CB 3.5Å; R330-K332 PolarHBondContact O-N 3.33Å; R330-L333 PolarHBondContact O-N 2.98Å; R330-L334 HydrophobicContact CG-CD1 3.89Å; R330-L334 HydrophobicContact CG-CG 4.24Å; R330-L334 WeakPolarHBondContact O-CG 2.92Å; R330-L334 PolarHBondContact O-N 3.48Å; R330-I365 HydrophobicContact CB-CG2 4.2Å; R330-A367 HydrophobicContact CG-CB 4.38Å; R330-A367 PolarHBondContact NH1-O 3.41Å; R330-A367 PolarHBondContact NH2-O 2.98Å
331	L	83.5	Confident	86.2	Confident	61 Å²	61	59.4 Å²	59.4	32%	0.319	28%	0.283	S	S	.	.	H	α-helix	trans	-56.7	-51.5	178.3	-76.8	-178.7	0	0	0	111.5	K325 D327 R329 L333 L334 D335	K325-L331 HydrophobicContact CB-CD1 4.15Å; K325-L331 HydrophobicContact CG-CD1 4.22Å; D327-L331 PolarHBondContact O-N 3.32Å; R329-L331 VanDerWaalsContact C-N 3.34Å; R329-L331 PolarHBondContact O-N 3.05Å; L331-L333 VanDerWaalsContact C-N 3.3Å; L331-L333 PolarHBondContact O-N 3.37Å; L331-L334 PolarHBondContact O-N 3.15Å; L331-L334 VanDerWaalsContact O-N 3.14Å; L331-D335 PolarHBondContact O-N 2.94Å
332	K	86.8	Confident	86.2	Confident	150 Å²	150	56.9 Å²	56.9	65%	0.652	28%	0.278	S	S	*	.	H	α-helix	trans	-56.8	-42.5	177.8	-74.2	169	-176.3	176.6	0	112.3	T328 R329 R330 D335 E336	T328-K332 WeakPolarHBondContact O-CB 3.43Å; T328-K332 WeakPolarHBondContact O-CD 3.41Å; T328-K332 WeakPolarHBondContact O-CG 3.47Å; T328-K332 PolarHBondContact O-N 3.11Å; R329-K332 PolarHBondContact O-N 3.35Å; R330-K332 PolarHBondContact O-N 3.33Å; K332-D335 PolarHBondContact O-N 3.13Å; K332-E336 WeakPolarHBondContact O-CB 3.39Å; K332-E336 PolarHBondContact O-N 3.14Å
333	L	86.4	Confident	86.2	Confident	6 Å²	6	61.8 Å²	61.8	3%	0.031	29%	0.293	C	S	.	.	H	α-helix	trans	-69	-35.7	177.6	-72.4	168	0	0	0	113	R329 R330 L331 E337 V358 E361 L362 I365	R329-L333 HydrophobicContact CG-CD1 4.01Å; R329-L333 WeakPolarHBondContact O-CG 3.02Å; R329-L333 PolarHBondContact O-N 3.36Å; R330-L333 PolarHBondContact O-N 2.98Å; L331-L333 VanDerWaalsContact C-N 3.3Å; L331-L333 PolarHBondContact O-N 3.37Å; L333-E337 VanDerWaalsContact O-CB 3.24Å; L333-E337 WeakPolarHBondContact O-CB 3.35Å; L333-E337 PolarHBondContact O-N 3.21Å; L333-V358 HydrophobicContact CB-CG1 4.44Å; L333-V358 HydrophobicContact CD2-CG1 4.23Å; L333-V358 HydrophobicContact CD2-CG2 4.16Å; L333-V358 WeakPolarHBondContact O-CG1 3.29Å; L333-E361 HydrophobicContact CD1-CB 3.84Å; L333-E361 HydrophobicContact CD2-CB 4.25Å; L333-L362 HydrophobicContact CB-CD2 3.65Å; L333-L362 HydrophobicContact CB-CG 3.98Å; L333-I365 HydrophobicContact CD1-CD1 3.44Å; L333-I365 VanDerWaalsContact CD1-CD1 3.44Å
334	L	86.1	Confident	86.1	Confident	37 Å²	37	64.8 Å²	64.8	19%	0.194	31%	0.309	C	S	.	.	H	α-helix	trans	-72.6	-31.5	175.6	-71.9	176.9	0	0	0	113	R330 L331 E337 K338 L362	R330-L334 HydrophobicContact CG-CD1 3.89Å; R330-L334 HydrophobicContact CG-CG 4.24Å; R330-L334 WeakPolarHBondContact O-CG 2.92Å; R330-L334 PolarHBondContact O-N 3.48Å; L331-L334 PolarHBondContact O-N 3.15Å; L331-L334 VanDerWaalsContact O-N 3.14Å; L334-E337 VanDerWaalsContact CD2-OE2 3.3Å; L334-E337 WeakPolarHBondContact CD2-OE2 3.49Å; L334-K338 WeakPolarHBondContact O-CD 3.45Å; L334-K338 WeakPolarHBondContact O-CE 3.37Å; L334-K338 VanDerWaalsContact O-CG 3.3Å; L334-K338 WeakPolarHBondContact O-CG 3.27Å; L334-K338 PolarHBondContact O-N 2.84Å; L334-L362 HydrophobicContact CD2-CD1 4.03Å; L334-L362 HydrophobicContact CD2-CD2 3.74Å; L334-L362 HydrophobicContact CG-CD2 3.91Å
335	D	88.3	Confident	86.2	Confident	69 Å²	69	71.7 Å²	71.7	37%	0.369	34%	0.34	S	S	.	.	H	α-helix	trans	-81.4	-32.4	175.2	-66	-30.6	0	0	0	111.4	L331 K332 K338 M339	L331-D335 PolarHBondContact O-N 2.94Å; K332-D335 PolarHBondContact O-N 3.13Å; D335-K338 IonicContact OD1-NZ 3.12Å; D335-K338 PolarHBondContact OD1-NZ 3.25Å; D335-M339 HydrophobicContact CB-CE 4.33Å; D335-M339 WeakPolarHBondContact O-CB 3.44Å; D335-M339 VanDerWaalsContact O-CE 3.26Å; D335-M339 WeakPolarHBondContact O-CE 3.44Å; D335-M339 WeakPolarHBondContact O-CG 3.4Å; D335-M339 PolarHBondContact O-N 3.41Å; D335-M339 VanDerWaalsContact O-N 3.08Å
336	E	88.3	Confident	86.4	Confident	52 Å²	52	75.4 Å²	75.4	24%	0.243	36%	0.356	C	S	.	.	H	α-helix	trans	-62.7	-47.1	165.8	-173.8	175.5	-173.6	0	0	110.9	K332 K338 M339 L340 R354 V358	K332-E336 WeakPolarHBondContact O-CB 3.39Å; K332-E336 PolarHBondContact O-N 3.14Å; E336-K338 PolarHBondContact O-N 3.16Å; E336-M339 PolarHBondContact O-N 3.01Å; E336-M339 VanDerWaalsContact O-N 3.12Å; E336-L340 HydrophobicContact CG-CD1 3.67Å; E336-L340 HydrophobicContact CG-CG 4.04Å; E336-L340 WeakPolarHBondContact O-CB 3.37Å; E336-L340 VanDerWaalsContact O-CG 3.23Å; E336-L340 WeakPolarHBondContact O-CG 3.37Å; E336-L340 PolarHBondContact O-N 3.01Å; E336-R354 VanDerWaalsContact CD-NH2 3.26Å; E336-R354 IonicContact OE1-CZ 2.66Å; E336-R354 VanDerWaalsContact OE1-CZ 3.27Å; E336-R354 IonicContact OE1-NE 2.68Å; E336-R354 PolarHBondContact OE1-NE 2.83Å; E336-R354 IonicContact OE1-NH2 3.66Å; E336-R354 PolarHBondContact OE1-NH2 3.32Å; E336-R354 IonicContact OE2-CZ 3.3Å; E336-R354 IonicContact OE2-NE 3.88Å; E336-R354 IonicContact OE2-NH2 2.77Å; E336-R354 PolarHBondContact OE2-NH2 2.85Å; E336-V358 HydrophobicContact CG-CG2 4.15Å
337	E	88.5	Confident	86.6	Confident	38 Å²	38	77.7 Å²	77.7	18%	0.178	38%	0.381	C	S	.	.	H	α-helix	trans	-49.5	-54.9	175.3	-174	-159.7	155.8	0	0	111.5	L333 L334 M339 L340 Q341 L355 V358 Y359 L362	L333-E337 VanDerWaalsContact O-CB 3.24Å; L333-E337 WeakPolarHBondContact O-CB 3.35Å; L333-E337 PolarHBondContact O-N 3.21Å; L334-E337 VanDerWaalsContact CD2-OE2 3.3Å; L334-E337 WeakPolarHBondContact CD2-OE2 3.49Å; E337-M339 PolarHBondContact O-N 3.18Å; E337-L340 PolarHBondContact O-N 3.36Å; E337-Q341 WeakPolarHBondContact O-CB 3.34Å; E337-Q341 VanDerWaalsContact O-CG 3.3Å; E337-Q341 WeakPolarHBondContact O-CG 3.48Å; E337-Q341 PolarHBondContact O-N 3.01Å; E337-Q341 PolarHBondContact OE1-NE2 3.47Å; E337-L355 HydrophobicContact CG-CD1 4.06Å; E337-V358 HydrophobicContact CB-CG1 3.98Å; E337-Y359 HydrophobicContact CG-CD1 4.37Å; E337-Y359 HydrophobicContact CG-CE1 3.81Å; E337-L362 HydrophobicContact CB-CD1 4.17Å; E337-L362 HydrophobicContact CG-CD1 4.28Å; E337-L362 VanDerWaalsContact OE2-CD1 3.28Å; E337-L362 WeakPolarHBondContact OE2-CD1 3.4Å
338	K	88.9	Confident	86.6	Confident	114 Å²	114	79.9 Å²	79.9	50%	0.496	39%	0.39	S	S	.	.	H	α-helix	trans	-60.1	-43	177.8	-65.7	164.2	-157.5	158.3	0	112.5	L334 D335 E336 L340 A342	L334-K338 WeakPolarHBondContact O-CD 3.45Å; L334-K338 WeakPolarHBondContact O-CE 3.37Å; L334-K338 VanDerWaalsContact O-CG 3.3Å; L334-K338 WeakPolarHBondContact O-CG 3.27Å; L334-K338 PolarHBondContact O-N 2.84Å; D335-K338 IonicContact OD1-NZ 3.12Å; D335-K338 PolarHBondContact OD1-NZ 3.25Å; E336-K338 PolarHBondContact O-N 3.16Å; K338-L340 VanDerWaalsContact C-N 3.3Å; K338-L340 PolarHBondContact O-N 2.94Å; K338-A342 VanDerWaalsContact O-CB 3.29Å; K338-A342 WeakPolarHBondContact O-CB 3.45Å; K338-A342 PolarHBondContact O-N 3.17Å
339	M	89.7	Confident	86.5	Confident	111 Å²	111	82.1 Å²	82.1	55%	0.547	40%	0.399	S	S	.	.	H	α-helix	trans	-67.2	-31.5	179.6	-80.6	-171.8	-88.4	0	0	112.6	D335 E336 E337 R343	D335-M339 HydrophobicContact CB-CE 4.33Å; D335-M339 WeakPolarHBondContact O-CB 3.44Å; D335-M339 VanDerWaalsContact O-CE 3.26Å; D335-M339 WeakPolarHBondContact O-CE 3.44Å; D335-M339 WeakPolarHBondContact O-CG 3.4Å; D335-M339 PolarHBondContact O-N 3.41Å; D335-M339 VanDerWaalsContact O-N 3.08Å; E336-M339 PolarHBondContact O-N 3.01Å; E336-M339 VanDerWaalsContact O-N 3.12Å; E337-M339 PolarHBondContact O-N 3.18Å; M339-R343 WeakPolarHBondContact O-CD 3.25Å; M339-R343 VanDerWaalsContact O-CG 3.28Å; M339-R343 WeakPolarHBondContact O-CG 3.33Å; M339-R343 PolarHBondContact O-N 3.33Å
340	L	88.9	Confident	86.5	Confident	19 Å²	19	80.1 Å²	80.1	10%	0.099	41%	0.406	C	S	.	.	H	α-helix	trans	-79.9	-40.8	176.2	-64.6	177.2	0	0	0	111.3	E336 E337 K338 A342 R343 L344 V351 R354 L355 V358	E336-L340 HydrophobicContact CG-CD1 3.67Å; E336-L340 HydrophobicContact CG-CG 4.04Å; E336-L340 WeakPolarHBondContact O-CB 3.37Å; E336-L340 VanDerWaalsContact O-CG 3.23Å; E336-L340 WeakPolarHBondContact O-CG 3.37Å; E336-L340 PolarHBondContact O-N 3.01Å; E337-L340 PolarHBondContact O-N 3.36Å; K338-L340 VanDerWaalsContact C-N 3.3Å; K338-L340 PolarHBondContact O-N 2.94Å; L340-A342 PolarHBondContact O-N 3.19Å; L340-R343 PolarHBondContact O-N 3.44Å; L340-R343 VanDerWaalsContact O-N 3.16Å; L340-L344 PolarHBondContact O-N 2.9Å; L340-V351 HydrophobicContact CB-CG1 3.49Å; L340-V351 VanDerWaalsContact CB-CG1 3.49Å; L340-V351 HydrophobicContact CD2-CG1 3.62Å; L340-V351 HydrophobicContact CD2-CG2 4.46Å; L340-V351 HydrophobicContact CG-CG1 4.03Å; L340-V351 WeakPolarHBondContact O-CG1 3.44Å; L340-R354 HydrophobicContact CD1-CB 4.13Å; L340-R354 HydrophobicContact CD1-CG 3.61Å; L340-L355 HydrophobicContact CB-CB 4.31Å; L340-L355 HydrophobicContact CB-CD1 4.12Å; L340-L355 HydrophobicContact CD1-CB 4.45Å; L340-V358 HydrophobicContact CD1-CG2 4.12Å
341	Q	88.8	Confident	86.7	Confident	57 Å²	57	79.1 Å²	79.1	27%	0.266	40%	0.404	S	S	.	.	H	α-helix	trans	-54.7	-51.7	170.1	-75.6	164.7	-10.8	0	0	111	E337 R343 L344 E345 L355 Y359	E337-Q341 WeakPolarHBondContact O-CB 3.34Å; E337-Q341 VanDerWaalsContact O-CG 3.3Å; E337-Q341 WeakPolarHBondContact O-CG 3.48Å; E337-Q341 PolarHBondContact O-N 3.01Å; E337-Q341 PolarHBondContact OE1-NE2 3.47Å; Q341-R343 PolarHBondContact O-N 3.05Å; Q341-L344 PolarHBondContact O-N 2.8Å; Q341-L344 VanDerWaalsContact O-N 3.1Å; Q341-E345 WeakPolarHBondContact O-CG 3.4Å; Q341-E345 PolarHBondContact O-N 3.35Å; Q341-L355 HydrophobicContact CG-CD1 4.15Å; Q341-L355 HydrophobicContact CG-CD2 4.12Å; Q341-Y359 PolarHBondContact NE2-OH 2.86Å
342	A	89.8	Confident	86.7	Confident	40 Å²	40	78.3 Å²	78.3	33%	0.331	41%	0.406	S	S	.	.	H	α-helix	trans	-70	-1.5	179.8	0	0	0	0	0	115.2	K338 L340 K346	K338-A342 VanDerWaalsContact O-CB 3.29Å; K338-A342 WeakPolarHBondContact O-CB 3.45Å; K338-A342 PolarHBondContact O-N 3.17Å; L340-A342 PolarHBondContact O-N 3.19Å; A342-K346 VanDerWaalsContact O-CD 3.24Å; A342-K346 WeakPolarHBondContact O-CD 3.44Å; A342-K346 WeakPolarHBondContact O-CE 3.46Å; A342-K346 WeakPolarHBondContact O-CG 3.35Å
343	R	88.2	Confident	86.7	Confident	119 Å²	119	77.9 Å²	77.9	45%	0.449	41%	0.406	S	S	.	.	H	α-helix	trans	-102.9	-37.1	167.7	-72.9	172.8	-167.3	-141.8	8.8	111.9	M339 L340 Q341 E345 K346 G347 E348 V351	M339-R343 WeakPolarHBondContact O-CD 3.25Å; M339-R343 VanDerWaalsContact O-CG 3.28Å; M339-R343 WeakPolarHBondContact O-CG 3.33Å; M339-R343 PolarHBondContact O-N 3.33Å; L340-R343 PolarHBondContact O-N 3.44Å; L340-R343 VanDerWaalsContact O-N 3.16Å; Q341-R343 PolarHBondContact O-N 3.05Å; R343-E345 VanDerWaalsContact C-N 3.31Å; R343-E345 PolarHBondContact O-N 3.26Å; R343-K346 CarbonylContact O-C 3.59Å; R343-K346 WeakPolarHBondContact O-CA 3.37Å; R343-K346 WeakPolarHBondContact O-CB 3.33Å; R343-K346 PolarHBondContact O-N 3.41Å; R343-G347 PolarHBondContact O-N 3.49Å; R343-E348 HydrophobicContact CB-CB 4.35Å; R343-E348 WeakPolarHBondContact CD-OE2 3.02Å; R343-E348 PolarHBondContact O-N 3.05Å; R343-V351 HydrophobicContact CB-CG2 4.07Å
344	L	88.3	Confident	86.8	Confident	64 Å²	64	81.8 Å²	81.8	34%	0.335	42%	0.421	S	S	.	.	H	α-helix	trans	-61.9	-40.7	172.4	-169.6	65.6	0	0	0	111	L340 Q341 K346 G347 A352 L355	L340-L344 PolarHBondContact O-N 2.9Å; Q341-L344 PolarHBondContact O-N 2.8Å; Q341-L344 VanDerWaalsContact O-N 3.1Å; L344-K346 PolarHBondContact O-N 3.2Å; L344-K346 VanDerWaalsContact O-N 3.15Å; L344-G347 PolarHBondContact O-N 3.09Å; L344-A352 HydrophobicContact CD1-CB 4.21Å; L344-L355 HydrophobicContact CD2-CD2 3.91Å
345	E	88.9	Confident	86.9	Confident	168 Å²	168	80.4 Å²	80.4	79%	0.785	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-19	170.6	-71.8	179.9	165.6	0	0	113.9	Q341 R343	Q341-E345 WeakPolarHBondContact O-CG 3.4Å; Q341-E345 PolarHBondContact O-N 3.35Å; R343-E345 VanDerWaalsContact C-N 3.31Å; R343-E345 PolarHBondContact O-N 3.26Å
346	K	88.3	Confident	86.9	Confident	171 Å²	171	83.9 Å²	83.9	74%	0.743	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.8	2.4	175.5	-63.4	174.7	-174.9	167.2	0	113.3	A342 R343 L344	A342-K346 VanDerWaalsContact O-CD 3.24Å; A342-K346 WeakPolarHBondContact O-CD 3.44Å; A342-K346 WeakPolarHBondContact O-CE 3.46Å; A342-K346 WeakPolarHBondContact O-CG 3.35Å; R343-K346 CarbonylContact O-C 3.59Å; R343-K346 WeakPolarHBondContact O-CA 3.37Å; R343-K346 WeakPolarHBondContact O-CB 3.33Å; R343-K346 PolarHBondContact O-N 3.41Å; L344-K346 PolarHBondContact O-N 3.2Å; L344-K346 VanDerWaalsContact O-N 3.15Å
347	G	84.3	Confident	87	Confident	54 Å²	54	87.2 Å²	87.2	56%	0.557	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.5	16.4	176.7	0	0	0	0	0	115.9	R343 L344 D349	R343-G347 PolarHBondContact O-N 3.49Å; L344-G347 PolarHBondContact O-N 3.09Å; G347-D349 PolarHBondContact O-N 2.96Å; G347-D349 VanDerWaalsContact O-N 3.11Å
348	E	83.8	Confident	87	Confident	86 Å²	86	85.4 Å²	85.4	40%	0.402	43%	0.433	S	S	.	.			trans	-81.1	77.5	173.7	-67.8	-172.8	176.3	0	0	111.8	R343 S350 V351	R343-E348 HydrophobicContact CB-CB 4.35Å; R343-E348 WeakPolarHBondContact CD-OE2 3.02Å; R343-E348 PolarHBondContact O-N 3.05Å; E348-S350 PolarHBondContact O-N 2.97Å; E348-V351 HydrophobicContact CB-CG2 3.86Å; E348-V351 VanDerWaalsContact O-CB 3.25Å; E348-V351 WeakPolarHBondContact O-CB 3.34Å; E348-V351 PolarHBondContact O-N 3.21Å
349	D	78.6	Confident	86.9	Confident	132 Å²	132	85 Å²	85	71%	0.706	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-55	-26.6	-179.1	-74.2	-26.4	0	0	0	114.3	G347 V351 A352	G347-D349 PolarHBondContact O-N 2.96Å; G347-D349 VanDerWaalsContact O-N 3.11Å; D349-V351 PolarHBondContact O-N 2.47Å; D349-A352 WeakPolarHBondContact O-CB 3.42Å; D349-A352 PolarHBondContact O-N 2.97Å
350	S	80.1	Confident	86.8	Confident	102 Å²	102	83.9 Å²	83.9	71%	0.713	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-60.3	-23	175.6	57.9	0	0	0	0	113.6	E348	E348-S350 PolarHBondContact O-N 2.97Å
351	V	85.8	Confident	86.6	Confident	12 Å²	12	85.4 Å²	85.4	7%	0.073	43%	0.429	C	S	.	.	G	3₁₀ helix	trans	-74.5	-27.1	-179.6	167.6	0	0	0	0	112.5	L340 R343 E348 D349 Q353 R354 L355	L340-V351 HydrophobicContact CB-CG1 3.49Å; L340-V351 VanDerWaalsContact CB-CG1 3.49Å; L340-V351 HydrophobicContact CD2-CG1 3.62Å; L340-V351 HydrophobicContact CD2-CG2 4.46Å; L340-V351 HydrophobicContact CG-CG1 4.03Å; L340-V351 WeakPolarHBondContact O-CG1 3.44Å; R343-V351 HydrophobicContact CB-CG2 4.07Å; E348-V351 HydrophobicContact CB-CG2 3.86Å; E348-V351 VanDerWaalsContact O-CB 3.25Å; E348-V351 WeakPolarHBondContact O-CB 3.34Å; E348-V351 PolarHBondContact O-N 3.21Å; D349-V351 PolarHBondContact O-N 2.47Å; V351-Q353 VanDerWaalsContact C-N 3.31Å; V351-Q353 PolarHBondContact O-N 3.06Å; V351-R354 PolarHBondContact O-N 3.17Å; V351-L355 PolarHBondContact O-N 3.22Å
352	A	83.8	Confident	86.4	Confident	43 Å²	43	83.3 Å²	83.3	36%	0.355	42%	0.419	S	S	.	.	H	α-helix	trans	-55.8	-41.9	-173.6	0	0	0	0	0	113.2	L344 D349 R354 L355 E356	L344-A352 HydrophobicContact CD1-CB 4.21Å; D349-A352 WeakPolarHBondContact O-CB 3.42Å; D349-A352 PolarHBondContact O-N 2.97Å; A352-R354 VanDerWaalsContact C-N 3.29Å; A352-R354 PolarHBondContact O-N 2.91Å; A352-L355 PolarHBondContact O-N 3.07Å; A352-E356 PolarHBondContact O-N 2.94Å
353	Q	87.1	Confident	86.1	Confident	142 Å²	142	89.8 Å²	89.8	66%	0.664	44%	0.435	S	S	*	.	H	α-helix	trans	-68.3	-23	179.3	-64.7	-172.9	10.5	0	0	114.2	V351 K357	V351-Q353 VanDerWaalsContact C-N 3.31Å; V351-Q353 PolarHBondContact O-N 3.06Å; Q353-K357 WeakPolarHBondContact O-CD 3.39Å; Q353-K357 WeakPolarHBondContact O-CG 3.43Å
354	R	88.1	Confident	85.9	Confident	87 Å²	87	89.7 Å²	89.7	33%	0.328	45%	0.448	S	S	.	.	H	α-helix	trans	-84.8	-39.7	172.2	-179.4	59.5	-176.1	146.4	4.8	110.3	E336 L340 V351 A352 E356 K357 V358 E361	E336-R354 VanDerWaalsContact CD-NH2 3.26Å; E336-R354 IonicContact OE1-CZ 2.66Å; E336-R354 VanDerWaalsContact OE1-CZ 3.27Å; E336-R354 IonicContact OE1-NE 2.68Å; E336-R354 PolarHBondContact OE1-NE 2.83Å; E336-R354 IonicContact OE1-NH2 3.66Å; E336-R354 PolarHBondContact OE1-NH2 3.32Å; E336-R354 IonicContact OE2-CZ 3.3Å; E336-R354 IonicContact OE2-NE 3.88Å; E336-R354 IonicContact OE2-NH2 2.77Å; E336-R354 PolarHBondContact OE2-NH2 2.85Å; L340-R354 HydrophobicContact CD1-CB 4.13Å; L340-R354 HydrophobicContact CD1-CG 3.61Å; V351-R354 PolarHBondContact O-N 3.17Å; A352-R354 VanDerWaalsContact C-N 3.29Å; A352-R354 PolarHBondContact O-N 2.91Å; R354-E356 VanDerWaalsContact C-N 3.35Å; R354-E356 PolarHBondContact O-N 3.45Å; R354-K357 PolarHBondContact O-N 3.15Å; R354-V358 HydrophobicContact CG-CG2 4.4Å; R354-V358 WeakPolarHBondContact O-CG2 3.42Å; R354-V358 PolarHBondContact O-N 2.99Å; R354-E361 IonicContact NH1-OE1 2.74Å; R354-E361 PolarHBondContact NH1-OE1 2.84Å; R354-E361 VanDerWaalsContact NH1-OE1 3.12Å; R354-E361 IonicContact NH2-OE1 3.02Å
355	L	89.1	Confident	85.4	Confident	8 Å²	8	88.9 Å²	88.9	4%	0.042	44%	0.443	C	S	.	.	H	α-helix	trans	-60.2	-42.2	176.4	-177.2	60.8	0	0	0	111.9	E337 L340 Q341 L344 V351 A352 K357 V358 Y359	E337-L355 HydrophobicContact CG-CD1 4.06Å; L340-L355 HydrophobicContact CB-CB 4.31Å; L340-L355 HydrophobicContact CB-CD1 4.12Å; L340-L355 HydrophobicContact CD1-CB 4.45Å; Q341-L355 HydrophobicContact CG-CD1 4.15Å; Q341-L355 HydrophobicContact CG-CD2 4.12Å; L344-L355 HydrophobicContact CD2-CD2 3.91Å; V351-L355 PolarHBondContact O-N 3.22Å; A352-L355 PolarHBondContact O-N 3.07Å; L355-K357 VanDerWaalsContact C-N 3.34Å; L355-K357 PolarHBondContact O-N 2.86Å; L355-V358 PolarHBondContact O-N 3.36Å; L355-Y359 HydrophobicContact CD1-CD2 4.5Å; L355-Y359 HydrophobicContact CD1-CE1 4.09Å; L355-Y359 HydrophobicContact CD1-CE2 3.99Å; L355-Y359 HydrophobicContact CD2-CE2 3.99Å; L355-Y359 HydrophobicContact CG-CD2 4.13Å; L355-Y359 HydrophobicContact CG-CE2 3.59Å; L355-Y359 WeakPolarHBondContact O-CD2 3.38Å; L355-Y359 PolarHBondContact O-N 2.97Å
356	E	88.4	Confident	84.9	Confident	142 Å²	142	82.2 Å²	82.2	66%	0.664	42%	0.42	S	S	*	.	H	α-helix	trans	-59.4	-42.4	174.3	-174.2	177.6	-152.2	0	0	112.4	A352 R354 Y359 E360	A352-E356 PolarHBondContact O-N 2.94Å; R354-E356 VanDerWaalsContact C-N 3.35Å; R354-E356 PolarHBondContact O-N 3.45Å; E356-Y359 PolarHBondContact O-N 3.44Å; E356-E360 PolarHBondContact O-N 2.73Å
357	K	89.6	Confident	84.2	Confident	123 Å²	123	74.6 Å²	74.6	54%	0.535	39%	0.389	S	S	.	.	H	α-helix	trans	-66.1	-39	175	-69.4	171.5	-175.4	170.9	0	112.1	Q353 R354 L355 E360 E361	Q353-K357 WeakPolarHBondContact O-CD 3.39Å; Q353-K357 WeakPolarHBondContact O-CG 3.43Å; R354-K357 PolarHBondContact O-N 3.15Å; L355-K357 VanDerWaalsContact C-N 3.34Å; L355-K357 PolarHBondContact O-N 2.86Å; K357-E360 PolarHBondContact O-N 2.78Å; K357-E361 WeakPolarHBondContact O-CG 3.41Å; K357-E361 PolarHBondContact O-N 3.47Å
358	V	88.9	Confident	83.8	Confident	0 Å²	0	76.8 Å²	76.8	0%	0	40%	0.401	C	S	.	.	H	α-helix	trans	-65.3	-41.3	175.8	169.2	0	0	0	0	110.8	L333 E336 E337 L340 R354 L355 E360 E361 L362	L333-V358 HydrophobicContact CB-CG1 4.44Å; L333-V358 HydrophobicContact CD2-CG1 4.23Å; L333-V358 HydrophobicContact CD2-CG2 4.16Å; L333-V358 WeakPolarHBondContact O-CG1 3.29Å; E336-V358 HydrophobicContact CG-CG2 4.15Å; E337-V358 HydrophobicContact CB-CG1 3.98Å; L340-V358 HydrophobicContact CD1-CG2 4.12Å; R354-V358 HydrophobicContact CG-CG2 4.4Å; R354-V358 WeakPolarHBondContact O-CG2 3.42Å; R354-V358 PolarHBondContact O-N 2.99Å; L355-V358 PolarHBondContact O-N 3.36Å; V358-E360 PolarHBondContact O-N 3.36Å; V358-E361 PolarHBondContact O-N 3.01Å; V358-L362 HydrophobicContact CG1-CD1 3.78Å; V358-L362 HydrophobicContact CG1-CG 4.34Å; V358-L362 WeakPolarHBondContact O-CB 3.38Å; V358-L362 VanDerWaalsContact O-CG 3.26Å; V358-L362 WeakPolarHBondContact O-CG 3.35Å; V358-L362 PolarHBondContact O-N 3.3Å
359	Y	87.4	Confident	83.9	Confident	106 Å²	106	76 Å²	76	42%	0.416	41%	0.41	S	S	.	.	H	α-helix	trans	-60.8	-41.7	172.1	-70.9	-40.4	0	0	0	112.3	E337 Q341 L355 E356 L362 R363	E337-Y359 HydrophobicContact CG-CD1 4.37Å; E337-Y359 HydrophobicContact CG-CE1 3.81Å; Q341-Y359 PolarHBondContact NE2-OH 2.86Å; L355-Y359 HydrophobicContact CD1-CD2 4.5Å; L355-Y359 HydrophobicContact CD1-CE1 4.09Å; L355-Y359 HydrophobicContact CD1-CE2 3.99Å; L355-Y359 HydrophobicContact CD2-CE2 3.99Å; L355-Y359 HydrophobicContact CG-CD2 4.13Å; L355-Y359 HydrophobicContact CG-CE2 3.59Å; L355-Y359 WeakPolarHBondContact O-CD2 3.38Å; L355-Y359 PolarHBondContact O-N 2.97Å; E356-Y359 PolarHBondContact O-N 3.44Å; Y359-L362 PolarHBondContact O-N 3.4Å; Y359-R363 VanDerWaalsContact O-CB 3.27Å; Y359-R363 WeakPolarHBondContact O-CB 3.45Å; Y359-R363 PolarHBondContact O-N 2.94Å
360	E	87.3	Confident	84.2	Confident	87 Å²	87	70.2 Å²	70.2	41%	0.407	38%	0.38	S	S	.	.	H	α-helix	trans	-68.4	-40.7	177.2	-169.6	60.2	-166.4	0	0	112	E356 K357 V358 L362 R363 V364	E356-E360 PolarHBondContact O-N 2.73Å; K357-E360 PolarHBondContact O-N 2.78Å; V358-E360 PolarHBondContact O-N 3.36Å; E360-L362 PolarHBondContact O-N 2.99Å; E360-R363 PolarHBondContact O-N 2.95Å; E360-R363 IonicContact OE1-CZ 3.61Å; E360-R363 IonicContact OE1-NE 3.99Å; E360-R363 PolarHBondContact OE1-NE 3.37Å; E360-R363 IonicContact OE1-NH2 3.79Å; E360-R363 PolarHBondContact OE1-NH2 3Å; E360-R363 IonicContact OE2-CZ 3.86Å; E360-R363 IonicContact OE2-NE 3.66Å; E360-R363 PolarHBondContact OE2-NE 3.49Å; E360-R363 IonicContact OE2-NH2 3.22Å; E360-R363 PolarHBondContact OE2-NH2 2.78Å; E360-V364 WeakPolarHBondContact O-CB 3.25Å; E360-V364 VanDerWaalsContact O-CG2 3.32Å; E360-V364 WeakPolarHBondContact O-CG2 3.22Å; E360-V364 PolarHBondContact O-N 2.98Å
361	E	84.9	Confident	84.6	Confident	51 Å²	51	69.2 Å²	69.2	24%	0.238	36%	0.364	C	S	.	.	H	α-helix	trans	-60.8	-43.8	172.1	-72.4	-169.3	-116	0	0	111.9	R329 L333 R354 K357 V358 R363 V364 I365	R329-E361 IonicContact CZ-OE2 2.79Å; R329-E361 IonicContact NE-OE2 3.27Å; R329-E361 IonicContact NH2-OE2 3.69Å; R329-E361 PolarHBondContact NH2-OE2 2.81Å; L333-E361 HydrophobicContact CD1-CB 3.84Å; L333-E361 HydrophobicContact CD2-CB 4.25Å; R354-E361 IonicContact NH1-OE1 2.74Å; R354-E361 PolarHBondContact NH1-OE1 2.84Å; R354-E361 VanDerWaalsContact NH1-OE1 3.12Å; R354-E361 IonicContact NH2-OE1 3.02Å; K357-E361 WeakPolarHBondContact O-CG 3.41Å; K357-E361 PolarHBondContact O-N 3.47Å; V358-E361 PolarHBondContact O-N 3.01Å; E361-R363 VanDerWaalsContact C-N 3.34Å; E361-R363 PolarHBondContact O-N 3.22Å; E361-V364 PolarHBondContact O-N 2.86Å; E361-I365 WeakPolarHBondContact O-CB 3.41Å; E361-I365 WeakPolarHBondContact O-CD1 3.19Å; E361-I365 VanDerWaalsContact O-CG1 3.27Å; E361-I365 WeakPolarHBondContact O-CG1 3.45Å; E361-I365 PolarHBondContact O-N 2.7Å
362	L	83.8	Confident	84.8	Confident	12 Å²	12	71.9 Å²	71.9	6%	0.063	39%	0.387	C	S	.	.	H	α-helix	trans	-66.3	-33.2	176.4	-74.2	168.4	0	0	0	112.8	L333 L334 E337 V358 Y359 E360 G366 A367	L333-L362 HydrophobicContact CB-CD2 3.65Å; L333-L362 HydrophobicContact CB-CG 3.98Å; L334-L362 HydrophobicContact CD2-CD1 4.03Å; L334-L362 HydrophobicContact CD2-CD2 3.74Å; L334-L362 HydrophobicContact CG-CD2 3.91Å; E337-L362 HydrophobicContact CB-CD1 4.17Å; E337-L362 HydrophobicContact CG-CD1 4.28Å; E337-L362 VanDerWaalsContact OE2-CD1 3.28Å; E337-L362 WeakPolarHBondContact OE2-CD1 3.4Å; V358-L362 HydrophobicContact CG1-CD1 3.78Å; V358-L362 HydrophobicContact CG1-CG 4.34Å; V358-L362 WeakPolarHBondContact O-CB 3.38Å; V358-L362 VanDerWaalsContact O-CG 3.26Å; V358-L362 WeakPolarHBondContact O-CG 3.35Å; V358-L362 PolarHBondContact O-N 3.3Å; Y359-L362 PolarHBondContact O-N 3.4Å; E360-L362 PolarHBondContact O-N 2.99Å; L362-G366 PolarHBondContact O-N 3.01Å; L362-A367 HydrophobicContact CB-CB 4.41Å; L362-A367 HydrophobicContact CD2-CB 4Å; L362-A367 PolarHBondContact O-N 2.9Å
363	R	84.2	Confident	85	Confident	176 Å²	176	72.8 Å²	72.8	66%	0.664	38%	0.383	S	S	*	.	H	α-helix	trans	-69.8	-42.9	174.3	-170.5	172.8	75.3	148.6	5.6	111.4	Y359 E360 E361 G366	Y359-R363 VanDerWaalsContact O-CB 3.27Å; Y359-R363 WeakPolarHBondContact O-CB 3.45Å; Y359-R363 PolarHBondContact O-N 2.94Å; E360-R363 PolarHBondContact O-N 2.95Å; E360-R363 IonicContact OE1-CZ 3.61Å; E360-R363 IonicContact OE1-NE 3.99Å; E360-R363 PolarHBondContact OE1-NE 3.37Å; E360-R363 IonicContact OE1-NH2 3.79Å; E360-R363 PolarHBondContact OE1-NH2 3Å; E360-R363 IonicContact OE2-CZ 3.86Å; E360-R363 IonicContact OE2-NE 3.66Å; E360-R363 PolarHBondContact OE2-NE 3.49Å; E360-R363 IonicContact OE2-NH2 3.22Å; E360-R363 PolarHBondContact OE2-NH2 2.78Å; E361-R363 VanDerWaalsContact C-N 3.34Å; E361-R363 PolarHBondContact O-N 3.22Å; R363-G366 PolarHBondContact O-N 3.37Å; R363-G366 VanDerWaalsContact O-N 3.08Å
364	V	82.8	Confident	85.2	Confident	117 Å²	117	66 Å²	66	71%	0.709	35%	0.351	S	S	*	.	H	α-helix	trans	-64.9	-37.2	174.3	168.7	0	0	0	0	112	E360 E361 G366	E360-V364 WeakPolarHBondContact O-CB 3.25Å; E360-V364 VanDerWaalsContact O-CG2 3.32Å; E360-V364 WeakPolarHBondContact O-CG2 3.22Å; E360-V364 PolarHBondContact O-N 2.98Å; E361-V364 PolarHBondContact O-N 2.86Å; V364-G366 PolarHBondContact O-N 2.84Å
365	I	77.9	Confident	85.5	Confident	48 Å²	48	65 Å²	65	25%	0.246	35%	0.347	C	S	.	.	H	α-helix	trans	-72.7	-17.7	172.9	-70	166	0	0	0	112	R329 R330 L333 E361	R329-I365 HydrophobicContact CG-CD1 4.17Å; R330-I365 HydrophobicContact CB-CG2 4.2Å; L333-I365 HydrophobicContact CD1-CD1 3.44Å; L333-I365 VanDerWaalsContact CD1-CD1 3.44Å; E361-I365 WeakPolarHBondContact O-CB 3.41Å; E361-I365 WeakPolarHBondContact O-CD1 3.19Å; E361-I365 VanDerWaalsContact O-CG1 3.27Å; E361-I365 WeakPolarHBondContact O-CG1 3.45Å; E361-I365 PolarHBondContact O-N 2.7Å
366	G	79.8	Confident	85.6	Confident	28 Å²	28	71 Å²	71	29%	0.289	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.6	34.8	-179.9	0	0	0	0	0	113.3	L362 R363 V364 A368 A369 A370	L362-G366 PolarHBondContact O-N 3.01Å; R363-G366 PolarHBondContact O-N 3.37Å; R363-G366 VanDerWaalsContact O-N 3.08Å; V364-G366 PolarHBondContact O-N 2.84Å; G366-A368 PolarHBondContact O-N 3.28Å; G366-A368 VanDerWaalsContact O-N 3.08Å; G366-A369 PolarHBondContact O-N 2.85Å; G366-A370 PolarHBondContact O-N 2.93Å
367	A	73.4	Confident	85.8	Confident	11 Å²	11	64.3 Å²	64.3	9%	0.091	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-37.8	-169.5	0	0	0	0	0	114.2	R330 L362 A370	R330-A367 HydrophobicContact CG-CB 4.38Å; R330-A367 PolarHBondContact NH1-O 3.41Å; R330-A367 PolarHBondContact NH2-O 2.98Å; L362-A367 HydrophobicContact CB-CB 4.41Å; L362-A367 HydrophobicContact CD2-CB 4Å; L362-A367 PolarHBondContact O-N 2.9Å; A367-A370 PolarHBondContact O-N 3.43Å
368	A	74.8	Confident	85.9	Confident	100 Å²	100	58.4 Å²	58.4	83%	0.826	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-43.8	176.3	0	0	0	0	0	113.3	G366 A370	G366-A368 PolarHBondContact O-N 3.28Å; G366-A368 VanDerWaalsContact O-N 3.08Å; A368-A370 VanDerWaalsContact C-N 3.29Å; A368-A370 PolarHBondContact O-N 3.33Å
369	A	85.6	Confident	86.1	Confident	70 Å²	70	60.1 Å²	60.1	58%	0.579	33%	0.327	S	S	*	.	H	α-helix	trans	-73.9	-22	179	0	0	0	0	0	113	G366 E371 A372 K373	G366-A369 PolarHBondContact O-N 2.85Å; A369-E371 PolarHBondContact O-N 3.47Å; A369-A372 WeakPolarHBondContact O-CB 3.35Å; A369-A372 PolarHBondContact O-N 3.03Å; A369-A372 VanDerWaalsContact O-N 3.14Å; A369-K373 PolarHBondContact O-N 2.83Å
370	A	85.3	Confident	86.1	Confident	9 Å²	9	55.1 Å²	55.1	7%	0.074	31%	0.308	C	S	.	.	H	α-helix	trans	-71.5	-18.8	-171.5	0	0	0	0	0	115	G366 A367 A368 A374 F410	G366-A370 PolarHBondContact O-N 2.93Å; A367-A370 PolarHBondContact O-N 3.43Å; A368-A370 VanDerWaalsContact C-N 3.29Å; A368-A370 PolarHBondContact O-N 3.33Å; A370-A374 WeakPolarHBondContact O-CB 3.28Å; A370-A374 PolarHBondContact O-N 3Å; A370-F410 HydrophobicContact CB-CE2 3.94Å; A370-F410 HydrophobicContact CB-CZ 4Å; A370-F410 WeakPolarHBondContact O-CE2 3.21Å
371	E	88.4	Confident	86.3	Confident	82 Å²	82	51 Å²	51	38%	0.383	29%	0.288	S	S	.	.	H	α-helix	trans	-68.6	-45.6	165.8	-179.4	170.8	169.2	0	0	111.2	V320 L324 A369 K373 A374 R375	V320-E371 HydrophobicContact CG2-CG 4.48Å; L324-E371 HydrophobicContact CD1-CB 4.25Å; L324-E371 HydrophobicContact CD1-CG 4.21Å; A369-E371 PolarHBondContact O-N 3.47Å; E371-K373 VanDerWaalsContact C-N 3.26Å; E371-K373 PolarHBondContact O-N 3.05Å; E371-A374 PolarHBondContact O-N 3.37Å; E371-A374 VanDerWaalsContact O-N 3.12Å; E371-R375 HydrophobicContact CG-CG 4.32Å; E371-R375 WeakPolarHBondContact O-CG 3.45Å; E371-R375 PolarHBondContact O-N 3.17Å; E371-R375 IonicContact OE1-CZ 3.91Å; E371-R375 IonicContact OE1-NE 2.72Å; E371-R375 PolarHBondContact OE1-NE 3.5Å; E371-R375 IonicContact OE1-NH2 2.72Å; E371-R375 PolarHBondContact OE1-NH2 2.81Å
372	A	89.9	Confident	86.5	Confident	67 Å²	67	49.7 Å²	49.7	55%	0.554	29%	0.285	S	S	*	.	H	α-helix	trans	-60.2	-38.4	175.6	0	0	0	0	0	111.4	A369 R375 R376	A369-A372 WeakPolarHBondContact O-CB 3.35Å; A369-A372 PolarHBondContact O-N 3.03Å; A369-A372 VanDerWaalsContact O-N 3.14Å; A372-R375 PolarHBondContact O-N 2.9Å; A372-R376 WeakPolarHBondContact O-CB 3.03Å; A372-R376 PolarHBondContact O-N 2.86Å
373	K	89.4	Confident	86.8	Confident	63 Å²	63	49.3 Å²	49.3	27%	0.274	28%	0.283	S	S	.	.	H	α-helix	trans	-59.4	-50	171.1	-170.4	-168.9	-179.8	-168.5	0	112	A369 E371 R375 R376 I377 F410 E412	A369-K373 PolarHBondContact O-N 2.83Å; E371-K373 VanDerWaalsContact C-N 3.26Å; E371-K373 PolarHBondContact O-N 3.05Å; K373-R375 VanDerWaalsContact C-N 3.34Å; K373-R375 PolarHBondContact O-N 3.02Å; K373-R376 PolarHBondContact O-N 2.87Å; K373-I377 HydrophobicContact CG-CD1 4.03Å; K373-I377 WeakPolarHBondContact O-CG1 3.5Å; K373-I377 PolarHBondContact O-N 3.07Å; K373-F410 HydrophobicContact CB-CE2 4.49Å; K373-F410 HydrophobicContact CD-CD2 3.99Å; K373-F410 HydrophobicContact CD-CE2 4.14Å; K373-F410 HydrophobicContact CG-CD2 4.35Å; K373-F410 PolarHBondContact NZ-O 3.36Å; K373-F410 VanDerWaalsContact NZ-O 3.15Å; K373-E412 WeakPolarHBondContact CE-OE1 3.41Å; K373-E412 IonicContact NZ-OE1 3.11Å; K373-E412 PolarHBondContact NZ-OE1 3.19Å
374	A	91.4	Very high	87	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-61.6	-40.6	179.2	0	0	0	0	0	112.1	V320 V323 L324 A370 E371 L378 F410	V320-A374 HydrophobicContact CG2-CB 4.37Å; V323-A374 HydrophobicContact CB-CB 4.4Å; V323-A374 HydrophobicContact CG1-CB 3.81Å; L324-A374 HydrophobicContact CD2-CB 4.03Å; L324-A374 HydrophobicContact CG-CB 4.1Å; A370-A374 WeakPolarHBondContact O-CB 3.28Å; A370-A374 PolarHBondContact O-N 3Å; E371-A374 PolarHBondContact O-N 3.37Å; E371-A374 VanDerWaalsContact O-N 3.12Å; A374-L378 WeakPolarHBondContact O-CB 3.48Å; A374-L378 WeakPolarHBondContact O-CG 3.49Å; A374-L378 PolarHBondContact O-N 3.24Å; A374-F410 HydrophobicContact CB-CD2 4.16Å; A374-F410 HydrophobicContact CB-CE2 4.19Å
375	R	92.4	Very high	87.3	Confident	64 Å²	64	43 Å²	43	24%	0.242	27%	0.266	C	S	.	.	H	α-helix	trans	-67.5	-38.6	175.7	-68.4	-171.9	-179.2	-80.6	0.1	112.9	V320 E371 A372 K373 L378 A379 Q388 N389	V320-R375 HydrophobicContact CG2-CG 3.78Å; E371-R375 HydrophobicContact CG-CG 4.32Å; E371-R375 WeakPolarHBondContact O-CG 3.45Å; E371-R375 PolarHBondContact O-N 3.17Å; E371-R375 IonicContact OE1-CZ 3.91Å; E371-R375 IonicContact OE1-NE 2.72Å; E371-R375 PolarHBondContact OE1-NE 3.5Å; E371-R375 IonicContact OE1-NH2 2.72Å; E371-R375 PolarHBondContact OE1-NH2 2.81Å; A372-R375 PolarHBondContact O-N 2.9Å; K373-R375 VanDerWaalsContact C-N 3.34Å; K373-R375 PolarHBondContact O-N 3.02Å; R375-L378 PolarHBondContact O-N 3Å; R375-A379 WeakPolarHBondContact O-CB 3.4Å; R375-A379 PolarHBondContact O-N 3.48Å; R375-Q388 VanDerWaalsContact NH1-OE1 3.12Å; R375-N389 PolarHBondContact NH1-OD1 2.82Å; R375-N389 PolarHBondContact NH2-OD1 3.33Å
376	R	92.1	Very high	87.8	Confident	135 Å²	135	47.8 Å²	47.8	51%	0.509	29%	0.287	S	S	.	.	H	α-helix	trans	-62.1	-48	173.4	178.7	176.6	171.9	-174.5	-1.8	111.9	A372 K373 L378 A379 G380 E781	A372-R376 WeakPolarHBondContact O-CB 3.03Å; A372-R376 PolarHBondContact O-N 2.86Å; K373-R376 PolarHBondContact O-N 2.87Å; R376-L378 VanDerWaalsContact C-N 3.32Å; R376-L378 PolarHBondContact O-N 3.39Å; R376-A379 PolarHBondContact O-N 3.33Å; R376-G380 PolarHBondContact O-N 3.02Å; R376-E781 IonicContact CZ-OE1 3.97Å; R376-E781 IonicContact CZ-OE2 2.78Å; R376-E781 IonicContact NE-OE1 3.86Å; R376-E781 PolarHBondContact NE-OE1 3.11Å; R376-E781 IonicContact NE-OE2 3.57Å; R376-E781 VanDerWaalsContact NH2-CD 3.34Å; R376-E781 IonicContact NH2-OE1 2.63Å; R376-E781 PolarHBondContact NH2-OE1 2.91Å; R376-E781 IonicContact NH2-OE2 3.18Å; R376-E781 PolarHBondContact NH2-OE2 2.99Å
377	I	92.6	Very high	88.3	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.005	28%	0.279	C	S	.	.	H	α-helix	trans	-61	-42	177.5	-66.3	168.2	0	0	0	110.9	K373 L381 A406 L409 F410 W432 Y436	K373-I377 HydrophobicContact CG-CD1 4.03Å; K373-I377 WeakPolarHBondContact O-CG1 3.5Å; K373-I377 PolarHBondContact O-N 3.07Å; I377-L381 HydrophobicContact CG2-CD1 4.2Å; I377-L381 WeakPolarHBondContact O-CG 3.29Å; I377-L381 PolarHBondContact O-N 3.35Å; I377-A406 HydrophobicContact CG2-CB 3.84Å; I377-L409 HydrophobicContact CD1-CB 4.45Å; I377-L409 HydrophobicContact CG2-CB 4.2Å; I377-L409 HydrophobicContact CG2-CD1 4.25Å; I377-F410 HydrophobicContact CD1-CB 4.06Å; I377-F410 HydrophobicContact CD1-CD2 4.43Å; I377-W432 HydrophobicContact CB-CH2 4.17Å; I377-W432 HydrophobicContact CG1-CH2 4.12Å; I377-W432 HydrophobicContact CG1-CZ2 4.48Å; I377-W432 HydrophobicContact CG2-CH2 4.04Å; I377-Y436 HydrophobicContact CG1-CE2 4.36Å
378	L	92.4	Very high	89.2	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-67.7	-42.9	176.1	-74.7	169.6	0	0	0	112.2	V320 V323 A374 R375 R376 G380 L381 F383 Q388 A406	V320-L378 HydrophobicContact CB-CD1 4.06Å; V320-L378 HydrophobicContact CG2-CD1 4.43Å; V323-L378 HydrophobicContact CG2-CD1 4.11Å; V323-L378 HydrophobicContact CG2-CD2 4.11Å; V323-L378 HydrophobicContact CG2-CG 4.22Å; A374-L378 WeakPolarHBondContact O-CB 3.48Å; A374-L378 WeakPolarHBondContact O-CG 3.49Å; A374-L378 PolarHBondContact O-N 3.24Å; R375-L378 PolarHBondContact O-N 3Å; R376-L378 VanDerWaalsContact C-N 3.32Å; R376-L378 PolarHBondContact O-N 3.39Å; L378-G380 VanDerWaalsContact C-N 3.35Å; L378-G380 PolarHBondContact O-N 3.4Å; L378-L381 CarbonylContact O-C 3.54Å; L378-L381 PolarHBondContact O-N 3.5Å; L378-L381 VanDerWaalsContact O-N 3.12Å; L378-F383 HydrophobicContact CB-CB 4.05Å; L378-F383 HydrophobicContact CB-CD2 4.3Å; L378-F383 HydrophobicContact CB-CG 4.28Å; L378-F383 HydrophobicContact CD2-CD1 4.25Å; L378-F383 HydrophobicContact CD2-CD2 3.76Å; L378-F383 HydrophobicContact CD2-CE1 4.29Å; L378-F383 HydrophobicContact CD2-CE2 3.78Å; L378-F383 HydrophobicContact CD2-CG 4Å; L378-F383 HydrophobicContact CD2-CZ 4.06Å; L378-F383 VanDerWaalsContact O-CB 3.31Å; L378-F383 WeakPolarHBondContact O-CB 3.41Å; L378-F383 VanDerWaalsContact O-CD2 3.29Å; L378-F383 WeakPolarHBondContact O-CD2 3.45Å; L378-F383 PolarHBondContact O-N 3.21Å; L378-Q388 HydrophobicContact CB-CG 3.98Å; L378-Q388 HydrophobicContact CD1-CG 4.3Å; L378-A406 HydrophobicContact CD2-CB 3.66Å; L378-A406 HydrophobicContact CG-CB 4.24Å
379	A	91.7	Very high	90	Very high	35 Å²	35	47.2 Å²	47.2	29%	0.289	26%	0.261	S	S	.	.	H	α-helix	trans	-59	-44.8	176.5	0	0	0	0	0	112	R375 R376 L381 S382	R375-A379 WeakPolarHBondContact O-CB 3.4Å; R375-A379 PolarHBondContact O-N 3.48Å; R376-A379 PolarHBondContact O-N 3.33Å; A379-L381 PolarHBondContact O-N 2.9Å; A379-S382 WeakPolarHBondContact O-CA 3.38Å; A379-S382 PolarHBondContact O-N 3Å
380	G	89	Confident	90.3	Very high	2 Å²	2	48.4 Å²	48.4	2%	0.021	25%	0.251	C	S	.	.	H	α-helix	trans	-65.4	-21.6	175.5	0	0	0	0	0	114.9	R376 L378 S382 W432	R376-G380 PolarHBondContact O-N 3.02Å; L378-G380 VanDerWaalsContact C-N 3.35Å; L378-G380 PolarHBondContact O-N 3.4Å; G380-S382 VanDerWaalsContact C-N 3.27Å; G380-S382 PolarHBondContact O-N 2.93Å; G380-W432 VanDerWaalsContact CA-CD2 3.47Å; G380-W432 VanDerWaalsContact CA-CG 3.48Å; G380-W432 WeakPolarHBondContact O-CB 3.29Å
381	L	90.7	Very high	90.6	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93	24.9	171.1	-65	171.4	0	0	0	112.9	I377 L378 A379 F383 R402 L405 A406 L409 L425 A429 W432	I377-L381 HydrophobicContact CG2-CD1 4.2Å; I377-L381 WeakPolarHBondContact O-CG 3.29Å; I377-L381 PolarHBondContact O-N 3.35Å; L378-L381 CarbonylContact O-C 3.54Å; L378-L381 PolarHBondContact O-N 3.5Å; L378-L381 VanDerWaalsContact O-N 3.12Å; A379-L381 PolarHBondContact O-N 2.9Å; L381-F383 HydrophobicContact CB-CD2 4.14Å; L381-F383 HydrophobicContact CB-CE2 4.19Å; L381-F383 WeakPolarHBondContact O-CD2 3.33Å; L381-R402 PolarHBondContact O-NH1 2.64Å; L381-L405 HydrophobicContact CD1-CD2 4.39Å; L381-L405 HydrophobicContact CD1-CG 4.36Å; L381-L405 HydrophobicContact CD2-CD2 3.96Å; L381-A406 HydrophobicContact CD1-CB 3.82Å; L381-L409 HydrophobicContact CD1-CD1 4.4Å; L381-L425 HydrophobicContact CD2-CD1 4.44Å; L381-L425 HydrophobicContact CD2-CD2 4.09Å; L381-A429 HydrophobicContact CD2-CB 4.36Å; L381-W432 HydrophobicContact CD2-CE3 4.13Å; L381-W432 HydrophobicContact CD2-CZ3 4.15Å; L381-W432 HydrophobicContact CG-CE3 4.21Å; L381-W432 HydrophobicContact CG-CZ3 4Å
382	S	88.1	Confident	90.6	Very high	24 Å²	24	44.9 Å²	44.9	17%	0.168	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.1	20.7	179.6	-49.4	0	0	0	0	116.5	A379 G380 T384 W399 D426	A379-S382 WeakPolarHBondContact O-CA 3.38Å; A379-S382 PolarHBondContact O-N 3Å; G380-S382 VanDerWaalsContact C-N 3.27Å; G380-S382 PolarHBondContact O-N 2.93Å; S382-T384 PolarHBondContact O-N 3.5Å; S382-W399 WeakPolarHBondContact O-CH2 3.23Å; S382-D426 WeakPolarHBondContact CB-OD2 3.38Å; S382-D426 VanDerWaalsContact OG-CG 3.31Å; S382-D426 PolarHBondContact OG-OD1 2.89Å; S382-D426 PolarHBondContact OG-OD2 2.68Å
383	F	90.1	Very high	90.6	Very high	4 Å²	4	46.6 Å²	46.6	2%	0.018	23%	0.231	C	C	.	.			trans	-85.7	110.9	174.1	-67.3	-109	0	0	0	112.1	A319 L378 L381 M387 Q388 F395 W399 R402 V403	A319-F383 HydrophobicContact CB-CE1 4.32Å; L378-F383 HydrophobicContact CB-CB 4.05Å; L378-F383 HydrophobicContact CB-CD2 4.3Å; L378-F383 HydrophobicContact CB-CG 4.28Å; L378-F383 HydrophobicContact CD2-CD1 4.25Å; L378-F383 HydrophobicContact CD2-CD2 3.76Å; L378-F383 HydrophobicContact CD2-CE1 4.29Å; L378-F383 HydrophobicContact CD2-CE2 3.78Å; L378-F383 HydrophobicContact CD2-CG 4Å; L378-F383 HydrophobicContact CD2-CZ 4.06Å; L378-F383 VanDerWaalsContact O-CB 3.31Å; L378-F383 WeakPolarHBondContact O-CB 3.41Å; L378-F383 VanDerWaalsContact O-CD2 3.29Å; L378-F383 WeakPolarHBondContact O-CD2 3.45Å; L378-F383 PolarHBondContact O-N 3.21Å; L381-F383 HydrophobicContact CB-CD2 4.14Å; L381-F383 HydrophobicContact CB-CE2 4.19Å; L381-F383 WeakPolarHBondContact O-CD2 3.33Å; F383-M387 HydrophobicContact CB-CB 4.29Å; F383-M387 HydrophobicContact CD1-CB 4.09Å; F383-Q388 HydrophobicContact CB-CG 3.99Å; F383-Q388 PolarHBondContact O-NE2 2.8Å; F383-F395 HydrophobicContact CD1-CE1 4.15Å; F383-F395 HydrophobicContact CD1-CZ 4.05Å; F383-F395 AromaticContact CE1-CE1 3.86Å; F383-F395 HydrophobicContact CE1-CE1 3.86Å; F383-F395 AromaticContact CE1-CZ 3.87Å; F383-F395 HydrophobicContact CE1-CZ 3.87Å; F383-W399 HydrophobicContact CD1-CE3 4.23Å; F383-W399 HydrophobicContact CD1-CZ3 4.3Å; F383-W399 HydrophobicContact CD2-CE3 4.22Å; F383-W399 AromaticContact CD2-CZ3 3.86Å; F383-W399 HydrophobicContact CD2-CZ3 3.86Å; F383-W399 AromaticContact CE1-CE3 3.83Å; F383-W399 HydrophobicContact CE1-CE3 3.83Å; F383-W399 HydrophobicContact CE1-CZ3 4.31Å; F383-W399 AromaticContact CE2-CE3 3.84Å; F383-W399 HydrophobicContact CE2-CE3 3.84Å; F383-W399 AromaticContact CE2-CZ3 3.9Å; F383-W399 HydrophobicContact CE2-CZ3 3.9Å; F383-W399 HydrophobicContact CG-CE3 4.41Å; F383-W399 HydrophobicContact CG-CZ3 4.08Å; F383-W399 AromaticContact CZ-CE3 3.62Å; F383-W399 HydrophobicContact CZ-CE3 3.62Å; F383-W399 HydrophobicContact CZ-CZ3 4.12Å; F383-R402 HydrophobicContact CE2-CB 3.67Å; F383-R402 HydrophobicContact CZ-CB 3.89Å; F383-V403 HydrophobicContact CE1-CG2 3.73Å; F383-V403 HydrophobicContact CZ-CG2 3.52Å
384	T	88.6	Confident	90.4	Very high	67 Å²	67	52.8 Å²	52.8	41%	0.411	25%	0.252	S	S	.	.			trans	-59.4	159.6	169.1	72.2	0	0	0	0	111.9	S382 E386 M387 Q388	S382-T384 PolarHBondContact O-N 3.5Å; T384-E386 PolarHBondContact O-N 3.04Å; T384-M387 HydrophobicContact CG2-SD 4.04Å; T384-M387 WeakPolarHBondContact O-CA 3.42Å; T384-M387 WeakPolarHBondContact O-CB 3.44Å; T384-M387 PolarHBondContact O-N 2.61Å; T384-M387 WeakPolarHBondContact OG1-CG 3.43Å; T384-M387 PolarHBondContact OG1-N 3.36Å; T384-M387 PolarHBondContact OG1-SD 2.71Å; T384-Q388 WeakPolarHBondContact O-CG 3.31Å; T384-Q388 PolarHBondContact O-N 2.8Å
385	P	89.3	Confident	90.2	Very high	94 Å²	94	53.5 Å²	53.5	61%	0.61	26%	0.255	S	S	*	.	H	α-helix	trans	-55.3	-34.9	178.3	-28	36.5	0	0	0	114.2	N389	P385-N389 PolarHBondContact O-N 2.71Å; P385-N389 PolarHBondContact O-ND2 2.93Å
386	E	89.5	Confident	89.7	Confident	147 Å²	147	54.1 Å²	54.1	69%	0.687	27%	0.269	S	S	*	.	H	α-helix	trans	-64.2	-40.5	172.6	-63.9	-174.9	-176.4	0	0	112.5	T384 N389 R390	T384-E386 PolarHBondContact O-N 3.04Å; E386-N389 PolarHBondContact O-N 3.25Å; E386-R390 PolarHBondContact O-N 2.84Å
387	M	89	Confident	89.1	Confident	26 Å²	26	48.6 Å²	48.6	13%	0.128	25%	0.254	C	S	.	.	H	α-helix	trans	-72.4	-37.2	-179.8	-69.7	165.9	68.8	0	0	111.2	F383 T384 N389 R390 F395 W399	F383-M387 HydrophobicContact CB-CB 4.29Å; F383-M387 HydrophobicContact CD1-CB 4.09Å; T384-M387 HydrophobicContact CG2-SD 4.04Å; T384-M387 WeakPolarHBondContact O-CA 3.42Å; T384-M387 WeakPolarHBondContact O-CB 3.44Å; T384-M387 PolarHBondContact O-N 2.61Å; T384-M387 WeakPolarHBondContact OG1-CG 3.43Å; T384-M387 PolarHBondContact OG1-N 3.36Å; T384-M387 PolarHBondContact OG1-SD 2.71Å; M387-N389 PolarHBondContact O-N 2.96Å; M387-R390 WeakPolarHBondContact O-CB 3.47Å; M387-R390 PolarHBondContact O-N 3.49Å; M387-F395 HydrophobicContact CB-CE1 4.18Å; M387-F395 HydrophobicContact CB-CZ 3.98Å; M387-F395 HydrophobicContact CE-CE1 3.91Å; M387-F395 HydrophobicContact CG-CE1 4.36Å; M387-F395 HydrophobicContact CG-CZ 4.5Å; M387-F395 WeakPolarHBondContact O-CZ 3.39Å; M387-W399 HydrophobicContact CE-CD2 4.02Å; M387-W399 HydrophobicContact CE-CE3 3.9Å; M387-W399 HydrophobicContact CE-CH2 3.46Å; M387-W399 VanDerWaalsContact CE-CH2 3.46Å; M387-W399 HydrophobicContact CE-CZ2 3.56Å; M387-W399 HydrophobicContact CE-CZ3 3.63Å
388	Q	92	Very high	88.5	Confident	12 Å²	12	49.9 Å²	49.9	6%	0.056	27%	0.268	C	S	.	.	H	α-helix	trans	-56.3	-36	173.5	-66.7	171.8	23.2	0	0	112.5	A319 V320 R375 L378 F383 T384	A319-Q388 PolarHBondContact N-O 2.84Å; V320-Q388 HydrophobicContact CB-CB 4.49Å; V320-Q388 WeakPolarHBondContact CB-O 3.45Å; V320-Q388 WeakPolarHBondContact CG1-O 3.41Å; V320-Q388 PolarHBondContact N-O 2.9Å; R375-Q388 VanDerWaalsContact NH1-OE1 3.12Å; L378-Q388 HydrophobicContact CB-CG 3.98Å; L378-Q388 HydrophobicContact CD1-CG 4.3Å; F383-Q388 HydrophobicContact CB-CG 3.99Å; F383-Q388 PolarHBondContact O-NE2 2.8Å; T384-Q388 WeakPolarHBondContact O-CG 3.31Å; T384-Q388 PolarHBondContact O-N 2.8Å
389	N	92.5	Very high	88.3	Confident	90 Å²	90	51.6 Å²	51.6	48%	0.481	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-1.6	179.8	-61	-21	0	0	0	113.3	R375 P385 E386 M387	R375-N389 PolarHBondContact NH1-OD1 2.82Å; R375-N389 PolarHBondContact NH2-OD1 3.33Å; P385-N389 PolarHBondContact O-N 2.71Å; P385-N389 PolarHBondContact O-ND2 2.93Å; E386-N389 PolarHBondContact O-N 3.25Å; M387-N389 PolarHBondContact O-N 2.96Å
390	R	91.2	Very high	88.1	Confident	95 Å²	95	53.2 Å²	53.2	36%	0.358	27%	0.274	S	S	.	.	S	Bend	trans	-81.8	141.4	-179.7	-171.5	179.3	-63.6	-173.5	1.8	111.1	P318 A319 E386 M387 R394 F395	P318-R390 CarbonylContact C-O 3.51Å; P318-R390 WeakPolarHBondContact CA-O 3.12Å; A319-R390 PolarHBondContact N-O 3.13Å; E386-R390 PolarHBondContact O-N 2.84Å; M387-R390 WeakPolarHBondContact O-CB 3.47Å; M387-R390 PolarHBondContact O-N 3.49Å; R390-R394 HydrophobicContact CG-CB 4.11Å; R390-F395 HydrophobicContact CB-CE2 3.83Å; R390-F395 HydrophobicContact CB-CZ 3.93Å; R390-F395 HydrophobicContact CG-CE2 3.99Å; R390-F395 HydrophobicContact CG-CZ 4.24Å
391	A	91.7	Very high	88	Confident	16 Å²	16	55 Å²	55	13%	0.132	28%	0.282	C	S	.	.	B	Isolated β-bridge	trans	-62.6	139.4	177	0	0	0	0	0	112.9	K393 R394 F395	A391-K393 HydrophobicContact CB-CG 4.5Å; A391-K393 PolarHBondContact O-N 3.1Å; A391-R394 PolarHBondContact O-N 2.81Å; A391-F395 WeakPolarHBondContact O-CD2 3.32Å
392	T	88.4	Confident	87.9	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.006	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-56.6	-33.1	-178.5	42.5	0	0	0	0	113.5	V312 I313 D315 T317 A322 R394 F395	V312-T392 HydrophobicContact CG1-CG2 4.07Å; I313-T392 PolarHBondContact O-OG1 2.85Å; D315-T392 PolarHBondContact N-OG1 2.87Å; D315-T392 VanDerWaalsContact N-OG1 3.17Å; D315-T392 PolarHBondContact O-N 2.98Å; D315-T392 PolarHBondContact O-OG1 3.04Å; T317-T392 PolarHBondContact O-N 2.81Å; T317-T392 PolarHBondContact O-OG1 3.48Å; A322-T392 HydrophobicContact CB-CG2 4.03Å; T392-R394 PolarHBondContact O-N 1.99Å; T392-F395 PolarHBondContact O-N 2.96Å
393	K	89.5	Confident	88.1	Confident	103 Å²	103	54.1 Å²	54.1	45%	0.448	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-65.3	-13.3	175.3	81.5	-173.7	-167.8	-172.3	0	116.2	A314 D315 D316 A391	A314-K393 HydrophobicContact CB-CB 4.23Å; A314-K393 VanDerWaalsContact O-CB 3.27Å; A314-K393 WeakPolarHBondContact O-CB 3.45Å; D315-K393 WeakPolarHBondContact O-CB 3.48Å; D315-K393 PolarHBondContact O-N 3.42Å; D316-K393 WeakPolarHBondContact OD1-CE 3.32Å; D316-K393 IonicContact OD1-NZ 2.83Å; D316-K393 PolarHBondContact OD1-NZ 2.63Å; D316-K393 IonicContact OD2-NZ 2.69Å; D316-K393 PolarHBondContact OD2-NZ 2.96Å; A391-K393 HydrophobicContact CB-CG 4.5Å; A391-K393 PolarHBondContact O-N 3.1Å
394	R	87	Confident	88.1	Confident	193 Å²	193	54.7 Å²	54.7	73%	0.728	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-97.4	12.9	177.4	-66.1	-169.7	178.8	-166.1	0.9	113.6	R390 A391 T392	R390-R394 HydrophobicContact CG-CB 4.11Å; A391-R394 PolarHBondContact O-N 2.81Å; T392-R394 PolarHBondContact O-N 1.99Å
395	F	86	Confident	88.2	Confident	14 Å²	14	51.9 Å²	51.9	6%	0.061	26%	0.262	C	S	.	.	S	Bend	trans	-110.1	146.4	177.4	-74.7	-78.8	0	0	0	111.5	A319 F383 M387 R390 A391 T392 W399 R400	A319-F395 HydrophobicContact CB-CE2 4.22Å; F383-F395 HydrophobicContact CD1-CE1 4.15Å; F383-F395 HydrophobicContact CD1-CZ 4.05Å; F383-F395 AromaticContact CE1-CE1 3.86Å; F383-F395 HydrophobicContact CE1-CE1 3.86Å; F383-F395 AromaticContact CE1-CZ 3.87Å; F383-F395 HydrophobicContact CE1-CZ 3.87Å; M387-F395 HydrophobicContact CB-CE1 4.18Å; M387-F395 HydrophobicContact CB-CZ 3.98Å; M387-F395 HydrophobicContact CE-CE1 3.91Å; M387-F395 HydrophobicContact CG-CE1 4.36Å; M387-F395 HydrophobicContact CG-CZ 4.5Å; M387-F395 WeakPolarHBondContact O-CZ 3.39Å; R390-F395 HydrophobicContact CB-CE2 3.83Å; R390-F395 HydrophobicContact CB-CZ 3.93Å; R390-F395 HydrophobicContact CG-CE2 3.99Å; R390-F395 HydrophobicContact CG-CZ 4.24Å; A391-F395 WeakPolarHBondContact O-CD2 3.32Å; T392-F395 PolarHBondContact O-N 2.96Å; F395-W399 HydrophobicContact CB-CB 3.75Å; F395-W399 HydrophobicContact CD1-CB 3.48Å; F395-W399 VanDerWaalsContact CD1-CB 3.48Å; F395-W399 HydrophobicContact CD1-CD2 4.27Å; F395-W399 AromaticContact CD1-CG 3.78Å; F395-W399 HydrophobicContact CD1-CG 3.78Å; F395-W399 HydrophobicContact CE1-CB 4.4Å; F395-W399 HydrophobicContact CE1-CD2 4.49Å; F395-W399 HydrophobicContact CE1-CG 4.45Å; F395-W399 HydrophobicContact CG-CB 3.98Å; F395-R400 HydrophobicContact CB-CG 4.01Å
396	S	82.4	Confident	88.3	Confident	77 Å²	77	47.4 Å²	47.4	54%	0.538	23%	0.233	S	C	.	.			trans	-72.1	165.8	169.2	68.3	0	0	0	0	111.1	G398 W399 R400	S396-G398 PolarHBondContact O-N 3.19Å; S396-W399 WeakPolarHBondContact O-CA 3.33Å; S396-W399 WeakPolarHBondContact O-CB 3.34Å; S396-W399 PolarHBondContact O-N 2.75Å; S396-R400 PolarHBondContact O-N 3.34Å
397	G	79.6	Confident	88.4	Confident	19 Å²	19	45.2 Å²	45.2	20%	0.196	22%	0.218	C	C	.	.	H	α-helix	trans	-53.6	-48.1	-174.2	0	0	0	0	0	114.4	E311 W399 R400 M401	E311-G397 VanDerWaalsContact OE1-C 3.26Å; E311-G397 WeakPolarHBondContact OE1-CA 3.49Å; E311-G397 WeakPolarHBondContact OE2-CA 3.17Å; G397-W399 VanDerWaalsContact C-N 3.29Å; G397-W399 PolarHBondContact O-N 3.26Å; G397-R400 CarbonylContact O-C 3.57Å; G397-R400 WeakPolarHBondContact O-CA 3.25Å; G397-R400 WeakPolarHBondContact O-CB 3.2Å; G397-R400 PolarHBondContact O-N 3.22Å; G397-M401 PolarHBondContact O-N 2.86Å
398	G	80.4	Confident	88.4	Confident	29 Å²	29	44 Å²	44	30%	0.299	21%	0.213	S	C	.	.	H	α-helix	trans	-57.5	-36.5	174.9	0	0	0	0	0	114	S396 M401 R402	S396-G398 PolarHBondContact O-N 3.19Å; G398-M401 PolarHBondContact O-N 2.87Å; G398-R402 WeakPolarHBondContact O-CG 3.29Å; G398-R402 PolarHBondContact O-N 3.06Å; G398-R402 VanDerWaalsContact O-N 3.09Å
399	W	86.8	Confident	88.4	Confident	35 Å²	35	43.5 Å²	43.5	13%	0.133	21%	0.21	C	C	.	.	H	α-helix	trans	-71.4	-37.8	172.8	-78	109.2	0	0	0	112.3	S382 F383 M387 F395 S396 G397 M401 R402 V403 N604	S382-W399 WeakPolarHBondContact O-CH2 3.23Å; F383-W399 HydrophobicContact CD1-CE3 4.23Å; F383-W399 HydrophobicContact CD1-CZ3 4.3Å; F383-W399 HydrophobicContact CD2-CE3 4.22Å; F383-W399 AromaticContact CD2-CZ3 3.86Å; F383-W399 HydrophobicContact CD2-CZ3 3.86Å; F383-W399 AromaticContact CE1-CE3 3.83Å; F383-W399 HydrophobicContact CE1-CE3 3.83Å; F383-W399 HydrophobicContact CE1-CZ3 4.31Å; F383-W399 AromaticContact CE2-CE3 3.84Å; F383-W399 HydrophobicContact CE2-CE3 3.84Å; F383-W399 AromaticContact CE2-CZ3 3.9Å; F383-W399 HydrophobicContact CE2-CZ3 3.9Å; F383-W399 HydrophobicContact CG-CE3 4.41Å; F383-W399 HydrophobicContact CG-CZ3 4.08Å; F383-W399 AromaticContact CZ-CE3 3.62Å; F383-W399 HydrophobicContact CZ-CE3 3.62Å; F383-W399 HydrophobicContact CZ-CZ3 4.12Å; M387-W399 HydrophobicContact CE-CD2 4.02Å; M387-W399 HydrophobicContact CE-CE3 3.9Å; M387-W399 HydrophobicContact CE-CH2 3.46Å; M387-W399 VanDerWaalsContact CE-CH2 3.46Å; M387-W399 HydrophobicContact CE-CZ2 3.56Å; M387-W399 HydrophobicContact CE-CZ3 3.63Å; F395-W399 HydrophobicContact CB-CB 3.75Å; F395-W399 HydrophobicContact CD1-CB 3.48Å; F395-W399 VanDerWaalsContact CD1-CB 3.48Å; F395-W399 HydrophobicContact CD1-CD2 4.27Å; F395-W399 AromaticContact CD1-CG 3.78Å; F395-W399 HydrophobicContact CD1-CG 3.78Å; F395-W399 HydrophobicContact CE1-CB 4.4Å; F395-W399 HydrophobicContact CE1-CD2 4.49Å; F395-W399 HydrophobicContact CE1-CG 4.45Å; F395-W399 HydrophobicContact CG-CB 3.98Å; S396-W399 WeakPolarHBondContact O-CA 3.33Å; S396-W399 WeakPolarHBondContact O-CB 3.34Å; S396-W399 PolarHBondContact O-N 2.75Å; G397-W399 VanDerWaalsContact C-N 3.29Å; G397-W399 PolarHBondContact O-N 3.26Å; W399-M401 VanDerWaalsContact C-N 3.31Å; W399-M401 PolarHBondContact O-N 3.47Å; W399-R402 WeakPolarHBondContact O-CB 3.42Å; W399-R402 PolarHBondContact O-N 3.3Å; W399-V403 WeakPolarHBondContact O-CG2 3.34Å; W399-V403 PolarHBondContact O-N 2.96Å; W399-N604 HydrophobicContact CZ2-CB 4.35Å
400	R	87.9	Confident	88.3	Confident	70 Å²	70	39.8 Å²	39.8	26%	0.264	19%	0.19	S	C	.	.	H	α-helix	trans	-64.9	-34	173	-61.8	-172.5	-57.4	-148.8	3.5	112.1	E311 V312 F395 S396 G397 V403 S404	E311-R400 HydrophobicContact CB-CB 3.97Å; E311-R400 HydrophobicContact CG-CB 4.38Å; E311-R400 IonicContact OE2-CZ 2.66Å; E311-R400 IonicContact OE2-NE 3.54Å; E311-R400 PolarHBondContact OE2-NE 3.08Å; E311-R400 IonicContact OE2-NH2 3.45Å; E311-R400 PolarHBondContact OE2-NH2 2.91Å; V312-R400 PolarHBondContact N-O 3.15Å; F395-R400 HydrophobicContact CB-CG 4.01Å; S396-R400 PolarHBondContact O-N 3.34Å; G397-R400 CarbonylContact O-C 3.57Å; G397-R400 WeakPolarHBondContact O-CA 3.25Å; G397-R400 WeakPolarHBondContact O-CB 3.2Å; G397-R400 PolarHBondContact O-N 3.22Å; R400-V403 PolarHBondContact O-N 3.49Å; R400-S404 PolarHBondContact O-N 3.01Å; R400-S404 VanDerWaalsContact O-N 3.13Å
401	M	87	Confident	88.1	Confident	40 Å²	40	38 Å²	38	20%	0.197	19%	0.186	C	C	.	.	H	α-helix	trans	-63.5	-42.3	171.1	-171.6	59.3	76	0	0	111.3	E309 E311 G397 G398 W399 V403 S404 L405	E309-M401 WeakPolarHBondContact O-CE 3.39Å; E311-M401 HydrophobicContact CG-CB 4.28Å; E311-M401 HydrophobicContact CG-CE 3.88Å; G397-M401 PolarHBondContact O-N 2.86Å; G398-M401 PolarHBondContact O-N 2.87Å; W399-M401 VanDerWaalsContact C-N 3.31Å; W399-M401 PolarHBondContact O-N 3.47Å; M401-V403 PolarHBondContact O-N 3.27Å; M401-S404 CarbonylContact O-C 3.54Å; M401-S404 WeakPolarHBondContact O-CA 3.32Å; M401-S404 WeakPolarHBondContact O-CB 3.46Å; M401-S404 PolarHBondContact O-N 3.13Å; M401-L405 PolarHBondContact O-N 3.35Å
402	R	89.9	Confident	88	Confident	4 Å²	4	40.3 Å²	40.3	2%	0.015	19%	0.194	C	C	.	.	H	α-helix	trans	-63.6	-35.4	174	-66.1	169.7	-178.7	-135.6	1.7	113.6	L381 F383 G398 W399 S404 L405 A406 H424 L425 D426 N604	L381-R402 PolarHBondContact O-NH1 2.64Å; F383-R402 HydrophobicContact CE2-CB 3.67Å; F383-R402 HydrophobicContact CZ-CB 3.89Å; G398-R402 WeakPolarHBondContact O-CG 3.29Å; G398-R402 PolarHBondContact O-N 3.06Å; G398-R402 VanDerWaalsContact O-N 3.09Å; W399-R402 WeakPolarHBondContact O-CB 3.42Å; W399-R402 PolarHBondContact O-N 3.3Å; R402-S404 PolarHBondContact O-N 3.02Å; R402-L405 PolarHBondContact O-N 2.72Å; R402-A406 WeakPolarHBondContact O-CB 3.33Å; R402-A406 PolarHBondContact O-N 2.83Å; R402-H424 PolarHBondContact NE-O 2.99Å; R402-H424 PolarHBondContact NH2-O 3.03Å; R402-L425 HydrophobicContact CG-CD2 3.79Å; R402-D426 IonicContact CZ-OD1 3.6Å; R402-D426 IonicContact NH1-OD1 2.64Å; R402-D426 PolarHBondContact NH1-OD1 3.32Å; R402-D426 IonicContact NH1-OD2 3.97Å; R402-D426 IonicContact NH2-OD1 2.7Å; R402-D426 PolarHBondContact NH2-OD1 2.92Å; R402-N604 PolarHBondContact NH2-ND2 3.25Å
403	V	90.6	Very high	88	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-64.5	-34.1	171.2	-173.4	0	0	0	0	110.5	V312 A319 A322 V323 F383 W399 R400 M401 A406 R407	V312-V403 HydrophobicContact CB-CB 4.41Å; V312-V403 HydrophobicContact CB-CG1 4.47Å; V312-V403 HydrophobicContact CG2-CB 3.96Å; V312-V403 HydrophobicContact CG2-CG1 3.96Å; A319-V403 HydrophobicContact CB-CG2 4.08Å; A322-V403 HydrophobicContact CB-CG1 3.95Å; V323-V403 HydrophobicContact CG2-CG1 4.12Å; F383-V403 HydrophobicContact CE1-CG2 3.73Å; F383-V403 HydrophobicContact CZ-CG2 3.52Å; W399-V403 WeakPolarHBondContact O-CG2 3.34Å; W399-V403 PolarHBondContact O-N 2.96Å; R400-V403 PolarHBondContact O-N 3.49Å; M401-V403 PolarHBondContact O-N 3.27Å; V403-A406 PolarHBondContact O-N 3.36Å; V403-R407 WeakPolarHBondContact O-CB 3.4Å; V403-R407 PolarHBondContact O-N 3.31Å
404	S	89.9	Confident	88.1	Confident	17 Å²	17	38.4 Å²	38.4	12%	0.119	19%	0.191	C	C	.	.	H	α-helix	trans	-66.4	-45.2	174.7	-144.2	0	0	0	0	112	Q310 R400 M401 R402 R407 A408	Q310-S404 WeakPolarHBondContact O-CB 3.11Å; Q310-S404 PolarHBondContact O-OG 3.31Å; R400-S404 PolarHBondContact O-N 3.01Å; R400-S404 VanDerWaalsContact O-N 3.13Å; M401-S404 CarbonylContact O-C 3.54Å; M401-S404 WeakPolarHBondContact O-CA 3.32Å; M401-S404 WeakPolarHBondContact O-CB 3.46Å; M401-S404 PolarHBondContact O-N 3.13Å; R402-S404 PolarHBondContact O-N 3.02Å; S404-R407 WeakPolarHBondContact O-CB 3.48Å; S404-R407 PolarHBondContact O-N 2.96Å; S404-A408 PolarHBondContact O-N 3.47Å
405	L	91.3	Very high	88.4	Confident	7 Å²	7	29.3 Å²	29.3	4%	0.037	16%	0.157	C	C	.	.	H	α-helix	trans	-61.3	-45.1	173.2	-178.2	62.6	0	0	0	111.5	C308 L381 M401 R402 R407 A408 L409 L418 L425 L433	C308-L405 VanDerWaalsContact SG-CA 3.6Å; L381-L405 HydrophobicContact CD1-CD2 4.39Å; L381-L405 HydrophobicContact CD1-CG 4.36Å; L381-L405 HydrophobicContact CD2-CD2 3.96Å; M401-L405 PolarHBondContact O-N 3.35Å; R402-L405 PolarHBondContact O-N 2.72Å; L405-R407 VanDerWaalsContact C-N 3.31Å; L405-R407 PolarHBondContact O-N 2.83Å; L405-A408 PolarHBondContact O-N 3.22Å; L405-A408 VanDerWaalsContact O-N 3.12Å; L405-L409 HydrophobicContact CD1-CD1 4.26Å; L405-L409 HydrophobicContact CD1-CG 4.24Å; L405-L409 HydrophobicContact CG-CD1 4Å; L405-L409 HydrophobicContact CG-CG 4.41Å; L405-L409 WeakPolarHBondContact O-CB 3.4Å; L405-L409 VanDerWaalsContact O-CG 3.28Å; L405-L409 WeakPolarHBondContact O-CG 3.42Å; L405-L409 PolarHBondContact O-N 3.46Å; L405-L418 HydrophobicContact CD1-CD1 4.4Å; L405-L418 HydrophobicContact CD1-CD2 3.7Å; L405-L425 HydrophobicContact CD2-CD1 4.15Å; L405-L425 HydrophobicContact CD2-CD2 4.47Å; L405-L433 HydrophobicContact CD2-CD1 4.42Å; L405-L433 HydrophobicContact CD2-CD2 4.16Å
406	A	92.2	Very high	88.8	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-58.3	-42.6	175.2	0	0	0	0	0	111.9	V323 I377 L378 L381 R402 V403 F410	V323-A406 HydrophobicContact CG2-CB 3.69Å; I377-A406 HydrophobicContact CG2-CB 3.84Å; L378-A406 HydrophobicContact CD2-CB 3.66Å; L378-A406 HydrophobicContact CG-CB 4.24Å; L381-A406 HydrophobicContact CD1-CB 3.82Å; R402-A406 WeakPolarHBondContact O-CB 3.33Å; R402-A406 PolarHBondContact O-N 2.83Å; V403-A406 PolarHBondContact O-N 3.36Å; A406-F410 WeakPolarHBondContact O-CB 3.21Å; A406-F410 PolarHBondContact O-N 2.97Å
407	R	90.1	Very high	89.3	Confident	101 Å²	101	25 Å²	25	38%	0.381	13%	0.128	S	C	.	.	H	α-helix	trans	-59.2	-47.1	172	153.8	165.2	-169.3	-161.5	2.8	111.8	A326 V403 S404 L405 F410 M411	A326-R407 HydrophobicContact CB-CB 4.24Å; A326-R407 HydrophobicContact CB-CG 3.53Å; V403-R407 WeakPolarHBondContact O-CB 3.4Å; V403-R407 PolarHBondContact O-N 3.31Å; S404-R407 WeakPolarHBondContact O-CB 3.48Å; S404-R407 PolarHBondContact O-N 2.96Å; L405-R407 VanDerWaalsContact C-N 3.31Å; L405-R407 PolarHBondContact O-N 2.83Å; R407-F410 PolarHBondContact O-N 3.05Å; R407-M411 HydrophobicContact CG-SD 4.06Å; R407-M411 WeakPolarHBondContact O-CG 3.2Å; R407-M411 PolarHBondContact O-N 2.76Å
408	A	90.3	Very high	90	Very high	2 Å²	2	24.1 Å²	24.1	2%	0.017	12%	0.119	C	C	.	.	H	α-helix	trans	-66.8	-40.5	-178.2	0	0	0	0	0	112.8	L306 C308 S404 L405 F410 E412 L416	L306-A408 HydrophobicContact CD2-CB 3.74Å; C308-A408 HydrophobicContact CB-CB 4.12Å; S404-A408 PolarHBondContact O-N 3.47Å; L405-A408 PolarHBondContact O-N 3.22Å; L405-A408 VanDerWaalsContact O-N 3.12Å; A408-F410 VanDerWaalsContact C-N 3.32Å; A408-E412 PolarHBondContact O-N 3.39Å; A408-L416 HydrophobicContact CB-CD1 3.84Å
409	L	91.6	Very high	90.5	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-68.6	-28.7	173.5	-64.7	172.1	0	0	0	112.9	I377 L381 L405 L416 W432 L433 Y436 L437 W440	I377-L409 HydrophobicContact CD1-CB 4.45Å; I377-L409 HydrophobicContact CG2-CB 4.2Å; I377-L409 HydrophobicContact CG2-CD1 4.25Å; L381-L409 HydrophobicContact CD1-CD1 4.4Å; L405-L409 HydrophobicContact CD1-CD1 4.26Å; L405-L409 HydrophobicContact CD1-CG 4.24Å; L405-L409 HydrophobicContact CG-CD1 4Å; L405-L409 HydrophobicContact CG-CG 4.41Å; L405-L409 WeakPolarHBondContact O-CB 3.4Å; L405-L409 VanDerWaalsContact O-CG 3.28Å; L405-L409 WeakPolarHBondContact O-CG 3.42Å; L405-L409 PolarHBondContact O-N 3.46Å; L409-L416 HydrophobicContact CD2-CD2 4.02Å; L409-W432 HydrophobicContact CD1-CH2 4.38Å; L409-W432 HydrophobicContact CD1-CZ3 4.03Å; L409-L433 HydrophobicContact CD1-CD1 3.68Å; L409-L433 HydrophobicContact CD2-CD1 4.21Å; L409-Y436 HydrophobicContact CB-CE1 4.05Å; L409-Y436 HydrophobicContact CD1-CD1 4.48Å; L409-Y436 HydrophobicContact CD1-CE1 4.46Å; L409-Y436 HydrophobicContact CD2-CD1 4.11Å; L409-Y436 HydrophobicContact CD2-CE1 3.94Å; L409-Y436 HydrophobicContact CG-CE1 4.37Å; L409-L437 HydrophobicContact CD2-CD2 3.79Å; L409-W440 HydrophobicContact CD2-CZ3 4.35Å
410	F	90.9	Very high	90.5	Very high	12 Å²	12	24.3 Å²	24.3	5%	0.053	12%	0.115	C	C	.	.	H	α-helix	trans	-75.7	-44.4	177.4	175.5	-101.9	0	0	0	112.4	V323 L324 D327 A370 K373 A374 I377 A406 R407 A408 E412	V323-F410 HydrophobicContact CG1-CB 3.57Å; V323-F410 HydrophobicContact CG1-CD1 4Å; V323-F410 HydrophobicContact CG1-CD2 4.16Å; V323-F410 HydrophobicContact CG1-CG 3.64Å; V323-F410 WeakPolarHBondContact O-CD1 3.18Å; L324-F410 HydrophobicContact CD2-CE1 4.48Å; L324-F410 HydrophobicContact CD2-CE2 4.25Å; L324-F410 HydrophobicContact CD2-CZ 3.81Å; D327-F410 HydrophobicContact CB-CE1 4.09Å; A370-F410 HydrophobicContact CB-CE2 3.94Å; A370-F410 HydrophobicContact CB-CZ 4Å; A370-F410 WeakPolarHBondContact O-CE2 3.21Å; K373-F410 HydrophobicContact CB-CE2 4.49Å; K373-F410 HydrophobicContact CD-CD2 3.99Å; K373-F410 HydrophobicContact CD-CE2 4.14Å; K373-F410 HydrophobicContact CG-CD2 4.35Å; K373-F410 PolarHBondContact NZ-O 3.36Å; K373-F410 VanDerWaalsContact NZ-O 3.15Å; A374-F410 HydrophobicContact CB-CD2 4.16Å; A374-F410 HydrophobicContact CB-CE2 4.19Å; I377-F410 HydrophobicContact CD1-CB 4.06Å; I377-F410 HydrophobicContact CD1-CD2 4.43Å; A406-F410 WeakPolarHBondContact O-CB 3.21Å; A406-F410 PolarHBondContact O-N 2.97Å; R407-F410 PolarHBondContact O-N 3.05Å; A408-F410 VanDerWaalsContact C-N 3.32Å; F410-E412 VanDerWaalsContact C-N 3.33Å; F410-E412 PolarHBondContact O-N 2.92Å
411	M	86.9	Confident	90.5	Very high	59 Å²	59	21.8 Å²	21.8	29%	0.291	11%	0.108	S	C	.	.	H	α-helix	trans	-62.5	-34.5	179.5	-75.7	176.7	64.5	0	0	113.5	L306 A326 R407	L306-M411 HydrophobicContact CD1-CE 4.4Å; L306-M411 HydrophobicContact CD2-CB 4.4Å; L306-M411 HydrophobicContact CD2-CE 4.07Å; L306-M411 HydrophobicContact CD2-SD 3.76Å; A326-M411 HydrophobicContact CB-CG 3.74Å; A326-M411 HydrophobicContact CB-SD 3.84Å; R407-M411 HydrophobicContact CG-SD 4.06Å; R407-M411 WeakPolarHBondContact O-CG 3.2Å; R407-M411 PolarHBondContact O-N 2.76Å
412	E	88.4	Confident	90.4	Very high	63 Å²	63	19.9 Å²	19.9	29%	0.294	10%	0.099	S	C	.	.			trans	48.4	63.3	-176.2	-56.2	-176.5	-164.7	0	0	115.2	K373 A408 F410 W440 K442	K373-E412 WeakPolarHBondContact CE-OE1 3.41Å; K373-E412 IonicContact NZ-OE1 3.11Å; K373-E412 PolarHBondContact NZ-OE1 3.19Å; A408-E412 PolarHBondContact O-N 3.39Å; F410-E412 VanDerWaalsContact C-N 3.33Å; F410-E412 PolarHBondContact O-N 2.92Å; E412-W440 HydrophobicContact CB-CH2 3.93Å; E412-W440 HydrophobicContact CB-CZ2 4.31Å; E412-W440 HydrophobicContact CG-CH2 3.7Å; E412-W440 HydrophobicContact CG-CZ2 4.49Å; E412-W440 HydrophobicContact CG-CZ3 3.94Å; E412-K442 HydrophobicContact CB-CD 3.97Å; E412-K442 WeakPolarHBondContact O-CD 3.48Å; E412-K442 WeakPolarHBondContact O-CE 3.45Å; E412-K442 PolarHBondContact O-NZ 2.97Å; E412-K442 IonicContact OE2-NZ 3.6Å; E412-K442 PolarHBondContact OE2-NZ 3.22Å
413	P	90.3	Very high	90	Very high	2 Å²	2	20.6 Å²	20.6	1%	0.013	10%	0.103	C	C	.	.			trans	-64	167.1	177.4	34.2	-42.4	0	0	0	112.3	D304 L306 L415 L416	D304-P413 WeakPolarHBondContact OD2-CA 3.37Å; D304-P413 VanDerWaalsContact OD2-CB 3.29Å; D304-P413 WeakPolarHBondContact OD2-CB 3.21Å; L306-P413 HydrophobicContact CB-CB 4.04Å; L306-P413 HydrophobicContact CB-CG 3.75Å; L306-P413 HydrophobicContact CD2-CG 4.4Å; P413-L415 VanDerWaalsContact C-N 3.32Å; P413-L415 PolarHBondContact O-N 3.49Å; P413-L416 HydrophobicContact CG-CB 3.73Å; P413-L416 HydrophobicContact CG-CD1 4.23Å
414	T	90.8	Very high	89.2	Confident	62 Å²	62	25.2 Å²	25.2	38%	0.38	12%	0.124	S	C	.	.	S	Bend	trans	-65.4	-37	178.4	-58.8	0	0	0	0	111.9	I303 D304 T443	I303-T414 HydrophobicContact CG2-CG2 4.09Å; D304-T414 PolarHBondContact O-N 3.2Å; T414-T443 WeakPolarHBondContact O-CB 3.47Å; T414-T443 PolarHBondContact O-N 3.13Å; T414-T443 VanDerWaalsContact O-N 3.17Å; T414-T443 PolarHBondContact O-OG1 2.79Å
415	L	92.9	Very high	88.9	Confident	2 Å²	2	24.6 Å²	24.6	1%	0.01	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	111.8	166.2	174.9	61.6	0	0	0	109.6	I247 I269 I303 D304 V305 L306 P413 M417 T443 L445	I247-L415 HydrophobicContact CD1-CD2 3.69Å; I269-L415 HydrophobicContact CD1-CD2 4.26Å; I269-L415 HydrophobicContact CG2-CD1 4.42Å; I303-L415 HydrophobicContact CG2-CB 4.22Å; D304-L415 PolarHBondContact O-N 2.87Å; V305-L415 HydrophobicContact CG1-CD2 4.38Å; V305-L415 HydrophobicContact CG2-CB 4.36Å; V305-L415 HydrophobicContact CG2-CD2 4.29Å; L306-L415 PolarHBondContact N-O 3.02Å; L306-L415 VanDerWaalsContact N-O 3.12Å; P413-L415 VanDerWaalsContact C-N 3.32Å; P413-L415 PolarHBondContact O-N 3.49Å; L415-M417 HydrophobicContact CD1-CG 4.35Å; L415-M417 HydrophobicContact CD2-CG 4.14Å; L415-M417 HydrophobicContact CD2-SD 4.04Å; L415-M417 HydrophobicContact CG-CG 3.87Å; L415-M417 HydrophobicContact CG-SD 4.44Å; L415-T443 HydrophobicContact CD1-CG2 3.93Å; L415-L445 HydrophobicContact CD1-CB 4.09Å
416	L	94.3	Very high	88.7	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	124.2	168.9	175.5	56.8	0	0	0	109.4	A408 L409 P413 L418 W440 T443 L444 L445	A408-L416 HydrophobicContact CB-CD1 3.84Å; L409-L416 HydrophobicContact CD2-CD2 4.02Å; P413-L416 HydrophobicContact CG-CB 3.73Å; P413-L416 HydrophobicContact CG-CD1 4.23Å; L416-L418 HydrophobicContact CD1-CD2 3.9Å; L416-L418 HydrophobicContact CD2-CD2 4.34Å; L416-L418 HydrophobicContact CG-CD2 4.07Å; L416-L418 HydrophobicContact CG-CG 4.24Å; L416-W440 HydrophobicContact CB-CZ2 4.06Å; L416-W440 HydrophobicContact CD2-CH2 3.81Å; L416-W440 HydrophobicContact CD2-CZ2 3.62Å; L416-W440 HydrophobicContact CG-CZ2 4.5Å; L416-T443 PolarHBondContact N-O 2.9Å; L416-L444 HydrophobicContact CB-CD2 3.85Å; L416-L444 HydrophobicContact CD2-CD2 3.92Å; L416-L444 HydrophobicContact CG-CD2 3.93Å; L416-L444 WeakPolarHBondContact O-CA 3.17Å; L416-L445 PolarHBondContact O-N 2.64Å
417	M	94.3	Very high	88.4	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	129.1	176.3	-51.8	-164.5	-56.9	0	0	110.7	L289 I292 A293 V305 L306 L307 C308 L415 L445	L289-M417 HydrophobicContact CD2-CB 4.38Å; L289-M417 HydrophobicContact CD2-SD 4.03Å; L289-M417 WeakPolarHBondContact O-CE 3.49Å; I292-M417 HydrophobicContact CB-CE 3.98Å; I292-M417 HydrophobicContact CB-SD 4.03Å; I292-M417 HydrophobicContact CD1-SD 4.33Å; I292-M417 HydrophobicContact CG2-CE 3.81Å; I292-M417 HydrophobicContact CG2-SD 3.56Å; I292-M417 VanDerWaalsContact CG2-SD 3.56Å; A293-M417 HydrophobicContact CB-CE 3.86Å; V305-M417 HydrophobicContact CG1-CE 3.65Å; V305-M417 HydrophobicContact CG1-CG 4.48Å; V305-M417 HydrophobicContact CG1-SD 4.11Å; L306-M417 WeakPolarHBondContact O-CB 3.47Å; L306-M417 PolarHBondContact O-N 2.84Å; L307-M417 HydrophobicContact CB-CB 4.49Å; L307-M417 HydrophobicContact CB-CE 3.91Å; L307-M417 HydrophobicContact CD1-CB 3.84Å; L307-M417 HydrophobicContact CD1-CE 4.37Å; L307-M417 HydrophobicContact CD2-CE 4.44Å; L307-M417 HydrophobicContact CG-CE 4.47Å; C308-M417 PolarHBondContact N-O 2.9Å; L415-M417 HydrophobicContact CD1-CG 4.35Å; L415-M417 HydrophobicContact CD2-CG 4.14Å; L415-M417 HydrophobicContact CD2-SD 4.04Å; L415-M417 HydrophobicContact CG-CG 3.87Å; L415-M417 HydrophobicContact CG-SD 4.44Å; M417-L445 VanDerWaalsContact CA-O 3.28Å; M417-L445 WeakPolarHBondContact CA-O 3.49Å; M417-L445 HydrophobicContact CG-CB 4.25Å; M417-L445 HydrophobicContact SD-CD2 4.05Å
418	L	92.8	Very high	88.3	Confident	1 Å²	1	21.3 Å²	21.3	1%	0.005	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	126.2	-179.5	-57	179.5	0	0	0	109.3	C308 L405 L416 P421 L437 L445 I446 V447	C308-L418 HydrophobicContact CB-CD2 3.7Å; L405-L418 HydrophobicContact CD1-CD1 4.4Å; L405-L418 HydrophobicContact CD1-CD2 3.7Å; L416-L418 HydrophobicContact CD1-CD2 3.9Å; L416-L418 HydrophobicContact CD2-CD2 4.34Å; L416-L418 HydrophobicContact CG-CD2 4.07Å; L416-L418 HydrophobicContact CG-CG 4.24Å; L418-P421 HydrophobicContact CB-CB 4.22Å; L418-P421 HydrophobicContact CB-CG 3.94Å; L418-P421 HydrophobicContact CD1-CB 4.34Å; L418-P421 HydrophobicContact CD1-CG 4.16Å; L418-L437 HydrophobicContact CD1-CD1 4.08Å; L418-L445 PolarHBondContact N-O 2.96Å; L418-I446 HydrophobicContact CB-CG1 4.35Å; L418-I446 HydrophobicContact CB-CG2 4.12Å; L418-I446 HydrophobicContact CD1-CD1 4.38Å; L418-I446 HydrophobicContact CD1-CG1 4.25Å; L418-I446 WeakPolarHBondContact O-CA 3.17Å; L418-V447 PolarHBondContact O-N 3.26Å
419	D	91.3	Very high	88.3	Confident	36 Å²	36	21.2 Å²	21.2	19%	0.193	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	112.2	174.3	-153.2	26	0	0	0	109.7	T286 L289 V447	T286-D419 WeakPolarHBondContact CA-OD2 3.18Å; T286-D419 WeakPolarHBondContact CB-OD2 3.44Å; T286-D419 WeakPolarHBondContact CG2-OD2 3.32Å; T286-D419 PolarHBondContact OG1-OD2 3.11Å; L289-D419 HydrophobicContact CD1-CB 3.73Å; D419-V447 WeakPolarHBondContact OD1-CB 3.45Å; D419-V447 WeakPolarHBondContact OD1-CG1 3.19Å; D419-V447 WeakPolarHBondContact OD1-CG2 3.39Å
420	E	87.3	Confident	88.2	Confident	32 Å²	32	21.5 Å²	21.5	15%	0.15	11%	0.111	C	C	.	.	S	Bend	trans	42.8	53.5	180	-58	-172.7	-162.6	0	0	115.2	K285 T422 N423 V447 H449	K285-E420 WeakPolarHBondContact CE-OE1 3.49Å; K285-E420 IonicContact NZ-OE1 3.07Å; K285-E420 PolarHBondContact NZ-OE1 2.87Å; E420-T422 PolarHBondContact O-N 3.05Å; E420-N423 WeakPolarHBondContact CB-ND2 3.33Å; E420-N423 PolarHBondContact O-N 2.96Å; E420-N423 PolarHBondContact OE2-ND2 2.93Å; E420-V447 VanDerWaalsContact CA-O 3.27Å; E420-V447 WeakPolarHBondContact CA-O 3.28Å; E420-V447 HydrophobicContact CG-CG1 3.82Å; E420-V447 PolarHBondContact N-O 3.09Å; E420-H449 IonicContact OE1-CD2 3.15Å; E420-H449 IonicContact OE1-NE2 2.66Å; E420-H449 IonicContact OE2-CD2 3.68Å
421	P	86.9	Confident	88.2	Confident	17 Å²	17	21.3 Å²	21.3	11%	0.11	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-16	-168.6	28.3	-37.1	0	0	0	114.5	L418 L425 L433 I446 V447 F453	L418-P421 HydrophobicContact CB-CB 4.22Å; L418-P421 HydrophobicContact CB-CG 3.94Å; L418-P421 HydrophobicContact CD1-CB 4.34Å; L418-P421 HydrophobicContact CD1-CG 4.16Å; P421-L425 VanDerWaalsContact O-CD1 3.24Å; P421-L425 WeakPolarHBondContact O-CD1 3.49Å; P421-L425 VanDerWaalsContact O-CG 3.3Å; P421-L425 WeakPolarHBondContact O-CG 3.45Å; P421-L433 HydrophobicContact CB-CD2 4.27Å; P421-I446 HydrophobicContact CG-CG2 3.98Å; P421-V447 WeakPolarHBondContact CD-O 3.29Å; P421-F453 HydrophobicContact CG-CZ 4.4Å
422	T	84.8	Confident	88.4	Confident	1 Å²	1	18.6 Å²	18.6	1%	0.006	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-29	179.4	46.2	0	0	0	0	113.4	E420 H424 L425 V430 D450 F453	E420-T422 PolarHBondContact O-N 3.05Å; T422-H424 PolarHBondContact O-N 3.43Å; T422-L425 PolarHBondContact O-N 3.17Å; T422-V430 HydrophobicContact CG2-CG1 4.08Å; T422-V430 HydrophobicContact CG2-CG2 4.16Å; T422-D450 HydrophobicContact CG2-CB 4.39Å; T422-F453 HydrophobicContact CG2-CD2 4.18Å; T422-F453 HydrophobicContact CG2-CG 4.34Å
423	N	81.8	Confident	88.6	Confident	19 Å²	19	15.6 Å²	15.6	10%	0.102	8%	0.082	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-13	-167.3	-63.9	8.1	0	0	0	115	E420 N715	E420-N423 WeakPolarHBondContact CB-ND2 3.33Å; E420-N423 PolarHBondContact O-N 2.96Å; E420-N423 PolarHBondContact OE2-ND2 2.93Å; N423-N715 PolarHBondContact O-OD1 2.96Å
424	H	74.4	Confident	88.6	Confident	97 Å²	97	15.9 Å²	15.9	45%	0.449	8%	0.084	S	C	.	.	T	Hydrogen-bonded Turn	trans	-124.3	12.7	179.1	-58.5	-30.1	0	0	0	112.7	R402 T422	R402-H424 PolarHBondContact NE-O 2.99Å; R402-H424 PolarHBondContact NH2-O 3.03Å; T422-H424 PolarHBondContact O-N 3.43Å
425	L	84.3	Confident	88.7	Confident	3 Å²	3	13.5 Å²	13.5	2%	0.016	7%	0.069	C	C	.	.			trans	-102.5	140.3	177.3	-63.6	-177.3	0	0	0	110.8	L381 R402 L405 P421 T422 A429 V430 L433	L381-L425 HydrophobicContact CD2-CD1 4.44Å; L381-L425 HydrophobicContact CD2-CD2 4.09Å; R402-L425 HydrophobicContact CG-CD2 3.79Å; L405-L425 HydrophobicContact CD2-CD1 4.15Å; L405-L425 HydrophobicContact CD2-CD2 4.47Å; P421-L425 VanDerWaalsContact O-CD1 3.24Å; P421-L425 WeakPolarHBondContact O-CD1 3.49Å; P421-L425 VanDerWaalsContact O-CG 3.3Å; P421-L425 WeakPolarHBondContact O-CG 3.45Å; T422-L425 PolarHBondContact O-N 3.17Å; L425-A429 HydrophobicContact CB-CB 4.19Å; L425-A429 HydrophobicContact CD2-CB 4.01Å; L425-A429 HydrophobicContact CG-CB 4.47Å; L425-V430 HydrophobicContact CB-CG2 3.51Å; L425-V430 HydrophobicContact CD1-CG2 4.31Å; L425-L433 HydrophobicContact CD1-CB 4.45Å; L425-L433 HydrophobicContact CD1-CD2 3.61Å
426	D	85.6	Confident	88.6	Confident	3 Å²	3	14.8 Å²	14.8	2%	0.016	7%	0.074	C	C	.	.			trans	-72.1	154.3	163.5	39.3	-16.8	0	0	0	108.6	S382 R402 N428 A429 V430 P603 N604	S382-D426 WeakPolarHBondContact CB-OD2 3.38Å; S382-D426 VanDerWaalsContact OG-CG 3.31Å; S382-D426 PolarHBondContact OG-OD1 2.89Å; S382-D426 PolarHBondContact OG-OD2 2.68Å; R402-D426 IonicContact CZ-OD1 3.6Å; R402-D426 IonicContact NH1-OD1 2.64Å; R402-D426 PolarHBondContact NH1-OD1 3.32Å; R402-D426 IonicContact NH1-OD2 3.97Å; R402-D426 IonicContact NH2-OD1 2.7Å; R402-D426 PolarHBondContact NH2-OD1 2.92Å; D426-N428 PolarHBondContact O-N 3.24Å; D426-N428 VanDerWaalsContact O-N 3.09Å; D426-A429 WeakPolarHBondContact O-CA 3.32Å; D426-A429 PolarHBondContact O-N 2.94Å; D426-A429 VanDerWaalsContact OD1-CB 3.22Å; D426-A429 WeakPolarHBondContact OD1-CB 3.22Å; D426-V430 PolarHBondContact O-N 3.46Å; D426-P603 VanDerWaalsContact OD2-CA 3.22Å; D426-P603 WeakPolarHBondContact OD2-CA 3.45Å; D426-N604 HydrophobicContact CB-CB 4.18Å; D426-N604 PolarHBondContact OD2-N 3.12Å
427	L	85.7	Confident	88.5	Confident	7 Å²	7	14.8 Å²	14.8	4%	0.037	7%	0.074	C	C	.	.	H	α-helix	trans	-48.6	-42.3	-178.4	-177.8	60.1	0	0	0	112.6	A429 V430 I431 V601 H741 I746 F768 Y771	L427-A429 PolarHBondContact O-N 2.9Å; L427-V430 PolarHBondContact O-N 2.91Å; L427-I431 HydrophobicContact CD1-CD1 4.22Å; L427-I431 HydrophobicContact CD1-CG1 4.46Å; L427-I431 HydrophobicContact CG-CD1 3.89Å; L427-I431 WeakPolarHBondContact O-CB 3.41Å; L427-I431 WeakPolarHBondContact O-CD1 3.15Å; L427-I431 VanDerWaalsContact O-CG1 3.28Å; L427-I431 WeakPolarHBondContact O-CG1 3.42Å; L427-I431 PolarHBondContact O-N 3.31Å; L427-V601 HydrophobicContact CD2-CB 4.25Å; L427-V601 HydrophobicContact CD2-CG1 3.64Å; L427-H741 WeakPolarHBondContact CD1-O 3.36Å; L427-I746 HydrophobicContact CD2-CD1 4.1Å; L427-F768 HydrophobicContact CD1-CE2 3.71Å; L427-F768 HydrophobicContact CD1-CZ 3.84Å; L427-F768 HydrophobicContact CD2-CE2 3.88Å; L427-F768 HydrophobicContact CG-CE2 4.28Å; L427-Y771 HydrophobicContact CD2-CD1 4.23Å; L427-Y771 HydrophobicContact CD2-CE1 3.87Å; L427-Y771 HydrophobicContact CG-CE1 4.42Å
428	N	88.4	Confident	88.4	Confident	29 Å²	29	16 Å²	16	16%	0.155	8%	0.08	C	C	.	.	H	α-helix	trans	-59.6	-42.8	177.9	-56.6	51.8	0	0	0	112.5	D426 W432 Y771 V775	D426-N428 PolarHBondContact O-N 3.24Å; D426-N428 VanDerWaalsContact O-N 3.09Å; N428-W432 PolarHBondContact O-N 2.87Å; N428-Y771 PolarHBondContact ND2-OH 3.04Å; N428-Y771 VanDerWaalsContact ND2-OH 3.12Å; N428-Y771 PolarHBondContact OD1-OH 2.99Å; N428-V775 HydrophobicContact CB-CG1 3.99Å
429	A	90	Very high	88.2	Confident	0 Å²	0	19.1 Å²	19.1	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-75.8	-29	177.4	0	0	0	0	0	112.8	L381 L425 D426 L427 L433	L381-A429 HydrophobicContact CD2-CB 4.36Å; L425-A429 HydrophobicContact CB-CB 4.19Å; L425-A429 HydrophobicContact CD2-CB 4.01Å; L425-A429 HydrophobicContact CG-CB 4.47Å; D426-A429 WeakPolarHBondContact O-CA 3.32Å; D426-A429 PolarHBondContact O-N 2.94Å; D426-A429 VanDerWaalsContact OD1-CB 3.22Å; D426-A429 WeakPolarHBondContact OD1-CB 3.22Å; L427-A429 PolarHBondContact O-N 2.9Å; A429-L433 WeakPolarHBondContact O-CB 3.25Å; A429-L433 PolarHBondContact O-N 3.47Å
430	V	90.1	Very high	88.2	Confident	7 Å²	7	18.1 Å²	18.1	4%	0.042	10%	0.095	C	C	.	.	H	α-helix	trans	-66.5	-44.4	170.1	175.9	0	0	0	0	110.8	T422 L425 D426 L427 L433 N434 H741	T422-V430 HydrophobicContact CG2-CG1 4.08Å; T422-V430 HydrophobicContact CG2-CG2 4.16Å; L425-V430 HydrophobicContact CB-CG2 3.51Å; L425-V430 HydrophobicContact CD1-CG2 4.31Å; D426-V430 PolarHBondContact O-N 3.46Å; L427-V430 PolarHBondContact O-N 2.91Å; V430-L433 PolarHBondContact O-N 3.23Å; V430-N434 VanDerWaalsContact O-CB 3.25Å; V430-N434 WeakPolarHBondContact O-CB 3.46Å; V430-N434 PolarHBondContact O-N 3.17Å; V430-H741 HydrophobicContact CG2-CB 4.04Å
431	I	90.5	Very high	88.2	Confident	7 Å²	7	25.7 Å²	25.7	4%	0.036	13%	0.127	C	C	.	.	H	α-helix	trans	-57.2	-49.8	175.1	-73	161.7	0	0	0	110.6	L427 N435 F768 Y771 K772 V775 L776	L427-I431 HydrophobicContact CD1-CD1 4.22Å; L427-I431 HydrophobicContact CD1-CG1 4.46Å; L427-I431 HydrophobicContact CG-CD1 3.89Å; L427-I431 WeakPolarHBondContact O-CB 3.41Å; L427-I431 WeakPolarHBondContact O-CD1 3.15Å; L427-I431 VanDerWaalsContact O-CG1 3.28Å; L427-I431 WeakPolarHBondContact O-CG1 3.42Å; L427-I431 PolarHBondContact O-N 3.31Å; I431-N435 PolarHBondContact O-N 2.92Å; I431-N435 VanDerWaalsContact O-N 3.17Å; I431-F768 HydrophobicContact CD1-CZ 4.32Å; I431-F768 HydrophobicContact CG1-CZ 4.46Å; I431-Y771 HydrophobicContact CD1-CD1 4.45Å; I431-Y771 HydrophobicContact CD1-CE1 4.46Å; I431-K772 HydrophobicContact CD1-CB 4.43Å; I431-K772 HydrophobicContact CD1-CG 4.47Å; I431-K772 HydrophobicContact CG1-CG 4.23Å; I431-K772 HydrophobicContact CG2-CG 3.81Å; I431-V775 HydrophobicContact CB-CG1 4.48Å; I431-V775 HydrophobicContact CG2-CG1 4.12Å; I431-L776 HydrophobicContact CG2-CD1 4.32Å; I431-L776 HydrophobicContact CG2-CD2 4.06Å; I431-L776 HydrophobicContact CG2-CG 3.91Å
432	W	91.9	Very high	88.5	Confident	2 Å²	2	28.7 Å²	28.7	1%	0.008	14%	0.139	C	C	.	.	H	α-helix	trans	-63.5	-47.5	177.2	-179.6	85	0	0	0	112.4	I377 G380 L381 L409 N428 N434 N435 Y436 L779 E781	I377-W432 HydrophobicContact CB-CH2 4.17Å; I377-W432 HydrophobicContact CG1-CH2 4.12Å; I377-W432 HydrophobicContact CG1-CZ2 4.48Å; I377-W432 HydrophobicContact CG2-CH2 4.04Å; G380-W432 VanDerWaalsContact CA-CD2 3.47Å; G380-W432 VanDerWaalsContact CA-CG 3.48Å; G380-W432 WeakPolarHBondContact O-CB 3.29Å; L381-W432 HydrophobicContact CD2-CE3 4.13Å; L381-W432 HydrophobicContact CD2-CZ3 4.15Å; L381-W432 HydrophobicContact CG-CE3 4.21Å; L381-W432 HydrophobicContact CG-CZ3 4Å; L409-W432 HydrophobicContact CD1-CH2 4.38Å; L409-W432 HydrophobicContact CD1-CZ3 4.03Å; N428-W432 PolarHBondContact O-N 2.87Å; W432-N434 VanDerWaalsContact C-N 3.31Å; W432-N434 PolarHBondContact O-N 3.37Å; W432-N435 PolarHBondContact O-N 2.91Å; W432-Y436 HydrophobicContact CH2-CD1 4.03Å; W432-Y436 AromaticContact CH2-CD2 3.65Å; W432-Y436 HydrophobicContact CH2-CD2 3.65Å; W432-Y436 HydrophobicContact CH2-CE1 4.41Å; W432-Y436 HydrophobicContact CH2-CE2 4.06Å; W432-Y436 AromaticContact CH2-CG 3.62Å; W432-Y436 HydrophobicContact CH2-CG 3.62Å; W432-Y436 AromaticContact CZ2-CD2 3.43Å; W432-Y436 HydrophobicContact CZ2-CD2 3.43Å; W432-Y436 VanDerWaalsContact CZ2-CD2 3.43Å; W432-Y436 AromaticContact CZ2-CE2 3.98Å; W432-Y436 HydrophobicContact CZ2-CE2 3.98Å; W432-Y436 AromaticContact CZ2-CG 3.79Å; W432-Y436 HydrophobicContact CZ2-CG 3.79Å; W432-Y436 HydrophobicContact CZ3-CG 4.23Å; W432-Y436 WeakPolarHBondContact O-CB 3.43Å; W432-Y436 PolarHBondContact O-N 3.28Å; W432-L779 HydrophobicContact CB-CD1 4.14Å; W432-L779 HydrophobicContact CG-CD1 4.25Å; W432-E781 PolarHBondContact NE1-OE1 2.94Å
433	L	92.3	Very high	88.9	Confident	0 Å²	0	29 Å²	29	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-61.4	-39.9	-178.6	-178.6	67.4	0	0	0	111.9	L405 L409 P421 L425 A429 V430 Y436 L437 F453	L405-L433 HydrophobicContact CD2-CD1 4.42Å; L405-L433 HydrophobicContact CD2-CD2 4.16Å; L409-L433 HydrophobicContact CD1-CD1 3.68Å; L409-L433 HydrophobicContact CD2-CD1 4.21Å; P421-L433 HydrophobicContact CB-CD2 4.27Å; L425-L433 HydrophobicContact CD1-CB 4.45Å; L425-L433 HydrophobicContact CD1-CD2 3.61Å; A429-L433 WeakPolarHBondContact O-CB 3.25Å; A429-L433 PolarHBondContact O-N 3.47Å; V430-L433 PolarHBondContact O-N 3.23Å; L433-Y436 PolarHBondContact O-N 3.06Å; L433-L437 HydrophobicContact CD1-CD1 3.78Å; L433-L437 HydrophobicContact CD1-CG 3.98Å; L433-L437 HydrophobicContact CD2-CD1 4.35Å; L433-L437 HydrophobicContact CG-CD1 3.77Å; L433-L437 HydrophobicContact CG-CG 4.3Å; L433-L437 WeakPolarHBondContact O-CB 3.49Å; L433-L437 VanDerWaalsContact O-CG 3.3Å; L433-L437 WeakPolarHBondContact O-CG 3.39Å; L433-L437 PolarHBondContact O-N 3.29Å; L433-F453 HydrophobicContact CD2-CE2 4.02Å; L433-F453 HydrophobicContact CD2-CZ 4.36Å; L433-F453 HydrophobicContact CG-CE2 4.11Å
434	N	91.1	Very high	89.6	Confident	8 Å²	8	28.1 Å²	28.1	4%	0.043	14%	0.136	C	C	.	.	H	α-helix	trans	-59.5	-54.6	174.2	-179.7	-12.6	0	0	0	110.4	V430 W432 Y436 L437 Q438 F453 D456	V430-N434 VanDerWaalsContact O-CB 3.25Å; V430-N434 WeakPolarHBondContact O-CB 3.46Å; V430-N434 PolarHBondContact O-N 3.17Å; W432-N434 VanDerWaalsContact C-N 3.31Å; W432-N434 PolarHBondContact O-N 3.37Å; N434-Y436 VanDerWaalsContact C-N 3.3Å; N434-Y436 PolarHBondContact O-N 2.94Å; N434-L437 PolarHBondContact O-N 2.88Å; N434-Q438 WeakPolarHBondContact O-CG 3.45Å; N434-Q438 PolarHBondContact O-N 3.35Å; N434-Q438 PolarHBondContact OD1-NE2 3.36Å; N434-F453 HydrophobicContact CB-CD2 4.1Å; N434-F453 HydrophobicContact CB-CE2 4.49Å; N434-D456 PolarHBondContact ND2-OD2 3.14Å; N434-D456 VanDerWaalsContact OD1-CB 3.23Å; N434-D456 WeakPolarHBondContact OD1-CB 3.39Å; N434-D456 PolarHBondContact OD1-OD2 2.91Å
435	N	91.3	Very high	90.5	Very high	12 Å²	12	23.6 Å²	23.6	6%	0.064	12%	0.115	C	C	.	.	H	α-helix	trans	-57.8	-41.4	178.3	-165	63.5	0	0	0	112.3	I431 W432 L776 T782 V784	I431-N435 PolarHBondContact O-N 2.92Å; I431-N435 VanDerWaalsContact O-N 3.17Å; W432-N435 PolarHBondContact O-N 2.91Å; N435-L776 HydrophobicContact CB-CD2 4.05Å; N435-T782 PolarHBondContact ND2-O 3.48Å; N435-V784 WeakPolarHBondContact OD1-CG2 3.49Å; N435-V784 PolarHBondContact OD1-N 3.13Å
436	Y	91.9	Very high	91	Very high	29 Å²	29	23.5 Å²	23.5	11%	0.114	11%	0.114	C	C	.	.	H	α-helix	trans	-64.7	-47.9	177.2	-171.2	-98	0	0	0	112.1	I377 L409 W432 L433 N434 Q438 S439 W440	I377-Y436 HydrophobicContact CG1-CE2 4.36Å; L409-Y436 HydrophobicContact CB-CE1 4.05Å; L409-Y436 HydrophobicContact CD1-CD1 4.48Å; L409-Y436 HydrophobicContact CD1-CE1 4.46Å; L409-Y436 HydrophobicContact CD2-CD1 4.11Å; L409-Y436 HydrophobicContact CD2-CE1 3.94Å; L409-Y436 HydrophobicContact CG-CE1 4.37Å; W432-Y436 HydrophobicContact CH2-CD1 4.03Å; W432-Y436 AromaticContact CH2-CD2 3.65Å; W432-Y436 HydrophobicContact CH2-CD2 3.65Å; W432-Y436 HydrophobicContact CH2-CE1 4.41Å; W432-Y436 HydrophobicContact CH2-CE2 4.06Å; W432-Y436 AromaticContact CH2-CG 3.62Å; W432-Y436 HydrophobicContact CH2-CG 3.62Å; W432-Y436 AromaticContact CZ2-CD2 3.43Å; W432-Y436 HydrophobicContact CZ2-CD2 3.43Å; W432-Y436 VanDerWaalsContact CZ2-CD2 3.43Å; W432-Y436 AromaticContact CZ2-CE2 3.98Å; W432-Y436 HydrophobicContact CZ2-CE2 3.98Å; W432-Y436 AromaticContact CZ2-CG 3.79Å; W432-Y436 HydrophobicContact CZ2-CG 3.79Å; W432-Y436 HydrophobicContact CZ3-CG 4.23Å; W432-Y436 WeakPolarHBondContact O-CB 3.43Å; W432-Y436 PolarHBondContact O-N 3.28Å; L433-Y436 PolarHBondContact O-N 3.06Å; N434-Y436 VanDerWaalsContact C-N 3.3Å; N434-Y436 PolarHBondContact O-N 2.94Å; Y436-Q438 PolarHBondContact O-N 3.23Å; Y436-S439 WeakPolarHBondContact O-CB 3.39Å; Y436-S439 PolarHBondContact O-N 3.37Å; Y436-S439 PolarHBondContact O-OG 3.06Å; Y436-W440 HydrophobicContact CE1-CE3 4.01Å; Y436-W440 AromaticContact CE1-CZ3 3.84Å; Y436-W440 HydrophobicContact CE1-CZ3 3.84Å
437	L	92.6	Very high	91.3	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-73.2	-24.6	-177.6	-69.5	175.4	0	0	0	113.9	L409 L418 L433 N434 S439 W440 L444 I446 F453 V457	L409-L437 HydrophobicContact CD2-CD2 3.79Å; L418-L437 HydrophobicContact CD1-CD1 4.08Å; L433-L437 HydrophobicContact CD1-CD1 3.78Å; L433-L437 HydrophobicContact CD1-CG 3.98Å; L433-L437 HydrophobicContact CD2-CD1 4.35Å; L433-L437 HydrophobicContact CG-CD1 3.77Å; L433-L437 HydrophobicContact CG-CG 4.3Å; L433-L437 WeakPolarHBondContact O-CB 3.49Å; L433-L437 VanDerWaalsContact O-CG 3.3Å; L433-L437 WeakPolarHBondContact O-CG 3.39Å; L433-L437 PolarHBondContact O-N 3.29Å; N434-L437 PolarHBondContact O-N 2.88Å; L437-S439 PolarHBondContact O-N 2.89Å; L437-W440 HydrophobicContact CD2-CD2 4.46Å; L437-W440 HydrophobicContact CD2-CE3 4.41Å; L437-W440 WeakPolarHBondContact O-CB 3.43Å; L437-W440 PolarHBondContact O-N 2.88Å; L437-W440 VanDerWaalsContact O-N 3.12Å; L437-L444 HydrophobicContact CD2-CD1 4.02Å; L437-L444 HydrophobicContact CD2-CD2 4.16Å; L437-I446 HydrophobicContact CD1-CD1 4.15Å; L437-F453 HydrophobicContact CD1-CE2 4.11Å; L437-F453 HydrophobicContact CD1-CZ 3.62Å; L437-V457 HydrophobicContact CB-CG1 3.85Å; L437-V457 HydrophobicContact CB-CG2 4.13Å
438	Q	91.1	Very high	91.5	Very high	27 Å²	27	23 Å²	23	13%	0.126	11%	0.112	C	C	.	.	H	α-helix	trans	-58.3	-37.7	168.9	-75.8	-178.7	47.4	0	0	112	R274 N434 Y436 W440 V457 V784	R274-Q438 PolarHBondContact NH1-O 2.99Å; N434-Q438 WeakPolarHBondContact O-CG 3.45Å; N434-Q438 PolarHBondContact O-N 3.35Å; N434-Q438 PolarHBondContact OD1-NE2 3.36Å; Y436-Q438 PolarHBondContact O-N 3.23Å; Q438-W440 PolarHBondContact O-N 3.37Å; Q438-V457 HydrophobicContact CG-CG2 4.4Å; Q438-V784 HydrophobicContact CB-CG1 4.28Å
439	S	88.8	Confident	91.3	Very high	66 Å²	66	22 Å²	22	46%	0.462	11%	0.106	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-9.9	178	82.6	0	0	0	0	114.3	Y436 L437	Y436-S439 WeakPolarHBondContact O-CB 3.39Å; Y436-S439 PolarHBondContact O-N 3.37Å; Y436-S439 PolarHBondContact O-OG 3.06Å; L437-S439 PolarHBondContact O-N 2.89Å
440	W	90.8	Very high	91.2	Very high	15 Å²	15	22.2 Å²	22.2	6%	0.057	11%	0.107	C	C	.	.			trans	-71.1	129.1	-170.8	-166.8	-93.3	0	0	0	112.4	R274 L409 E412 L416 Y436 L437 Q438 L444	R274-W440 PolarHBondContact NH1-O 2.83Å; L409-W440 HydrophobicContact CD2-CZ3 4.35Å; E412-W440 HydrophobicContact CB-CH2 3.93Å; E412-W440 HydrophobicContact CB-CZ2 4.31Å; E412-W440 HydrophobicContact CG-CH2 3.7Å; E412-W440 HydrophobicContact CG-CZ2 4.49Å; E412-W440 HydrophobicContact CG-CZ3 3.94Å; L416-W440 HydrophobicContact CB-CZ2 4.06Å; L416-W440 HydrophobicContact CD2-CH2 3.81Å; L416-W440 HydrophobicContact CD2-CZ2 3.62Å; L416-W440 HydrophobicContact CG-CZ2 4.5Å; Y436-W440 HydrophobicContact CE1-CE3 4.01Å; Y436-W440 AromaticContact CE1-CZ3 3.84Å; Y436-W440 HydrophobicContact CE1-CZ3 3.84Å; L437-W440 HydrophobicContact CD2-CD2 4.46Å; L437-W440 HydrophobicContact CD2-CE3 4.41Å; L437-W440 WeakPolarHBondContact O-CB 3.43Å; L437-W440 PolarHBondContact O-N 2.88Å; L437-W440 VanDerWaalsContact O-N 3.12Å; Q438-W440 PolarHBondContact O-N 3.37Å; W440-L444 HydrophobicContact CB-CD1 3.88Å; W440-L444 VanDerWaalsContact CD1-CG 3.46Å; W440-L444 HydrophobicContact CG-CD1 3.72Å; W440-L444 HydrophobicContact CG-CG 4.2Å
441	K	89	Confident	91	Very high	191 Å²	191	22.2 Å²	22.2	83%	0.83	11%	0.107	S	C	*	.			trans	-104.4	-14.4	-172.6	-58.4	178.5	-176.8	174	0	114.4
442	K	92.3	Very high	90.9	Very high	80 Å²	80	23.1 Å²	23.1	35%	0.348	11%	0.114	S	C	.	.	S	Bend	trans	-90.4	177.1	177.1	-69.9	166.5	177.2	170	0	109.6	E412	E412-K442 HydrophobicContact CB-CD 3.97Å; E412-K442 WeakPolarHBondContact O-CD 3.48Å; E412-K442 WeakPolarHBondContact O-CE 3.45Å; E412-K442 PolarHBondContact O-NZ 2.97Å; E412-K442 IonicContact OE2-NZ 3.6Å; E412-K442 PolarHBondContact OE2-NZ 3.22Å
443	T	93.9	Very high	90.7	Very high	8 Å²	8	23 Å²	23	5%	0.049	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	136.9	-175.9	-32	0	0	0	0	110.6	I269 G272 R273 T414 L415 L416	I269-T443 HydrophobicContact CG2-CG2 3.59Å; G272-T443 PolarHBondContact N-OG1 3.24Å; R273-T443 WeakPolarHBondContact O-CA 3.48Å; R273-T443 WeakPolarHBondContact O-CG2 3.34Å; T414-T443 WeakPolarHBondContact O-CB 3.47Å; T414-T443 PolarHBondContact O-N 3.13Å; T414-T443 VanDerWaalsContact O-N 3.17Å; T414-T443 PolarHBondContact O-OG1 2.79Å; L415-T443 HydrophobicContact CD1-CG2 3.93Å; L416-T443 PolarHBondContact N-O 2.9Å
444	L	94.9	Very high	90.7	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	139.9	174.3	-78.3	163.1	0	0	0	110.6	R273 R274 Y275 L416 L437 W440 I446 V457	R273-L444 PolarHBondContact O-N 3.36Å; R274-L444 HydrophobicContact CB-CB 4.17Å; R274-L444 HydrophobicContact CB-CD1 4.45Å; R274-L444 HydrophobicContact CG-CB 4.16Å; R274-L444 HydrophobicContact CG-CD1 3.91Å; R274-L444 HydrophobicContact CG-CG 4.49Å; Y275-L444 PolarHBondContact N-O 2.99Å; L416-L444 HydrophobicContact CB-CD2 3.85Å; L416-L444 HydrophobicContact CD2-CD2 3.92Å; L416-L444 HydrophobicContact CG-CD2 3.93Å; L416-L444 WeakPolarHBondContact O-CA 3.17Å; L437-L444 HydrophobicContact CD2-CD1 4.02Å; L437-L444 HydrophobicContact CD2-CD2 4.16Å; W440-L444 HydrophobicContact CB-CD1 3.88Å; W440-L444 VanDerWaalsContact CD1-CG 3.46Å; W440-L444 HydrophobicContact CG-CD1 3.72Å; W440-L444 HydrophobicContact CG-CG 4.2Å; L444-I446 HydrophobicContact CB-CD1 4.45Å; L444-I446 HydrophobicContact CB-CG1 4.34Å; L444-I446 HydrophobicContact CD1-CD1 4.43Å; L444-I446 HydrophobicContact CD2-CD1 4.41Å; L444-I446 HydrophobicContact CD2-CG1 4.44Å; L444-V457 HydrophobicContact CD1-CG1 4.49Å
445	L	94.7	Very high	90.7	Very high	1 Å²	1	24 Å²	24	1%	0.005	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	108.1	164.7	177.8	62.1	0	0	0	108.4	I269 Y275 L277 L289 I292 L415 L416 M417 L418 I462	I269-L445 HydrophobicContact CD1-CD2 4.05Å; Y275-L445 WeakPolarHBondContact O-CA 3.48Å; L277-L445 HydrophobicContact CB-CD1 4.05Å; L289-L445 HydrophobicContact CD2-CD2 3.55Å; L289-L445 HydrophobicContact CD2-CG 3.96Å; I292-L445 HydrophobicContact CD1-CD2 4.15Å; L415-L445 HydrophobicContact CD1-CB 4.09Å; L416-L445 PolarHBondContact O-N 2.64Å; M417-L445 VanDerWaalsContact CA-O 3.28Å; M417-L445 WeakPolarHBondContact CA-O 3.49Å; M417-L445 HydrophobicContact CG-CB 4.25Å; M417-L445 HydrophobicContact SD-CD2 4.05Å; L418-L445 PolarHBondContact N-O 2.96Å; L445-I462 HydrophobicContact CD1-CD1 3.9Å
446	I	94.1	Very high	90.6	Very high	1 Å²	1	24.6 Å²	24.6	1%	0.005	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	122.4	-174	-50.2	171.9	0	0	0	109.4	Y275 G276 L277 L418 P421 L437 L444 F453 V457	Y275-I446 PolarHBondContact O-N 2.62Å; G276-I446 CarbonylContact C-O 3.54Å; G276-I446 WeakPolarHBondContact CA-O 3.44Å; L277-I446 PolarHBondContact N-O 3.28Å; L418-I446 HydrophobicContact CB-CG1 4.35Å; L418-I446 HydrophobicContact CB-CG2 4.12Å; L418-I446 HydrophobicContact CD1-CD1 4.38Å; L418-I446 HydrophobicContact CD1-CG1 4.25Å; L418-I446 WeakPolarHBondContact O-CA 3.17Å; P421-I446 HydrophobicContact CG-CG2 3.98Å; L437-I446 HydrophobicContact CD1-CD1 4.15Å; L444-I446 HydrophobicContact CB-CD1 4.45Å; L444-I446 HydrophobicContact CB-CG1 4.34Å; L444-I446 HydrophobicContact CD1-CD1 4.43Å; L444-I446 HydrophobicContact CD2-CD1 4.41Å; L444-I446 HydrophobicContact CD2-CG1 4.44Å; I446-F453 HydrophobicContact CD1-CE1 3.89Å; I446-F453 HydrophobicContact CD1-CZ 4.17Å; I446-F453 HydrophobicContact CG2-CE1 3.92Å; I446-V457 HydrophobicContact CD1-CG1 4Å
447	V	92.4	Very high	90.6	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	128.9	161.1	176.6	0	0	0	0	107.4	L277 K285 L289 L418 D419 E420 P421	L277-V447 HydrophobicContact CB-CG2 3.87Å; L277-V447 HydrophobicContact CD2-CG2 3.73Å; L277-V447 HydrophobicContact CG-CG2 3.9Å; K285-V447 HydrophobicContact CB-CG1 4.04Å; K285-V447 HydrophobicContact CB-CG2 4Å; K285-V447 HydrophobicContact CD-CG1 3.76Å; K285-V447 HydrophobicContact CG-CG1 4.45Å; L289-V447 HydrophobicContact CD1-CG2 3.79Å; L289-V447 HydrophobicContact CG-CG2 4.31Å; L418-V447 PolarHBondContact O-N 3.26Å; D419-V447 WeakPolarHBondContact OD1-CB 3.45Å; D419-V447 WeakPolarHBondContact OD1-CG1 3.19Å; D419-V447 WeakPolarHBondContact OD1-CG2 3.39Å; E420-V447 VanDerWaalsContact CA-O 3.27Å; E420-V447 WeakPolarHBondContact CA-O 3.28Å; E420-V447 HydrophobicContact CG-CG1 3.82Å; E420-V447 PolarHBondContact N-O 3.09Å; P421-V447 WeakPolarHBondContact CD-O 3.29Å
448	S	89.1	Confident	90.7	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.119	C	C	.	.			trans	-154.4	161.1	172.3	-173.8	0	0	0	0	110.9	D450	S448-D450 PolarHBondContact OG-N 3.42Å; S448-D450 VanDerWaalsContact OG-N 3.13Å
449	H	85.3	Confident	90.8	Very high	8 Å²	8	24.8 Å²	24.8	4%	0.037	13%	0.128	C	C	.	.			trans	-107.6	-14.6	168.1	-76.5	-58.6	0	0	0	113.6	G279 N281 K285 E420 Q451 L717 I719 I722	G279-H449 PolarHBondContact O-CE1 2.8Å; N281-H449 PolarHBondContact OD1-NE2 2.88Å; K285-H449 PolarHBondContact NZ-NE2 3.07Å; E420-H449 IonicContact OE1-CD2 3.15Å; E420-H449 IonicContact OE1-NE2 2.66Å; E420-H449 IonicContact OE2-CD2 3.68Å; H449-Q451 PolarHBondContact O-N 3.22Å; H449-L717 PolarHBondContact CD2-O 3.39Å; H449-I719 HydrophobicContact CB-CG1 4.28Å; H449-I719 VanDerWaalsContact ND1-CG1 3.32Å; H449-I719 WeakPolarHBondContact ND1-CG1 3.28Å; H449-I722 HydrophobicContact CB-CD1 4.41Å
450	D	87.3	Confident	91	Very high	5 Å²	5	22.3 Å²	22.3	3%	0.027	11%	0.11	C	C	.	.			trans	-69.3	111.9	174.9	179.2	-13.4	0	0	0	110.2	T422 S448 S452 F453 L454	T422-D450 HydrophobicContact CG2-CB 4.39Å; S448-D450 PolarHBondContact OG-N 3.42Å; S448-D450 VanDerWaalsContact OG-N 3.13Å; D450-S452 VanDerWaalsContact C-N 3.34Å; D450-S452 WeakPolarHBondContact OD1-CA 3.35Å; D450-S452 WeakPolarHBondContact OD1-CB 3.45Å; D450-S452 PolarHBondContact OD1-N 2.81Å; D450-S452 PolarHBondContact OD1-OG 3.13Å; D450-S452 PolarHBondContact OD2-OG 3.35Å; D450-F453 HydrophobicContact CB-CB 3.9Å; D450-F453 VanDerWaalsContact CG-CB 3.45Å; D450-F453 PolarHBondContact OD1-N 3.27Å; D450-F453 WeakPolarHBondContact OD2-CB 3.45Å; D450-L454 WeakPolarHBondContact O-CB 3.43Å; D450-L454 WeakPolarHBondContact O-CD1 3.3Å; D450-L454 WeakPolarHBondContact O-CG 3.48Å; D450-L454 PolarHBondContact O-N 2.81Å; D450-L454 VanDerWaalsContact O-N 3.11Å
451	Q	86.8	Confident	91.2	Very high	6 Å²	6	21.6 Å²	21.6	3%	0.028	11%	0.107	C	C	.	.	H	α-helix	trans	-71.6	-28.7	-178.9	-65.2	176.3	79.5	0	0	112.6	H449 D455 Y476 I719 D723	H449-Q451 PolarHBondContact O-N 3.22Å; Q451-D455 WeakPolarHBondContact O-CB 3.32Å; Q451-D455 PolarHBondContact O-N 2.84Å; Q451-D455 VanDerWaalsContact O-N 3.08Å; Q451-Y476 HydrophobicContact CB-CD1 4.08Å; Q451-Y476 HydrophobicContact CB-CE1 4.24Å; Q451-Y476 HydrophobicContact CG-CD1 4.03Å; Q451-Y476 HydrophobicContact CG-CE1 3.69Å; Q451-Y476 VanDerWaalsContact OE1-CE1 3.29Å; Q451-I719 HydrophobicContact CG-CG2 3.36Å; Q451-D723 PolarHBondContact NE2-OD1 3.44Å
452	S	87.1	Confident	91.5	Very high	27 Å²	27	12.6 Å²	12.6	19%	0.189	7%	0.068	C	C	.	.	H	α-helix	trans	-73.6	-47	179.5	72.7	0	0	0	0	110.9	D450 L454 D455 D456	D450-S452 VanDerWaalsContact C-N 3.34Å; D450-S452 WeakPolarHBondContact OD1-CA 3.35Å; D450-S452 WeakPolarHBondContact OD1-CB 3.45Å; D450-S452 PolarHBondContact OD1-N 2.81Å; D450-S452 PolarHBondContact OD1-OG 3.13Å; D450-S452 PolarHBondContact OD2-OG 3.35Å; S452-L454 PolarHBondContact O-N 3Å; S452-D455 PolarHBondContact O-N 3.08Å; S452-D456 PolarHBondContact O-N 3.24Å
453	F	89.1	Confident	91.6	Very high	0 Å²	0	9.5 Å²	9.5	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-61.3	-42.2	174.4	179.1	-82.9	0	0	0	111.9	P421 T422 L433 N434 L437 I446 D450 D455 V457	P421-F453 HydrophobicContact CG-CZ 4.4Å; T422-F453 HydrophobicContact CG2-CD2 4.18Å; T422-F453 HydrophobicContact CG2-CG 4.34Å; L433-F453 HydrophobicContact CD2-CE2 4.02Å; L433-F453 HydrophobicContact CD2-CZ 4.36Å; L433-F453 HydrophobicContact CG-CE2 4.11Å; N434-F453 HydrophobicContact CB-CD2 4.1Å; N434-F453 HydrophobicContact CB-CE2 4.49Å; L437-F453 HydrophobicContact CD1-CE2 4.11Å; L437-F453 HydrophobicContact CD1-CZ 3.62Å; I446-F453 HydrophobicContact CD1-CE1 3.89Å; I446-F453 HydrophobicContact CD1-CZ 4.17Å; I446-F453 HydrophobicContact CG2-CE1 3.92Å; D450-F453 HydrophobicContact CB-CB 3.9Å; D450-F453 VanDerWaalsContact CG-CB 3.45Å; D450-F453 PolarHBondContact OD1-N 3.27Å; D450-F453 WeakPolarHBondContact OD2-CB 3.45Å; F453-D455 VanDerWaalsContact C-N 3.35Å; F453-D455 PolarHBondContact O-N 2.7Å; F453-V457 HydrophobicContact CD2-CG2 4.45Å; F453-V457 HydrophobicContact CE1-CG2 4.44Å; F453-V457 HydrophobicContact CE2-CG2 4.35Å; F453-V457 HydrophobicContact CZ-CG2 4.36Å; F453-V457 WeakPolarHBondContact O-CB 3.2Å; F453-V457 WeakPolarHBondContact O-CG2 3.42Å; F453-V457 PolarHBondContact O-N 3.41Å
454	L	91.4	Very high	91.4	Very high	0 Å²	0	9.3 Å²	9.3	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-66.2	-33.6	175.4	-73.5	169.2	0	0	0	113	V278 D450 S452 C458 Y476	V278-L454 HydrophobicContact CG1-CD1 3.53Å; V278-L454 HydrophobicContact CG1-CD2 4.41Å; D450-L454 WeakPolarHBondContact O-CB 3.43Å; D450-L454 WeakPolarHBondContact O-CD1 3.3Å; D450-L454 WeakPolarHBondContact O-CG 3.48Å; D450-L454 PolarHBondContact O-N 2.81Å; D450-L454 VanDerWaalsContact O-N 3.11Å; S452-L454 PolarHBondContact O-N 3Å; L454-C458 VanDerWaalsContact O-CB 3.27Å; L454-C458 WeakPolarHBondContact O-CB 3.47Å; L454-C458 PolarHBondContact O-N 2.85Å; L454-Y476 HydrophobicContact CB-CD2 4.38Å; L454-Y476 HydrophobicContact CB-CG 4.32Å; L454-Y476 HydrophobicContact CD1-CD2 4.05Å; L454-Y476 HydrophobicContact CD1-CE2 4.47Å
455	D	91.2	Very high	91	Very high	28 Å²	28	11.2 Å²	11.2	15%	0.15	6%	0.064	C	C	.	.	H	α-helix	trans	-77	-35.7	178.8	-151.7	76.2	0	0	0	113.1	Q451 S452 F453 N475 Y476 L477	Q451-D455 WeakPolarHBondContact O-CB 3.32Å; Q451-D455 PolarHBondContact O-N 2.84Å; Q451-D455 VanDerWaalsContact O-N 3.08Å; S452-D455 PolarHBondContact O-N 3.08Å; F453-D455 VanDerWaalsContact C-N 3.35Å; F453-D455 PolarHBondContact O-N 2.7Å; D455-N475 WeakPolarHBondContact OD1-CB 3.17Å; D455-N475 PolarHBondContact OD1-ND2 3.45Å; D455-N475 PolarHBondContact OD2-ND2 2.86Å; D455-Y476 PolarHBondContact OD1-N 2.88Å; D455-L477 HydrophobicContact CB-CD1 4.08Å; D455-L477 VanDerWaalsContact CG-CD1 3.48Å; D455-L477 WeakPolarHBondContact OD1-CB 3.49Å; D455-L477 VanDerWaalsContact OD1-CD1 3.24Å; D455-L477 WeakPolarHBondContact OD1-CD1 3.27Å; D455-L477 PolarHBondContact OD1-N 2.87Å
456	D	89.9	Confident	90.5	Very high	25 Å²	25	16.8 Å²	16.8	13%	0.134	9%	0.093	C	C	.	.	H	α-helix	trans	-73.1	-43.2	176.8	-77.3	-2.5	0	0	0	112.4	N434 S452 K772 K786	N434-D456 PolarHBondContact ND2-OD2 3.14Å; N434-D456 VanDerWaalsContact OD1-CB 3.23Å; N434-D456 WeakPolarHBondContact OD1-CB 3.39Å; N434-D456 PolarHBondContact OD1-OD2 2.91Å; S452-D456 PolarHBondContact O-N 3.24Å; D456-K772 IonicContact OD2-NZ 3.32Å; D456-K786 WeakPolarHBondContact OD1-CE 3.28Å; D456-K786 IonicContact OD1-NZ 3.28Å; D456-K786 PolarHBondContact OD1-NZ 3.39Å
457	V	91.6	Very high	90.2	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-92.3	-39.1	-169.7	-179.9	0	0	0	0	113.4	R274 L437 Q438 L444 I446 F453	R274-V457 PolarHBondContact NE-O 2.98Å; L437-V457 HydrophobicContact CB-CG1 3.85Å; L437-V457 HydrophobicContact CB-CG2 4.13Å; Q438-V457 HydrophobicContact CG-CG2 4.4Å; L444-V457 HydrophobicContact CD1-CG1 4.49Å; I446-V457 HydrophobicContact CD1-CG1 4Å; F453-V457 HydrophobicContact CD2-CG2 4.45Å; F453-V457 HydrophobicContact CE1-CG2 4.44Å; F453-V457 HydrophobicContact CE2-CG2 4.35Å; F453-V457 HydrophobicContact CZ-CG2 4.36Å; F453-V457 WeakPolarHBondContact O-CB 3.2Å; F453-V457 WeakPolarHBondContact O-CG2 3.42Å; F453-V457 PolarHBondContact O-N 3.41Å
458	C	93.8	Very high	90.1	Very high	8 Å²	8	23.8 Å²	23.8	5%	0.054	13%	0.125	C	C	.	.			trans	-88.3	137	-164.8	-61.9	0	0	0	0	114.3	R274 L454 I461	R274-C458 CarbonylContact O-C 3.43Å; R274-C458 WeakPolarHBondContact O-CA 3.48Å; L454-C458 VanDerWaalsContact O-CB 3.27Å; L454-C458 WeakPolarHBondContact O-CB 3.47Å; L454-C458 PolarHBondContact O-N 2.85Å; C458-I461 HydrophobicContact CB-CD1 3.93Å
459	T	92.6	Very high	90.3	Very high	51 Å²	51	24.4 Å²	24.4	31%	0.313	13%	0.128	S	C	.	.	S	Bend	trans	-90.6	-26	174.6	62	0	0	0	0	112.6	R274 G474	R274-T459 HydrophobicContact CB-CG2 4.32Å; R274-T459 PolarHBondContact N-OG1 3.42Å; R274-T459 VanDerWaalsContact N-OG1 3.08Å; R274-T459 PolarHBondContact O-N 3.32Å; R274-T459 PolarHBondContact O-OG1 2.92Å; T459-G474 CarbonylContact O-C 3.6Å; T459-G474 WeakPolarHBondContact O-CA 3.41Å; T459-G474 PolarHBondContact O-N 3.21Å
460	D	94.6	Very high	90.6	Very high	14 Å²	14	27.7 Å²	27.7	8%	0.075	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	145.2	-175.9	-59.7	-111.2	0	0	0	108.7	R273 R274 Y275 G276 Y472	R273-D460 WeakPolarHBondContact CD-OD2 3.47Å; R273-D460 IonicContact CZ-OD1 3.48Å; R273-D460 IonicContact NH1-OD1 2.79Å; R273-D460 PolarHBondContact NH1-OD1 2.85Å; R273-D460 IonicContact NH1-OD2 3.76Å; R274-D460 PolarHBondContact O-N 3.15Å; Y275-D460 WeakPolarHBondContact CA-O 3.42Å; Y275-D460 HydrophobicContact CD1-CB 3.69Å; Y275-D460 HydrophobicContact CE1-CB 3.75Å; G276-D460 PolarHBondContact N-O 2.96Å; D460-Y472 CarbonylContact C-O 3.54Å; D460-Y472 WeakPolarHBondContact CA-O 3.42Å
461	I	95.2	Very high	90.9	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.005	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	129.3	179.2	-60.7	-63.3	0	0	0	109.5	G276 V278 C458 Y472 Y476 F479	G276-I461 CarbonylContact O-C 3.55Å; G276-I461 WeakPolarHBondContact O-CA 3.28Å; V278-I461 HydrophobicContact CG2-CG2 3.46Å; V278-I461 VanDerWaalsContact CG2-CG2 3.46Å; C458-I461 HydrophobicContact CB-CD1 3.93Å; I461-Y472 PolarHBondContact N-O 2.9Å; I461-Y472 PolarHBondContact O-N 3.28Å; I461-Y476 HydrophobicContact CD1-CD2 4.38Å; I461-F479 HydrophobicContact CB-CB 4.02Å; I461-F479 HydrophobicContact CB-CG 4.2Å; I461-F479 HydrophobicContact CG1-CB 4.02Å; I461-F479 HydrophobicContact CG2-CB 4.07Å; I461-F479 HydrophobicContact CG2-CD1 3.91Å; I461-F479 HydrophobicContact CG2-CD2 4.05Å; I461-F479 HydrophobicContact CG2-CE1 4.43Å; I461-F479 HydrophobicContact CG2-CG 3.7Å
462	I	94.9	Very high	91.2	Very high	2 Å²	2	32.2 Å²	32.2	1%	0.01	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	112.4	172.9	-44.8	178.6	0	0	0	107.7	Y275 G276 L277 V278 L445 L469 Y471	Y275-I462 HydrophobicContact CD1-CD1 3.74Å; Y275-I462 HydrophobicContact CD1-CG1 3.72Å; Y275-I462 HydrophobicContact CG-CD1 4.05Å; Y275-I462 HydrophobicContact CG-CG1 4.38Å; G276-I462 PolarHBondContact O-N 2.87Å; L277-I462 WeakPolarHBondContact CA-O 3.36Å; L277-I462 HydrophobicContact CD1-CB 4.09Å; L277-I462 HydrophobicContact CD1-CG2 4.12Å; V278-I462 PolarHBondContact N-O 2.86Å; L445-I462 HydrophobicContact CD1-CD1 3.9Å; I462-L469 HydrophobicContact CG2-CB 3.9Å; I462-L469 HydrophobicContact CG2-CD1 4.47Å; I462-L469 HydrophobicContact CG2-CD2 3.78Å; I462-L469 HydrophobicContact CG2-CG 4.26Å; I462-Y471 HydrophobicContact CB-CE1 4.43Å; I462-Y471 HydrophobicContact CD1-CD1 4.39Å; I462-Y471 HydrophobicContact CD1-CE1 3.74Å; I462-Y471 HydrophobicContact CG1-CD1 3.93Å; I462-Y471 HydrophobicContact CG1-CE1 3.75Å; I462-Y471 HydrophobicContact CG2-CD1 4.33Å; I462-Y471 HydrophobicContact CG2-CE1 3.91Å
463	H	93.1	Very high	91.4	Very high	15 Å²	15	40.7 Å²	40.7	7%	0.069	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	120.4	177	-173.9	-133.6	0	0	0	110.7	V278 D465 Y470 Y472 F479 Y483	V278-H463 HydrophobicContact CG2-CB 4.46Å; V278-H463 CarbonylContact O-C 3.23Å; V278-H463 WeakPolarHBondContact O-CA 3.17Å; V278-H463 PolarHBondContact O-CD2 3.11Å; H463-D465 VanDerWaalsContact CE1-CB 3.49Å; H463-D465 WeakPolarHBondContact CE1-CB 3.25Å; H463-D465 PolarHBondContact O-N 2.88Å; H463-Y470 PolarHBondContact N-O 2.83Å; H463-Y470 PolarHBondContact O-N 3.04Å; H463-Y472 HydrophobicContact CB-CD2 4.34Å; H463-Y472 HydrophobicContact CB-CE2 3.84Å; H463-F479 HydrophobicContact CB-CE2 3.71Å; H463-F479 HydrophobicContact CB-CZ 3.96Å; H463-F479 AromaticContact CD2-CZ 3.64Å; H463-F479 AromaticContact CG-CE2 3.82Å; H463-F479 AromaticContact CG-CZ 3.68Å; H463-Y483 AromaticContact CE1-CE2 3.5Å; H463-Y483 AromaticContact CE1-CZ 3.74Å
464	L	90.3	Very high	91.5	Very high	4 Å²	4	41.8 Å²	41.8	2%	0.021	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	101.7	173.3	176.1	55.6	0	0	0	110.1	F262 L277 V278 K283 K285 L469	F262-L464 HydrophobicContact CD1-CD1 4.19Å; F262-L464 HydrophobicContact CE1-CD1 3.47Å; F262-L464 VanDerWaalsContact CE1-CD1 3.47Å; F262-L464 HydrophobicContact CE1-CD2 4.45Å; F262-L464 HydrophobicContact CZ-CD1 3.81Å; F262-L464 HydrophobicContact CZ-CD2 3.96Å; L277-L464 HydrophobicContact CD1-CB 4.29Å; V278-L464 PolarHBondContact O-N 3.14Å; K283-L464 HydrophobicContact CB-CD2 3.8Å; K283-L464 HydrophobicContact CB-CG 4.2Å; K285-L464 HydrophobicContact CG-CD2 4.01Å; L464-L469 HydrophobicContact CB-CD2 4.28Å; L464-L469 HydrophobicContact CD1-CD2 4.07Å
465	D	86.5	Confident	91.4	Very high	40 Å²	40	44 Å²	44	21%	0.214	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	147.1	-178.2	172.7	44.3	0	0	0	111.3	H463 Q467 K468 Y470	H463-D465 VanDerWaalsContact CE1-CB 3.49Å; H463-D465 WeakPolarHBondContact CE1-CB 3.25Å; H463-D465 PolarHBondContact O-N 2.88Å; D465-Q467 PolarHBondContact O-N 3.39Å; D465-Q467 VanDerWaalsContact O-N 3.13Å; D465-K468 PolarHBondContact N-O 3.26Å; D465-K468 PolarHBondContact O-N 3.19Å; D465-Y470 HydrophobicContact CB-CD2 4.16Å; D465-Y470 HydrophobicContact CB-CE2 4.08Å; D465-Y470 WeakPolarHBondContact O-CE2 3.48Å
466	N	84.6	Confident	91.3	Very high	117 Å²	117	43.4 Å²	43.4	63%	0.626	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	46.4	43.6	-179.6	-70.4	-70.2	0	0	0	113.5	K468	N466-K468 PolarHBondContact O-N 2.7Å
467	Q	88.3	Confident	91.3	Very high	81 Å²	81	46.1 Å²	46.1	38%	0.379	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.7	21	-179	-58.7	158.4	-66.4	0	0	114.7	E260 L261 F262 V263 D465	E260-Q467 VanDerWaalsContact CB-NE2 3.29Å; E260-Q467 PolarHBondContact O-NE2 3.23Å; L261-Q467 WeakPolarHBondContact O-CA 3.36Å; L261-Q467 WeakPolarHBondContact O-CB 3.32Å; F262-Q467 WeakPolarHBondContact CA-O 3.23Å; V263-Q467 HydrophobicContact CB-CB 4.42Å; V263-Q467 HydrophobicContact CG2-CB 4.3Å; V263-Q467 PolarHBondContact N-O 3.31Å; D465-Q467 PolarHBondContact O-N 3.39Å; D465-Q467 VanDerWaalsContact O-N 3.13Å
468	K	90	Very high	91.2	Very high	67 Å²	67	48.9 Å²	48.9	29%	0.291	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	160.9	-179.6	-68.1	-175.8	176.7	-179.3	0	111.6	V263 N264 D465 N466 Y470	V263-K468 WeakPolarHBondContact O-CE 3.35Å; V263-K468 WeakPolarHBondContact O-CG 3.36Å; N264-K468 WeakPolarHBondContact O-CE 3.47Å; D465-K468 PolarHBondContact N-O 3.26Å; D465-K468 PolarHBondContact O-N 3.19Å; N466-K468 PolarHBondContact O-N 2.7Å; K468-Y470 HydrophobicContact CB-CE2 4.41Å
469	L	92.6	Very high	91.1	Very high	14 Å²	14	48.7 Å²	48.7	7%	0.073	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	126	177.1	-64.3	176.2	0	0	0	109.8	F252 F262 L267 L277 L288 I462 L464 Y471	F252-L469 HydrophobicContact CE1-CD1 4.28Å; F252-L469 HydrophobicContact CZ-CD1 4.07Å; F262-L469 HydrophobicContact CE1-CD1 4.45Å; F262-L469 HydrophobicContact CE1-CD2 3.88Å; F262-L469 HydrophobicContact CE1-CG 4.08Å; L267-L469 HydrophobicContact CD1-CD1 3.93Å; L277-L469 HydrophobicContact CD1-CD2 4.06Å; L288-L469 HydrophobicContact CD2-CD1 3.99Å; L288-L469 HydrophobicContact CD2-CD2 4.29Å; I462-L469 HydrophobicContact CG2-CB 3.9Å; I462-L469 HydrophobicContact CG2-CD1 4.47Å; I462-L469 HydrophobicContact CG2-CD2 3.78Å; I462-L469 HydrophobicContact CG2-CG 4.26Å; L464-L469 HydrophobicContact CB-CD2 4.28Å; L464-L469 HydrophobicContact CD1-CD2 4.07Å; L469-Y471 HydrophobicContact CB-CE2 4.11Å
470	Y	92.1	Very high	90.9	Very high	77 Å²	77	49 Å²	49	30%	0.302	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	124.4	175.8	-63.3	-79.4	0	0	0	110.9	H463 D465 K468 Y472	H463-Y470 PolarHBondContact N-O 2.83Å; H463-Y470 PolarHBondContact O-N 3.04Å; D465-Y470 HydrophobicContact CB-CD2 4.16Å; D465-Y470 HydrophobicContact CB-CE2 4.08Å; D465-Y470 WeakPolarHBondContact O-CE2 3.48Å; K468-Y470 HydrophobicContact CB-CE2 4.41Å; Y470-Y472 WeakPolarHBondContact O-CD2 3.47Å; Y470-Y472 WeakPolarHBondContact O-CE2 3.44Å
471	Y	93.3	Very high	90.7	Very high	71 Å²	71	55.1 Å²	55.1	28%	0.278	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	131.6	-177.1	-60.5	-90.7	0	0	0	111.6	D266 L267 L268 Y275 I462 L469	D266-Y471 WeakPolarHBondContact O-CE2 3.43Å; D266-Y471 PolarHBondContact O-OH 2.85Å; L267-Y471 VanDerWaalsContact CA-OH 3.28Å; L267-Y471 WeakPolarHBondContact CA-OH 3.37Å; L268-Y471 HydrophobicContact CB-CE1 3.98Å; L268-Y471 HydrophobicContact CB-CE2 4.25Å; L268-Y471 HydrophobicContact CD1-CD2 4.28Å; L268-Y471 HydrophobicContact CD1-CE2 4.18Å; L268-Y471 HydrophobicContact CG-CE2 4.21Å; L268-Y471 PolarHBondContact N-OH 3.39Å; L268-Y471 WeakPolarHBondContact O-CE1 3.37Å; Y275-Y471 HydrophobicContact CE1-CD1 4.47Å; I462-Y471 HydrophobicContact CB-CE1 4.43Å; I462-Y471 HydrophobicContact CD1-CD1 4.39Å; I462-Y471 HydrophobicContact CD1-CE1 3.74Å; I462-Y471 HydrophobicContact CG1-CD1 3.93Å; I462-Y471 HydrophobicContact CG1-CE1 3.75Å; I462-Y471 HydrophobicContact CG2-CD1 4.33Å; I462-Y471 HydrophobicContact CG2-CE1 3.91Å; L469-Y471 HydrophobicContact CB-CE2 4.11Å
472	Y	93.3	Very high	90.4	Very high	34 Å²	34	59.8 Å²	59.8	13%	0.133	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	133.7	173.4	-57	-93.4	0	0	0	108.6	D460 I461 H463 Y470 F479 M482 K486	D460-Y472 CarbonylContact C-O 3.54Å; D460-Y472 WeakPolarHBondContact CA-O 3.42Å; I461-Y472 PolarHBondContact N-O 2.9Å; I461-Y472 PolarHBondContact O-N 3.28Å; H463-Y472 HydrophobicContact CB-CD2 4.34Å; H463-Y472 HydrophobicContact CB-CE2 3.84Å; Y470-Y472 WeakPolarHBondContact O-CD2 3.47Å; Y470-Y472 WeakPolarHBondContact O-CE2 3.44Å; Y472-F479 HydrophobicContact CD1-CD2 4.3Å; Y472-F479 AromaticContact CD2-CD2 3.48Å; Y472-F479 HydrophobicContact CD2-CD2 3.48Å; Y472-F479 VanDerWaalsContact CD2-CD2 3.48Å; Y472-F479 AromaticContact CD2-CE2 3.81Å; Y472-F479 HydrophobicContact CD2-CE2 3.81Å; Y472-F479 AromaticContact CE2-CD2 3.85Å; Y472-F479 HydrophobicContact CE2-CD2 3.85Å; Y472-F479 AromaticContact CE2-CE2 3.7Å; Y472-F479 HydrophobicContact CE2-CE2 3.7Å; Y472-F479 AromaticContact CG-CD2 3.74Å; Y472-F479 HydrophobicContact CG-CD2 3.74Å; Y472-F479 HydrophobicContact CG-CE2 4.44Å; Y472-M482 HydrophobicContact CD1-CB 4.43Å; Y472-K486 PolarHBondContact OH-NZ 3.16Å
473	R	91.5	Very high	90.1	Very high	205 Å²	205	61.9 Å²	61.9	77%	0.774	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.3	137	177.8	-172.8	179.7	180	-169.4	-1.8	109.9
474	G	90.6	Very high	89.8	Confident	23 Å²	23	64.1 Å²	64.1	24%	0.237	30%	0.303	C	S	.	.	S	Bend	trans	107.9	175.5	-174.7	0	0	0	0	0	112.8	T459	T459-G474 CarbonylContact O-C 3.6Å; T459-G474 WeakPolarHBondContact O-CA 3.41Å; T459-G474 PolarHBondContact O-N 3.21Å
475	N	89.7	Confident	89.7	Confident	46 Å²	46	70.1 Å²	70.1	25%	0.246	33%	0.33	C	S	.	.			trans	-68.5	171.6	-178	68.6	-14	0	0	0	113.6	D455 L477 T478 F479	D455-N475 WeakPolarHBondContact OD1-CB 3.17Å; D455-N475 PolarHBondContact OD1-ND2 3.45Å; D455-N475 PolarHBondContact OD2-ND2 2.86Å; N475-L477 PolarHBondContact O-N 3.44Å; N475-T478 WeakPolarHBondContact O-CB 3.26Å; N475-T478 PolarHBondContact O-N 3Å; N475-T478 VanDerWaalsContact O-N 3.08Å; N475-T478 WeakPolarHBondContact OD1-CB 3.49Å; N475-T478 PolarHBondContact OD1-N 3.31Å; N475-T478 VanDerWaalsContact OD1-N 3.13Å; N475-T478 PolarHBondContact OD1-OG1 3.26Å; N475-F479 PolarHBondContact O-N 3.37Å
476	Y	89.8	Confident	89.7	Confident	16 Å²	16	72.1 Å²	72.1	6%	0.063	34%	0.337	C	S	.	.	H	α-helix	trans	-60	-39.4	-176.6	-173.5	-92	0	0	0	113.3	V278 Q451 L454 D455 I461 T478 F479 K480 I719	V278-Y476 HydrophobicContact CB-CE2 4.45Å; V278-Y476 HydrophobicContact CG1-CD2 4.25Å; V278-Y476 HydrophobicContact CG1-CE2 4.06Å; V278-Y476 HydrophobicContact CG2-CE2 4.32Å; Q451-Y476 HydrophobicContact CB-CD1 4.08Å; Q451-Y476 HydrophobicContact CB-CE1 4.24Å; Q451-Y476 HydrophobicContact CG-CD1 4.03Å; Q451-Y476 HydrophobicContact CG-CE1 3.69Å; Q451-Y476 VanDerWaalsContact OE1-CE1 3.29Å; L454-Y476 HydrophobicContact CB-CD2 4.38Å; L454-Y476 HydrophobicContact CB-CG 4.32Å; L454-Y476 HydrophobicContact CD1-CD2 4.05Å; L454-Y476 HydrophobicContact CD1-CE2 4.47Å; D455-Y476 PolarHBondContact OD1-N 2.88Å; I461-Y476 HydrophobicContact CD1-CD2 4.38Å; Y476-T478 VanDerWaalsContact C-N 3.3Å; Y476-T478 PolarHBondContact O-N 3.12Å; Y476-F479 AromaticContact CD2-CD1 3.84Å; Y476-F479 HydrophobicContact CD2-CD1 3.84Å; Y476-F479 HydrophobicContact CD2-CE1 4.42Å; Y476-F479 AromaticContact CE2-CD1 3.54Å; Y476-F479 HydrophobicContact CE2-CD1 3.54Å; Y476-F479 AromaticContact CE2-CE1 3.69Å; Y476-F479 HydrophobicContact CE2-CE1 3.69Å; Y476-F479 WeakPolarHBondContact O-CB 3.49Å; Y476-F479 PolarHBondContact O-N 2.82Å; Y476-K480 HydrophobicContact CE1-CB 4.23Å; Y476-K480 HydrophobicContact CE1-CD 4.01Å; Y476-K480 HydrophobicContact CE1-CG 4.49Å; Y476-K480 WeakPolarHBondContact O-CB 3.3Å; Y476-K480 PolarHBondContact O-N 3.14Å; Y476-I719 HydrophobicContact CE2-CD1 3.86Å
477	L	88.6	Confident	89.6	Confident	83 Å²	83	69.5 Å²	69.5	44%	0.435	32%	0.321	S	S	.	.	H	α-helix	trans	-63.1	-35.2	175.4	-91.8	82.5	0	0	0	112.4	D455 N475 K481	D455-L477 HydrophobicContact CB-CD1 4.08Å; D455-L477 VanDerWaalsContact CG-CD1 3.48Å; D455-L477 WeakPolarHBondContact OD1-CB 3.49Å; D455-L477 VanDerWaalsContact OD1-CD1 3.24Å; D455-L477 WeakPolarHBondContact OD1-CD1 3.27Å; D455-L477 PolarHBondContact OD1-N 2.87Å; N475-L477 PolarHBondContact O-N 3.44Å; L477-K481 WeakPolarHBondContact O-CD 3.32Å; L477-K481 VanDerWaalsContact O-CG 3.27Å; L477-K481 WeakPolarHBondContact O-CG 3.41Å; L477-K481 PolarHBondContact O-N 2.97Å; L477-K481 VanDerWaalsContact O-N 3.14Å
478	T	90.6	Very high	89.5	Confident	57 Å²	57	72 Å²	72	35%	0.35	33%	0.331	S	S	.	.	H	α-helix	trans	-68.8	-43.5	174.5	-62.6	0	0	0	0	110.8	N475 Y476 K481 M482	N475-T478 WeakPolarHBondContact O-CB 3.26Å; N475-T478 PolarHBondContact O-N 3Å; N475-T478 VanDerWaalsContact O-N 3.08Å; N475-T478 WeakPolarHBondContact OD1-CB 3.49Å; N475-T478 PolarHBondContact OD1-N 3.31Å; N475-T478 VanDerWaalsContact OD1-N 3.13Å; N475-T478 PolarHBondContact OD1-OG1 3.26Å; Y476-T478 VanDerWaalsContact C-N 3.3Å; Y476-T478 PolarHBondContact O-N 3.12Å; T478-K481 PolarHBondContact O-N 2.76Å; T478-M482 WeakPolarHBondContact O-CB 3.41Å; T478-M482 VanDerWaalsContact O-CG 3.32Å; T478-M482 WeakPolarHBondContact O-CG 3.44Å; T478-M482 PolarHBondContact O-N 2.86Å
479	F	91.9	Very high	89.4	Confident	5 Å²	5	74 Å²	74	2%	0.022	34%	0.341	C	S	.	.	H	α-helix	trans	-56.5	-51.3	171.3	158.9	-105.5	0	0	0	111.9	V278 I461 H463 Y472 N475 Y476 K481 M482 Y483	V278-F479 HydrophobicContact CG2-CD1 4.47Å; V278-F479 HydrophobicContact CG2-CE1 3.94Å; V278-F479 HydrophobicContact CG2-CZ 4.2Å; I461-F479 HydrophobicContact CB-CB 4.02Å; I461-F479 HydrophobicContact CB-CG 4.2Å; I461-F479 HydrophobicContact CG1-CB 4.02Å; I461-F479 HydrophobicContact CG2-CB 4.07Å; I461-F479 HydrophobicContact CG2-CD1 3.91Å; I461-F479 HydrophobicContact CG2-CD2 4.05Å; I461-F479 HydrophobicContact CG2-CE1 4.43Å; I461-F479 HydrophobicContact CG2-CG 3.7Å; H463-F479 HydrophobicContact CB-CE2 3.71Å; H463-F479 HydrophobicContact CB-CZ 3.96Å; H463-F479 AromaticContact CD2-CZ 3.64Å; H463-F479 AromaticContact CG-CE2 3.82Å; H463-F479 AromaticContact CG-CZ 3.68Å; Y472-F479 HydrophobicContact CD1-CD2 4.3Å; Y472-F479 AromaticContact CD2-CD2 3.48Å; Y472-F479 HydrophobicContact CD2-CD2 3.48Å; Y472-F479 VanDerWaalsContact CD2-CD2 3.48Å; Y472-F479 AromaticContact CD2-CE2 3.81Å; Y472-F479 HydrophobicContact CD2-CE2 3.81Å; Y472-F479 AromaticContact CE2-CD2 3.85Å; Y472-F479 HydrophobicContact CE2-CD2 3.85Å; Y472-F479 AromaticContact CE2-CE2 3.7Å; Y472-F479 HydrophobicContact CE2-CE2 3.7Å; Y472-F479 AromaticContact CG-CD2 3.74Å; Y472-F479 HydrophobicContact CG-CD2 3.74Å; Y472-F479 HydrophobicContact CG-CE2 4.44Å; N475-F479 PolarHBondContact O-N 3.37Å; Y476-F479 AromaticContact CD2-CD1 3.84Å; Y476-F479 HydrophobicContact CD2-CD1 3.84Å; Y476-F479 HydrophobicContact CD2-CE1 4.42Å; Y476-F479 AromaticContact CE2-CD1 3.54Å; Y476-F479 HydrophobicContact CE2-CD1 3.54Å; Y476-F479 AromaticContact CE2-CE1 3.69Å; Y476-F479 HydrophobicContact CE2-CE1 3.69Å; Y476-F479 WeakPolarHBondContact O-CB 3.49Å; Y476-F479 PolarHBondContact O-N 2.82Å; F479-K481 VanDerWaalsContact C-N 3.33Å; F479-K481 PolarHBondContact O-N 2.95Å; F479-M482 PolarHBondContact O-N 3.04Å; F479-M482 VanDerWaalsContact O-N 3.14Å; F479-Y483 HydrophobicContact CE2-CG 4.27Å; F479-Y483 HydrophobicContact CZ-CD1 4.5Å; F479-Y483 HydrophobicContact CZ-CG 4.18Å; F479-Y483 VanDerWaalsContact O-CB 3.32Å; F479-Y483 WeakPolarHBondContact O-CB 3.12Å; F479-Y483 PolarHBondContact O-N 3.4Å
480	K	88.4	Confident	89	Confident	57 Å²	57	76.2 Å²	76.2	25%	0.248	35%	0.353	C	S	.	.	H	α-helix	trans	-57.2	-43.8	-178.4	-165	175.2	-165.2	167.3	0	111.6	Y476 Y483 V484 D723	Y476-K480 HydrophobicContact CE1-CB 4.23Å; Y476-K480 HydrophobicContact CE1-CD 4.01Å; Y476-K480 HydrophobicContact CE1-CG 4.49Å; Y476-K480 WeakPolarHBondContact O-CB 3.3Å; Y476-K480 PolarHBondContact O-N 3.14Å; K480-Y483 PolarHBondContact O-N 3.13Å; K480-V484 WeakPolarHBondContact O-CB 3.1Å; K480-V484 WeakPolarHBondContact O-CG2 3.13Å; K480-V484 PolarHBondContact O-N 2.98Å; K480-D723 WeakPolarHBondContact CE-OD2 3.35Å; K480-D723 IonicContact NZ-OD1 2.62Å; K480-D723 PolarHBondContact NZ-OD1 3.13Å; K480-D723 IonicContact NZ-OD2 3.32Å; K480-D723 PolarHBondContact NZ-OD2 3.16Å
481	K	89.8	Confident	88.6	Confident	142 Å²	142	75 Å²	75	62%	0.617	35%	0.35	S	S	*	.	H	α-helix	trans	-61.6	-49.6	174.6	-71.3	166.2	-173.6	171.5	0	112.1	L477 T478 F479 Y483 V484 Q485	L477-K481 WeakPolarHBondContact O-CD 3.32Å; L477-K481 VanDerWaalsContact O-CG 3.27Å; L477-K481 WeakPolarHBondContact O-CG 3.41Å; L477-K481 PolarHBondContact O-N 2.97Å; L477-K481 VanDerWaalsContact O-N 3.14Å; T478-K481 PolarHBondContact O-N 2.76Å; F479-K481 VanDerWaalsContact C-N 3.33Å; F479-K481 PolarHBondContact O-N 2.95Å; K481-Y483 PolarHBondContact O-N 3.38Å; K481-V484 PolarHBondContact O-N 3.27Å; K481-Q485 WeakPolarHBondContact O-CB 3.47Å; K481-Q485 PolarHBondContact O-N 3.03Å
482	M	88.8	Confident	88.3	Confident	99 Å²	99	78.3 Å²	78.3	49%	0.488	37%	0.366	S	S	.	.	H	α-helix	trans	-64.6	-37.8	179.2	-71.4	-66	-73.2	0	0	112.5	Y472 T478 F479 Q485 K486	Y472-M482 HydrophobicContact CD1-CB 4.43Å; T478-M482 WeakPolarHBondContact O-CB 3.41Å; T478-M482 VanDerWaalsContact O-CG 3.32Å; T478-M482 WeakPolarHBondContact O-CG 3.44Å; T478-M482 PolarHBondContact O-N 2.86Å; F479-M482 PolarHBondContact O-N 3.04Å; F479-M482 VanDerWaalsContact O-N 3.14Å; M482-Q485 PolarHBondContact O-N 2.87Å; M482-K486 WeakPolarHBondContact O-CB 3.33Å; M482-K486 PolarHBondContact O-N 3.47Å
483	Y	88.1	Confident	87.8	Confident	46 Å²	46	81.3 Å²	81.3	18%	0.18	38%	0.381	C	S	.	.	H	α-helix	trans	-67	-47	177.2	179.3	-118.2	0	0	0	111.9	H463 F479 K480 K481 Q485 K486 Q487	H463-Y483 AromaticContact CE1-CE2 3.5Å; H463-Y483 AromaticContact CE1-CZ 3.74Å; F479-Y483 HydrophobicContact CE2-CG 4.27Å; F479-Y483 HydrophobicContact CZ-CD1 4.5Å; F479-Y483 HydrophobicContact CZ-CG 4.18Å; F479-Y483 VanDerWaalsContact O-CB 3.32Å; F479-Y483 WeakPolarHBondContact O-CB 3.12Å; F479-Y483 PolarHBondContact O-N 3.4Å; K480-Y483 PolarHBondContact O-N 3.13Å; K481-Y483 PolarHBondContact O-N 3.38Å; Y483-Q485 VanDerWaalsContact C-N 3.29Å; Y483-Q485 PolarHBondContact O-N 3.19Å; Y483-K486 WeakPolarHBondContact O-CB 3.49Å; Y483-K486 PolarHBondContact O-N 3.29Å; Y483-K486 VanDerWaalsContact O-N 3.16Å; Y483-Q487 HydrophobicContact CD2-CG 4.31Å; Y483-Q487 HydrophobicContact CE1-CG 4.3Å; Y483-Q487 HydrophobicContact CE2-CG 3.91Å; Y483-Q487 WeakPolarHBondContact O-CG 3.47Å; Y483-Q487 PolarHBondContact O-N 2.79Å; Y483-Q487 PolarHBondContact OH-NE2 3.25Å
484	V	86.8	Confident	87.5	Confident	63 Å²	63	73.7 Å²	73.7	38%	0.382	35%	0.353	S	S	.	.	H	α-helix	trans	-61.7	-36.9	174.5	169.8	0	0	0	0	111.5	K480 K481 K488	K480-V484 WeakPolarHBondContact O-CB 3.1Å; K480-V484 WeakPolarHBondContact O-CG2 3.13Å; K480-V484 PolarHBondContact O-N 2.98Å; K481-V484 PolarHBondContact O-N 3.27Å; V484-K488 HydrophobicContact CG1-CD 3.97Å; V484-K488 WeakPolarHBondContact O-CB 2.97Å; V484-K488 VanDerWaalsContact O-CG 3.28Å; V484-K488 WeakPolarHBondContact O-CG 3.47Å; V484-K488 PolarHBondContact O-N 3.36Å
485	Q	88.3	Confident	87.3	Confident	129 Å²	129	76 Å²	76	60%	0.603	36%	0.359	S	S	*	.	H	α-helix	trans	-64.5	-46.7	172.6	179.6	172.7	-21.3	0	0	111.9	K481 M482 Y483 Q487 K488 E489	K481-Q485 WeakPolarHBondContact O-CB 3.47Å; K481-Q485 PolarHBondContact O-N 3.03Å; M482-Q485 PolarHBondContact O-N 2.87Å; Y483-Q485 VanDerWaalsContact C-N 3.29Å; Y483-Q485 PolarHBondContact O-N 3.19Å; Q485-Q487 PolarHBondContact O-N 2.76Å; Q485-K488 PolarHBondContact O-N 2.81Å; Q485-E489 PolarHBondContact O-N 3.46Å
486	K	86.9	Confident	87.2	Confident	82 Å²	82	80.6 Å²	80.6	36%	0.357	38%	0.377	S	S	.	.	H	α-helix	trans	-60.2	-43.4	177.6	-170.6	-175.1	-174.8	-171.7	0	111.8	Y472 M482 Y483 E489 L490	Y472-K486 PolarHBondContact OH-NZ 3.16Å; M482-K486 WeakPolarHBondContact O-CB 3.33Å; M482-K486 PolarHBondContact O-N 3.47Å; Y483-K486 WeakPolarHBondContact O-CB 3.49Å; Y483-K486 PolarHBondContact O-N 3.29Å; Y483-K486 VanDerWaalsContact O-N 3.16Å; K486-E489 PolarHBondContact O-N 3.12Å; K486-L490 WeakPolarHBondContact O-CB 3.32Å; K486-L490 PolarHBondContact O-N 3.03Å
487	Q	83.3	Confident	86.8	Confident	63 Å²	63	81 Å²	81	29%	0.294	38%	0.38	S	S	.	.	H	α-helix	trans	-65.2	-44.3	175.2	-70.7	-67.2	8.9	0	0	111.9	Y483 Q485 E489 L490 Q491	Y483-Q487 HydrophobicContact CD2-CG 4.31Å; Y483-Q487 HydrophobicContact CE1-CG 4.3Å; Y483-Q487 HydrophobicContact CE2-CG 3.91Å; Y483-Q487 WeakPolarHBondContact O-CG 3.47Å; Y483-Q487 PolarHBondContact O-N 2.79Å; Y483-Q487 PolarHBondContact OH-NE2 3.25Å; Q485-Q487 PolarHBondContact O-N 2.76Å; Q487-E489 VanDerWaalsContact C-N 3.25Å; Q487-E489 PolarHBondContact O-N 2.94Å; Q487-L490 PolarHBondContact O-N 3.3Å; Q487-Q491 WeakPolarHBondContact O-CB 3.49Å; Q487-Q491 PolarHBondContact O-N 2.77Å
488	K	85.5	Confident	86.5	Confident	132 Å²	132	80.2 Å²	80.2	57%	0.574	37%	0.374	S	S	*	.	H	α-helix	trans	-63.5	-28.2	174.9	-75.7	172.1	-179.6	173	0	113	V484 Q485 K492	V484-K488 HydrophobicContact CG1-CD 3.97Å; V484-K488 WeakPolarHBondContact O-CB 2.97Å; V484-K488 VanDerWaalsContact O-CG 3.28Å; V484-K488 WeakPolarHBondContact O-CG 3.47Å; V484-K488 PolarHBondContact O-N 3.36Å; Q485-K488 PolarHBondContact O-N 2.81Å; K488-K492 VanDerWaalsContact O-CD 3.32Å; K488-K492 WeakPolarHBondContact O-CD 3.4Å; K488-K492 VanDerWaalsContact O-CG 3.23Å; K488-K492 WeakPolarHBondContact O-CG 3.48Å; K488-K492 PolarHBondContact O-N 2.66Å
489	E	86.9	Confident	86.3	Confident	110 Å²	110	83.7 Å²	83.7	51%	0.514	38%	0.384	S	S	.	.	H	α-helix	trans	-75.1	-48.4	170.4	-163.2	-170.5	150.4	0	0	111.6	Q485 K486 Q487 Q491 K492 Q493	Q485-E489 PolarHBondContact O-N 3.46Å; K486-E489 PolarHBondContact O-N 3.12Å; Q487-E489 VanDerWaalsContact C-N 3.25Å; Q487-E489 PolarHBondContact O-N 2.94Å; E489-Q491 VanDerWaalsContact C-N 3.32Å; E489-Q491 PolarHBondContact O-N 2.82Å; E489-K492 CarbonylContact O-C 3.51Å; E489-K492 WeakPolarHBondContact O-CA 3.28Å; E489-K492 WeakPolarHBondContact O-CB 3.42Å; E489-K492 PolarHBondContact O-N 3.46Å; E489-Q493 HydrophobicContact CG-CG 4.47Å; E489-Q493 WeakPolarHBondContact O-CG 3.38Å; E489-Q493 PolarHBondContact O-N 3.37Å; E489-Q493 PolarHBondContact OE1-NE2 3.16Å
490	L	84.4	Confident	85.9	Confident	60 Å²	60	88.4 Å²	88.4	31%	0.314	41%	0.405	S	S	.	.	H	α-helix	trans	-62.3	-38.1	-177.6	-167.2	145.6	0	0	0	112	K486 Q487 Q493 Y494 L546 P549	K486-L490 WeakPolarHBondContact O-CB 3.32Å; K486-L490 PolarHBondContact O-N 3.03Å; Q487-L490 PolarHBondContact O-N 3.3Å; L490-Q493 PolarHBondContact O-N 3.31Å; L490-Y494 WeakPolarHBondContact O-CB 3.38Å; L490-Y494 PolarHBondContact O-N 2.66Å; L490-L546 HydrophobicContact CG-CD2 4.45Å; L490-P549 HydrophobicContact CD2-CG 3.7Å
491	Q	83.6	Confident	85.5	Confident	51 Å²	51	86.6 Å²	86.6	24%	0.238	40%	0.398	C	S	.	.	H	α-helix	trans	-60	-49	169.6	-174	62.6	45.4	0	0	111.5	Q487 E489 Q493 Y494 D495 P549	Q487-Q491 WeakPolarHBondContact O-CB 3.49Å; Q487-Q491 PolarHBondContact O-N 2.77Å; E489-Q491 VanDerWaalsContact C-N 3.32Å; E489-Q491 PolarHBondContact O-N 2.82Å; Q491-Q493 VanDerWaalsContact C-N 3.26Å; Q491-Q493 PolarHBondContact O-N 3.42Å; Q491-Y494 CarbonylContact O-C 3.56Å; Q491-Y494 WeakPolarHBondContact O-CA 3.4Å; Q491-Y494 WeakPolarHBondContact O-CB 3.27Å; Q491-Y494 PolarHBondContact O-N 2.98Å; Q491-D495 PolarHBondContact NE2-OD1 3.23Å; Q491-D495 PolarHBondContact O-N 2.86Å; Q491-P549 VanDerWaalsContact OE1-CG 3.26Å
492	K	86.9	Confident	85.2	Confident	142 Å²	142	85.3 Å²	85.3	62%	0.617	39%	0.392	S	S	*	.	H	α-helix	trans	-62.4	-32	176.7	-71.8	169.9	-173.6	175.5	0	112.9	K488 E489 K496	K488-K492 VanDerWaalsContact O-CD 3.32Å; K488-K492 WeakPolarHBondContact O-CD 3.4Å; K488-K492 VanDerWaalsContact O-CG 3.23Å; K488-K492 WeakPolarHBondContact O-CG 3.48Å; K488-K492 PolarHBondContact O-N 2.66Å; E489-K492 CarbonylContact O-C 3.51Å; E489-K492 WeakPolarHBondContact O-CA 3.28Å; E489-K492 WeakPolarHBondContact O-CB 3.42Å; E489-K492 PolarHBondContact O-N 3.46Å; K492-K496 WeakPolarHBondContact O-CB 3.24Å; K492-K496 PolarHBondContact O-N 3.01Å
493	Q	84.3	Confident	85	Confident	96 Å²	96	85.6 Å²	85.6	45%	0.449	39%	0.392	S	S	.	.	H	α-helix	trans	-69.8	-42.6	172.8	-66.9	-170.2	24.1	0	0	111	E489 L490 Q491 K496 Q497 L546	E489-Q493 HydrophobicContact CG-CG 4.47Å; E489-Q493 WeakPolarHBondContact O-CG 3.38Å; E489-Q493 PolarHBondContact O-N 3.37Å; E489-Q493 PolarHBondContact OE1-NE2 3.16Å; L490-Q493 PolarHBondContact O-N 3.31Å; Q491-Q493 VanDerWaalsContact C-N 3.26Å; Q491-Q493 PolarHBondContact O-N 3.42Å; Q493-K496 PolarHBondContact O-N 2.93Å; Q493-Q497 WeakPolarHBondContact O-CB 3.29Å; Q493-Q497 PolarHBondContact O-N 2.89Å; Q493-L546 HydrophobicContact CB-CD1 3.76Å
494	Y	84.4	Confident	84.5	Confident	45 Å²	45	85.5 Å²	85.5	18%	0.176	39%	0.394	C	S	.	.	H	α-helix	trans	-60	-52.8	173.4	176	-93.1	0	0	0	111.8	L490 Q491 K496 Q497 E498 L546 R548	L490-Y494 WeakPolarHBondContact O-CB 3.38Å; L490-Y494 PolarHBondContact O-N 2.66Å; Q491-Y494 CarbonylContact O-C 3.56Å; Q491-Y494 WeakPolarHBondContact O-CA 3.4Å; Q491-Y494 WeakPolarHBondContact O-CB 3.27Å; Q491-Y494 PolarHBondContact O-N 2.98Å; Y494-K496 PolarHBondContact O-N 3.45Å; Y494-Q497 CarbonylContact O-C 3.56Å; Y494-Q497 WeakPolarHBondContact O-CA 3.3Å; Y494-Q497 WeakPolarHBondContact O-CB 3.49Å; Y494-Q497 PolarHBondContact O-N 3.2Å; Y494-E498 HydrophobicContact CE1-CB 4.33Å; Y494-E498 PolarHBondContact O-N 2.9Å; Y494-L546 HydrophobicContact CD2-CB 4.04Å; Y494-L546 VanDerWaalsContact CD2-O 3.25Å; Y494-L546 WeakPolarHBondContact CD2-O 3.15Å; Y494-L546 VanDerWaalsContact CE2-O 3.27Å; Y494-L546 WeakPolarHBondContact CE2-O 3.22Å; Y494-R548 HydrophobicContact CE1-CB 4.16Å; Y494-R548 HydrophobicContact CE1-CG 4.04Å; Y494-R548 HydrophobicContact CE2-CB 3.98Å
495	D	86.1	Confident	84.1	Confident	71 Å²	71	86.6 Å²	86.6	38%	0.38	39%	0.394	S	S	.	.	H	α-helix	trans	-56.3	-39.5	178.7	-58.3	-29.3	0	0	0	111.5	Q491 Q497 K499	Q491-D495 PolarHBondContact NE2-OD1 3.23Å; Q491-D495 PolarHBondContact O-N 2.86Å; D495-Q497 VanDerWaalsContact C-N 3.33Å; D495-K499 WeakPolarHBondContact O-CB 3.5Å; D495-K499 PolarHBondContact O-N 3.03Å
496	K	87.2	Confident	83.6	Confident	144 Å²	144	84.8 Å²	84.8	63%	0.626	40%	0.401	S	S	*	.	H	α-helix	trans	-74.7	-20.7	178.1	-170.5	173.1	-172	171	0	113.3	K492 Q493 Y494 K500	K492-K496 WeakPolarHBondContact O-CB 3.24Å; K492-K496 PolarHBondContact O-N 3.01Å; Q493-K496 PolarHBondContact O-N 2.93Å; Y494-K496 PolarHBondContact O-N 3.45Å; K496-K500 WeakPolarHBondContact O-CD 3.22Å; K496-K500 WeakPolarHBondContact O-CG 3.41Å
497	Q	81.2	Confident	83.1	Confident	23 Å²	23	83.6 Å²	83.6	11%	0.107	41%	0.413	C	S	.	.	H	α-helix	trans	-82.9	-45.9	170.1	-176	166.7	14.9	0	0	110.4	Q493 Y494 D495 K500 L501 T518 L545	Q493-Q497 WeakPolarHBondContact O-CB 3.29Å; Q493-Q497 PolarHBondContact O-N 2.89Å; Y494-Q497 CarbonylContact O-C 3.56Å; Y494-Q497 WeakPolarHBondContact O-CA 3.3Å; Y494-Q497 WeakPolarHBondContact O-CB 3.49Å; Y494-Q497 PolarHBondContact O-N 3.2Å; D495-Q497 VanDerWaalsContact C-N 3.33Å; Q497-K500 PolarHBondContact O-N 2.91Å; Q497-L501 WeakPolarHBondContact O-CB 3.15Å; Q497-L501 PolarHBondContact O-N 2.93Å; Q497-T518 HydrophobicContact CG-CG2 4.26Å; Q497-L545 VanDerWaalsContact NE2-CD2 3.26Å
498	E	84.1	Confident	82.4	Confident	67 Å²	67	84 Å²	84	31%	0.313	43%	0.434	S	S	.	.	H	α-helix	trans	-64.3	-42.4	178.8	-158	-140.4	-175.8	0	0	111.7	Y494 K500 L501 K502	Y494-E498 HydrophobicContact CE1-CB 4.33Å; Y494-E498 PolarHBondContact O-N 2.9Å; E498-K500 PolarHBondContact O-N 3.43Å; E498-L501 CarbonylContact O-C 3.56Å; E498-L501 PolarHBondContact O-N 3.15Å; E498-L501 VanDerWaalsContact O-N 3.11Å; E498-K502 WeakPolarHBondContact O-CG 3.15Å; E498-K502 PolarHBondContact O-N 3.42Å; E498-K502 WeakPolarHBondContact OE1-CE 3.37Å; E498-K502 IonicContact OE1-NZ 2.71Å; E498-K502 PolarHBondContact OE1-NZ 3.19Å; E498-K502 WeakPolarHBondContact OE2-CE 3.38Å; E498-K502 IonicContact OE2-NZ 2.55Å; E498-K502 PolarHBondContact OE2-NZ 2.61Å
499	K	86.1	Confident	81.7	Confident	131 Å²	131	81.2 Å²	81.2	57%	0.57	42%	0.421	S	S	*	.	H	α-helix	trans	-58.5	-46	174.4	-178.6	171.9	176.8	173.6	0	112.2	D495 L501 K502 E503	D495-K499 WeakPolarHBondContact O-CB 3.5Å; D495-K499 PolarHBondContact O-N 3.03Å; K499-L501 VanDerWaalsContact C-N 3.27Å; K499-L501 PolarHBondContact O-N 3.15Å; K499-K502 WeakPolarHBondContact O-CB 3.47Å; K499-K502 PolarHBondContact O-N 3.11Å; K499-E503 WeakPolarHBondContact CE-OE1 3.27Å; K499-E503 WeakPolarHBondContact CG-OE1 3.2Å; K499-E503 VanDerWaalsContact O-CG 3.3Å; K499-E503 WeakPolarHBondContact O-CG 3.47Å; K499-E503 PolarHBondContact O-N 3.32Å
500	K	82.7	Confident	80.8	Confident	103 Å²	103	79.4 Å²	79.4	45%	0.448	42%	0.421	S	S	.	.	H	α-helix	trans	-62.9	-35.1	174.7	-72.3	171.8	-174.6	167.9	0	112.7	K496 Q497 E498 E503 L504	K496-K500 WeakPolarHBondContact O-CD 3.22Å; K496-K500 WeakPolarHBondContact O-CG 3.41Å; Q497-K500 PolarHBondContact O-N 2.91Å; E498-K500 PolarHBondContact O-N 3.43Å; K500-E503 PolarHBondContact O-N 2.94Å; K500-L504 WeakPolarHBondContact O-CB 3.43Å; K500-L504 VanDerWaalsContact O-CG 3.31Å; K500-L504 WeakPolarHBondContact O-CG 3.34Å; K500-L504 PolarHBondContact O-N 3.15Å
501	L	79.4	Confident	79.9	Confident	20 Å²	20	80 Å²	80	11%	0.105	43%	0.427	C	S	.	.	H	α-helix	trans	-73.9	-32.4	-179.9	-161.4	148	0	0	0	110.8	Q497 E498 K499 K505 E515	Q497-L501 WeakPolarHBondContact O-CB 3.15Å; Q497-L501 PolarHBondContact O-N 2.93Å; E498-L501 CarbonylContact O-C 3.56Å; E498-L501 PolarHBondContact O-N 3.15Å; E498-L501 VanDerWaalsContact O-N 3.11Å; K499-L501 VanDerWaalsContact C-N 3.27Å; K499-L501 PolarHBondContact O-N 3.15Å; L501-K505 HydrophobicContact CD2-CD 3.94Å; L501-K505 VanDerWaalsContact CD2-NZ 3.26Å; L501-K505 WeakPolarHBondContact O-CB 3.12Å; L501-K505 VanDerWaalsContact O-CG 3.25Å; L501-K505 WeakPolarHBondContact O-CG 3.41Å; L501-K505 PolarHBondContact O-N 3.49Å; L501-K505 VanDerWaalsContact O-N 3.1Å; L501-E515 HydrophobicContact CD1-CG 3.91Å
502	K	83.8	Confident	79.1	Confident	114 Å²	114	85.7 Å²	85.7	50%	0.496	45%	0.451	S	S	.	.	H	α-helix	trans	-66	-45.9	165.7	-72.8	168.4	174.3	165.3	0	111.7	E498 K499 L504 K505 A506	E498-K502 WeakPolarHBondContact O-CG 3.15Å; E498-K502 PolarHBondContact O-N 3.42Å; E498-K502 WeakPolarHBondContact OE1-CE 3.37Å; E498-K502 IonicContact OE1-NZ 2.71Å; E498-K502 PolarHBondContact OE1-NZ 3.19Å; E498-K502 WeakPolarHBondContact OE2-CE 3.38Å; E498-K502 IonicContact OE2-NZ 2.55Å; E498-K502 PolarHBondContact OE2-NZ 2.61Å; K499-K502 WeakPolarHBondContact O-CB 3.47Å; K499-K502 PolarHBondContact O-N 3.11Å; K502-L504 PolarHBondContact O-N 2.97Å; K502-K505 PolarHBondContact O-N 2.76Å; K502-A506 WeakPolarHBondContact O-CB 3.12Å; K502-A506 PolarHBondContact O-N 3.02Å
503	E	84.9	Confident	78.1	Confident	105 Å²	105	84.4 Å²	84.4	49%	0.491	45%	0.447	S	S	.	.	H	α-helix	trans	-59.9	-43.6	175	-72.1	163.2	178.6	0	0	112.1	K499 K500 A506 G507	K499-E503 WeakPolarHBondContact CE-OE1 3.27Å; K499-E503 WeakPolarHBondContact CG-OE1 3.2Å; K499-E503 VanDerWaalsContact O-CG 3.3Å; K499-E503 WeakPolarHBondContact O-CG 3.47Å; K499-E503 PolarHBondContact O-N 3.32Å; K500-E503 PolarHBondContact O-N 2.94Å; E503-A506 PolarHBondContact O-N 2.86Å; E503-G507 PolarHBondContact O-N 3.28Å
504	L	77.4	Confident	77.1	Confident	44 Å²	44	79.8 Å²	79.8	23%	0.23	43%	0.426	C	S	.	.	H	α-helix	trans	-66.4	-35.9	176.3	-77.5	164.8	0	0	0	112.9	K500 K502 G507 K509 A514	K500-L504 WeakPolarHBondContact O-CB 3.43Å; K500-L504 VanDerWaalsContact O-CG 3.31Å; K500-L504 WeakPolarHBondContact O-CG 3.34Å; K500-L504 PolarHBondContact O-N 3.15Å; K502-L504 PolarHBondContact O-N 2.97Å; L504-G507 PolarHBondContact O-N 3.12Å; L504-K509 HydrophobicContact CD2-CD 3.97Å; L504-K509 WeakPolarHBondContact O-CB 3.42Å; L504-K509 PolarHBondContact O-N 2.9Å; L504-A514 HydrophobicContact CB-CB 3.9Å
505	K	78.3	Confident	76.3	Confident	86 Å²	86	80.6 Å²	80.6	37%	0.374	43%	0.431	S	S	.	.	H	α-helix	trans	-68.8	-43.1	173	-77.2	170.7	176.2	173.7	0	111.8	L501 K502 G507 G508 A514	L501-K505 HydrophobicContact CD2-CD 3.94Å; L501-K505 VanDerWaalsContact CD2-NZ 3.26Å; L501-K505 WeakPolarHBondContact O-CB 3.12Å; L501-K505 VanDerWaalsContact O-CG 3.25Å; L501-K505 WeakPolarHBondContact O-CG 3.41Å; L501-K505 PolarHBondContact O-N 3.49Å; L501-K505 VanDerWaalsContact O-N 3.1Å; K502-K505 PolarHBondContact O-N 2.76Å; K505-G507 PolarHBondContact O-N 2.68Å; K505-G508 PolarHBondContact O-N 2.74Å; K505-A514 HydrophobicContact CG-CB 4.44Å
506	A	77.9	Confident	75.5	Confident	91 Å²	91	83.4 Å²	83.4	75%	0.752	44%	0.44	S	S	*	.	H	α-helix	trans	-62.3	-33.4	173.9	0	0	0	0	0	112	K502 E503 G508	K502-A506 WeakPolarHBondContact O-CB 3.12Å; K502-A506 PolarHBondContact O-N 3.02Å; E503-A506 PolarHBondContact O-N 2.86Å; A506-G508 PolarHBondContact O-N 2.93Å
507	G	76.9	Confident	74.6	Confident	58 Å²	58	80.5 Å²	80.5	60%	0.598	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	23.3	168	0	0	0	0	0	115.4	E503 L504 K505 K509	E503-G507 PolarHBondContact O-N 3.28Å; L504-G507 PolarHBondContact O-N 3.12Å; K505-G507 PolarHBondContact O-N 2.68Å; G507-K509 PolarHBondContact O-N 3.19Å
508	G	68.9	Low	73.7	Confident	71 Å²	71	80 Å²	80	73%	0.732	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.7	5.9	170.8	0	0	0	0	0	116.7	K505 A506	K505-G508 PolarHBondContact O-N 2.74Å; A506-G508 PolarHBondContact O-N 2.93Å
509	K	70.3	Confident	72.8	Confident	73 Å²	73	81 Å²	81	32%	0.317	43%	0.43	S	S	.	.			trans	-87.9	133.7	-177.4	-62.5	174.8	-178	174.8	0	112	L504 G507	L504-K509 HydrophobicContact CD2-CD 3.97Å; L504-K509 WeakPolarHBondContact O-CB 3.42Å; L504-K509 PolarHBondContact O-N 2.9Å; G507-K509 PolarHBondContact O-N 3.19Å
510	S	67.8	Low	71.8	Confident	72 Å²	72	78.8 Å²	78.8	50%	0.503	42%	0.422	S	S	.	.			trans	-57.9	146.2	174.4	-179.5	0	0	0	0	111.9	K512 Q513 A514	S510-K512 VanDerWaalsContact C-N 3.31Å; S510-K512 PolarHBondContact O-N 2.98Å; S510-K512 VanDerWaalsContact O-N 3.16Å; S510-Q513 WeakPolarHBondContact O-CA 3.19Å; S510-Q513 WeakPolarHBondContact O-CB 3.42Å; S510-Q513 PolarHBondContact O-N 3.36Å; S510-A514 PolarHBondContact O-N 2.74Å
511	T	66.6	Low	71	Confident	72 Å²	72	76.6 Å²	76.6	44%	0.442	42%	0.424	S	S	.	.	H	α-helix	trans	-39.5	-55.4	-179.3	-39	0	0	0	0	112.8	Q513 A514 E515	T511-Q513 VanDerWaalsContact C-N 3.35Å; T511-Q513 PolarHBondContact O-N 2.94Å; T511-A514 PolarHBondContact O-N 2.8Å; T511-E515 WeakPolarHBondContact CG2-OE1 3.47Å; T511-E515 WeakPolarHBondContact O-CG 3.46Å; T511-E515 PolarHBondContact O-N 3.01Å
512	K	66.9	Low	70.1	Confident	171 Å²	171	78.9 Å²	78.9	74%	0.743	44%	0.435	S	S	*	.	H	α-helix	trans	-66.9	-31.2	-178	-63.7	-178.9	177.3	-179.9	0	113.2	S510 K516	S510-K512 VanDerWaalsContact C-N 3.31Å; S510-K512 PolarHBondContact O-N 2.98Å; S510-K512 VanDerWaalsContact O-N 3.16Å; K512-K516 WeakPolarHBondContact O-CB 3.38Å; K512-K516 PolarHBondContact O-N 2.77Å
513	Q	64.9	Low	68.9	Low	115 Å²	115	75.7 Å²	75.7	54%	0.537	43%	0.425	S	S	.	.	H	α-helix	trans	-75.9	-40.9	176.9	-69.3	179.9	-16.4	0	0	111.9	S510 T511 E515 K516 Q517	S510-Q513 WeakPolarHBondContact O-CA 3.19Å; S510-Q513 WeakPolarHBondContact O-CB 3.42Å; S510-Q513 PolarHBondContact O-N 3.36Å; T511-Q513 VanDerWaalsContact C-N 3.35Å; T511-Q513 PolarHBondContact O-N 2.94Å; Q513-E515 VanDerWaalsContact C-N 3.35Å; Q513-K516 PolarHBondContact O-N 3Å; Q513-Q517 WeakPolarHBondContact O-CB 3.49Å; Q513-Q517 WeakPolarHBondContact O-CG 3.26Å; Q513-Q517 PolarHBondContact O-N 3.02Å
514	A	62.7	Low	67.7	Low	0 Å²	0	79.2 Å²	79.2	0%	0	43%	0.434	C	S	.	.	H	α-helix	trans	-62.1	-43.3	175.1	0	0	0	0	0	111.3	L504 K505 S510 T511 T518	L504-A514 HydrophobicContact CB-CB 3.9Å; K505-A514 HydrophobicContact CG-CB 4.44Å; S510-A514 PolarHBondContact O-N 2.74Å; T511-A514 PolarHBondContact O-N 2.8Å; A514-T518 WeakPolarHBondContact O-CB 3.45Å; A514-T518 PolarHBondContact O-N 3.05Å; A514-T518 PolarHBondContact O-OG1 2.77Å
515	E	67.7	Low	66.8	Low	61 Å²	61	84.6 Å²	84.6	29%	0.285	46%	0.456	S	S	.	.	H	α-helix	trans	-63	-47.4	174.9	-74	160	-162.6	0	0	112.2	L501 T511 Q513 T518 K519 L545	L501-E515 HydrophobicContact CD1-CG 3.91Å; T511-E515 WeakPolarHBondContact CG2-OE1 3.47Å; T511-E515 WeakPolarHBondContact O-CG 3.46Å; T511-E515 PolarHBondContact O-N 3.01Å; Q513-E515 VanDerWaalsContact C-N 3.35Å; E515-T518 PolarHBondContact O-N 3.16Å; E515-K519 PolarHBondContact O-N 2.89Å; E515-L545 HydrophobicContact CB-CD1 4.29Å; E515-L545 HydrophobicContact CG-CD1 3.95Å
516	K	69.9	Low	65.7	Low	131 Å²	131	86.4 Å²	86.4	57%	0.57	47%	0.465	S	S	*	.	H	α-helix	trans	-60.9	-49	178.1	-162.5	-172.5	-171.4	-115.5	0	111.9	K512 Q513 T518 K519 E520	K512-K516 WeakPolarHBondContact O-CB 3.38Å; K512-K516 PolarHBondContact O-N 2.77Å; Q513-K516 PolarHBondContact O-N 3Å; K516-T518 PolarHBondContact O-N 3.38Å; K516-K519 PolarHBondContact O-N 2.79Å; K516-E520 VanDerWaalsContact CE-OE1 3.24Å; K516-E520 WeakPolarHBondContact CE-OE1 3.4Å; K516-E520 HydrophobicContact CG-CG 4.48Å; K516-E520 IonicContact NZ-OE1 3.98Å; K516-E520 PolarHBondContact NZ-OE1 3.37Å; K516-E520 WeakPolarHBondContact O-CB 3.34Å; K516-E520 WeakPolarHBondContact O-CG 3.49Å; K516-E520 PolarHBondContact O-N 3.01Å
517	Q	67.6	Low	64.5	Low	82 Å²	82	88.4 Å²	88.4	38%	0.383	46%	0.459	S	S	.	.	H	α-helix	trans	-62.6	-31.2	176.7	-72.7	-175	-2.8	0	0	112.3	Q513 A521	Q513-Q517 WeakPolarHBondContact O-CB 3.49Å; Q513-Q517 WeakPolarHBondContact O-CG 3.26Å; Q513-Q517 PolarHBondContact O-N 3.02Å; Q517-A521 WeakPolarHBondContact O-CB 3.44Å; Q517-A521 PolarHBondContact O-N 2.9Å
518	T	62.8	Low	63.2	Low	14 Å²	14	94.1 Å²	94.1	9%	0.086	47%	0.468	C	S	.	.	H	α-helix	trans	-69.8	-43.2	174.9	-56.9	0	0	0	0	111.5	Q497 A514 E515 K516 A521 L522 L545	Q497-T518 HydrophobicContact CG-CG2 4.26Å; A514-T518 WeakPolarHBondContact O-CB 3.45Å; A514-T518 PolarHBondContact O-N 3.05Å; A514-T518 PolarHBondContact O-OG1 2.77Å; E515-T518 PolarHBondContact O-N 3.16Å; K516-T518 PolarHBondContact O-N 3.38Å; T518-A521 PolarHBondContact O-N 3.09Å; T518-L522 HydrophobicContact CG2-CD1 4.35Å; T518-L522 WeakPolarHBondContact O-CG 3.49Å; T518-L522 PolarHBondContact O-N 2.9Å; T518-L522 VanDerWaalsContact O-N 3.15Å; T518-L545 HydrophobicContact CG2-CD2 4.28Å
519	K	66.1	Low	62.2	Low	86 Å²	86	93.9 Å²	93.9	37%	0.374	47%	0.465	S	S	.	.	H	α-helix	trans	-62.6	-47	173.5	-70.8	-172.4	174.7	-170.3	0	111.9	E515 K516 A521 L522 T523 L545	E515-K519 PolarHBondContact O-N 2.89Å; K516-K519 PolarHBondContact O-N 2.79Å; K519-A521 VanDerWaalsContact C-N 3.3Å; K519-A521 PolarHBondContact O-N 2.78Å; K519-L522 WeakPolarHBondContact O-CB 3.29Å; K519-L522 PolarHBondContact O-N 3.04Å; K519-L522 VanDerWaalsContact O-N 3.08Å; K519-T523 PolarHBondContact O-N 3.15Å; K519-T523 PolarHBondContact O-OG1 2.96Å; K519-L545 HydrophobicContact CG-CD2 3.86Å; K519-L545 HydrophobicContact CG-CG 4.37Å
520	E	64.7	Low	60.9	Low	85 Å²	85	96.5 Å²	96.5	40%	0.397	48%	0.477	S	S	.	.	H	α-helix	trans	-61.2	-35.3	176.9	-70.8	168.7	172.6	0	0	112.6	K516 L522 T523 R524	K516-E520 VanDerWaalsContact CE-OE1 3.24Å; K516-E520 WeakPolarHBondContact CE-OE1 3.4Å; K516-E520 HydrophobicContact CG-CG 4.48Å; K516-E520 IonicContact NZ-OE1 3.98Å; K516-E520 PolarHBondContact NZ-OE1 3.37Å; K516-E520 WeakPolarHBondContact O-CB 3.34Å; K516-E520 WeakPolarHBondContact O-CG 3.49Å; K516-E520 PolarHBondContact O-N 3.01Å; E520-L522 VanDerWaalsContact C-N 3.35Å; E520-T523 PolarHBondContact O-OG1 2.74Å; E520-R524 WeakPolarHBondContact O-CB 3.49Å; E520-R524 PolarHBondContact O-N 2.89Å; E520-R524 VanDerWaalsContact O-N 3.17Å
521	A	64.6	Low	59.6	Low	58 Å²	58	103 Å²	103	48%	0.479	50%	0.496	S	S	.	.	H	α-helix	trans	-73.5	-23.7	175.1	0	0	0	0	0	113.6	Q517 T518 K519 K525	Q517-A521 WeakPolarHBondContact O-CB 3.44Å; Q517-A521 PolarHBondContact O-N 2.9Å; T518-A521 PolarHBondContact O-N 3.09Å; K519-A521 VanDerWaalsContact C-N 3.3Å; K519-A521 PolarHBondContact O-N 2.78Å; A521-K525 WeakPolarHBondContact O-CG 3.27Å; A521-K525 PolarHBondContact O-N 3.41Å
522	L	61.1	Low	58.3	Low	67 Å²	67	109.7 Å²	109.7	35%	0.351	52%	0.519	S	S	.	.	H	α-helix	trans	-79.7	-50	175.9	-73.5	165.1	0	0	0	111.4	T518 K519 E520 R524 K525 Q526	T518-L522 HydrophobicContact CG2-CD1 4.35Å; T518-L522 WeakPolarHBondContact O-CG 3.49Å; T518-L522 PolarHBondContact O-N 2.9Å; T518-L522 VanDerWaalsContact O-N 3.15Å; K519-L522 WeakPolarHBondContact O-CB 3.29Å; K519-L522 PolarHBondContact O-N 3.04Å; K519-L522 VanDerWaalsContact O-N 3.08Å; E520-L522 VanDerWaalsContact C-N 3.35Å; L522-R524 VanDerWaalsContact C-N 3.34Å; L522-R524 PolarHBondContact O-N 3.25Å; L522-K525 WeakPolarHBondContact O-CB 3.21Å; L522-K525 PolarHBondContact O-N 3.28Å; L522-Q526 PolarHBondContact O-N 3.44Å
523	T	59.6	Low	56.5	Low	47 Å²	47	103.6 Å²	103.6	29%	0.288	51%	0.505	S	S	.	.	H	α-helix	trans	-59	-44.9	175.8	52	0	0	0	0	111.4	K519 E520 K525 Q526 Q527 P543	K519-T523 PolarHBondContact O-N 3.15Å; K519-T523 PolarHBondContact O-OG1 2.96Å; E520-T523 PolarHBondContact O-OG1 2.74Å; T523-K525 PolarHBondContact O-N 3.33Å; T523-K525 VanDerWaalsContact O-N 3.15Å; T523-Q526 PolarHBondContact O-N 2.92Å; T523-Q526 VanDerWaalsContact O-N 3.15Å; T523-Q527 WeakPolarHBondContact O-CB 3.36Å; T523-Q527 WeakPolarHBondContact O-CG 3.31Å; T523-Q527 PolarHBondContact O-N 3.28Å; T523-P543 HydrophobicContact CG2-CG 3.47Å; T523-P543 VanDerWaalsContact CG2-CG 3.47Å
524	R	59.1	Low	55.1	Low	180 Å²	180	104.7 Å²	104.7	68%	0.679	52%	0.522	S	S	*	.	H	α-helix	trans	-66.4	-13.8	177.1	-160.7	175.6	-169.7	-167.9	4.6	113.9	E520 L522	E520-R524 WeakPolarHBondContact O-CB 3.49Å; E520-R524 PolarHBondContact O-N 2.89Å; E520-R524 VanDerWaalsContact O-N 3.17Å; L522-R524 VanDerWaalsContact C-N 3.34Å; L522-R524 PolarHBondContact O-N 3.25Å
525	K	58.6	Low	53.7	Low	157 Å²	157	113.7 Å²	113.7	68%	0.683	56%	0.564	S	S	*	*	H	α-helix	trans	-86.9	-44.4	168.4	-85.4	-168.9	171.3	-156.8	0	112.4	A521 L522 T523 Q527 K528 G529	A521-K525 WeakPolarHBondContact O-CG 3.27Å; A521-K525 PolarHBondContact O-N 3.41Å; L522-K525 WeakPolarHBondContact O-CB 3.21Å; L522-K525 PolarHBondContact O-N 3.28Å; T523-K525 PolarHBondContact O-N 3.33Å; T523-K525 VanDerWaalsContact O-N 3.15Å; K525-Q527 VanDerWaalsContact C-N 3.34Å; K525-Q527 PolarHBondContact O-N 3.16Å; K525-K528 PolarHBondContact O-N 2.94Å; K525-K528 VanDerWaalsContact O-N 3.09Å; K525-G529 PolarHBondContact O-N 3.28Å
526	Q	55.8	Low	52.1	Low	123 Å²	123	116.3 Å²	116.3	58%	0.575	58%	0.576	S	S	*	*	H	α-helix	trans	-58.7	-45.6	174.8	-72.1	172.8	-32.4	0	0	111.3	L522 T523 K528 G529 K530	L522-Q526 PolarHBondContact O-N 3.44Å; T523-Q526 PolarHBondContact O-N 2.92Å; T523-Q526 VanDerWaalsContact O-N 3.15Å; Q526-K528 PolarHBondContact O-N 3.45Å; Q526-G529 PolarHBondContact O-N 3.46Å; Q526-K530 PolarHBondContact O-N 3.12Å
527	Q	52.1	Low	50.4	Low	134 Å²	134	118.4 Å²	118.4	63%	0.626	59%	0.588	S	S	*	*	H	α-helix	trans	-63.9	-17.1	175.5	-71.5	177.7	-20.7	0	0	114.6	T523 K525	T523-Q527 WeakPolarHBondContact O-CB 3.36Å; T523-Q527 WeakPolarHBondContact O-CG 3.31Å; T523-Q527 PolarHBondContact O-N 3.28Å; K525-Q527 VanDerWaalsContact C-N 3.34Å; K525-Q527 PolarHBondContact O-N 3.16Å
528	K	49.9	Very low	48.8	Very low	178 Å²	178	124.1 Å²	124.1	77%	0.774	62%	0.615	S	S	*	*	H	α-helix	trans	-91.7	-11.2	171.6	-81.2	-169.4	171.8	-166.2	0	113.4	K525 Q526	K525-K528 PolarHBondContact O-N 2.94Å; K525-K528 VanDerWaalsContact O-N 3.09Å; Q526-K528 PolarHBondContact O-N 3.45Å
529	G	46.6	Very low	47.6	Very low	66 Å²	66	127.7 Å²	127.7	68%	0.68	64%	0.64	S	S	*	*	H	α-helix	trans	-85.1	-47.6	175.9	0	0	0	0	0	112.8	K525 Q526 K531	K525-G529 PolarHBondContact O-N 3.28Å; Q526-G529 PolarHBondContact O-N 3.46Å; G529-K531 PolarHBondContact O-N 2.98Å
530	K	44.7	Very low	46.3	Very low	128 Å²	128	129.6 Å²	129.6	56%	0.557	65%	0.654	S	S	*	*	S	Bend	trans	-77.3	113.4	173	-78.5	-166.9	170.8	-167.3	0	110.5	Q526 E536	Q526-K530 PolarHBondContact O-N 3.12Å; K530-E536 IonicContact NZ-OE1 2.65Å; K530-E536 PolarHBondContact NZ-OE1 2.94Å; K530-E536 IonicContact NZ-OE2 3.08Å; K530-E536 PolarHBondContact NZ-OE2 2.68Å
531	K	40.3	Very low	45.1	Very low	207 Å²	207	132.3 Å²	132.3	90%	0.9	67%	0.666	S	S	*	*			trans	-68.2	141.9	158.2	-82.7	-175.5	175.4	179.3	0	108.6	G529 G533	G529-K531 PolarHBondContact O-N 2.98Å; K531-G533 PolarHBondContact O-N 3.41Å
532	K	38.2	Very low	43.8	Very low	214 Å²	214	133.7 Å²	133.7	93%	0.93	68%	0.678	S	S	*	*			trans	-56.2	130.2	-169.2	-64.9	-175.8	176.9	-167.2	0	114
533	G	30.5	Very low	43	Very low	43 Å²	43	132 Å²	132	44%	0.443	67%	0.671	S	S	.	*			trans	-119.1	139.4	147.3	0	0	0	0	0	108.4	K531 Q535	K531-G533 PolarHBondContact O-N 3.41Å; G533-Q535 PolarHBondContact O-N 3.16Å
534	P	34.4	Very low	42.8	Very low	138 Å²	138	135.6 Å²	135.6	90%	0.896	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	17.5	-164.8	-17.5	33.7	0	0	0	117.1
535	Q	32.7	Very low	42.8	Very low	189 Å²	189	129.1 Å²	129.1	88%	0.883	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-139.3	14.2	-160.4	-138.6	169.5	-1.9	0	0	115.4	G533	G533-Q535 PolarHBondContact O-N 3.16Å
536	E	34.8	Very low	43	Very low	116 Å²	116	124.2 Å²	124.2	54%	0.542	64%	0.644	S	S	.	*			trans	-116.2	16.8	-179.6	-67.2	-171.3	121.1	0	0	114.2	K530	K530-E536 IonicContact NZ-OE1 2.65Å; K530-E536 PolarHBondContact NZ-OE1 2.94Å; K530-E536 IonicContact NZ-OE2 3.08Å; K530-E536 PolarHBondContact NZ-OE2 2.68Å
537	E	34.6	Very low	43.1	Very low	175 Å²	175	125.4 Å²	125.4	82%	0.818	65%	0.647	S	S	*	*	G	3₁₀ helix	trans	-80.6	-16.9	-169.7	-62.7	-161.4	143.7	0	0	115.3
538	E	34	Very low	43.5	Very low	202 Å²	202	126.4 Å²	126.4	94%	0.944	65%	0.645	S	S	*	*	G	3₁₀ helix	trans	-90.4	4.3	-168.8	-96.2	-174.5	158	0	0	117.2
539	S	36.3	Very low	44	Very low	89 Å²	89	119.1 Å²	119.1	62%	0.622	62%	0.616	S	S	*	*	G	3₁₀ helix	trans	-142.1	35.1	178.8	55.6	0	0	0	0	115.9	E541	S539-E541 PolarHBondContact O-N 2.69Å; S539-E541 VanDerWaalsContact O-N 3.16Å
540	L	38.9	Very low	44.5	Very low	126 Å²	126	124.8 Å²	124.8	66%	0.66	62%	0.622	S	S	*	*			trans	-82.2	84.1	168.3	-69.1	174.2	0	0	0	111	A542	L540-A542 PolarHBondContact O-N 3.03Å
541	E	40.3	Very low	44.9	Very low	141 Å²	141	124.9 Å²	124.9	66%	0.659	63%	0.625	S	S	*	*			trans	-48.2	128.3	165.4	-70.9	178.8	168.4	0	0	109.7	S539	S539-E541 PolarHBondContact O-N 2.69Å; S539-E541 VanDerWaalsContact O-N 3.16Å
542	A	37.5	Very low	45.7	Very low	88 Å²	88	119 Å²	119	73%	0.727	60%	0.598	S	S	*	*			trans	-65.2	125	-174.4	0	0	0	0	0	110.3	L540 E544	L540-A542 PolarHBondContact O-N 3.03Å; A542-E544 PolarHBondContact O-N 2.84Å
543	P	44.8	Very low	46.8	Very low	32 Å²	32	114.2 Å²	114.2	21%	0.208	59%	0.586	C	S	.	*			trans	-63.3	113	-174.4	23.8	-33.2	0	0	0	110.6	T523	T523-P543 HydrophobicContact CG2-CG 3.47Å; T523-P543 VanDerWaalsContact CG2-CG 3.47Å
544	E	55	Low	48.9	Very low	121 Å²	121	113 Å²	113	57%	0.565	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-62.5	159.4	170.6	-66.1	-144.8	112.2	0	0	110.9	A542 K547	A542-E544 PolarHBondContact O-N 2.84Å; E544-K547 WeakPolarHBondContact OE2-CE 3.4Å; E544-K547 IonicContact OE2-NZ 3.11Å; E544-K547 PolarHBondContact OE2-NZ 2.61Å
545	L	59.8	Low	51.1	Low	44 Å²	44	109.5 Å²	109.5	23%	0.23	54%	0.541	C	S	.	.	P	Polyproline II helix	trans	-68.4	141.1	166.8	-57.6	171.4	0	0	0	107.3	Q497 E515 T518 K519 K547	Q497-L545 VanDerWaalsContact NE2-CD2 3.26Å; E515-L545 HydrophobicContact CB-CD1 4.29Å; E515-L545 HydrophobicContact CG-CD1 3.95Å; T518-L545 HydrophobicContact CG2-CD2 4.28Å; K519-L545 HydrophobicContact CG-CD2 3.86Å; K519-L545 HydrophobicContact CG-CG 4.37Å; L545-K547 PolarHBondContact O-N 3.49Å
546	L	61.2	Low	53.6	Low	55 Å²	55	100.5 Å²	100.5	29%	0.288	50%	0.499	S	S	.	.	P	Polyproline II helix	trans	-55.9	119.1	171.4	-70.3	170.5	0	0	0	108.1	L490 Q493 Y494	L490-L546 HydrophobicContact CG-CD2 4.45Å; Q493-L546 HydrophobicContact CB-CD1 3.76Å; Y494-L546 HydrophobicContact CD2-CB 4.04Å; Y494-L546 VanDerWaalsContact CD2-O 3.25Å; Y494-L546 WeakPolarHBondContact CD2-O 3.15Å; Y494-L546 VanDerWaalsContact CE2-O 3.27Å; Y494-L546 WeakPolarHBondContact CE2-O 3.22Å
547	K	59.5	Low	56	Low	148 Å²	148	96.3 Å²	96.3	64%	0.643	48%	0.481	S	S	*	.	P	Polyproline II helix	trans	-70.3	145.3	171.7	-66.8	164.4	-171.3	164.1	0	107.1	E544 L545 P549	E544-K547 WeakPolarHBondContact OE2-CE 3.4Å; E544-K547 IonicContact OE2-NZ 3.11Å; E544-K547 PolarHBondContact OE2-NZ 2.61Å; L545-K547 PolarHBondContact O-N 3.49Å; K547-P549 WeakPolarHBondContact O-CD 3.46Å
548	R	59.8	Low	58.6	Low	154 Å²	154	88.3 Å²	88.3	58%	0.581	44%	0.444	S	S	*	.	P	Polyproline II helix	trans	-55.8	128.4	175.7	-174.5	-173.6	165.2	173	-3.3	107.6	Y494 K550 E551	Y494-R548 HydrophobicContact CE1-CB 4.16Å; Y494-R548 HydrophobicContact CE1-CG 4.04Å; Y494-R548 HydrophobicContact CE2-CB 3.98Å; R548-K550 PolarHBondContact O-N 2.82Å; R548-E551 IonicContact CZ-OE2 2.69Å; R548-E551 IonicContact NH2-OE2 2.68Å; R548-E551 PolarHBondContact NH2-OE2 3.46Å
549	P	60.3	Low	61.3	Low	25 Å²	25	81 Å²	81	16%	0.162	41%	0.413	C	S	.	.	P	Polyproline II helix	trans	-51.2	128.1	169.7	-29.8	39.2	0	0	0	109.7	L490 Q491 K547 E551	L490-P549 HydrophobicContact CD2-CG 3.7Å; Q491-P549 VanDerWaalsContact OE1-CG 3.26Å; K547-P549 WeakPolarHBondContact O-CD 3.46Å; P549-E551 PolarHBondContact O-N 2.87Å
550	K	57	Low	63.8	Low	185 Å²	185	80.7 Å²	80.7	80%	0.804	41%	0.405	S	S	*	.			trans	-71.5	99.9	172.8	-72.7	-173.8	176	-174.9	0	106.9	R548 Y552	R548-K550 PolarHBondContact O-N 2.82Å; K550-Y552 PolarHBondContact O-N 2.99Å
551	E	53.9	Low	66.3	Low	130 Å²	130	75.8 Å²	75.8	61%	0.607	38%	0.381	S	S	*	.			trans	-64.2	87.9	167.7	-88.7	170.3	127	0	0	108.7	R548 P549 T553	R548-E551 IonicContact CZ-OE2 2.69Å; R548-E551 IonicContact NH2-OE2 2.68Å; R548-E551 PolarHBondContact NH2-OE2 3.46Å; P549-E551 PolarHBondContact O-N 2.87Å; E551-T553 PolarHBondContact O-N 2.85Å; E551-T553 VanDerWaalsContact O-N 3.13Å
552	Y	55.8	Low	68.6	Low	85 Å²	85	73 Å²	73	33%	0.333	38%	0.375	S	S	.	.			trans	-87.3	63.1	176.5	-164.8	-115.7	0	0	0	109.2	K550 V554 G674 E676 R694	K550-Y552 PolarHBondContact O-N 2.99Å; Y552-V554 VanDerWaalsContact C-N 3.3Å; Y552-V554 HydrophobicContact CD1-CG2 3.88Å; Y552-V554 HydrophobicContact CE1-CG2 3.78Å; Y552-V554 PolarHBondContact O-N 3.43Å; Y552-G674 PolarHBondContact OH-O 3Å; Y552-E676 HydrophobicContact CE2-CG 3.99Å; Y552-R694 PolarHBondContact OH-NH1 2.92Å
553	T	61.5	Low	70.8	Confident	112 Å²	112	75.2 Å²	75.2	69%	0.687	38%	0.382	S	S	*	.			trans	-78.2	81.9	-175.8	-44.8	0	0	0	0	109.9	E551 K555	E551-T553 PolarHBondContact O-N 2.85Å; E551-T553 VanDerWaalsContact O-N 3.13Å; T553-K555 PolarHBondContact O-N 3.07Å
554	V	74.4	Confident	72.9	Confident	18 Å²	18	75.2 Å²	75.2	11%	0.109	38%	0.38	C	S	.	.			trans	-63.7	120	166.3	-173.5	0	0	0	0	107.5	Y552 F556 A724	Y552-V554 VanDerWaalsContact C-N 3.3Å; Y552-V554 HydrophobicContact CD1-CG2 3.88Å; Y552-V554 HydrophobicContact CE1-CG2 3.78Å; Y552-V554 PolarHBondContact O-N 3.43Å; V554-F556 HydrophobicContact CG1-CD1 3.65Å; V554-F556 HydrophobicContact CG1-CE1 3.57Å; V554-A724 HydrophobicContact CB-CB 4.46Å; V554-A724 HydrophobicContact CG1-CB 4.01Å
555	K	80.3	Confident	74.3	Confident	64 Å²	64	73.1 Å²	73.1	28%	0.278	38%	0.378	S	S	.	.			trans	-136.9	93.6	168.1	177	152.8	-176.7	145.9	0	109.9	T553 R672 E727 E731	T553-K555 PolarHBondContact O-N 3.07Å; K555-R672 CarbonylContact C-O 3.57Å; K555-R672 PolarHBondContact N-O 2.68Å; K555-R672 VanDerWaalsContact N-O 3.17Å; K555-R672 WeakPolarHBondContact O-CG 2.88Å; K555-R672 PolarHBondContact O-NE 2.77Å; K555-E727 IonicContact NZ-OE2 2.86Å; K555-E731 VanDerWaalsContact CE-OE2 3.24Å; K555-E731 WeakPolarHBondContact CE-OE2 3.38Å; K555-E731 IonicContact NZ-OE1 3.92Å; K555-E731 PolarHBondContact NZ-OE1 3.03Å; K555-E731 IonicContact NZ-OE2 2.76Å; K555-E731 PolarHBondContact NZ-OE2 3.44Å; K555-E731 VanDerWaalsContact NZ-OE2 3.15Å
556	F	86.9	Confident	75.5	Confident	0 Å²	0	75.4 Å²	75.4	0%	0	40%	0.396	C	S	.	.			trans	-58.5	142.6	167.7	-73.3	25.7	0	0	0	108.2	V554 F673 R694 F697 L717 A724 L725 A728	V554-F556 HydrophobicContact CG1-CD1 3.65Å; V554-F556 HydrophobicContact CG1-CE1 3.57Å; F556-F673 HydrophobicContact CB-CD1 4.09Å; F556-F673 HydrophobicContact CB-CE1 3.7Å; F556-F673 HydrophobicContact CD1-CB 4.4Å; F556-F673 AromaticContact CD1-CD1 3.42Å; F556-F673 HydrophobicContact CD1-CD1 3.42Å; F556-F673 VanDerWaalsContact CD1-CD1 3.42Å; F556-F673 AromaticContact CD1-CE1 3.98Å; F556-F673 HydrophobicContact CD1-CE1 3.98Å; F556-F673 HydrophobicContact CD1-CG 4.26Å; F556-F673 AromaticContact CD2-CD1 3.84Å; F556-F673 HydrophobicContact CD2-CD1 3.84Å; F556-F673 AromaticContact CD2-CE1 3.85Å; F556-F673 HydrophobicContact CD2-CE1 3.85Å; F556-F673 HydrophobicContact CE1-CB 4.22Å; F556-F673 AromaticContact CE1-CD1 3.72Å; F556-F673 HydrophobicContact CE1-CD1 3.72Å; F556-F673 HydrophobicContact CE1-CG 4.44Å; F556-F673 WeakPolarHBondContact CE1-O 3.42Å; F556-F673 HydrophobicContact CE2-CD1 4.11Å; F556-F673 HydrophobicContact CE2-CE1 4.48Å; F556-F673 AromaticContact CG-CD1 3.49Å; F556-F673 HydrophobicContact CG-CD1 3.49Å; F556-F673 VanDerWaalsContact CG-CD1 3.49Å; F556-F673 AromaticContact CG-CE1 3.56Å; F556-F673 HydrophobicContact CG-CE1 3.56Å; F556-F673 HydrophobicContact CZ-CD1 4.05Å; F556-R694 HydrophobicContact CZ-CG 4.48Å; F556-F697 HydrophobicContact CD2-CG 4.41Å; F556-F697 HydrophobicContact CE2-CB 4.09Å; F556-F697 HydrophobicContact CE2-CD1 4.19Å; F556-F697 AromaticContact CE2-CD2 3.69Å; F556-F697 HydrophobicContact CE2-CD2 3.69Å; F556-F697 HydrophobicContact CE2-CE2 4.15Å; F556-F697 AromaticContact CE2-CG 3.73Å; F556-F697 HydrophobicContact CE2-CG 3.73Å; F556-F697 HydrophobicContact CZ-CB 4.46Å; F556-F697 HydrophobicContact CZ-CD2 4.06Å; F556-F697 HydrophobicContact CZ-CG 4.35Å; F556-L717 HydrophobicContact CZ-CD2 4.49Å; F556-A724 HydrophobicContact CB-CB 4.46Å; F556-A724 HydrophobicContact CD1-CB 4.32Å; F556-A724 HydrophobicContact CG-CB 4.47Å; F556-L725 HydrophobicContact CD2-CB 4Å; F556-L725 HydrophobicContact CD2-CD1 3.96Å; F556-L725 HydrophobicContact CE2-CB 4.3Å; F556-L725 HydrophobicContact CE2-CD1 4.41Å; F556-A728 HydrophobicContact CB-CB 3.71Å; F556-A728 WeakPolarHBondContact O-CB 3.44Å
557	T	84.4	Confident	76.6	Confident	29 Å²	29	77.2 Å²	77.2	18%	0.178	41%	0.411	C	S	.	.			trans	-159.5	123.6	172.9	-47.1	0	0	0	0	108	R672	T557-R672 PolarHBondContact OG1-NE 2.86Å; T557-R672 PolarHBondContact OG1-NH2 2.76Å
558	F	89.7	Confident	78	Confident	6 Å²	6	70.3 Å²	70.3	3%	0.026	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-93.5	138	174.3	-55.4	-71.6	0	0	0	108.9	F673 F697 A701 L708 L725 A728 Y732	F558-F673 HydrophobicContact CE1-CE1 4.09Å; F558-F673 HydrophobicContact CE1-CZ 4.18Å; F558-F673 HydrophobicContact CZ-CE1 4.26Å; F558-F697 HydrophobicContact CE1-CD1 4.49Å; F558-F697 HydrophobicContact CZ-CD1 4.11Å; F558-A701 HydrophobicContact CD1-CB 4.09Å; F558-A701 HydrophobicContact CE1-CB 4.49Å; F558-L708 HydrophobicContact CB-CD1 4.38Å; F558-L708 HydrophobicContact CD1-CD1 4.34Å; F558-L708 HydrophobicContact CD2-CD1 3.7Å; F558-L708 HydrophobicContact CE2-CD1 4.07Å; F558-L708 HydrophobicContact CG-CD1 3.86Å; F558-L725 HydrophobicContact CE2-CD1 4.08Å; F558-L725 HydrophobicContact CZ-CD1 4.25Å; F558-A728 HydrophobicContact CD2-CB 4Å; F558-A728 HydrophobicContact CE2-CB 3.85Å; F558-Y732 HydrophobicContact CB-CD2 3.67Å; F558-Y732 HydrophobicContact CB-CE2 3.97Å; F558-Y732 HydrophobicContact CB-CG 4.34Å
559	P	89.5	Confident	79.5	Confident	48 Å²	48	63.1 Å²	63.1	31%	0.312	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-67.6	137.1	176.8	27.9	-31.8	0	0	0	109.5	A701 Q704	P559-A701 WeakPolarHBondContact CG-O 3.32Å; P559-Q704 HydrophobicContact CG-CB 4.06Å; P559-Q704 HydrophobicContact CG-CG 3.81Å
560	N	90.4	Very high	81.1	Confident	84 Å²	84	62.2 Å²	62.2	45%	0.449	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-70	133.3	-177.8	-76.7	-38.7	0	0	0	111.3	E731 Y732 K733	N560-E731 PolarHBondContact OD1-O 3.2Å; N560-Y732 WeakPolarHBondContact OD1-CA 3.49Å; N560-K733 HydrophobicContact CB-CB 4.25Å; N560-K733 WeakPolarHBondContact OD1-CB 3.34Å; N560-K733 PolarHBondContact OD1-N 3.39Å
561	P	90.4	Very high	82.8	Confident	22 Å²	22	53.5 Å²	53.5	14%	0.143	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-71.3	157.8	-178.3	28.8	-34.8	0	0	0	112.6	M594 D706	P561-M594 HydrophobicContact CB-CE 4.14Å; P561-M594 HydrophobicContact CG-CE 3.69Å; P561-D706 HydrophobicContact CB-CB 4.1Å; P561-D706 WeakPolarHBondContact CB-OD1 3.46Å
562	P	87.7	Confident	84.7	Confident	82 Å²	82	50.2 Å²	50.2	53%	0.532	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-66.4	157.7	167.7	31.5	-35.5	0	0	0	110.9	L564	P562-L564 PolarHBondContact O-N 3.27Å
563	P	85.4	Confident	86.6	Confident	136 Å²	136	48.7 Å²	48.7	88%	0.883	30%	0.298	S	S	*	.	P	Polyproline II helix	trans	-62.4	130.4	174.6	26.8	-34.4	0	0	0	110.9
564	L	87.8	Confident	88.1	Confident	32 Å²	32	43.4 Å²	43.4	17%	0.168	27%	0.265	C	S	.	.			trans	-121.3	141.5	-177	-169.6	63	0	0	0	110.4	P562 I568 M594 N629 R631 L632	P562-L564 PolarHBondContact O-N 3.27Å; L564-I568 HydrophobicContact CB-CD1 4.3Å; L564-I568 HydrophobicContact CD2-CD1 4.27Å; L564-I568 HydrophobicContact CG-CD1 4.23Å; L564-M594 HydrophobicContact CB-CE 4.45Å; L564-M594 HydrophobicContact CB-SD 4.12Å; L564-M594 HydrophobicContact CD2-SD 4.36Å; L564-N629 HydrophobicContact CD2-CB 4.16Å; L564-N629 HydrophobicContact CG-CB 4.43Å; L564-R631 HydrophobicContact CD1-CB 4.04Å; L564-L632 HydrophobicContact CD2-CB 4.36Å; L564-L632 HydrophobicContact CD2-CD1 3.38Å
565	S	85.6	Confident	89	Confident	76 Å²	76	44.1 Å²	44.1	53%	0.531	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-78.8	130.9	179.7	57	0	0	0	0	111.7	N629	S565-N629 PolarHBondContact O-ND2 2.65Å; S565-N629 PolarHBondContact OG-ND2 2.91Å
566	P	83.9	Confident	89.6	Confident	92 Å²	92	41.8 Å²	41.8	60%	0.597	26%	0.258	S	S	*	.	S	Bend	trans	-57.8	155.6	167.7	-24.9	35.4	0	0	0	112.6	I568	P566-I568 HydrophobicContact CG-CD1 4.43Å
567	P	85.3	Confident	89.8	Confident	94 Å²	94	42.2 Å²	42.2	61%	0.61	26%	0.263	S	S	*	.	P	Polyproline II helix	cis	-71.8	142.2	-5	30.9	-35.2	0	0	0	111.9
568	I	88.5	Confident	90	Very high	2 Å²	2	44.9 Å²	44.9	1%	0.01	27%	0.27	C	S	.	.			trans	-83.1	-67.5	-175.6	-53	-55.8	0	0	0	110.1	L564 P566 I592 M594 K628 N629 L632 V707	L564-I568 HydrophobicContact CB-CD1 4.3Å; L564-I568 HydrophobicContact CD2-CD1 4.27Å; L564-I568 HydrophobicContact CG-CD1 4.23Å; P566-I568 HydrophobicContact CG-CD1 4.43Å; I568-I592 HydrophobicContact CG2-CG1 4.47Å; I568-M594 HydrophobicContact CD1-CG 3.59Å; I568-M594 HydrophobicContact CD1-SD 3.93Å; I568-M594 HydrophobicContact CG1-CG 3.9Å; I568-M594 HydrophobicContact CG1-SD 4.26Å; I568-M594 HydrophobicContact CG2-SD 3.88Å; I568-K628 WeakPolarHBondContact O-CA 3.31Å; I568-N629 PolarHBondContact O-N 3.24Å; I568-L632 HydrophobicContact CG2-CD1 3.51Å; I568-V707 HydrophobicContact CG2-CG2 4.12Å
569	L	91.8	Very high	89.8	Confident	4 Å²	4	53.9 Å²	53.9	2%	0.021	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	139.6	176.6	170	63.1	0	0	0	109.1	I592 L615 M626 R627 K628 L632 I709	L569-I592 HydrophobicContact CB-CD1 3.96Å; L569-I592 HydrophobicContact CB-CG1 4Å; L569-I592 HydrophobicContact CD2-CD1 4.02Å; L569-I592 HydrophobicContact CG-CD1 4.37Å; L569-I592 PolarHBondContact O-N 3.1Å; L569-L615 HydrophobicContact CD1-CD2 4.41Å; L569-L615 WeakPolarHBondContact CD1-O 3.47Å; L569-L615 HydrophobicContact CD2-CB 4.25Å; L569-L615 HydrophobicContact CD2-CD2 4.1Å; L569-L615 HydrophobicContact CG-CD2 4.05Å; L569-M626 HydrophobicContact CD1-CG 3.95Å; L569-M626 HydrophobicContact CD1-SD 3.59Å; L569-M626 VanDerWaalsContact CD1-SD 3.59Å; L569-R627 CarbonylContact C-O 3.49Å; L569-R627 WeakPolarHBondContact CA-O 3.49Å; L569-K628 HydrophobicContact CB-CB 4.5Å; L569-K628 HydrophobicContact CD1-CB 3.83Å; L569-L632 HydrophobicContact CB-CD2 3.91Å; L569-I709 HydrophobicContact CD2-CD1 4.43Å
570	G	92.2	Very high	89.4	Confident	5 Å²	5	55.9 Å²	55.9	5%	0.052	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.1	158.9	174.2	0	0	0	0	0	114.3	F590 M626 R627	G570-F590 CarbonylContact C-O 3.56Å; G570-F590 WeakPolarHBondContact CA-O 3.34Å; G570-M626 CarbonylContact O-C 3.52Å; G570-M626 WeakPolarHBondContact O-CA 3.15Å; G570-R627 PolarHBondContact N-O 3.33Å; G570-R627 PolarHBondContact O-N 3.04Å
571	L	93.8	Very high	89.2	Confident	2 Å²	2	58 Å²	58	1%	0.01	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	134.9	170.7	-55.2	-178.8	0	0	0	108.1	V574 V588 D589 F590 L611 L614 L615 M626	L571-V574 HydrophobicContact CB-CB 4.37Å; L571-V574 HydrophobicContact CB-CG2 3.88Å; L571-V574 HydrophobicContact CD2-CG2 4.41Å; L571-V588 HydrophobicContact CD1-CG1 4.49Å; L571-D589 WeakPolarHBondContact O-CA 3.27Å; L571-F590 PolarHBondContact N-O 3.13Å; L571-F590 PolarHBondContact O-N 3.16Å; L571-L611 HydrophobicContact CD1-CD1 3.52Å; L571-L614 HydrophobicContact CD2-CB 4.35Å; L571-L615 HydrophobicContact CD1-CD2 4.25Å; L571-L615 HydrophobicContact CD1-CG 4.36Å; L571-L615 HydrophobicContact CD2-CD2 4.16Å; L571-L615 HydrophobicContact CG-CD2 3.9Å; L571-L615 HydrophobicContact CG-CG 4.48Å; L571-M626 HydrophobicContact CD2-CB 3.68Å; L571-M626 HydrophobicContact CD2-CG 3.67Å
572	H	94.3	Very high	88.9	Confident	62 Å²	62	64.6 Å²	64.6	29%	0.287	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	118.2	177.9	-64.1	-57.3	0	0	0	111.3	V574 D589 G624 E625 R627	H572-V574 PolarHBondContact O-N 2.95Å; H572-D589 VanDerWaalsContact CA-OD1 3.27Å; H572-D589 WeakPolarHBondContact CA-OD1 3.41Å; H572-D589 IonicContact ND1-OD1 2.62Å; H572-G624 WeakPolarHBondContact O-CA 3.48Å; H572-E625 PolarHBondContact N-O 2.9Å; H572-E625 PolarHBondContact O-N 2.86Å; H572-E625 VanDerWaalsContact O-N 3.09Å; H572-R627 VanDerWaalsContact CD2-CD 3.46Å; H572-R627 WeakPolarHBondContact CD2-CD 3.35Å; H572-R627 VanDerWaalsContact CD2-CZ 3.45Å; H572-R627 PolarHBondContact CD2-NH1 2.79Å; H572-R627 PolarHBondContact NE2-NH1 3.47Å; H572-R627 VanDerWaalsContact NE2-NH1 3.13Å
573	S	93.8	Very high	88.9	Confident	52 Å²	52	63 Å²	63	36%	0.364	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	44.1	44.7	-179.4	-46.1	0	0	0	0	113.7	V588 D589 G624	S573-V588 PolarHBondContact N-O 3.15Å; S573-D589 PolarHBondContact N-OD1 3.43Å; S573-D589 PolarHBondContact OG-OD2 2.98Å; S573-G624 WeakPolarHBondContact O-CA 3.29Å
574	V	93.8	Very high	89.1	Confident	1 Å²	1	58 Å²	58	1%	0.006	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	124.7	-169.9	165.5	0	0	0	0	113	L571 H572 K586 N587 V588 L614 P621 K623	L571-V574 HydrophobicContact CB-CB 4.37Å; L571-V574 HydrophobicContact CB-CG2 3.88Å; L571-V574 HydrophobicContact CD2-CG2 4.41Å; H572-V574 PolarHBondContact O-N 2.95Å; V574-K586 CarbonylContact O-C 3.58Å; V574-N587 PolarHBondContact O-N 2.89Å; V574-N587 VanDerWaalsContact O-N 3.1Å; V574-V588 HydrophobicContact CB-CB 4.5Å; V574-V588 PolarHBondContact N-O 3.45Å; V574-V588 PolarHBondContact O-N 3Å; V574-L614 HydrophobicContact CG1-CD1 4.43Å; V574-P621 HydrophobicContact CG1-CB 3.77Å; V574-P621 HydrophobicContact CG2-CB 4.14Å; V574-K623 WeakPolarHBondContact CA-O 3.48Å
575	D	93.4	Very high	89.3	Confident	33 Å²	33	56.6 Å²	56.6	18%	0.176	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	132.9	162.5	-76.6	-1.5	0	0	0	109.6	F585 K586 N587 I622 K623	D575-F585 WeakPolarHBondContact CA-O 3.38Å; D575-K586 VanDerWaalsContact OD1-CA 3.28Å; D575-K586 WeakPolarHBondContact OD1-CA 3.41Å; D575-N587 PolarHBondContact OD1-N 2.83Å; D575-I622 PolarHBondContact O-N 3.47Å; D575-K623 HydrophobicContact CB-CB 3.96Å; D575-K623 HydrophobicContact CB-CG 4.14Å; D575-K623 PolarHBondContact N-O 3.46Å; D575-K623 PolarHBondContact O-N 3.32Å; D575-K623 IonicContact OD2-NZ 2.66Å; D575-K623 PolarHBondContact OD2-NZ 3.37Å
576	F	93.5	Very high	89.6	Confident	15 Å²	15	58.1 Å²	58.1	7%	0.066	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	145.4	171.3	-175.6	-92.4	0	0	0	113.1	Y578 P583 L584 F585 T610 L614 L619 N620 I622	F576-Y578 HydrophobicContact CE1-CD1 4.35Å; F576-Y578 HydrophobicContact CE1-CD2 4.41Å; F576-Y578 HydrophobicContact CE1-CE1 4.11Å; F576-Y578 HydrophobicContact CE1-CE2 4.17Å; F576-Y578 HydrophobicContact CE1-CG 4.49Å; F576-Y578 HydrophobicContact CZ-CD1 4.29Å; F576-Y578 HydrophobicContact CZ-CE1 4.09Å; F576-P583 CarbonylContact O-C 3.56Å; F576-L584 PolarHBondContact O-N 2.83Å; F576-F585 HydrophobicContact CB-CB 4.37Å; F576-F585 HydrophobicContact CB-CD2 4.3Å; F576-F585 PolarHBondContact N-O 2.85Å; F576-F585 PolarHBondContact O-N 3.02Å; F576-T610 HydrophobicContact CD1-CG2 3.6Å; F576-T610 HydrophobicContact CE1-CG2 3.39Å; F576-T610 HydrophobicContact CZ-CG2 4.36Å; F576-L614 HydrophobicContact CB-CD1 3.95Å; F576-L614 HydrophobicContact CB-CD2 4.4Å; F576-L614 HydrophobicContact CD1-CD1 4.38Å; F576-L614 HydrophobicContact CD2-CD2 3.92Å; F576-L614 HydrophobicContact CE2-CD2 4.47Å; F576-L614 HydrophobicContact CG-CD1 4.07Å; F576-L614 HydrophobicContact CG-CD2 4.13Å; F576-L619 HydrophobicContact CE1-CD1 4.24Å; F576-L619 HydrophobicContact CE2-CB 4.34Å; F576-L619 HydrophobicContact CZ-CD1 3.9Å; F576-L619 HydrophobicContact CZ-CD2 4.42Å; F576-N620 WeakPolarHBondContact CD2-O 3.29Å; F576-N620 WeakPolarHBondContact CE2-O 3.45Å; F576-I622 HydrophobicContact CD2-CG1 4.42Å
577	G	90.7	Very high	90	Very high	10 Å²	10	58.6 Å²	58.6	10%	0.103	32%	0.318	C	S	.	.			trans	-160.8	155.8	171.7	0	0	0	0	0	110.7
578	Y	88.3	Confident	90.4	Very high	84 Å²	84	54.4 Å²	54.4	33%	0.329	29%	0.291	S	S	.	.			trans	-76.7	150.6	170.4	-65.7	-74.1	0	0	0	110.6	F576 G580 Q581 L584 T610	F576-Y578 HydrophobicContact CE1-CD1 4.35Å; F576-Y578 HydrophobicContact CE1-CD2 4.41Å; F576-Y578 HydrophobicContact CE1-CE1 4.11Å; F576-Y578 HydrophobicContact CE1-CE2 4.17Å; F576-Y578 HydrophobicContact CE1-CG 4.49Å; F576-Y578 HydrophobicContact CZ-CD1 4.29Å; F576-Y578 HydrophobicContact CZ-CE1 4.09Å; Y578-G580 PolarHBondContact O-N 3.26Å; Y578-Q581 WeakPolarHBondContact O-CB 3.41Å; Y578-Q581 PolarHBondContact O-N 2.88Å; Y578-L584 HydrophobicContact CD2-CD1 3.76Å; Y578-L584 HydrophobicContact CE2-CD1 3.57Å; Y578-T610 HydrophobicContact CE2-CG2 4.13Å; Y578-T610 WeakPolarHBondContact OH-CG2 3.4Å; Y578-T610 PolarHBondContact OH-OG1 2.97Å
579	E	85	Confident	90.5	Very high	196 Å²	196	58.2 Å²	58.2	92%	0.916	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	134.2	-176.3	-170.5	170.4	-160.7	0	0	111.8	Q581	E579-Q581 PolarHBondContact O-N 2.98Å
580	G	82.2	Confident	90.6	Very high	89 Å²	89	58.4 Å²	58.4	92%	0.918	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.7	4	-175.7	0	0	0	0	0	115.9	Y578	Y578-G580 PolarHBondContact O-N 3.26Å
581	Q	85.2	Confident	90.5	Very high	130 Å²	130	60.4 Å²	60.4	61%	0.607	33%	0.332	S	S	*	.	S	Bend	trans	-110.4	166.5	-178.8	-56.1	-171.7	15.7	0	0	112.8	Y578 E579	Y578-Q581 WeakPolarHBondContact O-CB 3.41Å; Y578-Q581 PolarHBondContact O-N 2.88Å; E579-Q581 PolarHBondContact O-N 2.98Å
582	K	84.6	Confident	90.5	Very high	159 Å²	159	60.6 Å²	60.6	69%	0.691	33%	0.333	S	S	*	.			trans	-61.4	136.5	168.4	-173.9	-172.9	174.2	-168.9	0	108.4	L584	K582-L584 PolarHBondContact O-N 3.46Å
583	P	87.6	Confident	90.4	Very high	48 Å²	48	61.9 Å²	61.9	31%	0.312	34%	0.342	S	S	.	.			trans	-56.9	136	173.1	23.4	-34	0	0	0	110.8	F576 K586 C759	F576-P583 CarbonylContact O-C 3.56Å; P583-K586 HydrophobicContact CB-CG 4.43Å; P583-K586 HydrophobicContact CG-CG 4.43Å; P583-C759 PolarHBondContact O-SG 3.24Å
584	L	88.9	Confident	90.1	Very high	33 Å²	33	61.1 Å²	61.1	17%	0.173	33%	0.333	C	S	.	.	S	Bend	trans	-84.5	-33.2	177.5	-65.8	176.7	0	0	0	111.2	F576 Y578 K582 T610 C759	F576-L584 PolarHBondContact O-N 2.83Å; Y578-L584 HydrophobicContact CD2-CD1 3.76Å; Y578-L584 HydrophobicContact CE2-CD1 3.57Å; K582-L584 PolarHBondContact O-N 3.46Å; L584-T610 HydrophobicContact CD1-CG2 4.23Å; L584-C759 WeakPolarHBondContact O-CA 3.43Å; L584-C759 WeakPolarHBondContact O-CB 3.3Å
585	F	93	Very high	89.9	Confident	1 Å²	1	66.9 Å²	66.9	0%	0.004	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	139.8	-179.2	-61.4	-65	0	0	0	110.4	D575 F576 V588 G607 T610 L611 L614 V756 C759 V761	D575-F585 WeakPolarHBondContact CA-O 3.38Å; F576-F585 HydrophobicContact CB-CB 4.37Å; F576-F585 HydrophobicContact CB-CD2 4.3Å; F576-F585 PolarHBondContact N-O 2.85Å; F576-F585 PolarHBondContact O-N 3.02Å; F585-V588 HydrophobicContact CB-CG2 3.83Å; F585-V588 HydrophobicContact CD1-CG2 3.92Å; F585-V588 HydrophobicContact CG-CG2 4.27Å; F585-G607 WeakPolarHBondContact CZ-O 3.34Å; F585-T610 HydrophobicContact CE2-CG2 4.12Å; F585-L611 HydrophobicContact CE1-CB 4.46Å; F585-L611 HydrophobicContact CE1-CD1 4.39Å; F585-L611 HydrophobicContact CE2-CB 4.21Å; F585-L611 HydrophobicContact CZ-CB 3.75Å; F585-L611 HydrophobicContact CZ-CD1 4.32Å; F585-L611 HydrophobicContact CZ-CG 4.47Å; F585-L614 HydrophobicContact CD2-CD1 3.89Å; F585-L614 HydrophobicContact CE2-CD1 4.21Å; F585-V756 HydrophobicContact CE1-CG1 3.72Å; F585-V756 HydrophobicContact CZ-CG1 4.25Å; F585-C759 CarbonylContact C-O 3.42Å; F585-C759 WeakPolarHBondContact CA-O 3.42Å; F585-V761 HydrophobicContact CD1-CG2 4.34Å; F585-V761 HydrophobicContact CE1-CG2 4.07Å
586	K	92.6	Very high	89.8	Confident	109 Å²	109	66.4 Å²	66.4	47%	0.474	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	129.3	174.4	-67.8	-176.1	-179.9	-179	0	110.2	V574 D575 P583 V588 C759	V574-K586 CarbonylContact O-C 3.58Å; D575-K586 VanDerWaalsContact OD1-CA 3.28Å; D575-K586 WeakPolarHBondContact OD1-CA 3.41Å; P583-K586 HydrophobicContact CB-CG 4.43Å; P583-K586 HydrophobicContact CG-CG 4.43Å; K586-V588 PolarHBondContact O-N 3.2Å; K586-V588 VanDerWaalsContact O-N 3.14Å; K586-C759 HydrophobicContact CG-CB 4.25Å; K586-C759 PolarHBondContact N-O 3.47Å
587	N	92.5	Very high	89.9	Confident	102 Å²	102	67.4 Å²	67.4	55%	0.545	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	42.2	46.8	179.6	-160.8	91.5	0	0	0	113.3	V574 D575 D589	V574-N587 PolarHBondContact O-N 2.89Å; V574-N587 VanDerWaalsContact O-N 3.1Å; D575-N587 PolarHBondContact OD1-N 2.83Å; N587-D589 PolarHBondContact O-N 3.29Å
588	V	92.1	Very high	90	Very high	6 Å²	6	67.1 Å²	67.1	4%	0.036	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	117.5	179.5	176	0	0	0	0	109.9	L571 S573 V574 F585 K586 F590 V761	L571-V588 HydrophobicContact CD1-CG1 4.49Å; S573-V588 PolarHBondContact N-O 3.15Å; V574-V588 HydrophobicContact CB-CB 4.5Å; V574-V588 PolarHBondContact N-O 3.45Å; V574-V588 PolarHBondContact O-N 3Å; F585-V588 HydrophobicContact CB-CG2 3.83Å; F585-V588 HydrophobicContact CD1-CG2 3.92Å; F585-V588 HydrophobicContact CG-CG2 4.27Å; K586-V588 PolarHBondContact O-N 3.2Å; K586-V588 VanDerWaalsContact O-N 3.14Å; V588-F590 HydrophobicContact CG1-CB 4.26Å; V588-V761 HydrophobicContact CG1-CB 4.47Å; V588-V761 HydrophobicContact CG1-CG2 3.85Å; V588-V761 HydrophobicContact CG2-CG2 4.42Å
589	D	92.1	Very high	90.2	Very high	82 Å²	82	63.1 Å²	63.1	44%	0.439	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	119.8	167.2	-74.4	-69.1	0	0	0	108.4	L571 H572 S573 N587	L571-D589 WeakPolarHBondContact O-CA 3.27Å; H572-D589 VanDerWaalsContact CA-OD1 3.27Å; H572-D589 WeakPolarHBondContact CA-OD1 3.41Å; H572-D589 IonicContact ND1-OD1 2.62Å; S573-D589 PolarHBondContact N-OD1 3.43Å; S573-D589 PolarHBondContact OG-OD2 2.98Å; N587-D589 PolarHBondContact O-N 3.29Å
590	F	92.6	Very high	90.6	Very high	8 Å²	8	53.8 Å²	53.8	4%	0.035	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	125.9	-176.8	172.9	-89.6	0	0	0	109.6	G570 L571 V588 I592 I598 L615 I737 W754	G570-F590 CarbonylContact C-O 3.56Å; G570-F590 WeakPolarHBondContact CA-O 3.34Å; L571-F590 PolarHBondContact N-O 3.13Å; L571-F590 PolarHBondContact O-N 3.16Å; V588-F590 HydrophobicContact CG1-CB 4.26Å; F590-I592 HydrophobicContact CE1-CG2 3.65Å; F590-I592 HydrophobicContact CZ-CG2 3.93Å; F590-I598 HydrophobicContact CE2-CD1 4.08Å; F590-I598 HydrophobicContact CE2-CG2 4.4Å; F590-I598 HydrophobicContact CZ-CD1 3.7Å; F590-I598 HydrophobicContact CZ-CG2 4.22Å; F590-L615 HydrophobicContact CD1-CD1 4.39Å; F590-L615 HydrophobicContact CD1-CD2 3.92Å; F590-L615 HydrophobicContact CE1-CD1 3.89Å; F590-L615 HydrophobicContact CE1-CD2 3.95Å; F590-I737 HydrophobicContact CE1-CD1 4.41Å; F590-W754 HydrophobicContact CD2-CD2 4.31Å; F590-W754 AromaticContact CD2-CE3 3.83Å; F590-W754 HydrophobicContact CD2-CE3 3.83Å; F590-W754 HydrophobicContact CD2-CH2 4.21Å; F590-W754 AromaticContact CD2-CZ3 3.77Å; F590-W754 HydrophobicContact CD2-CZ3 3.77Å; F590-W754 AromaticContact CE2-CD2 3.93Å; F590-W754 HydrophobicContact CE2-CD2 3.93Å; F590-W754 AromaticContact CE2-CE3 3.93Å; F590-W754 HydrophobicContact CE2-CE3 3.93Å; F590-W754 HydrophobicContact CE2-CG 4.43Å; F590-W754 HydrophobicContact CE2-CH2 4.5Å; F590-W754 HydrophobicContact CE2-CZ3 4.22Å
591	G	91.5	Very high	91	Very high	46 Å²	46	49.7 Å²	49.7	47%	0.474	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	157	-178.9	0	0	0	0	0	112.2
592	I	92.7	Very high	91	Very high	7 Å²	7	43.5 Å²	43.5	4%	0.036	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	150.7	175	78.2	-177.6	0	0	0	111.5	I568 L569 F590 I598 V707 A735 I737	I568-I592 HydrophobicContact CG2-CG1 4.47Å; L569-I592 HydrophobicContact CB-CD1 3.96Å; L569-I592 HydrophobicContact CB-CG1 4Å; L569-I592 HydrophobicContact CD2-CD1 4.02Å; L569-I592 HydrophobicContact CG-CD1 4.37Å; L569-I592 PolarHBondContact O-N 3.1Å; F590-I592 HydrophobicContact CE1-CG2 3.65Å; F590-I592 HydrophobicContact CZ-CG2 3.93Å; I592-I598 HydrophobicContact CG2-CD1 3.68Å; I592-V707 HydrophobicContact CD1-CG1 3.75Å; I592-V707 HydrophobicContact CD1-CG2 4.05Å; I592-A735 HydrophobicContact CD1-CB 4.07Å; I592-I737 HydrophobicContact CD1-CD1 4.06Å; I592-I737 HydrophobicContact CG2-CD1 4.04Å
593	D	91.6	Very high	90.9	Very high	89 Å²	89	38.5 Å²	38.5	48%	0.476	22%	0.215	S	C	.	.			trans	-110.1	167.1	170.3	-73.8	-58.6	0	0	0	111.2	D595 S596 A735	D593-D595 PolarHBondContact O-N 3.15Å; D593-D595 VanDerWaalsContact O-N 3.15Å; D593-S596 PolarHBondContact N-OG 3Å; D593-S596 VanDerWaalsContact O-CB 3.25Å; D593-S596 WeakPolarHBondContact O-CB 3.5Å; D593-S596 PolarHBondContact O-N 2.88Å; D593-S596 PolarHBondContact O-OG 3.3Å; D593-A735 WeakPolarHBondContact O-CB 3.45Å
594	M	87.7	Confident	90.7	Very high	35 Å²	35	38.3 Å²	38.3	17%	0.172	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-19.4	-172.5	-75.5	-64.4	-66.3	0	0	115.1	P561 L564 I568 D706 G734 A735	P561-M594 HydrophobicContact CB-CE 4.14Å; P561-M594 HydrophobicContact CG-CE 3.69Å; L564-M594 HydrophobicContact CB-CE 4.45Å; L564-M594 HydrophobicContact CB-SD 4.12Å; L564-M594 HydrophobicContact CD2-SD 4.36Å; I568-M594 HydrophobicContact CD1-CG 3.59Å; I568-M594 HydrophobicContact CD1-SD 3.93Å; I568-M594 HydrophobicContact CG1-CG 3.9Å; I568-M594 HydrophobicContact CG1-SD 4.26Å; I568-M594 HydrophobicContact CG2-SD 3.88Å; M594-D706 HydrophobicContact CE-CB 4.24Å; M594-G734 CarbonylContact O-C 3.55Å; M594-G734 WeakPolarHBondContact O-CA 3.34Å; M594-A735 PolarHBondContact O-N 3.26Å
595	D	89.7	Confident	90.2	Very high	122 Å²	122	40.1 Å²	40.1	65%	0.652	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.6	-9.6	176.8	55.7	-3.6	0	0	0	113.2	D593 R597	D593-D595 PolarHBondContact O-N 3.15Å; D593-D595 VanDerWaalsContact O-N 3.15Å; D595-R597 PolarHBondContact O-N 3.35Å; D595-R597 PolarHBondContact O-NH1 2.87Å
596	S	92.3	Very high	89.8	Confident	23 Å²	23	41.8 Å²	41.8	16%	0.161	25%	0.249	C	C	.	.			trans	-52.9	133.3	-173.2	-69.6	0	0	0	0	113.1	D593 V736	D593-S596 PolarHBondContact N-OG 3Å; D593-S596 VanDerWaalsContact O-CB 3.25Å; D593-S596 WeakPolarHBondContact O-CB 3.5Å; D593-S596 PolarHBondContact O-N 2.88Å; D593-S596 PolarHBondContact O-OG 3.3Å; S596-V736 PolarHBondContact O-N 3.44Å
597	R	94.1	Very high	89.5	Confident	37 Å²	37	37 Å²	37	14%	0.14	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	102.6	173.5	-67.4	-61.5	-176.6	-90.4	13.5	108.2	D595 I729 Y732 G734 C751 Q752	D595-R597 PolarHBondContact O-N 3.35Å; D595-R597 PolarHBondContact O-NH1 2.87Å; R597-I729 PolarHBondContact NH2-O 3.21Å; R597-Y732 PolarHBondContact NH2-O 3.44Å; R597-G734 PolarHBondContact NH1-O 3.18Å; R597-C751 WeakPolarHBondContact O-CA 3.44Å; R597-Q752 PolarHBondContact O-N 2.94Å
598	I	93.8	Very high	89.3	Confident	3 Å²	3	32.9 Å²	32.9	2%	0.015	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	126.6	-171.5	-65.8	175.1	0	0	0	109.2	F590 I592 I600 V736 I737 I738 W754	F590-I598 HydrophobicContact CE2-CD1 4.08Å; F590-I598 HydrophobicContact CE2-CG2 4.4Å; F590-I598 HydrophobicContact CZ-CD1 3.7Å; F590-I598 HydrophobicContact CZ-CG2 4.22Å; I592-I598 HydrophobicContact CG2-CD1 3.68Å; I598-I600 HydrophobicContact CG2-CG1 4.09Å; I598-V736 PolarHBondContact N-O 3.04Å; I598-I737 HydrophobicContact CG2-CG2 4.39Å; I598-I737 CarbonylContact O-C 3.6Å; I598-I737 WeakPolarHBondContact O-CA 3.39Å; I598-I738 PolarHBondContact O-N 3.45Å; I598-W754 HydrophobicContact CG2-CB 4.35Å; I598-W754 HydrophobicContact CG2-CG 4.07Å
599	C	93.6	Very high	89.1	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	122.3	165.7	-171.5	0	0	0	0	110.5	I738 I746 C751 Q752 W754	C599-I738 CarbonylContact C-O 2.92Å; C599-I738 WeakPolarHBondContact CA-O 3.36Å; C599-I738 PolarHBondContact SG-O 2.91Å; C599-I738 VanDerWaalsContact SG-O 3.33Å; C599-I746 HydrophobicContact CB-CG1 4.37Å; C599-I746 HydrophobicContact CB-CG2 4.05Å; C599-C751 HydrophobicContact CB-CB 3.73Å; C599-Q752 PolarHBondContact N-O 3.25Å; C599-W754 PolarHBondContact O-N 3.22Å
600	I	92.6	Very high	89.1	Confident	1 Å²	1	31.8 Å²	31.8	1%	0.005	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	115.5	177.4	-69	163.4	0	0	0	108.9	I598 K608 L611 L612 I737 I738 V739 W754 V756	I598-I600 HydrophobicContact CG2-CG1 4.09Å; I600-K608 HydrophobicContact CG2-CB 4.24Å; I600-K608 HydrophobicContact CG2-CD 4.22Å; I600-K608 HydrophobicContact CG2-CG 4.04Å; I600-L611 HydrophobicContact CD1-CD2 3.96Å; I600-L611 HydrophobicContact CG2-CD2 4.43Å; I600-L612 HydrophobicContact CD1-CD2 3.66Å; I600-I737 HydrophobicContact CD1-CG2 3.46Å; I600-I737 VanDerWaalsContact CD1-CG2 3.46Å; I600-I737 HydrophobicContact CG1-CG2 4.22Å; I600-I738 PolarHBondContact N-O 3.46Å; I600-V739 HydrophobicContact CB-CG2 3.86Å; I600-V739 HydrophobicContact CG2-CG2 4.08Å; I600-W754 CarbonylContact C-O 3.51Å; I600-W754 WeakPolarHBondContact CA-O 3.34Å; I600-V756 HydrophobicContact CG2-CG2 3.77Å
601	V	90.4	Very high	89	Confident	2 Å²	2	31.4 Å²	31.4	1%	0.012	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	179.7	-175.5	-57.5	0	0	0	0	111.6	L427 L753 W754 V755 V756 I764 Y771	L427-V601 HydrophobicContact CD2-CB 4.25Å; L427-V601 HydrophobicContact CD2-CG1 3.64Å; V601-L753 HydrophobicContact CG1-CD2 4.29Å; V601-L753 HydrophobicContact CG2-CB 4.49Å; V601-W754 PolarHBondContact N-O 3.18Å; V601-V755 HydrophobicContact CG2-CB 3.99Å; V601-V755 HydrophobicContact CG2-CG2 4.44Å; V601-V756 PolarHBondContact O-N 2.96Å; V601-V756 VanDerWaalsContact O-N 3.09Å; V601-I764 HydrophobicContact CG2-CD1 3.91Å; V601-Y771 HydrophobicContact CB-CE1 4.23Å; V601-Y771 HydrophobicContact CG2-CE1 4.11Å; V601-Y771 HydrophobicContact CG2-CE2 4.17Å
602	G	86.1	Confident	89.1	Confident	1 Å²	1	29.2 Å²	29.2	1%	0.01	18%	0.181	C	C	.	.	S	Bend	trans	111.7	173.3	-174.9	0	0	0	0	0	113.2	K608	G602-K608 PolarHBondContact O-NZ 3.12Å
603	P	82.4	Confident	89	Confident	54 Å²	54	31 Å²	31	35%	0.351	19%	0.191	S	C	.	.			trans	-69.6	162.6	-166.7	23.8	-31	0	0	0	114.2	D426 V606 K608	D426-P603 VanDerWaalsContact OD2-CA 3.22Å; D426-P603 WeakPolarHBondContact OD2-CA 3.45Å; P603-V606 HydrophobicContact CG-CB 4.15Å; P603-V606 HydrophobicContact CG-CG2 4.37Å; P603-V606 WeakPolarHBondContact O-CG1 3.17Å; P603-K608 PolarHBondContact O-NZ 2.9Å
604	N	82.6	Confident	89	Confident	43 Å²	43	26.9 Å²	26.9	23%	0.23	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	138	175.7	-89.3	3.1	0	0	0	112.7	W399 R402 D426 K608	W399-N604 HydrophobicContact CZ2-CB 4.35Å; R402-N604 PolarHBondContact NH2-ND2 3.25Å; D426-N604 HydrophobicContact CB-CB 4.18Å; D426-N604 PolarHBondContact OD2-N 3.12Å; N604-K608 PolarHBondContact OD1-NZ 3.26Å
605	G	77.9	Confident	89.2	Confident	72 Å²	72	25.2 Å²	25.2	74%	0.742	16%	0.16	S	C	*	.	T	Hydrogen-bonded Turn	trans	86.9	-5.7	-172.4	0	0	0	0	0	115.6	G607	G605-G607 VanDerWaalsContact C-N 3.28Å; G605-G607 PolarHBondContact O-N 2.95Å
606	V	85.1	Confident	89.2	Confident	36 Å²	36	20.2 Å²	20.2	22%	0.218	13%	0.134	C	C	.	.	S	Bend	trans	-72	-18.5	-178.4	80.7	0	0	0	0	114.3	P603 K608 V756	P603-V606 HydrophobicContact CG-CB 4.15Å; P603-V606 HydrophobicContact CG-CG2 4.37Å; P603-V606 WeakPolarHBondContact O-CG1 3.17Å; V606-K608 HydrophobicContact CG1-CG 4Å; V606-V756 HydrophobicContact CG1-CB 3.8Å; V606-V756 HydrophobicContact CG1-CG1 3.78Å; V606-V756 HydrophobicContact CG2-CG1 4.09Å; V606-V756 WeakPolarHBondContact CG2-O 3.23Å
607	G	85.4	Confident	89	Confident	7 Å²	7	20.6 Å²	20.6	7%	0.072	14%	0.142	C	C	.	.	S	Bend	trans	121.6	7.9	178.7	0	0	0	0	0	116.1	F585 G605 S609 T610 L611	F585-G607 WeakPolarHBondContact CZ-O 3.34Å; G605-G607 VanDerWaalsContact C-N 3.28Å; G605-G607 PolarHBondContact O-N 2.95Å; G607-S609 PolarHBondContact O-N 2.9Å; G607-T610 CarbonylContact O-C 3.46Å; G607-T610 WeakPolarHBondContact O-CA 3.4Å; G607-T610 VanDerWaalsContact O-CB 3.22Å; G607-T610 WeakPolarHBondContact O-CB 3.32Å; G607-T610 PolarHBondContact O-N 3.28Å; G607-L611 PolarHBondContact O-N 3.43Å
608	K	89.1	Confident	88.8	Confident	17 Å²	17	24.3 Å²	24.3	7%	0.074	16%	0.159	C	C	.	.	H	α-helix	trans	-45.7	-58.2	-179.6	-61.1	-165.1	-65.4	-83.1	0	113.3	I600 G602 P603 N604 V606 T610 L611 L612 V739 V756	I600-K608 HydrophobicContact CG2-CB 4.24Å; I600-K608 HydrophobicContact CG2-CD 4.22Å; I600-K608 HydrophobicContact CG2-CG 4.04Å; G602-K608 PolarHBondContact O-NZ 3.12Å; P603-K608 PolarHBondContact O-NZ 2.9Å; N604-K608 PolarHBondContact OD1-NZ 3.26Å; V606-K608 HydrophobicContact CG1-CG 4Å; K608-T610 VanDerWaalsContact C-N 3.29Å; K608-T610 PolarHBondContact O-N 3.26Å; K608-L611 WeakPolarHBondContact O-CB 3.33Å; K608-L611 PolarHBondContact O-N 2.9Å; K608-L611 VanDerWaalsContact O-N 3.15Å; K608-L612 PolarHBondContact O-N 3.22Å; K608-V739 HydrophobicContact CB-CG1 4.42Å; K608-V739 HydrophobicContact CB-CG2 4.09Å; K608-V739 HydrophobicContact CD-CG1 3.97Å; K608-V739 HydrophobicContact CD-CG2 4.49Å; K608-V756 HydrophobicContact CG-CG2 4.49Å
609	S	88.7	Confident	88.6	Confident	53 Å²	53	26.2 Å²	26.2	37%	0.371	17%	0.17	S	C	.	.	H	α-helix	trans	-62.2	-33.4	176.8	-47.9	0	0	0	0	113.1	G607 L612 L613 D711	G607-S609 PolarHBondContact O-N 2.9Å; S609-L612 PolarHBondContact O-N 3.47Å; S609-L613 VanDerWaalsContact O-CG 3.29Å; S609-L613 WeakPolarHBondContact O-CG 3.49Å; S609-L613 PolarHBondContact O-N 3.05Å; S609-D711 WeakPolarHBondContact CB-OD2 3.37Å; S609-D711 PolarHBondContact OG-OD2 3.49Å
610	T	90.4	Very high	88.5	Confident	12 Å²	12	32.5 Å²	32.5	7%	0.074	20%	0.203	C	C	.	.	H	α-helix	trans	-64.2	-39.1	175.1	-51.7	0	0	0	0	111.6	F576 Y578 L584 F585 G607 K608 L613 L614 L619	F576-T610 HydrophobicContact CD1-CG2 3.6Å; F576-T610 HydrophobicContact CE1-CG2 3.39Å; F576-T610 HydrophobicContact CZ-CG2 4.36Å; Y578-T610 HydrophobicContact CE2-CG2 4.13Å; Y578-T610 WeakPolarHBondContact OH-CG2 3.4Å; Y578-T610 PolarHBondContact OH-OG1 2.97Å; L584-T610 HydrophobicContact CD1-CG2 4.23Å; F585-T610 HydrophobicContact CE2-CG2 4.12Å; G607-T610 CarbonylContact O-C 3.46Å; G607-T610 WeakPolarHBondContact O-CA 3.4Å; G607-T610 VanDerWaalsContact O-CB 3.22Å; G607-T610 WeakPolarHBondContact O-CB 3.32Å; G607-T610 PolarHBondContact O-N 3.28Å; K608-T610 VanDerWaalsContact C-N 3.29Å; K608-T610 PolarHBondContact O-N 3.26Å; T610-L613 PolarHBondContact O-N 2.84Å; T610-L614 WeakPolarHBondContact O-CG 3.15Å; T610-L614 PolarHBondContact O-N 3.29Å; T610-L619 HydrophobicContact CG2-CD1 3.83Å
611	L	91.9	Very high	88.5	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-61.7	-43	173.5	-174.3	59.8	0	0	0	111.3	L571 F585 I600 G607 K608 L613 L614 L615 V756 V761	L571-L611 HydrophobicContact CD1-CD1 3.52Å; F585-L611 HydrophobicContact CE1-CB 4.46Å; F585-L611 HydrophobicContact CE1-CD1 4.39Å; F585-L611 HydrophobicContact CE2-CB 4.21Å; F585-L611 HydrophobicContact CZ-CB 3.75Å; F585-L611 HydrophobicContact CZ-CD1 4.32Å; F585-L611 HydrophobicContact CZ-CG 4.47Å; I600-L611 HydrophobicContact CD1-CD2 3.96Å; I600-L611 HydrophobicContact CG2-CD2 4.43Å; G607-L611 PolarHBondContact O-N 3.43Å; K608-L611 WeakPolarHBondContact O-CB 3.33Å; K608-L611 PolarHBondContact O-N 2.9Å; K608-L611 VanDerWaalsContact O-N 3.15Å; L611-L613 VanDerWaalsContact C-N 3.33Å; L611-L613 PolarHBondContact O-N 3.43Å; L611-L614 PolarHBondContact O-N 3.02Å; L611-L615 HydrophobicContact CG-CD1 4.3Å; L611-L615 WeakPolarHBondContact O-CB 2.78Å; L611-L615 WeakPolarHBondContact O-CG 3.26Å; L611-L615 PolarHBondContact O-N 3.44Å; L611-V756 HydrophobicContact CD2-CG2 4.14Å; L611-V761 HydrophobicContact CD1-CG2 4.31Å; L611-V761 HydrophobicContact CD2-CG1 4.13Å; L611-V761 HydrophobicContact CD2-CG2 3.76Å
612	L	92.4	Very high	88.5	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-65.8	-34.4	175.2	-55	-173.3	0	0	0	112.8	I600 K608 S609 L615 T616 F636 I709 D711 I737 V739	I600-L612 HydrophobicContact CD1-CD2 3.66Å; K608-L612 PolarHBondContact O-N 3.22Å; S609-L612 PolarHBondContact O-N 3.47Å; L612-L615 HydrophobicContact CD2-CD1 4.32Å; L612-L615 PolarHBondContact O-N 3.04Å; L612-T616 WeakPolarHBondContact O-CG2 2.97Å; L612-T616 PolarHBondContact O-N 2.84Å; L612-T616 PolarHBondContact O-OG1 3.12Å; L612-F636 HydrophobicContact CB-CE2 3.98Å; L612-I709 HydrophobicContact CB-CG2 3.92Å; L612-I709 HydrophobicContact CD1-CG2 3.87Å; L612-I709 HydrophobicContact CD2-CG2 3.7Å; L612-I709 HydrophobicContact CG-CG2 4.02Å; L612-D711 HydrophobicContact CD1-CB 3.61Å; L612-I737 HydrophobicContact CD2-CG2 3.86Å; L612-V739 HydrophobicContact CD1-CG2 3.87Å; L612-V739 HydrophobicContact CG-CG2 4.4Å
613	L	91.1	Very high	88.8	Confident	43 Å²	43	45.9 Å²	45.9	23%	0.225	27%	0.269	C	S	.	.	H	α-helix	trans	-71.4	-31.5	174.9	-70.3	172.1	0	0	0	112.8	S609 T610 L611 T616 G617 K618 L619 F636	S609-L613 VanDerWaalsContact O-CG 3.29Å; S609-L613 WeakPolarHBondContact O-CG 3.49Å; S609-L613 PolarHBondContact O-N 3.05Å; T610-L613 PolarHBondContact O-N 2.84Å; L611-L613 VanDerWaalsContact C-N 3.33Å; L611-L613 PolarHBondContact O-N 3.43Å; L613-T616 WeakPolarHBondContact CA-OG1 3.11Å; L613-T616 PolarHBondContact O-OG1 3.44Å; L613-T616 VanDerWaalsContact O-OG1 3.12Å; L613-G617 PolarHBondContact O-N 3.39Å; L613-K618 HydrophobicContact CB-CB 4.48Å; L613-K618 HydrophobicContact CD2-CB 3.89Å; L613-K618 HydrophobicContact CD2-CD 3.65Å; L613-K618 HydrophobicContact CD2-CG 4.38Å; L613-K618 PolarHBondContact O-N 2.89Å; L613-L619 HydrophobicContact CB-CB 4.44Å; L613-L619 HydrophobicContact CB-CD1 3.64Å; L613-L619 HydrophobicContact CB-CG 3.86Å; L613-L619 HydrophobicContact CD1-CD1 4.05Å; L613-L619 PolarHBondContact O-N 3.39Å; L613-F636 HydrophobicContact CD2-CE1 4.12Å; L613-F636 HydrophobicContact CD2-CZ 3.86Å
614	L	92.3	Very high	89.3	Confident	3 Å²	3	45.2 Å²	45.2	2%	0.016	27%	0.272	C	S	.	.	H	α-helix	trans	-68.2	-46.3	169	-70.9	164.3	0	0	0	111	L571 V574 F576 F585 T610 L611 T616 G617 L619 P621	L571-L614 HydrophobicContact CD2-CB 4.35Å; V574-L614 HydrophobicContact CG1-CD1 4.43Å; F576-L614 HydrophobicContact CB-CD1 3.95Å; F576-L614 HydrophobicContact CB-CD2 4.4Å; F576-L614 HydrophobicContact CD1-CD1 4.38Å; F576-L614 HydrophobicContact CD2-CD2 3.92Å; F576-L614 HydrophobicContact CE2-CD2 4.47Å; F576-L614 HydrophobicContact CG-CD1 4.07Å; F576-L614 HydrophobicContact CG-CD2 4.13Å; F585-L614 HydrophobicContact CD2-CD1 3.89Å; F585-L614 HydrophobicContact CE2-CD1 4.21Å; T610-L614 WeakPolarHBondContact O-CG 3.15Å; T610-L614 PolarHBondContact O-N 3.29Å; L611-L614 PolarHBondContact O-N 3.02Å; L614-T616 PolarHBondContact O-N 2.83Å; L614-G617 PolarHBondContact O-N 2.95Å; L614-L619 HydrophobicContact CD2-CB 3.94Å; L614-L619 HydrophobicContact CG-CB 4.32Å; L614-P621 HydrophobicContact CD2-CB 4.48Å
615	L	91.5	Very high	89.8	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-62.2	-38.4	178.4	-75.3	167	0	0	0	113.3	L569 L571 F590 L611 L612 G617 I709 I737	L569-L615 HydrophobicContact CD1-CD2 4.41Å; L569-L615 WeakPolarHBondContact CD1-O 3.47Å; L569-L615 HydrophobicContact CD2-CB 4.25Å; L569-L615 HydrophobicContact CD2-CD2 4.1Å; L569-L615 HydrophobicContact CG-CD2 4.05Å; L571-L615 HydrophobicContact CD1-CD2 4.25Å; L571-L615 HydrophobicContact CD1-CG 4.36Å; L571-L615 HydrophobicContact CD2-CD2 4.16Å; L571-L615 HydrophobicContact CG-CD2 3.9Å; L571-L615 HydrophobicContact CG-CG 4.48Å; F590-L615 HydrophobicContact CD1-CD1 4.39Å; F590-L615 HydrophobicContact CD1-CD2 3.92Å; F590-L615 HydrophobicContact CE1-CD1 3.89Å; F590-L615 HydrophobicContact CE1-CD2 3.95Å; L611-L615 HydrophobicContact CG-CD1 4.3Å; L611-L615 WeakPolarHBondContact O-CB 2.78Å; L611-L615 WeakPolarHBondContact O-CG 3.26Å; L611-L615 PolarHBondContact O-N 3.44Å; L612-L615 HydrophobicContact CD2-CD1 4.32Å; L612-L615 PolarHBondContact O-N 3.04Å; L615-G617 VanDerWaalsContact C-N 3.26Å; L615-G617 PolarHBondContact O-N 3.31Å; L615-I709 HydrophobicContact CB-CD1 4.11Å; L615-I737 HydrophobicContact CD1-CD1 3.93Å
616	T	89.9	Confident	90.5	Very high	17 Å²	17	46.1 Å²	46.1	10%	0.104	26%	0.256	C	S	.	.	H	α-helix	trans	-69.8	-24.9	172.4	48.4	0	0	0	0	112.7	L612 L613 L614 K628 V634 F636 I709	L612-T616 WeakPolarHBondContact O-CG2 2.97Å; L612-T616 PolarHBondContact O-N 2.84Å; L612-T616 PolarHBondContact O-OG1 3.12Å; L613-T616 WeakPolarHBondContact CA-OG1 3.11Å; L613-T616 PolarHBondContact O-OG1 3.44Å; L613-T616 VanDerWaalsContact O-OG1 3.12Å; L614-T616 PolarHBondContact O-N 2.83Å; T616-K628 PolarHBondContact O-NZ 2.95Å; T616-V634 HydrophobicContact CG2-CG1 4.01Å; T616-F636 HydrophobicContact CG2-CB 4Å; T616-F636 HydrophobicContact CG2-CD2 3.64Å; T616-F636 HydrophobicContact CG2-CE2 4.2Å; T616-F636 HydrophobicContact CG2-CG 3.85Å; T616-I709 HydrophobicContact CG2-CD1 4.14Å
617	G	88.1	Confident	90.8	Very high	32 Å²	32	50.2 Å²	50.2	33%	0.33	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.7	25.5	-170	0	0	0	0	0	113.2	L613 L614 L615 M626	L613-G617 PolarHBondContact O-N 3.39Å; L614-G617 PolarHBondContact O-N 2.95Å; L615-G617 VanDerWaalsContact C-N 3.26Å; L615-G617 PolarHBondContact O-N 3.31Å; G617-M626 VanDerWaalsContact CA-CE 3.43Å
618	K	88.6	Confident	91.2	Very high	114 Å²	114	54 Å²	54	50%	0.496	28%	0.282	S	S	.	.	S	Bend	trans	-81.1	-23.6	169.4	-75	-177.5	171.2	-174.8	0	112	L613 F636	L613-K618 HydrophobicContact CB-CB 4.48Å; L613-K618 HydrophobicContact CD2-CB 3.89Å; L613-K618 HydrophobicContact CD2-CD 3.65Å; L613-K618 HydrophobicContact CD2-CG 4.38Å; L613-K618 PolarHBondContact O-N 2.89Å; K618-F636 HydrophobicContact CD-CE1 4.38Å
619	L	90.6	Very high	91.3	Very high	44 Å²	44	54.6 Å²	54.6	23%	0.23	29%	0.286	C	S	.	.	S	Bend	trans	-115.8	142.1	168.5	-68	174.1	0	0	0	109.6	F576 T610 L613 L614	F576-L619 HydrophobicContact CE1-CD1 4.24Å; F576-L619 HydrophobicContact CE2-CB 4.34Å; F576-L619 HydrophobicContact CZ-CD1 3.9Å; F576-L619 HydrophobicContact CZ-CD2 4.42Å; T610-L619 HydrophobicContact CG2-CD1 3.83Å; L613-L619 HydrophobicContact CB-CB 4.44Å; L613-L619 HydrophobicContact CB-CD1 3.64Å; L613-L619 HydrophobicContact CB-CG 3.86Å; L613-L619 HydrophobicContact CD1-CD1 4.05Å; L613-L619 PolarHBondContact O-N 3.39Å; L614-L619 HydrophobicContact CD2-CB 3.94Å; L614-L619 HydrophobicContact CG-CB 4.32Å
620	N	90.6	Very high	91.3	Very high	132 Å²	132	61.4 Å²	61.4	71%	0.706	31%	0.312	S	S	*	.			trans	-92.5	139.3	172.8	-66.9	-23.1	0	0	0	109.8	F576	F576-N620 WeakPolarHBondContact CD2-O 3.29Å; F576-N620 WeakPolarHBondContact CE2-O 3.45Å
621	P	92.9	Very high	91.3	Very high	39 Å²	39	70.7 Å²	70.7	25%	0.253	35%	0.346	S	S	.	.			trans	-70.1	157.4	173.3	32.4	-36.4	0	0	0	111.5	V574 L614	V574-P621 HydrophobicContact CG1-CB 3.77Å; V574-P621 HydrophobicContact CG2-CB 4.14Å; L614-P621 HydrophobicContact CD2-CB 4.48Å
622	I	91.4	Very high	91.3	Very high	115 Å²	115	71.8 Å²	71.8	59%	0.59	35%	0.351	S	S	*	.	S	Bend	trans	-83.9	-37.7	176.2	-58.6	176.3	0	0	0	110.5	D575 F576	D575-I622 PolarHBondContact O-N 3.47Å; F576-I622 HydrophobicContact CD2-CG1 4.42Å
623	K	91.9	Very high	91.2	Very high	130 Å²	130	76.1 Å²	76.1	57%	0.565	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139	163.5	166.9	-45.7	-164.7	-157.3	104	0	109.5	V574 D575	V574-K623 WeakPolarHBondContact CA-O 3.48Å; D575-K623 HydrophobicContact CB-CB 3.96Å; D575-K623 HydrophobicContact CB-CG 4.14Å; D575-K623 PolarHBondContact N-O 3.46Å; D575-K623 PolarHBondContact O-N 3.32Å; D575-K623 IonicContact OD2-NZ 2.66Å; D575-K623 PolarHBondContact OD2-NZ 3.37Å
624	G	91.9	Very high	91.2	Very high	41 Å²	41	75.9 Å²	75.9	42%	0.423	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	75.3	-173.7	-170.3	0	0	0	0	0	111.3	H572 S573	H572-G624 WeakPolarHBondContact O-CA 3.48Å; S573-G624 WeakPolarHBondContact O-CA 3.29Å
625	E	93.3	Very high	91.1	Very high	92 Å²	92	75.7 Å²	75.7	43%	0.43	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	152.4	-179.7	59.9	177.6	168.8	0	0	112.4	H572 R627	H572-E625 PolarHBondContact N-O 2.9Å; H572-E625 PolarHBondContact O-N 2.86Å; H572-E625 VanDerWaalsContact O-N 3.09Å; E625-R627 HydrophobicContact CG-CG 4.23Å; E625-R627 IonicContact OE1-CZ 2.82Å; E625-R627 IonicContact OE1-NE 2.78Å; E625-R627 PolarHBondContact OE1-NE 3.48Å; E625-R627 IonicContact OE1-NH2 2.73Å; E625-R627 PolarHBondContact OE1-NH2 3Å
626	M	93.7	Very high	91.1	Very high	42 Å²	42	77 Å²	77	21%	0.207	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	121.4	166.3	179.5	-85.9	-71.8	0	0	108.5	L569 G570 L571 G617 K628	L569-M626 HydrophobicContact CD1-CG 3.95Å; L569-M626 HydrophobicContact CD1-SD 3.59Å; L569-M626 VanDerWaalsContact CD1-SD 3.59Å; G570-M626 CarbonylContact O-C 3.52Å; G570-M626 WeakPolarHBondContact O-CA 3.15Å; L571-M626 HydrophobicContact CD2-CB 3.68Å; L571-M626 HydrophobicContact CD2-CG 3.67Å; G617-M626 VanDerWaalsContact CA-CE 3.43Å; M626-K628 HydrophobicContact CE-CD 4.05Å; M626-K628 HydrophobicContact SD-CB 4.05Å; M626-K628 HydrophobicContact SD-CD 3.83Å; M626-K628 HydrophobicContact SD-CG 3.87Å
627	R	91.9	Very high	91.1	Very high	121 Å²	121	76.2 Å²	76.2	46%	0.457	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	135.9	175.1	-66	-176.2	-164.9	143.1	-5	109.6	L569 G570 H572 E625	L569-R627 CarbonylContact C-O 3.49Å; L569-R627 WeakPolarHBondContact CA-O 3.49Å; G570-R627 PolarHBondContact N-O 3.33Å; G570-R627 PolarHBondContact O-N 3.04Å; H572-R627 VanDerWaalsContact CD2-CD 3.46Å; H572-R627 WeakPolarHBondContact CD2-CD 3.35Å; H572-R627 VanDerWaalsContact CD2-CZ 3.45Å; H572-R627 PolarHBondContact CD2-NH1 2.79Å; H572-R627 PolarHBondContact NE2-NH1 3.47Å; H572-R627 VanDerWaalsContact NE2-NH1 3.13Å; E625-R627 HydrophobicContact CG-CG 4.23Å; E625-R627 IonicContact OE1-CZ 2.82Å; E625-R627 IonicContact OE1-NE 2.78Å; E625-R627 PolarHBondContact OE1-NE 3.48Å; E625-R627 IonicContact OE1-NH2 2.73Å; E625-R627 PolarHBondContact OE1-NH2 3Å
628	K	92.6	Very high	90.8	Very high	88 Å²	88	75.5 Å²	75.5	38%	0.383	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	149.5	171.7	60.6	-175.1	172.2	-173.5	0	111	I568 L569 T616 M626 H630 L632	I568-K628 WeakPolarHBondContact O-CA 3.31Å; L569-K628 HydrophobicContact CB-CB 4.5Å; L569-K628 HydrophobicContact CD1-CB 3.83Å; T616-K628 PolarHBondContact O-NZ 2.95Å; M626-K628 HydrophobicContact CE-CD 4.05Å; M626-K628 HydrophobicContact SD-CB 4.05Å; M626-K628 HydrophobicContact SD-CD 3.83Å; M626-K628 HydrophobicContact SD-CG 3.87Å; K628-H630 PolarHBondContact O-N 3.2Å; K628-L632 HydrophobicContact CB-CD2 4.03Å
629	N	92.3	Very high	89.9	Confident	28 Å²	28	74.7 Å²	74.7	15%	0.15	36%	0.357	C	S	.	.			trans	-59	132.5	172.6	-171.4	-47.6	0	0	0	109.7	L564 S565 I568 R631 L632	L564-N629 HydrophobicContact CD2-CB 4.16Å; L564-N629 HydrophobicContact CG-CB 4.43Å; S565-N629 PolarHBondContact O-ND2 2.65Å; S565-N629 PolarHBondContact OG-ND2 2.91Å; I568-N629 PolarHBondContact O-N 3.24Å; N629-R631 PolarHBondContact O-N 3.37Å; N629-R631 PolarHBondContact OD1-N 3.23Å; N629-L632 HydrophobicContact CB-CB 4.34Å; N629-L632 WeakPolarHBondContact O-CB 3.37Å; N629-L632 PolarHBondContact O-N 3.14Å
630	H	88.2	Confident	88.9	Confident	197 Å²	197	78.9 Å²	78.9	91%	0.912	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-16.1	-177.3	-61	-50.1	0	0	0	114.6	K628	K628-H630 PolarHBondContact O-N 3.2Å
631	R	90	Very high	87.7	Confident	207 Å²	207	73 Å²	73	78%	0.781	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.5	-5.6	175.3	-62.1	-177.1	-179.7	-176.5	0.5	113.8	L564 N629 K633	L564-R631 HydrophobicContact CD1-CB 4.04Å; N629-R631 PolarHBondContact O-N 3.37Å; N629-R631 PolarHBondContact OD1-N 3.23Å; R631-K633 PolarHBondContact O-N 3.39Å
632	L	91.3	Very high	86	Confident	22 Å²	22	72.3 Å²	72.3	12%	0.115	34%	0.341	C	S	.	.			trans	-66.9	121	-173.7	-166.5	81.3	0	0	0	112.4	L564 I568 L569 K628 N629 V634 D706 V707	L564-L632 HydrophobicContact CD2-CB 4.36Å; L564-L632 HydrophobicContact CD2-CD1 3.38Å; I568-L632 HydrophobicContact CG2-CD1 3.51Å; L569-L632 HydrophobicContact CB-CD2 3.91Å; K628-L632 HydrophobicContact CB-CD2 4.03Å; N629-L632 HydrophobicContact CB-CB 4.34Å; N629-L632 WeakPolarHBondContact O-CB 3.37Å; N629-L632 PolarHBondContact O-N 3.14Å; L632-V634 HydrophobicContact CD2-CG2 3.71Å; L632-V634 HydrophobicContact CG-CG2 4.21Å; L632-D706 HydrophobicContact CD1-CB 4.01Å; L632-V707 HydrophobicContact CD1-CG2 3.81Å; L632-V707 HydrophobicContact CD2-CG2 4.2Å; L632-V707 HydrophobicContact CG-CG2 4.27Å
633	K	90.8	Very high	84.6	Confident	92 Å²	92	72.8 Å²	72.8	40%	0.4	35%	0.345	S	S	.	.			trans	-96.3	113.4	168.8	-60	-171.8	-127.4	145.7	0	110.2	R631 Q704 P705 D706 V707	R631-K633 PolarHBondContact O-N 3.39Å; K633-Q704 PolarHBondContact NZ-O 2.96Å; K633-P705 WeakPolarHBondContact O-CA 3.03Å; K633-D706 PolarHBondContact N-OD2 3.41Å; K633-D706 PolarHBondContact O-N 2.64Å; K633-V707 PolarHBondContact O-N 3.19Å
634	V	91	Very high	83.3	Confident	37 Å²	37	71.1 Å²	71.1	22%	0.224	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	120.1	174.4	-174.7	0	0	0	0	109.7	T616 L632 I709	T616-V634 HydrophobicContact CG2-CG1 4.01Å; L632-V634 HydrophobicContact CD2-CG2 3.71Å; L632-V634 HydrophobicContact CG-CG2 4.21Å; V634-I709 HydrophobicContact CG1-CB 4.49Å; V634-I709 HydrophobicContact CG1-CD1 3.62Å; V634-I709 HydrophobicContact CG1-CG1 3.86Å
635	G	91.3	Very high	82.7	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	113.1	169.8	0	0	0	0	0	109.8	V707 I709	G635-V707 PolarHBondContact N-O 3.42Å; G635-I709 PolarHBondContact O-N 3.03Å
636	F	90.8	Very high	82.1	Confident	26 Å²	26	68.5 Å²	68.5	11%	0.114	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	122.9	-176.3	-178.3	-116.8	0	0	0	111.4	L612 L613 T616 K618 N638 I709	L612-F636 HydrophobicContact CB-CE2 3.98Å; L613-F636 HydrophobicContact CD2-CE1 4.12Å; L613-F636 HydrophobicContact CD2-CZ 3.86Å; T616-F636 HydrophobicContact CG2-CB 4Å; T616-F636 HydrophobicContact CG2-CD2 3.64Å; T616-F636 HydrophobicContact CG2-CE2 4.2Å; T616-F636 HydrophobicContact CG2-CG 3.85Å; K618-F636 HydrophobicContact CD-CE1 4.38Å; F636-N638 HydrophobicContact CD1-CB 4.26Å; F636-N638 HydrophobicContact CE1-CB 3.51Å; F636-N638 VanDerWaalsContact CE1-CG 3.41Å; F636-N638 WeakPolarHBondContact CE1-OD1 3.46Å; F636-N638 HydrophobicContact CE2-CB 4.25Å; F636-N638 HydrophobicContact CZ-CB 3.52Å; F636-I709 WeakPolarHBondContact CA-O 3.43Å; F636-I709 HydrophobicContact CD2-CB 4.06Å; F636-I709 HydrophobicContact CD2-CG2 3.78Å; F636-I709 HydrophobicContact CE2-CG2 4.07Å
637	F	89.1	Confident	81.6	Confident	1 Å²	1	69.5 Å²	69.5	0%	0.004	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	131.9	167.7	-173.3	-83.8	0	0	0	108.4	Y641 A693 V696 F697 L700 I709 L710 D711 P713	F637-Y641 AromaticContact CE1-CD1 3.86Å; F637-Y641 HydrophobicContact CE1-CD1 3.86Å; F637-Y641 HydrophobicContact CE1-CE1 4.06Å; F637-Y641 HydrophobicContact CE2-CD1 4.08Å; F637-Y641 HydrophobicContact CE2-CE1 4.42Å; F637-Y641 HydrophobicContact CE2-CG 4.35Å; F637-Y641 AromaticContact CZ-CD1 3.54Å; F637-Y641 HydrophobicContact CZ-CD1 3.54Å; F637-Y641 AromaticContact CZ-CE1 3.61Å; F637-Y641 HydrophobicContact CZ-CE1 3.61Å; F637-Y641 HydrophobicContact CZ-CG 4.25Å; F637-A693 HydrophobicContact CE2-CB 4.42Å; F637-A693 HydrophobicContact CZ-CB 4.23Å; F637-V696 HydrophobicContact CD2-CB 4.39Å; F637-V696 HydrophobicContact CD2-CG1 3.79Å; F637-V696 HydrophobicContact CE2-CB 4.26Å; F637-V696 HydrophobicContact CE2-CG1 4.14Å; F637-F697 HydrophobicContact CD2-CD1 4.33Å; F637-F697 AromaticContact CD2-CE1 3.91Å; F637-F697 HydrophobicContact CD2-CE1 3.91Å; F637-F697 HydrophobicContact CD2-CE2 4.12Å; F637-F697 AromaticContact CD2-CZ 3.78Å; F637-F697 HydrophobicContact CD2-CZ 3.78Å; F637-F697 HydrophobicContact CE1-CZ 4.36Å; F637-F697 AromaticContact CE2-CD2 4Å; F637-F697 HydrophobicContact CE2-CD2 4Å; F637-F697 HydrophobicContact CE2-CE1 4.16Å; F637-F697 AromaticContact CE2-CE2 3.51Å; F637-F697 HydrophobicContact CE2-CE2 3.51Å; F637-F697 HydrophobicContact CE2-CG 4.49Å; F637-F697 AromaticContact CE2-CZ 3.6Å; F637-F697 HydrophobicContact CE2-CZ 3.6Å; F637-F697 HydrophobicContact CG-CE1 4.36Å; F637-F697 HydrophobicContact CG-CZ 4.25Å; F637-F697 AromaticContact CZ-CE2 3.84Å; F637-F697 HydrophobicContact CZ-CE2 3.84Å; F637-F697 AromaticContact CZ-CZ 3.91Å; F637-F697 HydrophobicContact CZ-CZ 3.91Å; F637-L700 HydrophobicContact CB-CD1 3.88Å; F637-L700 HydrophobicContact CD2-CD1 4.04Å; F637-L700 HydrophobicContact CG-CD1 4.48Å; F637-I709 PolarHBondContact N-O 3.48Å; F637-L710 HydrophobicContact CB-CD2 3.6Å; F637-L710 HydrophobicContact CG-CD2 4.46Å; F637-D711 PolarHBondContact O-N 3.31Å; F637-P713 HydrophobicContact CD1-CB 4.39Å; F637-P713 HydrophobicContact CE1-CB 4.49Å
638	N	83.1	Confident	81.4	Confident	17 Å²	17	71.6 Å²	71.6	9%	0.091	34%	0.338	C	S	.	.			trans	-147.3	149.5	176.6	72.7	-59.7	0	0	0	111.9	F636 Q640 Y641 Q644 D711	F636-N638 HydrophobicContact CD1-CB 4.26Å; F636-N638 HydrophobicContact CE1-CB 3.51Å; F636-N638 VanDerWaalsContact CE1-CG 3.41Å; F636-N638 WeakPolarHBondContact CE1-OD1 3.46Å; F636-N638 HydrophobicContact CE2-CB 4.25Å; F636-N638 HydrophobicContact CZ-CB 3.52Å; N638-Q640 CarbonylContact O-C 3.56Å; N638-Q640 PolarHBondContact O-N 2.98Å; N638-Y641 WeakPolarHBondContact O-CA 3.45Å; N638-Y641 WeakPolarHBondContact O-CB 3.41Å; N638-Y641 WeakPolarHBondContact O-CD1 3.21Å; N638-Y641 PolarHBondContact O-N 2.95Å; N638-Q644 PolarHBondContact OD1-NE2 2.85Å; N638-D711 HydrophobicContact CB-CB 4.18Å
639	Q	69.4	Low	81.3	Confident	98 Å²	98	69.6 Å²	69.6	46%	0.458	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-50.8	-28.4	-172.2	-163.4	-178.9	68.9	0	0	115.3	Y641 E712 N715	Q639-Y641 PolarHBondContact O-N 2.89Å; Q639-E712 PolarHBondContact NE2-OE2 2.85Å; Q639-N715 PolarHBondContact NE2-ND2 2.86Å
640	Q	68.8	Low	81.3	Confident	131 Å²	131	69 Å²	69	61%	0.612	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-81.8	25.3	171.1	-63.3	172.4	-38.1	0	0	113.6	N638 A642 D643 Q644	N638-Q640 CarbonylContact O-C 3.56Å; N638-Q640 PolarHBondContact O-N 2.98Å; Q640-A642 PolarHBondContact O-N 2.93Å; Q640-D643 PolarHBondContact O-N 3.33Å; Q640-Q644 PolarHBondContact O-NE2 2.94Å; Q640-Q644 VanDerWaalsContact O-NE2 3.15Å
641	Y	65.8	Low	81.4	Confident	9 Å²	9	59.6 Å²	59.6	4%	0.035	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-63.9	-28.7	178.4	63.5	-99.7	0	0	0	111.8	F637 N638 Q639 D643 Q644 G689 K692 A693 V696 N716	F637-Y641 AromaticContact CE1-CD1 3.86Å; F637-Y641 HydrophobicContact CE1-CD1 3.86Å; F637-Y641 HydrophobicContact CE1-CE1 4.06Å; F637-Y641 HydrophobicContact CE2-CD1 4.08Å; F637-Y641 HydrophobicContact CE2-CE1 4.42Å; F637-Y641 HydrophobicContact CE2-CG 4.35Å; F637-Y641 AromaticContact CZ-CD1 3.54Å; F637-Y641 HydrophobicContact CZ-CD1 3.54Å; F637-Y641 AromaticContact CZ-CE1 3.61Å; F637-Y641 HydrophobicContact CZ-CE1 3.61Å; F637-Y641 HydrophobicContact CZ-CG 4.25Å; N638-Y641 WeakPolarHBondContact O-CA 3.45Å; N638-Y641 WeakPolarHBondContact O-CB 3.41Å; N638-Y641 WeakPolarHBondContact O-CD1 3.21Å; N638-Y641 PolarHBondContact O-N 2.95Å; Q639-Y641 PolarHBondContact O-N 2.89Å; Y641-D643 VanDerWaalsContact C-N 3.27Å; Y641-D643 PolarHBondContact O-N 3.39Å; Y641-Q644 PolarHBondContact O-N 3.34Å; Y641-G689 PolarHBondContact OH-O 2.88Å; Y641-K692 HydrophobicContact CD2-CB 4.48Å; Y641-K692 HydrophobicContact CE2-CB 3.8Å; Y641-A693 HydrophobicContact CE2-CB 4.1Å; Y641-V696 HydrophobicContact CD2-CG2 3.9Å; Y641-V696 HydrophobicContact CG-CG2 4.35Å; Y641-N716 PolarHBondContact OH-ND2 3.12Å
642	A	57.6	Low	81.5	Confident	25 Å²	25	49.8 Å²	49.8	21%	0.207	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-59.7	-38.8	179.8	0	0	0	0	0	112	Q640 Q644 L645 M647 K692	Q640-A642 PolarHBondContact O-N 2.93Å; A642-Q644 VanDerWaalsContact C-N 3.26Å; A642-Q644 PolarHBondContact O-N 3.4Å; A642-L645 PolarHBondContact O-N 3.15Å; A642-M647 WeakPolarHBondContact O-CE 2.88Å; A642-K692 HydrophobicContact CB-CD 4.24Å
643	D	61.2	Low	81.5	Confident	125 Å²	125	53.3 Å²	53.3	67%	0.668	26%	0.263	S	S	*	.	G	3₁₀ helix	trans	-78.4	-11.8	-175.6	-49.8	-39.4	0	0	0	112.8	Q640 Y641	Q640-D643 PolarHBondContact O-N 3.33Å; Y641-D643 VanDerWaalsContact C-N 3.27Å; Y641-D643 PolarHBondContact O-N 3.39Å
644	Q	66.2	Low	81.5	Confident	94 Å²	94	49.3 Å²	49.3	44%	0.439	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-89.4	-4.4	173.4	-71	162.9	92.4	0	0	112.6	N638 Q640 Y641 A642	N638-Q644 PolarHBondContact OD1-NE2 2.85Å; Q640-Q644 PolarHBondContact O-NE2 2.94Å; Q640-Q644 VanDerWaalsContact O-NE2 3.15Å; Y641-Q644 PolarHBondContact O-N 3.34Å; A642-Q644 VanDerWaalsContact C-N 3.26Å; A642-Q644 PolarHBondContact O-N 3.4Å
645	L	78.2	Confident	81.5	Confident	7 Å²	7	47.6 Å²	47.6	4%	0.037	23%	0.234	C	C	.	.	S	Bend	trans	-96.2	134	177.5	-64.5	172	0	0	0	111.4	A642 M647 Y654 I684 K692 V695 V696	A642-L645 PolarHBondContact O-N 3.15Å; L645-M647 PolarHBondContact O-N 3.35Å; L645-M647 VanDerWaalsContact O-N 3.1Å; L645-Y654 HydrophobicContact CD2-CD1 4.41Å; L645-Y654 HydrophobicContact CD2-CE1 3.74Å; L645-Y654 HydrophobicContact CD2-CE2 4.15Å; L645-I684 HydrophobicContact CB-CG2 3.85Å; L645-I684 HydrophobicContact CD1-CG2 3.82Å; L645-I684 HydrophobicContact CG-CG2 4.43Å; L645-K692 HydrophobicContact CD1-CB 3.92Å; L645-K692 HydrophobicContact CD1-CG 4.17Å; L645-V695 HydrophobicContact CD2-CG1 4.15Å; L645-V696 HydrophobicContact CD1-CG2 3.97Å; L645-V696 HydrophobicContact CD2-CG2 3.81Å; L645-V696 HydrophobicContact CG-CG2 4.07Å
646	N	80.4	Confident	81.5	Confident	71 Å²	71	50.7 Å²	50.7	38%	0.38	25%	0.25	S	C	.	.			trans	-67.3	109.6	172.2	-78.7	28.2	0	0	0	110.3	E648 E649 Y654 R657	N646-E648 VanDerWaalsContact C-N 3.28Å; N646-E648 PolarHBondContact O-N 3.26Å; N646-E649 WeakPolarHBondContact CB-OE2 3.12Å; N646-E649 VanDerWaalsContact CG-OE2 3.27Å; N646-E649 PolarHBondContact ND2-OE2 3.24Å; N646-Y654 HydrophobicContact CB-CD2 4.38Å; N646-R657 PolarHBondContact ND2-NH1 2.9Å; N646-R657 PolarHBondContact ND2-NH2 3.09Å
647	M	84.6	Confident	81.5	Confident	63 Å²	63	55.1 Å²	55.1	31%	0.31	27%	0.266	S	S	.	.	S	Bend	trans	-69.9	-21	-170.7	-65.3	-68.4	179.2	0	0	114.4	A642 L645 I684 S685 K692	A642-M647 WeakPolarHBondContact O-CE 2.88Å; L645-M647 PolarHBondContact O-N 3.35Å; L645-M647 VanDerWaalsContact O-N 3.1Å; M647-I684 HydrophobicContact SD-CG2 4.45Å; M647-S685 WeakPolarHBondContact O-CA 3.37Å; M647-S685 WeakPolarHBondContact O-CB 3.33Å; M647-S685 PolarHBondContact O-N 2.91Å; M647-S685 PolarHBondContact O-OG 3.3Å; M647-K692 PolarHBondContact SD-NZ 3Å; M647-K692 VanDerWaalsContact SD-NZ 3.39Å
648	E	86.9	Confident	81.4	Confident	165 Å²	165	57.7 Å²	57.7	77%	0.771	28%	0.28	S	S	*	.	S	Bend	trans	-88	-31.9	-173.3	-59.4	-176.8	159.2	0	0	113.2	N646 Q683	N646-E648 VanDerWaalsContact C-N 3.28Å; N646-E648 PolarHBondContact O-N 3.26Å; E648-Q683 WeakPolarHBondContact O-CG 3.47Å; E648-Q683 PolarHBondContact O-NE2 3.02Å
649	E	89.8	Confident	81.6	Confident	46 Å²	46	59.3 Å²	59.3	22%	0.215	29%	0.286	C	S	.	.	S	Bend	trans	-78.8	159.2	-179.7	-67	171	120.9	0	0	111.5	N646 R657 Q683 I684	N646-E649 WeakPolarHBondContact CB-OE2 3.12Å; N646-E649 VanDerWaalsContact CG-OE2 3.27Å; N646-E649 PolarHBondContact ND2-OE2 3.24Å; E649-R657 IonicContact OE1-CZ 3.25Å; E649-R657 IonicContact OE1-NE 2.71Å; E649-R657 IonicContact OE1-NH1 2.64Å; E649-R657 PolarHBondContact OE1-NH1 3.29Å; E649-R657 IonicContact OE2-CZ 2.84Å; E649-R657 IonicContact OE2-NH1 3.89Å; E649-R657 PolarHBondContact OE2-NH1 3.19Å; E649-R657 IonicContact OE2-NH2 2.96Å; E649-Q683 CarbonylContact O-C 3.52Å; E649-Q683 WeakPolarHBondContact O-CA 3.37Å; E649-I684 WeakPolarHBondContact O-CG1 3.37Å; E649-I684 PolarHBondContact O-N 3.19Å
650	T	92.5	Very high	82.6	Confident	15 Å²	15	61.8 Å²	61.8	9%	0.092	30%	0.302	C	S	.	.	B	Isolated β-bridge	trans	-81.5	157.9	169.9	71.5	0	0	0	0	111.8	T652 E653 Y654 I682	T650-T652 PolarHBondContact O-N 2.81Å; T650-T652 VanDerWaalsContact O-N 3.12Å; T650-E653 WeakPolarHBondContact CA-OE2 3.5Å; T650-E653 WeakPolarHBondContact CB-OE2 3.21Å; T650-E653 VanDerWaalsContact CG2-OE2 3.26Å; T650-E653 WeakPolarHBondContact CG2-OE2 3.33Å; T650-E653 PolarHBondContact N-OE2 3.1Å; T650-E653 PolarHBondContact O-N 3.14Å; T650-E653 PolarHBondContact OG1-N 2.95Å; T650-E653 PolarHBondContact OG1-OE2 3.1Å; T650-Y654 WeakPolarHBondContact O-CB 3.49Å; T650-Y654 PolarHBondContact O-N 2.88Å; T650-I682 WeakPolarHBondContact CA-O 3.45Å
651	A	90.1	Very high	83.5	Confident	0 Å²	0	58 Å²	58	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-55.9	-28.8	176.5	0	0	0	0	0	113.8	L670 L675 L687 V695	A651-L670 HydrophobicContact CB-CD1 3.97Å; A651-L670 HydrophobicContact CB-CD2 4.16Å; A651-L675 HydrophobicContact CB-CD2 3.81Å; A651-L687 HydrophobicContact CB-CD1 4.4Å; A651-V695 HydrophobicContact CB-CG2 3.71Å
652	T	92.2	Very high	84.8	Confident	1 Å²	1	61.1 Å²	61.1	1%	0.006	31%	0.307	C	S	.	.	H	α-helix	trans	-76.2	-47.3	177.8	-50.9	0	0	0	0	111.6	T650 Y654 L655 M656 Y663 R667 H680	T650-T652 PolarHBondContact O-N 2.81Å; T650-T652 VanDerWaalsContact O-N 3.12Å; T652-Y654 VanDerWaalsContact C-N 3.32Å; T652-Y654 PolarHBondContact O-N 2.83Å; T652-L655 PolarHBondContact O-N 3.29Å; T652-M656 HydrophobicContact CG2-CG 4.45Å; T652-M656 HydrophobicContact CG2-SD 4.08Å; T652-M656 VanDerWaalsContact O-CG 3.3Å; T652-M656 WeakPolarHBondContact O-CG 3.43Å; T652-M656 PolarHBondContact O-N 2.87Å; T652-Y663 HydrophobicContact CG2-CD2 3.63Å; T652-Y663 HydrophobicContact CG2-CE2 3.76Å; T652-Y663 HydrophobicContact CG2-CG 4.38Å; T652-R667 HydrophobicContact CG2-CG 3.73Å; T652-H680 PolarHBondContact N-O 2.99Å; T652-H680 PolarHBondContact OG1-O 3.14Å
653	E	91.9	Very high	86.3	Confident	97 Å²	97	65.2 Å²	65.2	45%	0.453	32%	0.318	S	S	.	.	H	α-helix	trans	-61.7	-40.8	179	-70.8	144.7	173.4	0	0	111.4	T650 L655 M656 R657	T650-E653 WeakPolarHBondContact CA-OE2 3.5Å; T650-E653 WeakPolarHBondContact CB-OE2 3.21Å; T650-E653 VanDerWaalsContact CG2-OE2 3.26Å; T650-E653 WeakPolarHBondContact CG2-OE2 3.33Å; T650-E653 PolarHBondContact N-OE2 3.1Å; T650-E653 PolarHBondContact O-N 3.14Å; T650-E653 PolarHBondContact OG1-N 2.95Å; T650-E653 PolarHBondContact OG1-OE2 3.1Å; E653-L655 PolarHBondContact O-N 2.96Å; E653-M656 PolarHBondContact O-N 3.23Å; E653-M656 VanDerWaalsContact O-N 3.14Å; E653-R657 WeakPolarHBondContact O-CB 3.22Å; E653-R657 PolarHBondContact O-N 3.06Å
654	Y	91.3	Very high	87.7	Confident	8 Å²	8	65.8 Å²	65.8	3%	0.031	32%	0.317	C	S	.	.	H	α-helix	trans	-54.1	-47.5	175.7	-177	-99.1	0	0	0	112.8	L645 N646 T650 T652 N658 I684 V695 E699	L645-Y654 HydrophobicContact CD2-CD1 4.41Å; L645-Y654 HydrophobicContact CD2-CE1 3.74Å; L645-Y654 HydrophobicContact CD2-CE2 4.15Å; N646-Y654 HydrophobicContact CB-CD2 4.38Å; T650-Y654 WeakPolarHBondContact O-CB 3.49Å; T650-Y654 PolarHBondContact O-N 2.88Å; T652-Y654 VanDerWaalsContact C-N 3.32Å; T652-Y654 PolarHBondContact O-N 2.83Å; Y654-N658 VanDerWaalsContact CE2-ND2 3.29Å; Y654-N658 WeakPolarHBondContact CE2-ND2 3.46Å; Y654-N658 VanDerWaalsContact O-CB 3.31Å; Y654-N658 WeakPolarHBondContact O-CB 3.35Å; Y654-N658 VanDerWaalsContact O-CG 3.24Å; Y654-N658 PolarHBondContact O-N 3.42Å; Y654-I684 HydrophobicContact CD2-CD1 4.27Å; Y654-I684 HydrophobicContact CG-CD1 4.06Å; Y654-V695 HydrophobicContact CD1-CG1 4.14Å; Y654-V695 HydrophobicContact CE1-CG1 4.47Å; Y654-E699 HydrophobicContact CE1-CB 4.43Å; Y654-E699 HydrophobicContact CE1-CG 4.06Å; Y654-E699 VanDerWaalsContact OH-CD 3.31Å; Y654-E699 PolarHBondContact OH-OE1 2.81Å; Y654-E699 PolarHBondContact OH-OE2 3.46Å
655	L	90.3	Very high	88.8	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-72.4	-35.6	176.3	-66.7	-175.5	0	0	0	112.9	T652 E653 F659 C669 L670 E699	T652-L655 PolarHBondContact O-N 3.29Å; E653-L655 PolarHBondContact O-N 2.96Å; L655-F659 HydrophobicContact CD2-CD2 4.06Å; L655-F659 HydrophobicContact CD2-CE2 3.84Å; L655-F659 PolarHBondContact O-N 2.94Å; L655-C669 HydrophobicContact CD1-CB 4.4Å; L655-L670 HydrophobicContact CD1-CD1 4.35Å; L655-L670 HydrophobicContact CD1-CD2 3.71Å; L655-L670 HydrophobicContact CD1-CG 3.72Å; L655-E699 HydrophobicContact CD2-CB 4.16Å
656	M	91.2	Very high	89.4	Confident	65 Å²	65	64.1 Å²	64.1	32%	0.32	31%	0.311	S	S	.	.	H	α-helix	trans	-61.6	-47.4	175.1	-70.4	177.1	60.5	0	0	111.1	T652 E653 N660 L661 Y663 S666	T652-M656 HydrophobicContact CG2-CG 4.45Å; T652-M656 HydrophobicContact CG2-SD 4.08Å; T652-M656 VanDerWaalsContact O-CG 3.3Å; T652-M656 WeakPolarHBondContact O-CG 3.43Å; T652-M656 PolarHBondContact O-N 2.87Å; E653-M656 PolarHBondContact O-N 3.23Å; E653-M656 VanDerWaalsContact O-N 3.14Å; M656-N660 WeakPolarHBondContact O-CA 3.29Å; M656-N660 PolarHBondContact O-N 2.7Å; M656-L661 WeakPolarHBondContact CG-O 3.49Å; M656-L661 PolarHBondContact O-N 2.72Å; M656-Y663 HydrophobicContact SD-CD2 3.71Å; M656-Y663 HydrophobicContact SD-CG 4.24Å; M656-S666 WeakPolarHBondContact CG-OG 3.28Å
657	R	90.3	Very high	89.9	Confident	119 Å²	119	63.7 Å²	63.7	45%	0.449	30%	0.304	S	S	.	.	H	α-helix	trans	-71.3	-43.5	-177.2	-168	-162.9	69.8	-165	-2	112.7	N646 E649 E653 F659	N646-R657 PolarHBondContact ND2-NH1 2.9Å; N646-R657 PolarHBondContact ND2-NH2 3.09Å; E649-R657 IonicContact OE1-CZ 3.25Å; E649-R657 IonicContact OE1-NE 2.71Å; E649-R657 IonicContact OE1-NH1 2.64Å; E649-R657 PolarHBondContact OE1-NH1 3.29Å; E649-R657 IonicContact OE2-CZ 2.84Å; E649-R657 IonicContact OE2-NH1 3.89Å; E649-R657 PolarHBondContact OE2-NH1 3.19Å; E649-R657 IonicContact OE2-NH2 2.96Å; E653-R657 WeakPolarHBondContact O-CB 3.22Å; E653-R657 PolarHBondContact O-N 3.06Å; R657-F659 VanDerWaalsContact C-N 3.34Å; R657-F659 PolarHBondContact O-N 3.02Å
658	N	88	Confident	90.1	Very high	56 Å²	56	66.5 Å²	66.5	30%	0.299	32%	0.315	S	S	.	.	H	α-helix	trans	-77.1	-19.2	-174.6	-66.8	-2.5	0	0	0	113.4	Y654	Y654-N658 VanDerWaalsContact CE2-ND2 3.29Å; Y654-N658 WeakPolarHBondContact CE2-ND2 3.46Å; Y654-N658 VanDerWaalsContact O-CB 3.31Å; Y654-N658 WeakPolarHBondContact O-CB 3.35Å; Y654-N658 VanDerWaalsContact O-CG 3.24Å; Y654-N658 PolarHBondContact O-N 3.42Å
659	F	87.9	Confident	90.1	Very high	51 Å²	51	59.6 Å²	59.6	22%	0.224	29%	0.285	C	S	.	.	H	α-helix	trans	-131.7	3.3	-175.1	-57.8	-76.6	0	0	0	114.9	L655 R657 L661 E699 C702 R703	L655-F659 HydrophobicContact CD2-CD2 4.06Å; L655-F659 HydrophobicContact CD2-CE2 3.84Å; L655-F659 PolarHBondContact O-N 2.94Å; R657-F659 VanDerWaalsContact C-N 3.34Å; R657-F659 PolarHBondContact O-N 3.02Å; F659-L661 HydrophobicContact CB-CD1 3.79Å; F659-L661 HydrophobicContact CB-CG 3.76Å; F659-L661 HydrophobicContact CG-CD1 4.42Å; F659-L661 PolarHBondContact O-N 2.77Å; F659-E699 HydrophobicContact CE2-CB 4.35Å; F659-E699 HydrophobicContact CE2-CG 3.79Å; F659-E699 HydrophobicContact CZ-CG 3.73Å; F659-E699 VanDerWaalsContact CZ-O 3.32Å; F659-E699 WeakPolarHBondContact CZ-O 3.46Å; F659-C702 HydrophobicContact CD1-CB 3.8Å; F659-C702 HydrophobicContact CD2-CB 3.65Å; F659-C702 HydrophobicContact CE1-CB 3.74Å; F659-C702 HydrophobicContact CE2-CB 3.6Å; F659-C702 HydrophobicContact CG-CB 3.76Å; F659-C702 HydrophobicContact CZ-CB 3.65Å; F659-R703 HydrophobicContact CE1-CB 4.46Å; F659-R703 HydrophobicContact CE1-CG 3.7Å; F659-R703 HydrophobicContact CZ-CG 3.88Å
660	N	89.6	Confident	90.1	Very high	150 Å²	150	57.4 Å²	57.4	80%	0.802	27%	0.274	S	S	*	.			trans	51.9	32.9	-173.5	-65.8	-38.2	0	0	0	113.9	M656	M656-N660 WeakPolarHBondContact O-CA 3.29Å; M656-N660 PolarHBondContact O-N 2.7Å
661	L	88.1	Confident	89.9	Confident	51 Å²	51	58.1 Å²	58.1	27%	0.267	29%	0.285	S	S	.	.			trans	-78.4	143.1	-178.2	-73.8	170	0	0	0	112	M656 F659 S666 C702	M656-L661 WeakPolarHBondContact CG-O 3.49Å; M656-L661 PolarHBondContact O-N 2.72Å; F659-L661 HydrophobicContact CB-CD1 3.79Å; F659-L661 HydrophobicContact CB-CG 3.76Å; F659-L661 HydrophobicContact CG-CD1 4.42Å; F659-L661 PolarHBondContact O-N 2.77Å; L661-S666 WeakPolarHBondContact CB-OG 3.03Å; L661-C702 HydrophobicContact CD1-CB 4.39Å; L661-C702 VanDerWaalsContact CD1-SG 3.57Å
662	P	92.9	Very high	89.8	Confident	74 Å²	74	64 Å²	64	48%	0.481	31%	0.307	S	S	.	.			trans	-60	141.7	169.7	-22.9	33.5	0	0	0	112	Q664 D665 S666	P662-Q664 PolarHBondContact O-N 2.8Å; P662-D665 PolarHBondContact O-N 3.37Å; P662-S666 PolarHBondContact O-N 2.9Å; P662-S666 PolarHBondContact O-OG 3.5Å
663	Y	89.8	Confident	89.5	Confident	111 Å²	111	64 Å²	64	44%	0.435	31%	0.307	S	S	.	.	H	α-helix	trans	-47.4	-40.1	178.5	177.6	-92	0	0	0	113.8	T652 M656 R667	T652-Y663 HydrophobicContact CG2-CD2 3.63Å; T652-Y663 HydrophobicContact CG2-CE2 3.76Å; T652-Y663 HydrophobicContact CG2-CG 4.38Å; M656-Y663 HydrophobicContact SD-CD2 3.71Å; M656-Y663 HydrophobicContact SD-CG 4.24Å; Y663-R667 HydrophobicContact CE1-CG 4.47Å; Y663-R667 WeakPolarHBondContact O-CG 3.42Å; Y663-R667 PolarHBondContact O-N 3.29Å; Y663-R667 VanDerWaalsContact O-N 3.13Å; Y663-R667 PolarHBondContact OH-NH1 2.97Å
664	Q	90.3	Very high	89.2	Confident	137 Å²	137	59.6 Å²	59.6	64%	0.64	29%	0.287	S	S	*	.	H	α-helix	trans	-65.1	-41	177.4	-64.1	-168.9	14	0	0	112.6	P662 R667 K668	P662-Q664 PolarHBondContact O-N 2.8Å; Q664-R667 PolarHBondContact O-N 3.49Å; Q664-K668 VanDerWaalsContact O-CG 3.29Å; Q664-K668 WeakPolarHBondContact O-CG 3Å; Q664-K668 PolarHBondContact O-N 3.08Å
665	D	89.3	Confident	89	Confident	67 Å²	67	59.4 Å²	59.4	36%	0.358	29%	0.287	S	S	.	.	H	α-helix	trans	-78.9	-34.5	-176.3	-63.3	-50.3	0	0	0	111.6	P662 R667 K668 C669	P662-D665 PolarHBondContact O-N 3.37Å; D665-R667 VanDerWaalsContact C-N 3.33Å; D665-R667 PolarHBondContact O-N 2.91Å; D665-K668 PolarHBondContact O-N 3.48Å; D665-K668 WeakPolarHBondContact OD1-CD 3.45Å; D665-K668 WeakPolarHBondContact OD1-CE 3.15Å; D665-K668 IonicContact OD1-NZ 3.3Å; D665-K668 PolarHBondContact OD1-NZ 3.04Å; D665-C669 WeakPolarHBondContact O-CB 3.36Å; D665-C669 PolarHBondContact O-N 3.03Å
666	S	90.4	Very high	88.7	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-55.7	-46.7	166	-61.8	0	0	0	0	111.4	M656 L661 P662 C669 L670	M656-S666 WeakPolarHBondContact CG-OG 3.28Å; L661-S666 WeakPolarHBondContact CB-OG 3.03Å; P662-S666 PolarHBondContact O-N 2.9Å; P662-S666 PolarHBondContact O-OG 3.5Å; S666-C669 PolarHBondContact O-N 2.93Å; S666-L670 VanDerWaalsContact O-CG 3.32Å; S666-L670 WeakPolarHBondContact O-CG 3.34Å; S666-L670 PolarHBondContact O-N 3.37Å
667	R	90.2	Very high	88.4	Confident	61 Å²	61	63.3 Å²	63.3	23%	0.23	31%	0.312	C	S	.	.	H	α-helix	trans	-69.7	-31.9	175.9	-67.8	-171.1	76.6	171.7	4.7	113.8	T652 Y663 Q664 D665 G671 S677 H680	T652-R667 HydrophobicContact CG2-CG 3.73Å; Y663-R667 HydrophobicContact CE1-CG 4.47Å; Y663-R667 WeakPolarHBondContact O-CG 3.42Å; Y663-R667 PolarHBondContact O-N 3.29Å; Y663-R667 VanDerWaalsContact O-N 3.13Å; Y663-R667 PolarHBondContact OH-NH1 2.97Å; Q664-R667 PolarHBondContact O-N 3.49Å; D665-R667 VanDerWaalsContact C-N 3.33Å; D665-R667 PolarHBondContact O-N 2.91Å; R667-G671 PolarHBondContact O-N 2.78Å; R667-S677 PolarHBondContact NH2-O 3.43Å; R667-S677 PolarHBondContact NH2-OG 2.92Å; R667-S677 VanDerWaalsContact NH2-OG 3.08Å; R667-H680 VanDerWaalsContact C-CE1 3.44Å; R667-H680 HydrophobicContact CG-CB 4.35Å; R667-H680 PolarHBondContact NE-ND1 3.02Å; R667-H680 VanDerWaalsContact NE-ND1 3.15Å; R667-H680 PolarHBondContact O-CE1 3.15Å
668	K	88.8	Confident	88.2	Confident	122 Å²	122	62.4 Å²	62.4	53%	0.53	31%	0.313	S	S	.	.	H	α-helix	trans	-64.4	-42.6	170.7	-71.2	167.6	-151.3	162.9	0	111.3	Q664 D665 G671 R672	Q664-K668 VanDerWaalsContact O-CG 3.29Å; Q664-K668 WeakPolarHBondContact O-CG 3Å; Q664-K668 PolarHBondContact O-N 3.08Å; D665-K668 PolarHBondContact O-N 3.48Å; D665-K668 WeakPolarHBondContact OD1-CD 3.45Å; D665-K668 WeakPolarHBondContact OD1-CE 3.15Å; D665-K668 IonicContact OD1-NZ 3.3Å; D665-K668 PolarHBondContact OD1-NZ 3.04Å; K668-G671 PolarHBondContact O-N 3.26Å; K668-R672 WeakPolarHBondContact O-CB 2.92Å; K668-R672 PolarHBondContact O-N 3.08Å
669	C	88.1	Confident	88.2	Confident	21 Å²	21	59.8 Å²	59.8	14%	0.142	30%	0.298	C	S	.	.	H	α-helix	trans	-62.1	-55.5	177.7	-166.1	0	0	0	0	110.9	L655 D665 S666 G671 R672 F673	L655-C669 HydrophobicContact CD1-CB 4.4Å; D665-C669 WeakPolarHBondContact O-CB 3.36Å; D665-C669 PolarHBondContact O-N 3.03Å; S666-C669 PolarHBondContact O-N 2.93Å; C669-G671 VanDerWaalsContact C-N 3.29Å; C669-G671 PolarHBondContact O-N 3.32Å; C669-R672 WeakPolarHBondContact O-CB 3.22Å; C669-R672 PolarHBondContact O-N 2.99Å; C669-F673 WeakPolarHBondContact O-CD2 3.23Å; C669-F673 PolarHBondContact O-N 3.48Å; C669-F673 VanDerWaalsContact O-N 3.09Å
670	L	90.1	Very high	88.3	Confident	0 Å²	0	58 Å²	58	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-55	-43	176.6	-67.7	170.4	0	0	0	112.4	A651 L655 S666 F673 G674 L675 H680 V695	A651-L670 HydrophobicContact CB-CD1 3.97Å; A651-L670 HydrophobicContact CB-CD2 4.16Å; L655-L670 HydrophobicContact CD1-CD1 4.35Å; L655-L670 HydrophobicContact CD1-CD2 3.71Å; L655-L670 HydrophobicContact CD1-CG 3.72Å; S666-L670 VanDerWaalsContact O-CG 3.32Å; S666-L670 WeakPolarHBondContact O-CG 3.34Å; S666-L670 PolarHBondContact O-N 3.37Å; L670-F673 PolarHBondContact O-N 2.84Å; L670-G674 PolarHBondContact O-N 3.06Å; L670-L675 HydrophobicContact CB-CB 4.14Å; L670-L675 HydrophobicContact CB-CD2 4.21Å; L670-L675 HydrophobicContact CD1-CD2 4.28Å; L670-L675 HydrophobicContact CD2-CD2 3.95Å; L670-L675 HydrophobicContact CG-CD2 4.38Å; L670-L675 WeakPolarHBondContact O-CB 3.43Å; L670-L675 PolarHBondContact O-N 2.91Å; L670-H680 HydrophobicContact CD1-CB 4.47Å; L670-V695 HydrophobicContact CD2-CG2 4.12Å
671	G	87.6	Confident	88.3	Confident	30 Å²	30	54.7 Å²	54.7	31%	0.309	28%	0.276	S	S	.	.	H	α-helix	trans	-64.6	-38.3	177	0	0	0	0	0	113.6	R667 K668 C669 G674 H680	R667-G671 PolarHBondContact O-N 2.78Å; K668-G671 PolarHBondContact O-N 3.26Å; C669-G671 VanDerWaalsContact C-N 3.29Å; C669-G671 PolarHBondContact O-N 3.32Å; G671-G674 PolarHBondContact O-N 2.85Å; G671-H680 VanDerWaalsContact CA-CE1 3.42Å; G671-H680 WeakPolarHBondContact CA-CE1 3.48Å; G671-H680 WeakPolarHBondContact CA-NE2 3.45Å; G671-H680 PolarHBondContact N-CE1 2.87Å; G671-H680 PolarHBondContact N-NE2 2.96Å
672	R	86.7	Confident	88.4	Confident	123 Å²	123	54.9 Å²	54.9	46%	0.464	28%	0.277	S	S	.	.	H	α-helix	trans	-65.3	-40.3	177.4	178.4	175.8	-167.1	155.5	7.6	112.4	K555 T557 K668 C669 G674	K555-R672 CarbonylContact C-O 3.57Å; K555-R672 PolarHBondContact N-O 2.68Å; K555-R672 VanDerWaalsContact N-O 3.17Å; K555-R672 WeakPolarHBondContact O-CG 2.88Å; K555-R672 PolarHBondContact O-NE 2.77Å; T557-R672 PolarHBondContact OG1-NE 2.86Å; T557-R672 PolarHBondContact OG1-NH2 2.76Å; K668-R672 WeakPolarHBondContact O-CB 2.92Å; K668-R672 PolarHBondContact O-N 3.08Å; C669-R672 WeakPolarHBondContact O-CB 3.22Å; C669-R672 PolarHBondContact O-N 2.99Å; R672-G674 PolarHBondContact O-N 3.01Å
673	F	87.4	Confident	88.3	Confident	2 Å²	2	54.9 Å²	54.9	1%	0.009	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	12.5	171.1	-74.7	-82.3	0	0	0	113.5	F556 F558 C669 L670 R694 F697 S698 A701	F556-F673 HydrophobicContact CB-CD1 4.09Å; F556-F673 HydrophobicContact CB-CE1 3.7Å; F556-F673 HydrophobicContact CD1-CB 4.4Å; F556-F673 AromaticContact CD1-CD1 3.42Å; F556-F673 HydrophobicContact CD1-CD1 3.42Å; F556-F673 VanDerWaalsContact CD1-CD1 3.42Å; F556-F673 AromaticContact CD1-CE1 3.98Å; F556-F673 HydrophobicContact CD1-CE1 3.98Å; F556-F673 HydrophobicContact CD1-CG 4.26Å; F556-F673 AromaticContact CD2-CD1 3.84Å; F556-F673 HydrophobicContact CD2-CD1 3.84Å; F556-F673 AromaticContact CD2-CE1 3.85Å; F556-F673 HydrophobicContact CD2-CE1 3.85Å; F556-F673 HydrophobicContact CE1-CB 4.22Å; F556-F673 AromaticContact CE1-CD1 3.72Å; F556-F673 HydrophobicContact CE1-CD1 3.72Å; F556-F673 HydrophobicContact CE1-CG 4.44Å; F556-F673 WeakPolarHBondContact CE1-O 3.42Å; F556-F673 HydrophobicContact CE2-CD1 4.11Å; F556-F673 HydrophobicContact CE2-CE1 4.48Å; F556-F673 AromaticContact CG-CD1 3.49Å; F556-F673 HydrophobicContact CG-CD1 3.49Å; F556-F673 VanDerWaalsContact CG-CD1 3.49Å; F556-F673 AromaticContact CG-CE1 3.56Å; F556-F673 HydrophobicContact CG-CE1 3.56Å; F556-F673 HydrophobicContact CZ-CD1 4.05Å; F558-F673 HydrophobicContact CE1-CE1 4.09Å; F558-F673 HydrophobicContact CE1-CZ 4.18Å; F558-F673 HydrophobicContact CZ-CE1 4.26Å; C669-F673 WeakPolarHBondContact O-CD2 3.23Å; C669-F673 PolarHBondContact O-N 3.48Å; C669-F673 VanDerWaalsContact O-N 3.09Å; L670-F673 PolarHBondContact O-N 2.84Å; F673-R694 WeakPolarHBondContact O-CB 3.49Å; F673-R694 WeakPolarHBondContact O-CD 3.43Å; F673-R694 WeakPolarHBondContact O-CG 3.18Å; F673-F697 HydrophobicContact CD1-CB 3.61Å; F673-F697 HydrophobicContact CE1-CB 3.9Å; F673-F697 HydrophobicContact CG-CB 4.4Å; F673-S698 WeakPolarHBondContact CB-OG 3.27Å; F673-A701 HydrophobicContact CE2-CB 3.56Å; F673-A701 HydrophobicContact CZ-CB 3.52Å
674	G	84.1	Confident	88.3	Confident	3 Å²	3	49.6 Å²	49.6	3%	0.031	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.6	21.3	171.7	0	0	0	0	0	115	Y552 L670 G671 R672 R694	Y552-G674 PolarHBondContact OH-O 3Å; L670-G674 PolarHBondContact O-N 3.06Å; G671-G674 PolarHBondContact O-N 2.85Å; R672-G674 PolarHBondContact O-N 3.01Å; G674-R694 WeakPolarHBondContact O-CD 3.38Å; G674-R694 PolarHBondContact O-NH1 3.24Å
675	L	87	Confident	88.2	Confident	5 Å²	5	45.6 Å²	45.6	3%	0.026	24%	0.237	C	C	.	.			trans	-75.4	127	166.2	-166.2	65.2	0	0	0	109.2	A651 L670 A679 H680 Q691 V695	A651-L675 HydrophobicContact CB-CD2 3.81Å; L670-L675 HydrophobicContact CB-CB 4.14Å; L670-L675 HydrophobicContact CB-CD2 4.21Å; L670-L675 HydrophobicContact CD1-CD2 4.28Å; L670-L675 HydrophobicContact CD2-CD2 3.95Å; L670-L675 HydrophobicContact CG-CD2 4.38Å; L670-L675 WeakPolarHBondContact O-CB 3.43Å; L670-L675 PolarHBondContact O-N 2.91Å; L675-A679 HydrophobicContact CD1-CB 3.86Å; L675-A679 HydrophobicContact CD2-CB 4.45Å; L675-A679 HydrophobicContact CG-CB 4.02Å; L675-H680 VanDerWaalsContact CB-NE2 3.33Å; L675-H680 WeakPolarHBondContact CB-NE2 3.48Å; L675-H680 PolarHBondContact O-NE2 3.31Å; L675-Q691 HydrophobicContact CD1-CB 3.82Å; L675-Q691 HydrophobicContact CD1-CG 3.88Å; L675-V695 HydrophobicContact CD2-CG2 4.13Å
676	E	84.1	Confident	88.1	Confident	73 Å²	73	49.6 Å²	49.6	34%	0.341	25%	0.251	S	S	.	.			trans	-62.2	138.7	175.4	-81.3	-157.7	-133.5	0	0	111.1	Y552 H678 A679 H680	Y552-E676 HydrophobicContact CE2-CG 3.99Å; E676-H678 WeakPolarHBondContact CB-ND1 3.2Å; E676-H678 VanDerWaalsContact CD-CE1 3.48Å; E676-H678 PolarHBondContact O-N 2.94Å; E676-H678 IonicContact OE1-CE1 3.83Å; E676-H678 IonicContact OE2-CE1 2.8Å; E676-H678 PolarHBondContact OE2-CE1 2.87Å; E676-H678 VanDerWaalsContact OE2-CE1 3.25Å; E676-H678 IonicContact OE2-ND1 3.49Å; E676-H678 PolarHBondContact OE2-ND1 3.45Å; E676-A679 WeakPolarHBondContact O-CA 3.47Å; E676-A679 WeakPolarHBondContact O-CB 3.49Å; E676-A679 PolarHBondContact O-N 3.21Å; E676-H680 PolarHBondContact O-CD2 3.28Å; E676-H680 PolarHBondContact O-N 2.94Å
677	S	86.5	Confident	87.9	Confident	73 Å²	73	50 Å²	50	51%	0.51	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-26.5	-176.6	-174.5	0	0	0	0	114.5	R667	R667-S677 PolarHBondContact NH2-O 3.43Å; R667-S677 PolarHBondContact NH2-OG 2.92Å; R667-S677 VanDerWaalsContact NH2-OG 3.08Å
678	H	85.5	Confident	87.5	Confident	101 Å²	101	49.7 Å²	49.7	47%	0.468	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-29.9	175.1	78.6	-101.4	0	0	0	113.1	E676	E676-H678 WeakPolarHBondContact CB-ND1 3.2Å; E676-H678 VanDerWaalsContact CD-CE1 3.48Å; E676-H678 PolarHBondContact O-N 2.94Å; E676-H678 IonicContact OE1-CE1 3.83Å; E676-H678 IonicContact OE2-CE1 2.8Å; E676-H678 PolarHBondContact OE2-CE1 2.87Å; E676-H678 VanDerWaalsContact OE2-CE1 3.25Å; E676-H678 IonicContact OE2-ND1 3.49Å; E676-H678 PolarHBondContact OE2-ND1 3.45Å
679	A	87.6	Confident	87.1	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-84.8	-10.1	-179.5	0	0	0	0	0	113.1	L675 E676 T681 I682 L687	L675-A679 HydrophobicContact CD1-CB 3.86Å; L675-A679 HydrophobicContact CD2-CB 4.45Å; L675-A679 HydrophobicContact CG-CB 4.02Å; E676-A679 WeakPolarHBondContact O-CA 3.47Å; E676-A679 WeakPolarHBondContact O-CB 3.49Å; E676-A679 PolarHBondContact O-N 3.21Å; A679-T681 PolarHBondContact O-N 3.45Å; A679-I682 PolarHBondContact O-N 3.34Å; A679-L687 HydrophobicContact CB-CD2 3.91Å
680	H	90.2	Very high	86.9	Confident	13 Å²	13	44.9 Å²	44.9	6%	0.06	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-62	-27.3	175.6	-67.2	-165.7	0	0	0	112.3	T652 R667 L670 G671 L675 E676	T652-H680 PolarHBondContact N-O 2.99Å; T652-H680 PolarHBondContact OG1-O 3.14Å; R667-H680 VanDerWaalsContact C-CE1 3.44Å; R667-H680 HydrophobicContact CG-CB 4.35Å; R667-H680 PolarHBondContact NE-ND1 3.02Å; R667-H680 VanDerWaalsContact NE-ND1 3.15Å; R667-H680 PolarHBondContact O-CE1 3.15Å; L670-H680 HydrophobicContact CD1-CB 4.47Å; G671-H680 VanDerWaalsContact CA-CE1 3.42Å; G671-H680 WeakPolarHBondContact CA-CE1 3.48Å; G671-H680 WeakPolarHBondContact CA-NE2 3.45Å; G671-H680 PolarHBondContact N-CE1 2.87Å; G671-H680 PolarHBondContact N-NE2 2.96Å; L675-H680 VanDerWaalsContact CB-NE2 3.33Å; L675-H680 WeakPolarHBondContact CB-NE2 3.48Å; L675-H680 PolarHBondContact O-NE2 3.31Å; E676-H680 PolarHBondContact O-CD2 3.28Å; E676-H680 PolarHBondContact O-N 2.94Å
681	T	89.8	Confident	86.7	Confident	81 Å²	81	46.8 Å²	46.8	50%	0.497	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-112.6	17.9	-179.8	56.7	0	0	0	0	112.4	A679	A679-T681 PolarHBondContact O-N 3.45Å
682	I	90.2	Very high	86.7	Confident	56 Å²	56	46.7 Å²	46.7	29%	0.287	25%	0.249	S	C	.	.	S	Bend	trans	-97.8	137.8	171.2	-68.9	178.7	0	0	0	108	T650 A679 K686 L687	T650-I682 WeakPolarHBondContact CA-O 3.45Å; A679-I682 PolarHBondContact O-N 3.34Å; I682-K686 HydrophobicContact CG2-CB 3.78Å; I682-L687 HydrophobicContact CB-CD2 4.05Å; I682-L687 HydrophobicContact CG2-CD2 3.85Å; I682-L687 HydrophobicContact CG2-CG 4.43Å
683	Q	91	Very high	86.8	Confident	74 Å²	74	40.8 Å²	40.8	35%	0.346	23%	0.227	S	C	.	.	B	Isolated β-bridge	trans	-60.6	139.2	176.1	-59.2	178	-79	0	0	110.4	E648 E649 S685 K686	E648-Q683 WeakPolarHBondContact O-CG 3.47Å; E648-Q683 PolarHBondContact O-NE2 3.02Å; E649-Q683 CarbonylContact O-C 3.52Å; E649-Q683 WeakPolarHBondContact O-CA 3.37Å; Q683-S685 WeakPolarHBondContact CB-OG 3.49Å; Q683-S685 PolarHBondContact O-N 3.1Å; Q683-S685 VanDerWaalsContact O-N 3.16Å; Q683-K686 PolarHBondContact O-N 2.9Å
684	I	89.5	Confident	86.8	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-60.8	-33.4	-171.2	-67	168.7	0	0	0	112	L645 M647 E649 Y654 K686 L687 K692	L645-I684 HydrophobicContact CB-CG2 3.85Å; L645-I684 HydrophobicContact CD1-CG2 3.82Å; L645-I684 HydrophobicContact CG-CG2 4.43Å; M647-I684 HydrophobicContact SD-CG2 4.45Å; E649-I684 WeakPolarHBondContact O-CG1 3.37Å; E649-I684 PolarHBondContact O-N 3.19Å; Y654-I684 HydrophobicContact CD2-CD1 4.27Å; Y654-I684 HydrophobicContact CG-CD1 4.06Å; I684-K686 PolarHBondContact O-N 3.44Å; I684-K686 VanDerWaalsContact O-N 3.14Å; I684-L687 HydrophobicContact CB-CD1 4.46Å; I684-L687 HydrophobicContact CG1-CD1 4.17Å; I684-L687 WeakPolarHBondContact O-CB 3.45Å; I684-L687 PolarHBondContact O-N 2.98Å; I684-K692 HydrophobicContact CG2-CD 4.44Å; I684-K692 HydrophobicContact CG2-CG 4.2Å; I684-K692 WeakPolarHBondContact O-CE 3.45Å
685	S	88.3	Confident	87.1	Confident	53 Å²	53	41.4 Å²	41.4	37%	0.371	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-41.7	-46	168.5	41.1	0	0	0	0	113.8	M647 Q683	M647-S685 WeakPolarHBondContact O-CA 3.37Å; M647-S685 WeakPolarHBondContact O-CB 3.33Å; M647-S685 PolarHBondContact O-N 2.91Å; M647-S685 PolarHBondContact O-OG 3.3Å; Q683-S685 WeakPolarHBondContact CB-OG 3.49Å; Q683-S685 PolarHBondContact O-N 3.1Å; Q683-S685 VanDerWaalsContact O-N 3.16Å
686	K	86.8	Confident	87.2	Confident	150 Å²	150	41.5 Å²	41.5	65%	0.652	23%	0.229	S	C	*	.	G	3₁₀ helix	trans	-89.1	-0.7	-173.4	-66.9	162.1	-177.1	162.5	0	113.6	I682 Q683 I684	I682-K686 HydrophobicContact CG2-CB 3.78Å; Q683-K686 PolarHBondContact O-N 2.9Å; I684-K686 PolarHBondContact O-N 3.44Å; I684-K686 VanDerWaalsContact O-N 3.14Å
687	L	85.8	Confident	87.5	Confident	10 Å²	10	38 Å²	38	5%	0.052	21%	0.213	C	C	.	.	S	Bend	trans	-81.1	140.2	175.3	-63.5	-178.2	0	0	0	111.4	A651 A679 I682 I684 Q691 K692 V695	A651-L687 HydrophobicContact CB-CD1 4.4Å; A679-L687 HydrophobicContact CB-CD2 3.91Å; I682-L687 HydrophobicContact CB-CD2 4.05Å; I682-L687 HydrophobicContact CG2-CD2 3.85Å; I682-L687 HydrophobicContact CG2-CG 4.43Å; I684-L687 HydrophobicContact CB-CD1 4.46Å; I684-L687 HydrophobicContact CG1-CD1 4.17Å; I684-L687 WeakPolarHBondContact O-CB 3.45Å; I684-L687 PolarHBondContact O-N 2.98Å; L687-Q691 HydrophobicContact CB-CB 3.95Å; L687-Q691 HydrophobicContact CD2-CB 4.28Å; L687-Q691 HydrophobicContact CG-CB 4.48Å; L687-K692 HydrophobicContact CB-CG 3.95Å; L687-K692 VanDerWaalsContact O-CE 3.27Å; L687-K692 WeakPolarHBondContact O-CE 3.36Å; L687-V695 HydrophobicContact CD1-CG2 4.19Å
688	S	82	Confident	87.7	Confident	54 Å²	54	34.6 Å²	34.6	38%	0.378	19%	0.188	S	C	.	.			trans	-65.6	159	171.4	61.7	0	0	0	0	112.3	G690 Q691 K692	S688-G690 VanDerWaalsContact C-N 3.26Å; S688-G690 PolarHBondContact O-N 3.18Å; S688-G690 VanDerWaalsContact O-N 3.16Å; S688-Q691 WeakPolarHBondContact O-CA 3.12Å; S688-Q691 WeakPolarHBondContact O-CB 3.47Å; S688-Q691 PolarHBondContact O-N 3.44Å; S688-Q691 VanDerWaalsContact OG-CD 3.31Å; S688-Q691 WeakPolarHBondContact OG-CG 3.35Å; S688-Q691 PolarHBondContact OG-OE1 2.99Å; S688-K692 PolarHBondContact O-N 3.16Å
689	G	81.4	Confident	87.9	Confident	31 Å²	31	30.3 Å²	30.3	32%	0.32	17%	0.169	S	C	.	.	H	α-helix	trans	-52.3	-39.7	-177.8	0	0	0	0	0	114.4	Y641 K692 A693	Y641-G689 PolarHBondContact OH-O 2.88Å; G689-K692 PolarHBondContact O-N 3.12Å; G689-A693 PolarHBondContact O-N 3.06Å
690	G	82.4	Confident	88	Confident	10 Å²	10	30.3 Å²	30.3	10%	0.103	17%	0.169	C	C	.	.	H	α-helix	trans	-72.6	-32.7	176.3	0	0	0	0	0	114	S688 A693 R694 N716	S688-G690 VanDerWaalsContact C-N 3.26Å; S688-G690 PolarHBondContact O-N 3.18Å; S688-G690 VanDerWaalsContact O-N 3.16Å; G690-A693 PolarHBondContact O-N 3.38Å; G690-R694 WeakPolarHBondContact O-CG 3.21Å; G690-R694 PolarHBondContact O-N 3.46Å; G690-R694 VanDerWaalsContact O-N 3.14Å; G690-N716 WeakPolarHBondContact CA-O 3.41Å
691	Q	86.8	Confident	88.1	Confident	41 Å²	41	30.2 Å²	30.2	19%	0.192	17%	0.17	C	C	.	.	H	α-helix	trans	-67.8	-41.1	170.8	-72.1	168	-53.8	0	0	110.8	L675 L687 S688 R694 V695	L675-Q691 HydrophobicContact CD1-CB 3.82Å; L675-Q691 HydrophobicContact CD1-CG 3.88Å; L687-Q691 HydrophobicContact CB-CB 3.95Å; L687-Q691 HydrophobicContact CD2-CB 4.28Å; L687-Q691 HydrophobicContact CG-CB 4.48Å; S688-Q691 WeakPolarHBondContact O-CA 3.12Å; S688-Q691 WeakPolarHBondContact O-CB 3.47Å; S688-Q691 PolarHBondContact O-N 3.44Å; S688-Q691 VanDerWaalsContact OG-CD 3.31Å; S688-Q691 WeakPolarHBondContact OG-CG 3.35Å; S688-Q691 PolarHBondContact OG-OE1 2.99Å; Q691-R694 PolarHBondContact O-N 3.13Å; Q691-V695 WeakPolarHBondContact O-CG2 3.47Å; Q691-V695 PolarHBondContact O-N 3.31Å; Q691-V695 VanDerWaalsContact O-N 3.15Å
692	K	88.3	Confident	88.1	Confident	27 Å²	27	27.7 Å²	27.7	12%	0.117	16%	0.156	C	C	.	.	H	α-helix	trans	-60.1	-42.4	172.1	-68.2	-176.7	176	-179.5	0	111.6	Y641 A642 L645 M647 I684 L687 S688 G689 R694 V695 V696	Y641-K692 HydrophobicContact CD2-CB 4.48Å; Y641-K692 HydrophobicContact CE2-CB 3.8Å; A642-K692 HydrophobicContact CB-CD 4.24Å; L645-K692 HydrophobicContact CD1-CB 3.92Å; L645-K692 HydrophobicContact CD1-CG 4.17Å; M647-K692 PolarHBondContact SD-NZ 3Å; M647-K692 VanDerWaalsContact SD-NZ 3.39Å; I684-K692 HydrophobicContact CG2-CD 4.44Å; I684-K692 HydrophobicContact CG2-CG 4.2Å; I684-K692 WeakPolarHBondContact O-CE 3.45Å; L687-K692 HydrophobicContact CB-CG 3.95Å; L687-K692 VanDerWaalsContact O-CE 3.27Å; L687-K692 WeakPolarHBondContact O-CE 3.36Å; S688-K692 PolarHBondContact O-N 3.16Å; G689-K692 PolarHBondContact O-N 3.12Å; K692-R694 PolarHBondContact O-N 3.05Å; K692-V695 WeakPolarHBondContact O-CB 3.37Å; K692-V695 PolarHBondContact O-N 3.46Å; K692-V696 PolarHBondContact O-N 3.01Å; K692-V696 VanDerWaalsContact O-N 3.14Å
693	A	87.9	Confident	88	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-57.6	-46.3	175.9	0	0	0	0	0	111.8	F637 Y641 G689 G690 V695 V696 F697 L717	F637-A693 HydrophobicContact CE2-CB 4.42Å; F637-A693 HydrophobicContact CZ-CB 4.23Å; Y641-A693 HydrophobicContact CE2-CB 4.1Å; G689-A693 PolarHBondContact O-N 3.06Å; G690-A693 PolarHBondContact O-N 3.38Å; A693-V695 VanDerWaalsContact C-N 3.32Å; A693-V695 PolarHBondContact O-N 3.13Å; A693-V696 PolarHBondContact O-N 2.65Å; A693-V696 VanDerWaalsContact O-N 3.11Å; A693-F697 HydrophobicContact CB-CE2 4.4Å; A693-F697 WeakPolarHBondContact O-CD2 3.44Å; A693-F697 PolarHBondContact O-N 3.11Å; A693-L717 HydrophobicContact CB-CD2 4.11Å
694	R	87.9	Confident	87.9	Confident	17 Å²	17	32.2 Å²	32.2	6%	0.064	17%	0.17	C	C	.	.	H	α-helix	trans	-63.7	-32.4	177.8	-69.6	174	177.2	163.9	12.2	113.6	Y552 F556 F673 G674 G690 Q691 K692 S698 L717 D718 S721	Y552-R694 PolarHBondContact OH-NH1 2.92Å; F556-R694 HydrophobicContact CZ-CG 4.48Å; F673-R694 WeakPolarHBondContact O-CB 3.49Å; F673-R694 WeakPolarHBondContact O-CD 3.43Å; F673-R694 WeakPolarHBondContact O-CG 3.18Å; G674-R694 WeakPolarHBondContact O-CD 3.38Å; G674-R694 PolarHBondContact O-NH1 3.24Å; G690-R694 WeakPolarHBondContact O-CG 3.21Å; G690-R694 PolarHBondContact O-N 3.46Å; G690-R694 VanDerWaalsContact O-N 3.14Å; Q691-R694 PolarHBondContact O-N 3.13Å; K692-R694 PolarHBondContact O-N 3.05Å; R694-S698 PolarHBondContact O-N 2.92Å; R694-S698 PolarHBondContact O-OG 3.19Å; R694-L717 HydrophobicContact CG-CD2 4.5Å; R694-D718 IonicContact CZ-OD2 3.07Å; R694-D718 IonicContact NH2-OD1 3.54Å; R694-D718 PolarHBondContact NH2-OD1 2.94Å; R694-D718 IonicContact NH2-OD2 2.72Å; R694-D718 PolarHBondContact NH2-OD2 2.89Å; R694-S721 PolarHBondContact NE-OG 3.29Å; R694-S721 PolarHBondContact NH2-OG 3.22Å
695	V	89.9	Confident	88.1	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-64.2	-43.9	171.3	175.9	0	0	0	0	110.5	L645 A651 Y654 L670 L675 L687 Q691 K692 A693 S698 E699	L645-V695 HydrophobicContact CD2-CG1 4.15Å; A651-V695 HydrophobicContact CB-CG2 3.71Å; Y654-V695 HydrophobicContact CD1-CG1 4.14Å; Y654-V695 HydrophobicContact CE1-CG1 4.47Å; L670-V695 HydrophobicContact CD2-CG2 4.12Å; L675-V695 HydrophobicContact CD2-CG2 4.13Å; L687-V695 HydrophobicContact CD1-CG2 4.19Å; Q691-V695 WeakPolarHBondContact O-CG2 3.47Å; Q691-V695 PolarHBondContact O-N 3.31Å; Q691-V695 VanDerWaalsContact O-N 3.15Å; K692-V695 WeakPolarHBondContact O-CB 3.37Å; K692-V695 PolarHBondContact O-N 3.46Å; A693-V695 VanDerWaalsContact C-N 3.32Å; A693-V695 PolarHBondContact O-N 3.13Å; V695-S698 VanDerWaalsContact O-CB 3.29Å; V695-S698 WeakPolarHBondContact O-CB 3.45Å; V695-S698 PolarHBondContact O-N 2.91Å; V695-E699 WeakPolarHBondContact O-CB 3.47Å; V695-E699 PolarHBondContact O-N 3.09Å
696	V	89.8	Confident	88.3	Confident	8 Å²	8	29.9 Å²	29.9	5%	0.048	15%	0.154	C	C	.	.	H	α-helix	trans	-70.4	-36.6	178.9	179	0	0	0	0	112.1	F637 Y641 L645 K692 A693 S698 E699 L700	F637-V696 HydrophobicContact CD2-CB 4.39Å; F637-V696 HydrophobicContact CD2-CG1 3.79Å; F637-V696 HydrophobicContact CE2-CB 4.26Å; F637-V696 HydrophobicContact CE2-CG1 4.14Å; Y641-V696 HydrophobicContact CD2-CG2 3.9Å; Y641-V696 HydrophobicContact CG-CG2 4.35Å; L645-V696 HydrophobicContact CD1-CG2 3.97Å; L645-V696 HydrophobicContact CD2-CG2 3.81Å; L645-V696 HydrophobicContact CG-CG2 4.07Å; K692-V696 PolarHBondContact O-N 3.01Å; K692-V696 VanDerWaalsContact O-N 3.14Å; A693-V696 PolarHBondContact O-N 2.65Å; A693-V696 VanDerWaalsContact O-N 3.11Å; V696-S698 VanDerWaalsContact C-N 3.29Å; V696-S698 PolarHBondContact O-N 3.18Å; V696-E699 WeakPolarHBondContact O-CB 3.5Å; V696-E699 PolarHBondContact O-N 3.48Å; V696-L700 HydrophobicContact CG1-CD1 4.11Å; V696-L700 HydrophobicContact CG1-CG 4.4Å; V696-L700 WeakPolarHBondContact O-CB 3.36Å; V696-L700 VanDerWaalsContact O-CG 3.26Å; V696-L700 WeakPolarHBondContact O-CG 3.49Å; V696-L700 PolarHBondContact O-N 2.97Å
697	F	90.6	Very high	88.6	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-63.4	-34.7	170.1	-74.3	-65.1	0	0	0	112.5	F556 F558 F637 F673 A693 L700 A701 L710 P713 L717 L725	F556-F697 HydrophobicContact CD2-CG 4.41Å; F556-F697 HydrophobicContact CE2-CB 4.09Å; F556-F697 HydrophobicContact CE2-CD1 4.19Å; F556-F697 AromaticContact CE2-CD2 3.69Å; F556-F697 HydrophobicContact CE2-CD2 3.69Å; F556-F697 HydrophobicContact CE2-CE2 4.15Å; F556-F697 AromaticContact CE2-CG 3.73Å; F556-F697 HydrophobicContact CE2-CG 3.73Å; F556-F697 HydrophobicContact CZ-CB 4.46Å; F556-F697 HydrophobicContact CZ-CD2 4.06Å; F556-F697 HydrophobicContact CZ-CG 4.35Å; F558-F697 HydrophobicContact CE1-CD1 4.49Å; F558-F697 HydrophobicContact CZ-CD1 4.11Å; F637-F697 HydrophobicContact CD2-CD1 4.33Å; F637-F697 AromaticContact CD2-CE1 3.91Å; F637-F697 HydrophobicContact CD2-CE1 3.91Å; F637-F697 HydrophobicContact CD2-CE2 4.12Å; F637-F697 AromaticContact CD2-CZ 3.78Å; F637-F697 HydrophobicContact CD2-CZ 3.78Å; F637-F697 HydrophobicContact CE1-CZ 4.36Å; F637-F697 AromaticContact CE2-CD2 4Å; F637-F697 HydrophobicContact CE2-CD2 4Å; F637-F697 HydrophobicContact CE2-CE1 4.16Å; F637-F697 AromaticContact CE2-CE2 3.51Å; F637-F697 HydrophobicContact CE2-CE2 3.51Å; F637-F697 HydrophobicContact CE2-CG 4.49Å; F637-F697 AromaticContact CE2-CZ 3.6Å; F637-F697 HydrophobicContact CE2-CZ 3.6Å; F637-F697 HydrophobicContact CG-CE1 4.36Å; F637-F697 HydrophobicContact CG-CZ 4.25Å; F637-F697 AromaticContact CZ-CE2 3.84Å; F637-F697 HydrophobicContact CZ-CE2 3.84Å; F637-F697 AromaticContact CZ-CZ 3.91Å; F637-F697 HydrophobicContact CZ-CZ 3.91Å; F673-F697 HydrophobicContact CD1-CB 3.61Å; F673-F697 HydrophobicContact CE1-CB 3.9Å; F673-F697 HydrophobicContact CG-CB 4.4Å; A693-F697 HydrophobicContact CB-CE2 4.4Å; A693-F697 WeakPolarHBondContact O-CD2 3.44Å; A693-F697 PolarHBondContact O-N 3.11Å; F697-L700 HydrophobicContact CD1-CD1 4.42Å; F697-A701 PolarHBondContact O-N 2.98Å; F697-L710 HydrophobicContact CE1-CD2 4.32Å; F697-P713 HydrophobicContact CE1-CB 4.49Å; F697-P713 HydrophobicContact CZ-CB 3.9Å; F697-L717 HydrophobicContact CD2-CD2 4.49Å; F697-L717 HydrophobicContact CE2-CD1 3.99Å; F697-L717 HydrophobicContact CE2-CD2 4.12Å; F697-L717 HydrophobicContact CE2-CG 4.4Å; F697-L717 HydrophobicContact CZ-CD1 4.45Å; F697-L725 HydrophobicContact CE1-CD1 4.29Å; F697-L725 HydrophobicContact CZ-CD2 4.44Å
698	S	90.3	Very high	89	Confident	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-65.2	-46	172.2	-53.2	0	0	0	0	111.6	F673 R694 V695 V696 L700 A701 C702	F673-S698 WeakPolarHBondContact CB-OG 3.27Å; R694-S698 PolarHBondContact O-N 2.92Å; R694-S698 PolarHBondContact O-OG 3.19Å; V695-S698 VanDerWaalsContact O-CB 3.29Å; V695-S698 WeakPolarHBondContact O-CB 3.45Å; V695-S698 PolarHBondContact O-N 2.91Å; V696-S698 VanDerWaalsContact C-N 3.29Å; V696-S698 PolarHBondContact O-N 3.18Å; S698-L700 PolarHBondContact O-N 3.47Å; S698-A701 PolarHBondContact O-N 3.25Å; S698-C702 PolarHBondContact O-N 3.07Å; S698-C702 PolarHBondContact O-SG 3.35Å
699	E	89.9	Confident	89.6	Confident	11 Å²	11	19.7 Å²	19.7	5%	0.051	10%	0.102	C	C	.	.	H	α-helix	trans	-59.4	-43.3	175.8	-174.5	-162.1	170.4	0	0	112	Y654 L655 F659 V695 V696 C702 R703	Y654-E699 HydrophobicContact CE1-CB 4.43Å; Y654-E699 HydrophobicContact CE1-CG 4.06Å; Y654-E699 VanDerWaalsContact OH-CD 3.31Å; Y654-E699 PolarHBondContact OH-OE1 2.81Å; Y654-E699 PolarHBondContact OH-OE2 3.46Å; L655-E699 HydrophobicContact CD2-CB 4.16Å; F659-E699 HydrophobicContact CE2-CB 4.35Å; F659-E699 HydrophobicContact CE2-CG 3.79Å; F659-E699 HydrophobicContact CZ-CG 3.73Å; F659-E699 VanDerWaalsContact CZ-O 3.32Å; F659-E699 WeakPolarHBondContact CZ-O 3.46Å; V695-E699 WeakPolarHBondContact O-CB 3.47Å; V695-E699 PolarHBondContact O-N 3.09Å; V696-E699 WeakPolarHBondContact O-CB 3.5Å; V696-E699 PolarHBondContact O-N 3.48Å; E699-C702 WeakPolarHBondContact O-CB 3.2Å; E699-C702 PolarHBondContact O-N 3.31Å; E699-R703 PolarHBondContact O-N 3.24Å; E699-R703 IonicContact OE1-CZ 3.12Å; E699-R703 IonicContact OE1-NH1 3.2Å; E699-R703 PolarHBondContact OE1-NH1 3.48Å; E699-R703 IonicContact OE1-NH2 3.97Å; E699-R703 PolarHBondContact OE1-NH2 3.36Å; E699-R703 IonicContact OE2-NH1 3.67Å
700	L	90.2	Very high	90.1	Very high	1 Å²	1	18.2 Å²	18.2	1%	0.005	9%	0.087	C	C	.	.	H	α-helix	trans	-64	-40.8	175.9	-73	167.5	0	0	0	112	F637 V696 F697 S698 C702 R703 P705	F637-L700 HydrophobicContact CB-CD1 3.88Å; F637-L700 HydrophobicContact CD2-CD1 4.04Å; F637-L700 HydrophobicContact CG-CD1 4.48Å; V696-L700 HydrophobicContact CG1-CD1 4.11Å; V696-L700 HydrophobicContact CG1-CG 4.4Å; V696-L700 WeakPolarHBondContact O-CB 3.36Å; V696-L700 VanDerWaalsContact O-CG 3.26Å; V696-L700 WeakPolarHBondContact O-CG 3.49Å; V696-L700 PolarHBondContact O-N 2.97Å; F697-L700 HydrophobicContact CD1-CD1 4.42Å; S698-L700 PolarHBondContact O-N 3.47Å; L700-C702 VanDerWaalsContact C-N 3.34Å; L700-R703 PolarHBondContact O-N 2.99Å; L700-P705 WeakPolarHBondContact O-CD 3.48Å
701	A	90.7	Very high	90.5	Very high	11 Å²	11	18.3 Å²	18.3	9%	0.091	9%	0.085	C	C	.	.	H	α-helix	trans	-64.7	-38.1	172.8	0	0	0	0	0	112.3	F558 P559 F673 F697 S698 R703 Q704	F558-A701 HydrophobicContact CD1-CB 4.09Å; F558-A701 HydrophobicContact CE1-CB 4.49Å; P559-A701 WeakPolarHBondContact CG-O 3.32Å; F673-A701 HydrophobicContact CE2-CB 3.56Å; F673-A701 HydrophobicContact CZ-CB 3.52Å; F697-A701 PolarHBondContact O-N 2.98Å; S698-A701 PolarHBondContact O-N 3.25Å; A701-R703 VanDerWaalsContact C-N 3.34Å; A701-R703 PolarHBondContact O-N 2.98Å; A701-Q704 PolarHBondContact O-N 2.86Å
702	C	89.9	Confident	90.5	Very high	28 Å²	28	17.4 Å²	17.4	19%	0.189	8%	0.081	C	C	.	.	H	α-helix	trans	-66.2	-29.8	174.8	-68.4	0	0	0	0	113.5	F659 L661 S698 E699 L700 Q704	F659-C702 HydrophobicContact CD1-CB 3.8Å; F659-C702 HydrophobicContact CD2-CB 3.65Å; F659-C702 HydrophobicContact CE1-CB 3.74Å; F659-C702 HydrophobicContact CE2-CB 3.6Å; F659-C702 HydrophobicContact CG-CB 3.76Å; F659-C702 HydrophobicContact CZ-CB 3.65Å; L661-C702 HydrophobicContact CD1-CB 4.39Å; L661-C702 VanDerWaalsContact CD1-SG 3.57Å; S698-C702 PolarHBondContact O-N 3.07Å; S698-C702 PolarHBondContact O-SG 3.35Å; E699-C702 WeakPolarHBondContact O-CB 3.2Å; E699-C702 PolarHBondContact O-N 3.31Å; L700-C702 VanDerWaalsContact C-N 3.34Å; C702-Q704 VanDerWaalsContact C-N 3.26Å; C702-Q704 PolarHBondContact O-N 3.41Å
703	R	88.8	Confident	90.5	Very high	112 Å²	112	16.1 Å²	16.1	42%	0.423	8%	0.076	S	C	.	.	H	α-helix	trans	-66.9	-21	174.4	-79.3	-170.1	173.3	100.4	15.2	114.6	F659 E699 L700 A701	F659-R703 HydrophobicContact CE1-CB 4.46Å; F659-R703 HydrophobicContact CE1-CG 3.7Å; F659-R703 HydrophobicContact CZ-CG 3.88Å; E699-R703 PolarHBondContact O-N 3.24Å; E699-R703 IonicContact OE1-CZ 3.12Å; E699-R703 IonicContact OE1-NH1 3.2Å; E699-R703 PolarHBondContact OE1-NH1 3.48Å; E699-R703 IonicContact OE1-NH2 3.97Å; E699-R703 PolarHBondContact OE1-NH2 3.36Å; E699-R703 IonicContact OE2-NH1 3.67Å; L700-R703 PolarHBondContact O-N 2.99Å; A701-R703 VanDerWaalsContact C-N 3.34Å; A701-R703 PolarHBondContact O-N 2.98Å
704	Q	89.6	Confident	90.4	Very high	112 Å²	112	16.5 Å²	16.5	52%	0.523	8%	0.078	S	C	.	.			trans	50.4	62.1	-172.8	-48.2	-174.4	-14	0	0	113	P559 K633 A701 C702	P559-Q704 HydrophobicContact CG-CB 4.06Å; P559-Q704 HydrophobicContact CG-CG 3.81Å; K633-Q704 PolarHBondContact NZ-O 2.96Å; A701-Q704 PolarHBondContact O-N 2.86Å; C702-Q704 VanDerWaalsContact C-N 3.26Å; C702-Q704 PolarHBondContact O-N 3.41Å
705	P	92.3	Very high	90.1	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.076	C	C	.	.			trans	-71.9	154.6	-178.9	31	-36.1	0	0	0	112.7	K633 L700 L708 Y732	K633-P705 WeakPolarHBondContact O-CA 3.03Å; L700-P705 WeakPolarHBondContact O-CD 3.48Å; P705-L708 HydrophobicContact CB-CD2 4.45Å; P705-L708 HydrophobicContact CG-CD2 3.61Å; P705-L708 HydrophobicContact CG-CG 4.27Å; P705-Y732 PolarHBondContact O-OH 3.22Å
706	D	93.3	Very high	89.5	Confident	4 Å²	4	18.8 Å²	18.8	2%	0.021	9%	0.091	C	C	.	.	S	Bend	trans	-93.3	-26.4	171.4	-46.8	-57.8	0	0	0	111.8	P561 M594 L632 K633 Y732 G734 A735	P561-D706 HydrophobicContact CB-CB 4.1Å; P561-D706 WeakPolarHBondContact CB-OD1 3.46Å; M594-D706 HydrophobicContact CE-CB 4.24Å; L632-D706 HydrophobicContact CD1-CB 4.01Å; K633-D706 PolarHBondContact N-OD2 3.41Å; K633-D706 PolarHBondContact O-N 2.64Å; D706-Y732 VanDerWaalsContact C-OH 3.27Å; D706-Y732 PolarHBondContact O-OH 2.84Å; D706-G734 VanDerWaalsContact O-CA 3.25Å; D706-G734 WeakPolarHBondContact O-CA 3.47Å; D706-A735 PolarHBondContact O-N 2.66Å; D706-A735 VanDerWaalsContact O-N 3.17Å
707	V	93.8	Very high	89.2	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	127	176.1	-178	0	0	0	0	109	I568 I592 L632 K633 G635 I709 A735	I568-V707 HydrophobicContact CG2-CG2 4.12Å; I592-V707 HydrophobicContact CD1-CG1 3.75Å; I592-V707 HydrophobicContact CD1-CG2 4.05Å; L632-V707 HydrophobicContact CD1-CG2 3.81Å; L632-V707 HydrophobicContact CD2-CG2 4.2Å; L632-V707 HydrophobicContact CG-CG2 4.27Å; K633-V707 PolarHBondContact O-N 3.19Å; G635-V707 PolarHBondContact N-O 3.42Å; V707-I709 HydrophobicContact CG1-CD1 4.46Å; V707-I709 HydrophobicContact CG1-CG1 3.95Å; V707-A735 WeakPolarHBondContact CA-O 3.37Å; V707-A735 HydrophobicContact CG1-CB 4.24Å; V707-A735 HydrophobicContact CG2-CB 4.15Å
708	L	94	Very high	88.9	Confident	0 Å²	0	19 Å²	19	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	127.2	168.7	-70.9	171.1	0	0	0	109.7	F558 P705 Y732 A735 V736 I737	F558-L708 HydrophobicContact CB-CD1 4.38Å; F558-L708 HydrophobicContact CD1-CD1 4.34Å; F558-L708 HydrophobicContact CD2-CD1 3.7Å; F558-L708 HydrophobicContact CE2-CD1 4.07Å; F558-L708 HydrophobicContact CG-CD1 3.86Å; P705-L708 HydrophobicContact CB-CD2 4.45Å; P705-L708 HydrophobicContact CG-CD2 3.61Å; P705-L708 HydrophobicContact CG-CG 4.27Å; L708-Y732 HydrophobicContact CB-CE1 4.43Å; L708-Y732 HydrophobicContact CD1-CD1 3.9Å; L708-Y732 HydrophobicContact CD1-CE1 3.63Å; L708-Y732 HydrophobicContact CD1-CE2 4.47Å; L708-Y732 HydrophobicContact CD1-CG 4.41Å; L708-Y732 HydrophobicContact CG-CE1 3.85Å; L708-A735 PolarHBondContact N-O 2.79Å; L708-V736 HydrophobicContact CB-CG1 4.2Å; L708-V736 HydrophobicContact CB-CG2 4.37Å; L708-V736 HydrophobicContact CD1-CG2 4.48Å; L708-V736 WeakPolarHBondContact O-CA 3.3Å; L708-I737 PolarHBondContact O-N 3.43Å
709	I	93.8	Very high	88.5	Confident	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	115.9	173.1	-59.6	-172.4	0	0	0	107.7	L569 L612 L615 T616 V634 G635 F636 F637 V707 I737	L569-I709 HydrophobicContact CD2-CD1 4.43Å; L612-I709 HydrophobicContact CB-CG2 3.92Å; L612-I709 HydrophobicContact CD1-CG2 3.87Å; L612-I709 HydrophobicContact CD2-CG2 3.7Å; L612-I709 HydrophobicContact CG-CG2 4.02Å; L615-I709 HydrophobicContact CB-CD1 4.11Å; T616-I709 HydrophobicContact CG2-CD1 4.14Å; V634-I709 HydrophobicContact CG1-CB 4.49Å; V634-I709 HydrophobicContact CG1-CD1 3.62Å; V634-I709 HydrophobicContact CG1-CG1 3.86Å; G635-I709 PolarHBondContact O-N 3.03Å; F636-I709 WeakPolarHBondContact CA-O 3.43Å; F636-I709 HydrophobicContact CD2-CB 4.06Å; F636-I709 HydrophobicContact CD2-CG2 3.78Å; F636-I709 HydrophobicContact CE2-CG2 4.07Å; F637-I709 PolarHBondContact N-O 3.48Å; V707-I709 HydrophobicContact CG1-CD1 4.46Å; V707-I709 HydrophobicContact CG1-CG1 3.95Å; I709-I737 WeakPolarHBondContact CA-O 3.24Å; I709-I737 HydrophobicContact CD1-CD1 4.23Å; I709-I737 HydrophobicContact CG1-CB 4.31Å; I709-I737 HydrophobicContact CG1-CD1 4.22Å; I709-I737 HydrophobicContact CG1-CG1 4.47Å
710	L	92.3	Very high	88.2	Confident	0 Å²	0	23 Å²	23	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	104.4	-168.6	-56.3	-179	0	0	0	111	F637 F697 P713 I729 V736 I737 I738 V739	F637-L710 HydrophobicContact CB-CD2 3.6Å; F637-L710 HydrophobicContact CG-CD2 4.46Å; F697-L710 HydrophobicContact CE1-CD2 4.32Å; L710-P713 HydrophobicContact CB-CB 4.03Å; L710-P713 HydrophobicContact CB-CG 3.85Å; L710-P713 HydrophobicContact CD1-CB 4.32Å; L710-P713 HydrophobicContact CD1-CG 4.29Å; L710-I729 HydrophobicContact CD1-CD1 4.32Å; L710-V736 HydrophobicContact CD1-CG1 4.38Å; L710-I737 PolarHBondContact N-O 2.94Å; L710-I738 HydrophobicContact CB-CG2 4.37Å; L710-I738 HydrophobicContact CD1-CG1 4.48Å; L710-I738 CarbonylContact O-C 3.55Å; L710-I738 WeakPolarHBondContact O-CA 3.2Å; L710-V739 PolarHBondContact O-N 3.26Å
711	D	90.9	Very high	88	Confident	12 Å²	12	23 Å²	23	6%	0.064	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	106.6	175.9	-155.2	15.4	0	0	0	110.3	S609 L612 F637 N638 V739	S609-D711 WeakPolarHBondContact CB-OD2 3.37Å; S609-D711 PolarHBondContact OG-OD2 3.49Å; L612-D711 HydrophobicContact CD1-CB 3.61Å; F637-D711 PolarHBondContact O-N 3.31Å; N638-D711 HydrophobicContact CB-CB 4.18Å; D711-V739 WeakPolarHBondContact OD1-CB 3.21Å
712	E	87.5	Confident	87.8	Confident	23 Å²	23	22.7 Å²	22.7	11%	0.107	11%	0.108	C	C	.	.	S	Bend	trans	48.7	59.6	-174.3	-56.4	-173.3	167.6	0	0	114.9	Q639 T714 N715 V739	Q639-E712 PolarHBondContact NE2-OE2 2.85Å; E712-T714 VanDerWaalsContact C-N 3.27Å; E712-T714 PolarHBondContact O-N 3.4Å; E712-N715 WeakPolarHBondContact CB-ND2 3.45Å; E712-N715 WeakPolarHBondContact O-CB 3.39Å; E712-N715 PolarHBondContact O-N 3.39Å; E712-N715 PolarHBondContact O-ND2 2.86Å; E712-N715 PolarHBondContact OE2-ND2 3.18Å; E712-V739 VanDerWaalsContact CA-O 3.23Å; E712-V739 WeakPolarHBondContact CA-O 3.4Å; E712-V739 HydrophobicContact CG-CG1 4.26Å; E712-V739 PolarHBondContact N-O 3.34Å
713	P	87.7	Confident	87.7	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-17.7	-173	29.5	-36.8	0	0	0	115.1	F637 F697 L710 N715 L717 L725 I738 V739 L745	F637-P713 HydrophobicContact CD1-CB 4.39Å; F637-P713 HydrophobicContact CE1-CB 4.49Å; F697-P713 HydrophobicContact CE1-CB 4.49Å; F697-P713 HydrophobicContact CZ-CB 3.9Å; L710-P713 HydrophobicContact CB-CB 4.03Å; L710-P713 HydrophobicContact CB-CG 3.85Å; L710-P713 HydrophobicContact CD1-CB 4.32Å; L710-P713 HydrophobicContact CD1-CG 4.29Å; P713-N715 VanDerWaalsContact C-N 3.3Å; P713-L717 WeakPolarHBondContact O-CD1 3.34Å; P713-L717 WeakPolarHBondContact O-CG 3.26Å; P713-L725 HydrophobicContact CB-CD2 4.01Å; P713-L725 HydrophobicContact CG-CD2 4.34Å; P713-I738 HydrophobicContact CG-CG2 3.94Å; P713-V739 VanDerWaalsContact CD-O 3.32Å; P713-V739 WeakPolarHBondContact CD-O 3.49Å; P713-L745 HydrophobicContact CG-CD2 4.27Å
714	T	84.8	Confident	87.7	Confident	8 Å²	8	17.8 Å²	17.8	5%	0.049	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-19	177.8	49.6	0	0	0	0	112.9	E712 N716 L717 I722 D742 L745	E712-T714 VanDerWaalsContact C-N 3.27Å; E712-T714 PolarHBondContact O-N 3.4Å; T714-N716 PolarHBondContact O-N 2.7Å; T714-L717 WeakPolarHBondContact O-CB 3.27Å; T714-L717 PolarHBondContact O-N 2.92Å; T714-L717 VanDerWaalsContact O-N 3.13Å; T714-I722 HydrophobicContact CG2-CD1 4.13Å; T714-I722 HydrophobicContact CG2-CG1 4.21Å; T714-I722 HydrophobicContact CG2-CG2 4.25Å; T714-D742 HydrophobicContact CG2-CB 3.86Å; T714-L745 HydrophobicContact CG2-CD2 3.73Å
715	N	82.5	Confident	87.8	Confident	4 Å²	4	12.5 Å²	12.5	2%	0.021	6%	0.064	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	130.2	179.9	-77.4	-27.6	0	0	0	111.8	N423 Q639 E712 P713 L717	N423-N715 PolarHBondContact O-OD1 2.96Å; Q639-N715 PolarHBondContact NE2-ND2 2.86Å; E712-N715 WeakPolarHBondContact CB-ND2 3.45Å; E712-N715 WeakPolarHBondContact O-CB 3.39Å; E712-N715 PolarHBondContact O-N 3.39Å; E712-N715 PolarHBondContact O-ND2 2.86Å; E712-N715 PolarHBondContact OE2-ND2 3.18Å; P713-N715 VanDerWaalsContact C-N 3.3Å; N715-L717 PolarHBondContact O-N 3.19Å; N715-L717 VanDerWaalsContact O-N 3.08Å
716	N	77.7	Confident	87.7	Confident	61 Å²	61	12.7 Å²	12.7	33%	0.326	7%	0.066	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.9	-0.7	-178.2	-47.3	-53.1	0	0	0	116.1	N281 Y641 G690 T714	N281-N716 PolarHBondContact ND2-O 2.72Å; Y641-N716 PolarHBondContact OH-ND2 3.12Å; G690-N716 WeakPolarHBondContact CA-O 3.41Å; T714-N716 PolarHBondContact O-N 2.7Å
717	L	82.8	Confident	87.6	Confident	1 Å²	1	17.5 Å²	17.5	1%	0.005	9%	0.088	C	C	.	.			trans	-75.6	153.5	171.6	-68.1	-170.6	0	0	0	110.8	H449 F556 A693 R694 F697 P713 T714 N715 I722 L725	H449-L717 PolarHBondContact CD2-O 3.39Å; F556-L717 HydrophobicContact CZ-CD2 4.49Å; A693-L717 HydrophobicContact CB-CD2 4.11Å; R694-L717 HydrophobicContact CG-CD2 4.5Å; F697-L717 HydrophobicContact CD2-CD2 4.49Å; F697-L717 HydrophobicContact CE2-CD1 3.99Å; F697-L717 HydrophobicContact CE2-CD2 4.12Å; F697-L717 HydrophobicContact CE2-CG 4.4Å; F697-L717 HydrophobicContact CZ-CD1 4.45Å; P713-L717 WeakPolarHBondContact O-CD1 3.34Å; P713-L717 WeakPolarHBondContact O-CG 3.26Å; T714-L717 WeakPolarHBondContact O-CB 3.27Å; T714-L717 PolarHBondContact O-N 2.92Å; T714-L717 VanDerWaalsContact O-N 3.13Å; N715-L717 PolarHBondContact O-N 3.19Å; N715-L717 VanDerWaalsContact O-N 3.08Å; L717-I722 HydrophobicContact CB-CD1 4.42Å; L717-I722 HydrophobicContact CB-CG1 3.89Å; L717-I722 HydrophobicContact CD1-CG1 4.34Å; L717-L725 HydrophobicContact CD1-CD2 4.28Å
718	D	83.8	Confident	87.5	Confident	10 Å²	10	17.6 Å²	17.6	5%	0.053	9%	0.089	C	C	.	.			trans	-94.2	167.7	166.7	60.3	20.7	0	0	0	111.2	R694 E720 S721 I722	R694-D718 IonicContact CZ-OD2 3.07Å; R694-D718 IonicContact NH2-OD1 3.54Å; R694-D718 PolarHBondContact NH2-OD1 2.94Å; R694-D718 IonicContact NH2-OD2 2.72Å; R694-D718 PolarHBondContact NH2-OD2 2.89Å; D718-E720 VanDerWaalsContact C-N 3.25Å; D718-E720 PolarHBondContact O-N 3.45Å; D718-S721 WeakPolarHBondContact O-CA 3.36Å; D718-S721 WeakPolarHBondContact O-CB 3.41Å; D718-S721 PolarHBondContact O-N 3.34Å; D718-S721 WeakPolarHBondContact OD1-CB 3.36Å; D718-S721 PolarHBondContact OD1-N 3.32Å; D718-S721 VanDerWaalsContact OD1-N 3.15Å; D718-S721 PolarHBondContact OD1-OG 3.04Å; D718-I722 PolarHBondContact O-N 3.48Å
719	I	83.4	Confident	87.4	Confident	12 Å²	12	17.6 Å²	17.6	6%	0.062	9%	0.089	C	C	.	.	H	α-helix	trans	-58.2	-38.1	-170.5	-48.4	-167.8	0	0	0	112.2	V278 H449 Q451 Y476 S721 I722 D723	V278-I719 HydrophobicContact CB-CD1 4.47Å; V278-I719 HydrophobicContact CG1-CD1 4.33Å; H449-I719 HydrophobicContact CB-CG1 4.28Å; H449-I719 VanDerWaalsContact ND1-CG1 3.32Å; H449-I719 WeakPolarHBondContact ND1-CG1 3.28Å; Q451-I719 HydrophobicContact CG-CG2 3.36Å; Y476-I719 HydrophobicContact CE2-CD1 3.86Å; I719-S721 VanDerWaalsContact C-N 3.34Å; I719-I722 PolarHBondContact O-N 3.49Å; I719-D723 PolarHBondContact O-N 2.79Å
720	E	82.5	Confident	87.4	Confident	84 Å²	84	21.8 Å²	21.8	39%	0.393	11%	0.111	S	C	.	.	H	α-helix	trans	-69.4	-31.5	178.1	-61.5	-179.6	164.7	0	0	111.8	D718 A724	D718-E720 VanDerWaalsContact C-N 3.25Å; D718-E720 PolarHBondContact O-N 3.45Å; E720-A724 WeakPolarHBondContact O-CB 3.44Å; E720-A724 PolarHBondContact O-N 3.04Å; E720-A724 VanDerWaalsContact O-N 3.14Å
721	S	85.7	Confident	87.4	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-74.9	-33.6	173.7	-51.7	0	0	0	0	112.9	R694 D718 I719 A724 L725	R694-S721 PolarHBondContact NE-OG 3.29Å; R694-S721 PolarHBondContact NH2-OG 3.22Å; D718-S721 WeakPolarHBondContact O-CA 3.36Å; D718-S721 WeakPolarHBondContact O-CB 3.41Å; D718-S721 PolarHBondContact O-N 3.34Å; D718-S721 WeakPolarHBondContact OD1-CB 3.36Å; D718-S721 PolarHBondContact OD1-N 3.32Å; D718-S721 VanDerWaalsContact OD1-N 3.15Å; D718-S721 PolarHBondContact OD1-OG 3.04Å; I719-S721 VanDerWaalsContact C-N 3.34Å; S721-A724 PolarHBondContact O-N 3.03Å; S721-L725 WeakPolarHBondContact O-CB 3.48Å; S721-L725 PolarHBondContact O-N 2.82Å
722	I	87.8	Confident	87.5	Confident	5 Å²	5	26 Å²	26	3%	0.026	13%	0.13	C	C	.	.	H	α-helix	trans	-68.9	-46.6	176.3	-62.2	171.5	0	0	0	109.8	H449 T714 L717 D718 I719 A724 L725 S726	H449-I722 HydrophobicContact CB-CD1 4.41Å; T714-I722 HydrophobicContact CG2-CD1 4.13Å; T714-I722 HydrophobicContact CG2-CG1 4.21Å; T714-I722 HydrophobicContact CG2-CG2 4.25Å; L717-I722 HydrophobicContact CB-CD1 4.42Å; L717-I722 HydrophobicContact CB-CG1 3.89Å; L717-I722 HydrophobicContact CD1-CG1 4.34Å; D718-I722 PolarHBondContact O-N 3.48Å; I719-I722 PolarHBondContact O-N 3.49Å; I722-A724 VanDerWaalsContact C-N 3.3Å; I722-A724 PolarHBondContact O-N 3.45Å; I722-L725 PolarHBondContact O-N 3.22Å; I722-L725 VanDerWaalsContact O-N 3.13Å; I722-S726 PolarHBondContact O-N 2.76Å; I722-S726 PolarHBondContact O-OG 3.4Å
723	D	87.1	Confident	87.7	Confident	32 Å²	32	32.2 Å²	32.2	17%	0.171	16%	0.157	C	C	.	.	H	α-helix	trans	-54	-47	172	-76.7	-15.1	0	0	0	111.3	Q451 K480 I719 L725 S726 E727 R744	Q451-D723 PolarHBondContact NE2-OD1 3.44Å; K480-D723 WeakPolarHBondContact CE-OD2 3.35Å; K480-D723 IonicContact NZ-OD1 2.62Å; K480-D723 PolarHBondContact NZ-OD1 3.13Å; K480-D723 IonicContact NZ-OD2 3.32Å; K480-D723 PolarHBondContact NZ-OD2 3.16Å; I719-D723 PolarHBondContact O-N 2.79Å; D723-L725 VanDerWaalsContact C-N 3.34Å; D723-L725 PolarHBondContact O-N 3.5Å; D723-S726 PolarHBondContact O-N 3.45Å; D723-E727 PolarHBondContact O-N 3.42Å; D723-E727 VanDerWaalsContact O-N 3.11Å; D723-R744 IonicContact OD1-CZ 2.89Å; D723-R744 VanDerWaalsContact OD1-CZ 3.3Å; D723-R744 IonicContact OD1-NH1 2.75Å; D723-R744 PolarHBondContact OD1-NH1 2.72Å; D723-R744 IonicContact OD1-NH2 3.16Å; D723-R744 PolarHBondContact OD1-NH2 2.82Å
724	A	88.9	Confident	87.9	Confident	6 Å²	6	32.2 Å²	32.2	5%	0.05	16%	0.157	C	C	.	.	H	α-helix	trans	-66.6	-31.3	178.8	0	0	0	0	0	113.5	V554 F556 E720 S721 I722 A728	V554-A724 HydrophobicContact CB-CB 4.46Å; V554-A724 HydrophobicContact CG1-CB 4.01Å; F556-A724 HydrophobicContact CB-CB 4.46Å; F556-A724 HydrophobicContact CD1-CB 4.32Å; F556-A724 HydrophobicContact CG-CB 4.47Å; E720-A724 WeakPolarHBondContact O-CB 3.44Å; E720-A724 PolarHBondContact O-N 3.04Å; E720-A724 VanDerWaalsContact O-N 3.14Å; S721-A724 PolarHBondContact O-N 3.03Å; I722-A724 VanDerWaalsContact C-N 3.3Å; I722-A724 PolarHBondContact O-N 3.45Å; A724-A728 WeakPolarHBondContact O-CB 3.2Å; A724-A728 PolarHBondContact O-N 3.33Å
725	L	90.5	Very high	88.3	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-70.2	-42.2	174.6	177.7	63.4	0	0	0	111.3	F556 F558 F697 P713 L717 S721 I722 D723 A728 I729	F556-L725 HydrophobicContact CD2-CB 4Å; F556-L725 HydrophobicContact CD2-CD1 3.96Å; F556-L725 HydrophobicContact CE2-CB 4.3Å; F556-L725 HydrophobicContact CE2-CD1 4.41Å; F558-L725 HydrophobicContact CE2-CD1 4.08Å; F558-L725 HydrophobicContact CZ-CD1 4.25Å; F697-L725 HydrophobicContact CE1-CD1 4.29Å; F697-L725 HydrophobicContact CZ-CD2 4.44Å; P713-L725 HydrophobicContact CB-CD2 4.01Å; P713-L725 HydrophobicContact CG-CD2 4.34Å; L717-L725 HydrophobicContact CD1-CD2 4.28Å; S721-L725 WeakPolarHBondContact O-CB 3.48Å; S721-L725 PolarHBondContact O-N 2.82Å; I722-L725 PolarHBondContact O-N 3.22Å; I722-L725 VanDerWaalsContact O-N 3.13Å; D723-L725 VanDerWaalsContact C-N 3.34Å; D723-L725 PolarHBondContact O-N 3.5Å; L725-A728 PolarHBondContact O-N 3.12Å; L725-I729 HydrophobicContact CD1-CD1 3.89Å; L725-I729 HydrophobicContact CD1-CG1 4.23Å; L725-I729 HydrophobicContact CG-CD1 3.84Å; L725-I729 WeakPolarHBondContact O-CG1 3.34Å; L725-I729 PolarHBondContact O-N 3.28Å
726	S	90.6	Very high	88.9	Confident	4 Å²	4	31.6 Å²	31.6	3%	0.028	15%	0.153	C	C	.	.	H	α-helix	trans	-57.6	-48.3	172.7	-59.6	0	0	0	0	111.4	I722 D723 A728 I729 N730 L745	I722-S726 PolarHBondContact O-N 2.76Å; I722-S726 PolarHBondContact O-OG 3.4Å; D723-S726 PolarHBondContact O-N 3.45Å; S726-A728 VanDerWaalsContact C-N 3.32Å; S726-A728 PolarHBondContact O-N 3.2Å; S726-I729 PolarHBondContact O-N 2.9Å; S726-N730 PolarHBondContact O-N 2.9Å; S726-N730 VanDerWaalsContact O-N 3.16Å; S726-L745 WeakPolarHBondContact OG-CD1 3.5Å
727	E	91	Very high	89.7	Confident	106 Å²	106	28.8 Å²	28.8	50%	0.495	14%	0.138	S	C	.	.	H	α-helix	trans	-58.4	-43.1	174.5	-73.2	-171.5	-169.1	0	0	112	K555 D723 I729 N730 E731	K555-E727 IonicContact NZ-OE2 2.86Å; D723-E727 PolarHBondContact O-N 3.42Å; D723-E727 VanDerWaalsContact O-N 3.11Å; E727-I729 PolarHBondContact O-N 2.93Å; E727-N730 PolarHBondContact O-N 2.95Å; E727-E731 PolarHBondContact O-N 2.87Å
728	A	92.3	Very high	90.2	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.008	14%	0.138	C	C	.	.	H	α-helix	trans	-66.2	-36.8	-178.9	0	0	0	0	0	113.4	F556 F558 A724 L725 S726 N730 Y732	F556-A728 HydrophobicContact CB-CB 3.71Å; F556-A728 WeakPolarHBondContact O-CB 3.44Å; F558-A728 HydrophobicContact CD2-CB 4Å; F558-A728 HydrophobicContact CE2-CB 3.85Å; A724-A728 WeakPolarHBondContact O-CB 3.2Å; A724-A728 PolarHBondContact O-N 3.33Å; L725-A728 PolarHBondContact O-N 3.12Å; S726-A728 VanDerWaalsContact C-N 3.32Å; S726-A728 PolarHBondContact O-N 3.2Å; A728-N730 VanDerWaalsContact C-N 3.31Å; A728-Y732 VanDerWaalsContact O-CB 3.25Å; A728-Y732 WeakPolarHBondContact O-CB 3.26Å; A728-Y732 PolarHBondContact O-N 3.23Å
729	I	92.5	Very high	90.6	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-69.8	-31.9	176.4	-70.4	161.9	0	0	0	110.8	R597 L710 L725 S726 E727 V736 I738 L745 T749	R597-I729 PolarHBondContact NH2-O 3.21Å; L710-I729 HydrophobicContact CD1-CD1 4.32Å; L725-I729 HydrophobicContact CD1-CD1 3.89Å; L725-I729 HydrophobicContact CD1-CG1 4.23Å; L725-I729 HydrophobicContact CG-CD1 3.84Å; L725-I729 WeakPolarHBondContact O-CG1 3.34Å; L725-I729 PolarHBondContact O-N 3.28Å; S726-I729 PolarHBondContact O-N 2.9Å; E727-I729 PolarHBondContact O-N 2.93Å; I729-V736 HydrophobicContact CG1-CG1 4.45Å; I729-V736 HydrophobicContact CG2-CB 4.45Å; I729-V736 HydrophobicContact CG2-CG1 4.3Å; I729-V736 HydrophobicContact CG2-CG2 4.21Å; I729-I738 HydrophobicContact CD1-CD1 3.89Å; I729-L745 HydrophobicContact CD1-CD1 4.2Å; I729-T749 HydrophobicContact CB-CG2 3.73Å; I729-T749 HydrophobicContact CD1-CG2 4.04Å; I729-T749 HydrophobicContact CG2-CG2 3.46Å; I729-T749 VanDerWaalsContact CG2-CG2 3.46Å
730	N	92.6	Very high	90.9	Very high	89 Å²	89	28.2 Å²	28.2	48%	0.476	14%	0.136	S	C	.	.	H	α-helix	trans	-80	-27.5	177	-70.6	-11.4	0	0	0	113.4	S726 E727 A728 E748 T749	S726-N730 PolarHBondContact O-N 2.9Å; S726-N730 VanDerWaalsContact O-N 3.16Å; E727-N730 PolarHBondContact O-N 2.95Å; A728-N730 VanDerWaalsContact C-N 3.31Å; N730-E748 PolarHBondContact ND2-O 2.95Å; N730-T749 WeakPolarHBondContact OD1-CA 3.18Å
731	E	92.6	Very high	91	Very high	93 Å²	93	24.6 Å²	24.6	44%	0.435	12%	0.119	S	C	.	.	H	α-helix	trans	-78.9	-18	171.2	-74.5	-174.8	168.4	0	0	113.8	K555 N560 E727	K555-E731 VanDerWaalsContact CE-OE2 3.24Å; K555-E731 WeakPolarHBondContact CE-OE2 3.38Å; K555-E731 IonicContact NZ-OE1 3.92Å; K555-E731 PolarHBondContact NZ-OE1 3.03Å; K555-E731 IonicContact NZ-OE2 2.76Å; K555-E731 PolarHBondContact NZ-OE2 3.44Å; K555-E731 VanDerWaalsContact NZ-OE2 3.15Å; N560-E731 PolarHBondContact OD1-O 3.2Å; E727-E731 PolarHBondContact O-N 2.87Å
732	Y	93.7	Very high	91.1	Very high	6 Å²	6	24.7 Å²	24.7	2%	0.024	12%	0.12	C	C	.	.			trans	-84.5	136.8	-171.7	178.3	-114.8	0	0	0	113.7	F558 N560 R597 P705 D706 L708 A728 G734 V736	F558-Y732 HydrophobicContact CB-CD2 3.67Å; F558-Y732 HydrophobicContact CB-CE2 3.97Å; F558-Y732 HydrophobicContact CB-CG 4.34Å; N560-Y732 WeakPolarHBondContact OD1-CA 3.49Å; R597-Y732 PolarHBondContact NH2-O 3.44Å; P705-Y732 PolarHBondContact O-OH 3.22Å; D706-Y732 VanDerWaalsContact C-OH 3.27Å; D706-Y732 PolarHBondContact O-OH 2.84Å; L708-Y732 HydrophobicContact CB-CE1 4.43Å; L708-Y732 HydrophobicContact CD1-CD1 3.9Å; L708-Y732 HydrophobicContact CD1-CE1 3.63Å; L708-Y732 HydrophobicContact CD1-CE2 4.47Å; L708-Y732 HydrophobicContact CD1-CG 4.41Å; L708-Y732 HydrophobicContact CG-CE1 3.85Å; A728-Y732 VanDerWaalsContact O-CB 3.25Å; A728-Y732 WeakPolarHBondContact O-CB 3.26Å; A728-Y732 PolarHBondContact O-N 3.23Å; Y732-G734 WeakPolarHBondContact CD1-O 3.44Å; Y732-G734 WeakPolarHBondContact CE1-O 3.39Å; Y732-V736 HydrophobicContact CD1-CG2 3.62Å; Y732-V736 HydrophobicContact CE1-CG2 3.88Å
733	K	91.8	Very high	90.9	Very high	154 Å²	154	25.1 Å²	25.1	67%	0.67	12%	0.124	S	C	*	.			trans	-102.8	9	-177	-64.8	-169.5	175.4	-166.2	0	115.3	N560	N560-K733 HydrophobicContact CB-CB 4.25Å; N560-K733 WeakPolarHBondContact OD1-CB 3.34Å; N560-K733 PolarHBondContact OD1-N 3.39Å
734	G	91.9	Very high	90.9	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	13%	0.127	C	C	.	.	S	Bend	trans	-96.6	175.8	168.1	0	0	0	0	0	111.9	M594 R597 D706 Y732	M594-G734 CarbonylContact O-C 3.55Å; M594-G734 WeakPolarHBondContact O-CA 3.34Å; R597-G734 PolarHBondContact NH1-O 3.18Å; D706-G734 VanDerWaalsContact O-CA 3.25Å; D706-G734 WeakPolarHBondContact O-CA 3.47Å; Y732-G734 WeakPolarHBondContact CD1-O 3.44Å; Y732-G734 WeakPolarHBondContact CE1-O 3.39Å
735	A	93.5	Very high	90.8	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	147.5	179.2	0	0	0	0	0	110.3	I592 D593 M594 D706 V707 L708	I592-A735 HydrophobicContact CD1-CB 4.07Å; D593-A735 WeakPolarHBondContact O-CB 3.45Å; M594-A735 PolarHBondContact O-N 3.26Å; D706-A735 PolarHBondContact O-N 2.66Å; D706-A735 VanDerWaalsContact O-N 3.17Å; V707-A735 WeakPolarHBondContact CA-O 3.37Å; V707-A735 HydrophobicContact CG1-CB 4.24Å; V707-A735 HydrophobicContact CG2-CB 4.15Å; L708-A735 PolarHBondContact N-O 2.79Å
736	V	94.9	Very high	90.8	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	120.5	179.6	-167.9	0	0	0	0	110.5	S596 I598 L708 L710 I729 Y732 I738	S596-V736 PolarHBondContact O-N 3.44Å; I598-V736 PolarHBondContact N-O 3.04Å; L708-V736 HydrophobicContact CB-CG1 4.2Å; L708-V736 HydrophobicContact CB-CG2 4.37Å; L708-V736 HydrophobicContact CD1-CG2 4.48Å; L708-V736 WeakPolarHBondContact O-CA 3.3Å; L710-V736 HydrophobicContact CD1-CG1 4.38Å; I729-V736 HydrophobicContact CG1-CG1 4.45Å; I729-V736 HydrophobicContact CG2-CB 4.45Å; I729-V736 HydrophobicContact CG2-CG1 4.3Å; I729-V736 HydrophobicContact CG2-CG2 4.21Å; Y732-V736 HydrophobicContact CD1-CG2 3.62Å; Y732-V736 HydrophobicContact CE1-CG2 3.88Å; V736-I738 HydrophobicContact CG1-CD1 3.91Å; V736-I738 HydrophobicContact CG1-CG1 3.66Å
737	I	94.8	Very high	90.7	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.005	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	126.4	172.1	-51.1	-178.6	0	0	0	108.1	F590 I592 I598 I600 L612 L615 L708 I709 L710	F590-I737 HydrophobicContact CE1-CD1 4.41Å; I592-I737 HydrophobicContact CD1-CD1 4.06Å; I592-I737 HydrophobicContact CG2-CD1 4.04Å; I598-I737 HydrophobicContact CG2-CG2 4.39Å; I598-I737 CarbonylContact O-C 3.6Å; I598-I737 WeakPolarHBondContact O-CA 3.39Å; I600-I737 HydrophobicContact CD1-CG2 3.46Å; I600-I737 VanDerWaalsContact CD1-CG2 3.46Å; I600-I737 HydrophobicContact CG1-CG2 4.22Å; L612-I737 HydrophobicContact CD2-CG2 3.86Å; L615-I737 HydrophobicContact CD1-CD1 3.93Å; L708-I737 PolarHBondContact O-N 3.43Å; I709-I737 WeakPolarHBondContact CA-O 3.24Å; I709-I737 HydrophobicContact CD1-CD1 4.23Å; I709-I737 HydrophobicContact CG1-CB 4.31Å; I709-I737 HydrophobicContact CG1-CD1 4.22Å; I709-I737 HydrophobicContact CG1-CG1 4.47Å; L710-I737 PolarHBondContact N-O 2.94Å
738	I	93.1	Very high	90.6	Very high	2 Å²	2	28.6 Å²	28.6	1%	0.01	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	128.3	-175.6	-44.6	-178.8	0	0	0	110.4	I598 C599 I600 L710 P713 I729 V736	I598-I738 PolarHBondContact O-N 3.45Å; C599-I738 CarbonylContact C-O 2.92Å; C599-I738 WeakPolarHBondContact CA-O 3.36Å; C599-I738 PolarHBondContact SG-O 2.91Å; C599-I738 VanDerWaalsContact SG-O 3.33Å; I600-I738 PolarHBondContact N-O 3.46Å; L710-I738 HydrophobicContact CB-CG2 4.37Å; L710-I738 HydrophobicContact CD1-CG1 4.48Å; L710-I738 CarbonylContact O-C 3.55Å; L710-I738 WeakPolarHBondContact O-CA 3.2Å; P713-I738 HydrophobicContact CG-CG2 3.94Å; I729-I738 HydrophobicContact CD1-CD1 3.89Å; V736-I738 HydrophobicContact CG1-CD1 3.91Å; V736-I738 HydrophobicContact CG1-CG1 3.66Å
739	V	91.9	Very high	90.5	Very high	3 Å²	3	28.6 Å²	28.6	2%	0.018	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	120.7	156.2	173.4	0	0	0	0	106.5	I600 K608 L612 L710 D711 E712 P713	I600-V739 HydrophobicContact CB-CG2 3.86Å; I600-V739 HydrophobicContact CG2-CG2 4.08Å; K608-V739 HydrophobicContact CB-CG1 4.42Å; K608-V739 HydrophobicContact CB-CG2 4.09Å; K608-V739 HydrophobicContact CD-CG1 3.97Å; K608-V739 HydrophobicContact CD-CG2 4.49Å; L612-V739 HydrophobicContact CD1-CG2 3.87Å; L612-V739 HydrophobicContact CG-CG2 4.4Å; L710-V739 PolarHBondContact O-N 3.26Å; D711-V739 WeakPolarHBondContact OD1-CB 3.21Å; E712-V739 VanDerWaalsContact CA-O 3.23Å; E712-V739 WeakPolarHBondContact CA-O 3.4Å; E712-V739 HydrophobicContact CG-CG1 4.26Å; E712-V739 PolarHBondContact N-O 3.34Å; P713-V739 VanDerWaalsContact CD-O 3.32Å; P713-V739 WeakPolarHBondContact CD-O 3.49Å
740	S	88.7	Confident	90.3	Very high	6 Å²	6	36.7 Å²	36.7	4%	0.042	18%	0.178	C	C	.	.			trans	-146.2	151.9	-178.3	-175.8	0	0	0	0	111.2	D742	S740-D742 PolarHBondContact OG-N 3.01Å
741	H	85.4	Confident	90.1	Very high	8 Å²	8	33 Å²	33	4%	0.037	16%	0.16	C	C	.	.			trans	-103.4	-7.9	166.1	60.2	-109.7	0	0	0	112.7	L427 V430 A743	L427-H741 WeakPolarHBondContact CD1-O 3.36Å; V430-H741 HydrophobicContact CG2-CB 4.04Å; H741-A743 PolarHBondContact O-N 2.99Å
742	D	86.8	Confident	90.1	Very high	3 Å²	3	33.2 Å²	33.2	2%	0.016	16%	0.161	C	C	.	.			trans	-80.8	109.3	178.2	-175.8	-34.7	0	0	0	110.5	T714 S740 R744 L745 I746	T714-D742 HydrophobicContact CG2-CB 3.86Å; S740-D742 PolarHBondContact OG-N 3.01Å; D742-R744 VanDerWaalsContact C-N 3.33Å; D742-R744 PolarHBondContact O-N 3.22Å; D742-R744 WeakPolarHBondContact OD1-CA 3.3Å; D742-R744 WeakPolarHBondContact OD1-CB 3.47Å; D742-R744 PolarHBondContact OD1-N 2.98Å; D742-L745 HydrophobicContact CB-CB 4.04Å; D742-L745 PolarHBondContact O-N 2.81Å; D742-L745 PolarHBondContact OD1-N 2.91Å; D742-I746 WeakPolarHBondContact O-CD1 3.36Å; D742-I746 WeakPolarHBondContact O-CG1 3.43Å; D742-I746 PolarHBondContact O-N 2.85Å
743	A	84.6	Confident	90	Very high	14 Å²	14	33.2 Å²	33.2	12%	0.116	16%	0.161	C	C	.	.	H	α-helix	trans	-60.7	-37.1	178.8	0	0	0	0	0	113.6	H741 T747 F768	H741-A743 PolarHBondContact O-N 2.99Å; A743-T747 WeakPolarHBondContact O-CB 3.39Å; A743-T747 PolarHBondContact O-N 2.97Å; A743-T747 VanDerWaalsContact O-N 3.11Å; A743-T747 PolarHBondContact O-OG1 3.14Å; A743-F768 HydrophobicContact CB-CD1 4.2Å; A743-F768 HydrophobicContact CB-CD2 4.49Å; A743-F768 HydrophobicContact CB-CE1 3.47Å; A743-F768 VanDerWaalsContact CB-CE1 3.47Å; A743-F768 HydrophobicContact CB-CE2 3.77Å; A743-F768 HydrophobicContact CB-CZ 3.22Å
744	R	86.1	Confident	90.1	Very high	61 Å²	61	27.6 Å²	27.6	23%	0.23	14%	0.135	C	C	.	.	H	α-helix	trans	-72.8	-41.6	-177.6	-179	172.5	171.4	-120.3	-38.9	110.6	D723 D742 I746 T747 E748	D723-R744 IonicContact OD1-CZ 2.89Å; D723-R744 VanDerWaalsContact OD1-CZ 3.3Å; D723-R744 IonicContact OD1-NH1 2.75Å; D723-R744 PolarHBondContact OD1-NH1 2.72Å; D723-R744 IonicContact OD1-NH2 3.16Å; D723-R744 PolarHBondContact OD1-NH2 2.82Å; D742-R744 VanDerWaalsContact C-N 3.33Å; D742-R744 PolarHBondContact O-N 3.22Å; D742-R744 WeakPolarHBondContact OD1-CA 3.3Å; D742-R744 WeakPolarHBondContact OD1-CB 3.47Å; D742-R744 PolarHBondContact OD1-N 2.98Å; R744-I746 PolarHBondContact O-N 3.33Å; R744-T747 PolarHBondContact O-N 3.27Å; R744-E748 HydrophobicContact CG-CG 4.05Å; R744-E748 IonicContact CZ-OE1 2.67Å; R744-E748 IonicContact CZ-OE2 2.75Å; R744-E748 VanDerWaalsContact CZ-OE2 3.32Å; R744-E748 IonicContact NE-OE1 2.68Å; R744-E748 PolarHBondContact NE-OE1 2.74Å; R744-E748 IonicContact NE-OE2 3.8Å; R744-E748 PolarHBondContact NE-OE2 3.02Å; R744-E748 IonicContact NH2-OE1 2.77Å; R744-E748 PolarHBondContact NH2-OE1 3.43Å; R744-E748 IonicContact NH2-OE2 2.68Å; R744-E748 PolarHBondContact NH2-OE2 3.02Å; R744-E748 WeakPolarHBondContact O-CB 3.41Å; R744-E748 WeakPolarHBondContact O-CG 3.41Å; R744-E748 PolarHBondContact O-N 2.9Å
745	L	88.4	Confident	90.1	Very high	1 Å²	1	28.1 Å²	28.1	1%	0.005	14%	0.138	C	C	.	.	H	α-helix	trans	-56.2	-52.4	174.8	178.2	61.7	0	0	0	110.6	P713 T714 S726 I729 D742 T747 E748 T749	P713-L745 HydrophobicContact CG-CD2 4.27Å; T714-L745 HydrophobicContact CG2-CD2 3.73Å; S726-L745 WeakPolarHBondContact OG-CD1 3.5Å; I729-L745 HydrophobicContact CD1-CD1 4.2Å; D742-L745 HydrophobicContact CB-CB 4.04Å; D742-L745 PolarHBondContact O-N 2.81Å; D742-L745 PolarHBondContact OD1-N 2.91Å; L745-T747 VanDerWaalsContact C-N 3.32Å; L745-T747 PolarHBondContact O-N 3.5Å; L745-E748 PolarHBondContact O-N 3.21Å; L745-T749 HydrophobicContact CD1-CG2 3.91Å; L745-T749 WeakPolarHBondContact O-CG2 3.27Å; L745-T749 PolarHBondContact O-N 3.2Å; L745-T749 PolarHBondContact O-OG1 2.9Å
746	I	89.6	Confident	89.9	Confident	3 Å²	3	28.1 Å²	28.1	2%	0.015	14%	0.139	C	C	.	.	H	α-helix	trans	-57.9	-44.7	-178.6	-62.6	165.5	0	0	0	111.3	L427 C599 D742 R744 Q750 C751 L753 F768	L427-I746 HydrophobicContact CD2-CD1 4.1Å; C599-I746 HydrophobicContact CB-CG1 4.37Å; C599-I746 HydrophobicContact CB-CG2 4.05Å; D742-I746 WeakPolarHBondContact O-CD1 3.36Å; D742-I746 WeakPolarHBondContact O-CG1 3.43Å; D742-I746 PolarHBondContact O-N 2.85Å; R744-I746 PolarHBondContact O-N 3.33Å; I746-Q750 PolarHBondContact O-N 3.17Å; I746-C751 HydrophobicContact CG2-CB 4.22Å; I746-C751 PolarHBondContact O-N 3.27Å; I746-L753 HydrophobicContact CG2-CD1 4.44Å; I746-F768 HydrophobicContact CB-CD2 4.44Å; I746-F768 HydrophobicContact CD1-CD2 4.43Å; I746-F768 HydrophobicContact CD1-CE2 4.17Å; I746-F768 HydrophobicContact CG2-CD2 4.21Å
747	T	89	Confident	89.5	Confident	81 Å²	81	31.9 Å²	31.9	50%	0.497	16%	0.156	S	C	.	.	H	α-helix	trans	-70.2	-42.9	-178.1	-54.4	0	0	0	0	112	A743 R744 L745 Q750	A743-T747 WeakPolarHBondContact O-CB 3.39Å; A743-T747 PolarHBondContact O-N 2.97Å; A743-T747 VanDerWaalsContact O-N 3.11Å; A743-T747 PolarHBondContact O-OG1 3.14Å; R744-T747 PolarHBondContact O-N 3.27Å; L745-T747 VanDerWaalsContact C-N 3.32Å; L745-T747 PolarHBondContact O-N 3.5Å; T747-Q750 PolarHBondContact O-N 2.93Å
748	E	89.3	Confident	89	Confident	74 Å²	74	39.3 Å²	39.3	35%	0.346	20%	0.196	S	C	.	.	H	α-helix	trans	-74.5	-25.1	-178.8	-72.5	-172.6	160.7	0	0	113.8	N730 R744 L745 Q750	N730-E748 PolarHBondContact ND2-O 2.95Å; R744-E748 HydrophobicContact CG-CG 4.05Å; R744-E748 IonicContact CZ-OE1 2.67Å; R744-E748 IonicContact CZ-OE2 2.75Å; R744-E748 VanDerWaalsContact CZ-OE2 3.32Å; R744-E748 IonicContact NE-OE1 2.68Å; R744-E748 PolarHBondContact NE-OE1 2.74Å; R744-E748 IonicContact NE-OE2 3.8Å; R744-E748 PolarHBondContact NE-OE2 3.02Å; R744-E748 IonicContact NH2-OE1 2.77Å; R744-E748 PolarHBondContact NH2-OE1 3.43Å; R744-E748 IonicContact NH2-OE2 2.68Å; R744-E748 PolarHBondContact NH2-OE2 3.02Å; R744-E748 WeakPolarHBondContact O-CB 3.41Å; R744-E748 WeakPolarHBondContact O-CG 3.41Å; R744-E748 PolarHBondContact O-N 2.9Å; L745-E748 PolarHBondContact O-N 3.21Å; E748-Q750 VanDerWaalsContact C-N 3.3Å
749	T	88.9	Confident	88.7	Confident	2 Å²	2	40.2 Å²	40.2	1%	0.012	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90	7.4	173.1	64.5	0	0	0	0	113.7	I729 N730 L745 C751	I729-T749 HydrophobicContact CB-CG2 3.73Å; I729-T749 HydrophobicContact CD1-CG2 4.04Å; I729-T749 HydrophobicContact CG2-CG2 3.46Å; I729-T749 VanDerWaalsContact CG2-CG2 3.46Å; N730-T749 WeakPolarHBondContact OD1-CA 3.18Å; L745-T749 HydrophobicContact CD1-CG2 3.91Å; L745-T749 WeakPolarHBondContact O-CG2 3.27Å; L745-T749 PolarHBondContact O-N 3.2Å; L745-T749 PolarHBondContact O-OG1 2.9Å; T749-C751 PolarHBondContact O-N 3.34Å; T749-C751 VanDerWaalsContact O-N 3.16Å; T749-C751 PolarHBondContact OG1-SG 2.97Å
750	Q	88.7	Confident	88.5	Confident	170 Å²	170	42.2 Å²	42.2	79%	0.794	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.3	40.7	177.5	-57.7	-170.8	-45.1	0	0	113.3	I746 T747 E748	I746-Q750 PolarHBondContact O-N 3.17Å; T747-Q750 PolarHBondContact O-N 2.93Å; E748-Q750 VanDerWaalsContact C-N 3.3Å
751	C	88.9	Confident	88.6	Confident	12 Å²	12	42.6 Å²	42.6	8%	0.081	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-72.8	134.1	-178.2	-76.6	0	0	0	0	112	R597 C599 I746 T749	R597-C751 WeakPolarHBondContact O-CA 3.44Å; C599-C751 HydrophobicContact CB-CB 3.73Å; I746-C751 HydrophobicContact CG2-CB 4.22Å; I746-C751 PolarHBondContact O-N 3.27Å; T749-C751 PolarHBondContact O-N 3.34Å; T749-C751 VanDerWaalsContact O-N 3.16Å; T749-C751 PolarHBondContact OG1-SG 2.97Å
752	Q	91.8	Very high	88.9	Confident	97 Å²	97	45.2 Å²	45.2	45%	0.453	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	131.7	162.6	-63.5	174.9	-8.8	0	0	109.1	R597 C599	R597-Q752 PolarHBondContact O-N 2.94Å; C599-Q752 PolarHBondContact N-O 3.25Å
753	L	92.1	Very high	89.1	Confident	5 Å²	5	49.9 Å²	49.9	3%	0.026	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	132.4	178.1	-69.1	82.1	0	0	0	110.2	V601 I746 I764 Y771	V601-L753 HydrophobicContact CG1-CD2 4.29Å; V601-L753 HydrophobicContact CG2-CB 4.49Å; I746-L753 HydrophobicContact CG2-CD1 4.44Å; L753-I764 HydrophobicContact CB-CB 4.15Å; L753-I764 HydrophobicContact CB-CD1 3.76Å; L753-I764 HydrophobicContact CB-CG1 4.5Å; L753-I764 HydrophobicContact CD2-CD1 4.49Å; L753-I764 PolarHBondContact O-N 3.12Å; L753-Y771 HydrophobicContact CD2-CD1 3.88Å; L753-Y771 HydrophobicContact CD2-CG 3.92Å
754	W	93	Very high	89.2	Confident	36 Å²	36	50.3 Å²	50.3	14%	0.136	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	114.7	175.4	-75.2	71.4	0	0	0	109	F590 I598 C599 I600 V601 V761 N762 Q763	F590-W754 HydrophobicContact CD2-CD2 4.31Å; F590-W754 AromaticContact CD2-CE3 3.83Å; F590-W754 HydrophobicContact CD2-CE3 3.83Å; F590-W754 HydrophobicContact CD2-CH2 4.21Å; F590-W754 AromaticContact CD2-CZ3 3.77Å; F590-W754 HydrophobicContact CD2-CZ3 3.77Å; F590-W754 AromaticContact CE2-CD2 3.93Å; F590-W754 HydrophobicContact CE2-CD2 3.93Å; F590-W754 AromaticContact CE2-CE3 3.93Å; F590-W754 HydrophobicContact CE2-CE3 3.93Å; F590-W754 HydrophobicContact CE2-CG 4.43Å; F590-W754 HydrophobicContact CE2-CH2 4.5Å; F590-W754 HydrophobicContact CE2-CZ3 4.22Å; I598-W754 HydrophobicContact CG2-CB 4.35Å; I598-W754 HydrophobicContact CG2-CG 4.07Å; C599-W754 PolarHBondContact O-N 3.22Å; I600-W754 CarbonylContact C-O 3.51Å; I600-W754 WeakPolarHBondContact CA-O 3.34Å; V601-W754 PolarHBondContact N-O 3.18Å; W754-V761 HydrophobicContact CB-CG1 4.3Å; W754-V761 HydrophobicContact CE3-CG1 4.07Å; W754-N762 CarbonylContact C-O 3.59Å; W754-N762 VanDerWaalsContact CA-O 3.25Å; W754-N762 WeakPolarHBondContact CA-O 3.39Å; W754-Q763 HydrophobicContact CD2-CB 3.96Å; W754-Q763 HydrophobicContact CD2-CG 4.4Å; W754-Q763 HydrophobicContact CE3-CB 4.1Å; W754-Q763 HydrophobicContact CH2-CB 4.13Å; W754-Q763 HydrophobicContact CZ2-CB 3.96Å; W754-Q763 HydrophobicContact CZ2-CG 4.22Å; W754-Q763 HydrophobicContact CZ3-CB 4.19Å
755	V	91.9	Very high	89.1	Confident	11 Å²	11	57 Å²	57	7%	0.067	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	137.2	-178.2	62.1	0	0	0	0	111.2	V601 E757 V761 N762 I764	V601-V755 HydrophobicContact CG2-CB 3.99Å; V601-V755 HydrophobicContact CG2-CG2 4.44Å; V755-E757 HydrophobicContact CG1-CG 4.15Å; V755-E757 HydrophobicContact CG2-CB 4.36Å; V755-E757 HydrophobicContact CG2-CG 4.39Å; V755-V761 CarbonylContact O-C 3.55Å; V755-V761 WeakPolarHBondContact O-CA 3.25Å; V755-N762 HydrophobicContact CG1-CB 3.96Å; V755-N762 PolarHBondContact N-O 2.85Å; V755-N762 PolarHBondContact O-N 3.03Å; V755-I764 HydrophobicContact CB-CD1 3.95Å; V755-I764 HydrophobicContact CB-CG1 4.39Å; V755-I764 HydrophobicContact CG1-CD1 4.22Å; V755-I764 HydrophobicContact CG1-CG1 4.11Å
756	V	90.7	Very high	88.8	Confident	1 Å²	1	58.7 Å²	58.7	1%	0.006	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	111.6	170	-176.4	0	0	0	0	109.2	F585 I600 V601 V606 K608 L611 V761	F585-V756 HydrophobicContact CE1-CG1 3.72Å; F585-V756 HydrophobicContact CZ-CG1 4.25Å; I600-V756 HydrophobicContact CG2-CG2 3.77Å; V601-V756 PolarHBondContact O-N 2.96Å; V601-V756 VanDerWaalsContact O-N 3.09Å; V606-V756 HydrophobicContact CG1-CB 3.8Å; V606-V756 HydrophobicContact CG1-CG1 3.78Å; V606-V756 HydrophobicContact CG2-CG1 4.09Å; V606-V756 WeakPolarHBondContact CG2-O 3.23Å; K608-V756 HydrophobicContact CG-CG2 4.49Å; L611-V756 HydrophobicContact CD2-CG2 4.14Å; V756-V761 HydrophobicContact CG2-CG1 4.18Å; V756-V761 HydrophobicContact CG2-CG2 4.35Å
757	E	85.6	Confident	88.6	Confident	78 Å²	78	62.9 Å²	62.9	36%	0.364	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	158.7	-175.3	63.4	-175.8	179.4	0	0	110.9	V755 C759 T760 N762	V755-E757 HydrophobicContact CG1-CG 4.15Å; V755-E757 HydrophobicContact CG2-CB 4.36Å; V755-E757 HydrophobicContact CG2-CG 4.39Å; E757-C759 PolarHBondContact O-N 2.91Å; E757-T760 PolarHBondContact N-O 2.83Å; E757-T760 CarbonylContact O-C 3.53Å; E757-T760 PolarHBondContact O-N 3.16Å; E757-T760 VanDerWaalsContact O-O 3.14Å; E757-T760 PolarHBondContact O-OG1 3.49Å; E757-N762 PolarHBondContact OE1-ND2 3.44Å
758	D	83.8	Confident	88.5	Confident	158 Å²	158	59.8 Å²	59.8	85%	0.845	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.8	27.3	176.2	-78	-11	0	0	0	117.5	T760	D758-T760 VanDerWaalsContact C-N 3.3Å
759	C	86.8	Confident	88.3	Confident	20 Å²	20	60.1 Å²	60.1	14%	0.135	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.3	21.1	-174.2	-53.5	0	0	0	0	115.1	P583 L584 F585 K586 E757	P583-C759 PolarHBondContact O-SG 3.24Å; L584-C759 WeakPolarHBondContact O-CA 3.43Å; L584-C759 WeakPolarHBondContact O-CB 3.3Å; F585-C759 CarbonylContact C-O 3.42Å; F585-C759 WeakPolarHBondContact CA-O 3.42Å; K586-C759 HydrophobicContact CG-CB 4.25Å; K586-C759 PolarHBondContact N-O 3.47Å; E757-C759 PolarHBondContact O-N 2.91Å
760	T	88.4	Confident	88.2	Confident	46 Å²	46	63 Å²	63	28%	0.282	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	-178.7	176.4	47.9	0	0	0	0	111.1	E757 D758	E757-T760 PolarHBondContact N-O 2.83Å; E757-T760 CarbonylContact O-C 3.53Å; E757-T760 PolarHBondContact O-N 3.16Å; E757-T760 VanDerWaalsContact O-O 3.14Å; E757-T760 PolarHBondContact O-OG1 3.49Å; D758-T760 VanDerWaalsContact C-N 3.3Å
761	V	91.3	Very high	88.2	Confident	13 Å²	13	55.2 Å²	55.2	8%	0.079	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	112.5	173.2	-165.8	0	0	0	0	107.5	F585 V588 L611 W754 V755 V756	F585-V761 HydrophobicContact CD1-CG2 4.34Å; F585-V761 HydrophobicContact CE1-CG2 4.07Å; V588-V761 HydrophobicContact CG1-CB 4.47Å; V588-V761 HydrophobicContact CG1-CG2 3.85Å; V588-V761 HydrophobicContact CG2-CG2 4.42Å; L611-V761 HydrophobicContact CD1-CG2 4.31Å; L611-V761 HydrophobicContact CD2-CG1 4.13Å; L611-V761 HydrophobicContact CD2-CG2 3.76Å; W754-V761 HydrophobicContact CB-CG1 4.3Å; W754-V761 HydrophobicContact CE3-CG1 4.07Å; V755-V761 CarbonylContact O-C 3.55Å; V755-V761 WeakPolarHBondContact O-CA 3.25Å; V756-V761 HydrophobicContact CG2-CG1 4.18Å; V756-V761 HydrophobicContact CG2-CG2 4.35Å
762	N	90.6	Very high	88.1	Confident	64 Å²	64	56.3 Å²	56.3	34%	0.342	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	139.9	-171.9	-61.3	-25.2	0	0	0	110	W754 V755 E757	W754-N762 CarbonylContact C-O 3.59Å; W754-N762 VanDerWaalsContact CA-O 3.25Å; W754-N762 WeakPolarHBondContact CA-O 3.39Å; V755-N762 HydrophobicContact CG1-CB 3.96Å; V755-N762 PolarHBondContact N-O 2.85Å; V755-N762 PolarHBondContact O-N 3.03Å; E757-N762 PolarHBondContact OE1-ND2 3.44Å
763	Q	90.8	Very high	87.9	Confident	100 Å²	100	56.8 Å²	56.8	47%	0.467	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	136.1	170.8	-175.8	176.4	-10.9	0	0	109.8	W754	W754-Q763 HydrophobicContact CD2-CB 3.96Å; W754-Q763 HydrophobicContact CD2-CG 4.4Å; W754-Q763 HydrophobicContact CE3-CB 4.1Å; W754-Q763 HydrophobicContact CH2-CB 4.13Å; W754-Q763 HydrophobicContact CZ2-CB 3.96Å; W754-Q763 HydrophobicContact CZ2-CG 4.22Å; W754-Q763 HydrophobicContact CZ3-CB 4.19Å
764	I	88.5	Confident	87.8	Confident	23 Å²	23	61.3 Å²	61.3	12%	0.118	31%	0.312	C	S	.	.			trans	-88.2	126.8	173.9	-67.8	157.1	0	0	0	109.4	V601 L753 V755 G766 Y771	V601-I764 HydrophobicContact CG2-CD1 3.91Å; L753-I764 HydrophobicContact CB-CB 4.15Å; L753-I764 HydrophobicContact CB-CD1 3.76Å; L753-I764 HydrophobicContact CB-CG1 4.5Å; L753-I764 HydrophobicContact CD2-CD1 4.49Å; L753-I764 PolarHBondContact O-N 3.12Å; V755-I764 HydrophobicContact CB-CD1 3.95Å; V755-I764 HydrophobicContact CB-CG1 4.39Å; V755-I764 HydrophobicContact CG1-CD1 4.22Å; V755-I764 HydrophobicContact CG1-CG1 4.11Å; I764-G766 PolarHBondContact O-N 3.08Å; I764-Y771 HydrophobicContact CD1-CD2 3.45Å; I764-Y771 VanDerWaalsContact CD1-CD2 3.45Å; I764-Y771 HydrophobicContact CD1-CE2 3.75Å; I764-Y771 HydrophobicContact CD1-CG 4.13Å
765	E	82.8	Confident	87.5	Confident	201 Å²	201	60.1 Å²	60.1	94%	0.939	31%	0.308	S	S	*	.	S	Bend	trans	-85.1	73.9	171.9	-67.1	-169	172.7	0	0	110.7
766	G	83.2	Confident	87.3	Confident	37 Å²	37	59.8 Å²	59.8	38%	0.381	31%	0.306	S	S	.	.	S	Bend	trans	-178.4	-176.2	-179.6	0	0	0	0	0	113.3	I764	I764-G766 PolarHBondContact O-N 3.08Å
767	D	85.3	Confident	87.2	Confident	92 Å²	92	66.2 Å²	66.2	49%	0.492	34%	0.336	S	S	.	.			trans	-97.3	-172.2	169.5	77.9	20.3	0	0	0	112.5	D769 D770 Y771	D767-D769 WeakPolarHBondContact OD1-CA 3.42Å; D767-D769 PolarHBondContact OD1-N 3.37Å; D767-D770 PolarHBondContact OD1-N 3.29Å; D767-Y771 PolarHBondContact O-N 3.26Å
768	F	85.4	Confident	87.3	Confident	16 Å²	16	66.7 Å²	66.7	7%	0.07	35%	0.353	C	S	.	.	H	α-helix	trans	-65.3	-38.2	179.2	-178	-85	0	0	0	113.5	L427 I431 A743 I746 Y771 K772	L427-F768 HydrophobicContact CD1-CE2 3.71Å; L427-F768 HydrophobicContact CD1-CZ 3.84Å; L427-F768 HydrophobicContact CD2-CE2 3.88Å; L427-F768 HydrophobicContact CG-CE2 4.28Å; I431-F768 HydrophobicContact CD1-CZ 4.32Å; I431-F768 HydrophobicContact CG1-CZ 4.46Å; A743-F768 HydrophobicContact CB-CD1 4.2Å; A743-F768 HydrophobicContact CB-CD2 4.49Å; A743-F768 HydrophobicContact CB-CE1 3.47Å; A743-F768 VanDerWaalsContact CB-CE1 3.47Å; A743-F768 HydrophobicContact CB-CE2 3.77Å; A743-F768 HydrophobicContact CB-CZ 3.22Å; I746-F768 HydrophobicContact CB-CD2 4.44Å; I746-F768 HydrophobicContact CD1-CD2 4.43Å; I746-F768 HydrophobicContact CD1-CE2 4.17Å; I746-F768 HydrophobicContact CG2-CD2 4.21Å; F768-Y771 PolarHBondContact O-N 3.49Å; F768-K772 HydrophobicContact CE1-CB 4.36Å; F768-K772 HydrophobicContact CE1-CD 4.24Å; F768-K772 VanDerWaalsContact O-CB 3.29Å; F768-K772 WeakPolarHBondContact O-CB 3.26Å; F768-K772 PolarHBondContact O-N 3.28Å
769	D	85.6	Confident	87.3	Confident	80 Å²	80	62.3 Å²	62.3	43%	0.428	33%	0.329	S	S	.	.	H	α-helix	trans	-78.7	-22.6	-177.7	-87.9	-35	0	0	0	112	D767 K772 R773	D767-D769 WeakPolarHBondContact OD1-CA 3.42Å; D767-D769 PolarHBondContact OD1-N 3.37Å; D769-K772 WeakPolarHBondContact OD1-CD 3.4Å; D769-K772 IonicContact OD1-NZ 2.67Å; D769-R773 PolarHBondContact O-N 3.48Å; D769-R773 VanDerWaalsContact O-N 3.17Å
770	D	87.6	Confident	87.2	Confident	64 Å²	64	64.6 Å²	64.6	34%	0.342	36%	0.357	S	S	.	.	H	α-helix	trans	-68.3	-50	165.1	-74.9	-39.7	0	0	0	111.6	D767 K772 R773 E774	D767-D770 PolarHBondContact OD1-N 3.29Å; D770-K772 VanDerWaalsContact C-N 3.28Å; D770-K772 PolarHBondContact O-N 2.89Å; D770-R773 WeakPolarHBondContact O-CA 2.95Å; D770-R773 WeakPolarHBondContact O-CB 3.4Å; D770-R773 PolarHBondContact O-N 3.46Å; D770-R773 IonicContact OD1-CZ 2.72Å; D770-R773 IonicContact OD1-NH1 2.87Å; D770-R773 PolarHBondContact OD1-NH1 3.46Å; D770-R773 IonicContact OD1-NH2 2.73Å; D770-R773 PolarHBondContact OD1-NH2 2.69Å; D770-E774 PolarHBondContact O-N 2.83Å
771	Y	87.9	Confident	87	Confident	6 Å²	6	63.2 Å²	63.2	2%	0.024	35%	0.347	C	S	.	.	H	α-helix	trans	-60.4	-37.1	174.3	-179.9	-110.6	0	0	0	112.2	L427 N428 I431 V601 L753 I764 D767 F768 R773 E774 V775	L427-Y771 HydrophobicContact CD2-CD1 4.23Å; L427-Y771 HydrophobicContact CD2-CE1 3.87Å; L427-Y771 HydrophobicContact CG-CE1 4.42Å; N428-Y771 PolarHBondContact ND2-OH 3.04Å; N428-Y771 VanDerWaalsContact ND2-OH 3.12Å; N428-Y771 PolarHBondContact OD1-OH 2.99Å; I431-Y771 HydrophobicContact CD1-CD1 4.45Å; I431-Y771 HydrophobicContact CD1-CE1 4.46Å; V601-Y771 HydrophobicContact CB-CE1 4.23Å; V601-Y771 HydrophobicContact CG2-CE1 4.11Å; V601-Y771 HydrophobicContact CG2-CE2 4.17Å; L753-Y771 HydrophobicContact CD2-CD1 3.88Å; L753-Y771 HydrophobicContact CD2-CG 3.92Å; I764-Y771 HydrophobicContact CD1-CD2 3.45Å; I764-Y771 VanDerWaalsContact CD1-CD2 3.45Å; I764-Y771 HydrophobicContact CD1-CE2 3.75Å; I764-Y771 HydrophobicContact CD1-CG 4.13Å; D767-Y771 PolarHBondContact O-N 3.26Å; F768-Y771 PolarHBondContact O-N 3.49Å; Y771-R773 VanDerWaalsContact C-N 3.27Å; Y771-R773 PolarHBondContact O-N 3.22Å; Y771-E774 PolarHBondContact O-N 3.11Å; Y771-V775 HydrophobicContact CD1-CG2 4.28Å; Y771-V775 HydrophobicContact CD2-CG2 4.33Å; Y771-V775 HydrophobicContact CE1-CG2 3.85Å; Y771-V775 HydrophobicContact CE2-CG2 3.93Å; Y771-V775 WeakPolarHBondContact O-CG2 3.29Å; Y771-V775 PolarHBondContact O-N 3.3Å
772	K	87.1	Confident	86.6	Confident	34 Å²	34	68.1 Å²	68.1	15%	0.148	38%	0.377	C	S	.	.	H	α-helix	trans	-59.9	-35.8	173.1	-174.1	-175.9	-173.1	172.1	0	112.5	I431 D456 F768 D769 D770 L776 M783	I431-K772 HydrophobicContact CD1-CB 4.43Å; I431-K772 HydrophobicContact CD1-CG 4.47Å; I431-K772 HydrophobicContact CG1-CG 4.23Å; I431-K772 HydrophobicContact CG2-CG 3.81Å; D456-K772 IonicContact OD2-NZ 3.32Å; F768-K772 HydrophobicContact CE1-CB 4.36Å; F768-K772 HydrophobicContact CE1-CD 4.24Å; F768-K772 VanDerWaalsContact O-CB 3.29Å; F768-K772 WeakPolarHBondContact O-CB 3.26Å; F768-K772 PolarHBondContact O-N 3.28Å; D769-K772 WeakPolarHBondContact OD1-CD 3.4Å; D769-K772 IonicContact OD1-NZ 2.67Å; D770-K772 VanDerWaalsContact C-N 3.28Å; D770-K772 PolarHBondContact O-N 2.89Å; K772-L776 WeakPolarHBondContact O-CG 3.41Å; K772-L776 PolarHBondContact O-N 3.17Å; K772-M783 HydrophobicContact CD-CE 4.01Å; K772-M783 HydrophobicContact CG-CE 4.38Å
773	R	88.4	Confident	85.9	Confident	107 Å²	107	68.5 Å²	68.5	40%	0.404	38%	0.378	S	S	.	.	H	α-helix	trans	-71.6	-48.9	176.2	-165.7	-173.1	-49	120.6	23.7	110.8	D769 D770 Y771 V775 L776 E777	D769-R773 PolarHBondContact O-N 3.48Å; D769-R773 VanDerWaalsContact O-N 3.17Å; D770-R773 WeakPolarHBondContact O-CA 2.95Å; D770-R773 WeakPolarHBondContact O-CB 3.4Å; D770-R773 PolarHBondContact O-N 3.46Å; D770-R773 IonicContact OD1-CZ 2.72Å; D770-R773 IonicContact OD1-NH1 2.87Å; D770-R773 PolarHBondContact OD1-NH1 3.46Å; D770-R773 IonicContact OD1-NH2 2.73Å; D770-R773 PolarHBondContact OD1-NH2 2.69Å; Y771-R773 VanDerWaalsContact C-N 3.27Å; Y771-R773 PolarHBondContact O-N 3.22Å; R773-V775 VanDerWaalsContact C-N 3.33Å; R773-V775 PolarHBondContact O-N 3.2Å; R773-L776 PolarHBondContact O-N 2.72Å; R773-L776 VanDerWaalsContact O-N 3.07Å; R773-E777 WeakPolarHBondContact CD-OE1 3.24Å; R773-E777 HydrophobicContact CG-CG 4.37Å; R773-E777 VanDerWaalsContact CG-OE1 3.31Å; R773-E777 WeakPolarHBondContact CG-OE1 3.19Å; R773-E777 WeakPolarHBondContact O-CG 3.46Å; R773-E777 PolarHBondContact O-N 2.99Å
774	E	89	Confident	85.2	Confident	101 Å²	101	66.4 Å²	66.4	47%	0.472	37%	0.372	S	S	.	.	H	α-helix	trans	-52.4	-49	176.8	-171.6	-167.6	162.9	0	0	111.8	D770 Y771 L776 E777 A778	D770-E774 PolarHBondContact O-N 2.83Å; Y771-E774 PolarHBondContact O-N 3.11Å; E774-L776 VanDerWaalsContact C-N 3.33Å; E774-L776 PolarHBondContact O-N 2.98Å; E774-E777 PolarHBondContact O-N 3.15Å; E774-A778 VanDerWaalsContact O-CB 3.29Å; E774-A778 WeakPolarHBondContact O-CB 3.44Å; E774-A778 PolarHBondContact O-N 3.49Å
775	V	87.6	Confident	83.8	Confident	11 Å²	11	71.7 Å²	71.7	7%	0.067	40%	0.4	C	S	.	.	H	α-helix	trans	-61.2	-37.5	177.9	169.5	0	0	0	0	112.7	N428 I431 Y771 R773 L779	N428-V775 HydrophobicContact CB-CG1 3.99Å; I431-V775 HydrophobicContact CB-CG1 4.48Å; I431-V775 HydrophobicContact CG2-CG1 4.12Å; Y771-V775 HydrophobicContact CD1-CG2 4.28Å; Y771-V775 HydrophobicContact CD2-CG2 4.33Å; Y771-V775 HydrophobicContact CE1-CG2 3.85Å; Y771-V775 HydrophobicContact CE2-CG2 3.93Å; Y771-V775 WeakPolarHBondContact O-CG2 3.29Å; Y771-V775 PolarHBondContact O-N 3.3Å; R773-V775 VanDerWaalsContact C-N 3.33Å; R773-V775 PolarHBondContact O-N 3.2Å; V775-L779 HydrophobicContact CG1-CD1 4.37Å; V775-L779 WeakPolarHBondContact O-CD1 3.38Å; V775-L779 WeakPolarHBondContact O-CG 3.42Å; V775-L779 PolarHBondContact O-N 3.18Å
776	L	87.4	Confident	82.3	Confident	4 Å²	4	68 Å²	68	2%	0.021	38%	0.381	C	S	.	.	H	α-helix	trans	-76	-40	178.5	-70.2	172.1	0	0	0	111.9	I431 N435 K772 R773 E774 L779 G780 E781 M783	I431-L776 HydrophobicContact CG2-CD1 4.32Å; I431-L776 HydrophobicContact CG2-CD2 4.06Å; I431-L776 HydrophobicContact CG2-CG 3.91Å; N435-L776 HydrophobicContact CB-CD2 4.05Å; K772-L776 WeakPolarHBondContact O-CG 3.41Å; K772-L776 PolarHBondContact O-N 3.17Å; R773-L776 PolarHBondContact O-N 2.72Å; R773-L776 VanDerWaalsContact O-N 3.07Å; E774-L776 VanDerWaalsContact C-N 3.33Å; E774-L776 PolarHBondContact O-N 2.98Å; L776-L779 PolarHBondContact O-N 3.29Å; L776-G780 PolarHBondContact O-N 2.93Å; L776-G780 VanDerWaalsContact O-N 3.16Å; L776-E781 HydrophobicContact CB-CB 4.5Å; L776-E781 HydrophobicContact CD2-CB 4.07Å; L776-E781 PolarHBondContact O-N 3.06Å; L776-M783 HydrophobicContact CD1-CB 4.12Å; L776-M783 HydrophobicContact CD1-CG 3.9Å
777	E	89.1	Confident	79.9	Confident	136 Å²	136	72.7 Å²	72.7	64%	0.636	40%	0.402	S	S	*	.	H	α-helix	trans	-64.3	-41.8	175.5	-72.2	-178.5	-168.4	0	0	111.5	R773 E774 L779 G780	R773-E777 WeakPolarHBondContact CD-OE1 3.24Å; R773-E777 HydrophobicContact CG-CG 4.37Å; R773-E777 VanDerWaalsContact CG-OE1 3.31Å; R773-E777 WeakPolarHBondContact CG-OE1 3.19Å; R773-E777 WeakPolarHBondContact O-CG 3.46Å; R773-E777 PolarHBondContact O-N 2.99Å; E774-E777 PolarHBondContact O-N 3.15Å; E777-L779 PolarHBondContact O-N 2.97Å; E777-G780 PolarHBondContact O-N 3.1Å
778	A	86.8	Confident	77.1	Confident	88 Å²	88	74.9 Å²	74.9	73%	0.727	41%	0.413	S	S	*	.	H	α-helix	trans	-63	-27	174.8	0	0	0	0	0	113.5	E774	E774-A778 VanDerWaalsContact O-CB 3.29Å; E774-A778 WeakPolarHBondContact O-CB 3.44Å; E774-A778 PolarHBondContact O-N 3.49Å
779	L	84.2	Confident	74.8	Confident	65 Å²	65	83.4 Å²	83.4	34%	0.34	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-5.5	173.5	-70.9	171.3	0	0	0	113.5	W432 V775 L776 E777 E781	W432-L779 HydrophobicContact CB-CD1 4.14Å; W432-L779 HydrophobicContact CG-CD1 4.25Å; V775-L779 HydrophobicContact CG1-CD1 4.37Å; V775-L779 WeakPolarHBondContact O-CD1 3.38Å; V775-L779 WeakPolarHBondContact O-CG 3.42Å; V775-L779 PolarHBondContact O-N 3.18Å; L776-L779 PolarHBondContact O-N 3.29Å; E777-L779 PolarHBondContact O-N 2.97Å; L779-E781 VanDerWaalsContact C-N 3.25Å; L779-E781 HydrophobicContact CB-CB 4.4Å; L779-E781 HydrophobicContact CB-CG 3.91Å; L779-E781 PolarHBondContact O-N 3.49Å
780	G	84.4	Confident	74.2	Confident	69 Å²	69	83.6 Å²	83.6	71%	0.711	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.4	24.1	-173.6	0	0	0	0	0	113.7	L776 E777	L776-G780 PolarHBondContact O-N 2.93Å; L776-G780 VanDerWaalsContact O-N 3.16Å; E777-G780 PolarHBondContact O-N 3.1Å
781	E	84.3	Confident	73.5	Confident	17 Å²	17	84.6 Å²	84.6	8%	0.079	48%	0.479	C	S	.	.	P	Polyproline II helix	trans	-96.6	126.8	-174.4	-74.5	-77.3	-172.8	0	0	111.2	R376 W432 L776 L779 M783	R376-E781 IonicContact CZ-OE1 3.97Å; R376-E781 IonicContact CZ-OE2 2.78Å; R376-E781 IonicContact NE-OE1 3.86Å; R376-E781 PolarHBondContact NE-OE1 3.11Å; R376-E781 IonicContact NE-OE2 3.57Å; R376-E781 VanDerWaalsContact NH2-CD 3.34Å; R376-E781 IonicContact NH2-OE1 2.63Å; R376-E781 PolarHBondContact NH2-OE1 2.91Å; R376-E781 IonicContact NH2-OE2 3.18Å; R376-E781 PolarHBondContact NH2-OE2 2.99Å; W432-E781 PolarHBondContact NE1-OE1 2.94Å; L776-E781 HydrophobicContact CB-CB 4.5Å; L776-E781 HydrophobicContact CD2-CB 4.07Å; L776-E781 PolarHBondContact O-N 3.06Å; L779-E781 VanDerWaalsContact C-N 3.25Å; L779-E781 HydrophobicContact CB-CB 4.4Å; L779-E781 HydrophobicContact CB-CG 3.91Å; L779-E781 PolarHBondContact O-N 3.49Å; E781-M783 PolarHBondContact O-N 2.99Å
782	T	82.8	Confident	72.7	Confident	115 Å²	115	88.9 Å²	88.9	71%	0.706	51%	0.505	S	S	*	.	P	Polyproline II helix	trans	-70.8	120.8	174.3	53.9	0	0	0	0	110.1	N435 V784	N435-T782 PolarHBondContact ND2-O 3.48Å; T782-V784 PolarHBondContact O-N 3.24Å
783	M	76.1	Confident	71.9	Confident	73 Å²	73	92.2 Å²	92.2	36%	0.36	53%	0.526	S	S	.	.	P	Polyproline II helix	trans	-60.9	125.1	173	-166.3	178.9	-160.7	0	0	110.3	K772 L776 E781 N785	K772-M783 HydrophobicContact CD-CE 4.01Å; K772-M783 HydrophobicContact CG-CE 4.38Å; L776-M783 HydrophobicContact CD1-CB 4.12Å; L776-M783 HydrophobicContact CD1-CG 3.9Å; E781-M783 PolarHBondContact O-N 2.99Å; M783-N785 PolarHBondContact O-N 3.25Å
784	V	76.4	Confident	70.8	Confident	56 Å²	56	91.3 Å²	91.3	34%	0.339	53%	0.533	S	S	.	.			trans	-74.1	96.1	175.3	178.9	0	0	0	0	108.2	N435 Q438 T782 K786	N435-V784 WeakPolarHBondContact OD1-CG2 3.49Å; N435-V784 PolarHBondContact OD1-N 3.13Å; Q438-V784 HydrophobicContact CB-CG1 4.28Å; T782-V784 PolarHBondContact O-N 3.24Å; V784-K786 PolarHBondContact O-N 3.5Å
785	N	58.7	Low	69.6	Low	133 Å²	133	90.6 Å²	90.6	71%	0.711	54%	0.537	S	S	*	.			trans	-57.4	128.1	173.7	-80.2	-33.1	0	0	0	110.3	M783 V787	M783-N785 PolarHBondContact O-N 3.25Å; N785-V787 PolarHBondContact O-N 3.5Å
786	K	51.7	Low	68.4	Low	123 Å²	123	96.3 Å²	96.3	54%	0.535	57%	0.571	S	S	.	*			trans	-61.8	101.9	173.8	-75.5	-171.6	175.9	-177.2	0	110.1	D456 V784 N788	D456-K786 WeakPolarHBondContact OD1-CE 3.28Å; D456-K786 IonicContact OD1-NZ 3.28Å; D456-K786 PolarHBondContact OD1-NZ 3.39Å; V784-K786 PolarHBondContact O-N 3.5Å; K786-N788 VanDerWaalsContact C-N 3.29Å; K786-N788 PolarHBondContact O-N 3.08Å
787	V	32.6	Very low	66.9	Low	136 Å²	136	103.4 Å²	103.4	82%	0.824	61%	0.613	S	S	*	*			trans	-68.2	93.3	161.8	-177	0	0	0	0	106.7	N785 P789	N785-V787 PolarHBondContact O-N 3.5Å; V787-P789 WeakPolarHBondContact O-CD 3.42Å
788	N	27	Very low	65	Low	138 Å²	138	100.7 Å²	100.7	74%	0.738	61%	0.611	S	S	*	*			trans	-58.3	126.6	168.8	-79.8	-27.7	0	0	0	109	K786	K786-N788 VanDerWaalsContact C-N 3.29Å; K786-N788 PolarHBondContact O-N 3.08Å
789	P	35.6	Very low	63.1	Low	195 Å²	195	101.8 Å²	101.8	100%	1.266	60%	0.601	S	S	*	*			trans	-77	0	174.6	33.4	-35.8	0	0	0	112.9	V787	V787-P789 WeakPolarHBondContact O-CD 3.42Å

Retrieved 789 of 789 residues in 3090 ms (Link to these results)

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