A0A087XL27_POEFO Loading...

Serine/threonine-protein kinase DCLK2

AlphaFold DB , UniProt , Accession A0A087XL27, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 753 aa.

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(Predicted Aligned Error values between residue pairs)

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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	V	33.7	Very low	29	Very low	185 Å²	185	158.3 Å²	158.3	100%	1.121	82%	0.819	S	S	*	*				0	90.8	0	-161.5	0	0	0	0	105.6
2	S	29.4	Very low	28.9	Very low	96 Å²	96	159.5 Å²	159.5	67%	0.671	81%	0.814	S	S	*	*			cis	72.7	126.1	44.2	-40.2	0	0	0	0	111.3
3	F	29.8	Very low	28.9	Very low	187 Å²	187	155.5 Å²	155.5	82%	0.82	80%	0.795	S	S	*	*			cis	-128.1	158.4	-4.2	-80.7	-104.1	0	0	0	108
4	R	29.4	Very low	28.9	Very low	212 Å²	212	154.6 Å²	154.6	80%	0.8	79%	0.786	S	S	*	*			cis	99.4	98.5	23.4	-166	-170.4	-168	-168	5	115.2	V6	R4-V6 HydrophobicContact CG-CG2 4.41Å
5	S	29.9	Very low	28.9	Very low	114 Å²	114	157.5 Å²	157.5	80%	0.797	78%	0.784	S	S	*	*			trans	-162.6	147.3	160.6	-102.7	0	0	0	0	107.8
6	V	30.9	Very low	29.2	Very low	101 Å²	101	154.6 Å²	154.6	61%	0.612	77%	0.772	S	S	*	*			cis	58.3	140.2	-8.6	-84.9	0	0	0	0	118.6	R4	R4-V6 HydrophobicContact CG-CG2 4.41Å
7	M	28.7	Very low	29.4	Very low	164 Å²	164	155.4 Å²	155.4	81%	0.808	77%	0.769	S	S	*	*			cis	-119.4	-175.4	11.4	-61.2	-180	166.9	0	0	110.7
8	D	24.8	Very low	29.4	Very low	153 Å²	153	152.3 Å²	152.3	82%	0.818	77%	0.765	S	S	*	*			cis	-139.2	164.6	24.5	-79.5	-62.7	0	0	0	115
9	L	27.7	Very low	29.6	Very low	163 Å²	163	151.4 Å²	151.4	85%	0.853	76%	0.758	S	S	*	*			trans	-149.2	108.1	-179.2	-174.2	127.8	0	0	0	109.3
10	E	27.1	Very low	29.8	Very low	198 Å²	198	153.2 Å²	153.2	93%	0.925	76%	0.756	S	S	*	*			trans	-131.3	153.3	171.3	-74.3	-155.3	148.4	0	0	112.2
11	H	27.7	Very low	29.8	Very low	168 Å²	168	155.3 Å²	155.3	78%	0.778	76%	0.757	S	S	*	*			trans	-165.3	118.1	-163.3	167.6	45.5	0	0	0	107.6
12	F	27.6	Very low	29.8	Very low	173 Å²	173	151.9 Å²	151.9	76%	0.759	74%	0.736	S	S	*	*			trans	-175.2	165.4	152.7	-123.9	-117	0	0	0	113.5
13	D	29.6	Very low	29.9	Very low	107 Å²	107	158.2 Å²	158.2	57%	0.572	75%	0.745	S	S	*	*			trans	32	127.4	169.2	-68.2	-5.7	0	0	0	121.2
14	E	29.2	Very low	29.9	Very low	144 Å²	144	160.5 Å²	160.5	67%	0.673	75%	0.749	S	S	*	*			cis	84.6	137.3	43.7	-156.7	-159.3	-123.5	0	0	114.1
15	R	28.7	Very low	30	Very low	198 Å²	198	153.8 Å²	153.8	75%	0.747	75%	0.745	S	S	*	*			trans	96.2	145.7	163.4	-58.5	-175.6	-169.9	148.8	21.9	118.7
16	D	33.3	Very low	30.2	Very low	111 Å²	111	153.7 Å²	153.7	59%	0.594	75%	0.745	S	S	*	*			cis	-170	159.6	-25.9	-167	2	0	0	0	110.1
17	K	32.2	Very low	30.4	Very low	167 Å²	167	160.6 Å²	160.6	73%	0.726	76%	0.759	S	S	*	*			trans	63.5	157.2	167.4	-71.9	132	-175.1	152.3	0	116.9
18	S	29.6	Very low	30.4	Very low	100 Å²	100	156.3 Å²	156.3	70%	0.699	76%	0.757	S	S	*	*			cis	-139.1	130.5	4.4	48.1	0	0	0	0	110.2
19	Q	33.7	Very low	31	Very low	136 Å²	136	157.7 Å²	157.7	64%	0.636	77%	0.765	S	S	*	*				52.9	138.6	88.9	-78.6	-171.1	17	0	0	115.6
20	R	32.8	Very low	31.1	Very low	186 Å²	186	153.7 Å²	153.7	70%	0.702	76%	0.763	S	S	*	*			cis	-121.4	-150	-0.9	-61.8	87.4	-164.6	-153.4	4.3	108.5
21	Y	31.3	Very low	31.7	Very low	199 Å²	199	152.2 Å²	152.2	78%	0.78	76%	0.761	S	S	*	*			cis	-163.6	151.1	-3.1	-113.5	-29	0	0	0	104.4
22	T	32.2	Very low	32.2	Very low	112 Å²	112	149.8 Å²	149.8	69%	0.687	76%	0.76	S	S	*	*			cis	-154.1	177.5	-0	-19.3	0	0	0	0	105.3
23	R	31.9	Very low	32.9	Very low	229 Å²	229	146.7 Å²	146.7	86%	0.864	76%	0.76	S	S	*	*			cis	-152.3	-168.5	9.6	-152.1	164.2	-171.3	178.3	2.5	109.8
24	R	30.3	Very low	33.4	Very low	236 Å²	236	147.6 Å²	147.6	89%	0.891	77%	0.771	S	S	*	*			trans	-64.8	152	-178	-58.6	169.7	171.5	-169.1	-5	114.7
25	G	30.9	Very low	33.8	Very low	70 Å²	70	147 Å²	147	72%	0.722	78%	0.778	S	S	*	*			cis	123.6	151.5	-12.7	0	0	0	0	0	116.7
26	S	34.1	Very low	34.6	Very low	113 Å²	113	146.9 Å²	146.9	79%	0.79	79%	0.785	S	S	*	*			trans	72.4	149	174.2	-67.6	0	0	0	0	117.8
27	R	34.4	Very low	34.8	Very low	245 Å²	245	146.1 Å²	146.1	93%	0.925	79%	0.789	S	S	*	*			cis	-165.5	156.3	-11.9	-115.3	171.8	174.9	-175.5	-2.3	109.1
28	G	30.2	Very low	35.1	Very low	74 Å²	74	142.1 Å²	142.1	76%	0.763	79%	0.787	S	S	*	*			trans	155.6	110.4	161.4	0	0	0	0	0	115.5
29	N	36.7	Very low	35.6	Very low	182 Å²	182	143.4 Å²	143.4	97%	0.973	78%	0.782	S	S	*	*			trans	-94.8	146.8	165.6	-79.8	1.8	0	0	0	109.7
30	G	29.1	Very low	35.7	Very low	80 Å²	80	141.9 Å²	141.9	83%	0.825	79%	0.785	S	S	*	*			trans	163	91	170.7	0	0	0	0	0	114.6
31	L	40.8	Very low	36.2	Very low	166 Å²	166	136.3 Å²	136.3	87%	0.869	78%	0.775	S	S	*	*			trans	-72.7	155.7	158.7	-83.6	162.5	0	0	0	109
32	P	38.5	Very low	36.8	Very low	117 Å²	117	131.7 Å²	131.7	76%	0.76	76%	0.763	S	S	*	*			cis	-137.1	179.6	39.3	42	-24.9	0	0	0	116.8
33	S	42.4	Very low	37.2	Very low	109 Å²	109	134.9 Å²	134.9	76%	0.762	76%	0.763	S	S	*	*			trans	-72.2	143.8	172.5	-43.9	0	0	0	0	113.1
34	P	39.6	Very low	37.7	Very low	125 Å²	125	133 Å²	133	81%	0.812	76%	0.757	S	S	*	*			trans	-112.9	156.5	146.7	-4.6	25.4	0	0	0	112.9
35	T	37.9	Very low	38.5	Very low	131 Å²	131	125.1 Å²	125.1	80%	0.804	74%	0.735	S	S	*	*			trans	-79.3	158.1	-179.7	44.8	0	0	0	0	114.3
36	H	45.8	Very low	39.1	Very low	196 Å²	196	131.2 Å²	131.2	91%	0.907	74%	0.736	S	S	*	*			trans	30.9	112.2	152.1	-91.3	-105.5	0	0	0	119.3
37	S	36.8	Very low	39.7	Very low	95 Å²	95	129.1 Å²	129.1	66%	0.664	72%	0.718	S	S	*	*			trans	-141.4	141.4	152.7	178	0	0	0	0	110.3	H39	S37-H39 PolarHBondContact O-N 2.93Å
38	A	37.3	Very low	40.2	Very low	84 Å²	84	122.6 Å²	122.6	69%	0.694	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	16.2	-171.4	0	0	0	0	0	114.9	S41	A38-S41 PolarHBondContact O-OG 3.01Å
39	H	40.3	Very low	41	Very low	126 Å²	126	125.1 Å²	125.1	58%	0.583	69%	0.693	S	S	*	*	H	α-helix	trans	-90.6	-21	-170.9	-117.8	-89.6	0	0	0	115.1	S37 S41 L42 Y43	S37-H39 PolarHBondContact O-N 2.93Å; H39-S41 VanDerWaalsContact C-N 3.33Å; H39-S41 PolarHBondContact O-N 3.46Å; H39-L42 PolarHBondContact O-N 3.32Å; H39-Y43 PolarHBondContact O-N 3.46Å
40	C	37.4	Very low	41.3	Very low	105 Å²	105	119.1 Å²	119.1	71%	0.709	67%	0.669	S	S	*	*	H	α-helix	trans	-71.2	-25.6	-179.3	-65.8	0	0	0	0	113.6	R44	C40-R44 WeakPolarHBondContact O-CB 3.14Å; C40-R44 PolarHBondContact O-N 3.33Å
41	S	43.3	Very low	41.9	Very low	69 Å²	69	120.8 Å²	120.8	48%	0.483	66%	0.658	S	S	.	*	H	α-helix	trans	-65.1	-51.1	173.1	51.8	0	0	0	0	110.7	A38 H39 Y43 R44 T45	A38-S41 PolarHBondContact O-OG 3.01Å; H39-S41 VanDerWaalsContact C-N 3.33Å; H39-S41 PolarHBondContact O-N 3.46Å; S41-Y43 PolarHBondContact O-N 2.95Å; S41-R44 PolarHBondContact O-N 3.27Å; S41-R44 VanDerWaalsContact O-N 3.16Å; S41-T45 PolarHBondContact O-N 3.15Å; S41-T45 PolarHBondContact O-OG1 3.26Å
42	L	41.9	Very low	42.3	Very low	102 Å²	102	116 Å²	116	53%	0.534	64%	0.638	S	S	.	*	H	α-helix	trans	-61	-40.1	-178.9	-71.1	174	0	0	0	113	H39 R44 T45 R46	H39-L42 PolarHBondContact O-N 3.32Å; L42-R44 VanDerWaalsContact C-N 3.35Å; L42-T45 PolarHBondContact O-OG1 3.16Å; L42-R46 WeakPolarHBondContact O-CB 3.4Å; L42-R46 PolarHBondContact O-N 3.41Å
43	Y	41.1	Very low	42.7	Very low	178 Å²	178	117.1 Å²	117.1	70%	0.698	64%	0.637	S	S	*	*	H	α-helix	trans	-67	-39	176.8	-129.7	-87.2	0	0	0	111.7	H39 S41 T47	H39-Y43 PolarHBondContact O-N 3.46Å; S41-Y43 PolarHBondContact O-N 2.95Å; Y43-T47 HydrophobicContact CD1-CG2 4.49Å; Y43-T47 PolarHBondContact O-N 3.09Å; Y43-T47 VanDerWaalsContact O-N 3.09Å; Y43-T47 PolarHBondContact O-OG1 2.79Å
44	R	43.2	Very low	43	Very low	191 Å²	191	119.8 Å²	119.8	72%	0.721	64%	0.638	S	S	*	*	H	α-helix	trans	-72.2	-38.1	179.9	-160.3	175	-165.3	165.1	4	112.7	C40 S41 L42 T47 L48	C40-R44 WeakPolarHBondContact O-CB 3.14Å; C40-R44 PolarHBondContact O-N 3.33Å; S41-R44 PolarHBondContact O-N 3.27Å; S41-R44 VanDerWaalsContact O-N 3.16Å; L42-R44 VanDerWaalsContact C-N 3.35Å; R44-T47 PolarHBondContact O-OG1 3.37Å; R44-L48 WeakPolarHBondContact O-CB 3.38Å; R44-L48 WeakPolarHBondContact O-CD1 3.45Å; R44-L48 VanDerWaalsContact O-CG 3.29Å; R44-L48 WeakPolarHBondContact O-CG 3.31Å; R44-L48 PolarHBondContact O-N 3.17Å
45	T	46.8	Very low	43.9	Very low	70 Å²	70	119 Å²	119	43%	0.429	62%	0.622	S	S	.	*	H	α-helix	trans	-72.7	-36.8	174.1	54.2	0	0	0	0	111.8	S41 L42 L48 Q49	S41-T45 PolarHBondContact O-N 3.15Å; S41-T45 PolarHBondContact O-OG1 3.26Å; L42-T45 PolarHBondContact O-OG1 3.16Å; T45-L48 PolarHBondContact O-N 2.88Å; T45-Q49 WeakPolarHBondContact O-CB 3.5Å; T45-Q49 WeakPolarHBondContact O-CG 3.29Å; T45-Q49 PolarHBondContact O-N 3.45Å
46	R	42.8	Very low	44.9	Very low	198 Å²	198	120.5 Å²	120.5	75%	0.747	62%	0.617	S	S	*	*	H	α-helix	trans	-69.9	-37.5	179.4	-159.8	173.5	-165.6	174.6	4.1	112.7	L42 A50	L42-R46 WeakPolarHBondContact O-CB 3.4Å; L42-R46 PolarHBondContact O-N 3.41Å; R46-A50 WeakPolarHBondContact O-CB 3.37Å; R46-A50 PolarHBondContact O-N 3.01Å
47	T	47.6	Very low	46.1	Very low	69 Å²	69	113.2 Å²	113.2	42%	0.423	59%	0.591	S	S	.	*	H	α-helix	trans	-69.3	-39.4	170.6	54.4	0	0	0	0	112.4	Y43 R44 A50 L51	Y43-T47 HydrophobicContact CD1-CG2 4.49Å; Y43-T47 PolarHBondContact O-N 3.09Å; Y43-T47 VanDerWaalsContact O-N 3.09Å; Y43-T47 PolarHBondContact O-OG1 2.79Å; R44-T47 PolarHBondContact O-OG1 3.37Å; T47-A50 PolarHBondContact O-N 3.15Å; T47-L51 WeakPolarHBondContact O-CB 3.28Å; T47-L51 VanDerWaalsContact O-CG 3.31Å; T47-L51 WeakPolarHBondContact O-CG 3.43Å; T47-L51 PolarHBondContact O-N 2.86Å
48	L	45.6	Very low	48.1	Very low	108 Å²	108	111.8 Å²	111.8	57%	0.565	57%	0.573	S	S	*	*	H	α-helix	trans	-66.3	-37.4	175.2	-76.8	171.7	0	0	0	112.6	R44 T45 L51 S52	R44-L48 WeakPolarHBondContact O-CB 3.38Å; R44-L48 WeakPolarHBondContact O-CD1 3.45Å; R44-L48 VanDerWaalsContact O-CG 3.29Å; R44-L48 WeakPolarHBondContact O-CG 3.31Å; R44-L48 PolarHBondContact O-N 3.17Å; T45-L48 PolarHBondContact O-N 2.88Å; L48-L51 PolarHBondContact O-N 3.48Å; L48-S52 VanDerWaalsContact O-CB 3.3Å; L48-S52 WeakPolarHBondContact O-CB 3.33Å; L48-S52 PolarHBondContact O-N 2.98Å
49	Q	46.3	Very low	50.2	Low	126 Å²	126	114.2 Å²	114.2	59%	0.589	57%	0.567	S	S	*	*	H	α-helix	trans	-68.2	-42.4	175	-79.6	-179.1	-28.6	0	0	111.9	T45 L51 S52 L53	T45-Q49 WeakPolarHBondContact O-CB 3.5Å; T45-Q49 WeakPolarHBondContact O-CG 3.29Å; T45-Q49 PolarHBondContact O-N 3.45Å; Q49-L51 PolarHBondContact O-N 3.31Å; Q49-S52 WeakPolarHBondContact CA-OG 3.3Å; Q49-S52 PolarHBondContact O-N 2.74Å; Q49-S52 VanDerWaalsContact O-N 3.15Å; Q49-S52 PolarHBondContact O-OG 3.47Å; Q49-L53 PolarHBondContact O-N 2.64Å
50	A	42.7	Very low	52.4	Low	56 Å²	56	108.2 Å²	108.2	46%	0.463	54%	0.54	S	S	.	.	H	α-helix	trans	-57.5	-48	172.6	0	0	0	0	0	111.6	R46 T47 S52 L53	R46-A50 WeakPolarHBondContact O-CB 3.37Å; R46-A50 PolarHBondContact O-N 3.01Å; T47-A50 PolarHBondContact O-N 3.15Å; A50-S52 VanDerWaalsContact C-N 3.29Å; A50-S52 PolarHBondContact O-N 2.66Å; A50-L53 PolarHBondContact O-N 3.48Å
51	L	41.9	Very low	54.7	Low	116 Å²	116	107.4 Å²	107.4	61%	0.607	52%	0.522	S	S	*	.	H	α-helix	trans	-65.4	-29.2	176	-69.9	168.2	0	0	0	113.1	T47 L48 Q49 L53	T47-L51 WeakPolarHBondContact O-CB 3.28Å; T47-L51 VanDerWaalsContact O-CG 3.31Å; T47-L51 WeakPolarHBondContact O-CG 3.43Å; T47-L51 PolarHBondContact O-N 2.86Å; L48-L51 PolarHBondContact O-N 3.48Å; Q49-L51 PolarHBondContact O-N 3.31Å; L51-L53 VanDerWaalsContact C-N 3.31Å; L51-L53 PolarHBondContact O-N 3.26Å
52	S	49.5	Very low	56.8	Low	64 Å²	64	104.1 Å²	104.1	45%	0.448	50%	0.499	S	S	.	.	H	α-helix	trans	-74.2	-18.2	178.7	78.7	0	0	0	0	114.7	L48 Q49 A50	L48-S52 VanDerWaalsContact O-CB 3.3Å; L48-S52 WeakPolarHBondContact O-CB 3.33Å; L48-S52 PolarHBondContact O-N 2.98Å; Q49-S52 WeakPolarHBondContact CA-OG 3.3Å; Q49-S52 PolarHBondContact O-N 2.74Å; Q49-S52 VanDerWaalsContact O-N 3.15Å; Q49-S52 PolarHBondContact O-OG 3.47Å; A50-S52 VanDerWaalsContact C-N 3.29Å; A50-S52 PolarHBondContact O-N 2.66Å
53	L	46.5	Very low	58.9	Low	142 Å²	142	99.7 Å²	99.7	74%	0.743	48%	0.475	S	S	*	.	H	α-helix	trans	-87	-28.4	-177.6	-77.2	165.1	0	0	0	112.9	Q49 A50 L51	Q49-L53 PolarHBondContact O-N 2.64Å; A50-L53 PolarHBondContact O-N 3.48Å; L51-L53 VanDerWaalsContact C-N 3.31Å; L51-L53 PolarHBondContact O-N 3.26Å
54	E	49.4	Very low	61	Low	164 Å²	164	93 Å²	93	77%	0.766	45%	0.449	S	S	*	.	H	α-helix	trans	-95.9	-18	-174.3	-66.5	-169.5	142.5	0	0	115.4
55	K	56.8	Low	62.9	Low	109 Å²	109	84 Å²	84	47%	0.474	42%	0.415	S	S	.	.			trans	-133.2	48.6	-169.7	-64.6	-168.4	-173.7	-179	0	116.3	E80	K55-E80 HydrophobicContact CD-CG 4.37Å; K55-E80 VanDerWaalsContact CD-OE1 3.28Å; K55-E80 WeakPolarHBondContact CD-OE1 3.31Å; K55-E80 IonicContact NZ-OE1 2.62Å; K55-E80 PolarHBondContact NZ-OE1 2.78Å
56	K	60.1	Low	64.2	Low	162 Å²	162	81.7 Å²	81.7	70%	0.704	41%	0.405	S	S	*	.			trans	-69	135.2	163.8	-70.7	-177.6	-179.6	175.5	0	110.5	K58	K56-K58 PolarHBondContact O-N 2.92Å
57	A	69.8	Low	65.9	Low	44 Å²	44	73.5 Å²	73.5	36%	0.364	38%	0.376	S	S	.	.			trans	-79.7	113.5	176.8	0	0	0	0	0	110	K59 A76 I77	A57-K59 PolarHBondContact O-N 2.84Å; A57-A76 HydrophobicContact CB-CB 4.46Å; A57-I77 CarbonylContact C-O 3.59Å; A57-I77 WeakPolarHBondContact CA-O 3.33Å
58	K	80.8	Confident	66.8	Low	64 Å²	64	78.2 Å²	78.2	28%	0.278	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	123.2	-178.9	-57.5	-177.9	179.4	175.6	0	109.9	K56 I60 I77 E122 L124 E126	K56-K58 PolarHBondContact O-N 2.92Å; K58-I60 HydrophobicContact CB-CD1 3.84Å; K58-I60 HydrophobicContact CB-CG1 4.01Å; K58-I60 HydrophobicContact CD-CD1 4.45Å; K58-I77 PolarHBondContact N-O 3.34Å; K58-I77 PolarHBondContact O-N 2.83Å; K58-E122 PolarHBondContact NZ-O 2.85Å; K58-E122 VanDerWaalsContact NZ-O 3.12Å; K58-L124 WeakPolarHBondContact CD-O 3.39Å; K58-L124 WeakPolarHBondContact CE-O 3.31Å; K58-L124 PolarHBondContact NZ-O 3.04Å; K58-E126 HydrophobicContact CB-CB 4.06Å; K58-E126 HydrophobicContact CG-CB 4.31Å
59	K	81.3	Confident	67.5	Low	135 Å²	135	81.6 Å²	81.6	59%	0.587	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.1	117.2	174.2	-175.4	179.1	-179.8	179.4	0	110.5	A57 V74 E126 G127	A57-K59 PolarHBondContact O-N 2.84Å; K59-V74 HydrophobicContact CD-CG1 4.36Å; K59-V74 HydrophobicContact CG-CG1 3.65Å; K59-E126 PolarHBondContact N-OE1 3.11Å; K59-G127 PolarHBondContact O-N 3.46Å
60	I	85.9	Confident	69	Low	1 Å²	1	78.1 Å²	78.1	1%	0.005	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	144.6	-165	-57.2	-164.6	0	0	0	110.8	K58 F62 V74 Y75 I77 L124 V125 Y130	K58-I60 HydrophobicContact CB-CD1 3.84Å; K58-I60 HydrophobicContact CB-CG1 4.01Å; K58-I60 HydrophobicContact CD-CD1 4.45Å; I60-F62 HydrophobicContact CB-CE2 4.17Å; I60-F62 HydrophobicContact CB-CZ 4.41Å; I60-F62 HydrophobicContact CG2-CE1 4.29Å; I60-F62 HydrophobicContact CG2-CE2 3.82Å; I60-F62 HydrophobicContact CG2-CZ 3.69Å; I60-V74 CarbonylContact O-C 3.55Å; I60-V74 WeakPolarHBondContact O-CA 3.35Å; I60-Y75 PolarHBondContact N-O 2.62Å; I60-Y75 PolarHBondContact O-N 3.28Å; I60-I77 HydrophobicContact CB-CD1 4.49Å; I60-I77 HydrophobicContact CD1-CD1 4.31Å; I60-L124 HydrophobicContact CD1-CB 3.53Å; I60-V125 WeakPolarHBondContact CD1-O 3.48Å; I60-V125 WeakPolarHBondContact CG1-O 3.37Å; I60-Y130 HydrophobicContact CG2-CD2 3.41Å; I60-Y130 VanDerWaalsContact CG2-CD2 3.41Å; I60-Y130 HydrophobicContact CG2-CE2 3.65Å
61	R	85.3	Confident	70.4	Confident	87 Å²	87	83.1 Å²	83.1	33%	0.328	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	132.8	177.9	-171.3	178.4	-66.7	-88.1	-2.3	112.1	Y63 K71 G72 I73 V74 E128 S129 Y130	R61-Y63 HydrophobicContact CB-CE2 4.45Å; R61-Y63 VanDerWaalsContact CD-CZ 3.43Å; R61-Y63 VanDerWaalsContact CD-OH 3.25Å; R61-Y63 WeakPolarHBondContact CD-OH 3.35Å; R61-Y63 HydrophobicContact CG-CD2 4.23Å; R61-Y63 HydrophobicContact CG-CE2 3.7Å; R61-K71 PolarHBondContact NH1-O 2.9Å; R61-G72 PolarHBondContact NH1-O 3Å; R61-I73 CarbonylContact C-O 3.58Å; R61-I73 WeakPolarHBondContact CA-O 3.5Å; R61-V74 HydrophobicContact CB-CG2 4.45Å; R61-V74 HydrophobicContact CG-CG2 4.37Å; R61-E128 PolarHBondContact N-O 3.15Å; R61-S129 WeakPolarHBondContact O-CA 3.36Å; R61-Y130 PolarHBondContact O-N 2.89Å
62	F	88	Confident	72.2	Confident	0 Å²	0	78.1 Å²	78.1	0%	0	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	124.4	176.5	-65.4	-76.7	0	0	0	111.8	I60 F70 G72 I73 I77 L88 L92 L96 I109 L124 Y130	I60-F62 HydrophobicContact CB-CE2 4.17Å; I60-F62 HydrophobicContact CB-CZ 4.41Å; I60-F62 HydrophobicContact CG2-CE1 4.29Å; I60-F62 HydrophobicContact CG2-CE2 3.82Å; I60-F62 HydrophobicContact CG2-CZ 3.69Å; F62-F70 WeakPolarHBondContact O-CE1 3.48Å; F62-G72 CarbonylContact O-C 3.48Å; F62-G72 WeakPolarHBondContact O-CA 3.46Å; F62-I73 HydrophobicContact CB-CG2 3.98Å; F62-I73 PolarHBondContact N-O 3.47Å; F62-I73 PolarHBondContact O-N 3.34Å; F62-I77 HydrophobicContact CE2-CD1 3.69Å; F62-I77 HydrophobicContact CZ-CD1 3.68Å; F62-L88 HydrophobicContact CZ-CD2 4.43Å; F62-L92 HydrophobicContact CB-CD2 4.44Å; F62-L92 HydrophobicContact CD1-CD1 4.15Å; F62-L92 HydrophobicContact CD2-CD1 4.29Å; F62-L92 HydrophobicContact CD2-CD2 3.84Å; F62-L92 HydrophobicContact CE1-CD1 4.16Å; F62-L92 HydrophobicContact CE2-CD1 4.3Å; F62-L92 HydrophobicContact CE2-CD2 4.34Å; F62-L92 HydrophobicContact CG-CD1 4.21Å; F62-L92 HydrophobicContact CG-CD2 4.13Å; F62-L92 HydrophobicContact CZ-CD1 4.23Å; F62-L96 HydrophobicContact CB-CD1 4.48Å; F62-I109 HydrophobicContact CD1-CG2 4.41Å; F62-I109 HydrophobicContact CE1-CD1 3.95Å; F62-I109 HydrophobicContact CE1-CG1 4.47Å; F62-I109 HydrophobicContact CE1-CG2 4.01Å; F62-L124 HydrophobicContact CZ-CD1 4.45Å; F62-Y130 CarbonylContact C-O 3.6Å; F62-Y130 WeakPolarHBondContact CA-O 3.3Å; F62-Y130 HydrophobicContact CE1-CD2 4.44Å; F62-Y130 HydrophobicContact CE1-CG 4.43Å
63	Y	85.9	Confident	73.8	Confident	9 Å²	9	77.4 Å²	77.4	4%	0.035	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	169	174	-68.6	-93.2	0	0	0	111.3	R61 F70 Y130 C132 Y143	R61-Y63 HydrophobicContact CB-CE2 4.45Å; R61-Y63 VanDerWaalsContact CD-CZ 3.43Å; R61-Y63 VanDerWaalsContact CD-OH 3.25Å; R61-Y63 WeakPolarHBondContact CD-OH 3.35Å; R61-Y63 HydrophobicContact CG-CD2 4.23Å; R61-Y63 HydrophobicContact CG-CE2 3.7Å; Y63-F70 WeakPolarHBondContact CD1-O 3.4Å; Y63-Y130 PolarHBondContact N-O 3.35Å; Y63-C132 WeakPolarHBondContact O-CB 3.36Å; Y63-C132 PolarHBondContact O-N 3.46Å; Y63-Y143 HydrophobicContact CD1-CD1 4.5Å; Y63-Y143 WeakPolarHBondContact CE1-O 3.16Å; Y63-Y143 PolarHBondContact OH-O 3.36Å
64	R	85.9	Confident	75.5	Confident	38 Å²	38	73.6 Å²	73.6	14%	0.143	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	132	174.8	-65.7	172.8	173.1	171.3	-10.2	110	G66 D67 F70 L96 D98 L102 Y143	R64-G66 PolarHBondContact O-N 3.15Å; R64-D67 HydrophobicContact CB-CB 3.92Å; R64-D67 PolarHBondContact O-N 3.13Å; R64-D67 VanDerWaalsContact O-N 3.09Å; R64-F70 HydrophobicContact CB-CD1 4.31Å; R64-F70 HydrophobicContact CG-CD1 3.84Å; R64-F70 HydrophobicContact CG-CE1 3.95Å; R64-F70 HydrophobicContact CG-CG 4.41Å; R64-L96 HydrophobicContact CG-CD2 4.18Å; R64-L96 PolarHBondContact NE-O 2.86Å; R64-L96 PolarHBondContact NH2-O 3.45Å; R64-D98 IonicContact CZ-OD2 3.4Å; R64-D98 VanDerWaalsContact CZ-OD2 3.27Å; R64-D98 IonicContact NE-OD2 3.69Å; R64-D98 IonicContact NH1-OD2 3.3Å; R64-D98 PolarHBondContact NH1-OD2 3.46Å; R64-D98 IonicContact NH2-OD2 2.7Å; R64-L102 HydrophobicContact CG-CD1 3.97Å; R64-Y143 VanDerWaalsContact O-CE1 3.32Å; R64-Y143 WeakPolarHBondContact O-CE1 3.44Å
65	N	82.6	Confident	77.1	Confident	1 Å²	1	66.7 Å²	66.7	1%	0.005	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	128.6	176.5	-171.4	34.6	0	0	0	110.9	D67 N101 V131 C132 A133 P137 K139 Y143	N65-D67 VanDerWaalsContact C-N 3.29Å; N65-D67 PolarHBondContact O-N 3.4Å; N65-N101 PolarHBondContact O-ND2 2.86Å; N65-V131 HydrophobicContact CB-CG1 4.03Å; N65-C132 WeakPolarHBondContact CB-O 3.45Å; N65-C132 PolarHBondContact N-O 3.28Å; N65-A133 HydrophobicContact CB-CB 3.91Å; N65-P137 PolarHBondContact ND2-O 3.26Å; N65-K139 PolarHBondContact OD1-N 3.43Å; N65-Y143 PolarHBondContact OD1-OH 2.99Å
66	G	73.9	Confident	78.4	Confident	23 Å²	23	64 Å²	64	24%	0.237	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.7	-5.6	-177.9	0	0	0	0	0	116.2	R64 Y143	R64-G66 PolarHBondContact O-N 3.15Å; G66-Y143 PolarHBondContact N-OH 2.82Å
67	D	77.7	Confident	79.4	Confident	26 Å²	26	56.4 Å²	56.4	14%	0.139	27%	0.269	C	S	.	.			trans	-100.9	109.5	177	-168	-22.7	0	0	0	111	R64 N65 Y69 F70 Y143	R64-D67 HydrophobicContact CB-CB 3.92Å; R64-D67 PolarHBondContact O-N 3.13Å; R64-D67 VanDerWaalsContact O-N 3.09Å; N65-D67 VanDerWaalsContact C-N 3.29Å; N65-D67 PolarHBondContact O-N 3.4Å; D67-Y69 PolarHBondContact OD1-N 3.38Å; D67-F70 HydrophobicContact CB-CB 4.13Å; D67-F70 PolarHBondContact OD1-N 3.15Å; D67-F70 WeakPolarHBondContact OD2-CB 3.44Å; D67-Y143 WeakPolarHBondContact O-CD1 3.31Å; D67-Y143 WeakPolarHBondContact O-CE1 3.22Å
68	R	66.9	Low	79.8	Confident	168 Å²	168	55.8 Å²	55.8	63%	0.634	26%	0.262	S	S	*	.	S	Bend	trans	-90.9	-0.5	178.3	65.6	171.3	-68.7	-174.9	0.4	114.5	L141	R68-L141 HydrophobicContact CB-CD1 4.42Å
69	Y	60.6	Low	79.2	Confident	179 Å²	179	58 Å²	58	70%	0.702	27%	0.273	S	S	*	.	S	Bend	trans	-114.5	-24.8	-175.5	-58.5	-66.2	0	0	0	112	D67 K71	D67-Y69 PolarHBondContact OD1-N 3.38Å; Y69-K71 PolarHBondContact O-N 3.35Å
70	F	77.9	Confident	78.5	Confident	53 Å²	53	57.2 Å²	57.2	23%	0.232	27%	0.272	C	S	.	.			trans	-66.3	110.7	169.8	179.9	-108.5	0	0	0	111.9	F62 Y63 R64 D67 G72 I73 L96	F62-F70 WeakPolarHBondContact O-CE1 3.48Å; Y63-F70 WeakPolarHBondContact CD1-O 3.4Å; R64-F70 HydrophobicContact CB-CD1 4.31Å; R64-F70 HydrophobicContact CG-CD1 3.84Å; R64-F70 HydrophobicContact CG-CE1 3.95Å; R64-F70 HydrophobicContact CG-CG 4.41Å; D67-F70 HydrophobicContact CB-CB 4.13Å; D67-F70 PolarHBondContact OD1-N 3.15Å; D67-F70 WeakPolarHBondContact OD2-CB 3.44Å; F70-G72 VanDerWaalsContact CE1-CA 3.49Å; F70-G72 PolarHBondContact O-N 3.41Å; F70-I73 HydrophobicContact CZ-CB 4.13Å; F70-L96 HydrophobicContact CE1-CD2 3.67Å; F70-L96 HydrophobicContact CE2-CD2 4.41Å; F70-L96 HydrophobicContact CZ-CD2 3.4Å
71	K	72.2	Confident	77.8	Confident	160 Å²	160	62.6 Å²	62.6	70%	0.696	29%	0.292	S	S	*	.			trans	-70.2	11.2	-175.9	-56.2	-175.7	-179.2	-178.3	0	115.1	R61 Y69	R61-K71 PolarHBondContact NH1-O 2.9Å; Y69-K71 PolarHBondContact O-N 3.35Å
72	G	79.1	Confident	77.6	Confident	12 Å²	12	58.9 Å²	58.9	12%	0.124	28%	0.278	C	S	.	.			trans	74.9	138	-178.4	0	0	0	0	0	114.3	R61 F62 F70	R61-G72 PolarHBondContact NH1-O 3Å; F62-G72 CarbonylContact O-C 3.48Å; F62-G72 WeakPolarHBondContact O-CA 3.46Å; F70-G72 VanDerWaalsContact CE1-CA 3.49Å; F70-G72 PolarHBondContact O-N 3.41Å
73	I	83.2	Confident	76.9	Confident	49 Å²	49	69.3 Å²	69.3	25%	0.251	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	143.5	169	-167.3	170.3	0	0	0	109.6	R61 F62 F70 Y75 L96	R61-I73 CarbonylContact C-O 3.58Å; R61-I73 WeakPolarHBondContact CA-O 3.5Å; F62-I73 HydrophobicContact CB-CG2 3.98Å; F62-I73 PolarHBondContact N-O 3.47Å; F62-I73 PolarHBondContact O-N 3.34Å; F70-I73 HydrophobicContact CZ-CB 4.13Å; I73-Y75 HydrophobicContact CD1-CD2 4.33Å; I73-Y75 HydrophobicContact CD1-CE2 4.13Å; I73-Y75 HydrophobicContact CG1-CD2 4.43Å; I73-L96 HydrophobicContact CB-CD2 4.34Å; I73-L96 HydrophobicContact CG2-CD1 4.48Å; I73-L96 HydrophobicContact CG2-CD2 3.73Å; I73-L96 HydrophobicContact CG2-CG 4.26Å
74	V	83.1	Confident	76.7	Confident	61 Å²	61	71.5 Å²	71.5	37%	0.37	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	132.7	173.8	-178.2	0	0	0	0	109.5	K59 I60 R61	K59-V74 HydrophobicContact CD-CG1 4.36Å; K59-V74 HydrophobicContact CG-CG1 3.65Å; I60-V74 CarbonylContact O-C 3.55Å; I60-V74 WeakPolarHBondContact O-CA 3.35Å; R61-V74 HydrophobicContact CB-CG2 4.45Å; R61-V74 HydrophobicContact CG-CG2 4.37Å
75	Y	82.8	Confident	76.6	Confident	20 Å²	20	70.9 Å²	70.9	8%	0.078	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	139.7	-176.4	-118.2	-126.1	0	0	0	110.7	I60 I73 I77 R81 F82 L88 D91 L92 S95	I60-Y75 PolarHBondContact N-O 2.62Å; I60-Y75 PolarHBondContact O-N 3.28Å; I73-Y75 HydrophobicContact CD1-CD2 4.33Å; I73-Y75 HydrophobicContact CD1-CE2 4.13Å; I73-Y75 HydrophobicContact CG1-CD2 4.43Å; Y75-I77 HydrophobicContact CD1-CG1 4.42Å; Y75-R81 VanDerWaalsContact CE1-NH2 3.29Å; Y75-R81 PolarHBondContact OH-NH2 2.77Å; Y75-F82 HydrophobicContact CD1-CE2 4.13Å; Y75-F82 HydrophobicContact CD1-CZ 4.25Å; Y75-F82 HydrophobicContact CE1-CE2 4.09Å; Y75-F82 AromaticContact CE1-CZ 3.73Å; Y75-F82 HydrophobicContact CE1-CZ 3.73Å; Y75-L88 HydrophobicContact CD1-CD1 3.92Å; Y75-L88 HydrophobicContact CE1-CD1 4.1Å; Y75-D91 PolarHBondContact OH-OD2 2.7Å; Y75-D91 VanDerWaalsContact OH-OD2 3.04Å; Y75-L92 HydrophobicContact CD1-CD2 4.07Å; Y75-L92 HydrophobicContact CD2-CD2 4.27Å; Y75-L92 HydrophobicContact CE1-CD2 4.02Å; Y75-L92 HydrophobicContact CE1-CG 4.47Å; Y75-L92 HydrophobicContact CE2-CD2 4.25Å; Y75-L92 HydrophobicContact CG-CD2 4.2Å; Y75-S95 PolarHBondContact OH-OG 2.87Å
76	A	83.7	Confident	76.6	Confident	52 Å²	52	76.3 Å²	76.3	43%	0.43	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	123.5	166.6	0	0	0	0	0	109.3	A57 R81	A57-A76 HydrophobicContact CB-CB 4.46Å; A76-R81 PolarHBondContact O-NH1 3.36Å
77	I	80.4	Confident	77.1	Confident	3 Å²	3	77.1 Å²	77.1	2%	0.015	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	115.8	-175.8	-67.6	168.6	0	0	0	109.1	A57 K58 I60 F62 Y75 F82 L88 I121 L124	A57-I77 CarbonylContact C-O 3.59Å; A57-I77 WeakPolarHBondContact CA-O 3.33Å; K58-I77 PolarHBondContact N-O 3.34Å; K58-I77 PolarHBondContact O-N 2.83Å; I60-I77 HydrophobicContact CB-CD1 4.49Å; I60-I77 HydrophobicContact CD1-CD1 4.31Å; F62-I77 HydrophobicContact CE2-CD1 3.69Å; F62-I77 HydrophobicContact CZ-CD1 3.68Å; Y75-I77 HydrophobicContact CD1-CG1 4.42Å; I77-F82 HydrophobicContact CB-CD2 4.38Å; I77-F82 HydrophobicContact CG1-CD2 4.06Å; I77-F82 HydrophobicContact CG1-CE2 4.11Å; I77-F82 HydrophobicContact CG2-CD2 4.18Å; I77-L88 HydrophobicContact CD1-CD1 3.86Å; I77-L88 HydrophobicContact CD1-CD2 3.63Å; I77-L88 HydrophobicContact CD1-CG 4.42Å; I77-L88 HydrophobicContact CG1-CD1 4.08Å; I77-L88 HydrophobicContact CG1-CD2 4.44Å; I77-I121 HydrophobicContact CG2-CG2 3.82Å; I77-L124 HydrophobicContact CD1-CD1 4Å
78	S	79.3	Confident	77.4	Confident	30 Å²	30	75.9 Å²	75.9	21%	0.21	36%	0.36	C	S	.	.			trans	-121.7	155.4	167.5	67	0	0	0	0	109.6	E80 R81 F82	S78-E80 PolarHBondContact O-N 2.84Å; S78-E80 VanDerWaalsContact O-N 3.13Å; S78-R81 PolarHBondContact O-N 3.49Å; S78-R81 VanDerWaalsContact O-N 3.11Å; S78-R81 PolarHBondContact OG-N 3.24Å; S78-R81 VanDerWaalsContact OG-N 3.15Å; S78-F82 PolarHBondContact O-N 3.32Å
79	Q	67.3	Low	78.4	Confident	111 Å²	111	68.9 Å²	68.9	52%	0.519	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-22.3	173.3	-71.5	174.7	-24.2	0	0	112.8
80	E	66.4	Low	79.4	Confident	119 Å²	119	62.4 Å²	62.4	56%	0.556	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-32.9	177.5	-63.4	-176.3	172.6	0	0	112.7	K55 S78	K55-E80 HydrophobicContact CD-CG 4.37Å; K55-E80 VanDerWaalsContact CD-OE1 3.28Å; K55-E80 WeakPolarHBondContact CD-OE1 3.31Å; K55-E80 IonicContact NZ-OE1 2.62Å; K55-E80 PolarHBondContact NZ-OE1 2.78Å; S78-E80 PolarHBondContact O-N 2.84Å; S78-E80 VanDerWaalsContact O-N 3.13Å
81	R	72	Confident	79.7	Confident	113 Å²	113	61.2 Å²	61.2	43%	0.426	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-39.1	172.2	-172.4	179.5	172.8	-147	-5.9	111.8	Y75 A76 S78 D91	Y75-R81 VanDerWaalsContact CE1-NH2 3.29Å; Y75-R81 PolarHBondContact OH-NH2 2.77Å; A76-R81 PolarHBondContact O-NH1 3.36Å; S78-R81 PolarHBondContact O-N 3.49Å; S78-R81 VanDerWaalsContact O-N 3.11Å; S78-R81 PolarHBondContact OG-N 3.24Å; S78-R81 VanDerWaalsContact OG-N 3.15Å; R81-D91 IonicContact CZ-OD2 3.68Å; R81-D91 IonicContact NH2-OD2 2.75Å; R81-D91 PolarHBondContact NH2-OD2 2.76Å
82	F	80.3	Confident	80.3	Confident	10 Å²	10	53.6 Å²	53.6	4%	0.044	28%	0.282	C	S	.	.			trans	-130.5	103.4	-177.5	-61.4	-66.3	0	0	0	111.4	Y75 I77 S78 A87 L88 D91 I121	Y75-F82 HydrophobicContact CD1-CE2 4.13Å; Y75-F82 HydrophobicContact CD1-CZ 4.25Å; Y75-F82 HydrophobicContact CE1-CE2 4.09Å; Y75-F82 AromaticContact CE1-CZ 3.73Å; Y75-F82 HydrophobicContact CE1-CZ 3.73Å; I77-F82 HydrophobicContact CB-CD2 4.38Å; I77-F82 HydrophobicContact CG1-CD2 4.06Å; I77-F82 HydrophobicContact CG1-CE2 4.11Å; I77-F82 HydrophobicContact CG2-CD2 4.18Å; S78-F82 PolarHBondContact O-N 3.32Å; F82-A87 HydrophobicContact CD1-CB 4.27Å; F82-L88 HydrophobicContact CB-CB 4.43Å; F82-L88 HydrophobicContact CD1-CB 4.01Å; F82-L88 HydrophobicContact CD1-CD1 4.4Å; F82-L88 HydrophobicContact CD2-CD1 3.98Å; F82-L88 HydrophobicContact CE1-CB 4.44Å; F82-L88 HydrophobicContact CE1-CD1 4.21Å; F82-L88 HydrophobicContact CE2-CD1 3.74Å; F82-L88 HydrophobicContact CG-CB 4.08Å; F82-L88 HydrophobicContact CG-CD1 4.29Å; F82-L88 HydrophobicContact CZ-CD1 3.87Å; F82-D91 HydrophobicContact CE1-CB 3.74Å; F82-D91 HydrophobicContact CZ-CB 4.08Å; F82-D91 WeakPolarHBondContact CZ-OD2 3.42Å; F82-I121 HydrophobicContact CB-CD1 3.63Å
83	R	73.4	Confident	80.5	Confident	219 Å²	219	55.3 Å²	55.3	83%	0.826	29%	0.29	S	S	*	.	S	Bend	trans	-80.3	-14.9	179.6	-65.7	-176.5	176.5	85.5	1.3	114.2
84	S	82.4	Confident	80.2	Confident	54 Å²	54	60.7 Å²	60.7	38%	0.378	31%	0.307	S	S	.	.	S	Bend	trans	-150.1	159.5	176.2	69.3	0	0	0	0	110.8	D86 A87 L88 I121	S84-D86 VanDerWaalsContact C-N 3.27Å; S84-D86 PolarHBondContact O-N 2.75Å; S84-A87 WeakPolarHBondContact O-CB 3.28Å; S84-A87 PolarHBondContact O-N 3.06Å; S84-A87 PolarHBondContact OG-N 3.44Å; S84-L88 PolarHBondContact O-N 2.96Å; S84-I121 VanDerWaalsContact O-CD1 3.3Å; S84-I121 WeakPolarHBondContact O-CD1 3.43Å
85	L	82.6	Confident	79.9	Confident	26 Å²	26	60 Å²	60	14%	0.136	31%	0.305	C	S	.	.	H	α-helix	trans	-60.9	-37.4	176.6	-175.8	60.2	0	0	0	111.5	A87 L88 L89 I109 T119 I121	L85-A87 VanDerWaalsContact C-N 3.3Å; L85-A87 PolarHBondContact O-N 3.36Å; L85-L88 HydrophobicContact CD1-CD2 4.26Å; L85-L88 CarbonylContact O-C 3.57Å; L85-L88 WeakPolarHBondContact O-CA 2.95Å; L85-L88 WeakPolarHBondContact O-CB 3.35Å; L85-L88 PolarHBondContact O-N 2.76Å; L85-L89 HydrophobicContact CG-CD1 4.15Å; L85-L89 HydrophobicContact CG-CG 4.26Å; L85-L89 WeakPolarHBondContact O-CG 3.32Å; L85-L89 PolarHBondContact O-N 2.89Å; L85-I109 HydrophobicContact CD1-CD1 4.24Å; L85-T119 WeakPolarHBondContact CD2-O 3.37Å; L85-I121 HydrophobicContact CB-CG1 4.37Å; L85-I121 HydrophobicContact CD1-CG1 4.09Å
86	D	84.1	Confident	79.4	Confident	114 Å²	114	59.2 Å²	59.2	61%	0.61	30%	0.302	S	S	*	.	H	α-helix	trans	-62.5	-35.1	178.3	-52.3	-69	0	0	0	113	S84 L88 L89 A90	S84-D86 VanDerWaalsContact C-N 3.27Å; S84-D86 PolarHBondContact O-N 2.75Å; D86-L88 VanDerWaalsContact C-N 3.3Å; D86-L88 PolarHBondContact O-N 3.22Å; D86-L89 PolarHBondContact O-N 2.88Å; D86-A90 WeakPolarHBondContact O-CB 3.28Å; D86-A90 PolarHBondContact O-N 3.15Å
87	A	83.9	Confident	78.3	Confident	40 Å²	40	60.8 Å²	60.8	33%	0.331	31%	0.31	S	S	.	.	H	α-helix	trans	-64.6	-36.4	174.2	0	0	0	0	0	111.8	F82 S84 L85 D91	F82-A87 HydrophobicContact CD1-CB 4.27Å; S84-A87 WeakPolarHBondContact O-CB 3.28Å; S84-A87 PolarHBondContact O-N 3.06Å; S84-A87 PolarHBondContact OG-N 3.44Å; L85-A87 VanDerWaalsContact C-N 3.3Å; L85-A87 PolarHBondContact O-N 3.36Å; A87-D91 PolarHBondContact O-N 2.77Å
88	L	85	Confident	77.5	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-71.6	-43.4	173.5	176.6	63.6	0	0	0	111.6	F62 Y75 I77 F82 S84 L85 D86 A90 D91 L92 I109 I121 L124	F62-L88 HydrophobicContact CZ-CD2 4.43Å; Y75-L88 HydrophobicContact CD1-CD1 3.92Å; Y75-L88 HydrophobicContact CE1-CD1 4.1Å; I77-L88 HydrophobicContact CD1-CD1 3.86Å; I77-L88 HydrophobicContact CD1-CD2 3.63Å; I77-L88 HydrophobicContact CD1-CG 4.42Å; I77-L88 HydrophobicContact CG1-CD1 4.08Å; I77-L88 HydrophobicContact CG1-CD2 4.44Å; F82-L88 HydrophobicContact CB-CB 4.43Å; F82-L88 HydrophobicContact CD1-CB 4.01Å; F82-L88 HydrophobicContact CD1-CD1 4.4Å; F82-L88 HydrophobicContact CD2-CD1 3.98Å; F82-L88 HydrophobicContact CE1-CB 4.44Å; F82-L88 HydrophobicContact CE1-CD1 4.21Å; F82-L88 HydrophobicContact CE2-CD1 3.74Å; F82-L88 HydrophobicContact CG-CB 4.08Å; F82-L88 HydrophobicContact CG-CD1 4.29Å; F82-L88 HydrophobicContact CZ-CD1 3.87Å; S84-L88 PolarHBondContact O-N 2.96Å; L85-L88 HydrophobicContact CD1-CD2 4.26Å; L85-L88 CarbonylContact O-C 3.57Å; L85-L88 WeakPolarHBondContact O-CA 2.95Å; L85-L88 WeakPolarHBondContact O-CB 3.35Å; L85-L88 PolarHBondContact O-N 2.76Å; D86-L88 VanDerWaalsContact C-N 3.3Å; D86-L88 PolarHBondContact O-N 3.22Å; L88-A90 VanDerWaalsContact C-N 3.3Å; L88-A90 PolarHBondContact O-N 3.05Å; L88-D91 PolarHBondContact O-N 2.69Å; L88-L92 HydrophobicContact CD1-CD1 3.85Å; L88-L92 HydrophobicContact CD1-CG 3.94Å; L88-L92 HydrophobicContact CD2-CD1 4.45Å; L88-L92 HydrophobicContact CG-CD1 3.78Å; L88-L92 HydrophobicContact CG-CG 4.3Å; L88-L92 WeakPolarHBondContact O-CB 3.38Å; L88-L92 WeakPolarHBondContact O-CG 3.28Å; L88-L92 PolarHBondContact O-N 2.75Å; L88-I109 HydrophobicContact CD2-CD1 4.32Å; L88-I121 HydrophobicContact CB-CD1 4.27Å; L88-I121 HydrophobicContact CD2-CD1 4.46Å; L88-I121 HydrophobicContact CD2-CG1 4.31Å; L88-L124 HydrophobicContact CD2-CD1 3.7Å
89	L	85.9	Confident	76.3	Confident	22 Å²	22	67.7 Å²	67.7	12%	0.115	35%	0.345	C	S	.	.	H	α-helix	trans	-59.8	-39.4	176.1	-67.9	171.5	0	0	0	111.7	L85 D86 T93 V106 I109	L85-L89 HydrophobicContact CG-CD1 4.15Å; L85-L89 HydrophobicContact CG-CG 4.26Å; L85-L89 WeakPolarHBondContact O-CG 3.32Å; L85-L89 PolarHBondContact O-N 2.89Å; D86-L89 PolarHBondContact O-N 2.88Å; L89-T93 VanDerWaalsContact O-CB 3.28Å; L89-T93 WeakPolarHBondContact O-CB 3.37Å; L89-T93 PolarHBondContact O-N 2.94Å; L89-T93 PolarHBondContact O-OG1 2.87Å; L89-V106 HydrophobicContact CD2-CG1 3.76Å; L89-I109 HydrophobicContact CD2-CD1 3.82Å; L89-I109 HydrophobicContact CD2-CG1 3.83Å
90	A	83.1	Confident	76.1	Confident	43 Å²	43	68.1 Å²	68.1	36%	0.355	36%	0.355	S	S	.	.	H	α-helix	trans	-67.8	-38	175.8	0	0	0	0	0	113.2	D86 L88 R94	D86-A90 WeakPolarHBondContact O-CB 3.28Å; D86-A90 PolarHBondContact O-N 3.15Å; L88-A90 VanDerWaalsContact C-N 3.3Å; L88-A90 PolarHBondContact O-N 3.05Å; A90-R94 PolarHBondContact O-N 2.9Å
91	D	83.8	Confident	75.8	Confident	28 Å²	28	64 Å²	64	15%	0.15	34%	0.337	C	S	.	.	H	α-helix	trans	-76	-36.9	178.5	-150.6	34.8	0	0	0	112.3	Y75 R81 F82 A87 L88 R94 S95	Y75-D91 PolarHBondContact OH-OD2 2.7Å; Y75-D91 VanDerWaalsContact OH-OD2 3.04Å; R81-D91 IonicContact CZ-OD2 3.68Å; R81-D91 IonicContact NH2-OD2 2.75Å; R81-D91 PolarHBondContact NH2-OD2 2.76Å; F82-D91 HydrophobicContact CE1-CB 3.74Å; F82-D91 HydrophobicContact CZ-CB 4.08Å; F82-D91 WeakPolarHBondContact CZ-OD2 3.42Å; A87-D91 PolarHBondContact O-N 2.77Å; L88-D91 PolarHBondContact O-N 2.69Å; D91-R94 PolarHBondContact O-N 3.04Å; D91-R94 IonicContact OD1-CZ 2.73Å; D91-R94 IonicContact OD1-NE 3.58Å; D91-R94 PolarHBondContact OD1-NE 2.75Å; D91-R94 IonicContact OD1-NH2 2.74Å; D91-R94 PolarHBondContact OD1-NH2 3.49Å; D91-S95 WeakPolarHBondContact O-CB 3.48Å; D91-S95 PolarHBondContact O-N 3.22Å; D91-S95 PolarHBondContact O-OG 2.74Å
92	L	84.4	Confident	75.9	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-66.4	-35.7	169.9	-70	172.7	0	0	0	111.7	F62 Y75 L88 R94 S95 L96 V106 I109	F62-L92 HydrophobicContact CB-CD2 4.44Å; F62-L92 HydrophobicContact CD1-CD1 4.15Å; F62-L92 HydrophobicContact CD2-CD1 4.29Å; F62-L92 HydrophobicContact CD2-CD2 3.84Å; F62-L92 HydrophobicContact CE1-CD1 4.16Å; F62-L92 HydrophobicContact CE2-CD1 4.3Å; F62-L92 HydrophobicContact CE2-CD2 4.34Å; F62-L92 HydrophobicContact CG-CD1 4.21Å; F62-L92 HydrophobicContact CG-CD2 4.13Å; F62-L92 HydrophobicContact CZ-CD1 4.23Å; Y75-L92 HydrophobicContact CD1-CD2 4.07Å; Y75-L92 HydrophobicContact CD2-CD2 4.27Å; Y75-L92 HydrophobicContact CE1-CD2 4.02Å; Y75-L92 HydrophobicContact CE1-CG 4.47Å; Y75-L92 HydrophobicContact CE2-CD2 4.25Å; Y75-L92 HydrophobicContact CG-CD2 4.2Å; L88-L92 HydrophobicContact CD1-CD1 3.85Å; L88-L92 HydrophobicContact CD1-CG 3.94Å; L88-L92 HydrophobicContact CD2-CD1 4.45Å; L88-L92 HydrophobicContact CG-CD1 3.78Å; L88-L92 HydrophobicContact CG-CG 4.3Å; L88-L92 WeakPolarHBondContact O-CB 3.38Å; L88-L92 WeakPolarHBondContact O-CG 3.28Å; L88-L92 PolarHBondContact O-N 2.75Å; L92-R94 VanDerWaalsContact C-N 3.34Å; L92-R94 PolarHBondContact O-N 3.22Å; L92-S95 PolarHBondContact O-N 3.39Å; L92-S95 VanDerWaalsContact O-N 3.16Å; L92-L96 HydrophobicContact CB-CD1 4.44Å; L92-L96 HydrophobicContact CD2-CD1 4.4Å; L92-L96 VanDerWaalsContact O-CB 3.27Å; L92-L96 WeakPolarHBondContact O-CB 3.4Å; L92-L96 PolarHBondContact O-N 3.3Å; L92-V106 HydrophobicContact CB-CB 4.37Å; L92-V106 HydrophobicContact CB-CG2 4.16Å; L92-I109 HydrophobicContact CD1-CD1 3.84Å
93	T	83.1	Confident	75	Confident	47 Å²	47	61.6 Å²	61.6	29%	0.288	34%	0.336	S	S	.	.	H	α-helix	trans	-59.4	-42.4	172.8	-67.9	0	0	0	0	112.1	L89 S97 V106	L89-T93 VanDerWaalsContact O-CB 3.28Å; L89-T93 WeakPolarHBondContact O-CB 3.37Å; L89-T93 PolarHBondContact O-N 2.94Å; L89-T93 PolarHBondContact O-OG1 2.87Å; T93-S97 PolarHBondContact O-N 3.29Å; T93-V106 PolarHBondContact OG1-N 2.85Å; T93-V106 PolarHBondContact OG1-O 2.72Å
94	R	78.3	Confident	74.9	Confident	162 Å²	162	55.9 Å²	55.9	61%	0.611	32%	0.319	S	S	*	.	H	α-helix	trans	-67.7	-38.1	173.1	-68.6	-177	-68.1	-96.8	6	112.5	A90 D91 L92	A90-R94 PolarHBondContact O-N 2.9Å; D91-R94 PolarHBondContact O-N 3.04Å; D91-R94 IonicContact OD1-CZ 2.73Å; D91-R94 IonicContact OD1-NE 3.58Å; D91-R94 PolarHBondContact OD1-NE 2.75Å; D91-R94 IonicContact OD1-NH2 2.74Å; D91-R94 PolarHBondContact OD1-NH2 3.49Å; L92-R94 VanDerWaalsContact C-N 3.34Å; L92-R94 PolarHBondContact O-N 3.22Å
95	S	75.3	Confident	74.7	Confident	48 Å²	48	53.9 Å²	53.9	34%	0.336	31%	0.307	S	S	.	.	H	α-helix	trans	-83.1	-23.2	-172.9	-54.9	0	0	0	0	114.4	Y75 D91 L92	Y75-S95 PolarHBondContact OH-OG 2.87Å; D91-S95 WeakPolarHBondContact O-CB 3.48Å; D91-S95 PolarHBondContact O-N 3.22Å; D91-S95 PolarHBondContact O-OG 2.74Å; L92-S95 PolarHBondContact O-N 3.39Å; L92-S95 VanDerWaalsContact O-N 3.16Å
96	L	73	Confident	74.7	Confident	2 Å²	2	52.7 Å²	52.7	1%	0.01	30%	0.301	C	S	.	.	S	Bend	trans	-110.2	11.1	-178.4	-68.5	172.4	0	0	0	112.7	F62 R64 F70 I73 L92 D98 L102 V106 C132	F62-L96 HydrophobicContact CB-CD1 4.48Å; R64-L96 HydrophobicContact CG-CD2 4.18Å; R64-L96 PolarHBondContact NE-O 2.86Å; R64-L96 PolarHBondContact NH2-O 3.45Å; F70-L96 HydrophobicContact CE1-CD2 3.67Å; F70-L96 HydrophobicContact CE2-CD2 4.41Å; F70-L96 HydrophobicContact CZ-CD2 3.4Å; I73-L96 HydrophobicContact CB-CD2 4.34Å; I73-L96 HydrophobicContact CG2-CD1 4.48Å; I73-L96 HydrophobicContact CG2-CD2 3.73Å; I73-L96 HydrophobicContact CG2-CG 4.26Å; L92-L96 HydrophobicContact CB-CD1 4.44Å; L92-L96 HydrophobicContact CD2-CD1 4.4Å; L92-L96 VanDerWaalsContact O-CB 3.27Å; L92-L96 WeakPolarHBondContact O-CB 3.4Å; L92-L96 PolarHBondContact O-N 3.3Å; L96-D98 WeakPolarHBondContact O-CB 3.38Å; L96-D98 PolarHBondContact O-N 2.88Å; L96-D98 VanDerWaalsContact O-N 3.09Å; L96-L102 HydrophobicContact CB-CD1 3.8Å; L96-V106 HydrophobicContact CB-CG2 4.36Å; L96-V106 HydrophobicContact CD1-CG2 4.06Å; L96-C132 HydrophobicContact CD1-CB 3.85Å
97	S	60.7	Low	74.8	Confident	86 Å²	86	54.4 Å²	54.4	60%	0.601	30%	0.299	S	S	*	.			trans	-43.3	111.2	-174.6	61.3	0	0	0	0	113.1	T93	T93-S97 PolarHBondContact O-N 3.29Å
98	D	62.9	Low	74.8	Confident	31 Å²	31	53.3 Å²	53.3	17%	0.166	29%	0.288	C	S	.	.			trans	-156.6	110.1	-174.4	-170.6	-40.7	0	0	0	108.8	R64 L96 V100 N101 L102	R64-D98 IonicContact CZ-OD2 3.4Å; R64-D98 VanDerWaalsContact CZ-OD2 3.27Å; R64-D98 IonicContact NE-OD2 3.69Å; R64-D98 IonicContact NH1-OD2 3.3Å; R64-D98 PolarHBondContact NH1-OD2 3.46Å; R64-D98 IonicContact NH2-OD2 2.7Å; L96-D98 WeakPolarHBondContact O-CB 3.38Å; L96-D98 PolarHBondContact O-N 2.88Å; L96-D98 VanDerWaalsContact O-N 3.09Å; D98-V100 PolarHBondContact O-N 2.82Å; D98-V100 WeakPolarHBondContact OD1-CA 3.39Å; D98-V100 WeakPolarHBondContact OD1-CB 3.34Å; D98-V100 PolarHBondContact OD1-N 3.28Å; D98-N101 PolarHBondContact OD1-N 2.89Å; D98-L102 CarbonylContact O-C 3.6Å; D98-L102 VanDerWaalsContact O-CA 3.26Å; D98-L102 WeakPolarHBondContact O-CA 3.11Å; D98-L102 PolarHBondContact O-N 3.42Å
99	N	55.5	Low	75	Confident	146 Å²	146	53.3 Å²	53.3	78%	0.781	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-7.9	-176.5	-64.5	-12.7	0	0	0	113.1
100	V	61.9	Low	75	Confident	120 Å²	120	54.6 Å²	54.6	73%	0.727	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-47	177.8	-175.1	0	0	0	0	110.2	D98	D98-V100 PolarHBondContact O-N 2.82Å; D98-V100 WeakPolarHBondContact OD1-CA 3.39Å; D98-V100 WeakPolarHBondContact OD1-CB 3.34Å; D98-V100 PolarHBondContact OD1-N 3.28Å
101	N	60.8	Low	75.2	Confident	34 Å²	34	54 Å²	54	18%	0.182	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-19.5	-176.1	-76.7	84.3	0	0	0	114.5	N65 D98	N65-N101 PolarHBondContact O-ND2 2.86Å; D98-N101 PolarHBondContact OD1-N 2.89Å
102	L	72.8	Confident	75	Confident	5 Å²	5	53.8 Å²	53.8	3%	0.026	28%	0.283	C	S	.	.			trans	-137.7	58.3	-179.7	-69.3	172.3	0	0	0	112.2	R64 L96 D98 Q104 G105 V106	R64-L102 HydrophobicContact CG-CD1 3.97Å; L96-L102 HydrophobicContact CB-CD1 3.8Å; D98-L102 CarbonylContact O-C 3.6Å; D98-L102 VanDerWaalsContact O-CA 3.26Å; D98-L102 WeakPolarHBondContact O-CA 3.11Å; D98-L102 PolarHBondContact O-N 3.42Å; L102-Q104 PolarHBondContact O-N 3.06Å; L102-G105 PolarHBondContact O-N 3.4Å; L102-V106 HydrophobicContact CD1-CG2 3.83Å
103	P	62.7	Low	74.5	Confident	67 Å²	67	58.6 Å²	58.6	44%	0.435	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-7.5	-168.3	24.6	-36.1	0	0	0	116.6
104	Q	69.7	Low	74.3	Confident	98 Å²	98	57.2 Å²	57.2	46%	0.458	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.2	21.1	172.9	-58.6	-170.8	2	0	0	112.7	L102 R107 S134	L102-Q104 PolarHBondContact O-N 3.06Å; Q104-R107 PolarHBondContact O-NE 2.68Å; Q104-R107 PolarHBondContact O-NH2 3.12Å; Q104-S134 PolarHBondContact N-OG 3.19Å
105	G	78.4	Confident	74.3	Confident	12 Å²	12	55.2 Å²	55.2	12%	0.124	31%	0.309	C	S	.	.			trans	78.7	-168.4	-171.5	0	0	0	0	0	113.5	L102 S134	L102-G105 PolarHBondContact O-N 3.4Å; G105-S134 WeakPolarHBondContact O-CA 3.38Å
106	V	84.1	Confident	74.6	Confident	2 Å²	2	56.3 Å²	56.3	1%	0.012	31%	0.314	C	S	.	.			trans	-87.5	114.2	174.1	-176.6	0	0	0	0	108.6	L89 L92 T93 L96 L102 I109 C132	L89-V106 HydrophobicContact CD2-CG1 3.76Å; L92-V106 HydrophobicContact CB-CB 4.37Å; L92-V106 HydrophobicContact CB-CG2 4.16Å; T93-V106 PolarHBondContact OG1-N 2.85Å; T93-V106 PolarHBondContact OG1-O 2.72Å; L96-V106 HydrophobicContact CB-CG2 4.36Å; L96-V106 HydrophobicContact CD1-CG2 4.06Å; L102-V106 HydrophobicContact CD1-CG2 3.83Å; V106-I109 HydrophobicContact CG1-CG1 4.37Å; V106-C132 HydrophobicContact CB-CB 4.4Å; V106-C132 HydrophobicContact CG1-CB 3.63Å; V106-C132 HydrophobicContact CG2-CB 3.84Å
107	R	84.9	Confident	75.2	Confident	150 Å²	150	61.5 Å²	61.5	57%	0.566	34%	0.337	S	S	*	.			trans	-113	-21.7	-178.6	-60.5	-58.5	-174.9	143.3	3	113.3	Q104 A133	Q104-R107 PolarHBondContact O-NE 2.68Å; Q104-R107 PolarHBondContact O-NH2 3.12Å; R107-A133 PolarHBondContact N-O 3.3Å
108	T	84.9	Confident	76.5	Confident	16 Å²	16	57.8 Å²	57.8	10%	0.098	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	148.6	175.9	-61.6	0	0	0	0	110.2	Y110 K117 A133	T108-Y110 HydrophobicContact CG2-CD2 3.75Å; T108-Y110 HydrophobicContact CG2-CE1 4.2Å; T108-Y110 HydrophobicContact CG2-CE2 3.29Å; T108-Y110 HydrophobicContact CG2-CG 4.37Å; T108-K117 HydrophobicContact CG2-CD 3.54Å; T108-K117 HydrophobicContact CG2-CG 3.7Å; T108-K117 PolarHBondContact OG1-NZ 2.8Å; T108-A133 PolarHBondContact N-O 3.16Å; T108-A133 PolarHBondContact O-N 2.89Å
109	I	87.9	Confident	77.4	Confident	1 Å²	1	60.1 Å²	60.1	1%	0.005	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	132.4	167.7	-64.5	166	0	0	0	107.8	F62 L85 L88 L89 L92 V106 I118 L124 Y130 V131	F62-I109 HydrophobicContact CD1-CG2 4.41Å; F62-I109 HydrophobicContact CE1-CD1 3.95Å; F62-I109 HydrophobicContact CE1-CG1 4.47Å; F62-I109 HydrophobicContact CE1-CG2 4.01Å; L85-I109 HydrophobicContact CD1-CD1 4.24Å; L88-I109 HydrophobicContact CD2-CD1 4.32Å; L89-I109 HydrophobicContact CD2-CD1 3.82Å; L89-I109 HydrophobicContact CD2-CG1 3.83Å; L92-I109 HydrophobicContact CD1-CD1 3.84Å; V106-I109 HydrophobicContact CG1-CG1 4.37Å; I109-I118 HydrophobicContact CB-CB 4.21Å; I109-I118 HydrophobicContact CB-CG1 4.41Å; I109-I118 HydrophobicContact CG2-CB 4.19Å; I109-I118 HydrophobicContact CG2-CG1 3.87Å; I109-I118 PolarHBondContact O-N 3.3Å; I109-L124 HydrophobicContact CG2-CD2 4.49Å; I109-Y130 HydrophobicContact CG2-CD1 4.3Å; I109-Y130 HydrophobicContact CG2-CG 4.24Å; I109-V131 WeakPolarHBondContact CA-O 3.47Å
110	Y	86.7	Confident	78.6	Confident	48 Å²	48	57.7 Å²	57.7	19%	0.188	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	159.2	174.1	-67.2	-86.7	0	0	0	110.5	T108 T116 K117 Y130 V131 A133 F138	T108-Y110 HydrophobicContact CG2-CD2 3.75Å; T108-Y110 HydrophobicContact CG2-CE1 4.2Å; T108-Y110 HydrophobicContact CG2-CE2 3.29Å; T108-Y110 HydrophobicContact CG2-CG 4.37Å; Y110-T116 WeakPolarHBondContact CA-O 3.32Å; Y110-K117 HydrophobicContact CD1-CB 4.13Å; Y110-K117 HydrophobicContact CE1-CB 3.93Å; Y110-Y130 CarbonylContact O-C 3.56Å; Y110-Y130 VanDerWaalsContact O-CA 3.3Å; Y110-Y130 WeakPolarHBondContact O-CA 3.48Å; Y110-Y130 WeakPolarHBondContact O-CB 3.45Å; Y110-V131 PolarHBondContact N-O 3.39Å; Y110-V131 PolarHBondContact O-N 2.97Å; Y110-A133 HydrophobicContact CD2-CB 4.02Å; Y110-A133 HydrophobicContact CE2-CB 3.87Å; Y110-F138 HydrophobicContact CD2-CB 4.43Å; Y110-F138 HydrophobicContact CD2-CD2 4.26Å; Y110-F138 HydrophobicContact CE2-CB 4.42Å; Y110-F138 HydrophobicContact CG-CD2 4.18Å
111	T	86.4	Confident	79.6	Confident	30 Å²	30	53 Å²	53	18%	0.184	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	160.8	160.2	38.5	0	0	0	0	111.5	D113 G114 T116 Y130	T111-D113 PolarHBondContact O-N 3.17Å; T111-G114 PolarHBondContact O-N 2.88Å; T111-T116 WeakPolarHBondContact CG2-OG1 3.42Å; T111-T116 PolarHBondContact N-O 3.05Å; T111-T116 PolarHBondContact OG1-N 2.84Å; T111-T116 PolarHBondContact OG1-O 3.33Å; T111-T116 PolarHBondContact OG1-OG1 3.39Å; T111-Y130 HydrophobicContact CG2-CD1 4.14Å; T111-Y130 HydrophobicContact CG2-CE1 3.88Å
112	V	80	Confident	80.4	Confident	24 Å²	24	58.1 Å²	58.1	15%	0.145	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-33.7	178.5	160.5	0	0	0	0	113.1	G114 S129 V131 F138 T144	V112-G114 VanDerWaalsContact C-N 3.26Å; V112-G114 PolarHBondContact O-N 3.29Å; V112-S129 WeakPolarHBondContact CG2-O 3.37Å; V112-V131 HydrophobicContact CG2-CG2 4.4Å; V112-F138 WeakPolarHBondContact O-CZ 3.42Å; V112-T144 HydrophobicContact CG1-CG2 3.96Å; V112-T144 HydrophobicContact CG2-CG2 4.04Å
113	D	75.4	Confident	80.8	Confident	102 Å²	102	61.9 Å²	61.9	55%	0.545	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-11.9	177.9	-56.4	-65.8	0	0	0	114.1	T111 V115	T111-D113 PolarHBondContact O-N 3.17Å; D113-V115 HydrophobicContact CB-CG2 3.92Å; D113-V115 PolarHBondContact O-N 2.81Å
114	G	77.8	Confident	81.7	Confident	17 Å²	17	58.7 Å²	58.7	18%	0.175	30%	0.303	C	S	.	.	S	Bend	trans	77.9	-5.8	-175.7	0	0	0	0	0	115.6	T111 V112 T116 F138	T111-G114 PolarHBondContact O-N 2.88Å; V112-G114 VanDerWaalsContact C-N 3.26Å; V112-G114 PolarHBondContact O-N 3.29Å; G114-T116 PolarHBondContact O-N 3.27Å; G114-F138 VanDerWaalsContact CA-CZ 3.45Å
115	V	77.8	Confident	82.2	Confident	120 Å²	120	57.7 Å²	57.7	73%	0.727	30%	0.303	S	S	*	.			trans	-70.4	-34.4	-169.8	-178.9	0	0	0	0	112.5	D113	D113-V115 HydrophobicContact CB-CG2 3.92Å; D113-V115 PolarHBondContact O-N 2.81Å
116	T	81.8	Confident	82.2	Confident	72 Å²	72	62.1 Å²	62.1	44%	0.442	32%	0.32	S	S	.	.			trans	-121	130	-176.8	55.6	0	0	0	0	111.9	Y110 T111 G114	Y110-T116 WeakPolarHBondContact CA-O 3.32Å; T111-T116 WeakPolarHBondContact CG2-OG1 3.42Å; T111-T116 PolarHBondContact N-O 3.05Å; T111-T116 PolarHBondContact OG1-N 2.84Å; T111-T116 PolarHBondContact OG1-O 3.33Å; T111-T116 PolarHBondContact OG1-OG1 3.39Å; G114-T116 PolarHBondContact O-N 3.27Å
117	K	86.2	Confident	81.6	Confident	110 Å²	110	64.9 Å²	64.9	48%	0.478	35%	0.35	S	S	.	.	B	Isolated β-bridge	trans	-85.7	127.8	168.5	170	164.6	177.7	148.9	0	109.2	T108 Y110	T108-K117 HydrophobicContact CG2-CD 3.54Å; T108-K117 HydrophobicContact CG2-CG 3.7Å; T108-K117 PolarHBondContact OG1-NZ 2.8Å; Y110-K117 HydrophobicContact CD1-CB 4.13Å; Y110-K117 HydrophobicContact CE1-CB 3.93Å
118	I	88.1	Confident	81.5	Confident	9 Å²	9	62.8 Å²	62.8	5%	0.046	35%	0.346	C	S	.	.			trans	-75.4	125.7	174.7	-55.4	-56.4	0	0	0	109.2	I109 N120 Q123 L124 Y130	I109-I118 HydrophobicContact CB-CB 4.21Å; I109-I118 HydrophobicContact CB-CG1 4.41Å; I109-I118 HydrophobicContact CG2-CB 4.19Å; I109-I118 HydrophobicContact CG2-CG1 3.87Å; I109-I118 PolarHBondContact O-N 3.3Å; I118-N120 WeakPolarHBondContact CG2-O 3.47Å; I118-Q123 HydrophobicContact CD1-CB 4.21Å; I118-Q123 HydrophobicContact CG2-CB 4.39Å; I118-L124 HydrophobicContact CB-CD2 4.48Å; I118-L124 HydrophobicContact CD1-CD2 4.44Å; I118-L124 HydrophobicContact CG1-CD2 4.01Å; I118-L124 HydrophobicContact CG2-CD2 3.86Å; I118-L124 HydrophobicContact CG2-CG 4.07Å; I118-Y130 HydrophobicContact CD1-CD1 4.11Å; I118-Y130 HydrophobicContact CD1-CE1 3.77Å; I118-Y130 HydrophobicContact CG1-CD1 3.94Å; I118-Y130 HydrophobicContact CG1-CE1 4.1Å
119	T	82.2	Confident	81.5	Confident	80 Å²	80	63 Å²	63	49%	0.491	35%	0.348	S	S	.	.			trans	-112.7	-20.7	177.9	56.2	0	0	0	0	113.1	L85 Q123	L85-T119 WeakPolarHBondContact CD2-O 3.37Å; T119-Q123 PolarHBondContact OG1-NE2 2.81Å; T119-Q123 PolarHBondContact OG1-OE1 3.43Å
120	N	80.9	Confident	81.5	Confident	94 Å²	94	63.4 Å²	63.4	50%	0.503	35%	0.35	S	S	.	.	S	Bend	trans	-137.7	146.4	178.1	-73.6	-60.2	0	0	0	111.8	I118 E122 Q123	I118-N120 WeakPolarHBondContact CG2-O 3.47Å; N120-E122 PolarHBondContact O-N 3.3Å; N120-E122 VanDerWaalsContact O-N 3.15Å; N120-Q123 HydrophobicContact CB-CG 4.46Å; N120-Q123 VanDerWaalsContact N-OE1 3.11Å; N120-Q123 WeakPolarHBondContact O-CB 3.39Å; N120-Q123 PolarHBondContact O-N 2.85Å
121	I	81.3	Confident	81.5	Confident	21 Å²	21	61.1 Å²	61.1	11%	0.108	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-60.1	-25.2	177.8	-75.9	178.4	0	0	0	112.5	I77 F82 S84 L85 L88 Q123 L124	I77-I121 HydrophobicContact CG2-CG2 3.82Å; F82-I121 HydrophobicContact CB-CD1 3.63Å; S84-I121 VanDerWaalsContact O-CD1 3.3Å; S84-I121 WeakPolarHBondContact O-CD1 3.43Å; L85-I121 HydrophobicContact CB-CG1 4.37Å; L85-I121 HydrophobicContact CD1-CG1 4.09Å; L88-I121 HydrophobicContact CB-CD1 4.27Å; L88-I121 HydrophobicContact CD2-CD1 4.46Å; L88-I121 HydrophobicContact CD2-CG1 4.31Å; I121-Q123 VanDerWaalsContact C-N 3.29Å; I121-Q123 PolarHBondContact O-N 2.9Å; I121-L124 HydrophobicContact CG1-CD1 4.48Å; I121-L124 WeakPolarHBondContact O-CB 3.41Å; I121-L124 PolarHBondContact O-N 3.36Å
122	E	78	Confident	81.6	Confident	143 Å²	143	59.7 Å²	59.7	67%	0.668	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-66.9	-30.8	-179.7	-60.4	-175.3	158	0	0	112.7	K58 N120 L124	K58-E122 PolarHBondContact NZ-O 2.85Å; K58-E122 VanDerWaalsContact NZ-O 3.12Å; N120-E122 PolarHBondContact O-N 3.3Å; N120-E122 VanDerWaalsContact O-N 3.15Å; E122-L124 PolarHBondContact O-N 2.98Å
123	Q	81.3	Confident	81.8	Confident	84 Å²	84	58.6 Å²	58.6	39%	0.393	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-70.5	-12.7	176.2	-61.6	162.1	-12.1	0	0	113.5	I118 T119 N120 I121 Y130	I118-Q123 HydrophobicContact CD1-CB 4.21Å; I118-Q123 HydrophobicContact CG2-CB 4.39Å; T119-Q123 PolarHBondContact OG1-NE2 2.81Å; T119-Q123 PolarHBondContact OG1-OE1 3.43Å; N120-Q123 HydrophobicContact CB-CG 4.46Å; N120-Q123 VanDerWaalsContact N-OE1 3.11Å; N120-Q123 WeakPolarHBondContact O-CB 3.39Å; N120-Q123 PolarHBondContact O-N 2.85Å; I121-Q123 VanDerWaalsContact C-N 3.29Å; I121-Q123 PolarHBondContact O-N 2.9Å; Q123-Y130 PolarHBondContact O-OH 2.64Å
124	L	83.1	Confident	82.2	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	30%	0.3	C	S	.	.			trans	-79.2	127.5	174.8	-61.8	174.1	0	0	0	109.3	K58 I60 F62 I77 L88 I109 I118 I121 E122 Y130	K58-L124 WeakPolarHBondContact CD-O 3.39Å; K58-L124 WeakPolarHBondContact CE-O 3.31Å; K58-L124 PolarHBondContact NZ-O 3.04Å; I60-L124 HydrophobicContact CD1-CB 3.53Å; F62-L124 HydrophobicContact CZ-CD1 4.45Å; I77-L124 HydrophobicContact CD1-CD1 4Å; L88-L124 HydrophobicContact CD2-CD1 3.7Å; I109-L124 HydrophobicContact CG2-CD2 4.49Å; I118-L124 HydrophobicContact CB-CD2 4.48Å; I118-L124 HydrophobicContact CD1-CD2 4.44Å; I118-L124 HydrophobicContact CG1-CD2 4.01Å; I118-L124 HydrophobicContact CG2-CD2 3.86Å; I118-L124 HydrophobicContact CG2-CG 4.07Å; I121-L124 HydrophobicContact CG1-CD1 4.48Å; I121-L124 WeakPolarHBondContact O-CB 3.41Å; I121-L124 PolarHBondContact O-N 3.36Å; E122-L124 PolarHBondContact O-N 2.98Å; L124-Y130 WeakPolarHBondContact CA-OH 3.35Å; L124-Y130 HydrophobicContact CD2-CD1 3.95Å; L124-Y130 HydrophobicContact CD2-CD2 3.96Å; L124-Y130 HydrophobicContact CD2-CE1 3.87Å; L124-Y130 HydrophobicContact CD2-CE2 3.86Å; L124-Y130 HydrophobicContact CD2-CG 4.01Å
125	V	80.1	Confident	82.1	Confident	77 Å²	77	58.7 Å²	58.7	47%	0.467	32%	0.321	S	S	.	.			trans	-105.5	146.5	-174.8	-179.4	0	0	0	0	110.3	I60 E128 Y130	I60-V125 WeakPolarHBondContact CD1-O 3.48Å; I60-V125 WeakPolarHBondContact CG1-O 3.37Å; V125-E128 HydrophobicContact CB-CB 4.11Å; V125-E128 HydrophobicContact CB-CG 3.84Å; V125-E128 HydrophobicContact CG1-CG 4.01Å; V125-E128 PolarHBondContact O-N 3.38Å; V125-Y130 PolarHBondContact N-OH 3.26Å
126	E	77.3	Confident	81.8	Confident	104 Å²	104	56 Å²	56	49%	0.486	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	138.8	176.5	177.5	158.7	-142.2	0	0	111.6	K58 K59 E128	K58-E126 HydrophobicContact CB-CB 4.06Å; K58-E126 HydrophobicContact CG-CB 4.31Å; K59-E126 PolarHBondContact N-OE1 3.11Å; E126-E128 PolarHBondContact O-N 3.16Å
127	G	71.2	Confident	81.2	Confident	61 Å²	61	57.4 Å²	57.4	63%	0.629	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.1	-24.9	-173.3	0	0	0	0	0	113.6	K59	K59-G127 PolarHBondContact O-N 3.46Å
128	E	82.4	Confident	80.9	Confident	105 Å²	105	54.2 Å²	54.2	49%	0.491	30%	0.297	S	S	.	.			trans	-75.6	163.3	-170.6	-80	-55.3	149	0	0	115.6	R61 V125 E126 Y130	R61-E128 PolarHBondContact N-O 3.15Å; V125-E128 HydrophobicContact CB-CB 4.11Å; V125-E128 HydrophobicContact CB-CG 3.84Å; V125-E128 HydrophobicContact CG1-CG 4.01Å; V125-E128 PolarHBondContact O-N 3.38Å; E126-E128 PolarHBondContact O-N 3.16Å; E128-Y130 HydrophobicContact CB-CE2 3.69Å
129	S	85.9	Confident	80.4	Confident	21 Å²	21	58 Å²	58	15%	0.147	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	139.6	-177.9	-68	0	0	0	0	112.5	R61 V112	R61-S129 WeakPolarHBondContact O-CA 3.36Å; V112-S129 WeakPolarHBondContact CG2-O 3.37Å
130	Y	87.8	Confident	79.9	Confident	10 Å²	10	61.8 Å²	61.8	4%	0.039	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	156.9	-177.7	-60.6	-88.6	0	0	0	111	I60 R61 F62 Y63 I109 Y110 T111 I118 Q123 L124 V125 E128	I60-Y130 HydrophobicContact CG2-CD2 3.41Å; I60-Y130 VanDerWaalsContact CG2-CD2 3.41Å; I60-Y130 HydrophobicContact CG2-CE2 3.65Å; R61-Y130 PolarHBondContact O-N 2.89Å; F62-Y130 CarbonylContact C-O 3.6Å; F62-Y130 WeakPolarHBondContact CA-O 3.3Å; F62-Y130 HydrophobicContact CE1-CD2 4.44Å; F62-Y130 HydrophobicContact CE1-CG 4.43Å; Y63-Y130 PolarHBondContact N-O 3.35Å; I109-Y130 HydrophobicContact CG2-CD1 4.3Å; I109-Y130 HydrophobicContact CG2-CG 4.24Å; Y110-Y130 CarbonylContact O-C 3.56Å; Y110-Y130 VanDerWaalsContact O-CA 3.3Å; Y110-Y130 WeakPolarHBondContact O-CA 3.48Å; Y110-Y130 WeakPolarHBondContact O-CB 3.45Å; T111-Y130 HydrophobicContact CG2-CD1 4.14Å; T111-Y130 HydrophobicContact CG2-CE1 3.88Å; I118-Y130 HydrophobicContact CD1-CD1 4.11Å; I118-Y130 HydrophobicContact CD1-CE1 3.77Å; I118-Y130 HydrophobicContact CG1-CD1 3.94Å; I118-Y130 HydrophobicContact CG1-CE1 4.1Å; Q123-Y130 PolarHBondContact O-OH 2.64Å; L124-Y130 WeakPolarHBondContact CA-OH 3.35Å; L124-Y130 HydrophobicContact CD2-CD1 3.95Å; L124-Y130 HydrophobicContact CD2-CD2 3.96Å; L124-Y130 HydrophobicContact CD2-CE1 3.87Å; L124-Y130 HydrophobicContact CD2-CE2 3.86Å; L124-Y130 HydrophobicContact CD2-CG 4.01Å; V125-Y130 PolarHBondContact N-OH 3.26Å; E128-Y130 HydrophobicContact CB-CE2 3.69Å
131	V	86.6	Confident	79.5	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	119.8	-178.2	-177.6	0	0	0	0	109.6	N65 I109 Y110 V112 F138 Y143	N65-V131 HydrophobicContact CB-CG1 4.03Å; I109-V131 WeakPolarHBondContact CA-O 3.47Å; Y110-V131 PolarHBondContact N-O 3.39Å; Y110-V131 PolarHBondContact O-N 2.97Å; V112-V131 HydrophobicContact CG2-CG2 4.4Å; V131-F138 HydrophobicContact CB-CE2 4Å; V131-F138 HydrophobicContact CG1-CD2 4.4Å; V131-F138 HydrophobicContact CG1-CE2 4.08Å; V131-F138 HydrophobicContact CG2-CE2 4.03Å; V131-Y143 HydrophobicContact CG1-CE1 4.42Å; V131-Y143 HydrophobicContact CG1-CE2 4.22Å; V131-Y143 HydrophobicContact CG2-CD2 3.66Å; V131-Y143 HydrophobicContact CG2-CE2 3.86Å; V131-Y143 HydrophobicContact CG2-CG 4.06Å
132	C	87.8	Confident	78.8	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	128.3	173.7	-69.9	0	0	0	0	110.3	Y63 N65 L96 V106	Y63-C132 WeakPolarHBondContact O-CB 3.36Å; Y63-C132 PolarHBondContact O-N 3.46Å; N65-C132 WeakPolarHBondContact CB-O 3.45Å; N65-C132 PolarHBondContact N-O 3.28Å; L96-C132 HydrophobicContact CD1-CB 3.85Å; V106-C132 HydrophobicContact CB-CB 4.4Å; V106-C132 HydrophobicContact CG1-CB 3.63Å; V106-C132 HydrophobicContact CG2-CB 3.84Å
133	A	84.4	Confident	78.4	Confident	0 Å²	0	58 Å²	58	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	152.4	178	0	0	0	0	0	111.7	N65 R107 T108 Y110	N65-A133 HydrophobicContact CB-CB 3.91Å; R107-A133 PolarHBondContact N-O 3.3Å; T108-A133 PolarHBondContact N-O 3.16Å; T108-A133 PolarHBondContact O-N 2.89Å; Y110-A133 HydrophobicContact CD2-CB 4.02Å; Y110-A133 HydrophobicContact CE2-CB 3.87Å
134	S	83.9	Confident	77.7	Confident	3 Å²	3	57.5 Å²	57.5	2%	0.021	31%	0.309	C	S	.	.			trans	-79.2	-143.9	167	-177.2	0	0	0	0	109.2	Q104 G105 E136	Q104-S134 PolarHBondContact N-OG 3.19Å; G105-S134 WeakPolarHBondContact O-CA 3.38Å; S134-E136 VanDerWaalsContact C-N 3.26Å
135	I	76.2	Confident	76.3	Confident	118 Å²	118	64.2 Å²	64.2	61%	0.605	34%	0.338	S	S	*	.	S	Bend	trans	-77.8	-7.3	166.6	59.8	161.6	0	0	0	113.7
136	E	71.3	Confident	74.5	Confident	64 Å²	64	65.3 Å²	65.3	30%	0.299	34%	0.341	S	S	.	.	S	Bend	trans	-70.6	147.7	178.6	-66.7	-163.8	152.9	0	0	112.7	S134 K139	S134-E136 VanDerWaalsContact C-N 3.26Å; E136-K139 IonicContact OE1-NZ 2.76Å; E136-K139 WeakPolarHBondContact OE2-CE 3.49Å; E136-K139 IonicContact OE2-NZ 2.72Å; E136-K139 PolarHBondContact OE2-NZ 2.89Å
137	P	69.9	Low	72.5	Confident	101 Å²	101	67.1 Å²	67.1	66%	0.656	36%	0.359	S	S	*	.	P	Polyproline II helix	trans	-61.7	152.1	172.6	27.8	-35.6	0	0	0	111.8	N65 K139	N65-P137 PolarHBondContact ND2-O 3.26Å; P137-K139 PolarHBondContact O-N 3.16Å
138	F	78.8	Confident	70.5	Confident	44 Å²	44	69.5 Å²	69.5	19%	0.193	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-61.7	125.2	177.1	175.5	-92.2	0	0	0	111.4	Y110 V112 G114 V131 K140 Y143	Y110-F138 HydrophobicContact CD2-CB 4.43Å; Y110-F138 HydrophobicContact CD2-CD2 4.26Å; Y110-F138 HydrophobicContact CE2-CB 4.42Å; Y110-F138 HydrophobicContact CG-CD2 4.18Å; V112-F138 WeakPolarHBondContact O-CZ 3.42Å; G114-F138 VanDerWaalsContact CA-CZ 3.45Å; V131-F138 HydrophobicContact CB-CE2 4Å; V131-F138 HydrophobicContact CG1-CD2 4.4Å; V131-F138 HydrophobicContact CG1-CE2 4.08Å; V131-F138 HydrophobicContact CG2-CE2 4.03Å; F138-K140 HydrophobicContact CD1-CB 4.4Å; F138-K140 VanDerWaalsContact CE1-CA 3.46Å; F138-K140 HydrophobicContact CE1-CB 3.78Å; F138-K140 HydrophobicContact CE1-CG 4.19Å; F138-Y143 HydrophobicContact CE2-CE2 4.02Å; F138-Y143 AromaticContact CZ-CE2 3.93Å; F138-Y143 HydrophobicContact CZ-CE2 3.93Å
139	K	77.9	Confident	68.2	Low	88 Å²	88	69.7 Å²	69.7	38%	0.383	37%	0.368	S	S	.	.			trans	-95.5	110.6	176.4	-70.3	162.3	176.4	165.5	0	107.9	N65 E136 P137 L141 Y143	N65-K139 PolarHBondContact OD1-N 3.43Å; E136-K139 IonicContact OE1-NZ 2.76Å; E136-K139 WeakPolarHBondContact OE2-CE 3.49Å; E136-K139 IonicContact OE2-NZ 2.72Å; E136-K139 PolarHBondContact OE2-NZ 2.89Å; P137-K139 PolarHBondContact O-N 3.16Å; K139-L141 PolarHBondContact O-N 3.24Å; K139-Y143 WeakPolarHBondContact O-CE2 3.19Å; K139-Y143 PolarHBondContact O-OH 2.94Å
140	K	71.8	Confident	65.5	Low	160 Å²	160	75.1 Å²	75.1	70%	0.696	40%	0.395	S	S	*	.			trans	-72.4	110.4	-179.9	-170.1	165.9	-176.6	165.6	0	110.6	F138	F138-K140 HydrophobicContact CD1-CB 4.4Å; F138-K140 VanDerWaalsContact CE1-CA 3.46Å; F138-K140 HydrophobicContact CE1-CB 3.78Å; F138-K140 HydrophobicContact CE1-CG 4.19Å
141	L	71.7	Confident	62.8	Low	63 Å²	63	85.9 Å²	85.9	33%	0.33	44%	0.436	S	S	.	.			trans	-138.9	157.5	-179.1	-61.9	173.3	0	0	0	109.3	R68 K139 Y143	R68-L141 HydrophobicContact CB-CD1 4.42Å; K139-L141 PolarHBondContact O-N 3.24Å; L141-Y143 HydrophobicContact CB-CD2 4.3Å; L141-Y143 HydrophobicContact CB-CE1 4.17Å; L141-Y143 HydrophobicContact CB-CE2 3.89Å; L141-Y143 HydrophobicContact CD1-CE1 4.19Å; L141-Y143 WeakPolarHBondContact O-CD2 3.15Å; L141-Y143 PolarHBondContact O-N 3.39Å
142	D	68.3	Low	60.1	Low	105 Å²	105	90.7 Å²	90.7	56%	0.561	48%	0.476	S	S	*	.			trans	-76.3	62.3	177.2	-73.6	-35.3	0	0	0	112.3	T144 K145	D142-T144 PolarHBondContact O-N 3.28Å; D142-K145 HydrophobicContact CB-CB 4.11Å; D142-K145 HydrophobicContact CB-CD 3.76Å; D142-K145 HydrophobicContact CB-CG 3.92Å; D142-K145 VanDerWaalsContact CG-NZ 3.33Å; D142-K145 PolarHBondContact O-N 2.99Å; D142-K145 VanDerWaalsContact O-N 3.12Å; D142-K145 IonicContact OD1-NZ 2.69Å; D142-K145 WeakPolarHBondContact OD2-CD 3.42Å; D142-K145 WeakPolarHBondContact OD2-CE 3.36Å; D142-K145 IonicContact OD2-NZ 2.87Å; D142-K145 PolarHBondContact OD2-NZ 3.4Å
143	Y	69.6	Low	57.5	Low	10 Å²	10	97.5 Å²	97.5	4%	0.039	52%	0.517	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-26.7	-176	-63.9	-74.7	0	0	0	114.1	Y63 R64 N65 G66 D67 V131 F138 K139 L141	Y63-Y143 HydrophobicContact CD1-CD1 4.5Å; Y63-Y143 WeakPolarHBondContact CE1-O 3.16Å; Y63-Y143 PolarHBondContact OH-O 3.36Å; R64-Y143 VanDerWaalsContact O-CE1 3.32Å; R64-Y143 WeakPolarHBondContact O-CE1 3.44Å; N65-Y143 PolarHBondContact OD1-OH 2.99Å; G66-Y143 PolarHBondContact N-OH 2.82Å; D67-Y143 WeakPolarHBondContact O-CD1 3.31Å; D67-Y143 WeakPolarHBondContact O-CE1 3.22Å; V131-Y143 HydrophobicContact CG1-CE1 4.42Å; V131-Y143 HydrophobicContact CG1-CE2 4.22Å; V131-Y143 HydrophobicContact CG2-CD2 3.66Å; V131-Y143 HydrophobicContact CG2-CE2 3.86Å; V131-Y143 HydrophobicContact CG2-CG 4.06Å; F138-Y143 HydrophobicContact CE2-CE2 4.02Å; F138-Y143 AromaticContact CZ-CE2 3.93Å; F138-Y143 HydrophobicContact CZ-CE2 3.93Å; K139-Y143 WeakPolarHBondContact O-CE2 3.19Å; K139-Y143 PolarHBondContact O-OH 2.94Å; L141-Y143 HydrophobicContact CB-CD2 4.3Å; L141-Y143 HydrophobicContact CB-CE1 4.17Å; L141-Y143 HydrophobicContact CB-CE2 3.89Å; L141-Y143 HydrophobicContact CD1-CE1 4.19Å; L141-Y143 WeakPolarHBondContact O-CD2 3.15Å; L141-Y143 PolarHBondContact O-N 3.39Å
144	T	64.9	Low	54.8	Low	73 Å²	73	101.6 Å²	101.6	45%	0.448	56%	0.56	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93.3	-5.8	-177.1	49.5	0	0	0	0	114.7	V112 D142 N146	V112-T144 HydrophobicContact CG1-CG2 3.96Å; V112-T144 HydrophobicContact CG2-CG2 4.04Å; D142-T144 PolarHBondContact O-N 3.28Å; T144-N146 VanDerWaalsContact C-N 3.32Å; T144-N146 PolarHBondContact O-N 3.26Å
145	K	53.8	Low	52.1	Low	142 Å²	142	105.4 Å²	105.4	62%	0.617	59%	0.591	S	S	*	*			trans	-78	78.6	178.9	-76.3	-173.9	-171.1	160.2	0	112.1	D142 V147	D142-K145 HydrophobicContact CB-CB 4.11Å; D142-K145 HydrophobicContact CB-CD 3.76Å; D142-K145 HydrophobicContact CB-CG 3.92Å; D142-K145 VanDerWaalsContact CG-NZ 3.33Å; D142-K145 PolarHBondContact O-N 2.99Å; D142-K145 VanDerWaalsContact O-N 3.12Å; D142-K145 IonicContact OD1-NZ 2.69Å; D142-K145 WeakPolarHBondContact OD2-CD 3.42Å; D142-K145 WeakPolarHBondContact OD2-CE 3.36Å; D142-K145 IonicContact OD2-NZ 2.87Å; D142-K145 PolarHBondContact OD2-NZ 3.4Å; K145-V147 PolarHBondContact O-N 2.79Å
146	N	43	Very low	49.9	Very low	99 Å²	99	111.7 Å²	111.7	53%	0.529	61%	0.607	S	S	.	*			trans	-59.5	116.2	161.9	-76.5	13.7	0	0	0	109.7	T144 N148	T144-N146 VanDerWaalsContact C-N 3.32Å; T144-N146 PolarHBondContact O-N 3.26Å; N146-N148 PolarHBondContact O-N 3.36Å
147	V	35.5	Very low	47.8	Very low	142 Å²	142	115.6 Å²	115.6	86%	0.861	64%	0.636	S	S	*	*			trans	-73.7	84.8	164.7	-177.6	0	0	0	0	108.2	K145	K145-V147 PolarHBondContact O-N 2.79Å
148	N	29.8	Very low	45.8	Very low	112 Å²	112	115.8 Å²	115.8	60%	0.599	65%	0.646	S	S	*	*			trans	-98.4	110.2	171.8	-120.3	67.8	0	0	0	107.9	N146 N150	N146-N148 PolarHBondContact O-N 3.36Å; N148-N150 PolarHBondContact O-N 3.34Å
149	P	33.4	Very low	43.4	Very low	109 Å²	109	118.5 Å²	118.5	71%	0.708	68%	0.677	S	S	*	*			trans	-73.5	90.6	172.8	29.7	-32.8	0	0	0	109.6
150	N	28.5	Very low	41.1	Very low	134 Å²	134	119.5 Å²	119.5	72%	0.717	70%	0.695	S	S	*	*			trans	-76.9	130.8	173.2	-74.2	-6.3	0	0	0	110.7	N148	N148-N150 PolarHBondContact O-N 3.34Å
151	W	31.8	Very low	39.1	Very low	236 Å²	236	116.9 Å²	116.9	89%	0.894	69%	0.692	S	S	*	*			trans	-137.2	82.1	152.7	33.8	-91.7	0	0	0	110.6
152	A	29.4	Very low	37.1	Very low	102 Å²	102	125 Å²	125	84%	0.843	72%	0.718	S	S	*	*			trans	-115.6	82.8	158.3	0	0	0	0	0	107.6
153	V	33.2	Very low	35	Very low	143 Å²	143	126.9 Å²	126.9	87%	0.867	73%	0.728	S	S	*	*			trans	-135.3	113.5	173.8	-175.7	0	0	0	0	108.3
154	G	27.1	Very low	33.6	Very low	86 Å²	86	131.6 Å²	131.6	89%	0.887	76%	0.76	S	S	*	*			trans	-151.1	43.3	-175.9	0	0	0	0	0	111.9
155	A	28.2	Very low	31.7	Very low	83 Å²	83	132.4 Å²	132.4	69%	0.686	77%	0.768	S	S	*	*			trans	-145.8	101.9	-177.5	0	0	0	0	0	113
156	R	29.4	Very low	30.5	Very low	249 Å²	249	130.6 Å²	130.6	94%	0.94	77%	0.774	S	S	*	*			trans	48	102.2	144.6	-55.7	179.7	-177.4	-172.7	-0.5	118.5
157	T	28.2	Very low	29.8	Very low	147 Å²	147	134.2 Å²	134.2	90%	0.902	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-88.9	144.9	144.5	36.2	0	0	0	0	110.3
158	A	28.2	Very low	29.3	Very low	104 Å²	104	131 Å²	131	86%	0.86	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-91.9	159.5	170	0	0	0	0	0	110.9
159	A	28.6	Very low	29.1	Very low	102 Å²	102	131.4 Å²	131.4	84%	0.843	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-68.4	151.3	-165.2	0	0	0	0	0	115.9
160	S	28.2	Very low	29	Very low	109 Å²	109	130.2 Å²	130.2	76%	0.762	80%	0.799	S	S	*	*			trans	-160.2	102.3	133.7	-159.8	0	0	0	0	114.2
161	V	30.8	Very low	29.1	Very low	104 Å²	104	132.3 Å²	132.3	63%	0.63	81%	0.806	S	S	*	*				68.8	121.3	129.7	177.2	0	0	0	0	122.1
162	R	29.8	Very low	29.1	Very low	233 Å²	233	125.7 Å²	125.7	88%	0.879	80%	0.802	S	S	*	*			trans	80.2	111	148.5	-90.6	177.5	-80	-153.5	-5.4	122.9
163	D	24.3	Very low	28.9	Very low	146 Å²	146	124.2 Å²	124.2	78%	0.781	80%	0.796	S	S	*	*			trans	-53.9	167.8	133.9	-85.8	-60.1	0	0	0	113
164	P	39.2	Very low	28.7	Very low	108 Å²	108	122.6 Å²	122.6	70%	0.701	79%	0.792	S	S	*	*			cis	-148.4	170.9	30.7	44.1	-24.1	0	0	0	120.3
165	S	25.8	Very low	29	Very low	90 Å²	90	124.4 Å²	124.4	63%	0.629	79%	0.787	S	S	*	*			trans	52	112.7	139.3	67.7	0	0	0	0	123.6
166	S	28.1	Very low	29.1	Very low	104 Å²	104	128.8 Å²	128.8	73%	0.727	79%	0.794	S	S	*	*				77.6	149.2	125.3	76.2	0	0	0	0	123
167	L	27.6	Very low	29.2	Very low	175 Å²	175	123.1 Å²	123.1	92%	0.916	79%	0.787	S	S	*	*			trans	70.4	138.4	162	-64.9	167.3	0	0	0	120.2
168	G	25.1	Very low	29.6	Very low	74 Å²	74	127 Å²	127	76%	0.763	79%	0.785	S	S	*	*			trans	111.5	89.2	135.5	0	0	0	0	0	120.6
169	S	27.6	Very low	30	Very low	122 Å²	122	126.2 Å²	126.2	85%	0.853	76%	0.764	S	S	*	*			trans	52	125.6	139.2	-147.8	0	0	0	0	123.6
170	A	30.7	Very low	30.4	Very low	84 Å²	84	126.1 Å²	126.1	69%	0.694	75%	0.753	S	S	*	*			trans	17	129.5	146	0	0	0	0	0	120.7
171	M	29.3	Very low	31.4	Very low	178 Å²	178	127.2 Å²	127.2	88%	0.877	74%	0.744	S	S	*	*				-167	156.9	77.5	-105	-64.3	-174.4	0	0	115.4
172	A	32	Very low	32	Very low	97 Å²	97	128 Å²	128	80%	0.802	74%	0.744	S	S	*	*			trans	27.6	120.6	156.5	0	0	0	0	0	121.6
173	G	26.1	Very low	33.3	Very low	70 Å²	70	120.4 Å²	120.4	72%	0.722	72%	0.718	S	S	*	*			trans	-176.7	60.9	171.5	0	0	0	0	0	118.3
174	S	28.6	Very low	34.9	Very low	110 Å²	110	114.4 Å²	114.4	77%	0.769	69%	0.685	S	S	*	*			trans	66.1	152.8	172	78.9	0	0	0	0	118.2	E176	S174-E176 PolarHBondContact O-N 3.28Å
175	P	33.9	Very low	35.9	Very low	123 Å²	123	117.2 Å²	117.2	80%	0.799	69%	0.687	S	S	*	*			trans	-95.4	86.7	-178.7	36.5	-32.5	0	0	0	112.7	T177	P175-T177 PolarHBondContact O-N 2.96Å
176	E	29.1	Very low	38	Very low	175 Å²	175	117.7 Å²	117.7	82%	0.818	69%	0.687	S	S	*	*			trans	-68.9	113.6	157.3	-73.7	-164.4	145.6	0	0	109.2	S174 R178	S174-E176 PolarHBondContact O-N 3.28Å; E176-R178 VanDerWaalsContact C-N 3.32Å; E176-R178 PolarHBondContact O-N 2.91Å
177	T	31.4	Very low	40.1	Very low	130 Å²	130	114.4 Å²	114.4	80%	0.798	66%	0.66	S	S	*	*			trans	-69.6	88	174.2	33.6	0	0	0	0	110.6	P175 E179	P175-T177 PolarHBondContact O-N 2.96Å; T177-E179 PolarHBondContact O-N 2.93Å
178	R	37.2	Very low	42.3	Very low	228 Å²	228	109.5 Å²	109.5	86%	0.86	63%	0.634	S	S	*	*			trans	-60.9	82.4	162.7	-74.4	-177.3	169.6	-172.2	-2.9	110	E176 T180	E176-R178 VanDerWaalsContact C-N 3.32Å; E176-R178 PolarHBondContact O-N 2.91Å; R178-T180 PolarHBondContact O-N 2.77Å
179	E	37.1	Very low	44.8	Very low	89 Å²	89	106 Å²	106	42%	0.416	60%	0.598	S	S	.	*			trans	-63.1	109.1	170	-72.2	-150.1	118.6	0	0	109.5	T177 K181 Q247	T177-E179 PolarHBondContact O-N 2.93Å; E179-K181 PolarHBondContact O-N 2.75Å; E179-Q247 PolarHBondContact OE1-NE2 3.13Å
180	T	37.4	Very low	47.3	Very low	99 Å²	99	101.1 Å²	101.1	61%	0.607	56%	0.564	S	S	*	*			trans	-67.4	94.4	-179.4	20.1	0	0	0	0	110.2	R178 D182 F183	R178-T180 PolarHBondContact O-N 2.77Å; T180-D182 PolarHBondContact O-N 2.96Å; T180-F183 WeakPolarHBondContact O-CD1 3.14Å; T180-F183 WeakPolarHBondContact O-CE1 3.48Å
181	K	48.7	Very low	49.7	Very low	132 Å²	132	97.1 Å²	97.1	57%	0.574	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	12.1	-173.4	-69.9	-177.6	176.2	178.2	0	115.9	E179 R208	E179-K181 PolarHBondContact O-N 2.75Å; K181-R208 WeakPolarHBondContact O-CD 3.11Å; K181-R208 PolarHBondContact O-NE 3.05Å; K181-R208 PolarHBondContact O-NH1 3.5Å; K181-R208 PolarHBondContact O-NH2 3.16Å
182	D	43.9	Very low	52.1	Low	120 Å²	120	89.3 Å²	89.3	64%	0.642	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.2	-6.9	-171.7	-62.2	-63.4	0	0	0	115.1	T180 R208	T180-D182 PolarHBondContact O-N 2.96Å; D182-R208 IonicContact OD1-CZ 3.27Å; D182-R208 IonicContact OD1-NH1 2.68Å; D182-R208 PolarHBondContact OD1-NH1 2.94Å; D182-R208 IonicContact OD1-NH2 3.93Å; D182-R208 PolarHBondContact OD1-NH2 2.8Å
183	F	57.1	Low	54.3	Low	74 Å²	74	86.7 Å²	86.7	33%	0.325	46%	0.462	S	S	.	.	S	Bend	trans	-82.6	-14	173.9	65.5	-97.1	0	0	0	114.2	T180 K185 Q247 F250	T180-F183 WeakPolarHBondContact O-CD1 3.14Å; T180-F183 WeakPolarHBondContact O-CE1 3.48Å; F183-K185 PolarHBondContact O-N 3.45Å; F183-Q247 HydrophobicContact CE1-CG 3.89Å; F183-Q247 HydrophobicContact CE2-CG 4.02Å; F183-Q247 HydrophobicContact CZ-CB 4.38Å; F183-Q247 HydrophobicContact CZ-CG 3.44Å; F183-Q247 VanDerWaalsContact CZ-CG 3.44Å; F183-F250 HydrophobicContact CD2-CB 4.5Å; F183-F250 HydrophobicContact CE2-CD2 4.03Å
184	I	57.9	Low	56.3	Low	20 Å²	20	84.3 Å²	84.3	10%	0.103	43%	0.434	C	S	.	.			trans	-77.5	80.8	-167.3	-49.4	175.1	0	0	0	112	R208 L246 F250	I184-R208 HydrophobicContact CB-CB 4.08Å; I184-R208 HydrophobicContact CB-CG 4.46Å; I184-R208 HydrophobicContact CG2-CB 4.18Å; I184-R208 VanDerWaalsContact CG2-N 3.33Å; I184-L246 HydrophobicContact CD1-CD2 3.71Å; I184-L246 HydrophobicContact CG1-CD2 4.35Å; I184-F250 HydrophobicContact CG2-CE1 3.9Å; I184-F250 HydrophobicContact CG2-CE2 3.94Å; I184-F250 HydrophobicContact CG2-CZ 3.5Å
185	K	59.9	Low	58.2	Low	168 Å²	168	80.4 Å²	80.4	73%	0.73	41%	0.411	S	S	*	.			trans	-72.4	148.8	165.3	-65.3	178.2	-179.3	176.2	0	110.3	F183 K187 F250	F183-K185 PolarHBondContact O-N 3.45Å; K185-K187 PolarHBondContact O-N 3.35Å; K185-F250 VanDerWaalsContact O-CE1 3.25Å; K185-F250 WeakPolarHBondContact O-CE1 3.45Å
186	P	69.1	Low	59.2	Low	99 Å²	99	80 Å²	80	64%	0.643	41%	0.406	S	S	*	.			trans	-59.4	124.6	172.5	-21	32.8	0	0	0	111.4	L205 L206 N207	P186-L205 HydrophobicContact CB-CD1 4.37Å; P186-L206 CarbonylContact C-O 3.59Å; P186-L206 WeakPolarHBondContact CA-O 3.35Å; P186-N207 HydrophobicContact CB-CB 3.91Å; P186-N207 HydrophobicContact CG-CB 4.07Å
187	K	72.6	Confident	60.3	Low	35 Å²	35	76.7 Å²	76.7	15%	0.152	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	129.8	-179.1	-163.3	-175.6	-174.7	-166.6	0	110.8	K185 V189 L206 F249 F250 A251 D253 D254	K185-K187 PolarHBondContact O-N 3.35Å; K187-V189 HydrophobicContact CD-CG1 4.22Å; K187-V189 HydrophobicContact CG-CG1 4.35Å; K187-L206 PolarHBondContact N-O 3.26Å; K187-L206 PolarHBondContact O-N 3.41Å; K187-F249 WeakPolarHBondContact CD-O 3.42Å; K187-F250 HydrophobicContact CB-CD1 3.84Å; K187-F250 HydrophobicContact CB-CE1 3.79Å; K187-F250 HydrophobicContact CD-CD1 4.3Å; K187-A251 PolarHBondContact NZ-O 2.8Å; K187-D253 PolarHBondContact NZ-O 2.88Å; K187-D254 WeakPolarHBondContact CE-OD1 3.08Å; K187-D254 IonicContact NZ-OD1 2.72Å; K187-D254 PolarHBondContact NZ-OD1 2.88Å
188	L	73.3	Confident	61.3	Low	72 Å²	72	76.7 Å²	76.7	38%	0.377	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	97.7	179.9	-178.1	60.9	0	0	0	110.2	R203 L205	L188-R203 HydrophobicContact CD1-CB 3.93Å; L188-R203 HydrophobicContact CG-CB 4.36Å; L188-L205 HydrophobicContact CB-CD1 4.27Å; L188-L205 HydrophobicContact CD1-CB 4.27Å
189	V	79	Confident	62.6	Low	0 Å²	0	67.4 Å²	67.4	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	144.7	-178.7	-58.5	0	0	0	0	111.3	K187 I191 R203 V204 L206 F256	K187-V189 HydrophobicContact CD-CG1 4.22Å; K187-V189 HydrophobicContact CG-CG1 4.35Å; V189-I191 HydrophobicContact CG2-CD1 4.1Å; V189-I191 HydrophobicContact CG2-CG1 4.12Å; V189-R203 CarbonylContact O-C 3.54Å; V189-R203 WeakPolarHBondContact O-CA 3.49Å; V189-V204 HydrophobicContact CG2-CB 4.19Å; V189-V204 WeakPolarHBondContact CG2-O 3.14Å; V189-V204 PolarHBondContact N-O 2.87Å; V189-V204 PolarHBondContact O-N 2.89Å; V189-L206 HydrophobicContact CG1-CD1 4.15Å; V189-L206 HydrophobicContact CG2-CD1 3.73Å; V189-L206 HydrophobicContact CG2-CG 4.04Å; V189-F256 HydrophobicContact CB-CD2 3.91Å; V189-F256 HydrophobicContact CB-CE2 3.71Å; V189-F256 HydrophobicContact CG1-CD2 4.32Å; V189-F256 HydrophobicContact CG1-CE2 3.62Å; V189-F256 HydrophobicContact CG1-CZ 4.48Å
190	T	78.6	Confident	63.9	Low	21 Å²	21	67.8 Å²	67.8	13%	0.129	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	126.5	177	-54.9	0	0	0	0	109.4	A201 R203 D254 I255 F256	T190-A201 HydrophobicContact CG2-CB 4.48Å; T190-R203 HydrophobicContact CG2-CG 4.25Å; T190-D254 PolarHBondContact N-O 3.09Å; T190-I255 CarbonylContact O-C 3.56Å; T190-I255 VanDerWaalsContact O-CA 3.31Å; T190-I255 WeakPolarHBondContact O-CA 3.34Å; T190-F256 PolarHBondContact O-N 3.35Å
191	I	81.8	Confident	65.6	Low	0 Å²	0	65.6 Å²	65.6	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	120.1	-172.5	-41.8	178.9	0	0	0	109.7	V189 A201 V202 V204 I221 I225 L235 F256 A258	V189-I191 HydrophobicContact CG2-CD1 4.1Å; V189-I191 HydrophobicContact CG2-CG1 4.12Å; I191-A201 CarbonylContact O-C 3.6Å; I191-A201 WeakPolarHBondContact O-CA 3.35Å; I191-V202 PolarHBondContact N-O 3.43Å; I191-V202 PolarHBondContact O-N 2.83Å; I191-V204 HydrophobicContact CD1-CB 4.28Å; I191-V204 HydrophobicContact CD1-CG2 3.92Å; I191-I221 HydrophobicContact CD1-CB 4.27Å; I191-I221 HydrophobicContact CD1-CD1 3.49Å; I191-I221 VanDerWaalsContact CD1-CD1 3.49Å; I191-I221 HydrophobicContact CD1-CG1 3.51Å; I191-I221 HydrophobicContact CD1-CG2 3.76Å; I191-I221 HydrophobicContact CG2-CG2 4.23Å; I191-I225 HydrophobicContact CB-CD1 3.91Å; I191-I225 HydrophobicContact CG2-CD1 3.47Å; I191-I225 VanDerWaalsContact CG2-CD1 3.47Å; I191-L235 HydrophobicContact CG2-CD2 3.65Å; I191-F256 CarbonylContact C-O 3.45Å; I191-F256 VanDerWaalsContact CA-O 3.3Å; I191-F256 WeakPolarHBondContact CA-O 3.21Å; I191-F256 HydrophobicContact CG2-CB 4.3Å; I191-A258 HydrophobicContact CG2-CB 3.88Å
192	V	79	Confident	66.6	Low	13 Å²	13	60.8 Å²	60.8	8%	0.079	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	135.9	-174.1	-173.9	0	0	0	0	109.5	R199 A201 I255 F256 I257 A258	V192-R199 HydrophobicContact CG1-CB 4.06Å; V192-A201 HydrophobicContact CG2-CB 4.21Å; V192-I255 HydrophobicContact CG2-CG2 4.24Å; V192-F256 PolarHBondContact N-O 2.91Å; V192-I257 CarbonylContact O-C 3.48Å; V192-I257 WeakPolarHBondContact O-CA 3.31Å; V192-A258 PolarHBondContact O-N 2.91Å
193	R	78.5	Confident	68.1	Low	42 Å²	42	63.2 Å²	63.2	16%	0.158	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	125.5	173.3	167.5	166.1	171.6	174.2	-12.5	111.3	R199 K200 I225 K226 L227 D228	R193-R199 WeakPolarHBondContact O-CG 3.37Å; R193-K200 WeakPolarHBondContact CB-O 3.21Å; R193-K200 PolarHBondContact N-O 2.8Å; R193-I225 HydrophobicContact CB-CG2 4.04Å; R193-K226 PolarHBondContact NH1-O 3.01Å; R193-L227 HydrophobicContact CB-CD2 4.24Å; R193-L227 HydrophobicContact CG-CD2 3.59Å; R193-D228 IonicContact CZ-OD1 3.48Å; R193-D228 IonicContact CZ-OD2 3.63Å; R193-D228 VanDerWaalsContact NH1-CG 3.28Å; R193-D228 IonicContact NH1-OD1 3.77Å; R193-D228 PolarHBondContact NH1-OD1 3.5Å; R193-D228 IonicContact NH1-OD2 3.62Å; R193-D228 PolarHBondContact NH1-OD2 2.84Å; R193-D228 IonicContact NH2-OD1 2.74Å; R193-D228 PolarHBondContact NH2-OD1 3.42Å; R193-D228 IonicContact NH2-OD2 3.75Å; R193-D228 PolarHBondContact NH2-OD2 3.39Å
194	S	69.3	Low	69	Low	20 Å²	20	60.9 Å²	60.9	14%	0.14	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-63.9	149.9	168	-132.5	0	0	0	0	111.6	A258 C259 D269	S194-A258 WeakPolarHBondContact CB-O 3.39Å; S194-A258 PolarHBondContact N-O 3.35Å; S194-C259 PolarHBondContact OG-SG 3.36Å; S194-D269 WeakPolarHBondContact CB-OD2 3.36Å; S194-D269 VanDerWaalsContact OG-CG 3.24Å; S194-D269 PolarHBondContact OG-OD2 2.88Å
195	G	68.4	Low	69.7	Low	28 Å²	28	64.3 Å²	64.3	29%	0.289	34%	0.341	S	S	.	.	S	Bend	trans	103.3	-156.1	174.1	0	0	0	0	0	115.2	R199 D269	G195-R199 PolarHBondContact O-NE 3.35Å; G195-D269 WeakPolarHBondContact CA-OD1 3.27Å; G195-D269 VanDerWaalsContact N-CG 3.35Å; G195-D269 PolarHBondContact N-OD1 2.87Å; G195-D269 PolarHBondContact N-OD2 3.32Å; G195-D269 VanDerWaalsContact N-OD2 3.12Å
196	V	55.2	Low	70.5	Confident	115 Å²	115	56.6 Å²	56.6	70%	0.697	31%	0.307	S	S	*	.	S	Bend	trans	-58.4	135.9	-169.6	-77.3	0	0	0	0	113.9
197	K	51.5	Low	70.5	Confident	105 Å²	105	53.3 Å²	53.3	46%	0.457	28%	0.284	S	S	.	.	S	Bend	trans	-70.6	148.1	174.5	-71.2	175.9	174.9	170	0	110.5	R199 D273 E276	K197-R199 HydrophobicContact CG-CG 4.2Å; K197-D273 IonicContact NZ-OD2 3.79Å; K197-D273 PolarHBondContact NZ-OD2 2.78Å; K197-E276 WeakPolarHBondContact CE-OE2 3.18Å; K197-E276 IonicContact NZ-OE2 2.89Å
198	P	51.5	Low	69.8	Low	131 Å²	131	57.6 Å²	57.6	85%	0.851	30%	0.299	S	S	*	.	S	Bend	cis	-76.3	128.3	1.8	30.7	-34.5	0	0	0	112.7	K200	P198-K200 PolarHBondContact O-N 2.88Å
199	R	65.4	Low	69.1	Low	33 Å²	33	62.7 Å²	62.7	13%	0.125	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-78.6	123.3	-177.8	-68.9	175.7	179.1	145.7	-4.6	110.6	V192 R193 G195 K197 D268 D269 E276	V192-R199 HydrophobicContact CG1-CB 4.06Å; R193-R199 WeakPolarHBondContact O-CG 3.37Å; G195-R199 PolarHBondContact O-NE 3.35Å; K197-R199 HydrophobicContact CG-CG 4.2Å; R199-D268 PolarHBondContact NH2-O 3.36Å; R199-D269 IonicContact CZ-OD1 2.78Å; R199-D269 IonicContact NE-OD1 2.89Å; R199-D269 IonicContact NH2-OD1 3.15Å; R199-D269 PolarHBondContact NH2-OD1 2.81Å; R199-E276 IonicContact NH1-OE2 2.66Å
200	K	63.4	Low	67.9	Low	96 Å²	96	64.3 Å²	64.3	42%	0.417	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-74.3	124.5	173	-179.5	-175.5	165.4	-163.7	0	109.9	R193 P198 V202 A224 I225	R193-K200 WeakPolarHBondContact CB-O 3.21Å; R193-K200 PolarHBondContact N-O 2.8Å; P198-K200 PolarHBondContact O-N 2.88Å; K200-V202 HydrophobicContact CG-CG2 4.4Å; K200-A224 PolarHBondContact NZ-O 2.82Å; K200-I225 PolarHBondContact NZ-O 3.04Å
201	A	73.5	Confident	67.2	Low	54 Å²	54	63.4 Å²	63.4	45%	0.446	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	148.2	169	0	0	0	0	0	111.1	T190 I191 V192	T190-A201 HydrophobicContact CG2-CB 4.48Å; I191-A201 CarbonylContact O-C 3.6Å; I191-A201 WeakPolarHBondContact O-CA 3.35Å; V192-A201 HydrophobicContact CG2-CB 4.21Å
202	V	70.6	Confident	66.3	Low	31 Å²	31	69.5 Å²	69.5	19%	0.188	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	134.2	177.7	-174.8	0	0	0	0	109.5	I191 K200 V204 A224 I225	I191-V202 PolarHBondContact N-O 3.43Å; I191-V202 PolarHBondContact O-N 2.83Å; K200-V202 HydrophobicContact CG-CG2 4.4Å; V202-V204 HydrophobicContact CG1-CG2 4.2Å; V202-A224 HydrophobicContact CG1-CB 4.18Å; V202-I225 HydrophobicContact CB-CG1 4.37Å; V202-I225 HydrophobicContact CG2-CG1 4.07Å
203	R	73.9	Confident	66.2	Low	171 Å²	171	71.2 Å²	71.2	65%	0.645	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95	131.3	174.1	-55.1	-178.7	80.4	-172	4.4	109.5	L188 V189 T190	L188-R203 HydrophobicContact CD1-CB 3.93Å; L188-R203 HydrophobicContact CG-CB 4.36Å; V189-R203 CarbonylContact O-C 3.54Å; V189-R203 WeakPolarHBondContact O-CA 3.49Å; T190-R203 HydrophobicContact CG2-CG 4.25Å
204	V	75.9	Confident	66	Low	25 Å²	25	71.4 Å²	71.4	15%	0.152	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	127.2	-173.1	-178.3	0	0	0	0	109.6	V189 I191 V202 L206	V189-V204 HydrophobicContact CG2-CB 4.19Å; V189-V204 WeakPolarHBondContact CG2-O 3.14Å; V189-V204 PolarHBondContact N-O 2.87Å; V189-V204 PolarHBondContact O-N 2.89Å; I191-V204 HydrophobicContact CD1-CB 4.28Å; I191-V204 HydrophobicContact CD1-CG2 3.92Å; V202-V204 HydrophobicContact CG1-CG2 4.2Å; V204-L206 HydrophobicContact CG1-CD2 3.97Å
205	L	73.9	Confident	66.3	Low	91 Å²	91	76.2 Å²	76.2	48%	0.476	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	106.3	178.9	-175.8	66.5	0	0	0	110.9	P186 L188 T210	P186-L205 HydrophobicContact CB-CD1 4.37Å; L188-L205 HydrophobicContact CB-CD1 4.27Å; L188-L205 HydrophobicContact CD1-CB 4.27Å; L205-T210 PolarHBondContact O-OG1 2.82Å
206	L	75.6	Confident	66.7	Low	6 Å²	6	79 Å²	79	3%	0.031	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	124.2	175.2	-56.7	179.1	0	0	0	109.2	P186 K187 V189 V204 A211 V217 F249 F250	P186-L206 CarbonylContact C-O 3.59Å; P186-L206 WeakPolarHBondContact CA-O 3.35Å; K187-L206 PolarHBondContact N-O 3.26Å; K187-L206 PolarHBondContact O-N 3.41Å; V189-L206 HydrophobicContact CG1-CD1 4.15Å; V189-L206 HydrophobicContact CG2-CD1 3.73Å; V189-L206 HydrophobicContact CG2-CG 4.04Å; V204-L206 HydrophobicContact CG1-CD2 3.97Å; L206-A211 HydrophobicContact CB-CB 4.29Å; L206-V217 HydrophobicContact CD1-CG1 4.33Å; L206-V217 HydrophobicContact CD2-CG1 3.75Å; L206-V217 HydrophobicContact CD2-CG2 4.1Å; L206-F249 HydrophobicContact CD1-CB 3.74Å; L206-F249 HydrophobicContact CD1-CD1 3.48Å; L206-F249 VanDerWaalsContact CD1-CD1 3.48Å; L206-F249 HydrophobicContact CD1-CD2 4.38Å; L206-F249 HydrophobicContact CD1-CE1 4.05Å; L206-F249 HydrophobicContact CD1-CG 3.65Å; L206-F250 HydrophobicContact CB-CE1 4.02Å; L206-F250 HydrophobicContact CB-CZ 3.59Å
207	N	69.6	Low	67.7	Low	30 Å²	30	73.7 Å²	73.7	16%	0.16	36%	0.363	C	S	.	.			trans	-149.9	171.8	177.6	71.4	53.5	0	0	0	111	P186 K209 T210 A211	P186-N207 HydrophobicContact CB-CB 3.91Å; P186-N207 HydrophobicContact CG-CB 4.07Å; N207-K209 PolarHBondContact O-N 2.77Å; N207-K209 VanDerWaalsContact OD1-CA 3.3Å; N207-K209 WeakPolarHBondContact OD1-CA 3.47Å; N207-K209 WeakPolarHBondContact OD1-CB 3.45Å; N207-K209 PolarHBondContact OD1-N 2.91Å; N207-T210 PolarHBondContact N-OG1 3.32Å; N207-T210 PolarHBondContact O-N 3.36Å; N207-T210 PolarHBondContact O-OG1 2.93Å; N207-T210 PolarHBondContact OD1-N 3.31Å; N207-A211 WeakPolarHBondContact O-CB 3.34Å; N207-A211 PolarHBondContact O-N 2.78Å
208	R	58.2	Low	68.8	Low	125 Å²	125	69.5 Å²	69.5	47%	0.472	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-17.8	-176.9	-165	174.2	177.6	157.4	8.7	114.8	K181 D182 I184	K181-R208 WeakPolarHBondContact O-CD 3.11Å; K181-R208 PolarHBondContact O-NE 3.05Å; K181-R208 PolarHBondContact O-NH1 3.5Å; K181-R208 PolarHBondContact O-NH2 3.16Å; D182-R208 IonicContact OD1-CZ 3.27Å; D182-R208 IonicContact OD1-NH1 2.68Å; D182-R208 PolarHBondContact OD1-NH1 2.94Å; D182-R208 IonicContact OD1-NH2 3.93Å; D182-R208 PolarHBondContact OD1-NH2 2.8Å; I184-R208 HydrophobicContact CB-CB 4.08Å; I184-R208 HydrophobicContact CB-CG 4.46Å; I184-R208 HydrophobicContact CG2-CB 4.18Å; I184-R208 VanDerWaalsContact CG2-N 3.33Å
209	K	57.5	Low	69.9	Low	179 Å²	179	66.1 Å²	66.1	78%	0.778	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.3	-0.1	176.3	-59.7	-176.5	179.2	179	0	114.4	N207 H212	N207-K209 PolarHBondContact O-N 2.77Å; N207-K209 VanDerWaalsContact OD1-CA 3.3Å; N207-K209 WeakPolarHBondContact OD1-CA 3.47Å; N207-K209 WeakPolarHBondContact OD1-CB 3.45Å; N207-K209 PolarHBondContact OD1-N 2.91Å; K209-H212 PolarHBondContact O-NE2 2.76Å
210	T	55.2	Low	70.2	Confident	34 Å²	34	67.9 Å²	67.9	21%	0.209	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.5	-43.4	176.4	57.5	0	0	0	0	112.2	L205 N207 H212	L205-T210 PolarHBondContact O-OG1 2.82Å; N207-T210 PolarHBondContact N-OG1 3.32Å; N207-T210 PolarHBondContact O-N 3.36Å; N207-T210 PolarHBondContact O-OG1 2.93Å; N207-T210 PolarHBondContact OD1-N 3.31Å; T210-H212 VanDerWaalsContact C-N 3.29Å; T210-H212 PolarHBondContact O-N 2.88Å
211	A	62.7	Low	70.8	Confident	3 Å²	3	63.3 Å²	63.3	3%	0.025	32%	0.317	C	S	.	.			trans	-82.1	69.2	180	0	0	0	0	0	110.9	L206 N207 V217 L246 F250	L206-A211 HydrophobicContact CB-CB 4.29Å; N207-A211 WeakPolarHBondContact O-CB 3.34Å; N207-A211 PolarHBondContact O-N 2.78Å; A211-V217 HydrophobicContact CB-CG2 3.96Å; A211-L246 HydrophobicContact CB-CD1 4.03Å; A211-L246 HydrophobicContact CB-CD2 4.14Å; A211-L246 HydrophobicContact CB-CG 4.39Å; A211-F250 HydrophobicContact CB-CE2 4.36Å; A211-F250 HydrophobicContact CB-CZ 4.16Å
212	H	62.9	Low	70.9	Confident	128 Å²	128	61.6 Å²	61.6	59%	0.593	30%	0.301	S	S	*	.	S	Bend	trans	-82.9	-31.8	-175.9	-67.6	-35.2	0	0	0	114.6	K209 T210	K209-H212 PolarHBondContact O-NE2 2.76Å; T210-H212 VanDerWaalsContact C-N 3.29Å; T210-H212 PolarHBondContact O-N 2.88Å
213	S	76.6	Confident	70.8	Confident	48 Å²	48	65.5 Å²	65.5	34%	0.336	32%	0.321	S	S	.	.			trans	-153.4	159.5	172.2	68.6	0	0	0	0	109.6	D215 Q216 V217 L246	S213-D215 VanDerWaalsContact C-N 3.33Å; S213-D215 PolarHBondContact O-N 3.31Å; S213-Q216 PolarHBondContact O-N 2.81Å; S213-Q216 WeakPolarHBondContact OG-CB 3.49Å; S213-Q216 PolarHBondContact OG-N 2.72Å; S213-V217 WeakPolarHBondContact O-CG2 3.4Å; S213-V217 PolarHBondContact O-N 3.32Å; S213-L246 WeakPolarHBondContact O-CD1 3.43Å
214	F	75.9	Confident	70.6	Confident	46 Å²	46	59.2 Å²	59.2	20%	0.202	31%	0.305	C	S	.	.	H	α-helix	trans	-59	-44.4	176.9	179.7	-106.4	0	0	0	111.8	Q216 V217 M218 I243 F249	F214-Q216 PolarHBondContact O-N 3.5Å; F214-V217 PolarHBondContact O-N 3.32Å; F214-M218 HydrophobicContact CD1-CG 4.1Å; F214-M218 HydrophobicContact CD2-CG 4.5Å; F214-M218 HydrophobicContact CE1-CG 3.74Å; F214-M218 HydrophobicContact CE1-SD 4.3Å; F214-M218 HydrophobicContact CE2-CG 4.16Å; F214-M218 HydrophobicContact CE2-SD 4.24Å; F214-M218 HydrophobicContact CG-CG 4.48Å; F214-M218 HydrophobicContact CZ-CG 3.77Å; F214-M218 HydrophobicContact CZ-SD 3.81Å; F214-M218 WeakPolarHBondContact O-CG 3.38Å; F214-M218 PolarHBondContact O-N 3.11Å; F214-I243 HydrophobicContact CE2-CG2 3.78Å; F214-F249 AromaticContact CD2-CE2 3.9Å; F214-F249 HydrophobicContact CD2-CE2 3.9Å; F214-F249 AromaticContact CE2-CE2 3.82Å; F214-F249 HydrophobicContact CE2-CE2 3.82Å
215	D	74.4	Confident	70.3	Confident	122 Å²	122	58 Å²	58	65%	0.652	30%	0.298	S	S	*	.	H	α-helix	trans	-63.9	-37.2	-179.5	-53.8	-62.2	0	0	0	113.2	S213 M218 S219	S213-D215 VanDerWaalsContact C-N 3.33Å; S213-D215 PolarHBondContact O-N 3.31Å; D215-M218 PolarHBondContact O-N 3.26Å; D215-S219 PolarHBondContact O-N 3.28Å
216	Q	76.8	Confident	69.9	Low	87 Å²	87	60.6 Å²	60.6	41%	0.407	31%	0.306	S	S	.	.	H	α-helix	trans	-65	-44.6	175	-175.6	62.9	59.7	0	0	110.5	S213 F214 M218 S219 D220	S213-Q216 PolarHBondContact O-N 2.81Å; S213-Q216 WeakPolarHBondContact OG-CB 3.49Å; S213-Q216 PolarHBondContact OG-N 2.72Å; F214-Q216 PolarHBondContact O-N 3.5Å; Q216-M218 VanDerWaalsContact C-N 3.35Å; Q216-M218 PolarHBondContact O-N 3.19Å; Q216-S219 WeakPolarHBondContact O-CB 3.31Å; Q216-S219 PolarHBondContact O-N 2.89Å; Q216-S219 VanDerWaalsContact O-N 3.15Å; Q216-D220 PolarHBondContact NE2-OD1 2.8Å; Q216-D220 PolarHBondContact O-N 2.81Å
217	V	76.3	Confident	69.3	Low	2 Å²	2	61 Å²	61	1%	0.012	31%	0.308	C	S	.	.	H	α-helix	trans	-61.8	-43.2	177.2	171.8	0	0	0	0	110.7	L206 A211 S213 F214 S219 D220 I221 L246 F249	L206-V217 HydrophobicContact CD1-CG1 4.33Å; L206-V217 HydrophobicContact CD2-CG1 3.75Å; L206-V217 HydrophobicContact CD2-CG2 4.1Å; A211-V217 HydrophobicContact CB-CG2 3.96Å; S213-V217 WeakPolarHBondContact O-CG2 3.4Å; S213-V217 PolarHBondContact O-N 3.32Å; F214-V217 PolarHBondContact O-N 3.32Å; V217-S219 VanDerWaalsContact C-N 3.31Å; V217-S219 PolarHBondContact O-N 2.93Å; V217-D220 PolarHBondContact O-N 2.88Å; V217-I221 HydrophobicContact CG1-CD1 3.48Å; V217-I221 VanDerWaalsContact CG1-CD1 3.48Å; V217-I221 HydrophobicContact CG1-CG1 4.33Å; V217-I221 WeakPolarHBondContact O-CB 3.45Å; V217-I221 VanDerWaalsContact O-CD1 3.32Å; V217-I221 WeakPolarHBondContact O-CD1 3.41Å; V217-I221 WeakPolarHBondContact O-CG1 3.09Å; V217-I221 PolarHBondContact O-N 3.04Å; V217-L246 HydrophobicContact CG2-CD1 4.04Å; V217-F249 HydrophobicContact CB-CE2 4.49Å; V217-F249 HydrophobicContact CG1-CD2 4.37Å; V217-F249 HydrophobicContact CG1-CE1 4.22Å; V217-F249 HydrophobicContact CG1-CE2 3.64Å; V217-F249 HydrophobicContact CG1-CZ 3.53Å
218	M	75.8	Confident	68.6	Low	18 Å²	18	66.2 Å²	66.2	9%	0.089	34%	0.336	C	S	.	.	H	α-helix	trans	-60.3	-36.1	173.7	-71.4	-67.9	-69.6	0	0	113.2	F214 D215 Q216 T222 V232 L235	F214-M218 HydrophobicContact CD1-CG 4.1Å; F214-M218 HydrophobicContact CD2-CG 4.5Å; F214-M218 HydrophobicContact CE1-CG 3.74Å; F214-M218 HydrophobicContact CE1-SD 4.3Å; F214-M218 HydrophobicContact CE2-CG 4.16Å; F214-M218 HydrophobicContact CE2-SD 4.24Å; F214-M218 HydrophobicContact CG-CG 4.48Å; F214-M218 HydrophobicContact CZ-CG 3.77Å; F214-M218 HydrophobicContact CZ-SD 3.81Å; F214-M218 WeakPolarHBondContact O-CG 3.38Å; F214-M218 PolarHBondContact O-N 3.11Å; D215-M218 PolarHBondContact O-N 3.26Å; Q216-M218 VanDerWaalsContact C-N 3.35Å; Q216-M218 PolarHBondContact O-N 3.19Å; M218-T222 WeakPolarHBondContact O-CB 3.21Å; M218-T222 PolarHBondContact O-N 3Å; M218-T222 VanDerWaalsContact O-N 3.08Å; M218-T222 PolarHBondContact O-OG1 3.44Å; M218-V232 HydrophobicContact CE-CG1 4.17Å; M218-V232 WeakPolarHBondContact CE-O 3.49Å; M218-L235 HydrophobicContact SD-CD1 3.44Å; M218-L235 WeakPolarHBondContact SD-CD1 3.41Å; M218-L235 HydrophobicContact SD-CG 3.94Å
219	S	73.3	Confident	68.5	Low	59 Å²	59	62 Å²	62	41%	0.413	33%	0.326	S	S	.	.	H	α-helix	trans	-69.5	-47.2	174.8	-166.5	0	0	0	0	112.2	D215 Q216 V217 I221 T222 D223	D215-S219 PolarHBondContact O-N 3.28Å; Q216-S219 WeakPolarHBondContact O-CB 3.31Å; Q216-S219 PolarHBondContact O-N 2.89Å; Q216-S219 VanDerWaalsContact O-N 3.15Å; V217-S219 VanDerWaalsContact C-N 3.31Å; V217-S219 PolarHBondContact O-N 2.93Å; S219-I221 VanDerWaalsContact C-N 3.3Å; S219-I221 PolarHBondContact O-N 3.36Å; S219-T222 VanDerWaalsContact O-CB 3.3Å; S219-T222 WeakPolarHBondContact O-CB 3.46Å; S219-T222 PolarHBondContact O-N 3.43Å; S219-T222 VanDerWaalsContact O-N 3.13Å; S219-D223 PolarHBondContact O-N 2.85Å
220	D	72.6	Confident	68.9	Low	70 Å²	70	55.3 Å²	55.3	37%	0.374	31%	0.307	S	S	.	.	H	α-helix	trans	-62	-40	179.6	-67.3	-3.6	0	0	0	111.2	Q216 V217 D223 A224	Q216-D220 PolarHBondContact NE2-OD1 2.8Å; Q216-D220 PolarHBondContact O-N 2.81Å; V217-D220 PolarHBondContact O-N 2.88Å; D220-D223 PolarHBondContact O-N 2.99Å; D220-A224 WeakPolarHBondContact O-CB 3.31Å; D220-A224 PolarHBondContact O-N 2.94Å; D220-A224 VanDerWaalsContact O-N 3.1Å
221	I	76.4	Confident	69.5	Low	1 Å²	1	57.7 Å²	57.7	1%	0.005	32%	0.321	C	S	.	.	H	α-helix	trans	-65.9	-38.6	175.6	-68.1	167.4	0	0	0	111.1	I191 V217 S219 A224 I225 L235 F249	I191-I221 HydrophobicContact CD1-CB 4.27Å; I191-I221 HydrophobicContact CD1-CD1 3.49Å; I191-I221 VanDerWaalsContact CD1-CD1 3.49Å; I191-I221 HydrophobicContact CD1-CG1 3.51Å; I191-I221 HydrophobicContact CD1-CG2 3.76Å; I191-I221 HydrophobicContact CG2-CG2 4.23Å; V217-I221 HydrophobicContact CG1-CD1 3.48Å; V217-I221 VanDerWaalsContact CG1-CD1 3.48Å; V217-I221 HydrophobicContact CG1-CG1 4.33Å; V217-I221 WeakPolarHBondContact O-CB 3.45Å; V217-I221 VanDerWaalsContact O-CD1 3.32Å; V217-I221 WeakPolarHBondContact O-CD1 3.41Å; V217-I221 WeakPolarHBondContact O-CG1 3.09Å; V217-I221 PolarHBondContact O-N 3.04Å; S219-I221 VanDerWaalsContact C-N 3.3Å; S219-I221 PolarHBondContact O-N 3.36Å; I221-A224 PolarHBondContact O-N 3.5Å; I221-I225 HydrophobicContact CG2-CD1 3.64Å; I221-I225 HydrophobicContact CG2-CG1 4.38Å; I221-I225 WeakPolarHBondContact O-CB 3.28Å; I221-I225 WeakPolarHBondContact O-CG1 3.24Å; I221-I225 PolarHBondContact O-N 3.03Å; I221-L235 HydrophobicContact CD1-CD1 3.68Å; I221-L235 HydrophobicContact CG2-CD1 4.47Å; I221-L235 HydrophobicContact CG2-CD2 4.37Å; I221-F249 HydrophobicContact CD1-CE1 3.87Å; I221-F249 HydrophobicContact CD1-CZ 3.74Å
222	T	74.2	Confident	70.1	Confident	18 Å²	18	57.9 Å²	57.9	11%	0.11	32%	0.322	C	S	.	.	H	α-helix	trans	-59	-52.9	174.7	-70.2	0	0	0	0	111.7	M218 S219 A224 I225 K226 V231 V232	M218-T222 WeakPolarHBondContact O-CB 3.21Å; M218-T222 PolarHBondContact O-N 3Å; M218-T222 VanDerWaalsContact O-N 3.08Å; M218-T222 PolarHBondContact O-OG1 3.44Å; S219-T222 VanDerWaalsContact O-CB 3.3Å; S219-T222 WeakPolarHBondContact O-CB 3.46Å; S219-T222 PolarHBondContact O-N 3.43Å; S219-T222 VanDerWaalsContact O-N 3.13Å; T222-A224 VanDerWaalsContact C-N 3.29Å; T222-A224 PolarHBondContact O-N 3.17Å; T222-I225 PolarHBondContact O-N 3.35Å; T222-K226 PolarHBondContact O-N 3.32Å; T222-V231 HydrophobicContact CG2-CB 4.02Å; T222-V231 HydrophobicContact CG2-CG1 4.06Å; T222-V232 WeakPolarHBondContact OG1-CB 3.4Å; T222-V232 PolarHBondContact OG1-N 3.36Å
223	D	70.3	Confident	70.4	Confident	113 Å²	113	58.2 Å²	58.2	60%	0.604	32%	0.322	S	S	*	.	H	α-helix	trans	-65.1	-31.9	-178.2	-86.8	-12.3	0	0	0	112.8	S219 D220 K226	S219-D223 PolarHBondContact O-N 2.85Å; D220-D223 PolarHBondContact O-N 2.99Å; D223-K226 WeakPolarHBondContact O-CE 3.5Å; D223-K226 VanDerWaalsContact O-CG 3.27Å; D223-K226 WeakPolarHBondContact O-CG 3.26Å
224	A	69.1	Low	70.5	Confident	38 Å²	38	60 Å²	60	31%	0.314	32%	0.321	S	S	.	.	H	α-helix	trans	-75.3	-43.8	178.8	0	0	0	0	0	112.9	K200 V202 D220 I221 T222	K200-A224 PolarHBondContact NZ-O 2.82Å; V202-A224 HydrophobicContact CG1-CB 4.18Å; D220-A224 WeakPolarHBondContact O-CB 3.31Å; D220-A224 PolarHBondContact O-N 2.94Å; D220-A224 VanDerWaalsContact O-N 3.1Å; I221-A224 PolarHBondContact O-N 3.5Å; T222-A224 VanDerWaalsContact C-N 3.29Å; T222-A224 PolarHBondContact O-N 3.17Å
225	I	69.6	Low	70.8	Confident	1 Å²	1	57.8 Å²	57.8	1%	0.005	31%	0.312	C	S	.	.	H	α-helix	trans	-78.6	-47.4	-176.8	-65.7	176.8	0	0	0	111.4	I191 R193 K200 V202 I221 T222 L227 A258	I191-I225 HydrophobicContact CB-CD1 3.91Å; I191-I225 HydrophobicContact CG2-CD1 3.47Å; I191-I225 VanDerWaalsContact CG2-CD1 3.47Å; R193-I225 HydrophobicContact CB-CG2 4.04Å; K200-I225 PolarHBondContact NZ-O 3.04Å; V202-I225 HydrophobicContact CB-CG1 4.37Å; V202-I225 HydrophobicContact CG2-CG1 4.07Å; I221-I225 HydrophobicContact CG2-CD1 3.64Å; I221-I225 HydrophobicContact CG2-CG1 4.38Å; I221-I225 WeakPolarHBondContact O-CB 3.28Å; I221-I225 WeakPolarHBondContact O-CG1 3.24Å; I221-I225 PolarHBondContact O-N 3.03Å; T222-I225 PolarHBondContact O-N 3.35Å; I225-L227 HydrophobicContact CG2-CD2 3.77Å; I225-L227 HydrophobicContact CG2-CG 4.39Å; I225-A258 HydrophobicContact CD1-CB 3.42Å; I225-A258 VanDerWaalsContact CD1-CB 3.42Å
226	K	65.1	Low	71	Confident	144 Å²	144	53 Å²	53	63%	0.626	29%	0.285	S	S	*	.			trans	55.1	87.9	-171.8	-51.5	-165.7	177.7	-165.3	0	112.2	R193 T222 D223	R193-K226 PolarHBondContact NH1-O 3.01Å; T222-K226 PolarHBondContact O-N 3.32Å; D223-K226 WeakPolarHBondContact O-CE 3.5Å; D223-K226 VanDerWaalsContact O-CG 3.27Å; D223-K226 WeakPolarHBondContact O-CG 3.26Å
227	L	62.8	Low	71.2	Confident	15 Å²	15	49 Å²	49	8%	0.079	27%	0.266	C	S	.	.	B	Isolated β-bridge	trans	-77.9	143.5	169	-55.9	-179.7	0	0	0	109.3	R193 I225 S229 G230 V232 G260	R193-L227 HydrophobicContact CB-CD2 4.24Å; R193-L227 HydrophobicContact CG-CD2 3.59Å; I225-L227 HydrophobicContact CG2-CD2 3.77Å; I225-L227 HydrophobicContact CG2-CG 4.39Å; L227-S229 PolarHBondContact O-N 2.83Å; L227-G230 PolarHBondContact O-N 3.18Å; L227-V232 HydrophobicContact CD1-CG2 3.79Å; L227-V232 HydrophobicContact CG-CG2 4.05Å; L227-G260 VanDerWaalsContact CD1-N 3.33Å
228	D	55.8	Low	71	Confident	139 Å²	139	51.4 Å²	51.4	74%	0.743	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-22.2	178.1	-49.9	-16.7	0	0	0	111.6	R193 G230	R193-D228 IonicContact CZ-OD1 3.48Å; R193-D228 IonicContact CZ-OD2 3.63Å; R193-D228 VanDerWaalsContact NH1-CG 3.28Å; R193-D228 IonicContact NH1-OD1 3.77Å; R193-D228 PolarHBondContact NH1-OD1 3.5Å; R193-D228 IonicContact NH1-OD2 3.62Å; R193-D228 PolarHBondContact NH1-OD2 2.84Å; R193-D228 IonicContact NH2-OD1 2.74Å; R193-D228 PolarHBondContact NH2-OD1 3.42Å; R193-D228 IonicContact NH2-OD2 3.75Å; R193-D228 PolarHBondContact NH2-OD2 3.39Å; D228-G230 VanDerWaalsContact C-N 3.31Å
229	S	55.5	Low	70.8	Confident	38 Å²	38	56 Å²	56	27%	0.266	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	13.9	173.1	53.9	0	0	0	0	114.1	L227 P261 E262	L227-S229 PolarHBondContact O-N 2.83Å; S229-P261 WeakPolarHBondContact O-CD 3.35Å; S229-P261 WeakPolarHBondContact O-CG 3.4Å; S229-E262 VanDerWaalsContact CB-OE1 3.31Å; S229-E262 WeakPolarHBondContact CB-OE1 3.35Å
230	G	65.5	Low	70.4	Confident	38 Å²	38	54.1 Å²	54.1	39%	0.392	30%	0.296	S	S	.	.	B	Isolated β-bridge	trans	92	-126.3	172.5	0	0	0	0	0	114.1	L227 D228	L227-G230 PolarHBondContact O-N 3.18Å; D228-G230 VanDerWaalsContact C-N 3.31Å
231	V	67.9	Low	70.5	Confident	83 Å²	83	56.3 Å²	56.3	50%	0.503	30%	0.302	S	S	.	.	S	Bend	trans	-76.9	142.1	-169.4	-56.9	0	0	0	0	113.2	T222 K233	T222-V231 HydrophobicContact CG2-CB 4.02Å; T222-V231 HydrophobicContact CG2-CG1 4.06Å; V231-K233 HydrophobicContact CG2-CG 4.06Å; V231-K233 PolarHBondContact O-N 3.18Å
232	V	74.3	Confident	70.5	Confident	7 Å²	7	60.9 Å²	60.9	4%	0.042	32%	0.324	C	S	.	.			trans	-71.3	116.2	170.5	-179.2	0	0	0	0	107.3	M218 T222 L227 L235 A258	M218-V232 HydrophobicContact CE-CG1 4.17Å; M218-V232 WeakPolarHBondContact CE-O 3.49Å; T222-V232 WeakPolarHBondContact OG1-CB 3.4Å; T222-V232 PolarHBondContact OG1-N 3.36Å; L227-V232 HydrophobicContact CD1-CG2 3.79Å; L227-V232 HydrophobicContact CG-CG2 4.05Å; V232-L235 HydrophobicContact CG1-CD2 4.43Å; V232-L235 HydrophobicContact CG1-CG 4.34Å; V232-A258 HydrophobicContact CG1-CB 3.87Å; V232-A258 HydrophobicContact CG2-CB 4.07Å
233	K	70.6	Confident	70.8	Confident	135 Å²	135	60.4 Å²	60.4	59%	0.587	32%	0.321	S	S	*	.			trans	-97	-24.7	-180	-74	-164.5	172.4	-173.3	0	113.3	V231 C259	V231-K233 HydrophobicContact CG2-CG 4.06Å; V231-K233 PolarHBondContact O-N 3.18Å; K233-C259 PolarHBondContact N-O 3Å
234	R	78.8	Confident	71	Confident	85 Å²	85	59.3 Å²	59.3	32%	0.321	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	144.9	-176.9	-67.3	173.7	-69.8	164.2	-5.5	110.3	Y236 M242 C259	R234-Y236 HydrophobicContact CB-CD2 4.42Å; R234-Y236 HydrophobicContact CB-CE2 3.67Å; R234-Y236 WeakPolarHBondContact CD-OH 3.44Å; R234-Y236 PolarHBondContact NH1-OH 3.37Å; R234-M242 HydrophobicContact CG-SD 4.19Å; R234-C259 PolarHBondContact N-O 2.81Å; R234-C259 PolarHBondContact O-N 2.86Å
235	L	81.1	Confident	71.4	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	147.5	168.6	-76	163.6	0	0	0	109.2	I191 M218 I221 V232 I243 F249 F256 I257 A258	I191-L235 HydrophobicContact CG2-CD2 3.65Å; M218-L235 HydrophobicContact SD-CD1 3.44Å; M218-L235 WeakPolarHBondContact SD-CD1 3.41Å; M218-L235 HydrophobicContact SD-CG 3.94Å; I221-L235 HydrophobicContact CD1-CD1 3.68Å; I221-L235 HydrophobicContact CG2-CD1 4.47Å; I221-L235 HydrophobicContact CG2-CD2 4.37Å; V232-L235 HydrophobicContact CG1-CD2 4.43Å; V232-L235 HydrophobicContact CG1-CG 4.34Å; L235-I243 HydrophobicContact CB-CB 3.98Å; L235-I243 HydrophobicContact CB-CG1 3.81Å; L235-I243 PolarHBondContact O-N 3.38Å; L235-F249 HydrophobicContact CD1-CE1 3.78Å; L235-F249 HydrophobicContact CD1-CZ 3.42Å; L235-F249 VanDerWaalsContact CD1-CZ 3.42Å; L235-F256 HydrophobicContact CD2-CB 4.37Å; L235-I257 WeakPolarHBondContact CA-O 3.26Å; L235-A258 HydrophobicContact CD2-CB 3.78Å
236	Y	79.4	Confident	71.6	Confident	22 Å²	22	59.5 Å²	59.5	9%	0.086	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	148.5	177.2	-66.2	-92.1	0	0	0	110.1	R234 G240 K241 M242 F256 I257 C259 F264	R234-Y236 HydrophobicContact CB-CD2 4.42Å; R234-Y236 HydrophobicContact CB-CE2 3.67Å; R234-Y236 WeakPolarHBondContact CD-OH 3.44Å; R234-Y236 PolarHBondContact NH1-OH 3.37Å; Y236-G240 WeakPolarHBondContact CD1-O 3.43Å; Y236-K241 CarbonylContact C-O 3.46Å; Y236-K241 WeakPolarHBondContact CA-O 3.02Å; Y236-M242 HydrophobicContact CD1-CB 3.89Å; Y236-M242 HydrophobicContact CD1-CG 4.26Å; Y236-M242 HydrophobicContact CE1-CB 3.62Å; Y236-M242 HydrophobicContact CE1-CG 3.82Å; Y236-M242 HydrophobicContact CE1-SD 4.23Å; Y236-F256 CarbonylContact O-C 3.42Å; Y236-F256 WeakPolarHBondContact O-CA 3.21Å; Y236-I257 PolarHBondContact N-O 3.32Å; Y236-I257 PolarHBondContact O-N 2.97Å; Y236-C259 HydrophobicContact CE2-CB 4.32Å; Y236-F264 HydrophobicContact CD1-CZ 4.43Å; Y236-F264 AromaticContact CD2-CE2 3.85Å; Y236-F264 HydrophobicContact CD2-CE2 3.85Å; Y236-F264 HydrophobicContact CD2-CZ 4.36Å; Y236-F264 HydrophobicContact CE1-CE2 4.32Å; Y236-F264 HydrophobicContact CE1-CZ 4.17Å; Y236-F264 HydrophobicContact CE2-CD2 4.27Å; Y236-F264 AromaticContact CE2-CE2 3.45Å; Y236-F264 HydrophobicContact CE2-CE2 3.45Å; Y236-F264 VanDerWaalsContact CE2-CE2 3.45Å; Y236-F264 HydrophobicContact CE2-CZ 4.1Å; Y236-F264 HydrophobicContact CG-CE2 4.44Å; Y236-F264 AromaticContact CZ-CE2 3.72Å; Y236-F264 AromaticContact CZ-CZ 4Å
237	T	81.4	Confident	72	Confident	4 Å²	4	57.2 Å²	57.2	3%	0.025	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	170.3	163.3	68.8	0	0	0	0	110.2	D239 G240 K241 I243 D253 F256	T237-D239 PolarHBondContact O-N 2.93Å; T237-D239 PolarHBondContact OG1-N 3.38Å; T237-G240 PolarHBondContact O-N 2.88Å; T237-K241 HydrophobicContact CG2-CB 4.17Å; T237-K241 PolarHBondContact N-O 3.2Å; T237-K241 WeakPolarHBondContact OG1-CB 3.41Å; T237-K241 PolarHBondContact OG1-N 3.06Å; T237-I243 HydrophobicContact CG2-CD1 3.63Å; T237-D253 HydrophobicContact CG2-CB 4.07Å; T237-D253 WeakPolarHBondContact CG2-OD2 3.49Å; T237-F256 HydrophobicContact CG2-CD1 4.32Å; T237-F256 HydrophobicContact CG2-CE1 4.1Å
238	V	72	Confident	72.6	Confident	52 Å²	52	58.9 Å²	58.9	32%	0.315	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-27.8	172.2	-175.9	0	0	0	0	111.9	G240 I255 F270	V238-G240 PolarHBondContact O-N 3.45Å; V238-I255 HydrophobicContact CG2-CB 3.77Å; V238-I255 HydrophobicContact CG2-CG2 3.61Å; V238-F270 WeakPolarHBondContact O-CD1 3.48Å
239	D	70.3	Confident	73.4	Confident	113 Å²	113	52.2 Å²	52.2	60%	0.604	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-3.2	171.2	-65.2	-12.3	0	0	0	114	T237 K241	T237-D239 PolarHBondContact O-N 2.93Å; T237-D239 PolarHBondContact OG1-N 3.38Å; D239-K241 VanDerWaalsContact C-N 3.34Å; D239-K241 HydrophobicContact CB-CD 4.31Å; D239-K241 HydrophobicContact CB-CG 4.23Å; D239-K241 PolarHBondContact O-N 3.35Å; D239-K241 WeakPolarHBondContact OD2-CE 3.39Å; D239-K241 IonicContact OD2-NZ 3.77Å; D239-K241 PolarHBondContact OD2-NZ 3.17Å
240	G	65.1	Low	74.1	Confident	20 Å²	20	52.4 Å²	52.4	21%	0.206	28%	0.278	C	S	.	.			trans	77.4	11.7	-176.1	0	0	0	0	0	115.2	Y236 T237 V238	Y236-G240 WeakPolarHBondContact CD1-O 3.43Å; T237-G240 PolarHBondContact O-N 2.88Å; V238-G240 PolarHBondContact O-N 3.45Å
241	K	75.3	Confident	74.5	Confident	116 Å²	116	53 Å²	53	50%	0.504	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-72	127.4	172.2	-58.3	164.1	-174.8	143.9	0	108.9	Y236 T237 D239	Y236-K241 CarbonylContact C-O 3.46Å; Y236-K241 WeakPolarHBondContact CA-O 3.02Å; T237-K241 HydrophobicContact CG2-CB 4.17Å; T237-K241 PolarHBondContact N-O 3.2Å; T237-K241 WeakPolarHBondContact OG1-CB 3.41Å; T237-K241 PolarHBondContact OG1-N 3.06Å; D239-K241 VanDerWaalsContact C-N 3.34Å; D239-K241 HydrophobicContact CB-CD 4.31Å; D239-K241 HydrophobicContact CB-CG 4.23Å; D239-K241 PolarHBondContact O-N 3.35Å; D239-K241 WeakPolarHBondContact OD2-CE 3.39Å; D239-K241 IonicContact OD2-NZ 3.77Å; D239-K241 PolarHBondContact OD2-NZ 3.17Å
242	M	76.8	Confident	74.6	Confident	97 Å²	97	58.3 Å²	58.3	48%	0.478	30%	0.298	S	S	.	.	B	Isolated β-bridge	trans	-75.9	133.2	178.1	-167.3	169.9	67.8	0	0	110.6	R234 Y236 T244	R234-M242 HydrophobicContact CG-SD 4.19Å; Y236-M242 HydrophobicContact CD1-CB 3.89Å; Y236-M242 HydrophobicContact CD1-CG 4.26Å; Y236-M242 HydrophobicContact CE1-CB 3.62Å; Y236-M242 HydrophobicContact CE1-CG 3.82Å; Y236-M242 HydrophobicContact CE1-SD 4.23Å; M242-T244 HydrophobicContact CE-CG2 4.05Å
243	I	81	Confident	74.8	Confident	9 Å²	9	59.9 Å²	59.9	5%	0.046	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-79.2	126.9	174.1	-47.9	-51.3	0	0	0	108	F214 L235 T237 D248 F249 F256	F214-I243 HydrophobicContact CE2-CG2 3.78Å; L235-I243 HydrophobicContact CB-CB 3.98Å; L235-I243 HydrophobicContact CB-CG1 3.81Å; L235-I243 PolarHBondContact O-N 3.38Å; T237-I243 HydrophobicContact CG2-CD1 3.63Å; I243-D248 HydrophobicContact CB-CB 4.47Å; I243-D248 HydrophobicContact CD1-CB 4.22Å; I243-D248 HydrophobicContact CG2-CB 3.66Å; I243-F249 HydrophobicContact CG2-CD2 3.94Å; I243-F249 HydrophobicContact CG2-CE2 3.82Å; I243-F249 HydrophobicContact CG2-CG 4.41Å; I243-F249 HydrophobicContact CG2-CZ 4.17Å; I243-F256 HydrophobicContact CD1-CD1 3.66Å; I243-F256 HydrophobicContact CD1-CE1 3.54Å; I243-F256 HydrophobicContact CG1-CD1 3.74Å; I243-F256 HydrophobicContact CG1-CE1 4.04Å
244	T	74.4	Confident	75.1	Confident	89 Å²	89	57.6 Å²	57.6	55%	0.546	30%	0.301	S	S	.	.			trans	-123.8	-23.9	-172.2	60.2	0	0	0	0	113.9	M242 D248	M242-T244 HydrophobicContact CE-CG2 4.05Å; T244-D248 WeakPolarHBondContact CA-OD2 3.31Å; T244-D248 PolarHBondContact N-OD2 3.35Å; T244-D248 PolarHBondContact OG1-OD2 3.4Å
245	C	75.6	Confident	75.2	Confident	34 Å²	34	55 Å²	55	23%	0.23	29%	0.293	C	S	.	.	S	Bend	trans	-140.1	174.6	180	72.3	0	0	0	0	111.7	Q247 D248	C245-Q247 VanDerWaalsContact C-N 3.28Å; C245-Q247 PolarHBondContact O-N 3.24Å; C245-D248 PolarHBondContact N-OD2 3.31Å; C245-D248 PolarHBondContact SG-OD1 3.22Å; C245-D248 PolarHBondContact SG-OD2 2.96Å
246	L	75.1	Confident	75.3	Confident	10 Å²	10	55 Å²	55	5%	0.052	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-27.3	-179.7	-160	117.6	0	0	0	112.6	I184 A211 S213 V217 F250	I184-L246 HydrophobicContact CD1-CD2 3.71Å; I184-L246 HydrophobicContact CG1-CD2 4.35Å; A211-L246 HydrophobicContact CB-CD1 4.03Å; A211-L246 HydrophobicContact CB-CD2 4.14Å; A211-L246 HydrophobicContact CB-CG 4.39Å; S213-L246 WeakPolarHBondContact O-CD1 3.43Å; V217-L246 HydrophobicContact CG2-CD1 4.04Å; L246-F250 HydrophobicContact CD2-CE2 3.9Å; L246-F250 HydrophobicContact CG-CE2 4.34Å; L246-F250 VanDerWaalsContact O-CD2 3.25Å; L246-F250 WeakPolarHBondContact O-CD2 3.49Å
247	Q	73.3	Confident	75.4	Confident	96 Å²	96	54.4 Å²	54.4	45%	0.449	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-67.3	-35.9	-178.8	-62.5	168	53.9	0	0	111.7	E179 F183 C245 F249 F250 A251	E179-Q247 PolarHBondContact OE1-NE2 3.13Å; F183-Q247 HydrophobicContact CE1-CG 3.89Å; F183-Q247 HydrophobicContact CE2-CG 4.02Å; F183-Q247 HydrophobicContact CZ-CB 4.38Å; F183-Q247 HydrophobicContact CZ-CG 3.44Å; F183-Q247 VanDerWaalsContact CZ-CG 3.44Å; C245-Q247 VanDerWaalsContact C-N 3.28Å; C245-Q247 PolarHBondContact O-N 3.24Å; Q247-F249 PolarHBondContact O-N 2.97Å; Q247-F250 PolarHBondContact O-N 2.6Å; Q247-A251 PolarHBondContact O-N 3.43Å
248	D	75.8	Confident	75.4	Confident	49 Å²	49	54.2 Å²	54.2	26%	0.262	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-57.2	-32.4	-179.8	-61.3	-30.6	0	0	0	112.8	I243 T244 C245 F250 A251	I243-D248 HydrophobicContact CB-CB 4.47Å; I243-D248 HydrophobicContact CD1-CB 4.22Å; I243-D248 HydrophobicContact CG2-CB 3.66Å; T244-D248 WeakPolarHBondContact CA-OD2 3.31Å; T244-D248 PolarHBondContact N-OD2 3.35Å; T244-D248 PolarHBondContact OG1-OD2 3.4Å; C245-D248 PolarHBondContact N-OD2 3.31Å; C245-D248 PolarHBondContact SG-OD1 3.22Å; C245-D248 PolarHBondContact SG-OD2 2.96Å; D248-F250 VanDerWaalsContact C-N 3.29Å; D248-F250 PolarHBondContact O-N 2.77Å; D248-A251 WeakPolarHBondContact O-CB 3.42Å; D248-A251 PolarHBondContact O-N 2.97Å
249	F	72.4	Confident	75.5	Confident	0 Å²	0	52 Å²	52	0%	0	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-68.8	-23.8	175.2	-75.8	-79.9	0	0	0	114.1	K187 L206 F214 V217 I221 L235 I243 Q247 F256	K187-F249 WeakPolarHBondContact CD-O 3.42Å; L206-F249 HydrophobicContact CD1-CB 3.74Å; L206-F249 HydrophobicContact CD1-CD1 3.48Å; L206-F249 VanDerWaalsContact CD1-CD1 3.48Å; L206-F249 HydrophobicContact CD1-CD2 4.38Å; L206-F249 HydrophobicContact CD1-CE1 4.05Å; L206-F249 HydrophobicContact CD1-CG 3.65Å; F214-F249 AromaticContact CD2-CE2 3.9Å; F214-F249 HydrophobicContact CD2-CE2 3.9Å; F214-F249 AromaticContact CE2-CE2 3.82Å; F214-F249 HydrophobicContact CE2-CE2 3.82Å; V217-F249 HydrophobicContact CB-CE2 4.49Å; V217-F249 HydrophobicContact CG1-CD2 4.37Å; V217-F249 HydrophobicContact CG1-CE1 4.22Å; V217-F249 HydrophobicContact CG1-CE2 3.64Å; V217-F249 HydrophobicContact CG1-CZ 3.53Å; I221-F249 HydrophobicContact CD1-CE1 3.87Å; I221-F249 HydrophobicContact CD1-CZ 3.74Å; L235-F249 HydrophobicContact CD1-CE1 3.78Å; L235-F249 HydrophobicContact CD1-CZ 3.42Å; L235-F249 VanDerWaalsContact CD1-CZ 3.42Å; I243-F249 HydrophobicContact CG2-CD2 3.94Å; I243-F249 HydrophobicContact CG2-CE2 3.82Å; I243-F249 HydrophobicContact CG2-CG 4.41Å; I243-F249 HydrophobicContact CG2-CZ 4.17Å; Q247-F249 PolarHBondContact O-N 2.97Å; F249-F256 HydrophobicContact CD1-CE1 4.43Å; F249-F256 HydrophobicContact CD1-CE2 4.36Å; F249-F256 HydrophobicContact CD1-CZ 4.26Å
250	F	70.7	Confident	75.6	Confident	42 Å²	42	46.9 Å²	46.9	18%	0.184	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-101.6	11.3	-178.2	-60.8	-80.7	0	0	0	112.8	F183 I184 K185 K187 L206 A211 L246 Q247 D248	F183-F250 HydrophobicContact CD2-CB 4.5Å; F183-F250 HydrophobicContact CE2-CD2 4.03Å; I184-F250 HydrophobicContact CG2-CE1 3.9Å; I184-F250 HydrophobicContact CG2-CE2 3.94Å; I184-F250 HydrophobicContact CG2-CZ 3.5Å; K185-F250 VanDerWaalsContact O-CE1 3.25Å; K185-F250 WeakPolarHBondContact O-CE1 3.45Å; K187-F250 HydrophobicContact CB-CD1 3.84Å; K187-F250 HydrophobicContact CB-CE1 3.79Å; K187-F250 HydrophobicContact CD-CD1 4.3Å; L206-F250 HydrophobicContact CB-CE1 4.02Å; L206-F250 HydrophobicContact CB-CZ 3.59Å; A211-F250 HydrophobicContact CB-CE2 4.36Å; A211-F250 HydrophobicContact CB-CZ 4.16Å; L246-F250 HydrophobicContact CD2-CE2 3.9Å; L246-F250 HydrophobicContact CG-CE2 4.34Å; L246-F250 VanDerWaalsContact O-CD2 3.25Å; L246-F250 WeakPolarHBondContact O-CD2 3.49Å; Q247-F250 PolarHBondContact O-N 2.6Å; D248-F250 VanDerWaalsContact C-N 3.29Å; D248-F250 PolarHBondContact O-N 2.77Å
251	A	72.4	Confident	75.2	Confident	50 Å²	50	49.5 Å²	49.5	41%	0.413	26%	0.264	S	S	.	.	S	Bend	trans	-65.6	-172.5	163.8	0	0	0	0	0	111.8	K187 Q247 D248 D253	K187-A251 PolarHBondContact NZ-O 2.8Å; Q247-A251 PolarHBondContact O-N 3.43Å; D248-A251 WeakPolarHBondContact O-CB 3.42Å; D248-A251 PolarHBondContact O-N 2.97Å; A251-D253 PolarHBondContact O-N 2.96Å
252	E	69.9	Low	74.4	Confident	194 Å²	194	50 Å²	50	91%	0.907	27%	0.268	S	S	*	.	S	Bend	trans	-71	-16.3	-179.6	-58.7	-170.4	157.7	0	0	113.5
253	D	79.3	Confident	72.9	Confident	41 Å²	41	55 Å²	55	22%	0.219	29%	0.288	C	S	.	.			trans	-75.4	124.9	-178	-74	-61.5	0	0	0	113.5	K187 T237 A251 F256	K187-D253 PolarHBondContact NZ-O 2.88Å; T237-D253 HydrophobicContact CG2-CB 4.07Å; T237-D253 WeakPolarHBondContact CG2-OD2 3.49Å; A251-D253 PolarHBondContact O-N 2.96Å; D253-F256 HydrophobicContact CB-CE1 4.32Å; D253-F256 HydrophobicContact CB-CZ 4.12Å; D253-F256 WeakPolarHBondContact O-CE2 3.4Å; D253-F256 WeakPolarHBondContact O-CZ 3.41Å
254	D	77.3	Confident	71.2	Confident	87 Å²	87	57.5 Å²	57.5	47%	0.465	30%	0.298	S	S	.	.			trans	-102	-8.8	178.5	-72.6	-10.7	0	0	0	113.8	K187 T190	K187-D254 WeakPolarHBondContact CE-OD1 3.08Å; K187-D254 IonicContact NZ-OD1 2.72Å; K187-D254 PolarHBondContact NZ-OD1 2.88Å; T190-D254 PolarHBondContact N-O 3.09Å
255	I	81.3	Confident	70.2	Confident	30 Å²	30	61.6 Å²	61.6	15%	0.154	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	128.3	-173.1	-55.5	177.5	0	0	0	110.5	T190 V192 V238	T190-I255 CarbonylContact O-C 3.56Å; T190-I255 VanDerWaalsContact O-CA 3.31Å; T190-I255 WeakPolarHBondContact O-CA 3.34Å; V192-I255 HydrophobicContact CG2-CG2 4.24Å; V238-I255 HydrophobicContact CG2-CB 3.77Å; V238-I255 HydrophobicContact CG2-CG2 3.61Å
256	F	83.2	Confident	68.9	Low	0 Å²	0	68.1 Å²	68.1	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	152.2	-176.7	-55.5	-90.7	0	0	0	111.5	V189 T190 I191 V192 L235 Y236 T237 I243 F249 D253	V189-F256 HydrophobicContact CB-CD2 3.91Å; V189-F256 HydrophobicContact CB-CE2 3.71Å; V189-F256 HydrophobicContact CG1-CD2 4.32Å; V189-F256 HydrophobicContact CG1-CE2 3.62Å; V189-F256 HydrophobicContact CG1-CZ 4.48Å; T190-F256 PolarHBondContact O-N 3.35Å; I191-F256 CarbonylContact C-O 3.45Å; I191-F256 VanDerWaalsContact CA-O 3.3Å; I191-F256 WeakPolarHBondContact CA-O 3.21Å; I191-F256 HydrophobicContact CG2-CB 4.3Å; V192-F256 PolarHBondContact N-O 2.91Å; L235-F256 HydrophobicContact CD2-CB 4.37Å; Y236-F256 CarbonylContact O-C 3.42Å; Y236-F256 WeakPolarHBondContact O-CA 3.21Å; T237-F256 HydrophobicContact CG2-CD1 4.32Å; T237-F256 HydrophobicContact CG2-CE1 4.1Å; I243-F256 HydrophobicContact CD1-CD1 3.66Å; I243-F256 HydrophobicContact CD1-CE1 3.54Å; I243-F256 HydrophobicContact CG1-CD1 3.74Å; I243-F256 HydrophobicContact CG1-CE1 4.04Å; F249-F256 HydrophobicContact CD1-CE1 4.43Å; F249-F256 HydrophobicContact CD1-CE2 4.36Å; F249-F256 HydrophobicContact CD1-CZ 4.26Å; D253-F256 HydrophobicContact CB-CE1 4.32Å; D253-F256 HydrophobicContact CB-CZ 4.12Å; D253-F256 WeakPolarHBondContact O-CE2 3.4Å; D253-F256 WeakPolarHBondContact O-CZ 3.41Å
257	I	80.7	Confident	67.5	Low	9 Å²	9	75.3 Å²	75.3	5%	0.046	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	124.1	-179.4	-56.3	177.2	0	0	0	109.3	V192 L235 Y236 F270	V192-I257 CarbonylContact O-C 3.48Å; V192-I257 WeakPolarHBondContact O-CA 3.31Å; L235-I257 WeakPolarHBondContact CA-O 3.26Å; Y236-I257 PolarHBondContact N-O 3.32Å; Y236-I257 PolarHBondContact O-N 2.97Å; I257-F270 HydrophobicContact CD1-CD1 3.8Å; I257-F270 HydrophobicContact CD1-CE1 3.83Å
258	A	81.4	Confident	66.5	Low	0 Å²	0	75.6 Å²	75.6	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	115.8	-175.1	0	0	0	0	0	112.4	I191 V192 S194 I225 V232 L235	I191-A258 HydrophobicContact CG2-CB 3.88Å; V192-A258 PolarHBondContact O-N 2.91Å; S194-A258 WeakPolarHBondContact CB-O 3.39Å; S194-A258 PolarHBondContact N-O 3.35Å; I225-A258 HydrophobicContact CD1-CB 3.42Å; I225-A258 VanDerWaalsContact CD1-CB 3.42Å; V232-A258 HydrophobicContact CG1-CB 3.87Å; V232-A258 HydrophobicContact CG2-CB 4.07Å; L235-A258 HydrophobicContact CD2-CB 3.78Å
259	C	74.2	Confident	65.4	Low	5 Å²	5	74.2 Å²	74.2	3%	0.034	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	131.4	-173.9	-57.2	0	0	0	0	112.2	S194 K233 R234 Y236	S194-C259 PolarHBondContact OG-SG 3.36Å; K233-C259 PolarHBondContact N-O 3Å; R234-C259 PolarHBondContact N-O 2.81Å; R234-C259 PolarHBondContact O-N 2.86Å; Y236-C259 HydrophobicContact CE2-CB 4.32Å
260	G	73.1	Confident	64.3	Low	7 Å²	7	76.1 Å²	76.1	7%	0.072	36%	0.363	C	S	.	.			trans	-83.7	-161.2	175.4	0	0	0	0	0	113.6	L227 E262	L227-G260 VanDerWaalsContact CD1-N 3.33Å; G260-E262 PolarHBondContact O-N 2.85Å
261	P	56.6	Low	63.2	Low	75 Å²	75	79.3 Å²	79.3	49%	0.487	38%	0.382	S	S	.	.	S	Bend	trans	-74.4	-6.1	174	31.6	-35.9	0	0	0	114.4	S229	S229-P261 WeakPolarHBondContact O-CD 3.35Å; S229-P261 WeakPolarHBondContact O-CG 3.4Å
262	E	57.2	Low	62.2	Low	127 Å²	127	79 Å²	79	59%	0.593	37%	0.374	S	S	*	.	S	Bend	trans	-58.5	156.6	178.1	-66.1	-58.8	148.2	0	0	113.9	S229 G260 F264	S229-E262 VanDerWaalsContact CB-OE1 3.31Å; S229-E262 WeakPolarHBondContact CB-OE1 3.35Å; G260-E262 PolarHBondContact O-N 2.85Å; E262-F264 PolarHBondContact O-N 2.81Å
263	K	45.2	Very low	61.1	Low	202 Å²	202	73.9 Å²	73.9	88%	0.878	35%	0.352	S	S	*	.	P	Polyproline II helix	trans	-70.1	117	175.1	-74.7	-172.5	178.2	-179.4	0	111	R265	K263-R265 PolarHBondContact O-N 2.84Å
264	F	46.3	Very low	59.2	Low	61 Å²	61	80.1 Å²	80.1	27%	0.268	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-58.7	119	-178.7	-162.7	-100.5	0	0	0	112	Y236 E262 Y266 F270	Y236-F264 HydrophobicContact CD1-CZ 4.43Å; Y236-F264 AromaticContact CD2-CE2 3.85Å; Y236-F264 HydrophobicContact CD2-CE2 3.85Å; Y236-F264 HydrophobicContact CD2-CZ 4.36Å; Y236-F264 HydrophobicContact CE1-CE2 4.32Å; Y236-F264 HydrophobicContact CE1-CZ 4.17Å; Y236-F264 HydrophobicContact CE2-CD2 4.27Å; Y236-F264 AromaticContact CE2-CE2 3.45Å; Y236-F264 HydrophobicContact CE2-CE2 3.45Å; Y236-F264 VanDerWaalsContact CE2-CE2 3.45Å; Y236-F264 HydrophobicContact CE2-CZ 4.1Å; Y236-F264 HydrophobicContact CG-CE2 4.44Å; Y236-F264 AromaticContact CZ-CE2 3.72Å; Y236-F264 AromaticContact CZ-CZ 4Å; E262-F264 PolarHBondContact O-N 2.81Å; F264-Y266 AromaticContact CD1-CD2 3.74Å; F264-Y266 HydrophobicContact CD1-CD2 3.74Å; F264-Y266 HydrophobicContact CD1-CE2 4.18Å; F264-Y266 HydrophobicContact CD1-CG 4.43Å; F264-Y266 AromaticContact CE1-CD2 3.61Å; F264-Y266 HydrophobicContact CE1-CD2 3.61Å; F264-Y266 AromaticContact CE1-CE2 3.72Å; F264-Y266 HydrophobicContact CE1-CE2 3.72Å; F264-Y266 HydrophobicContact CE1-CG 4.18Å; F264-F270 AromaticContact CE1-CE2 3.98Å; F264-F270 HydrophobicContact CE1-CE2 3.98Å; F264-F270 HydrophobicContact CE1-CZ 4.49Å; F264-F270 AromaticContact CZ-CE2 3.71Å; F264-F270 HydrophobicContact CZ-CE2 3.71Å; F264-F270 AromaticContact CZ-CZ 3.81Å; F264-F270 HydrophobicContact CZ-CZ 3.81Å
265	R	53	Low	57.4	Low	175 Å²	175	81.9 Å²	81.9	66%	0.66	39%	0.39	S	S	*	.			trans	-99.3	101.9	175.3	-73.8	-171.4	-178.7	142.1	2.6	110.3	K263 Q267	K263-R265 PolarHBondContact O-N 2.84Å; R265-Q267 PolarHBondContact O-N 2.85Å; R265-Q267 VanDerWaalsContact O-N 3.08Å
266	Y	47.7	Very low	55.7	Low	171 Å²	171	82.5 Å²	82.5	67%	0.671	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-15.4	-169.2	-132.8	-76.1	0	0	0	115.4	F264	F264-Y266 AromaticContact CD1-CD2 3.74Å; F264-Y266 HydrophobicContact CD1-CD2 3.74Å; F264-Y266 HydrophobicContact CD1-CE2 4.18Å; F264-Y266 HydrophobicContact CD1-CG 4.43Å; F264-Y266 AromaticContact CE1-CD2 3.61Å; F264-Y266 HydrophobicContact CE1-CD2 3.61Å; F264-Y266 AromaticContact CE1-CE2 3.72Å; F264-Y266 HydrophobicContact CE1-CE2 3.72Å; F264-Y266 HydrophobicContact CE1-CG 4.18Å
267	Q	46.5	Very low	53.8	Low	161 Å²	161	84.7 Å²	84.7	75%	0.752	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109	-22.9	-169.5	-70.7	175.5	-49.4	0	0	115.3	R265 N271	R265-Q267 PolarHBondContact O-N 2.85Å; R265-Q267 VanDerWaalsContact O-N 3.08Å; Q267-N271 PolarHBondContact O-ND2 2.97Å
268	D	51.5	Low	52.1	Low	101 Å²	101	93.6 Å²	93.6	54%	0.54	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	-29	-176.4	-64.3	-43.8	0	0	0	113.8	R199	R199-D268 PolarHBondContact NH2-O 3.36Å
269	D	53.9	Low	50.3	Low	21 Å²	21	99.8 Å²	99.8	11%	0.112	48%	0.477	C	S	.	.	S	Bend	trans	-85.5	-17.8	-170.9	-83.8	-19.3	0	0	0	114.8	S194 G195 R199	S194-D269 WeakPolarHBondContact CB-OD2 3.36Å; S194-D269 VanDerWaalsContact OG-CG 3.24Å; S194-D269 PolarHBondContact OG-OD2 2.88Å; G195-D269 WeakPolarHBondContact CA-OD1 3.27Å; G195-D269 VanDerWaalsContact N-CG 3.35Å; G195-D269 PolarHBondContact N-OD1 2.87Å; G195-D269 PolarHBondContact N-OD2 3.32Å; G195-D269 VanDerWaalsContact N-OD2 3.12Å; R199-D269 IonicContact CZ-OD1 2.78Å; R199-D269 IonicContact NE-OD1 2.89Å; R199-D269 IonicContact NH2-OD1 3.15Å; R199-D269 PolarHBondContact NH2-OD1 2.81Å
270	F	49.4	Very low	49	Very low	40 Å²	40	101.9 Å²	101.9	18%	0.175	49%	0.49	C	S	.	.	S	Bend	trans	-95.1	-16.9	176.7	-68.7	-72.9	0	0	0	114.3	V238 I257 F264 L272	V238-F270 WeakPolarHBondContact O-CD1 3.48Å; I257-F270 HydrophobicContact CD1-CD1 3.8Å; I257-F270 HydrophobicContact CD1-CE1 3.83Å; F264-F270 AromaticContact CE1-CE2 3.98Å; F264-F270 HydrophobicContact CE1-CE2 3.98Å; F264-F270 HydrophobicContact CE1-CZ 4.49Å; F264-F270 AromaticContact CZ-CE2 3.71Å; F264-F270 HydrophobicContact CZ-CE2 3.71Å; F264-F270 AromaticContact CZ-CZ 3.81Å; F264-F270 HydrophobicContact CZ-CZ 3.81Å; F270-L272 PolarHBondContact O-N 3.41Å
271	N	47.5	Very low	47.5	Very low	109 Å²	109	109 Å²	109	58%	0.583	52%	0.519	S	S	*	.			trans	-82.5	96	174.8	-73.1	-44.5	0	0	0	110	Q267	Q267-N271 PolarHBondContact O-ND2 2.97Å
272	L	51.5	Low	46.3	Very low	44 Å²	44	110.8 Å²	110.8	23%	0.23	53%	0.533	C	S	.	.			trans	-85.5	117.4	165.9	-64.7	174.4	0	0	0	108.6	F270 E276	F270-L272 PolarHBondContact O-N 3.41Å; L272-E276 HydrophobicContact CB-CB 4.44Å; L272-E276 HydrophobicContact CD2-CB 4.28Å
273	D	46.4	Very low	45	Very low	86 Å²	86	109.2 Å²	109.2	46%	0.46	54%	0.536	S	S	.	.			trans	-63.7	158.9	176.2	-56.9	-51	0	0	0	110.7	K197 N275 E276 C277	K197-D273 IonicContact NZ-OD2 3.79Å; K197-D273 PolarHBondContact NZ-OD2 2.78Å; D273-N275 PolarHBondContact O-N 3.23Å; D273-E276 PolarHBondContact O-N 3.34Å; D273-C277 PolarHBondContact O-N 3.13Å
274	E	38.7	Very low	44.3	Very low	171 Å²	171	105.4 Å²	105.4	80%	0.799	54%	0.535	S	S	*	.	H	α-helix	trans	-53.4	-29.4	175.8	-76.1	-167.5	102.6	0	0	112.9	C277 R278	E274-C277 WeakPolarHBondContact O-CB 3.33Å; E274-C277 PolarHBondContact O-N 2.96Å; E274-R278 PolarHBondContact O-N 2.88Å; E274-R278 VanDerWaalsContact O-N 3.08Å
275	N	41	Very low	43.6	Very low	125 Å²	125	113.3 Å²	113.3	67%	0.668	57%	0.565	S	S	*	*	H	α-helix	trans	-71.8	-35.4	175.5	-71.1	-21.4	0	0	0	113.4	D273 C277 R278	D273-N275 PolarHBondContact O-N 3.23Å; N275-C277 VanDerWaalsContact C-N 3.34Å; N275-R278 PolarHBondContact O-N 3.23Å
276	E	45.3	Very low	42.6	Very low	42 Å²	42	108.6 Å²	108.6	20%	0.196	57%	0.57	C	S	.	*	H	α-helix	trans	-73.5	-29.4	172.3	-69.2	-173	138.3	0	0	111	K197 R199 L272 D273 V279 T280	K197-E276 WeakPolarHBondContact CE-OE2 3.18Å; K197-E276 IonicContact NZ-OE2 2.89Å; R199-E276 IonicContact NH1-OE2 2.66Å; L272-E276 HydrophobicContact CB-CB 4.44Å; L272-E276 HydrophobicContact CD2-CB 4.28Å; D273-E276 PolarHBondContact O-N 3.34Å; E276-V279 PolarHBondContact O-N 3.48Å; E276-T280 PolarHBondContact O-N 2.66Å; E276-T280 PolarHBondContact O-OG1 2.66Å
277	C	43.4	Very low	41.6	Very low	47 Å²	47	112.2 Å²	112.2	32%	0.318	58%	0.583	S	S	.	*	H	α-helix	trans	-64.7	-37.8	170.8	-70.6	0	0	0	0	113.1	D273 E274 N275 V279 T280 K281	D273-C277 PolarHBondContact O-N 3.13Å; E274-C277 WeakPolarHBondContact O-CB 3.33Å; E274-C277 PolarHBondContact O-N 2.96Å; N275-C277 VanDerWaalsContact C-N 3.34Å; C277-V279 VanDerWaalsContact C-N 3.32Å; C277-V279 PolarHBondContact O-N 2.86Å; C277-T280 WeakPolarHBondContact CA-OG1 3.33Å; C277-T280 PolarHBondContact O-N 2.65Å; C277-T280 PolarHBondContact O-OG1 3.39Å; C277-K281 PolarHBondContact O-N 2.73Å
278	R	44.1	Very low	40.8	Very low	195 Å²	195	112.4 Å²	112.4	74%	0.736	59%	0.588	S	S	*	*	H	α-helix	trans	-65.3	-31.4	175.9	-77.5	-174.4	176.1	-157.2	0.7	113.7	E274 N275 T280	E274-R278 PolarHBondContact O-N 2.88Å; E274-R278 VanDerWaalsContact O-N 3.08Å; N275-R278 PolarHBondContact O-N 3.23Å; R278-T280 VanDerWaalsContact C-N 3.29Å
279	V	44.3	Very low	39.7	Very low	130 Å²	130	113.2 Å²	113.2	79%	0.788	60%	0.599	S	S	*	*	H	α-helix	trans	-73.7	-23.3	176.4	178.9	0	0	0	0	111.9	E276 C277	E276-V279 PolarHBondContact O-N 3.48Å; C277-V279 VanDerWaalsContact C-N 3.32Å; C277-V279 PolarHBondContact O-N 2.86Å
280	T	47.4	Very low	38.4	Very low	50 Å²	50	118.1 Å²	118.1	31%	0.307	63%	0.63	S	S	.	*	H	α-helix	trans	-104	-17.1	-176.9	48	0	0	0	0	114.3	E276 C277 R278	E276-T280 PolarHBondContact O-N 2.66Å; E276-T280 PolarHBondContact O-OG1 2.66Å; C277-T280 WeakPolarHBondContact CA-OG1 3.33Å; C277-T280 PolarHBondContact O-N 2.65Å; C277-T280 PolarHBondContact O-OG1 3.39Å; R278-T280 VanDerWaalsContact C-N 3.29Å
281	K	40.2	Very low	37.5	Very low	157 Å²	157	122.3 Å²	122.3	68%	0.683	66%	0.658	S	S	*	*			trans	-123.3	104.8	177.1	-68.5	-179.3	179.1	174.2	0	111.9	C277	C277-K281 PolarHBondContact O-N 2.73Å
282	S	31.2	Very low	36.8	Very low	112 Å²	112	125.8 Å²	125.8	78%	0.783	67%	0.671	S	S	*	*			trans	-147.6	131.5	162.3	-79	0	0	0	0	108.8
283	S	31.3	Very low	35.6	Very low	93 Å²	93	127 Å²	127	65%	0.65	69%	0.694	S	S	*	*			trans	60.7	80.1	-173.5	-152.2	0	0	0	0	116.9
284	S	30.5	Very low	34.8	Very low	123 Å²	123	134.8 Å²	134.8	86%	0.86	72%	0.717	S	S	*	*			trans	-144	117.8	139.4	61.7	0	0	0	0	109.4
285	Y	31.8	Very low	34.3	Very low	227 Å²	227	132.1 Å²	132.1	89%	0.89	72%	0.717	S	S	*	*			trans	-91	135	-175.1	-87.4	-88.2	0	0	0	112.2
286	G	30.3	Very low	33.8	Very low	75 Å²	75	133.5 Å²	133.5	77%	0.773	72%	0.724	S	S	*	*			trans	65.3	84	144.5	0	0	0	0	0	118.7
287	R	27.7	Very low	33.7	Very low	248 Å²	248	136.9 Å²	136.9	94%	0.936	75%	0.749	S	S	*	*			trans	-128.3	135.1	142.2	-81.2	-167.1	176	-163	-1	110.9
288	L	29	Very low	33	Very low	164 Å²	164	144.7 Å²	144.7	86%	0.859	77%	0.772	S	S	*	*			trans	-76	136.3	172.9	-67.6	164.3	0	0	0	109.5	T290	L288-T290 PolarHBondContact O-N 2.75Å
289	P	28.7	Very low	32.3	Very low	118 Å²	118	141.2 Å²	141.2	77%	0.766	77%	0.773	S	S	*	*			trans	-78.9	103.2	175.7	30.4	-32.8	0	0	0	111	V291	P289-V291 PolarHBondContact O-N 2.81Å
290	T	27.6	Very low	31.5	Very low	125 Å²	125	139.2 Å²	139.2	77%	0.767	78%	0.778	S	S	*	*			trans	-73.9	108.3	170.7	-55.4	0	0	0	0	109.9	L288 H292	L288-T290 PolarHBondContact O-N 2.75Å; T290-H292 PolarHBondContact O-N 3.11Å
291	V	29.7	Very low	30.7	Very low	128 Å²	128	140.3 Å²	140.3	78%	0.776	80%	0.799	S	S	*	*			trans	-65.4	129.3	-179.4	178.4	0	0	0	0	111.5	P289	P289-V291 PolarHBondContact O-N 2.81Å
292	H	32.4	Very low	30.3	Very low	182 Å²	182	142.5 Å²	142.5	84%	0.843	82%	0.815	S	S	*	*			trans	-129	137.7	152.4	-85.1	55.2	0	0	0	107.2	T290	T290-H292 PolarHBondContact O-N 3.11Å
293	G	26.9	Very low	30.2	Very low	70 Å²	70	142 Å²	142	72%	0.722	81%	0.812	S	S	*	*			trans	-158.9	157.4	-172.4	0	0	0	0	0	115.4
294	R	30.1	Very low	30.3	Very low	249 Å²	249	148.9 Å²	148.9	94%	0.94	82%	0.823	S	S	*	*			trans	-160	143.4	165.6	-90.1	165.9	-171.4	-153.9	0.4	105
295	S	27.9	Very low	30.2	Very low	114 Å²	114	153.7 Å²	153.7	80%	0.797	82%	0.822	S	S	*	*			cis	-155.5	163.1	3.4	39.3	0	0	0	0	111.9
296	L	30.3	Very low	30.2	Very low	154 Å²	154	147.1 Å²	147.1	81%	0.806	81%	0.81	S	S	*	*			trans	-67	175.5	176.5	-113.8	75.3	0	0	0	113.2
297	P	42.4	Very low	30.1	Very low	114 Å²	114	153 Å²	153	74%	0.74	81%	0.814	S	S	*	*			cis	-132.8	-177.4	31.5	37.6	-14.9	0	0	0	114.9
298	R	28.7	Very low	30.1	Very low	210 Å²	210	146.3 Å²	146.3	79%	0.792	81%	0.805	S	S	*	*			cis	-148.8	142.3	25.1	-62.8	166.2	56.7	163.9	-3.7	114.8
299	T	29.6	Very low	30.9	Very low	123 Å²	123	144.3 Å²	144.3	76%	0.755	80%	0.802	S	S	*	*			trans	45.1	120.9	140.1	61	0	0	0	0	123.6
300	G	28.3	Very low	31	Very low	87 Å²	87	143.9 Å²	143.9	90%	0.897	80%	0.802	S	S	*	*			trans	111.3	128.5	146.9	0	0	0	0	0	115.9
301	G	29.5	Very low	32.1	Very low	73 Å²	73	143.6 Å²	143.6	75%	0.753	80%	0.802	S	S	*	*			cis	177.6	167.6	-7.5	0	0	0	0	0	113.9
302	M	32.4	Very low	32.1	Very low	203 Å²	203	142.7 Å²	142.7	100%	1	81%	0.808	S	S	*	*			trans	72.5	156.9	174.1	-52.8	-159.7	76.6	0	0	118.2
303	S	29.3	Very low	31.9	Very low	103 Å²	103	137.8 Å²	137.8	72%	0.72	81%	0.806	S	S	*	*			trans	-150.6	143.9	-158.8	167	0	0	0	0	112.5
304	R	32.6	Very low	32	Very low	237 Å²	237	140.3 Å²	140.3	89%	0.894	81%	0.813	S	S	*	*			trans	179.2	118.3	137.3	-90.9	145.1	-167.6	-155	2.8	107.8
305	R	28.9	Very low	32	Very low	224 Å²	224	132.5 Å²	132.5	85%	0.845	80%	0.802	S	S	*	*				81.5	86	63.2	-171.8	174.3	-177.8	174.7	1.3	113.2
306	S	31.1	Very low	32.1	Very low	89 Å²	89	135 Å²	135	62%	0.622	81%	0.806	S	S	*	*				58.2	152.2	118.4	85.6	0	0	0	0	120.3
307	K	29.1	Very low	31.9	Very low	197 Å²	197	130.5 Å²	130.5	86%	0.857	80%	0.797	S	S	*	*			cis	-166	172.8	3.6	-129.9	171.4	-177.3	-175.1	0	109.1
308	S	28.6	Very low	31.2	Very low	109 Å²	109	132 Å²	132	76%	0.762	80%	0.804	S	S	*	*			trans	-60.7	171	165.3	-5.3	0	0	0	0	112.8
309	P	45.3	Very low	31.2	Very low	122 Å²	122	126.7 Å²	126.7	79%	0.792	81%	0.805	S	S	*	*			cis	-146.3	-176.4	38.6	42.7	-21.7	0	0	0	118.6
310	S	31.2	Very low	31.2	Very low	108 Å²	108	124.4 Å²	124.4	76%	0.755	81%	0.807	S	S	*	*			trans	-65.5	175.8	162.9	-19.6	0	0	0	0	112.5
311	P	49.8	Very low	31.5	Very low	120 Å²	120	125.2 Å²	125.2	78%	0.779	80%	0.798	S	S	*	*				-153.3	176	52.6	43.6	-22.6	0	0	0	119.5
312	A	29.8	Very low	31.6	Very low	109 Å²	109	127.9 Å²	127.9	90%	0.901	80%	0.8	S	S	*	*			trans	57.7	140.1	146.6	0	0	0	0	0	122.7
313	G	28.3	Very low	31.5	Very low	78 Å²	78	125.4 Å²	125.4	80%	0.804	79%	0.79	S	S	*	*			trans	168.2	137.4	167.7	0	0	0	0	0	112.2
314	S	29.7	Very low	31.6	Very low	124 Å²	124	125.2 Å²	125.2	87%	0.867	79%	0.789	S	S	*	*			trans	-115.5	143.7	-170.8	-63.5	0	0	0	0	115
315	A	30.4	Very low	31.6	Very low	84 Å²	84	120 Å²	120	69%	0.694	78%	0.784	S	S	*	*			trans	69.6	134.9	138.3	0	0	0	0	0	123.7
316	N	28.5	Very low	32.4	Very low	167 Å²	167	114.8 Å²	114.8	89%	0.893	78%	0.778	S	S	*	*			trans	75.2	148.8	142.1	-63.3	-5.7	0	0	0	122.4
317	G	27	Very low	32.5	Very low	60 Å²	60	122.3 Å²	122.3	62%	0.619	79%	0.793	S	S	*	*			trans	97.1	124.8	-177.1	0	0	0	0	0	112.2
318	T	26.8	Very low	32.6	Very low	145 Å²	145	119.3 Å²	119.3	89%	0.89	80%	0.797	S	S	*	*			cis	59.7	129.7	9.7	24.3	0	0	0	0	115.6
319	A	28.8	Very low	32.6	Very low	98 Å²	98	117.3 Å²	117.3	81%	0.81	79%	0.794	S	S	*	*			cis	-158	167.5	2.3	0	0	0	0	0	113.3
320	G	29.2	Very low	31.9	Very low	76 Å²	76	121.5 Å²	121.5	78%	0.784	80%	0.8	S	S	*	*			trans	102.7	150.5	160.8	0	0	0	0	0	116.3
321	S	35.1	Very low	32	Very low	104 Å²	104	121.6 Å²	121.6	73%	0.727	80%	0.8	S	S	*	*			cis	-165.6	168.8	-5.6	61.1	0	0	0	0	112.9
322	T	32.8	Very low	31.4	Very low	128 Å²	128	121.8 Å²	121.8	79%	0.785	80%	0.802	S	S	*	*			trans	72.4	149.7	172.9	75.5	0	0	0	0	116.8
323	L	30	Very low	31.2	Very low	152 Å²	152	121.8 Å²	121.8	80%	0.796	80%	0.795	S	S	*	*			cis	-149.2	153.9	-0.9	-152.5	78	0	0	0	112.3
324	S	30.2	Very low	32.4	Very low	99 Å²	99	123.1 Å²	123.1	69%	0.692	79%	0.79	S	S	*	*			trans	33.5	120.1	155.4	-61.5	0	0	0	0	125
325	T	33.2	Very low	32.3	Very low	128 Å²	128	124.3 Å²	124.3	79%	0.785	79%	0.785	S	S	*	*			trans	-10.3	162.8	134.4	54.7	0	0	0	0	120.9
326	P	46.1	Very low	32.1	Very low	113 Å²	113	128 Å²	128	73%	0.734	79%	0.792	S	S	*	*			cis	-143	154.8	23	38	-17.3	0	0	0	120.6
327	R	32	Very low	32.1	Very low	247 Å²	247	125.8 Å²	125.8	93%	0.932	78%	0.784	S	S	*	*			trans	35.8	123.1	139.9	-63.9	178.7	166.2	-171.1	-4.3	121.2
328	S	31.3	Very low	32.1	Very low	134 Å²	134	128 Å²	128	94%	0.937	79%	0.791	S	S	*	*				-163.4	152.8	93.8	-165.4	0	0	0	0	111.8
329	G	29.7	Very low	33.2	Very low	68 Å²	68	126.8 Å²	126.8	70%	0.701	79%	0.785	S	S	*	*			trans	-179.4	146.8	174.5	0	0	0	0	0	112.1
330	K	30.1	Very low	33.1	Very low	209 Å²	209	126.4 Å²	126.4	91%	0.909	78%	0.782	S	S	*	*			trans	-158.2	111	173.8	-106.2	174.1	-177.4	-179.8	0	111.4
331	S	32.6	Very low	33.1	Very low	110 Å²	110	127.9 Å²	127.9	77%	0.769	78%	0.78	S	S	*	*			trans	-72.5	173.3	150.1	-43.4	0	0	0	0	109
332	P	37.9	Very low	33	Very low	124 Å²	124	130.5 Å²	130.5	81%	0.805	79%	0.786	S	S	*	*				-153.4	172.8	81.4	40.9	-22.1	0	0	0	117
333	S	26.5	Very low	32.9	Very low	110 Å²	110	134.6 Å²	134.6	77%	0.769	79%	0.787	S	S	*	*			trans	-123.2	175	154.1	-23.7	0	0	0	0	107.1
334	P	53.8	Low	32.9	Very low	105 Å²	105	136.8 Å²	136.8	68%	0.682	78%	0.784	S	S	*	*			cis	-136.8	-174.8	-14	42.1	-24.9	0	0	0	113.9
335	I	27.2	Very low	33	Very low	149 Å²	149	142 Å²	142	76%	0.764	79%	0.789	S	S	*	*			trans	48.6	124.3	147	-64.7	153.6	0	0	0	120.8
336	L	26.2	Very low	32.9	Very low	162 Å²	162	143 Å²	143	85%	0.848	79%	0.785	S	S	*	*				-163.7	176.8	121.9	-108.2	172.4	0	0	0	112.5
337	T	27.6	Very low	32	Very low	120 Å²	120	140.7 Å²	140.7	74%	0.736	78%	0.781	S	S	*	*			trans	-98.8	162.6	-156.2	45.4	0	0	0	0	117.9
338	S	27.2	Very low	32.1	Very low	108 Å²	108	134 Å²	134	76%	0.755	77%	0.772	S	S	*	*			trans	-19.7	165.7	155.6	-46.7	0	0	0	0	119
339	P	49.3	Very low	32.2	Very low	118 Å²	118	135.6 Å²	135.6	77%	0.766	77%	0.765	S	S	*	*			cis	-150	168.3	24.9	43.8	-23.3	0	0	0	121.1
340	A	26.5	Very low	32.2	Very low	91 Å²	91	141.9 Å²	141.9	75%	0.752	77%	0.769	S	S	*	*			trans	57.7	138.4	139.8	0	0	0	0	0	124.7
341	S	30.6	Very low	32.2	Very low	106 Å²	106	137.4 Å²	137.4	74%	0.741	76%	0.764	S	S	*	*			trans	131.4	97.7	130.9	-58.8	0	0	0	0	119.3
342	L	32.1	Very low	32	Very low	160 Å²	160	135.4 Å²	135.4	84%	0.838	76%	0.761	S	S	*	*				64.1	142.6	127.9	-73.1	168.9	0	0	0	124.7
343	R	30.3	Very low	31.8	Very low	214 Å²	214	135.2 Å²	135.2	81%	0.808	76%	0.762	S	S	*	*			trans	74.7	149.6	153.2	-77.4	-176	176.7	-164.2	2	118.7
344	R	31.4	Very low	32.2	Very low	197 Å²	197	134.5 Å²	134.5	74%	0.743	76%	0.757	S	S	*	*			cis	-174	155.7	-21	-153.7	-173.9	-168.6	-171.3	4.1	109.9
345	R	31.2	Very low	31.2	Very low	208 Å²	208	137 Å²	137	79%	0.785	76%	0.764	S	S	*	*			trans	63.8	172.9	166.6	-74.3	-175	147.8	-175.5	-3.5	115.6
346	Q	32.5	Very low	31.6	Very low	151 Å²	151	134.2 Å²	134.2	71%	0.706	76%	0.758	S	S	*	*			cis	-166.1	159.3	-42.1	-103.2	-176	-104.9	0	0	107.3
347	G	27.1	Very low	31.8	Very low	64 Å²	64	134.4 Å²	134.4	66%	0.66	76%	0.759	S	S	*	*			cis	113.2	103	-12.9	0	0	0	0	0	116.8
348	S	32.9	Very low	32	Very low	105 Å²	105	132.9 Å²	132.9	73%	0.734	76%	0.758	S	S	*	*			trans	154.5	162.4	149	-166.8	0	0	0	0	114.5
349	Q	33.9	Very low	32.3	Very low	169 Å²	169	133.3 Å²	133.3	79%	0.79	76%	0.761	S	S	*	*			trans	78.4	148.9	160.2	-51.7	-147	1.3	0	0	120.8
350	Y	30	Very low	31.4	Very low	200 Å²	200	133.6 Å²	133.6	78%	0.784	76%	0.761	S	S	*	*			cis	-170.4	157.6	-34.8	-128.2	-76	0	0	0	111.9
351	S	29.8	Very low	31.6	Very low	115 Å²	115	139.3 Å²	139.3	80%	0.804	77%	0.769	S	S	*	*			trans	73.1	145.9	151.2	-78.6	0	0	0	0	124.6
352	G	27.3	Very low	31.6	Very low	68 Å²	68	140.7 Å²	140.7	70%	0.701	77%	0.772	S	S	*	*			trans	105	102.9	163.9	0	0	0	0	0	114.6
353	S	35.3	Very low	31.4	Very low	120 Å²	120	138.4 Å²	138.4	84%	0.839	77%	0.768	S	S	*	*				71.4	131.2	52.9	-56.9	0	0	0	0	114.3
354	S	34	Very low	31.4	Very low	95 Å²	95	133.2 Å²	133.2	66%	0.664	77%	0.765	S	S	*	*			cis	-177.4	164.6	-2.3	47.5	0	0	0	0	113
355	L	33.7	Very low	31.2	Very low	158 Å²	158	129.7 Å²	129.7	83%	0.827	77%	0.771	S	S	*	*			trans	75.5	154.4	163.3	-46.7	-175.3	0	0	0	117.9
356	S	33.8	Very low	31.7	Very low	90 Å²	90	128.8 Å²	128.8	63%	0.629	78%	0.778	S	S	*	*			cis	-172.2	168.7	-23.2	-94.3	0	0	0	0	111.9
357	L	32.1	Very low	31.7	Very low	166 Å²	166	129.3 Å²	129.3	87%	0.869	79%	0.785	S	S	*	*			trans	73.2	122.2	167.4	-64.9	131.1	0	0	0	116.3
358	A	31.8	Very low	32.5	Very low	87 Å²	87	135.4 Å²	135.4	72%	0.719	80%	0.797	S	S	*	*				86.1	143.3	67.8	0	0	0	0	0	112.9
359	S	32.1	Very low	32.4	Very low	117 Å²	117	134.1 Å²	134.1	82%	0.818	80%	0.8	S	S	*	*			cis	-155.6	-178.4	12.3	-141.3	0	0	0	0	113.6
360	T	31	Very low	32.4	Very low	125 Å²	125	134 Å²	134	77%	0.767	81%	0.805	S	S	*	*			trans	-61.7	149	-175.1	55	0	0	0	0	117.8
361	K	31.4	Very low	32.5	Very low	210 Å²	210	127.8 Å²	127.8	91%	0.913	80%	0.801	S	S	*	*				-165.7	-177.3	127.8	-115	177.9	-176.5	-176.8	0	114.4
362	V	30.9	Very low	33.2	Very low	135 Å²	135	128.2 Å²	128.2	82%	0.818	80%	0.801	S	S	*	*			trans	-128.9	146	-161.8	177.1	0	0	0	0	111.4
363	C	26.6	Very low	33.4	Very low	112 Å²	112	131 Å²	131	76%	0.757	80%	0.8	S	S	*	*				141.6	132.2	129.9	-152.3	0	0	0	0	116.1
364	S	30.2	Very low	33.5	Very low	106 Å²	106	130.8 Å²	130.8	74%	0.741	80%	0.799	S	S	*	*			trans	34.2	128.8	149.9	64.8	0	0	0	0	123.5
365	S	28.4	Very low	33.4	Very low	123 Å²	123	134.3 Å²	134.3	86%	0.86	81%	0.805	S	S	*	*				-161.4	169.4	114.8	61.5	0	0	0	0	111.2
366	M	40.1	Very low	33.5	Very low	189 Å²	189	132.9 Å²	132.9	93%	0.931	80%	0.802	S	S	*	*			trans	-100.1	155.1	-177.5	-58.2	155.7	81	0	0	111.2
367	D	32.8	Very low	33.4	Very low	162 Å²	162	136 Å²	136	87%	0.866	81%	0.806	S	S	*	*			trans	-158	158.9	143	-153.6	5.8	0	0	0	110.5
368	E	43.3	Very low	33.5	Very low	192 Å²	192	133.4 Å²	133.4	90%	0.897	80%	0.8	S	S	*	*			trans	-126.1	147.7	175.9	-72.3	-144.2	136.8	0	0	111.9
369	G	31.4	Very low	33.9	Very low	78 Å²	78	135.6 Å²	135.6	80%	0.804	80%	0.804	S	S	*	*			trans	-175.4	46.6	-172	0	0	0	0	0	119.3
370	D	33.7	Very low	34.3	Very low	167 Å²	167	138.9 Å²	138.9	89%	0.893	81%	0.806	S	S	*	*			trans	41.7	94.9	146.4	-154.1	12.7	0	0	0	122.4
371	G	32.5	Very low	34.7	Very low	68 Å²	68	142.3 Å²	142.3	70%	0.701	81%	0.813	S	S	*	*			trans	74.5	172.9	135.9	0	0	0	0	0	121.9
372	P	45.1	Very low	35.6	Very low	124 Å²	124	134.9 Å²	134.9	81%	0.805	79%	0.787	S	S	*	*			cis	-123.1	169.1	-9.9	41.2	-28.1	0	0	0	114.9
373	N	31.8	Very low	36.9	Very low	128 Å²	128	130.8 Å²	130.8	68%	0.684	77%	0.765	S	S	*	*			trans	-1.6	119.4	171.8	-67.8	22.1	0	0	0	120
374	S	35.9	Very low	39.2	Very low	115 Å²	115	131.3 Å²	131.3	80%	0.804	77%	0.767	S	S	*	*			trans	-124.4	106.3	132.8	-71.2	0	0	0	0	107.7	V376	S374-V376 PolarHBondContact O-N 3.27Å
375	E	31.6	Very low	41.7	Very low	169 Å²	169	127.9 Å²	127.9	79%	0.79	74%	0.741	S	S	*	*			trans	-72	92.3	179	-70.5	177.3	133.7	0	0	109.3	E377	E375-E377 PolarHBondContact O-N 2.05Å; E375-E377 VanDerWaalsContact O-N 3.12Å
376	V	37.5	Very low	44.6	Very low	127 Å²	127	123.2 Å²	123.2	77%	0.77	71%	0.708	S	S	*	*			trans	-76.1	96.1	169.1	-177.6	0	0	0	0	107.3	S374	S374-V376 PolarHBondContact O-N 3.27Å
377	E	31.6	Very low	46.8	Very low	155 Å²	155	119 Å²	119	72%	0.724	69%	0.693	S	S	*	*			trans	-40.5	123.9	167.3	-79.4	-73.6	127.4	0	0	110.2	E375 V379	E375-E377 PolarHBondContact O-N 2.05Å; E375-E377 VanDerWaalsContact O-N 3.12Å; E377-V379 PolarHBondContact O-N 2.88Å
378	P	34.1	Very low	49.4	Very low	112 Å²	112	113.7 Å²	113.7	73%	0.727	67%	0.669	S	S	*	*			trans	-70.5	97.3	-179.2	28.6	-33.4	0	0	0	109.1	E380	P378-E380 PolarHBondContact O-N 3.49Å
379	V	40.6	Very low	51.7	Low	133 Å²	133	104.6 Å²	104.6	81%	0.806	63%	0.626	S	S	*	*			trans	-56.6	112.2	173.6	-175.6	0	0	0	0	108	E377 E381	E377-V379 PolarHBondContact O-N 2.88Å; V379-E381 PolarHBondContact O-N 2.89Å
380	E	39.7	Very low	54.5	Low	187 Å²	187	102.3 Å²	102.3	87%	0.874	60%	0.6	S	S	*	*			trans	-57.3	107.3	176.6	-77.7	-164.9	121.9	0	0	109.5	P378 C382	P378-E380 PolarHBondContact O-N 3.49Å; E380-C382 PolarHBondContact O-N 2.9Å
381	E	39.4	Very low	57.4	Low	196 Å²	196	99.7 Å²	99.7	92%	0.916	59%	0.586	S	S	*	*			trans	-75.7	79.8	-177.7	-164.1	167.4	-139.9	0	0	109.6	V379	V379-E381 PolarHBondContact O-N 2.89Å
382	C	49.3	Very low	60.3	Low	54 Å²	54	101.2 Å²	101.2	37%	0.365	57%	0.57	S	S	.	*	P	Polyproline II helix	trans	-48.3	140.6	178.4	-172.7	0	0	0	0	110.9	E380	E380-C382 PolarHBondContact O-N 2.9Å
383	S	59.7	Low	62.8	Low	50 Å²	50	95.4 Å²	95.4	35%	0.35	53%	0.533	S	S	.	.	P	Polyproline II helix	trans	-48.2	134.5	-169.8	53.2	0	0	0	0	112.7	V385	S383-V385 PolarHBondContact O-N 2.79Å
384	P	75.1	Confident	65.8	Low	122 Å²	122	95.9 Å²	95.9	79%	0.792	53%	0.528	S	S	*	.	P	Polyproline II helix	trans	-59.7	117.9	-171.1	21.9	-33.1	0	0	0	110.4
385	V	82	Confident	68.6	Low	34 Å²	34	92 Å²	92	21%	0.206	50%	0.5	C	S	.	.	P	Polyproline II helix	trans	-57.4	132.8	-179.8	176.2	0	0	0	0	109.1	S383 T387 I389 V395	S383-V385 PolarHBondContact O-N 2.79Å; V385-T387 PolarHBondContact O-N 3.29Å; V385-I389 HydrophobicContact CG1-CB 3.83Å; V385-I389 HydrophobicContact CG1-CG2 3.59Å; V385-V395 HydrophobicContact CG1-CG2 4.14Å; V385-V395 HydrophobicContact CG2-CG2 4.41Å
386	P	88.5	Confident	71.5	Confident	26 Å²	26	85 Å²	85	17%	0.169	47%	0.474	C	S	.	.	P	Polyproline II helix	trans	-52.8	137.8	-179	-28.6	34.7	0	0	0	112.3	S388 I389 A390 T460 Y465	P386-S388 PolarHBondContact O-N 2.9Å; P386-S388 VanDerWaalsContact O-N 3.15Å; P386-I389 WeakPolarHBondContact O-CA 3.38Å; P386-I389 PolarHBondContact O-N 3.01Å; P386-A390 PolarHBondContact O-N 3.17Å; P386-T460 HydrophobicContact CG-CG2 3.78Å; P386-Y465 HydrophobicContact CG-CD2 4.1Å; P386-Y465 HydrophobicContact CG-CE1 4.49Å; P386-Y465 HydrophobicContact CG-CE2 3.6Å
387	T	87.6	Confident	74.1	Confident	100 Å²	100	85.8 Å²	85.8	61%	0.613	46%	0.463	S	S	*	.	H	α-helix	trans	-52.8	-41.3	-176.4	-34.1	0	0	0	0	111.8	V385 I389 A390 D391	V385-T387 PolarHBondContact O-N 3.29Å; T387-I389 VanDerWaalsContact C-N 3.27Å; T387-I389 PolarHBondContact O-N 3.05Å; T387-A390 CarbonylContact O-C 3.51Å; T387-A390 PolarHBondContact O-N 3.35Å; T387-D391 VanDerWaalsContact O-CB 3.31Å; T387-D391 WeakPolarHBondContact O-CB 3.3Å; T387-D391 PolarHBondContact O-N 2.98Å
388	S	87.7	Confident	77	Confident	50 Å²	50	82.7 Å²	82.7	35%	0.35	45%	0.45	S	S	.	.	H	α-helix	trans	-56.4	-34	175.4	49.1	0	0	0	0	114.8	P386 M458	P386-S388 PolarHBondContact O-N 2.9Å; P386-S388 VanDerWaalsContact O-N 3.15Å; S388-M458 WeakPolarHBondContact OG-CE 3.37Å; S388-M458 PolarHBondContact OG-SD 3.08Å; S388-M458 VanDerWaalsContact OG-SD 3.36Å
389	I	91.1	Very high	79.6	Confident	1 Å²	1	78.5 Å²	78.5	1%	0.005	42%	0.421	C	S	.	.	H	α-helix	trans	-80.4	-45.5	172.1	-65.6	-65	0	0	0	109.9	V385 P386 T387 D391 R392 Y393 V395 L421 M458 V467	V385-I389 HydrophobicContact CG1-CB 3.83Å; V385-I389 HydrophobicContact CG1-CG2 3.59Å; P386-I389 WeakPolarHBondContact O-CA 3.38Å; P386-I389 PolarHBondContact O-N 3.01Å; T387-I389 VanDerWaalsContact C-N 3.27Å; T387-I389 PolarHBondContact O-N 3.05Å; I389-D391 VanDerWaalsContact C-N 3.32Å; I389-D391 PolarHBondContact O-N 2.85Å; I389-R392 PolarHBondContact O-N 2.87Å; I389-Y393 HydrophobicContact CD1-CD2 4.46Å; I389-Y393 HydrophobicContact CG2-CD2 4.33Å; I389-Y393 WeakPolarHBondContact O-CA 3.41Å; I389-Y393 WeakPolarHBondContact O-CB 3.34Å; I389-Y393 PolarHBondContact O-N 2.91Å; I389-V395 HydrophobicContact CG2-CG2 4.36Å; I389-L421 HydrophobicContact CG2-CD1 4.46Å; I389-L421 HydrophobicContact CG2-CD2 4.2Å; I389-M458 HydrophobicContact CD1-CB 3.95Å; I389-M458 HydrophobicContact CD1-CE 4.25Å; I389-M458 HydrophobicContact CG1-CB 3.99Å; I389-M458 HydrophobicContact CG1-CE 4.48Å; I389-M458 HydrophobicContact CG1-CG 4.16Å; I389-V467 HydrophobicContact CD1-CG2 4.37Å
390	A	90.8	Very high	81.7	Confident	31 Å²	31	73 Å²	73	26%	0.256	39%	0.392	S	S	.	.	H	α-helix	trans	-63	-34	-177.8	0	0	0	0	0	113.6	P386 T387 R392 R413	P386-A390 PolarHBondContact O-N 3.17Å; T387-A390 CarbonylContact O-C 3.51Å; T387-A390 PolarHBondContact O-N 3.35Å; A390-R392 VanDerWaalsContact C-N 3.32Å; A390-R392 PolarHBondContact O-N 2.93Å; A390-R413 PolarHBondContact O-NE 3.21Å; A390-R413 PolarHBondContact O-NH2 3.4Å
391	D	92.9	Very high	84	Confident	111 Å²	111	69.6 Å²	69.6	59%	0.594	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-29.3	178.8	-70.3	-22	0	0	0	112.5	T387 I389 R413	T387-D391 VanDerWaalsContact O-CB 3.31Å; T387-D391 WeakPolarHBondContact O-CB 3.3Å; T387-D391 PolarHBondContact O-N 2.98Å; I389-D391 VanDerWaalsContact C-N 3.32Å; I389-D391 PolarHBondContact O-N 2.85Å; D391-R413 VanDerWaalsContact O-CD 3.22Å; D391-R413 WeakPolarHBondContact O-CD 3.35Å
392	R	94.8	Very high	86.1	Confident	100 Å²	100	61.1 Å²	61.1	38%	0.377	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.3	-31.6	-177.8	-72.3	-174.6	57.5	-148.5	-17.3	113.8	I389 A390 E412 R413 E456	I389-R392 PolarHBondContact O-N 2.87Å; A390-R392 VanDerWaalsContact C-N 3.32Å; A390-R392 PolarHBondContact O-N 2.93Å; R392-E412 IonicContact NH2-OE1 3.62Å; R392-R413 WeakPolarHBondContact O-CB 3.1Å; R392-R413 WeakPolarHBondContact O-CG 3.21Å; R392-R413 PolarHBondContact O-N 2.9Å; R392-E456 IonicContact CZ-OE1 3.71Å; R392-E456 IonicContact CZ-OE2 2.84Å; R392-E456 IonicContact NH1-OE1 2.66Å; R392-E456 PolarHBondContact NH1-OE1 2.79Å; R392-E456 IonicContact NH1-OE2 2.64Å; R392-E456 PolarHBondContact NH1-OE2 2.86Å; R392-E456 IonicContact NH2-OE2 3.06Å; R392-E456 PolarHBondContact NH2-OE2 3.42Å
393	Y	96.3	Very high	87.8	Confident	3 Å²	3	64.1 Å²	64.1	1%	0.012	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	128.3	-176.4	-59.5	-86.5	0	0	0	110.9	I389 V395 V411 E412 Y419 E456 V467	I389-Y393 HydrophobicContact CD1-CD2 4.46Å; I389-Y393 HydrophobicContact CG2-CD2 4.33Å; I389-Y393 WeakPolarHBondContact O-CA 3.41Å; I389-Y393 WeakPolarHBondContact O-CB 3.34Å; I389-Y393 PolarHBondContact O-N 2.91Å; Y393-V395 PolarHBondContact O-N 3.15Å; Y393-V411 CarbonylContact C-O 3.46Å; Y393-V411 WeakPolarHBondContact CA-O 3.15Å; Y393-E412 HydrophobicContact CD1-CB 3.92Å; Y393-E412 HydrophobicContact CD1-CG 4.28Å; Y393-E412 HydrophobicContact CE1-CB 3.75Å; Y393-E412 HydrophobicContact CE1-CG 3.91Å; Y393-Y419 HydrophobicContact CE1-CD2 4.04Å; Y393-Y419 HydrophobicContact CE1-CE2 4.46Å; Y393-E456 PolarHBondContact OH-OE2 3.37Å; Y393-V467 HydrophobicContact CE1-CG1 3.89Å; Y393-V467 HydrophobicContact CE2-CG2 4.15Å
394	K	95.8	Very high	89.1	Confident	137 Å²	137	63.9 Å²	63.9	60%	0.596	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.4	100.2	165.1	-177.7	-171.9	176.1	-172.4	0	107.9	C410 V411 R413	K394-C410 WeakPolarHBondContact O-CA 2.65Å; K394-V411 PolarHBondContact N-O 3.13Å; K394-V411 PolarHBondContact O-N 3.04Å; K394-R413 HydrophobicContact CB-CG 4.48Å
395	V	94.9	Very high	89.9	Confident	33 Å²	33	58.1 Å²	58.1	20%	0.2	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	139.1	172.7	-174.5	0	0	0	0	109.9	V385 I389 Y393 R408 E409 C410 L421	V385-V395 HydrophobicContact CG1-CG2 4.14Å; V385-V395 HydrophobicContact CG2-CG2 4.41Å; I389-V395 HydrophobicContact CG2-CG2 4.36Å; Y393-V395 PolarHBondContact O-N 3.15Å; V395-R408 HydrophobicContact CG1-CB 3.88Å; V395-R408 HydrophobicContact CG1-CG 4.5Å; V395-E409 CarbonylContact C-O 3.52Å; V395-C410 HydrophobicContact CG2-CB 4.31Å; V395-L421 HydrophobicContact CG1-CD2 4.07Å; V395-L421 HydrophobicContact CG2-CD2 3.59Å
396	G	91.9	Very high	90.4	Very high	24 Å²	24	58 Å²	58	25%	0.247	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	-144.6	-176.6	0	0	0	0	0	113.1	R408 E409	G396-R408 PolarHBondContact O-NE 2.77Å; G396-R408 VanDerWaalsContact O-NE 3.11Å; G396-R408 PolarHBondContact O-NH2 2.9Å; G396-E409 PolarHBondContact N-O 3.15Å
397	R	92.4	Very high	90.6	Very high	142 Å²	142	56.8 Å²	56.8	54%	0.536	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	158.1	178.2	60.8	-175.9	161	-172.3	-6.5	112.6	R408 E409	R397-R408 WeakPolarHBondContact O-CA 3.21Å; R397-E409 HydrophobicContact CG-CB 4.21Å; R397-E409 IonicContact CZ-OE2 2.85Å; R397-E409 IonicContact NE-OE2 2.77Å; R397-E409 PolarHBondContact NE-OE2 3.3Å; R397-E409 IonicContact NH2-OE2 2.63Å; R397-E409 PolarHBondContact NH2-OE2 2.77Å; R397-E409 PolarHBondContact O-N 3.49Å
398	I	92.3	Very high	90.9	Very high	91 Å²	91	54.4 Å²	54.4	47%	0.467	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	133.4	161.5	-62.8	171.6	0	0	0	107.5	G400 V406 R408	I398-G400 WeakPolarHBondContact CG2-O 3.43Å; I398-V406 HydrophobicContact CD1-CG1 4.17Å; I398-V406 HydrophobicContact CG1-CG1 4.05Å; I398-V406 HydrophobicContact CG2-CG1 4.03Å; I398-R408 HydrophobicContact CG1-CG 4.15Å
399	L	87.8	Confident	91.2	Very high	23 Å²	23	53.6 Å²	53.6	12%	0.12	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	-32.1	173.8	-70.4	175.6	0	0	0	111.2	V407 E409 L470 T681 V685	L399-V407 HydrophobicContact CB-CG1 4.35Å; L399-V407 HydrophobicContact CD1-CG1 4.44Å; L399-V407 PolarHBondContact N-O 2.98Å; L399-E409 HydrophobicContact CD1-CB 3.96Å; L399-E409 HydrophobicContact CD1-CG 4.49Å; L399-E409 HydrophobicContact CD2-CB 4.05Å; L399-E409 HydrophobicContact CD2-CG 4.49Å; L399-E409 HydrophobicContact CG-CB 3.9Å; L399-L470 HydrophobicContact CD1-CD1 4.3Å; L399-L470 HydrophobicContact CD1-CD2 4.4Å; L399-T681 HydrophobicContact CD2-CG2 3.64Å; L399-V685 HydrophobicContact CB-CB 4.48Å; L399-V685 HydrophobicContact CB-CG1 3.77Å; L399-V685 HydrophobicContact CB-CG2 3.87Å; L399-V685 HydrophobicContact CD1-CG2 4.28Å
400	G	86.8	Confident	91.4	Very high	18 Å²	18	53.5 Å²	53.5	19%	0.186	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169	156.1	176.6	0	0	0	0	0	111.1	I398 V407 T689	I398-G400 WeakPolarHBondContact CG2-O 3.43Å; G400-V407 PolarHBondContact N-O 3.07Å; G400-V407 PolarHBondContact O-N 3.25Å; G400-T689 VanDerWaalsContact C-CG2 3.46Å
401	D	87.1	Confident	91.6	Very high	116 Å²	116	53.9 Å²	53.9	62%	0.62	27%	0.273	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.5	142.4	-179.5	-174	18.9	0	0	0	109.5
402	G	83.9	Confident	91.8	Very high	18 Å²	18	49.8 Å²	49.8	19%	0.186	25%	0.25	C	S	.	.			trans	-148.5	156.3	-173.2	0	0	0	0	0	110.7	F404 A405	G402-F404 PolarHBondContact O-N 3.2Å; G402-A405 WeakPolarHBondContact CA-O 3.44Å; G402-A405 PolarHBondContact N-O 3.27Å; G402-A405 PolarHBondContact O-N 2.92Å; G402-A405 VanDerWaalsContact O-N 3.13Å
403	N	85.5	Confident	91.9	Very high	116 Å²	116	52.1 Å²	52.1	62%	0.62	26%	0.259	S	S	*	.	S	Bend	trans	-48.1	-42.8	-166.4	-59.3	-68.8	0	0	0	113.2	K428 D694	N403-K428 WeakPolarHBondContact O-CD 3.03Å; N403-K428 WeakPolarHBondContact O-CE 3.4Å; N403-K428 PolarHBondContact O-NZ 2.98Å; N403-D694 PolarHBondContact ND2-OD1 3.33Å
404	F	86.4	Confident	91.8	Very high	45 Å²	45	56.4 Å²	56.4	20%	0.197	29%	0.29	C	S	.	.	S	Bend	trans	-108.2	-13.5	-175.8	-54.6	-84.2	0	0	0	114.4	G402 S425 K428 T691 L693	G402-F404 PolarHBondContact O-N 3.2Å; F404-S425 PolarHBondContact O-N 3.27Å; F404-K428 HydrophobicContact CD1-CB 4.03Å; F404-T691 HydrophobicContact CB-CG2 3.95Å; F404-T691 WeakPolarHBondContact CD2-OG1 3.39Å; F404-L693 HydrophobicContact CB-CD1 4.46Å; F404-L693 HydrophobicContact CD1-CB 4.12Å; F404-L693 HydrophobicContact CD1-CD1 3.54Å; F404-L693 HydrophobicContact CD1-CG 4.44Å; F404-L693 HydrophobicContact CD2-CB 3.6Å; F404-L693 HydrophobicContact CD2-CD1 4.45Å; F404-L693 HydrophobicContact CE1-CB 4.02Å; F404-L693 HydrophobicContact CE1-CD1 3.82Å; F404-L693 HydrophobicContact CE2-CB 3.5Å; F404-L693 VanDerWaalsContact CE2-CB 3.5Å; F404-L693 HydrophobicContact CG-CB 3.92Å; F404-L693 HydrophobicContact CG-CD1 3.9Å; F404-L693 HydrophobicContact CG-CG 4.43Å; F404-L693 HydrophobicContact CZ-CB 3.72Å; F404-L693 HydrophobicContact CZ-CD1 4.4Å
405	A	90.5	Very high	91.9	Very high	1 Å²	1	53.5 Å²	53.5	1%	0.008	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	136.1	-171.7	0	0	0	0	0	113.9	G402 K422 I423 I424 T691	G402-A405 WeakPolarHBondContact CA-O 3.44Å; G402-A405 PolarHBondContact N-O 3.27Å; G402-A405 PolarHBondContact O-N 2.92Å; G402-A405 VanDerWaalsContact O-N 3.13Å; A405-K422 HydrophobicContact CB-CG 4.32Å; A405-I423 CarbonylContact C-O 3.6Å; A405-I423 WeakPolarHBondContact CA-O 3.31Å; A405-I424 HydrophobicContact CB-CB 4.44Å; A405-I424 HydrophobicContact CB-CG1 3.95Å; A405-T691 HydrophobicContact CB-CG2 3.64Å
406	V	92.6	Very high	91.8	Very high	32 Å²	32	54.3 Å²	54.3	19%	0.194	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	136.9	172	-175.2	0	0	0	0	108.7	I398 R408 I423	I398-V406 HydrophobicContact CD1-CG1 4.17Å; I398-V406 HydrophobicContact CG1-CG1 4.05Å; I398-V406 HydrophobicContact CG2-CG1 4.03Å; V406-R408 HydrophobicContact CG1-CG 4.29Å; V406-I423 PolarHBondContact N-O 2.87Å; V406-I423 PolarHBondContact O-N 3.06Å
407	V	93.5	Very high	91.9	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	125.9	174.9	-178	0	0	0	0	110.1	L399 G400 A420 L421 K422 V685 I688 T689	L399-V407 HydrophobicContact CB-CG1 4.35Å; L399-V407 HydrophobicContact CD1-CG1 4.44Å; L399-V407 PolarHBondContact N-O 2.98Å; G400-V407 PolarHBondContact N-O 3.07Å; G400-V407 PolarHBondContact O-N 3.25Å; V407-A420 HydrophobicContact CG1-CB 4.02Å; V407-L421 WeakPolarHBondContact CA-O 3.37Å; V407-K422 HydrophobicContact CG2-CB 4.33Å; V407-K422 HydrophobicContact CG2-CG 4.36Å; V407-V685 HydrophobicContact CB-CG1 4.19Å; V407-V685 HydrophobicContact CG1-CG1 4.13Å; V407-I688 HydrophobicContact CG1-CB 4.33Å; V407-I688 HydrophobicContact CG1-CG2 3.84Å; V407-I688 HydrophobicContact CG2-CB 4.15Å; V407-I688 HydrophobicContact CG2-CG2 3.75Å; V407-I688 WeakPolarHBondContact CG2-O 3.22Å; V407-T689 HydrophobicContact CB-CG2 3.93Å; V407-T689 HydrophobicContact CG2-CG2 3.5Å
408	R	93.7	Very high	92	Very high	51 Å²	51	58.3 Å²	58.3	19%	0.192	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	151.2	178	-58.4	-173.5	69.3	159.5	0.6	111.4	V395 G396 R397 I398 V406 L421 I423	V395-R408 HydrophobicContact CG1-CB 3.88Å; V395-R408 HydrophobicContact CG1-CG 4.5Å; G396-R408 PolarHBondContact O-NE 2.77Å; G396-R408 VanDerWaalsContact O-NE 3.11Å; G396-R408 PolarHBondContact O-NH2 2.9Å; R397-R408 WeakPolarHBondContact O-CA 3.21Å; I398-R408 HydrophobicContact CG1-CG 4.15Å; V406-R408 HydrophobicContact CG1-CG 4.29Å; R408-L421 PolarHBondContact N-O 3.25Å; R408-L421 PolarHBondContact O-N 2.95Å; R408-I423 HydrophobicContact CG-CD1 4.28Å
409	E	93.8	Very high	92.2	Very high	32 Å²	32	55.1 Å²	55.1	15%	0.15	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	138.8	167.8	-164.9	178.4	105.6	0	0	108.4	V395 G396 R397 L399	V395-E409 CarbonylContact C-O 3.52Å; G396-E409 PolarHBondContact N-O 3.15Å; R397-E409 HydrophobicContact CG-CB 4.21Å; R397-E409 IonicContact CZ-OE2 2.85Å; R397-E409 IonicContact NE-OE2 2.77Å; R397-E409 PolarHBondContact NE-OE2 3.3Å; R397-E409 IonicContact NH2-OE2 2.63Å; R397-E409 PolarHBondContact NH2-OE2 2.77Å; R397-E409 PolarHBondContact O-N 3.49Å; L399-E409 HydrophobicContact CD1-CB 3.96Å; L399-E409 HydrophobicContact CD1-CG 4.49Å; L399-E409 HydrophobicContact CD2-CB 4.05Å; L399-E409 HydrophobicContact CD2-CG 4.49Å; L399-E409 HydrophobicContact CG-CB 3.9Å
410	C	95.2	Very high	92.5	Very high	0 Å²	0	54 Å²	54	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	143.1	170.4	68.3	0	0	0	0	111.5	K394 V395 Y419 L421	K394-C410 WeakPolarHBondContact O-CA 2.65Å; V395-C410 HydrophobicContact CG2-CB 4.31Å; C410-Y419 PolarHBondContact N-O 3.06Å; C410-Y419 PolarHBondContact O-N 2.87Å; C410-Y419 VanDerWaalsContact O-O 3.05Å; C410-Y419 VanDerWaalsContact SG-C 3.59Å; C410-Y419 PolarHBondContact SG-O 3.16Å; C410-L421 HydrophobicContact CB-CB 4.14Å
411	V	96.1	Very high	92.9	Very high	38 Å²	38	53.2 Å²	53.2	23%	0.23	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	123.4	-178.3	-174.5	0	0	0	0	109.1	Y393 K394 R413 R417 E418	Y393-V411 CarbonylContact C-O 3.46Å; Y393-V411 WeakPolarHBondContact CA-O 3.15Å; K394-V411 PolarHBondContact N-O 3.13Å; K394-V411 PolarHBondContact O-N 3.04Å; V411-R413 PolarHBondContact O-N 3.01Å; V411-R417 CarbonylContact C-O 3.55Å; V411-R417 WeakPolarHBondContact CA-O 3.46Å; V411-E418 HydrophobicContact CG2-CG 4.32Å
412	E	96.8	Very high	93.3	Very high	26 Å²	26	47.7 Å²	47.7	12%	0.121	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	123.8	176.4	-168.4	-171.5	-150.5	0	0	109.9	R392 Y393 S414 T415 G416 R417 Y419	R392-E412 IonicContact NH2-OE1 3.62Å; Y393-E412 HydrophobicContact CD1-CB 3.92Å; Y393-E412 HydrophobicContact CD1-CG 4.28Å; Y393-E412 HydrophobicContact CE1-CB 3.75Å; Y393-E412 HydrophobicContact CE1-CG 3.91Å; E412-S414 VanDerWaalsContact C-N 3.3Å; E412-S414 VanDerWaalsContact CG-OG 3.31Å; E412-S414 WeakPolarHBondContact CG-OG 3.44Å; E412-S414 PolarHBondContact O-N 3.21Å; E412-S414 PolarHBondContact OE1-OG 3Å; E412-S414 PolarHBondContact OE2-OG 3.13Å; E412-T415 WeakPolarHBondContact OE2-CB 3.35Å; E412-T415 WeakPolarHBondContact OE2-CG2 3.21Å; E412-T415 PolarHBondContact OE2-OG1 2.8Å; E412-G416 WeakPolarHBondContact O-CA 3.43Å; E412-G416 PolarHBondContact O-N 3.37Å; E412-R417 PolarHBondContact N-O 3.09Å; E412-Y419 HydrophobicContact CB-CD2 4.21Å; E412-Y419 HydrophobicContact CB-CE2 3.89Å
413	R	95.8	Very high	93.8	Very high	148 Å²	148	47.5 Å²	47.5	56%	0.558	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-25.2	-171.6	-64.7	169.3	-177	-88.7	9.7	113.7	A390 D391 R392 K394 V411	A390-R413 PolarHBondContact O-NE 3.21Å; A390-R413 PolarHBondContact O-NH2 3.4Å; D391-R413 VanDerWaalsContact O-CD 3.22Å; D391-R413 WeakPolarHBondContact O-CD 3.35Å; R392-R413 WeakPolarHBondContact O-CB 3.1Å; R392-R413 WeakPolarHBondContact O-CG 3.21Å; R392-R413 PolarHBondContact O-N 2.9Å; K394-R413 HydrophobicContact CB-CG 4.48Å; V411-R413 PolarHBondContact O-N 3.01Å
414	S	96.2	Very high	94.1	Very high	94 Å²	94	42.1 Å²	42.1	66%	0.657	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-35.4	-179.3	50.2	0	0	0	0	113.1	E412	E412-S414 VanDerWaalsContact C-N 3.3Å; E412-S414 VanDerWaalsContact CG-OG 3.31Å; E412-S414 WeakPolarHBondContact CG-OG 3.44Å; E412-S414 PolarHBondContact O-N 3.21Å; E412-S414 PolarHBondContact OE1-OG 3Å; E412-S414 PolarHBondContact OE2-OG 3.13Å
415	T	95.9	Very high	94.4	Very high	75 Å²	75	41.2 Å²	41.2	46%	0.46	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.1	-16.7	-173.5	63.6	0	0	0	0	114.1	E412 R417	E412-T415 WeakPolarHBondContact OE2-CB 3.35Å; E412-T415 WeakPolarHBondContact OE2-CG2 3.21Å; E412-T415 PolarHBondContact OE2-OG1 2.8Å; T415-R417 PolarHBondContact O-N 3.46Å; T415-R417 WeakPolarHBondContact OG1-CB 3.27Å; T415-R417 WeakPolarHBondContact OG1-CG 3.42Å; T415-R417 PolarHBondContact OG1-N 3.18Å
416	G	94.3	Very high	94.4	Very high	51 Å²	51	44.2 Å²	44.2	53%	0.526	23%	0.226	S	C	.	.			trans	72	8	-171.5	0	0	0	0	0	114.2	E412	E412-G416 WeakPolarHBondContact O-CA 3.43Å; E412-G416 PolarHBondContact O-N 3.37Å
417	R	94.1	Very high	94.2	Very high	160 Å²	160	46.8 Å²	46.8	60%	0.604	24%	0.239	S	C	*	.			trans	-76.3	140.8	-178.1	-70.4	176.9	173.6	-167.1	-4.1	112	V411 E412 T415 Y419	V411-R417 CarbonylContact C-O 3.55Å; V411-R417 WeakPolarHBondContact CA-O 3.46Å; E412-R417 PolarHBondContact N-O 3.09Å; T415-R417 PolarHBondContact O-N 3.46Å; T415-R417 WeakPolarHBondContact OG1-CB 3.27Å; T415-R417 WeakPolarHBondContact OG1-CG 3.42Å; T415-R417 PolarHBondContact OG1-N 3.18Å; R417-Y419 HydrophobicContact CB-CD2 4.37Å; R417-Y419 HydrophobicContact CB-CE2 3.53Å; R417-Y419 WeakPolarHBondContact CD-OH 3.47Å; R417-Y419 WeakPolarHBondContact O-CD2 3.48Å
418	E	94.4	Very high	93.9	Very high	89 Å²	89	52 Å²	52	42%	0.416	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	137.8	-179.8	-56.3	176.9	95.8	0	0	111.4	V411 L470 K472	V411-E418 HydrophobicContact CG2-CG 4.32Å; E418-L470 HydrophobicContact CB-CD2 4.35Å; E418-K472 IonicContact OE1-NZ 3.04Å; E418-K472 PolarHBondContact OE1-NZ 2.95Å; E418-K472 IonicContact OE2-NZ 2.75Å; E418-K472 PolarHBondContact OE2-NZ 3.46Å
419	Y	95.6	Very high	93.5	Very high	25 Å²	25	49.9 Å²	49.9	10%	0.098	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	163.2	-176.1	-64.2	-72.8	0	0	0	110.4	Y393 C410 E412 R417 I455 V467	Y393-Y419 HydrophobicContact CE1-CD2 4.04Å; Y393-Y419 HydrophobicContact CE1-CE2 4.46Å; C410-Y419 PolarHBondContact N-O 3.06Å; C410-Y419 PolarHBondContact O-N 2.87Å; C410-Y419 VanDerWaalsContact O-O 3.05Å; C410-Y419 VanDerWaalsContact SG-C 3.59Å; C410-Y419 PolarHBondContact SG-O 3.16Å; E412-Y419 HydrophobicContact CB-CD2 4.21Å; E412-Y419 HydrophobicContact CB-CE2 3.89Å; R417-Y419 HydrophobicContact CB-CD2 4.37Å; R417-Y419 HydrophobicContact CB-CE2 3.53Å; R417-Y419 WeakPolarHBondContact CD-OH 3.47Å; R417-Y419 WeakPolarHBondContact O-CD2 3.48Å; Y419-I455 HydrophobicContact CD1-CD1 4.43Å; Y419-I455 HydrophobicContact CD1-CG1 3.76Å; Y419-I455 HydrophobicContact CE1-CD1 3.94Å; Y419-I455 HydrophobicContact CE1-CG1 3.68Å; Y419-I455 HydrophobicContact CE1-CG2 4.31Å; Y419-V467 HydrophobicContact CD1-CG1 4.47Å; Y419-V467 HydrophobicContact CG-CG1 4.04Å
420	A	95	Very high	93.2	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	124.5	174.5	0	0	0	0	0	110.1	V407 M468 L470 I688	V407-A420 HydrophobicContact CG1-CB 4.02Å; A420-M468 PolarHBondContact N-O 3.45Å; A420-M468 PolarHBondContact O-N 3.14Å; A420-L470 HydrophobicContact CB-CB 4.35Å; A420-L470 HydrophobicContact CB-CD1 4.34Å; A420-I688 HydrophobicContact CB-CD1 3.58Å; A420-I688 HydrophobicContact CB-CG2 4.11Å
421	L	95.5	Very high	92.6	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	99.9	175.3	-178.5	64.1	0	0	0	109.3	I389 V395 V407 R408 C410 I423 Y465 V467	I389-L421 HydrophobicContact CG2-CD1 4.46Å; I389-L421 HydrophobicContact CG2-CD2 4.2Å; V395-L421 HydrophobicContact CG1-CD2 4.07Å; V395-L421 HydrophobicContact CG2-CD2 3.59Å; V407-L421 WeakPolarHBondContact CA-O 3.37Å; R408-L421 PolarHBondContact N-O 3.25Å; R408-L421 PolarHBondContact O-N 2.95Å; C410-L421 HydrophobicContact CB-CB 4.14Å; L421-I423 HydrophobicContact CD2-CD1 4.19Å; L421-I423 HydrophobicContact CD2-CG1 4.34Å; L421-I423 HydrophobicContact CG-CD1 4.34Å; L421-I423 HydrophobicContact CG-CG1 3.97Å; L421-Y465 HydrophobicContact CD1-CD1 4.26Å; L421-Y465 HydrophobicContact CD2-CD1 4.44Å; L421-V467 HydrophobicContact CD1-CG2 4.02Å
422	K	94.5	Very high	92.1	Very high	1 Å²	1	59 Å²	59	0%	0.004	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	121.1	172.5	-176.2	-179.6	-172.3	170	0	108.6	A405 V407 I424 E439 Y465 L466 M468 I688 T690	A405-K422 HydrophobicContact CB-CG 4.32Å; V407-K422 HydrophobicContact CG2-CB 4.33Å; V407-K422 HydrophobicContact CG2-CG 4.36Å; K422-I424 HydrophobicContact CD-CD1 4.31Å; K422-I424 HydrophobicContact CD-CG1 4.46Å; K422-I424 HydrophobicContact CG-CD1 4.46Å; K422-I424 HydrophobicContact CG-CG1 4.07Å; K422-E439 IonicContact NZ-OE1 3.97Å; K422-E439 PolarHBondContact NZ-OE1 3.38Å; K422-E439 IonicContact NZ-OE2 2.89Å; K422-Y465 CarbonylContact O-C 3.59Å; K422-Y465 WeakPolarHBondContact O-CA 3.39Å; K422-L466 HydrophobicContact CB-CB 4.28Å; K422-L466 HydrophobicContact CD-CD1 4.31Å; K422-L466 PolarHBondContact N-O 3.08Å; K422-L466 PolarHBondContact O-N 3.29Å; K422-M468 HydrophobicContact CB-SD 4.36Å; K422-M468 HydrophobicContact CD-SD 3.9Å; K422-I688 HydrophobicContact CB-CG2 3.96Å; K422-I688 HydrophobicContact CD-CG2 4.29Å; K422-I688 WeakPolarHBondContact CD-O 3.46Å; K422-I688 WeakPolarHBondContact CE-O 3.25Å; K422-I688 HydrophobicContact CG-CG2 4.41Å; K422-I688 WeakPolarHBondContact CG-O 3.28Å; K422-I688 PolarHBondContact NZ-O 2.84Å; K422-T690 WeakPolarHBondContact CE-O 3.49Å; K422-T690 PolarHBondContact NZ-O 2.99Å
423	I	94.3	Very high	91.6	Very high	14 Å²	14	61.5 Å²	61.5	7%	0.072	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	104.2	-177.5	-50.1	176.8	0	0	0	107.7	A405 V406 R408 L421 D463 Y465	A405-I423 CarbonylContact C-O 3.6Å; A405-I423 WeakPolarHBondContact CA-O 3.31Å; V406-I423 PolarHBondContact N-O 2.87Å; V406-I423 PolarHBondContact O-N 3.06Å; R408-I423 HydrophobicContact CG-CD1 4.28Å; L421-I423 HydrophobicContact CD2-CD1 4.19Å; L421-I423 HydrophobicContact CD2-CG1 4.34Å; L421-I423 HydrophobicContact CG-CD1 4.34Å; L421-I423 HydrophobicContact CG-CG1 3.97Å; I423-D463 HydrophobicContact CG2-CB 4.15Å; I423-Y465 HydrophobicContact CB-CD1 4.37Å; I423-Y465 HydrophobicContact CB-CE1 4.39Å; I423-Y465 HydrophobicContact CD1-CD1 4.18Å; I423-Y465 HydrophobicContact CD1-CE1 3.94Å; I423-Y465 HydrophobicContact CG1-CD1 3.78Å; I423-Y465 HydrophobicContact CG1-CE1 3.94Å; I423-Y465 HydrophobicContact CG2-CD1 3.98Å; I423-Y465 HydrophobicContact CG2-CE1 3.64Å
424	I	92.9	Very high	90.9	Very high	2 Å²	2	60.3 Å²	60.3	1%	0.01	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	120.7	-177.2	-48.4	-178.8	0	0	0	109	A405 K422 K426 I436 D463 L464 L466	A405-I424 HydrophobicContact CB-CB 4.44Å; A405-I424 HydrophobicContact CB-CG1 3.95Å; K422-I424 HydrophobicContact CD-CD1 4.31Å; K422-I424 HydrophobicContact CD-CG1 4.46Å; K422-I424 HydrophobicContact CG-CD1 4.46Å; K422-I424 HydrophobicContact CG-CG1 4.07Å; I424-K426 PolarHBondContact O-N 2.63Å; I424-I436 HydrophobicContact CD1-CG2 3.92Å; I424-I436 HydrophobicContact CG2-CD1 4.38Å; I424-D463 CarbonylContact O-C 3.53Å; I424-D463 WeakPolarHBondContact O-CA 3.32Å; I424-L464 HydrophobicContact CB-CB 4.48Å; I424-L464 PolarHBondContact N-O 2.89Å; I424-L464 PolarHBondContact O-N 3.28Å; I424-L466 HydrophobicContact CD1-CD1 3.93Å
425	S	92	Very high	90.4	Very high	27 Å²	27	58 Å²	58	19%	0.189	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	119.8	-178.3	-166.9	0	0	0	0	111.9	F404 D427 K428 C429 D463	F404-S425 PolarHBondContact O-N 3.27Å; S425-D427 VanDerWaalsContact C-N 3.28Å; S425-D427 PolarHBondContact O-N 2.76Å; S425-K428 PolarHBondContact O-N 3.11Å; S425-C429 PolarHBondContact O-N 3.34Å; S425-C429 PolarHBondContact O-SG 3.14Å; S425-D463 VanDerWaalsContact CA-OD1 3.28Å; S425-D463 WeakPolarHBondContact CA-OD1 3.32Å; S425-D463 VanDerWaalsContact CB-OD1 3.31Å; S425-D463 WeakPolarHBondContact CB-OD1 3.49Å; S425-D463 PolarHBondContact OG-OD1 2.98Å
426	K	90.6	Very high	90	Very high	63 Å²	63	54.9 Å²	54.9	27%	0.274	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-66.3	-31.9	-177.8	-61.8	-178.6	169.5	-175.7	0	112	I424 K428 C429 K430 D459 T460 R462	I424-K426 PolarHBondContact O-N 2.63Å; K426-K428 VanDerWaalsContact C-N 3.26Å; K426-K428 PolarHBondContact O-N 3.15Å; K426-C429 PolarHBondContact O-N 3.18Å; K426-K430 PolarHBondContact O-N 2.91Å; K426-D459 WeakPolarHBondContact CE-OD1 3.46Å; K426-D459 IonicContact NZ-OD1 3.46Å; K426-D459 PolarHBondContact NZ-OD1 2.63Å; K426-D459 IonicContact NZ-OD2 3.38Å; K426-D459 PolarHBondContact NZ-OD2 3.35Å; K426-T460 WeakPolarHBondContact CE-O 3.4Å; K426-T460 PolarHBondContact NZ-O 3.04Å; K426-R462 WeakPolarHBondContact CA-O 3.44Å; K426-R462 WeakPolarHBondContact CB-O 3.25Å; K426-R462 WeakPolarHBondContact CG-O 2.98Å; K426-R462 PolarHBondContact N-O 2.8Å
427	D	89.2	Confident	89.7	Confident	87 Å²	87	58.6 Å²	58.6	47%	0.465	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-60.9	-35.4	175.8	-77.3	-47.5	0	0	0	112.2	S425 C429 K430	S425-D427 VanDerWaalsContact C-N 3.28Å; S425-D427 PolarHBondContact O-N 2.76Å; D427-C429 VanDerWaalsContact C-N 3.32Å; D427-K430 WeakPolarHBondContact OD1-CE 3.22Å; D427-K430 IonicContact OD1-NZ 2.76Å; D427-K430 PolarHBondContact OD1-NZ 2.76Å
428	K	86.9	Confident	89.3	Confident	110 Å²	110	53 Å²	53	48%	0.478	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-74.5	-18.4	172.7	-61.3	-174.7	173.9	-176.6	0	113.7	N403 F404 S425 K426	N403-K428 WeakPolarHBondContact O-CD 3.03Å; N403-K428 WeakPolarHBondContact O-CE 3.4Å; N403-K428 PolarHBondContact O-NZ 2.98Å; F404-K428 HydrophobicContact CD1-CB 4.03Å; S425-K428 PolarHBondContact O-N 3.11Å; K426-K428 VanDerWaalsContact C-N 3.26Å; K426-K428 PolarHBondContact O-N 3.15Å
429	C	84.5	Confident	89	Confident	5 Å²	5	49 Å²	49	3%	0.034	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-100.4	5.5	-174.1	-60	0	0	0	0	114.3	S425 K426 D427 G431 K432 E433 I436 L693	S425-C429 PolarHBondContact O-N 3.34Å; S425-C429 PolarHBondContact O-SG 3.14Å; K426-C429 PolarHBondContact O-N 3.18Å; D427-C429 VanDerWaalsContact C-N 3.32Å; C429-G431 PolarHBondContact O-N 2.99Å; C429-K432 CarbonylContact O-C 3.56Å; C429-K432 WeakPolarHBondContact O-CA 3.47Å; C429-K432 PolarHBondContact O-N 2.89Å; C429-E433 PolarHBondContact O-N 2.94Å; C429-I436 HydrophobicContact CB-CG1 4.45Å; C429-L693 HydrophobicContact CB-CD1 3.98Å
430	K	86.7	Confident	88.8	Confident	138 Å²	138	48.1 Å²	48.1	60%	0.6	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.1	129.8	-172.7	-78.3	174.8	178.8	160.2	0	113.4	K426 D427 K432 E433	K426-K430 PolarHBondContact O-N 2.91Å; D427-K430 WeakPolarHBondContact OD1-CE 3.22Å; D427-K430 IonicContact OD1-NZ 2.76Å; D427-K430 PolarHBondContact OD1-NZ 2.76Å; K430-K432 PolarHBondContact O-N 2.76Å; K430-E433 VanDerWaalsContact CA-OE1 3.31Å; K430-E433 WeakPolarHBondContact CA-OE1 3.39Å
431	G	83.8	Confident	88.8	Confident	60 Å²	60	50.6 Å²	50.6	62%	0.619	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.9	-2.3	-175.2	0	0	0	0	0	115.1	C429 E433	C429-G431 PolarHBondContact O-N 2.99Å; G431-E433 VanDerWaalsContact C-OE2 3.23Å; G431-E433 WeakPolarHBondContact CA-OE2 3.5Å; G431-E433 PolarHBondContact N-OE1 2.74Å; G431-E433 PolarHBondContact N-OE2 3.05Å
432	K	84.7	Confident	88.7	Confident	65 Å²	65	50.6 Å²	50.6	28%	0.283	27%	0.265	S	S	.	.			trans	-127	14.4	177.6	-52.7	-172.7	-171.4	-176.8	0	112.7	C429 K430 H434 M435 L693 E696	C429-K432 CarbonylContact O-C 3.56Å; C429-K432 WeakPolarHBondContact O-CA 3.47Å; C429-K432 PolarHBondContact O-N 2.89Å; K430-K432 PolarHBondContact O-N 2.76Å; K432-H434 PolarHBondContact O-N 2.93Å; K432-H434 VanDerWaalsContact O-N 3.13Å; K432-M435 HydrophobicContact CB-SD 4.25Å; K432-M435 WeakPolarHBondContact O-CB 3.38Å; K432-M435 PolarHBondContact O-N 3.42Å; K432-L693 HydrophobicContact CB-CD1 4.43Å; K432-L693 HydrophobicContact CB-CD2 3.56Å; K432-L693 HydrophobicContact CD-CD2 3.84Å; K432-L693 HydrophobicContact CG-CD2 4.35Å; K432-E696 WeakPolarHBondContact CE-OE1 3.48Å; K432-E696 IonicContact NZ-OE1 2.73Å; K432-E696 PolarHBondContact NZ-OE1 3.01Å; K432-E696 IonicContact NZ-OE2 3.49Å; K432-E696 PolarHBondContact NZ-OE2 3.03Å
433	E	85.8	Confident	88.7	Confident	78 Å²	78	50.8 Å²	50.8	36%	0.364	27%	0.266	S	S	.	.	H	α-helix	trans	-56.3	-34	-175.7	-55.5	86	166.3	0	0	112	C429 K430 G431 M435 I436 Q437	C429-E433 PolarHBondContact O-N 2.94Å; K430-E433 VanDerWaalsContact CA-OE1 3.31Å; K430-E433 WeakPolarHBondContact CA-OE1 3.39Å; G431-E433 VanDerWaalsContact C-OE2 3.23Å; G431-E433 WeakPolarHBondContact CA-OE2 3.5Å; G431-E433 PolarHBondContact N-OE1 2.74Å; G431-E433 PolarHBondContact N-OE2 3.05Å; E433-M435 PolarHBondContact O-N 2.73Å; E433-I436 PolarHBondContact O-N 3.23Å; E433-Q437 VanDerWaalsContact O-CG 3.31Å; E433-Q437 WeakPolarHBondContact O-CG 3.13Å; E433-Q437 PolarHBondContact O-N 3.45Å
434	H	83	Confident	88.6	Confident	122 Å²	122	56.4 Å²	56.4	57%	0.565	29%	0.286	S	S	*	.	H	α-helix	trans	-58.6	-29.5	177	72.9	-85.6	0	0	0	113.5	K432 S438	K432-H434 PolarHBondContact O-N 2.93Å; K432-H434 VanDerWaalsContact O-N 3.13Å; H434-S438 WeakPolarHBondContact O-CB 3.41Å; H434-S438 PolarHBondContact O-N 2.94Å
435	M	84.3	Confident	88.6	Confident	45 Å²	45	63.3 Å²	63.3	22%	0.222	31%	0.312	C	S	.	.	H	α-helix	trans	-71.2	-44.9	177.8	-60.1	179.3	65.1	0	0	111	K432 E433 S438 E439 P692 L693	K432-M435 HydrophobicContact CB-SD 4.25Å; K432-M435 WeakPolarHBondContact O-CB 3.38Å; K432-M435 PolarHBondContact O-N 3.42Å; E433-M435 PolarHBondContact O-N 2.73Å; M435-S438 WeakPolarHBondContact O-CB 3.5Å; M435-S438 PolarHBondContact O-N 2.88Å; M435-E439 PolarHBondContact O-N 3.06Å; M435-P692 HydrophobicContact CB-CB 3.83Å; M435-P692 HydrophobicContact CE-CB 4.08Å; M435-P692 VanDerWaalsContact CE-O 3.26Å; M435-P692 WeakPolarHBondContact CE-O 3.46Å; M435-L693 HydrophobicContact CB-CD2 3.97Å; M435-L693 HydrophobicContact CE-CD2 4.12Å; M435-L693 HydrophobicContact CG-CD2 4.31Å; M435-L693 HydrophobicContact SD-CD2 3.59Å; M435-L693 VanDerWaalsContact SD-CD2 3.59Å
436	I	87.9	Confident	88.8	Confident	10 Å²	10	62.1 Å²	62.1	5%	0.051	30%	0.304	C	S	.	.	H	α-helix	trans	-65.2	-43.3	174.9	-52.8	-57.4	0	0	0	110.3	I424 C429 E433 S438 E439 V440 L464 P692 L693	I424-I436 HydrophobicContact CD1-CG2 3.92Å; I424-I436 HydrophobicContact CG2-CD1 4.38Å; C429-I436 HydrophobicContact CB-CG1 4.45Å; E433-I436 PolarHBondContact O-N 3.23Å; I436-S438 VanDerWaalsContact C-N 3.26Å; I436-S438 PolarHBondContact O-N 2.89Å; I436-E439 PolarHBondContact O-N 2.68Å; I436-V440 HydrophobicContact CG2-CG2 4.24Å; I436-V440 WeakPolarHBondContact O-CB 3.49Å; I436-V440 WeakPolarHBondContact O-CG2 3.41Å; I436-V440 PolarHBondContact O-N 2.97Å; I436-L464 HydrophobicContact CG2-CD2 3.9Å; I436-P692 HydrophobicContact CD1-CB 4.46Å; I436-P692 HydrophobicContact CD1-CG 4.08Å; I436-L693 HydrophobicContact CD1-CD1 4.24Å; I436-L693 HydrophobicContact CD1-CG 3.99Å
437	Q	87.3	Confident	89.1	Confident	129 Å²	129	66.6 Å²	66.6	60%	0.603	32%	0.323	S	S	*	.	H	α-helix	trans	-60.8	-35.2	175.7	-71.1	171.4	-0.5	0	0	112.2	E433 S441	E433-Q437 VanDerWaalsContact O-CG 3.31Å; E433-Q437 WeakPolarHBondContact O-CG 3.13Å; E433-Q437 PolarHBondContact O-N 3.45Å; Q437-S441 WeakPolarHBondContact O-CB 3.37Å; Q437-S441 PolarHBondContact O-N 2.8Å; Q437-S441 PolarHBondContact O-OG 3.09Å
438	S	85.9	Confident	89.5	Confident	44 Å²	44	63.6 Å²	63.6	31%	0.308	31%	0.306	S	S	.	.	H	α-helix	trans	-63.9	-53.9	174.7	-171.2	0	0	0	0	111.8	H434 M435 I436 V440 S441 I442	H434-S438 WeakPolarHBondContact O-CB 3.41Å; H434-S438 PolarHBondContact O-N 2.94Å; M435-S438 WeakPolarHBondContact O-CB 3.5Å; M435-S438 PolarHBondContact O-N 2.88Å; I436-S438 VanDerWaalsContact C-N 3.26Å; I436-S438 PolarHBondContact O-N 2.89Å; S438-V440 VanDerWaalsContact C-N 3.34Å; S438-V440 PolarHBondContact O-N 2.86Å; S438-S441 PolarHBondContact O-N 2.91Å; S438-S441 PolarHBondContact O-OG 3.45Å; S438-I442 PolarHBondContact O-N 3.4Å; S438-I442 VanDerWaalsContact O-N 3.16Å
439	E	89.6	Confident	89.9	Confident	5 Å²	5	62.7 Å²	62.7	2%	0.023	31%	0.312	C	S	.	.	H	α-helix	trans	-51.4	-53	175.4	179.8	-165.4	-173.2	0	0	110.6	K422 M435 I436 S441 I442 L443 F537 P692	K422-E439 IonicContact NZ-OE1 3.97Å; K422-E439 PolarHBondContact NZ-OE1 3.38Å; K422-E439 IonicContact NZ-OE2 2.89Å; M435-E439 PolarHBondContact O-N 3.06Å; I436-E439 PolarHBondContact O-N 2.68Å; E439-S441 PolarHBondContact O-N 3.33Å; E439-I442 WeakPolarHBondContact O-CB 3.44Å; E439-I442 PolarHBondContact O-N 2.62Å; E439-I442 VanDerWaalsContact O-N 3.16Å; E439-L443 HydrophobicContact CG-CD1 3.87Å; E439-L443 HydrophobicContact CG-CG 4.4Å; E439-L443 WeakPolarHBondContact O-CG 3.43Å; E439-L443 PolarHBondContact O-N 3.38Å; E439-F537 HydrophobicContact CG-CB 4.45Å; E439-P692 HydrophobicContact CB-CG 3.82Å; E439-P692 HydrophobicContact CG-CG 4.35Å; E439-P692 WeakPolarHBondContact OE2-CD 3.46Å; E439-P692 WeakPolarHBondContact OE2-CG 3.19Å
440	V	91.3	Very high	90.5	Very high	5 Å²	5	63.2 Å²	63.2	3%	0.03	31%	0.314	C	S	.	.	H	α-helix	trans	-63.7	-40.4	-177.6	173.7	0	0	0	0	111.8	I436 S438 I442 L443 R444 E457 L464 L466	I436-V440 HydrophobicContact CG2-CG2 4.24Å; I436-V440 WeakPolarHBondContact O-CB 3.49Å; I436-V440 WeakPolarHBondContact O-CG2 3.41Å; I436-V440 PolarHBondContact O-N 2.97Å; S438-V440 VanDerWaalsContact C-N 3.34Å; S438-V440 PolarHBondContact O-N 2.86Å; V440-I442 PolarHBondContact O-N 3.42Å; V440-L443 PolarHBondContact O-N 2.66Å; V440-R444 VanDerWaalsContact O-CG 3.28Å; V440-R444 WeakPolarHBondContact O-CG 3.26Å; V440-R444 PolarHBondContact O-N 3.2Å; V440-E457 WeakPolarHBondContact CG1-OE2 3.38Å; V440-L464 HydrophobicContact CG2-CD2 3.82Å; V440-L466 HydrophobicContact CG1-CD2 4.5Å; V440-L466 HydrophobicContact CG2-CD1 3.98Å; V440-L466 HydrophobicContact CG2-CD2 4.23Å
441	S	93.3	Very high	91	Very high	52 Å²	52	56.6 Å²	56.6	36%	0.364	29%	0.285	S	S	.	.	H	α-helix	trans	-63.4	-30.1	177.4	77.2	0	0	0	0	113	Q437 S438 E439 R445	Q437-S441 WeakPolarHBondContact O-CB 3.37Å; Q437-S441 PolarHBondContact O-N 2.8Å; Q437-S441 PolarHBondContact O-OG 3.09Å; S438-S441 PolarHBondContact O-N 2.91Å; S438-S441 PolarHBondContact O-OG 3.45Å; E439-S441 PolarHBondContact O-N 3.33Å; S441-R445 WeakPolarHBondContact O-CD 3.28Å; S441-R445 VanDerWaalsContact O-CG 3.28Å; S441-R445 WeakPolarHBondContact O-CG 3.09Å
442	I	94.6	Very high	91.5	Very high	1 Å²	1	53.9 Å²	53.9	1%	0.005	26%	0.256	C	S	.	.	H	α-helix	trans	-77.4	-49	174.1	-70.9	169.9	0	0	0	110	S438 E439 V440 R444 R445 V446 I510 F537 A540	S438-I442 PolarHBondContact O-N 3.4Å; S438-I442 VanDerWaalsContact O-N 3.16Å; E439-I442 WeakPolarHBondContact O-CB 3.44Å; E439-I442 PolarHBondContact O-N 2.62Å; E439-I442 VanDerWaalsContact O-N 3.16Å; V440-I442 PolarHBondContact O-N 3.42Å; I442-R444 VanDerWaalsContact C-N 3.28Å; I442-R444 PolarHBondContact O-N 2.9Å; I442-R445 WeakPolarHBondContact O-CA 3.4Å; I442-R445 WeakPolarHBondContact O-CB 3.45Å; I442-R445 PolarHBondContact O-N 2.95Å; I442-V446 HydrophobicContact CG2-CG1 4.19Å; I442-V446 PolarHBondContact O-N 3.08Å; I442-V446 VanDerWaalsContact O-N 3.16Å; I442-I510 HydrophobicContact CG2-CD1 4.2Å; I442-I510 HydrophobicContact CG2-CG2 4.2Å; I442-F537 HydrophobicContact CG2-CD1 3.69Å; I442-F537 HydrophobicContact CG2-CE1 4.32Å; I442-F537 HydrophobicContact CG2-CG 4.42Å; I442-A540 HydrophobicContact CD1-CB 3.87Å; I442-A540 WeakPolarHBondContact CD1-O 3.46Å; I442-A540 HydrophobicContact CG2-CB 4.41Å
443	L	93.3	Very high	92	Very high	4 Å²	4	52.9 Å²	52.9	2%	0.021	25%	0.254	C	S	.	.	H	α-helix	trans	-57.2	-36.5	179.4	-73.7	177.2	0	0	0	113.2	E439 V440 R445 V446 L454 M468 F537	E439-L443 HydrophobicContact CG-CD1 3.87Å; E439-L443 HydrophobicContact CG-CG 4.4Å; E439-L443 WeakPolarHBondContact O-CG 3.43Å; E439-L443 PolarHBondContact O-N 3.38Å; V440-L443 PolarHBondContact O-N 2.66Å; L443-R445 PolarHBondContact O-N 2.84Å; L443-V446 HydrophobicContact CD2-CG2 4.49Å; L443-L454 HydrophobicContact CB-CB 3.99Å; L443-L454 HydrophobicContact CB-CD2 3.87Å; L443-M468 HydrophobicContact CD1-CE 4.24Å; L443-F537 HydrophobicContact CD2-CB 4.12Å; L443-F537 HydrophobicContact CD2-CD2 3.64Å; L443-F537 HydrophobicContact CD2-CE2 4.36Å; L443-F537 HydrophobicContact CD2-CG 3.95Å; L443-F537 HydrophobicContact CG-CB 4.4Å
444	R	93.4	Very high	92.5	Very high	133 Å²	133	50.2 Å²	50.2	50%	0.502	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-28.5	172.4	-72.4	170.3	-172.1	-176.1	-0.5	114.1	V440 I442 L454 E457	V440-R444 VanDerWaalsContact O-CG 3.28Å; V440-R444 WeakPolarHBondContact O-CG 3.26Å; V440-R444 PolarHBondContact O-N 3.2Å; I442-R444 VanDerWaalsContact C-N 3.28Å; I442-R444 PolarHBondContact O-N 2.9Å; R444-L454 HydrophobicContact CG-CD2 4.16Å; R444-E457 IonicContact CZ-OE1 2.76Å; R444-E457 IonicContact CZ-OE2 3.38Å; R444-E457 IonicContact NE-OE1 2.7Å; R444-E457 PolarHBondContact NE-OE1 2.86Å; R444-E457 IonicContact NE-OE2 2.73Å; R444-E457 PolarHBondContact NE-OE2 3.34Å; R444-E457 IonicContact NH1-OE1 3.52Å; R444-E457 IonicContact NH2-OE1 3.5Å; R444-E457 PolarHBondContact NH2-OE1 3.21Å; R444-E457 IonicContact NH2-OE2 2.67Å; R444-E457 PolarHBondContact NH2-OE2 2.96Å
445	R	93.5	Very high	93.1	Very high	147 Å²	147	47.7 Å²	47.7	56%	0.555	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-27.6	-171.8	-66.4	167.6	65.3	86.7	-2.5	112.9	S441 I442 L443 Y504	S441-R445 WeakPolarHBondContact O-CD 3.28Å; S441-R445 VanDerWaalsContact O-CG 3.28Å; S441-R445 WeakPolarHBondContact O-CG 3.09Å; I442-R445 WeakPolarHBondContact O-CA 3.4Å; I442-R445 WeakPolarHBondContact O-CB 3.45Å; I442-R445 PolarHBondContact O-N 2.95Å; L443-R445 PolarHBondContact O-N 2.84Å; R445-Y504 PolarHBondContact O-OH 3.06Å
446	V	95.8	Very high	93.5	Very high	2 Å²	2	47.4 Å²	47.4	1%	0.012	23%	0.23	C	C	.	.			trans	-88	122.8	-173.6	-60.7	0	0	0	0	112.1	I442 L443 I451 Y504 L505 L508 I510 F537	I442-V446 HydrophobicContact CG2-CG1 4.19Å; I442-V446 PolarHBondContact O-N 3.08Å; I442-V446 VanDerWaalsContact O-N 3.16Å; L443-V446 HydrophobicContact CD2-CG2 4.49Å; V446-I451 HydrophobicContact CB-CD1 4.48Å; V446-I451 HydrophobicContact CG2-CG2 4.14Å; V446-Y504 HydrophobicContact CB-CE1 4Å; V446-Y504 HydrophobicContact CG1-CE1 4.21Å; V446-L505 HydrophobicContact CB-CD2 4.37Å; V446-L505 HydrophobicContact CG1-CD2 3.49Å; V446-L505 VanDerWaalsContact CG1-CD2 3.49Å; V446-L508 HydrophobicContact CG1-CD1 4.43Å; V446-I510 HydrophobicContact CG1-CD1 3.93Å; V446-F537 HydrophobicContact CG2-CZ 4.49Å
447	K	96	Very high	93.8	Very high	157 Å²	157	50 Å²	50	68%	0.683	24%	0.242	S	C	*	.			trans	-141.6	94	179.7	-63.7	-172	-179.6	-174.7	0	109.4	Y504	K447-Y504 PolarHBondContact N-OH 2.96Å; K447-Y504 WeakPolarHBondContact O-CE2 3.32Å; K447-Y504 PolarHBondContact O-OH 3.3Å
448	H	97.4	Very high	94.1	Very high	24 Å²	24	46.2 Å²	46.2	11%	0.111	23%	0.225	C	C	.	.			trans	-147.5	140.8	-176.2	-174.8	-95.9	0	0	0	109.6	N450 I451 S500 A501 Y504	H448-N450 VanDerWaalsContact C-N 3.27Å; H448-N450 PolarHBondContact CE1-OD1 3.11Å; H448-N450 VanDerWaalsContact CE1-OD1 3.31Å; H448-N450 PolarHBondContact ND1-N 2.89Å; H448-N450 VanDerWaalsContact ND1-N 3.19Å; H448-N450 PolarHBondContact O-N 2.95Å; H448-I451 HydrophobicContact CB-CB 4.25Å; H448-I451 HydrophobicContact CB-CD1 3.84Å; H448-I451 HydrophobicContact CB-CG1 4Å; H448-I451 PolarHBondContact O-N 3.07Å; H448-I451 VanDerWaalsContact O-N 3.11Å; H448-S500 PolarHBondContact CE1-OG 3.46Å; H448-S500 PolarHBondContact NE2-OG 2.96Å; H448-A501 PolarHBondContact CE1-N 2.72Å; H448-Y504 HydrophobicContact CB-CD1 3.8Å; H448-Y504 HydrophobicContact CB-CD2 4.18Å; H448-Y504 HydrophobicContact CB-CE1 4.12Å; H448-Y504 HydrophobicContact CB-CE2 4.46Å; H448-Y504 HydrophobicContact CB-CG 3.84Å; H448-Y504 AromaticContact CD2-CD2 3.86Å; H448-Y504 AromaticContact CD2-CG 3.74Å; H448-Y504 AromaticContact CG-CG 3.94Å
449	P	95.9	Very high	94.4	Very high	91 Å²	91	48.9 Å²	48.9	59%	0.591	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-37.7	-177.2	21.4	-34	0	0	0	113.3	I451 K533	P449-I451 VanDerWaalsContact C-N 3.27Å; P449-I451 PolarHBondContact O-N 2.76Å; P449-K533 WeakPolarHBondContact O-CE 3.47Å; P449-K533 WeakPolarHBondContact O-CG 3.46Å; P449-K533 PolarHBondContact O-NZ 3.19Å
450	N	97.2	Very high	94.5	Very high	15 Å²	15	50.4 Å²	50.4	8%	0.08	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	26.1	178.8	-52.2	102.7	0	0	0	114.2	H448 N497 A501 L532 K533 L534	H448-N450 VanDerWaalsContact C-N 3.27Å; H448-N450 PolarHBondContact CE1-OD1 3.11Å; H448-N450 VanDerWaalsContact CE1-OD1 3.31Å; H448-N450 PolarHBondContact ND1-N 2.89Å; H448-N450 VanDerWaalsContact ND1-N 3.19Å; H448-N450 PolarHBondContact O-N 2.95Å; N450-N497 WeakPolarHBondContact CB-O 3.31Å; N450-N497 WeakPolarHBondContact ND2-CB 3.45Å; N450-N497 PolarHBondContact ND2-OD1 2.63Å; N450-A501 HydrophobicContact CB-CB 4.09Å; N450-A501 WeakPolarHBondContact O-CB 3.38Å; N450-L532 VanDerWaalsContact CA-O 3.27Å; N450-L532 WeakPolarHBondContact CA-O 3.38Å; N450-L532 WeakPolarHBondContact CB-O 3.4Å; N450-L532 PolarHBondContact ND2-O 3.38Å; N450-K533 WeakPolarHBondContact O-CA 3.45Å; N450-L534 PolarHBondContact O-N 3.34Å
451	I	97.3	Very high	94.4	Very high	0 Å²	0	62 Å²	62	0%	0	29%	0.289	C	S	.	.	B	Isolated β-bridge	trans	-127.6	142.5	172.7	-66.3	-178.9	0	0	0	108.3	V446 H448 P449 L453 A501 Y504 L505 K533 L534 F537	V446-I451 HydrophobicContact CB-CD1 4.48Å; V446-I451 HydrophobicContact CG2-CG2 4.14Å; H448-I451 HydrophobicContact CB-CB 4.25Å; H448-I451 HydrophobicContact CB-CD1 3.84Å; H448-I451 HydrophobicContact CB-CG1 4Å; H448-I451 PolarHBondContact O-N 3.07Å; H448-I451 VanDerWaalsContact O-N 3.11Å; P449-I451 VanDerWaalsContact C-N 3.27Å; P449-I451 PolarHBondContact O-N 2.76Å; I451-L453 PolarHBondContact O-N 3.27Å; I451-A501 HydrophobicContact CD1-CB 4.37Å; I451-A501 HydrophobicContact CG1-CB 3.91Å; I451-Y504 HydrophobicContact CD1-CD1 3.89Å; I451-Y504 HydrophobicContact CD1-CE1 4.4Å; I451-L505 HydrophobicContact CD1-CD1 4.37Å; I451-L505 HydrophobicContact CD1-CD2 3.86Å; I451-L505 HydrophobicContact CD1-CG 3.98Å; I451-K533 PolarHBondContact O-NZ 3.32Å; I451-L534 WeakPolarHBondContact CA-O 3Å; I451-F537 HydrophobicContact CD1-CZ 4.27Å; I451-F537 HydrophobicContact CG2-CE2 3.7Å; I451-F537 HydrophobicContact CG2-CZ 3.66Å
452	V	94.9	Very high	94.2	Very high	2 Å²	2	67.9 Å²	67.9	1%	0.012	30%	0.303	C	S	.	.			trans	-70.2	114	171.8	178.6	0	0	0	0	108.8	M468 E469 V471 L521 K533 L534	V452-M468 HydrophobicContact CG1-CE 4.41Å; V452-E469 HydrophobicContact CG1-CB 4.24Å; V452-V471 HydrophobicContact CG2-CG2 4.32Å; V452-L521 HydrophobicContact CG2-CD1 4.39Å; V452-K533 HydrophobicContact CG2-CB 3.96Å; V452-L534 PolarHBondContact N-O 2.8Å
453	L	95.2	Very high	94.2	Very high	44 Å²	44	68.5 Å²	68.5	23%	0.23	31%	0.306	C	S	.	.			trans	-82.9	141.1	-170.4	-58.8	-177.9	0	0	0	113.5	I451 I455 M468 E469	I451-L453 PolarHBondContact O-N 3.27Å; L453-I455 HydrophobicContact CB-CD1 4Å; L453-M468 WeakPolarHBondContact O-CA 3.36Å; L453-E469 HydrophobicContact CB-CB 4.42Å; L453-E469 PolarHBondContact N-OE2 3.3Å; L453-E469 PolarHBondContact O-N 3.27Å
454	L	95.9	Very high	94.2	Very high	23 Å²	23	69 Å²	69	12%	0.12	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	118.4	156.6	179	67.6	0	0	0	108.3	L443 R444 E456 L466 M468	L443-L454 HydrophobicContact CB-CB 3.99Å; L443-L454 HydrophobicContact CB-CD2 3.87Å; R444-L454 HydrophobicContact CG-CD2 4.16Å; L454-E456 WeakPolarHBondContact CD1-O 3.33Å; L454-L466 HydrophobicContact CD1-CB 3.82Å; L454-L466 HydrophobicContact CD1-CD2 3.93Å; L454-L466 HydrophobicContact CD1-CG 4.4Å; L454-M468 HydrophobicContact CD1-CG 4.25Å
455	I	95.1	Very high	94.2	Very high	69 Å²	69	62.9 Å²	62.9	35%	0.354	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	-46.6	-178	-50.6	-59.9	0	0	0	110	Y419 L453 V467	Y419-I455 HydrophobicContact CD1-CD1 4.43Å; Y419-I455 HydrophobicContact CD1-CG1 3.76Å; Y419-I455 HydrophobicContact CE1-CD1 3.94Å; Y419-I455 HydrophobicContact CE1-CG1 3.68Å; Y419-I455 HydrophobicContact CE1-CG2 4.31Å; L453-I455 HydrophobicContact CB-CD1 4Å; I455-V467 HydrophobicContact CB-CB 4.37Å; I455-V467 HydrophobicContact CB-CG1 4.11Å; I455-V467 WeakPolarHBondContact CB-O 3.11Å; I455-V467 PolarHBondContact N-O 2.85Å
456	E	93.8	Very high	94.3	Very high	38 Å²	38	55.9 Å²	55.9	18%	0.178	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	156.4	-176.1	-173.1	158.9	150.9	0	0	111.2	R392 Y393 L454 V467	R392-E456 IonicContact CZ-OE1 3.71Å; R392-E456 IonicContact CZ-OE2 2.84Å; R392-E456 IonicContact NH1-OE1 2.66Å; R392-E456 PolarHBondContact NH1-OE1 2.79Å; R392-E456 IonicContact NH1-OE2 2.64Å; R392-E456 PolarHBondContact NH1-OE2 2.86Å; R392-E456 IonicContact NH2-OE2 3.06Å; R392-E456 PolarHBondContact NH2-OE2 3.42Å; Y393-E456 PolarHBondContact OH-OE2 3.37Å; L454-E456 WeakPolarHBondContact CD1-O 3.33Å; E456-V467 HydrophobicContact CB-CB 4.04Å; E456-V467 HydrophobicContact CB-CG2 4.1Å; E456-V467 PolarHBondContact N-O 2.89Å; E456-V467 PolarHBondContact O-N 2.93Å
457	E	93.9	Very high	94.3	Very high	64 Å²	64	55.9 Å²	55.9	30%	0.299	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	149.9	175.7	54.1	168.7	-160.3	0	0	110.9	V440 R444 Y465 L466	V440-E457 WeakPolarHBondContact CG1-OE2 3.38Å; R444-E457 IonicContact CZ-OE1 2.76Å; R444-E457 IonicContact CZ-OE2 3.38Å; R444-E457 IonicContact NE-OE1 2.7Å; R444-E457 PolarHBondContact NE-OE1 2.86Å; R444-E457 IonicContact NE-OE2 2.73Å; R444-E457 PolarHBondContact NE-OE2 3.34Å; R444-E457 IonicContact NH1-OE1 3.52Å; R444-E457 IonicContact NH2-OE1 3.5Å; R444-E457 PolarHBondContact NH2-OE1 3.21Å; R444-E457 IonicContact NH2-OE2 2.67Å; R444-E457 PolarHBondContact NH2-OE2 2.96Å; E457-Y465 CarbonylContact C-O 3.52Å; E457-Y465 VanDerWaalsContact CA-O 3.31Å; E457-Y465 WeakPolarHBondContact CA-O 3.33Å; E457-L466 HydrophobicContact CB-CD2 3.75Å
458	M	93.3	Very high	94.3	Very high	50 Å²	50	48.8 Å²	48.8	25%	0.246	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	106.9	174.2	-170.7	70.5	51.2	0	0	108.6	S388 I389 T460 Y465	S388-M458 WeakPolarHBondContact OG-CE 3.37Å; S388-M458 PolarHBondContact OG-SD 3.08Å; S388-M458 VanDerWaalsContact OG-SD 3.36Å; I389-M458 HydrophobicContact CD1-CB 3.95Å; I389-M458 HydrophobicContact CD1-CE 4.25Å; I389-M458 HydrophobicContact CG1-CB 3.99Å; I389-M458 HydrophobicContact CG1-CE 4.48Å; I389-M458 HydrophobicContact CG1-CG 4.16Å; M458-T460 HydrophobicContact CG-CG2 4.4Å; M458-Y465 PolarHBondContact N-O 2.99Å; M458-Y465 PolarHBondContact O-N 2.87Å
459	D	92.5	Very high	94.1	Very high	101 Å²	101	49.3 Å²	49.3	54%	0.54	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	120.8	179.4	-166.5	52.9	0	0	0	110.9	K426 L464	K426-D459 WeakPolarHBondContact CE-OD1 3.46Å; K426-D459 IonicContact NZ-OD1 3.46Å; K426-D459 PolarHBondContact NZ-OD1 2.63Å; K426-D459 IonicContact NZ-OD2 3.38Å; K426-D459 PolarHBondContact NZ-OD2 3.35Å; D459-L464 HydrophobicContact CB-CD1 4Å
460	T	91.6	Very high	93.9	Very high	36 Å²	36	46 Å²	46	22%	0.221	21%	0.208	C	C	.	.			trans	-115.8	-179.5	-179	82.1	0	0	0	0	111.9	P386 K426 M458 R462 D463 Y465	P386-T460 HydrophobicContact CG-CG2 3.78Å; K426-T460 WeakPolarHBondContact CE-O 3.4Å; K426-T460 PolarHBondContact NZ-O 3.04Å; M458-T460 HydrophobicContact CG-CG2 4.4Å; T460-R462 VanDerWaalsContact C-N 3.33Å; T460-R462 PolarHBondContact O-N 3.47Å; T460-R462 PolarHBondContact OG1-N 3.42Å; T460-D463 WeakPolarHBondContact CB-O 3.19Å; T460-D463 PolarHBondContact N-O 3.47Å; T460-D463 PolarHBondContact OG1-N 3.12Å; T460-D463 PolarHBondContact OG1-O 3.14Å; T460-Y465 HydrophobicContact CG2-CD2 3.89Å; T460-Y465 HydrophobicContact CG2-CE2 3.67Å
461	R	89.1	Confident	93.6	Very high	250 Å²	250	45.3 Å²	45.3	94%	0.943	21%	0.205	S	C	*	.	S	Bend	trans	-69.6	-27.1	177.6	-66.8	-173	-178.5	-174.4	1.6	113.9
462	R	89	Confident	93.1	Very high	174 Å²	174	49.4 Å²	49.4	66%	0.657	22%	0.223	S	C	*	.	S	Bend	trans	-110.3	-41.6	-176.2	-69.7	-173.2	178.3	-168.7	-0.6	112.9	K426 T460	K426-R462 WeakPolarHBondContact CA-O 3.44Å; K426-R462 WeakPolarHBondContact CB-O 3.25Å; K426-R462 WeakPolarHBondContact CG-O 2.98Å; K426-R462 PolarHBondContact N-O 2.8Å; T460-R462 VanDerWaalsContact C-N 3.33Å; T460-R462 PolarHBondContact O-N 3.47Å; T460-R462 PolarHBondContact OG1-N 3.42Å
463	D	93.1	Very high	92.4	Very high	15 Å²	15	50.8 Å²	50.8	8%	0.08	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	149	-169.4	-50.6	-69.9	0	0	0	110.7	I423 I424 S425 T460 Y465	I423-D463 HydrophobicContact CG2-CB 4.15Å; I424-D463 CarbonylContact O-C 3.53Å; I424-D463 WeakPolarHBondContact O-CA 3.32Å; S425-D463 VanDerWaalsContact CA-OD1 3.28Å; S425-D463 WeakPolarHBondContact CA-OD1 3.32Å; S425-D463 VanDerWaalsContact CB-OD1 3.31Å; S425-D463 WeakPolarHBondContact CB-OD1 3.49Å; S425-D463 PolarHBondContact OG-OD1 2.98Å; T460-D463 WeakPolarHBondContact CB-O 3.19Å; T460-D463 PolarHBondContact N-O 3.47Å; T460-D463 PolarHBondContact OG1-N 3.12Å; T460-D463 PolarHBondContact OG1-O 3.14Å; D463-Y465 HydrophobicContact CB-CD2 4.49Å; D463-Y465 HydrophobicContact CB-CE2 3.76Å
464	L	93.4	Very high	91.9	Very high	14 Å²	14	48.9 Å²	48.9	7%	0.073	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	123.7	171.1	170.5	63.1	0	0	0	108.6	I424 I436 V440 D459 L466	I424-L464 HydrophobicContact CB-CB 4.48Å; I424-L464 PolarHBondContact N-O 2.89Å; I424-L464 PolarHBondContact O-N 3.28Å; I436-L464 HydrophobicContact CG2-CD2 3.9Å; V440-L464 HydrophobicContact CG2-CD2 3.82Å; D459-L464 HydrophobicContact CB-CD1 4Å; L464-L466 HydrophobicContact CD1-CD2 4.06Å; L464-L466 HydrophobicContact CD2-CD2 4.3Å; L464-L466 HydrophobicContact CD2-CG 4.5Å; L464-L466 HydrophobicContact CG-CD2 4.11Å; L464-L466 HydrophobicContact CG-CG 4.22Å
465	Y	94.9	Very high	91.4	Very high	5 Å²	5	48.3 Å²	48.3	2%	0.02	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	130.5	179.6	-59.1	-102.5	0	0	0	109.3	P386 L421 K422 I423 E457 M458 T460 D463	P386-Y465 HydrophobicContact CG-CD2 4.1Å; P386-Y465 HydrophobicContact CG-CE1 4.49Å; P386-Y465 HydrophobicContact CG-CE2 3.6Å; L421-Y465 HydrophobicContact CD1-CD1 4.26Å; L421-Y465 HydrophobicContact CD2-CD1 4.44Å; K422-Y465 CarbonylContact O-C 3.59Å; K422-Y465 WeakPolarHBondContact O-CA 3.39Å; I423-Y465 HydrophobicContact CB-CD1 4.37Å; I423-Y465 HydrophobicContact CB-CE1 4.39Å; I423-Y465 HydrophobicContact CD1-CD1 4.18Å; I423-Y465 HydrophobicContact CD1-CE1 3.94Å; I423-Y465 HydrophobicContact CG1-CD1 3.78Å; I423-Y465 HydrophobicContact CG1-CE1 3.94Å; I423-Y465 HydrophobicContact CG2-CD1 3.98Å; I423-Y465 HydrophobicContact CG2-CE1 3.64Å; E457-Y465 CarbonylContact C-O 3.52Å; E457-Y465 VanDerWaalsContact CA-O 3.31Å; E457-Y465 WeakPolarHBondContact CA-O 3.33Å; M458-Y465 PolarHBondContact N-O 2.99Å; M458-Y465 PolarHBondContact O-N 2.87Å; T460-Y465 HydrophobicContact CG2-CD2 3.89Å; T460-Y465 HydrophobicContact CG2-CE2 3.67Å; D463-Y465 HydrophobicContact CB-CD2 4.49Å; D463-Y465 HydrophobicContact CB-CE2 3.76Å
466	L	95.2	Very high	90.9	Very high	0 Å²	0	45 Å²	45	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	116.9	178.2	-56.5	172.9	0	0	0	108.6	K422 I424 V440 L454 E457 L464 M468	K422-L466 HydrophobicContact CB-CB 4.28Å; K422-L466 HydrophobicContact CD-CD1 4.31Å; K422-L466 PolarHBondContact N-O 3.08Å; K422-L466 PolarHBondContact O-N 3.29Å; I424-L466 HydrophobicContact CD1-CD1 3.93Å; V440-L466 HydrophobicContact CG1-CD2 4.5Å; V440-L466 HydrophobicContact CG2-CD1 3.98Å; V440-L466 HydrophobicContact CG2-CD2 4.23Å; L454-L466 HydrophobicContact CD1-CB 3.82Å; L454-L466 HydrophobicContact CD1-CD2 3.93Å; L454-L466 HydrophobicContact CD1-CG 4.4Å; E457-L466 HydrophobicContact CB-CD2 3.75Å; L464-L466 HydrophobicContact CD1-CD2 4.06Å; L464-L466 HydrophobicContact CD2-CD2 4.3Å; L464-L466 HydrophobicContact CD2-CG 4.5Å; L464-L466 HydrophobicContact CG-CD2 4.11Å; L464-L466 HydrophobicContact CG-CG 4.22Å; L466-M468 HydrophobicContact CB-CG 4.31Å
467	V	95.6	Very high	90.4	Very high	1 Å²	1	43.5 Å²	43.5	1%	0.006	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	112.9	172.8	-175.6	0	0	0	0	107.5	I389 Y393 Y419 L421 I455 E456	I389-V467 HydrophobicContact CD1-CG2 4.37Å; Y393-V467 HydrophobicContact CE1-CG1 3.89Å; Y393-V467 HydrophobicContact CE2-CG2 4.15Å; Y419-V467 HydrophobicContact CD1-CG1 4.47Å; Y419-V467 HydrophobicContact CG-CG1 4.04Å; L421-V467 HydrophobicContact CD1-CG2 4.02Å; I455-V467 HydrophobicContact CB-CB 4.37Å; I455-V467 HydrophobicContact CB-CG1 4.11Å; I455-V467 WeakPolarHBondContact CB-O 3.11Å; I455-V467 PolarHBondContact N-O 2.85Å; E456-V467 HydrophobicContact CB-CB 4.04Å; E456-V467 HydrophobicContact CB-CG2 4.1Å; E456-V467 PolarHBondContact N-O 2.89Å; E456-V467 PolarHBondContact O-N 2.93Å
468	M	95.4	Very high	89.8	Confident	9 Å²	9	42 Å²	42	4%	0.044	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	154.5	-175.2	-60	-175.6	70.3	0	0	111.2	A420 K422 L443 V452 L453 L454 L466 L470 I688	A420-M468 PolarHBondContact N-O 3.45Å; A420-M468 PolarHBondContact O-N 3.14Å; K422-M468 HydrophobicContact CB-SD 4.36Å; K422-M468 HydrophobicContact CD-SD 3.9Å; L443-M468 HydrophobicContact CD1-CE 4.24Å; V452-M468 HydrophobicContact CG1-CE 4.41Å; L453-M468 WeakPolarHBondContact O-CA 3.36Å; L454-M468 HydrophobicContact CD1-CG 4.25Å; L466-M468 HydrophobicContact CB-CG 4.31Å; M468-L470 PolarHBondContact O-N 2.68Å; M468-I688 HydrophobicContact SD-CG2 3.98Å
469	E	94.3	Very high	89.2	Confident	34 Å²	34	39.8 Å²	39.8	16%	0.159	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	123.6	174.4	-175.1	177.5	-153	0	0	111.6	V452 L453 V471 K533	V452-E469 HydrophobicContact CG1-CB 4.24Å; L453-E469 HydrophobicContact CB-CB 4.42Å; L453-E469 PolarHBondContact N-OE2 3.3Å; L453-E469 PolarHBondContact O-N 3.27Å; E469-V471 HydrophobicContact CG-CG2 4.27Å; E469-V471 PolarHBondContact O-N 3.12Å; E469-K533 WeakPolarHBondContact OE1-CE 3.25Å; E469-K533 IonicContact OE1-NZ 3.08Å; E469-K533 PolarHBondContact OE1-NZ 2.95Å; E469-K533 WeakPolarHBondContact OE2-CE 3.21Å; E469-K533 IonicContact OE2-NZ 3.16Å; E469-K533 PolarHBondContact OE2-NZ 3.4Å
470	L	92.1	Very high	88.7	Confident	21 Å²	21	35 Å²	35	11%	0.11	16%	0.16	C	C	.	.			trans	-91.4	102.1	179.3	177.5	59.2	0	0	0	110.7	L399 E418 A420 M468 K472	L399-L470 HydrophobicContact CD1-CD1 4.3Å; L399-L470 HydrophobicContact CD1-CD2 4.4Å; E418-L470 HydrophobicContact CB-CD2 4.35Å; A420-L470 HydrophobicContact CB-CB 4.35Å; A420-L470 HydrophobicContact CB-CD1 4.34Å; M468-L470 PolarHBondContact O-N 2.68Å; L470-K472 HydrophobicContact CG-CG 4.2Å
471	V	90.3	Very high	88.3	Confident	2 Å²	2	34.7 Å²	34.7	1%	0.012	16%	0.158	C	C	.	.			trans	-93.5	121.5	177.2	-173.2	0	0	0	0	109.8	V452 E469 L521 V522 Y523 K533	V452-V471 HydrophobicContact CG2-CG2 4.32Å; E469-V471 HydrophobicContact CG-CG2 4.27Å; E469-V471 PolarHBondContact O-N 3.12Å; V471-L521 HydrophobicContact CB-CB 4.02Å; V471-L521 HydrophobicContact CB-CD1 3.8Å; V471-L521 HydrophobicContact CG1-CB 3.73Å; V471-L521 HydrophobicContact CG1-CD1 4.41Å; V471-L521 HydrophobicContact CG2-CD1 4.35Å; V471-V522 WeakPolarHBondContact CG1-O 3.34Å; V471-Y523 HydrophobicContact CG1-CD2 4.41Å; V471-K533 HydrophobicContact CG2-CB 4.5Å; V471-K533 HydrophobicContact CG2-CD 3.5Å
472	K	85.6	Confident	87.8	Confident	85 Å²	85	26.7 Å²	26.7	37%	0.37	14%	0.14	S	C	.	.			trans	-103.2	-14.9	-170.7	-68.2	-177.3	173.6	179.1	0	115.8	E418 L470 G474	E418-K472 IonicContact OE1-NZ 3.04Å; E418-K472 PolarHBondContact OE1-NZ 2.95Å; E418-K472 IonicContact OE2-NZ 2.75Å; E418-K472 PolarHBondContact OE2-NZ 3.46Å; L470-K472 HydrophobicContact CG-CG 4.2Å; K472-G474 PolarHBondContact O-N 2.73Å; K472-G474 VanDerWaalsContact O-N 3.08Å
473	G	80.8	Confident	87.2	Confident	32 Å²	32	20.5 Å²	20.5	33%	0.33	12%	0.123	S	C	.	.	S	Bend	trans	-75.4	8.8	-171.9	0	0	0	0	0	116.3	V522	G473-V522 CarbonylContact C-O 3.44Å; G473-V522 WeakPolarHBondContact CA-O 3.36Å; G473-V522 PolarHBondContact N-O 2.99Å
474	G	85.2	Confident	86.3	Confident	3 Å²	3	25.1 Å²	25.1	3%	0.031	16%	0.157	C	C	.	.			trans	91.7	-173.4	177.6	0	0	0	0	0	114.5	K472 D478 L521 V522	K472-G474 PolarHBondContact O-N 2.73Å; K472-G474 VanDerWaalsContact O-N 3.08Å; G474-D478 WeakPolarHBondContact CA-OD2 3.46Å; G474-L521 CarbonylContact O-C 3.49Å; G474-L521 WeakPolarHBondContact O-CA 3.11Å; G474-V522 PolarHBondContact O-N 2.89Å
475	D	84.5	Confident	85.9	Confident	12 Å²	12	30 Å²	30	6%	0.064	18%	0.175	C	C	.	.	B	Isolated β-bridge	trans	-88.2	177.8	170.3	70.6	39.8	0	0	0	112.4	F477 D478 A479 L520 Y674 K677	D475-F477 PolarHBondContact O-N 2.96Å; D475-F477 WeakPolarHBondContact OD1-CA 3.35Å; D475-F477 PolarHBondContact OD1-N 2.67Å; D475-D478 PolarHBondContact N-OD2 2.91Å; D475-D478 WeakPolarHBondContact O-CB 3.35Å; D475-D478 PolarHBondContact O-N 2.73Å; D475-D478 PolarHBondContact OD1-N 2.76Å; D475-A479 PolarHBondContact O-N 3.36Å; D475-A479 VanDerWaalsContact O-N 3.16Å; D475-L520 CarbonylContact C-O 3.51Å; D475-L520 WeakPolarHBondContact CA-O 3.42Å; D475-Y674 PolarHBondContact OD2-OH 3.41Å; D475-K677 IonicContact OD2-NZ 2.62Å; D475-K677 PolarHBondContact OD2-NZ 2.72Å
476	L	84.8	Confident	85.5	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-55	-34.5	-179.4	-171	61.6	0	0	0	113.3	I480 M494 P517 L520 L532 I579 L583	L476-I480 HydrophobicContact CG-CD1 4.46Å; L476-I480 WeakPolarHBondContact O-CD1 3.34Å; L476-I480 VanDerWaalsContact O-CG1 3.31Å; L476-I480 WeakPolarHBondContact O-CG1 3.16Å; L476-I480 PolarHBondContact O-N 3.32Å; L476-M494 HydrophobicContact CD1-CE 4.45Å; L476-M494 HydrophobicContact CD1-CG 4.34Å; L476-M494 HydrophobicContact CD1-SD 3.64Å; L476-P517 HydrophobicContact CB-CB 4.17Å; L476-P517 HydrophobicContact CD2-CB 4.1Å; L476-P517 HydrophobicContact CD2-CG 4.35Å; L476-L520 HydrophobicContact CB-CB 4.23Å; L476-L520 HydrophobicContact CD2-CD1 3.91Å; L476-L520 PolarHBondContact N-O 3.14Å; L476-L532 HydrophobicContact CD1-CD1 3.64Å; L476-L532 HydrophobicContact CD1-CD2 3.73Å; L476-L532 HydrophobicContact CD1-CG 4.34Å; L476-I579 HydrophobicContact CD2-CG2 3.65Å; L476-L583 HydrophobicContact CD1-CD2 4.01Å; L476-L583 HydrophobicContact CD2-CD2 3.9Å; L476-L583 HydrophobicContact CG-CD2 3.96Å
477	F	83.9	Confident	85.2	Confident	6 Å²	6	30.6 Å²	30.6	3%	0.026	18%	0.178	C	C	.	.	H	α-helix	trans	-87.3	-28	-178.8	-65	-20.7	0	0	0	112.6	D475 A479 I480 T481 P517 I582 I668 F672 Y674	D475-F477 PolarHBondContact O-N 2.96Å; D475-F477 WeakPolarHBondContact OD1-CA 3.35Å; D475-F477 PolarHBondContact OD1-N 2.67Å; F477-A479 VanDerWaalsContact C-N 3.32Å; F477-I480 HydrophobicContact CD1-CD1 4.2Å; F477-T481 WeakPolarHBondContact O-CB 3.46Å; F477-T481 VanDerWaalsContact O-CG2 3.32Å; F477-T481 WeakPolarHBondContact O-CG2 3.26Å; F477-T481 PolarHBondContact O-N 3.43Å; F477-T481 PolarHBondContact O-OG1 3.1Å; F477-P517 HydrophobicContact CD1-CB 4.27Å; F477-P517 HydrophobicContact CD2-CB 4.05Å; F477-P517 HydrophobicContact CE1-CB 3.88Å; F477-P517 HydrophobicContact CE1-CG 3.89Å; F477-P517 HydrophobicContact CE2-CB 3.63Å; F477-P517 HydrophobicContact CE2-CG 3.8Å; F477-P517 HydrophobicContact CG-CB 4.37Å; F477-P517 HydrophobicContact CZ-CB 3.56Å; F477-P517 HydrophobicContact CZ-CG 3.36Å; F477-I582 HydrophobicContact CE1-CG2 3.8Å; F477-I582 HydrophobicContact CZ-CG2 3.75Å; F477-I668 HydrophobicContact CB-CG2 3.87Å; F477-I668 HydrophobicContact CD1-CD1 3.93Å; F477-I668 HydrophobicContact CD1-CG1 4.48Å; F477-I668 HydrophobicContact CD1-CG2 4.02Å; F477-I668 HydrophobicContact CD2-CG2 3.95Å; F477-I668 HydrophobicContact CE1-CD1 4.2Å; F477-I668 HydrophobicContact CE2-CG2 4.48Å; F477-I668 HydrophobicContact CG-CG2 3.68Å; F477-F672 HydrophobicContact CD2-CB 4.35Å; F477-F672 HydrophobicContact CD2-CD2 4.37Å; F477-F672 HydrophobicContact CD2-CG 4.22Å; F477-F672 HydrophobicContact CE2-CB 4.14Å; F477-F672 AromaticContact CE2-CD1 3.71Å; F477-F672 HydrophobicContact CE2-CD1 3.71Å; F477-F672 AromaticContact CE2-CD2 3.66Å; F477-F672 HydrophobicContact CE2-CD2 3.66Å; F477-F672 AromaticContact CE2-CE1 3.96Å; F477-F672 HydrophobicContact CE2-CE1 3.96Å; F477-F672 AromaticContact CE2-CE2 3.93Å; F477-F672 HydrophobicContact CE2-CE2 3.93Å; F477-F672 AromaticContact CE2-CG 3.55Å; F477-F672 HydrophobicContact CE2-CG 3.55Å; F477-F672 HydrophobicContact CE2-CZ 4.07Å; F477-F672 HydrophobicContact CZ-CD1 4.35Å; F477-F672 AromaticContact CZ-CD2 3.98Å; F477-F672 HydrophobicContact CZ-CD2 3.98Å; F477-F672 HydrophobicContact CZ-CE1 4.16Å; F477-F672 AromaticContact CZ-CE2 3.79Å; F477-F672 HydrophobicContact CZ-CE2 3.79Å; F477-F672 HydrophobicContact CZ-CG 4.26Å; F477-F672 AromaticContact CZ-CZ 3.88Å; F477-F672 HydrophobicContact CZ-CZ 3.88Å; F477-Y674 HydrophobicContact CB-CD2 4.35Å; F477-Y674 HydrophobicContact CB-CE2 4.37Å
478	D	81.1	Confident	85	Confident	31 Å²	31	31.7 Å²	31.7	17%	0.166	18%	0.183	C	C	.	.	H	α-helix	trans	-53.5	-50.5	163	-75.4	-47.3	0	0	0	110.1	G474 D475 I480 T481 S482 Y674 K677	G474-D478 WeakPolarHBondContact CA-OD2 3.46Å; D475-D478 PolarHBondContact N-OD2 2.91Å; D475-D478 WeakPolarHBondContact O-CB 3.35Å; D475-D478 PolarHBondContact O-N 2.73Å; D475-D478 PolarHBondContact OD1-N 2.76Å; D478-I480 PolarHBondContact O-N 3.14Å; D478-T481 PolarHBondContact O-N 2.84Å; D478-S482 VanDerWaalsContact O-CB 3.24Å; D478-S482 WeakPolarHBondContact O-CB 3.33Å; D478-S482 PolarHBondContact O-N 3.37Å; D478-S482 PolarHBondContact O-OG 3.37Å; D478-Y674 WeakPolarHBondContact OD1-CE1 3.45Å; D478-Y674 PolarHBondContact OD1-OH 2.76Å; D478-Y674 PolarHBondContact OD2-OH 3.26Å; D478-K677 IonicContact OD2-NZ 2.72Å; D478-K677 PolarHBondContact OD2-NZ 3.38Å; D478-K677 VanDerWaalsContact OD2-NZ 3.08Å
479	A	80.4	Confident	84.7	Confident	4 Å²	4	34.9 Å²	34.9	3%	0.033	19%	0.194	C	C	.	.	H	α-helix	trans	-67.7	-34.4	-175.5	0	0	0	0	0	114.6	D475 F477 S482 S483 M494 V522	D475-A479 PolarHBondContact O-N 3.36Å; D475-A479 VanDerWaalsContact O-N 3.16Å; F477-A479 VanDerWaalsContact C-N 3.32Å; A479-S482 PolarHBondContact O-OG 3.06Å; A479-S483 PolarHBondContact O-N 3.37Å; A479-M494 HydrophobicContact CB-CE 4.35Å; A479-V522 HydrophobicContact CB-CB 4.11Å; A479-V522 HydrophobicContact CB-CG1 3.96Å; A479-V522 HydrophobicContact CB-CG2 3.45Å; A479-V522 VanDerWaalsContact CB-CG2 3.45Å
480	I	83.1	Confident	84.5	Confident	2 Å²	2	36.2 Å²	36.2	1%	0.01	20%	0.202	C	C	.	.	H	α-helix	trans	-75.9	-41.9	176.3	-59.6	164	0	0	0	110.7	L476 F477 D478 S482 S483 Y486 M494 L583 V664 I668	L476-I480 HydrophobicContact CG-CD1 4.46Å; L476-I480 WeakPolarHBondContact O-CD1 3.34Å; L476-I480 VanDerWaalsContact O-CG1 3.31Å; L476-I480 WeakPolarHBondContact O-CG1 3.16Å; L476-I480 PolarHBondContact O-N 3.32Å; F477-I480 HydrophobicContact CD1-CD1 4.2Å; D478-I480 PolarHBondContact O-N 3.14Å; I480-S482 VanDerWaalsContact C-N 3.34Å; I480-S482 PolarHBondContact O-N 3.37Å; I480-S483 PolarHBondContact O-N 2.95Å; I480-Y486 HydrophobicContact CG1-CD2 4.38Å; I480-Y486 HydrophobicContact CG1-CE2 3.79Å; I480-Y486 HydrophobicContact CG2-CD1 4.18Å; I480-Y486 HydrophobicContact CG2-CD2 4.29Å; I480-Y486 HydrophobicContact CG2-CE1 4.21Å; I480-Y486 HydrophobicContact CG2-CE2 4.31Å; I480-Y486 HydrophobicContact CG2-CG 4.21Å; I480-M494 HydrophobicContact CG1-CE 4.26Å; I480-M494 HydrophobicContact CG1-SD 4.43Å; I480-L583 HydrophobicContact CD1-CD2 3.39Å; I480-V664 HydrophobicContact CG2-CB 4.3Å; I480-V664 HydrophobicContact CG2-CG1 4.25Å; I480-I668 HydrophobicContact CB-CD1 4.14Å; I480-I668 HydrophobicContact CD1-CD1 3.9Å; I480-I668 HydrophobicContact CG2-CD1 3.77Å
481	T	81.9	Confident	84.4	Confident	29 Å²	29	35.2 Å²	35.2	18%	0.178	20%	0.197	C	C	.	.	H	α-helix	trans	-80.1	-14.1	-176.1	63.4	0	0	0	0	114.4	F477 D478 A665 I668 K669	F477-T481 WeakPolarHBondContact O-CB 3.46Å; F477-T481 VanDerWaalsContact O-CG2 3.32Å; F477-T481 WeakPolarHBondContact O-CG2 3.26Å; F477-T481 PolarHBondContact O-N 3.43Å; F477-T481 PolarHBondContact O-OG1 3.1Å; D478-T481 PolarHBondContact O-N 2.84Å; T481-A665 HydrophobicContact CG2-CB 4.21Å; T481-I668 HydrophobicContact CG2-CB 4.34Å; T481-I668 HydrophobicContact CG2-CG2 4.03Å; T481-K669 HydrophobicContact CG2-CG 4.17Å
482	S	78.9	Confident	84.6	Confident	81 Å²	81	35.5 Å²	35.5	57%	0.566	20%	0.199	S	C	*	.	H	α-helix	trans	-89	-18.7	169.4	56.9	0	0	0	0	113.9	D478 A479 I480	D478-S482 VanDerWaalsContact O-CB 3.24Å; D478-S482 WeakPolarHBondContact O-CB 3.33Å; D478-S482 PolarHBondContact O-N 3.37Å; D478-S482 PolarHBondContact O-OG 3.37Å; A479-S482 PolarHBondContact O-OG 3.06Å; I480-S482 VanDerWaalsContact C-N 3.34Å; I480-S482 PolarHBondContact O-N 3.37Å
483	S	77.6	Confident	84.9	Confident	44 Å²	44	34.6 Å²	34.6	31%	0.308	20%	0.203	S	C	.	.			trans	-78.6	126.2	-178.7	-154	0	0	0	0	112	A479 I480 R485	A479-S483 PolarHBondContact O-N 3.37Å; I480-S483 PolarHBondContact O-N 2.95Å; S483-R485 VanDerWaalsContact C-N 3.28Å; S483-R485 WeakPolarHBondContact CB-O 3.43Å; S483-R485 PolarHBondContact O-N 2.7Å; S483-R485 PolarHBondContact OG-O 3.38Å
484	S	74.3	Confident	85.5	Confident	113 Å²	113	34.1 Å²	34.1	79%	0.79	19%	0.192	S	C	*	.	S	Bend	trans	-70.3	-26.2	175.9	56.4	0	0	0	0	112.9	Q661	S484-Q661 PolarHBondContact O-NE2 2.89Å
485	R	83.3	Confident	86	Confident	117 Å²	117	34 Å²	34	44%	0.442	19%	0.191	S	C	.	.	S	Bend	trans	-130.7	135.8	174.8	-171.7	178.8	-176.2	-131.6	-10	108.8	S483 T487 E657 G659	S483-R485 VanDerWaalsContact C-N 3.28Å; S483-R485 WeakPolarHBondContact CB-O 3.43Å; S483-R485 PolarHBondContact O-N 2.7Å; S483-R485 PolarHBondContact OG-O 3.38Å; R485-T487 HydrophobicContact CG-CG2 4.43Å; R485-E657 PolarHBondContact NH1-O 3.01Å; R485-E657 PolarHBondContact NH2-O 3.4Å; R485-G659 PolarHBondContact NH2-O 3.46Å
486	Y	86.8	Confident	86.6	Confident	9 Å²	9	37.6 Å²	37.6	4%	0.035	21%	0.206	C	C	.	.			trans	-151.5	135.8	179.7	-178.8	-96.8	0	0	0	109.6	I480 D490 A491 M494 L583 Q661 L662 V664	I480-Y486 HydrophobicContact CG1-CD2 4.38Å; I480-Y486 HydrophobicContact CG1-CE2 3.79Å; I480-Y486 HydrophobicContact CG2-CD1 4.18Å; I480-Y486 HydrophobicContact CG2-CD2 4.29Å; I480-Y486 HydrophobicContact CG2-CE1 4.21Å; I480-Y486 HydrophobicContact CG2-CE2 4.31Å; I480-Y486 HydrophobicContact CG2-CG 4.21Å; Y486-D490 HydrophobicContact CD2-CB 3.64Å; Y486-D490 HydrophobicContact CE2-CB 3.58Å; Y486-A491 WeakPolarHBondContact OH-CB 3.36Å; Y486-M494 HydrophobicContact CE2-CE 4.18Å; Y486-M494 HydrophobicContact CE2-SD 4.27Å; Y486-L583 VanDerWaalsContact CE1-O 3.29Å; Y486-L583 WeakPolarHBondContact CE1-O 3.4Å; Y486-L583 PolarHBondContact OH-O 2.78Å; Y486-Q661 CarbonylContact O-C 3.55Å; Y486-Q661 WeakPolarHBondContact O-CA 3.43Å; Y486-L662 HydrophobicContact CD1-CB 4.2Å; Y486-L662 HydrophobicContact CD1-CD1 4.41Å; Y486-L662 HydrophobicContact CE1-CD1 4.16Å; Y486-L662 PolarHBondContact O-N 2.68Å; Y486-V664 HydrophobicContact CD1-CB 4.39Å; Y486-V664 HydrophobicContact CD1-CG2 3.82Å; Y486-V664 HydrophobicContact CE1-CB 4.46Å; Y486-V664 HydrophobicContact CE1-CG2 3.83Å
487	T	90.3	Very high	87.2	Confident	8 Å²	8	38.8 Å²	38.8	5%	0.049	21%	0.212	C	C	.	.			trans	-142.5	172.7	-164.7	69.2	0	0	0	0	111.6	R485 R489 D490 A491	R485-T487 HydrophobicContact CG-CG2 4.43Å; T487-R489 PolarHBondContact O-N 3.05Å; T487-R489 PolarHBondContact OG1-N 3.18Å; T487-D490 WeakPolarHBondContact CA-OD2 3.33Å; T487-D490 WeakPolarHBondContact CB-OD2 3.5Å; T487-D490 PolarHBondContact N-OD2 3.32Å; T487-D490 PolarHBondContact O-N 3.26Å; T487-D490 PolarHBondContact OG1-OD2 3.01Å; T487-A491 PolarHBondContact O-N 3.46Å
488	E	90.6	Very high	87.8	Confident	24 Å²	24	38.7 Å²	38.7	11%	0.112	21%	0.212	C	C	.	.	H	α-helix	trans	-60	-29.7	171.3	-75.3	-172.5	-130.6	0	0	113.3	D490 A491 S492 V619 S620 W649 L662	E488-D490 VanDerWaalsContact C-N 3.35Å; E488-A491 PolarHBondContact O-N 3.41Å; E488-S492 VanDerWaalsContact O-CB 3.27Å; E488-S492 WeakPolarHBondContact O-CB 3.41Å; E488-S492 PolarHBondContact O-N 3.13Å; E488-V619 WeakPolarHBondContact OE1-CA 3.5Å; E488-S620 PolarHBondContact OE1-N 2.89Å; E488-S620 VanDerWaalsContact OE2-CB 3.3Å; E488-S620 WeakPolarHBondContact OE2-CB 3.45Å; E488-S620 PolarHBondContact OE2-OG 2.73Å; E488-W649 HydrophobicContact CB-CZ2 4.1Å; E488-W649 HydrophobicContact CG-CZ2 4.34Å; E488-W649 PolarHBondContact OE2-NE1 2.74Å; E488-L662 HydrophobicContact CG-CD1 4.04Å; E488-L662 HydrophobicContact CG-CD2 4.38Å
489	R	89.1	Confident	88.7	Confident	76 Å²	76	37.3 Å²	37.3	29%	0.287	21%	0.205	S	C	.	.	H	α-helix	trans	-66.9	-38.4	177.3	-163.1	178.2	-177.5	101.5	1.5	111	T487 S492 C493 D653 L655	T487-R489 PolarHBondContact O-N 3.05Å; T487-R489 PolarHBondContact OG1-N 3.18Å; R489-S492 PolarHBondContact O-N 3.14Å; R489-C493 PolarHBondContact O-N 3.41Å; R489-C493 PolarHBondContact O-SG 3.12Å; R489-D653 PolarHBondContact NH1-O 2.85Å; R489-D653 VanDerWaalsContact NH1-O 3.11Å; R489-D653 IonicContact NH2-OD1 2.68Å; R489-D653 PolarHBondContact NH2-OD1 2.9Å; R489-L655 HydrophobicContact CB-CB 4.38Å; R489-L655 WeakPolarHBondContact CD-O 3.37Å; R489-L655 HydrophobicContact CG-CB 4.37Å; R489-L655 PolarHBondContact NH1-O 3.4Å
490	D	89.1	Confident	89.5	Confident	62 Å²	62	38.4 Å²	38.4	33%	0.332	21%	0.213	S	C	.	.	H	α-helix	trans	-64.6	-45.6	175.1	-54.1	-73.7	0	0	0	111.3	Y486 T487 E488 S492 C493 M494	Y486-D490 HydrophobicContact CD2-CB 3.64Å; Y486-D490 HydrophobicContact CE2-CB 3.58Å; T487-D490 WeakPolarHBondContact CA-OD2 3.33Å; T487-D490 WeakPolarHBondContact CB-OD2 3.5Å; T487-D490 PolarHBondContact N-OD2 3.32Å; T487-D490 PolarHBondContact O-N 3.26Å; T487-D490 PolarHBondContact OG1-OD2 3.01Å; E488-D490 VanDerWaalsContact C-N 3.35Å; D490-S492 VanDerWaalsContact C-N 3.32Å; D490-S492 PolarHBondContact O-N 2.87Å; D490-C493 PolarHBondContact O-N 3.05Å; D490-M494 WeakPolarHBondContact O-CG 3.29Å; D490-M494 PolarHBondContact O-N 3.45Å
491	A	91.9	Very high	90.3	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-62.4	-38.1	175.8	0	0	0	0	0	112.4	Y486 T487 E488 M494 L495 L583 V584 W649	Y486-A491 WeakPolarHBondContact OH-CB 3.36Å; T487-A491 PolarHBondContact O-N 3.46Å; E488-A491 PolarHBondContact O-N 3.41Å; A491-M494 WeakPolarHBondContact O-CB 3.44Å; A491-M494 PolarHBondContact O-N 3.28Å; A491-L495 PolarHBondContact O-N 3.21Å; A491-L583 HydrophobicContact CB-CB 4.09Å; A491-V584 HydrophobicContact CB-CG2 4.48Å; A491-W649 HydrophobicContact CB-CH2 3.79Å; A491-W649 HydrophobicContact CB-CZ2 4.2Å
492	S	93.9	Very high	91	Very high	8 Å²	8	37 Å²	37	6%	0.056	20%	0.204	C	C	.	.	H	α-helix	trans	-67.8	-45.6	176.3	174.6	0	0	0	0	112.2	E488 R489 D490 M494 L495 F496 W649	E488-S492 VanDerWaalsContact O-CB 3.27Å; E488-S492 WeakPolarHBondContact O-CB 3.41Å; E488-S492 PolarHBondContact O-N 3.13Å; R489-S492 PolarHBondContact O-N 3.14Å; D490-S492 VanDerWaalsContact C-N 3.32Å; D490-S492 PolarHBondContact O-N 2.87Å; S492-M494 VanDerWaalsContact C-N 3.29Å; S492-M494 PolarHBondContact O-N 3.32Å; S492-L495 PolarHBondContact O-N 2.84Å; S492-L495 VanDerWaalsContact O-N 3.12Å; S492-F496 PolarHBondContact O-N 2.91Å; S492-W649 WeakPolarHBondContact CB-O 3.13Å; S492-W649 PolarHBondContact OG-O 3.12Å
493	C	91.9	Very high	92	Very high	65 Å²	65	36.3 Å²	36.3	44%	0.439	19%	0.191	S	C	.	.	H	α-helix	trans	-59.4	-39.7	173.8	-68.8	0	0	0	0	112.2	R489 D490 F496 N497	R489-C493 PolarHBondContact O-N 3.41Å; R489-C493 PolarHBondContact O-SG 3.12Å; D490-C493 PolarHBondContact O-N 3.05Å; C493-F496 PolarHBondContact O-N 2.88Å; C493-N497 PolarHBondContact O-N 2.91Å; C493-N497 VanDerWaalsContact O-N 3.17Å; C493-N497 PolarHBondContact O-ND2 2.74Å
494	M	92.9	Very high	93	Very high	22 Å²	22	36.9 Å²	36.9	11%	0.108	19%	0.187	C	C	.	.	H	α-helix	trans	-61.5	-46.4	172.5	-74.9	177.9	-177.7	0	0	112	L476 A479 I480 Y486 D490 A491 S492 N497 L498 L532 L583	L476-M494 HydrophobicContact CD1-CE 4.45Å; L476-M494 HydrophobicContact CD1-CG 4.34Å; L476-M494 HydrophobicContact CD1-SD 3.64Å; A479-M494 HydrophobicContact CB-CE 4.35Å; I480-M494 HydrophobicContact CG1-CE 4.26Å; I480-M494 HydrophobicContact CG1-SD 4.43Å; Y486-M494 HydrophobicContact CE2-CE 4.18Å; Y486-M494 HydrophobicContact CE2-SD 4.27Å; D490-M494 WeakPolarHBondContact O-CG 3.29Å; D490-M494 PolarHBondContact O-N 3.45Å; A491-M494 WeakPolarHBondContact O-CB 3.44Å; A491-M494 PolarHBondContact O-N 3.28Å; S492-M494 VanDerWaalsContact C-N 3.29Å; S492-M494 PolarHBondContact O-N 3.32Å; M494-N497 PolarHBondContact O-N 3.29Å; M494-L498 PolarHBondContact O-N 2.9Å; M494-L498 VanDerWaalsContact O-N 3.14Å; M494-L532 HydrophobicContact CB-CD1 3.8Å; M494-L532 HydrophobicContact CB-CG 4.3Å; M494-L532 HydrophobicContact CG-CD1 4.07Å; M494-L532 HydrophobicContact CG-CD2 4.32Å; M494-L532 HydrophobicContact CG-CG 4.15Å; M494-L583 HydrophobicContact CB-CD1 3.95Å; M494-L583 HydrophobicContact SD-CD1 4.48Å; M494-L583 HydrophobicContact SD-CD2 3.95Å
495	L	96.3	Very high	94.1	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.005	15%	0.149	C	C	.	.	H	α-helix	trans	-65.3	-40.8	176.3	179.2	57.1	0	0	0	112.5	A491 S492 N497 L498 A499 T580 L626 M630 V644 W649 V650	A491-L495 PolarHBondContact O-N 3.21Å; S492-L495 PolarHBondContact O-N 2.84Å; S492-L495 VanDerWaalsContact O-N 3.12Å; L495-N497 VanDerWaalsContact C-N 3.29Å; L495-N497 PolarHBondContact O-N 3.32Å; L495-L498 PolarHBondContact O-N 3.37Å; L495-A499 HydrophobicContact CD1-CB 4.49Å; L495-A499 VanDerWaalsContact O-CB 3.28Å; L495-A499 WeakPolarHBondContact O-CB 3.43Å; L495-A499 PolarHBondContact O-N 3.16Å; L495-T580 WeakPolarHBondContact CD1-OG1 3.42Å; L495-T580 HydrophobicContact CD2-CG2 3.91Å; L495-L626 HydrophobicContact CD2-CD2 3.68Å; L495-L626 HydrophobicContact CD2-CG 4.49Å; L495-M630 HydrophobicContact CD1-CE 3.95Å; L495-M630 HydrophobicContact CD2-SD 4.19Å; L495-V644 HydrophobicContact CD1-CG1 4.15Å; L495-V644 HydrophobicContact CD2-CG1 4.11Å; L495-V644 HydrophobicContact CG-CG1 4.15Å; L495-W649 HydrophobicContact CB-CZ3 4.26Å; L495-W649 HydrophobicContact CD2-CE3 4.22Å; L495-W649 HydrophobicContact CD2-CZ3 3.84Å; L495-V650 HydrophobicContact CD2-CG2 3.87Å; L495-V650 HydrophobicContact CG-CG2 4.3Å
496	F	96.7	Very high	94.9	Very high	88 Å²	88	27 Å²	27	39%	0.386	13%	0.133	S	C	.	.	H	α-helix	trans	-55.3	-46	175.9	179.3	-90	0	0	0	111.3	S492 C493 S500 L645 V650	S492-F496 PolarHBondContact O-N 2.91Å; C493-F496 PolarHBondContact O-N 2.88Å; F496-S500 VanDerWaalsContact O-CB 3.31Å; F496-S500 WeakPolarHBondContact O-CB 3.42Å; F496-S500 PolarHBondContact O-N 2.96Å; F496-L645 HydrophobicContact CD2-CD2 3.55Å; F496-L645 HydrophobicContact CE2-CD2 3.8Å; F496-L645 HydrophobicContact CG-CD2 4.11Å; F496-V650 HydrophobicContact CB-CG1 3.99Å; F496-V650 HydrophobicContact CD2-CG1 3.81Å; F496-V650 HydrophobicContact CG-CG1 4.41Å
497	N	96.6	Very high	95.4	Very high	24 Å²	24	32.1 Å²	32.1	13%	0.128	16%	0.161	C	C	.	.	H	α-helix	trans	-62.1	-45.4	178.3	-79.1	-146.9	0	0	0	111.7	N450 C493 M494 L495 A501 S531 L532	N450-N497 WeakPolarHBondContact CB-O 3.31Å; N450-N497 WeakPolarHBondContact ND2-CB 3.45Å; N450-N497 PolarHBondContact ND2-OD1 2.63Å; C493-N497 PolarHBondContact O-N 2.91Å; C493-N497 VanDerWaalsContact O-N 3.17Å; C493-N497 PolarHBondContact O-ND2 2.74Å; M494-N497 PolarHBondContact O-N 3.29Å; L495-N497 VanDerWaalsContact C-N 3.29Å; L495-N497 PolarHBondContact O-N 3.32Å; N497-A501 PolarHBondContact O-N 3.21Å; N497-A501 VanDerWaalsContact O-N 3.15Å; N497-S531 WeakPolarHBondContact OD1-CA 3.44Å; N497-S531 WeakPolarHBondContact OD1-CB 3.44Å; N497-L532 HydrophobicContact CB-CB 3.95Å; N497-L532 HydrophobicContact CB-CG 4.46Å; N497-L532 PolarHBondContact OD1-N 3.23Å
498	L	97.9	Very high	95.7	Very high	5 Å²	5	34.2 Å²	34.2	3%	0.026	17%	0.171	C	C	.	.	H	α-helix	trans	-65.7	-49.2	177.9	177.4	52.4	0	0	0	112	M494 L495 S500 A501 I502 I515 L520 A576 I579	M494-L498 PolarHBondContact O-N 2.9Å; M494-L498 VanDerWaalsContact O-N 3.14Å; L495-L498 PolarHBondContact O-N 3.37Å; L498-S500 VanDerWaalsContact C-N 3.29Å; L498-S500 PolarHBondContact O-N 3.08Å; L498-A501 WeakPolarHBondContact O-CB 3.43Å; L498-A501 PolarHBondContact O-N 2.83Å; L498-A501 VanDerWaalsContact O-N 3.15Å; L498-I502 HydrophobicContact CD1-CD1 3.74Å; L498-I502 HydrophobicContact CD1-CG1 4.04Å; L498-I502 HydrophobicContact CG-CD1 3.81Å; L498-I502 VanDerWaalsContact O-CG1 3.31Å; L498-I502 WeakPolarHBondContact O-CG1 3.49Å; L498-I502 PolarHBondContact O-N 2.93Å; L498-I515 HydrophobicContact CD1-CG2 4Å; L498-I515 HydrophobicContact CD2-CG2 4.35Å; L498-L520 HydrophobicContact CD1-CD2 3.8Å; L498-L520 HydrophobicContact CD2-CD1 4.03Å; L498-A576 HydrophobicContact CD2-CB 3.82Å; L498-A576 HydrophobicContact CG-CB 4.27Å; L498-I579 HydrophobicContact CD2-CD1 4.39Å
499	A	98.4	Very high	96.1	Very high	2 Å²	2	37.3 Å²	37.3	2%	0.017	19%	0.189	C	C	.	.	H	α-helix	trans	-64.3	-32.8	179.4	0	0	0	0	0	112.1	L495 I502 K503 V644 L645	L495-A499 HydrophobicContact CD1-CB 4.49Å; L495-A499 VanDerWaalsContact O-CB 3.28Å; L495-A499 WeakPolarHBondContact O-CB 3.43Å; L495-A499 PolarHBondContact O-N 3.16Å; A499-I502 PolarHBondContact O-N 2.95Å; A499-K503 VanDerWaalsContact O-CB 3.26Å; A499-K503 WeakPolarHBondContact O-CB 3.38Å; A499-K503 PolarHBondContact O-N 2.63Å; A499-V644 HydrophobicContact CB-CB 4.33Å; A499-V644 HydrophobicContact CB-CG1 3.68Å; A499-L645 HydrophobicContact CB-CD1 4.44Å; A499-L645 HydrophobicContact CB-CD2 3.83Å; A499-L645 HydrophobicContact CB-CG 3.78Å
500	S	98.4	Very high	96.5	Very high	27 Å²	27	33.7 Å²	33.7	19%	0.189	18%	0.175	C	C	.	.	H	α-helix	trans	-65	-44.8	171.2	-166	0	0	0	0	112	H448 F496 L498 K503 Y504	H448-S500 PolarHBondContact CE1-OG 3.46Å; H448-S500 PolarHBondContact NE2-OG 2.96Å; F496-S500 VanDerWaalsContact O-CB 3.31Å; F496-S500 WeakPolarHBondContact O-CB 3.42Å; F496-S500 PolarHBondContact O-N 2.96Å; L498-S500 VanDerWaalsContact C-N 3.29Å; L498-S500 PolarHBondContact O-N 3.08Å; S500-K503 PolarHBondContact O-N 2.85Å; S500-Y504 WeakPolarHBondContact O-CB 3.48Å; S500-Y504 PolarHBondContact O-N 3.39Å
501	A	98.4	Very high	96.9	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-60.9	-44.7	174	0	0	0	0	0	112	H448 N450 I451 N497 L498 Y504 L505 L534	H448-A501 PolarHBondContact CE1-N 2.72Å; N450-A501 HydrophobicContact CB-CB 4.09Å; N450-A501 WeakPolarHBondContact O-CB 3.38Å; I451-A501 HydrophobicContact CD1-CB 4.37Å; I451-A501 HydrophobicContact CG1-CB 3.91Å; N497-A501 PolarHBondContact O-N 3.21Å; N497-A501 VanDerWaalsContact O-N 3.15Å; L498-A501 WeakPolarHBondContact O-CB 3.43Å; L498-A501 PolarHBondContact O-N 2.83Å; L498-A501 VanDerWaalsContact O-N 3.15Å; A501-Y504 WeakPolarHBondContact O-CB 3.37Å; A501-Y504 PolarHBondContact O-N 3.47Å; A501-L505 WeakPolarHBondContact O-CG 3.22Å; A501-L505 PolarHBondContact O-N 2.7Å; A501-L534 HydrophobicContact CB-CB 4.46Å; A501-L534 HydrophobicContact CB-CD2 4.5Å
502	I	98.7	Very high	97.1	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.005	16%	0.159	C	C	.	.	H	α-helix	trans	-64.7	-45.3	178.3	-63.9	168.5	0	0	0	110.8	L498 A499 Y504 L505 H506 I515 D572 I573 A576 A641	L498-I502 HydrophobicContact CD1-CD1 3.74Å; L498-I502 HydrophobicContact CD1-CG1 4.04Å; L498-I502 HydrophobicContact CG-CD1 3.81Å; L498-I502 VanDerWaalsContact O-CG1 3.31Å; L498-I502 WeakPolarHBondContact O-CG1 3.49Å; L498-I502 PolarHBondContact O-N 2.93Å; A499-I502 PolarHBondContact O-N 2.95Å; I502-Y504 VanDerWaalsContact C-N 3.29Å; I502-Y504 PolarHBondContact O-N 2.95Å; I502-L505 PolarHBondContact O-N 3.24Å; I502-L505 VanDerWaalsContact O-N 3.17Å; I502-H506 WeakPolarHBondContact CG2-CE1 3.45Å; I502-H506 WeakPolarHBondContact CG2-NE2 3.45Å; I502-H506 WeakPolarHBondContact O-CB 3.31Å; I502-H506 PolarHBondContact O-CD2 3.28Å; I502-H506 VanDerWaalsContact O-CG 3.26Å; I502-H506 PolarHBondContact O-N 3.19Å; I502-I515 HydrophobicContact CD1-CD1 3.67Å; I502-I515 HydrophobicContact CG1-CD1 3.71Å; I502-D572 HydrophobicContact CD1-CB 4.46Å; I502-D572 HydrophobicContact CG2-CB 4Å; I502-I573 HydrophobicContact CG2-CD1 3.84Å; I502-A576 HydrophobicContact CD1-CB 3.83Å; I502-A641 HydrophobicContact CB-CB 4.33Å; I502-A641 HydrophobicContact CG2-CB 4Å
503	K	98.6	Very high	97.2	Very high	66 Å²	66	32.4 Å²	32.4	29%	0.287	16%	0.164	S	C	.	.	H	α-helix	trans	-55.7	-43.8	174.6	176.3	170.2	173	174.4	0	111.6	A499 S500 H506 N507 A641 V642 L645	A499-K503 VanDerWaalsContact O-CB 3.26Å; A499-K503 WeakPolarHBondContact O-CB 3.38Å; A499-K503 PolarHBondContact O-N 2.63Å; S500-K503 PolarHBondContact O-N 2.85Å; K503-H506 PolarHBondContact O-N 2.78Å; K503-N507 WeakPolarHBondContact O-CB 3.46Å; K503-N507 PolarHBondContact O-N 3.2Å; K503-N507 PolarHBondContact O-OD1 3.09Å; K503-A641 HydrophobicContact CB-CB 3.71Å; K503-V642 HydrophobicContact CD-CG2 4.01Å; K503-V642 HydrophobicContact CG-CG2 4.29Å; K503-L645 HydrophobicContact CB-CD1 4.1Å; K503-L645 HydrophobicContact CD-CD1 3.41Å; K503-L645 VanDerWaalsContact CD-CD1 3.41Å; K503-L645 HydrophobicContact CG-CD1 4.42Å
504	Y	98.7	Very high	97.3	Very high	57 Å²	57	29.4 Å²	29.4	22%	0.224	14%	0.144	C	C	.	.	H	α-helix	trans	-62.4	-45.6	176.5	176.4	-89.7	0	0	0	112.4	R445 V446 K447 H448 I451 S500 A501 I502 L508	R445-Y504 PolarHBondContact O-OH 3.06Å; V446-Y504 HydrophobicContact CB-CE1 4Å; V446-Y504 HydrophobicContact CG1-CE1 4.21Å; K447-Y504 PolarHBondContact N-OH 2.96Å; K447-Y504 WeakPolarHBondContact O-CE2 3.32Å; K447-Y504 PolarHBondContact O-OH 3.3Å; H448-Y504 HydrophobicContact CB-CD1 3.8Å; H448-Y504 HydrophobicContact CB-CD2 4.18Å; H448-Y504 HydrophobicContact CB-CE1 4.12Å; H448-Y504 HydrophobicContact CB-CE2 4.46Å; H448-Y504 HydrophobicContact CB-CG 3.84Å; H448-Y504 AromaticContact CD2-CD2 3.86Å; H448-Y504 AromaticContact CD2-CG 3.74Å; H448-Y504 AromaticContact CG-CG 3.94Å; I451-Y504 HydrophobicContact CD1-CD1 3.89Å; I451-Y504 HydrophobicContact CD1-CE1 4.4Å; S500-Y504 WeakPolarHBondContact O-CB 3.48Å; S500-Y504 PolarHBondContact O-N 3.39Å; A501-Y504 WeakPolarHBondContact O-CB 3.37Å; A501-Y504 PolarHBondContact O-N 3.47Å; I502-Y504 VanDerWaalsContact C-N 3.29Å; I502-Y504 PolarHBondContact O-N 2.95Å; Y504-L508 HydrophobicContact CD1-CD1 4.33Å; Y504-L508 HydrophobicContact CE1-CD1 3.62Å; Y504-L508 PolarHBondContact O-N 3.36Å
505	L	98.4	Very high	97.5	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-65.5	-43.3	176.9	-66.9	177.2	0	0	0	112.3	V446 I451 A501 I502 N507 L508 N509 I510 H512 L534 F537	V446-L505 HydrophobicContact CB-CD2 4.37Å; V446-L505 HydrophobicContact CG1-CD2 3.49Å; V446-L505 VanDerWaalsContact CG1-CD2 3.49Å; I451-L505 HydrophobicContact CD1-CD1 4.37Å; I451-L505 HydrophobicContact CD1-CD2 3.86Å; I451-L505 HydrophobicContact CD1-CG 3.98Å; A501-L505 WeakPolarHBondContact O-CG 3.22Å; A501-L505 PolarHBondContact O-N 2.7Å; I502-L505 PolarHBondContact O-N 3.24Å; I502-L505 VanDerWaalsContact O-N 3.17Å; L505-N507 VanDerWaalsContact C-N 3.35Å; L505-N507 PolarHBondContact O-N 3.47Å; L505-L508 CarbonylContact O-C 3.59Å; L505-L508 WeakPolarHBondContact O-CA 3.38Å; L505-L508 WeakPolarHBondContact O-CB 3.27Å; L505-L508 PolarHBondContact O-N 3.46Å; L505-N509 PolarHBondContact O-N 2.91Å; L505-I510 CarbonylContact C-O 3.56Å; L505-I510 HydrophobicContact CB-CB 4.25Å; L505-I510 HydrophobicContact CB-CG2 4.49Å; L505-I510 HydrophobicContact CD2-CB 4.33Å; L505-I510 HydrophobicContact CD2-CD1 4.4Å; L505-I510 HydrophobicContact CD2-CG2 4.13Å; L505-I510 PolarHBondContact O-N 3.42Å; L505-H512 HydrophobicContact CD1-CB 4.43Å; L505-L534 HydrophobicContact CD1-CD2 4.03Å; L505-F537 HydrophobicContact CD1-CE1 3.83Å; L505-F537 HydrophobicContact CD1-CZ 4.17Å; L505-F537 HydrophobicContact CD2-CE1 3.76Å; L505-F537 HydrophobicContact CD2-CZ 4.29Å; L505-F537 HydrophobicContact CG-CE1 4.46Å
506	H	98.3	Very high	97.3	Very high	22 Å²	22	29 Å²	29	10%	0.102	14%	0.142	C	C	.	.	H	α-helix	trans	-65.7	-36.9	-178.8	-71.7	-168.4	0	0	0	112	I502 K503 L508 N509 I510 L569 D572	I502-H506 WeakPolarHBondContact CG2-CE1 3.45Å; I502-H506 WeakPolarHBondContact CG2-NE2 3.45Å; I502-H506 WeakPolarHBondContact O-CB 3.31Å; I502-H506 PolarHBondContact O-CD2 3.28Å; I502-H506 VanDerWaalsContact O-CG 3.26Å; I502-H506 PolarHBondContact O-N 3.19Å; K503-H506 PolarHBondContact O-N 2.78Å; H506-L508 PolarHBondContact O-N 2.98Å; H506-N509 WeakPolarHBondContact O-CA 3.41Å; H506-N509 PolarHBondContact O-N 2.96Å; H506-I510 PolarHBondContact CD2-O 3.02Å; H506-L569 HydrophobicContact CB-CD1 4.08Å; H506-L569 PolarHBondContact CE1-O 2.83Å; H506-L569 PolarHBondContact NE2-O 3.21Å; H506-L569 VanDerWaalsContact NE2-O 3.15Å; H506-D572 IonicContact CD2-OD2 2.69Å; H506-D572 IonicContact CE1-OD2 2.77Å; H506-D572 IonicContact NE2-OD2 2.94Å; H506-D572 PolarHBondContact NE2-OD2 2.87Å
507	N	98.1	Very high	97	Very high	117 Å²	117	24.9 Å²	24.9	63%	0.626	12%	0.123	S	C	*	.	H	α-helix	trans	-63	-23.1	171.3	-73.1	-6.1	0	0	0	113.5	K503 L505	K503-N507 WeakPolarHBondContact O-CB 3.46Å; K503-N507 PolarHBondContact O-N 3.2Å; K503-N507 PolarHBondContact O-OD1 3.09Å; L505-N507 VanDerWaalsContact C-N 3.35Å; L505-N507 PolarHBondContact O-N 3.47Å
508	L	97.3	Very high	96.5	Very high	52 Å²	52	27.9 Å²	27.9	27%	0.272	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	5.7	172.9	-63.7	177.5	0	0	0	113	V446 Y504 L505 H506 I510	V446-L508 HydrophobicContact CG1-CD1 4.43Å; Y504-L508 HydrophobicContact CD1-CD1 4.33Å; Y504-L508 HydrophobicContact CE1-CD1 3.62Å; Y504-L508 PolarHBondContact O-N 3.36Å; L505-L508 CarbonylContact O-C 3.59Å; L505-L508 WeakPolarHBondContact O-CA 3.38Å; L505-L508 WeakPolarHBondContact O-CB 3.27Å; L505-L508 PolarHBondContact O-N 3.46Å; H506-L508 PolarHBondContact O-N 2.98Å; L508-I510 HydrophobicContact CB-CD1 3.75Å; L508-I510 HydrophobicContact CB-CG1 4.12Å; L508-I510 HydrophobicContact CD1-CD1 4.08Å; L508-I510 PolarHBondContact O-N 3.36Å
509	N	97.5	Very high	96.3	Very high	89 Å²	89	28 Å²	28	48%	0.476	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.8	32	-169.6	-59.8	-79.6	0	0	0	113.6	L505 H506 V542 V543	L505-N509 PolarHBondContact O-N 2.91Å; H506-N509 WeakPolarHBondContact O-CA 3.41Å; H506-N509 PolarHBondContact O-N 2.96Å; N509-V542 CarbonylContact O-C 3.55Å; N509-V542 WeakPolarHBondContact O-CA 3.27Å; N509-V543 PolarHBondContact O-N 2.91Å
510	I	97.8	Very high	96	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	129.9	175.7	-62.9	161.2	0	0	0	109.2	I442 V446 L505 H506 L508 A540 T541 V542 L569	I442-I510 HydrophobicContact CG2-CD1 4.2Å; I442-I510 HydrophobicContact CG2-CG2 4.2Å; V446-I510 HydrophobicContact CG1-CD1 3.93Å; L505-I510 CarbonylContact C-O 3.56Å; L505-I510 HydrophobicContact CB-CB 4.25Å; L505-I510 HydrophobicContact CB-CG2 4.49Å; L505-I510 HydrophobicContact CD2-CB 4.33Å; L505-I510 HydrophobicContact CD2-CD1 4.4Å; L505-I510 HydrophobicContact CD2-CG2 4.13Å; L505-I510 PolarHBondContact O-N 3.42Å; H506-I510 PolarHBondContact CD2-O 3.02Å; L508-I510 HydrophobicContact CB-CD1 3.75Å; L508-I510 HydrophobicContact CB-CG1 4.12Å; L508-I510 HydrophobicContact CD1-CD1 4.08Å; L508-I510 PolarHBondContact O-N 3.36Å; I510-A540 HydrophobicContact CG2-CB 4.41Å; I510-T541 WeakPolarHBondContact CA-O 3.42Å; I510-V542 HydrophobicContact CG1-CG2 4.22Å; I510-L569 WeakPolarHBondContact O-CD2 3.49Å
511	V	97.7	Very high	95.7	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	140.3	168.6	64.9	0	0	0	0	109.6	R513 A540 T541 V543 L547 L569 V571 D572	V511-R513 HydrophobicContact CB-CG 4.3Å; V511-R513 HydrophobicContact CG1-CG 3.79Å; V511-R513 HydrophobicContact CG2-CG 3.7Å; V511-A540 VanDerWaalsContact O-CA 3.28Å; V511-A540 WeakPolarHBondContact O-CA 3.32Å; V511-T541 HydrophobicContact CG1-CG2 3.55Å; V511-T541 PolarHBondContact N-O 2.85Å; V511-T541 PolarHBondContact O-N 3.23Å; V511-V543 HydrophobicContact CB-CG2 3.76Å; V511-V543 HydrophobicContact CG1-CG2 3.49Å; V511-V543 VanDerWaalsContact CG1-CG2 3.49Å; V511-L547 HydrophobicContact CG1-CD1 3.77Å; V511-L569 HydrophobicContact CB-CD2 4.16Å; V511-V571 HydrophobicContact CG2-CG2 3.47Å; V511-V571 VanDerWaalsContact CG2-CG2 3.47Å; V511-D572 WeakPolarHBondContact CA-OD2 3.5Å; V511-D572 WeakPolarHBondContact CG2-OD2 3.16Å
512	H	97.4	Very high	95.3	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.128	C	C	.	.			trans	-89.9	-41.7	-175.6	-164.6	-87.9	0	0	0	113.3	L505 D514 I515 G535 D536 F537 L539 D572	L505-H512 HydrophobicContact CD1-CB 4.43Å; H512-D514 PolarHBondContact O-N 3.4Å; H512-I515 HydrophobicContact CB-CD1 3.95Å; H512-I515 HydrophobicContact CB-CG1 3.69Å; H512-G535 PolarHBondContact CE1-O 3.43Å; H512-G535 VanDerWaalsContact CE1-O 3.25Å; H512-G535 PolarHBondContact NE2-O 2.84Å; H512-D536 PolarHBondContact CE1-O 2.75Å; H512-D536 PolarHBondContact NE2-O 3.42Å; H512-F537 AromaticContact CD2-CD1 3.84Å; H512-F537 AromaticContact CD2-CE1 3.64Å; H512-F537 AromaticContact CD2-CZ 3.93Å; H512-L539 CarbonylContact O-C 3.6Å; H512-D572 WeakPolarHBondContact CB-OD1 3.43Å; H512-D572 PolarHBondContact N-OD1 3.35Å; H512-D572 VanDerWaalsContact N-OD1 3.14Å; H512-D572 PolarHBondContact N-OD2 3.47Å
513	R	95.3	Very high	94.9	Very high	43 Å²	43	30.9 Å²	30.9	16%	0.162	15%	0.145	C	C	.	.	S	Bend	trans	65.3	-17.2	174.7	-50.1	-171.3	-66.7	178.1	-6.2	117.9	V511 L539 Y567 V571 D572	V511-R513 HydrophobicContact CB-CG 4.3Å; V511-R513 HydrophobicContact CG1-CG 3.79Å; V511-R513 HydrophobicContact CG2-CG 3.7Å; R513-L539 PolarHBondContact NE-O 2.97Å; R513-L539 PolarHBondContact NH2-O 3Å; R513-Y567 VanDerWaalsContact CD-OH 3.31Å; R513-Y567 WeakPolarHBondContact CD-OH 3.34Å; R513-Y567 HydrophobicContact CG-CE2 4.28Å; R513-Y567 PolarHBondContact NH1-OH 3.35Å; R513-V571 HydrophobicContact CG-CG2 4.49Å; R513-D572 PolarHBondContact N-OD1 3.29Å
514	D	94.9	Very high	94.3	Very high	2 Å²	2	33 Å²	33	1%	0.011	16%	0.156	C	C	.	.			trans	-124	49.9	172	-162.6	36.7	0	0	0	110.8	H512 K516 N519 L539 T553 K695	H512-D514 PolarHBondContact O-N 3.4Å; D514-K516 IonicContact OD1-NZ 2.75Å; D514-K516 PolarHBondContact OD1-NZ 2.84Å; D514-K516 IonicContact OD2-NZ 3.43Å; D514-K516 PolarHBondContact OD2-NZ 3.01Å; D514-N519 PolarHBondContact O-ND2 3.39Å; D514-N519 PolarHBondContact OD2-ND2 2.89Å; D514-L539 HydrophobicContact CB-CB 4.34Å; D514-L539 HydrophobicContact CB-CD1 4.12Å; D514-T553 PolarHBondContact OD1-OG1 3.45Å; D514-K695 IonicContact OD2-NZ 2.6Å; D514-K695 PolarHBondContact OD2-NZ 3.34Å
515	I	96.6	Very high	93.7	Very high	2 Å²	2	34.8 Å²	34.8	1%	0.01	17%	0.166	C	C	.	.			trans	-79.4	120.8	171.7	-55.7	-171.4	0	0	0	108.5	L498 I502 H512 L534 D572 A575 I579	L498-I515 HydrophobicContact CD1-CG2 4Å; L498-I515 HydrophobicContact CD2-CG2 4.35Å; I502-I515 HydrophobicContact CD1-CD1 3.67Å; I502-I515 HydrophobicContact CG1-CD1 3.71Å; H512-I515 HydrophobicContact CB-CD1 3.95Å; H512-I515 HydrophobicContact CB-CG1 3.69Å; I515-L534 HydrophobicContact CD1-CD2 4.3Å; I515-L534 HydrophobicContact CG1-CD1 4.35Å; I515-L534 HydrophobicContact CG2-CD1 4.49Å; I515-D572 HydrophobicContact CD1-CB 3.6Å; I515-A575 HydrophobicContact CB-CB 3.95Å; I515-A575 HydrophobicContact CG2-CB 4.5Å; I515-I579 HydrophobicContact CG2-CD1 3.74Å
516	K	92.3	Very high	93	Very high	13 Å²	13	44.1 Å²	44.1	6%	0.057	21%	0.214	C	C	.	.	S	Bend	trans	-161.6	161.3	-178.2	63.9	-173.4	-177.1	-143.7	0	110.7	D514 E518 N519 L520 T553 Y556	D514-K516 IonicContact OD1-NZ 2.75Å; D514-K516 PolarHBondContact OD1-NZ 2.84Å; D514-K516 IonicContact OD2-NZ 3.43Å; D514-K516 PolarHBondContact OD2-NZ 3.01Å; K516-E518 WeakPolarHBondContact CB-OE2 3.4Å; K516-E518 WeakPolarHBondContact CD-OE2 3.35Å; K516-E518 HydrophobicContact CG-CB 4.34Å; K516-E518 VanDerWaalsContact CG-OE2 3.23Å; K516-E518 WeakPolarHBondContact CG-OE2 3.41Å; K516-E518 PolarHBondContact O-N 2.97Å; K516-N519 WeakPolarHBondContact CE-OD1 3.23Å; K516-N519 HydrophobicContact CG-CB 4.04Å; K516-N519 PolarHBondContact O-N 3.46Å; K516-L520 WeakPolarHBondContact O-CG 3.23Å; K516-L520 PolarHBondContact O-N 3.15Å; K516-T553 HydrophobicContact CD-CG2 4.22Å; K516-T553 WeakPolarHBondContact CD-OG1 3.42Å; K516-T553 PolarHBondContact NZ-OG1 2.85Å; K516-Y556 HydrophobicContact CB-CD2 3.71Å; K516-Y556 HydrophobicContact CB-CE2 3.7Å; K516-Y556 HydrophobicContact CB-CG 4.16Å
517	P	89.4	Confident	92.3	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-51.6	-38.6	-179.6	-28.3	37.1	0	0	0	114.3	L476 F477 N519 L520 Y556 I579	L476-P517 HydrophobicContact CB-CB 4.17Å; L476-P517 HydrophobicContact CD2-CB 4.1Å; L476-P517 HydrophobicContact CD2-CG 4.35Å; F477-P517 HydrophobicContact CD1-CB 4.27Å; F477-P517 HydrophobicContact CD2-CB 4.05Å; F477-P517 HydrophobicContact CE1-CB 3.88Å; F477-P517 HydrophobicContact CE1-CG 3.89Å; F477-P517 HydrophobicContact CE2-CB 3.63Å; F477-P517 HydrophobicContact CE2-CG 3.8Å; F477-P517 HydrophobicContact CG-CB 4.37Å; F477-P517 HydrophobicContact CZ-CB 3.56Å; F477-P517 HydrophobicContact CZ-CG 3.36Å; P517-N519 PolarHBondContact O-N 2.81Å; P517-L520 PolarHBondContact O-N 2.96Å; P517-L520 VanDerWaalsContact O-N 3.14Å; P517-Y556 VanDerWaalsContact CD-OH 3.23Å; P517-Y556 WeakPolarHBondContact CD-OH 3.31Å; P517-Y556 HydrophobicContact CG-CE1 4.19Å; P517-I579 HydrophobicContact CG-CG1 4.39Å
518	E	86.5	Confident	91.4	Very high	88 Å²	88	45.9 Å²	45.9	41%	0.411	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-67.8	-18.8	179.8	-51.4	95.3	131.6	0	0	113.2	K516 I687	K516-E518 WeakPolarHBondContact CB-OE2 3.4Å; K516-E518 WeakPolarHBondContact CD-OE2 3.35Å; K516-E518 HydrophobicContact CG-CB 4.34Å; K516-E518 VanDerWaalsContact CG-OE2 3.23Å; K516-E518 WeakPolarHBondContact CG-OE2 3.41Å; K516-E518 PolarHBondContact O-N 2.97Å; E518-I687 VanDerWaalsContact O-CD1 3.29Å; E518-I687 WeakPolarHBondContact O-CD1 3.46Å; E518-I687 WeakPolarHBondContact O-CG1 3.43Å
519	N	92.8	Very high	90.6	Very high	6 Å²	6	46 Å²	46	3%	0.032	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-102.7	7.2	177.8	-68.7	-2.2	0	0	0	112.4	D514 K516 P517 G535 I687	D514-N519 PolarHBondContact O-ND2 3.39Å; D514-N519 PolarHBondContact OD2-ND2 2.89Å; K516-N519 WeakPolarHBondContact CE-OD1 3.23Å; K516-N519 HydrophobicContact CG-CB 4.04Å; K516-N519 PolarHBondContact O-N 3.46Å; P517-N519 PolarHBondContact O-N 2.81Å; N519-G535 PolarHBondContact O-N 3.01Å; N519-I687 VanDerWaalsContact CA-CD1 3.5Å
520	L	93.5	Very high	90.1	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.005	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	98.7	-178.6	-69.4	173.3	0	0	0	110.1	D475 L476 L498 K516 P517 L534 I579	D475-L520 CarbonylContact C-O 3.51Å; D475-L520 WeakPolarHBondContact CA-O 3.42Å; L476-L520 HydrophobicContact CB-CB 4.23Å; L476-L520 HydrophobicContact CD2-CD1 3.91Å; L476-L520 PolarHBondContact N-O 3.14Å; L498-L520 HydrophobicContact CD1-CD2 3.8Å; L498-L520 HydrophobicContact CD2-CD1 4.03Å; K516-L520 WeakPolarHBondContact O-CG 3.23Å; K516-L520 PolarHBondContact O-N 3.15Å; P517-L520 PolarHBondContact O-N 2.96Å; P517-L520 VanDerWaalsContact O-N 3.14Å; L520-L534 HydrophobicContact CD2-CB 4.13Å; L520-L534 HydrophobicContact CD2-CD1 3.8Å; L520-I579 HydrophobicContact CD1-CD1 3.87Å; L520-I579 HydrophobicContact CD1-CG2 4.33Å
521	L	92	Very high	89.7	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.005	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	149.7	179.9	-58.3	-175.6	0	0	0	112	V452 V471 G474 L532 K533 I687	V452-L521 HydrophobicContact CG2-CD1 4.39Å; V471-L521 HydrophobicContact CB-CB 4.02Å; V471-L521 HydrophobicContact CB-CD1 3.8Å; V471-L521 HydrophobicContact CG1-CB 3.73Å; V471-L521 HydrophobicContact CG1-CD1 4.41Å; V471-L521 HydrophobicContact CG2-CD1 4.35Å; G474-L521 CarbonylContact O-C 3.49Å; G474-L521 WeakPolarHBondContact O-CA 3.11Å; L521-L532 CarbonylContact O-C 3.55Å; L521-L532 WeakPolarHBondContact O-CA 3.25Å; L521-K533 PolarHBondContact N-O 2.86Å; L521-K533 PolarHBondContact O-N 3.45Å; L521-I687 HydrophobicContact CD1-CD1 3.86Å; L521-I687 HydrophobicContact CD2-CD1 3.48Å; L521-I687 VanDerWaalsContact CD2-CD1 3.48Å; L521-I687 HydrophobicContact CG-CD1 3.44Å; L521-I687 VanDerWaalsContact CG-CD1 3.44Å
522	V	90.1	Very high	89.5	Confident	2 Å²	2	46.6 Å²	46.6	1%	0.012	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	121	179.1	176.2	0	0	0	0	109	V471 G473 G474 A479 K530 L532	V471-V522 WeakPolarHBondContact CG1-O 3.34Å; G473-V522 CarbonylContact C-O 3.44Å; G473-V522 WeakPolarHBondContact CA-O 3.36Å; G473-V522 PolarHBondContact N-O 2.99Å; G474-V522 PolarHBondContact O-N 2.89Å; A479-V522 HydrophobicContact CB-CB 4.11Å; A479-V522 HydrophobicContact CB-CG1 3.96Å; A479-V522 HydrophobicContact CB-CG2 3.45Å; A479-V522 VanDerWaalsContact CB-CG2 3.45Å; V522-K530 HydrophobicContact CG1-CB 4.08Å; V522-K530 HydrophobicContact CG1-CD 4.19Å; V522-K530 HydrophobicContact CG1-CG 4.16Å; V522-L532 HydrophobicContact CG2-CD2 3.54Å
523	Y	89.3	Confident	89.4	Confident	88 Å²	88	47.1 Å²	47.1	35%	0.345	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	118	169.7	-174	-83.9	0	0	0	108.8	V471 H525 S531 K533	V471-Y523 HydrophobicContact CG1-CD2 4.41Å; Y523-H525 AromaticContact CD1-CD2 3.98Å; Y523-H525 AromaticContact CD1-CE1 3.93Å; Y523-H525 AromaticContact CD1-ND1 3.89Å; Y523-H525 AromaticContact CD1-NE2 3.95Å; Y523-H525 AromaticContact CE1-CE1 3.85Å; Y523-H525 AromaticContact CE1-ND1 3.54Å; Y523-S531 PolarHBondContact N-O 3.21Å; Y523-S531 PolarHBondContact O-N 2.92Å; Y523-S531 PolarHBondContact O-OG 3.2Å; Y523-K533 HydrophobicContact CD2-CD 4.42Å
524	E	86.9	Confident	89.5	Confident	111 Å²	111	45.2 Å²	45.2	52%	0.519	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	124.6	175.8	-172.3	162.6	-130.1	0	0	109.2	K530	E524-K530 WeakPolarHBondContact OE1-CE 3.31Å
525	H	85.9	Confident	89.4	Confident	94 Å²	94	45.2 Å²	45.2	44%	0.435	24%	0.237	S	C	.	.	P	Polyproline II helix	trans	-86	165.2	-179.4	-67.9	-87	0	0	0	111.2	Y523 D527 G528 S529 S531	Y523-H525 AromaticContact CD1-CD2 3.98Å; Y523-H525 AromaticContact CD1-CE1 3.93Å; Y523-H525 AromaticContact CD1-ND1 3.89Å; Y523-H525 AromaticContact CD1-NE2 3.95Å; Y523-H525 AromaticContact CE1-CE1 3.85Å; Y523-H525 AromaticContact CE1-ND1 3.54Å; H525-D527 WeakPolarHBondContact CB-OD1 3.37Å; H525-D527 PolarHBondContact O-N 2.77Å; H525-D527 VanDerWaalsContact O-N 3.13Å; H525-G528 PolarHBondContact O-N 2.8Å; H525-S529 WeakPolarHBondContact CB-OG 3.39Å; H525-S529 PolarHBondContact CD2-O 3.03Å; H525-S529 PolarHBondContact CD2-OG 3.29Å; H525-S529 PolarHBondContact N-O 3.46Å; H525-S531 WeakPolarHBondContact NE2-CB 3.48Å; H525-S531 PolarHBondContact NE2-OG 3.36Å
526	L	83.3	Confident	89	Confident	195 Å²	195	45.4 Å²	45.4	100%	1.021	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-13.4	-178.5	-63.9	175.1	0	0	0	114.3
527	D	83.2	Confident	89	Confident	128 Å²	128	45 Å²	45	68%	0.684	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.4	0.1	173.2	59.6	9.6	0	0	0	113.4	H525 S529	H525-D527 WeakPolarHBondContact CB-OD1 3.37Å; H525-D527 PolarHBondContact O-N 2.77Å; H525-D527 VanDerWaalsContact O-N 3.13Å; D527-S529 VanDerWaalsContact C-N 3.31Å; D527-S529 WeakPolarHBondContact OD1-CB 3.49Å; D527-S529 PolarHBondContact OD1-N 3.47Å; D527-S529 PolarHBondContact OD1-OG 2.97Å
528	G	79.4	Confident	88.9	Confident	49 Å²	49	45.4 Å²	45.4	51%	0.505	24%	0.241	S	C	.	.	S	Bend	trans	81.8	1.6	-175.4	0	0	0	0	0	114.6	H525	H525-G528 PolarHBondContact O-N 2.8Å
529	S	81.6	Confident	89.1	Confident	54 Å²	54	41.7 Å²	41.7	38%	0.378	22%	0.224	S	C	.	.			trans	-70.7	150	171.6	70.8	0	0	0	0	111.1	H525 D527	H525-S529 WeakPolarHBondContact CB-OG 3.39Å; H525-S529 PolarHBondContact CD2-O 3.03Å; H525-S529 PolarHBondContact CD2-OG 3.29Å; H525-S529 PolarHBondContact N-O 3.46Å; D527-S529 VanDerWaalsContact C-N 3.31Å; D527-S529 WeakPolarHBondContact OD1-CB 3.49Å; D527-S529 PolarHBondContact OD1-N 3.47Å; D527-S529 PolarHBondContact OD1-OG 2.97Å
530	K	85.6	Confident	89.1	Confident	84 Å²	84	41.7 Å²	41.7	37%	0.365	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	137.2	-178.1	-68.4	179.4	-179.5	179.2	0	110.2	V522 E524	V522-K530 HydrophobicContact CG1-CB 4.08Å; V522-K530 HydrophobicContact CG1-CD 4.19Å; V522-K530 HydrophobicContact CG1-CG 4.16Å; E524-K530 WeakPolarHBondContact OE1-CE 3.31Å
531	S	89.8	Confident	89.1	Confident	11 Å²	11	43 Å²	43	8%	0.077	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	147.3	177.1	59.5	0	0	0	0	111	N497 Y523 H525	N497-S531 WeakPolarHBondContact OD1-CA 3.44Å; N497-S531 WeakPolarHBondContact OD1-CB 3.44Å; Y523-S531 PolarHBondContact N-O 3.21Å; Y523-S531 PolarHBondContact O-N 2.92Å; Y523-S531 PolarHBondContact O-OG 3.2Å; H525-S531 WeakPolarHBondContact NE2-CB 3.48Å; H525-S531 PolarHBondContact NE2-OG 3.36Å
532	L	93.8	Very high	89.3	Confident	6 Å²	6	45.3 Å²	45.3	3%	0.031	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	146.3	177.6	-60.4	-170.5	0	0	0	112	N450 L476 M494 N497 L521 V522	N450-L532 VanDerWaalsContact CA-O 3.27Å; N450-L532 WeakPolarHBondContact CA-O 3.38Å; N450-L532 WeakPolarHBondContact CB-O 3.4Å; N450-L532 PolarHBondContact ND2-O 3.38Å; L476-L532 HydrophobicContact CD1-CD1 3.64Å; L476-L532 HydrophobicContact CD1-CD2 3.73Å; L476-L532 HydrophobicContact CD1-CG 4.34Å; M494-L532 HydrophobicContact CB-CD1 3.8Å; M494-L532 HydrophobicContact CB-CG 4.3Å; M494-L532 HydrophobicContact CG-CD1 4.07Å; M494-L532 HydrophobicContact CG-CD2 4.32Å; M494-L532 HydrophobicContact CG-CG 4.15Å; N497-L532 HydrophobicContact CB-CB 3.95Å; N497-L532 HydrophobicContact CB-CG 4.46Å; N497-L532 PolarHBondContact OD1-N 3.23Å; L521-L532 CarbonylContact O-C 3.55Å; L521-L532 WeakPolarHBondContact O-CA 3.25Å; V522-L532 HydrophobicContact CG2-CD2 3.54Å
533	K	95.4	Very high	89.4	Confident	12 Å²	12	46.3 Å²	46.3	5%	0.052	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	119.6	170.5	-77	174.2	172	-75.9	0	110.2	P449 N450 I451 V452 E469 V471 L521 Y523	P449-K533 WeakPolarHBondContact O-CE 3.47Å; P449-K533 WeakPolarHBondContact O-CG 3.46Å; P449-K533 PolarHBondContact O-NZ 3.19Å; N450-K533 WeakPolarHBondContact O-CA 3.45Å; I451-K533 PolarHBondContact O-NZ 3.32Å; V452-K533 HydrophobicContact CG2-CB 3.96Å; E469-K533 WeakPolarHBondContact OE1-CE 3.25Å; E469-K533 IonicContact OE1-NZ 3.08Å; E469-K533 PolarHBondContact OE1-NZ 2.95Å; E469-K533 WeakPolarHBondContact OE2-CE 3.21Å; E469-K533 IonicContact OE2-NZ 3.16Å; E469-K533 PolarHBondContact OE2-NZ 3.4Å; V471-K533 HydrophobicContact CG2-CB 4.5Å; V471-K533 HydrophobicContact CG2-CD 3.5Å; L521-K533 PolarHBondContact N-O 2.86Å; L521-K533 PolarHBondContact O-N 3.45Å; Y523-K533 HydrophobicContact CD2-CD 4.42Å
534	L	96.8	Very high	89.5	Confident	2 Å²	2	49.5 Å²	49.5	1%	0.01	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	132.4	173.7	178.1	61.6	0	0	0	110.8	N450 I451 V452 A501 L505 I515 L520	N450-L534 PolarHBondContact O-N 3.34Å; I451-L534 WeakPolarHBondContact CA-O 3Å; V452-L534 PolarHBondContact N-O 2.8Å; A501-L534 HydrophobicContact CB-CB 4.46Å; A501-L534 HydrophobicContact CB-CD2 4.5Å; L505-L534 HydrophobicContact CD1-CD2 4.03Å; I515-L534 HydrophobicContact CD1-CD2 4.3Å; I515-L534 HydrophobicContact CG1-CD1 4.35Å; I515-L534 HydrophobicContact CG2-CD1 4.49Å; L520-L534 HydrophobicContact CD2-CB 4.13Å; L520-L534 HydrophobicContact CD2-CD1 3.8Å
535	G	93.1	Very high	89.6	Confident	2 Å²	2	45.9 Å²	45.9	2%	0.021	27%	0.268	C	S	.	.			trans	-135.4	-173.8	175.3	0	0	0	0	0	113	H512 N519	H512-G535 PolarHBondContact CE1-O 3.43Å; H512-G535 VanDerWaalsContact CE1-O 3.25Å; H512-G535 PolarHBondContact NE2-O 2.84Å; N519-G535 PolarHBondContact O-N 3.01Å
536	D	88.4	Confident	89.8	Confident	7 Å²	7	45.3 Å²	45.3	4%	0.037	27%	0.273	C	S	.	.			trans	59.7	71.1	-174.4	-159.6	-28.8	0	0	0	113.9	H512 G538 I687 T690 K695	H512-D536 PolarHBondContact CE1-O 2.75Å; H512-D536 PolarHBondContact NE2-O 3.42Å; D536-G538 PolarHBondContact O-N 2.68Å; D536-G538 VanDerWaalsContact O-N 3.09Å; D536-G538 WeakPolarHBondContact OD1-CA 3.39Å; D536-G538 PolarHBondContact OD1-N 2.89Å; D536-I687 HydrophobicContact CB-CG2 4.15Å; D536-T690 WeakPolarHBondContact OD2-CB 3.42Å; D536-T690 PolarHBondContact OD2-OG1 3.19Å; D536-K695 VanDerWaalsContact CG-CE 3.47Å; D536-K695 WeakPolarHBondContact OD1-CE 3.42Å; D536-K695 IonicContact OD1-NZ 3.5Å; D536-K695 PolarHBondContact OD1-NZ 3.43Å; D536-K695 WeakPolarHBondContact OD2-CE 3.18Å; D536-K695 IonicContact OD2-NZ 2.72Å; D536-K695 PolarHBondContact OD2-NZ 3.46Å
537	F	92.8	Very high	90.1	Very high	4 Å²	4	37.6 Å²	37.6	2%	0.018	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-74.8	14.9	171.6	-71.3	-97.6	0	0	0	112.7	E439 I442 L443 V446 I451 L505 H512 L539 A540	E439-F537 HydrophobicContact CG-CB 4.45Å; I442-F537 HydrophobicContact CG2-CD1 3.69Å; I442-F537 HydrophobicContact CG2-CE1 4.32Å; I442-F537 HydrophobicContact CG2-CG 4.42Å; L443-F537 HydrophobicContact CD2-CB 4.12Å; L443-F537 HydrophobicContact CD2-CD2 3.64Å; L443-F537 HydrophobicContact CD2-CE2 4.36Å; L443-F537 HydrophobicContact CD2-CG 3.95Å; L443-F537 HydrophobicContact CG-CB 4.4Å; V446-F537 HydrophobicContact CG2-CZ 4.49Å; I451-F537 HydrophobicContact CD1-CZ 4.27Å; I451-F537 HydrophobicContact CG2-CE2 3.7Å; I451-F537 HydrophobicContact CG2-CZ 3.66Å; L505-F537 HydrophobicContact CD1-CE1 3.83Å; L505-F537 HydrophobicContact CD1-CZ 4.17Å; L505-F537 HydrophobicContact CD2-CE1 3.76Å; L505-F537 HydrophobicContact CD2-CZ 4.29Å; L505-F537 HydrophobicContact CG-CE1 4.46Å; H512-F537 AromaticContact CD2-CD1 3.84Å; H512-F537 AromaticContact CD2-CE1 3.64Å; H512-F537 AromaticContact CD2-CZ 3.93Å; F537-L539 PolarHBondContact O-N 3.49Å; F537-L539 VanDerWaalsContact O-N 3.16Å; F537-A540 HydrophobicContact CB-CB 3.96Å; F537-A540 HydrophobicContact CD1-CB 3.71Å; F537-A540 HydrophobicContact CG-CB 4.3Å; F537-A540 WeakPolarHBondContact O-CB 3.25Å; F537-A540 PolarHBondContact O-N 2.73Å
538	G	88	Confident	90.3	Very high	9 Å²	9	38 Å²	38	9%	0.093	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-64.9	-19.5	-175	0	0	0	0	0	114.7	D536 P692	D536-G538 PolarHBondContact O-N 2.68Å; D536-G538 VanDerWaalsContact O-N 3.09Å; D536-G538 WeakPolarHBondContact OD1-CA 3.39Å; D536-G538 PolarHBondContact OD1-N 2.89Å; G538-P692 WeakPolarHBondContact O-CA 3.37Å; G538-P692 WeakPolarHBondContact O-CB 3.46Å
539	L	88.6	Confident	90.6	Very high	10 Å²	10	37.9 Å²	37.9	5%	0.052	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-111.2	4.7	169.7	-74.2	178.7	0	0	0	113.6	H512 R513 D514 F537 C551 K695 V699	H512-L539 CarbonylContact O-C 3.6Å; R513-L539 PolarHBondContact NE-O 2.97Å; R513-L539 PolarHBondContact NH2-O 3Å; D514-L539 HydrophobicContact CB-CB 4.34Å; D514-L539 HydrophobicContact CB-CD1 4.12Å; F537-L539 PolarHBondContact O-N 3.49Å; F537-L539 VanDerWaalsContact O-N 3.16Å; L539-C551 HydrophobicContact CD1-CB 4.3Å; L539-K695 HydrophobicContact CD1-CB 4.22Å; L539-K695 HydrophobicContact CD1-CD 4.17Å; L539-K695 HydrophobicContact CD1-CG 4.4Å; L539-K695 HydrophobicContact CD2-CB 3.81Å; L539-K695 HydrophobicContact CD2-CG 4.32Å; L539-K695 HydrophobicContact CG-CB 3.89Å; L539-K695 HydrophobicContact CG-CD 4.11Å; L539-K695 HydrophobicContact CG-CG 3.92Å; L539-V699 HydrophobicContact CD2-CG2 4.27Å
540	A	94.6	Very high	90.8	Very high	5 Å²	5	36.2 Å²	36.2	4%	0.041	21%	0.207	C	C	.	.			trans	-69.4	150.3	-178.9	0	0	0	0	0	112.5	I442 I510 V511 F537	I442-A540 HydrophobicContact CD1-CB 3.87Å; I442-A540 WeakPolarHBondContact CD1-O 3.46Å; I442-A540 HydrophobicContact CG2-CB 4.41Å; I510-A540 HydrophobicContact CG2-CB 4.41Å; V511-A540 VanDerWaalsContact O-CA 3.28Å; V511-A540 WeakPolarHBondContact O-CA 3.32Å; F537-A540 HydrophobicContact CB-CB 3.96Å; F537-A540 HydrophobicContact CD1-CB 3.71Å; F537-A540 HydrophobicContact CG-CB 4.3Å; F537-A540 WeakPolarHBondContact O-CB 3.25Å; F537-A540 PolarHBondContact O-N 2.73Å
541	T	93.8	Very high	90.9	Very high	30 Å²	30	32.3 Å²	32.3	18%	0.184	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	154.2	174.1	-175.5	0	0	0	0	111.7	I510 V511 L547	I510-T541 WeakPolarHBondContact CA-O 3.42Å; V511-T541 HydrophobicContact CG1-CG2 3.55Å; V511-T541 PolarHBondContact N-O 2.85Å; V511-T541 PolarHBondContact O-N 3.23Å; T541-L547 HydrophobicContact CG2-CD1 3.54Å; T541-L547 HydrophobicContact CG2-CD2 4.44Å
542	V	94.6	Very high	90.7	Very high	48 Å²	48	31.8 Å²	31.8	29%	0.291	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	136.7	163.1	-176.6	0	0	0	0	109	N509 I510	N509-V542 CarbonylContact O-C 3.55Å; N509-V542 WeakPolarHBondContact O-CA 3.27Å; I510-V542 HydrophobicContact CG1-CG2 4.22Å
543	V	93.9	Very high	90.4	Very high	24 Å²	24	32.7 Å²	32.7	15%	0.145	19%	0.192	C	C	.	.			trans	-96.9	108.1	178.5	-176.3	0	0	0	0	108.8	N509 V511 G545 L547 L569	N509-V543 PolarHBondContact O-N 2.91Å; V511-V543 HydrophobicContact CB-CG2 3.76Å; V511-V543 HydrophobicContact CG1-CG2 3.49Å; V511-V543 VanDerWaalsContact CG1-CG2 3.49Å; V543-G545 WeakPolarHBondContact CG1-O 3.03Å; V543-L547 HydrophobicContact CG2-CD1 4.21Å; V543-L569 HydrophobicContact CB-CD2 4.28Å; V543-L569 HydrophobicContact CG2-CD2 3.73Å; V543-L569 HydrophobicContact CG2-CG 4.39Å
544	N	90.4	Very high	90	Very high	154 Å²	154	33.2 Å²	33.2	82%	0.824	20%	0.197	S	C	*	.	S	Bend	trans	-108.8	8.9	174.7	-60.1	-68.7	0	0	0	112.5
545	G	88.2	Confident	89.7	Confident	35 Å²	35	34.9 Å²	34.9	36%	0.361	21%	0.207	S	C	.	.	S	Bend	trans	161.3	177.2	-170.3	0	0	0	0	0	110	V543	V543-G545 WeakPolarHBondContact CG1-O 3.03Å
546	P	89.8	Confident	89.7	Confident	82 Å²	82	35.4 Å²	35.4	53%	0.532	21%	0.209	S	C	.	.			trans	-62.3	137.9	179.6	26	-34.1	0	0	0	111.9	Y548	P546-Y548 HydrophobicContact CB-CE2 3.99Å; P546-Y548 HydrophobicContact CG-CE2 3.96Å; P546-Y548 WeakPolarHBondContact CG-OH 3.37Å; P546-Y548 WeakPolarHBondContact O-CE2 3.02Å
547	L	90.2	Very high	90	Very high	33 Å²	33	35.5 Å²	35.5	17%	0.173	21%	0.209	C	C	.	.	B	Isolated β-bridge	trans	-101.4	141.8	177.9	-60.7	175.4	0	0	0	110.3	V511 T541 V543 G566 Y567	V511-L547 HydrophobicContact CG1-CD1 3.77Å; T541-L547 HydrophobicContact CG2-CD1 3.54Å; T541-L547 HydrophobicContact CG2-CD2 4.44Å; V543-L547 HydrophobicContact CG2-CD1 4.21Å; L547-G566 CarbonylContact O-C 3.59Å; L547-G566 WeakPolarHBondContact O-CA 3.27Å; L547-Y567 HydrophobicContact CB-CD1 4.25Å; L547-Y567 HydrophobicContact CB-CD2 3.94Å; L547-Y567 HydrophobicContact CB-CE1 3.92Å; L547-Y567 HydrophobicContact CB-CE2 3.57Å; L547-Y567 HydrophobicContact CB-CG 4.26Å; L547-Y567 HydrophobicContact CD1-CD2 4.28Å; L547-Y567 HydrophobicContact CD1-CE2 3.66Å; L547-Y567 HydrophobicContact CG-CE2 4.25Å; L547-Y567 PolarHBondContact N-O 3.1Å; L547-Y567 WeakPolarHBondContact O-CD1 3.31Å; L547-Y567 WeakPolarHBondContact O-CE1 3.38Å; L547-Y567 PolarHBondContact O-N 3.19Å
548	Y	88.3	Confident	90.1	Very high	137 Å²	137	35.3 Å²	35.3	54%	0.537	21%	0.209	S	C	.	.			trans	-123.8	4.2	-176.5	-58.8	-86.3	0	0	0	113.4	P546 V550	P546-Y548 HydrophobicContact CB-CE2 3.99Å; P546-Y548 HydrophobicContact CG-CE2 3.96Å; P546-Y548 WeakPolarHBondContact CG-OH 3.37Å; P546-Y548 WeakPolarHBondContact O-CE2 3.02Å; Y548-V550 PolarHBondContact O-N 2.69Å
549	A	85.1	Confident	90.5	Very high	47 Å²	47	35.1 Å²	35.1	39%	0.388	21%	0.206	S	C	.	.			trans	-78.4	107.5	177.6	0	0	0	0	0	109.6	C551 Y567	A549-C551 PolarHBondContact O-N 2.73Å; A549-C551 VanDerWaalsContact O-N 3.13Å; A549-C551 PolarHBondContact O-SG 3.05Å; A549-C551 VanDerWaalsContact O-SG 3.41Å; A549-Y567 VanDerWaalsContact O-CE1 3.31Å; A549-Y567 WeakPolarHBondContact O-CE1 3.3Å; A549-Y567 PolarHBondContact O-OH 2.78Å
550	V	85.9	Confident	90.8	Very high	19 Å²	19	35.1 Å²	35.1	12%	0.115	21%	0.206	C	C	.	.			trans	-66	108.6	175.1	-171.1	0	0	0	0	108.6	Y548 I561 E564 V699 F700	Y548-V550 PolarHBondContact O-N 2.69Å; V550-I561 HydrophobicContact CB-CG2 4.43Å; V550-I561 HydrophobicContact CG1-CG2 4.05Å; V550-E564 HydrophobicContact CG2-CG 3.54Å; V550-V699 CarbonylContact O-C 3.1Å; V550-V699 WeakPolarHBondContact O-CA 2.99Å; V550-F700 HydrophobicContact CB-CB 3.99Å; V550-F700 HydrophobicContact CG1-CB 3.75Å; V550-F700 HydrophobicContact CG1-CD2 3.99Å; V550-F700 HydrophobicContact CG1-CG 4.16Å; V550-F700 PolarHBondContact O-N 2.97Å
551	C	86.8	Confident	90.6	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.007	21%	0.205	C	C	.	.	B	Isolated β-bridge	trans	-151.5	158.1	-176.4	64.1	0	0	0	0	113.5	L539 A549 Q698 V699	L539-C551 HydrophobicContact CD1-CB 4.3Å; A549-C551 PolarHBondContact O-N 2.73Å; A549-C551 VanDerWaalsContact O-N 3.13Å; A549-C551 PolarHBondContact O-SG 3.05Å; A549-C551 VanDerWaalsContact O-SG 3.41Å; C551-Q698 WeakPolarHBondContact CA-O 3.33Å; C551-V699 HydrophobicContact CB-CG2 4.15Å
552	G	86.7	Confident	90.4	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	21%	0.205	C	C	.	.	S	Bend	trans	121.4	-171.2	177.5	0	0	0	0	0	112.1	Q698	G552-Q698 PolarHBondContact N-O 3.33Å
553	T	86.8	Confident	90.1	Very high	26 Å²	26	35.1 Å²	35.1	16%	0.16	21%	0.209	C	C	.	.			trans	-100	114.8	-178.2	-57.8	0	0	0	0	109.5	D514 K516 T555 Y556	D514-T553 PolarHBondContact OD1-OG1 3.45Å; K516-T553 HydrophobicContact CD-CG2 4.22Å; K516-T553 WeakPolarHBondContact CD-OG1 3.42Å; K516-T553 PolarHBondContact NZ-OG1 2.85Å; T553-T555 VanDerWaalsContact C-N 3.34Å; T553-T555 PolarHBondContact O-N 2.65Å; T553-Y556 HydrophobicContact CG2-CD2 3.99Å; T553-Y556 HydrophobicContact CG2-CE2 4.09Å; T553-Y556 PolarHBondContact O-N 3.48Å
554	P	87.6	Confident	89.8	Confident	22 Å²	22	37.8 Å²	37.8	14%	0.143	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-42.8	-45.8	-160.4	-37.2	36.9	0	0	0	117.6	Y556 V557 L600 F601 I604 F700	P554-Y556 PolarHBondContact O-N 3.4Å; P554-V557 PolarHBondContact O-N 3.27Å; P554-V557 VanDerWaalsContact O-N 3.14Å; P554-L600 HydrophobicContact CB-CD2 4.04Å; P554-F601 HydrophobicContact CB-CE1 3.97Å; P554-F601 HydrophobicContact CB-CZ 4.1Å; P554-F601 HydrophobicContact CG-CZ 4.22Å; P554-I604 WeakPolarHBondContact O-CD1 3.42Å; P554-F700 HydrophobicContact CG-CE2 4.47Å; P554-F700 HydrophobicContact CG-CZ 3.81Å
555	T	89.8	Confident	89.6	Confident	38 Å²	38	35.1 Å²	35.1	23%	0.233	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-55.1	-25.2	179.9	-40.9	0	0	0	0	114.3	T553 P588	T553-T555 VanDerWaalsContact C-N 3.34Å; T553-T555 PolarHBondContact O-N 2.65Å; T555-P588 HydrophobicContact CG2-CB 3.63Å; T555-P588 HydrophobicContact CG2-CG 4.17Å
556	Y	94.5	Very high	89.6	Confident	13 Å²	13	34.5 Å²	34.5	5%	0.051	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-112.7	0.9	-174.9	-46.3	-81.5	0	0	0	113.1	K516 P517 T553 P554 V578 I579 I582	K516-Y556 HydrophobicContact CB-CD2 3.71Å; K516-Y556 HydrophobicContact CB-CE2 3.7Å; K516-Y556 HydrophobicContact CB-CG 4.16Å; P517-Y556 VanDerWaalsContact CD-OH 3.23Å; P517-Y556 WeakPolarHBondContact CD-OH 3.31Å; P517-Y556 HydrophobicContact CG-CE1 4.19Å; T553-Y556 HydrophobicContact CG2-CD2 3.99Å; T553-Y556 HydrophobicContact CG2-CE2 4.09Å; T553-Y556 PolarHBondContact O-N 3.48Å; P554-Y556 PolarHBondContact O-N 3.4Å; Y556-V578 HydrophobicContact CD1-CB 4.18Å; Y556-V578 HydrophobicContact CD1-CG1 3.51Å; Y556-V578 HydrophobicContact CE1-CG1 3.93Å; Y556-V578 HydrophobicContact CG-CG1 4.47Å; Y556-I579 HydrophobicContact CD1-CG1 4.09Å; Y556-I579 HydrophobicContact CE1-CG1 4.11Å; Y556-I582 HydrophobicContact CE1-CD1 3.71Å
557	V	93.8	Very high	89.9	Confident	8 Å²	8	31 Å²	31	5%	0.048	18%	0.18	C	C	.	.			trans	-75.1	139.1	-176.8	175.6	0	0	0	0	110.6	P554 I561 V562 W574	P554-V557 PolarHBondContact O-N 3.27Å; P554-V557 VanDerWaalsContact O-N 3.14Å; V557-I561 HydrophobicContact CG1-CB 3.61Å; V557-I561 HydrophobicContact CG1-CD1 4.06Å; V557-I561 HydrophobicContact CG1-CG1 4.37Å; V557-I561 HydrophobicContact CG1-CG2 3.69Å; V557-V562 HydrophobicContact CG1-CG2 3.78Å; V557-W574 PolarHBondContact O-NE1 3.21Å
558	A	95.6	Very high	90.1	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.008	18%	0.183	C	C	.	.			trans	-81.8	151.7	-178.7	0	0	0	0	0	112.9	E560 I561 V562 V571 W574	A558-E560 VanDerWaalsContact C-N 3.29Å; A558-E560 WeakPolarHBondContact CB-OE2 3.4Å; A558-E560 PolarHBondContact O-N 2.66Å; A558-I561 HydrophobicContact CB-CD1 4.25Å; A558-I561 HydrophobicContact CB-CG1 4.32Å; A558-I561 WeakPolarHBondContact O-CB 3.24Å; A558-I561 PolarHBondContact O-N 3.43Å; A558-V562 PolarHBondContact O-N 2.89Å; A558-V571 HydrophobicContact CB-CB 3.94Å; A558-V571 HydrophobicContact CB-CG1 3.91Å; A558-W574 VanDerWaalsContact CA-CD1 3.5Å; A558-W574 HydrophobicContact CB-CB 3.84Å; A558-W574 HydrophobicContact CB-CD2 4.39Å; A558-W574 HydrophobicContact CB-CG 3.78Å
559	P	95.2	Very high	90.6	Very high	4 Å²	4	26 Å²	26	3%	0.026	17%	0.168	C	C	.	.	H	α-helix	trans	-58	-37.3	-174.6	-24.5	34.6	0	0	0	113.5	I561 V562 A563 W574 I604 L605 V633	P559-I561 PolarHBondContact O-N 3.42Å; P559-V562 PolarHBondContact O-N 3.44Å; P559-A563 WeakPolarHBondContact O-CB 3.39Å; P559-A563 PolarHBondContact O-N 2.56Å; P559-W574 HydrophobicContact CG-CD2 4.41Å; P559-W574 HydrophobicContact CG-CE3 4.14Å; P559-W574 HydrophobicContact CG-CH2 3.43Å; P559-W574 VanDerWaalsContact CG-CH2 3.43Å; P559-W574 HydrophobicContact CG-CZ2 3.73Å; P559-W574 HydrophobicContact CG-CZ3 3.65Å; P559-I604 HydrophobicContact CB-CG2 4.4Å; P559-I604 HydrophobicContact CG-CG2 4.02Å; P559-I604 WeakPolarHBondContact CG-O 3.32Å; P559-L605 HydrophobicContact CB-CD2 4.38Å; P559-V633 HydrophobicContact CB-CG1 4.03Å; P559-V633 HydrophobicContact CG-CG1 4.25Å; P559-V633 HydrophobicContact CG-CG2 4.3Å
560	E	94.6	Very high	91.2	Very high	11 Å²	11	25.7 Å²	25.7	5%	0.051	16%	0.158	C	C	.	.	H	α-helix	trans	-68.4	-20.4	178.3	65.8	-91.2	-149.1	0	0	114	A558 T565 Y567 V571 V635 R638	A558-E560 VanDerWaalsContact C-N 3.29Å; A558-E560 WeakPolarHBondContact CB-OE2 3.4Å; A558-E560 PolarHBondContact O-N 2.66Å; E560-T565 PolarHBondContact O-N 3.5Å; E560-T565 PolarHBondContact O-OG1 2.96Å; E560-Y567 VanDerWaalsContact CG-CB 3.45Å; E560-V571 HydrophobicContact CG-CG1 4.09Å; E560-V571 WeakPolarHBondContact OE1-CG1 3.33Å; E560-V635 HydrophobicContact CB-CG2 4.27Å; E560-V635 HydrophobicContact CG-CG2 4.13Å; E560-R638 IonicContact OE1-CZ 2.66Å; E560-R638 IonicContact OE1-NH1 2.73Å; E560-R638 PolarHBondContact OE1-NH1 2.99Å; E560-R638 IonicContact OE1-NH2 3.54Å; E560-R638 PolarHBondContact OE1-NH2 2.72Å; E560-R638 IonicContact OE2-CZ 2.66Å; E560-R638 IonicContact OE2-NH1 3.18Å; E560-R638 PolarHBondContact OE2-NH1 2.93Å; E560-R638 IonicContact OE2-NH2 3.99Å; E560-R638 PolarHBondContact OE2-NH2 2.98Å
561	I	91.7	Very high	91.8	Very high	5 Å²	5	25 Å²	25	3%	0.026	15%	0.153	C	C	.	.	H	α-helix	trans	-77.7	-45.2	170.8	-55.8	176.4	0	0	0	109.5	V550 V557 A558 P559 A563 E564 Y567 V571	V550-I561 HydrophobicContact CB-CG2 4.43Å; V550-I561 HydrophobicContact CG1-CG2 4.05Å; V557-I561 HydrophobicContact CG1-CB 3.61Å; V557-I561 HydrophobicContact CG1-CD1 4.06Å; V557-I561 HydrophobicContact CG1-CG1 4.37Å; V557-I561 HydrophobicContact CG1-CG2 3.69Å; A558-I561 HydrophobicContact CB-CD1 4.25Å; A558-I561 HydrophobicContact CB-CG1 4.32Å; A558-I561 WeakPolarHBondContact O-CB 3.24Å; A558-I561 PolarHBondContact O-N 3.43Å; P559-I561 PolarHBondContact O-N 3.42Å; I561-A563 VanDerWaalsContact C-N 3.34Å; I561-E564 PolarHBondContact O-N 2.97Å; I561-Y567 HydrophobicContact CB-CD1 4.3Å; I561-Y567 HydrophobicContact CB-CE1 4.5Å; I561-Y567 HydrophobicContact CG1-CD1 3.68Å; I561-Y567 HydrophobicContact CG1-CD2 4.24Å; I561-Y567 HydrophobicContact CG1-CE1 3.99Å; I561-Y567 HydrophobicContact CG1-CG 3.81Å; I561-Y567 HydrophobicContact CG2-CE1 4.24Å; I561-V571 HydrophobicContact CD1-CB 3.87Å; I561-V571 HydrophobicContact CD1-CG1 3.76Å; I561-V571 HydrophobicContact CD1-CG2 4.3Å; I561-V571 HydrophobicContact CG1-CB 4.48Å; I561-V571 HydrophobicContact CG1-CG1 3.81Å
562	V	89.1	Confident	92.4	Very high	31 Å²	31	25 Å²	25	19%	0.188	15%	0.153	C	C	.	.	H	α-helix	trans	-64.9	-38.2	178.9	-175.9	0	0	0	0	111.5	V557 A558 P559 E564 F601 I604 L605	V557-V562 HydrophobicContact CG1-CG2 3.78Å; A558-V562 PolarHBondContact O-N 2.89Å; P559-V562 PolarHBondContact O-N 3.44Å; V562-E564 VanDerWaalsContact C-N 3.28Å; V562-E564 PolarHBondContact O-N 3.39Å; V562-F601 HydrophobicContact CG1-CB 3.79Å; V562-F601 HydrophobicContact CG1-CD1 3.95Å; V562-F601 HydrophobicContact CG1-CG 3.95Å; V562-F601 HydrophobicContact CG2-CD1 3.83Å; V562-F601 HydrophobicContact CG2-CE1 4.27Å; V562-I604 HydrophobicContact CG2-CG2 4.08Å; V562-L605 HydrophobicContact CB-CD2 4.05Å; V562-L605 HydrophobicContact CB-CG 4.32Å; V562-L605 HydrophobicContact CG1-CD1 3.9Å; V562-L605 HydrophobicContact CG1-CD2 4.1Å; V562-L605 HydrophobicContact CG1-CG 3.91Å
563	A	87.4	Confident	92.9	Very high	46 Å²	46	25 Å²	25	38%	0.38	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-2.1	-179.7	0	0	0	0	0	114.6	P559 I561 T565 L605	P559-A563 WeakPolarHBondContact O-CB 3.39Å; P559-A563 PolarHBondContact O-N 2.56Å; I561-A563 VanDerWaalsContact C-N 3.34Å; A563-T565 HydrophobicContact CB-CG2 3.87Å; A563-T565 PolarHBondContact O-N 2.93Å; A563-L605 HydrophobicContact CB-CD2 3.87Å
564	E	89.4	Confident	93.5	Very high	81 Å²	81	23.8 Å²	23.8	38%	0.379	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.8	19.5	-173.8	-62.3	-169.5	-149.1	0	0	114.7	V550 I561 V562 G566 G702	V550-E564 HydrophobicContact CG2-CG 3.54Å; I561-E564 PolarHBondContact O-N 2.97Å; V562-E564 VanDerWaalsContact C-N 3.28Å; V562-E564 PolarHBondContact O-N 3.39Å; E564-G566 VanDerWaalsContact C-N 3.3Å; E564-G566 PolarHBondContact O-N 3.21Å; E564-G702 WeakPolarHBondContact OE1-CA 3.39Å
565	T	85.6	Confident	94	Very high	97 Å²	97	23 Å²	23	60%	0.595	14%	0.141	S	C	*	.	S	Bend	trans	-74.8	-16.1	-171.6	45.2	0	0	0	0	114.5	E560 A563	E560-T565 PolarHBondContact O-N 3.5Å; E560-T565 PolarHBondContact O-OG1 2.96Å; A563-T565 HydrophobicContact CB-CG2 3.87Å; A563-T565 PolarHBondContact O-N 2.93Å
566	G	88.9	Confident	94.4	Very high	22 Å²	22	21.2 Å²	21.2	23%	0.227	13%	0.13	C	C	.	.			trans	105	120.9	-177	0	0	0	0	0	111.2	L547 E564	L547-G566 CarbonylContact O-C 3.59Å; L547-G566 WeakPolarHBondContact O-CA 3.27Å; E564-G566 VanDerWaalsContact C-N 3.3Å; E564-G566 PolarHBondContact O-N 3.21Å
567	Y	94.4	Very high	94.6	Very high	9 Å²	9	20.6 Å²	20.6	4%	0.035	13%	0.128	C	C	.	.	B	Isolated β-bridge	trans	-124.9	166	-171.6	68.4	-97.1	0	0	0	113.5	R513 L547 A549 E560 I561 V571	R513-Y567 VanDerWaalsContact CD-OH 3.31Å; R513-Y567 WeakPolarHBondContact CD-OH 3.34Å; R513-Y567 HydrophobicContact CG-CE2 4.28Å; R513-Y567 PolarHBondContact NH1-OH 3.35Å; L547-Y567 HydrophobicContact CB-CD1 4.25Å; L547-Y567 HydrophobicContact CB-CD2 3.94Å; L547-Y567 HydrophobicContact CB-CE1 3.92Å; L547-Y567 HydrophobicContact CB-CE2 3.57Å; L547-Y567 HydrophobicContact CB-CG 4.26Å; L547-Y567 HydrophobicContact CD1-CD2 4.28Å; L547-Y567 HydrophobicContact CD1-CE2 3.66Å; L547-Y567 HydrophobicContact CG-CE2 4.25Å; L547-Y567 PolarHBondContact N-O 3.1Å; L547-Y567 WeakPolarHBondContact O-CD1 3.31Å; L547-Y567 WeakPolarHBondContact O-CE1 3.38Å; L547-Y567 PolarHBondContact O-N 3.19Å; A549-Y567 VanDerWaalsContact O-CE1 3.31Å; A549-Y567 WeakPolarHBondContact O-CE1 3.3Å; A549-Y567 PolarHBondContact O-OH 2.78Å; E560-Y567 VanDerWaalsContact CG-CB 3.45Å; I561-Y567 HydrophobicContact CB-CD1 4.3Å; I561-Y567 HydrophobicContact CB-CE1 4.5Å; I561-Y567 HydrophobicContact CG1-CD1 3.68Å; I561-Y567 HydrophobicContact CG1-CD2 4.24Å; I561-Y567 HydrophobicContact CG1-CE1 3.99Å; I561-Y567 HydrophobicContact CG1-CG 3.81Å; I561-Y567 HydrophobicContact CG2-CE1 4.24Å; Y567-V571 HydrophobicContact CD2-CG1 3.73Å; Y567-V571 HydrophobicContact CD2-CG2 4.27Å; Y567-V571 HydrophobicContact CG-CG1 3.97Å
568	G	95.3	Very high	94.8	Very high	24 Å²	24	20.2 Å²	20.2	25%	0.247	13%	0.126	C	C	.	.			trans	-143.1	-150.9	179.2	0	0	0	0	0	112.1	K570 V571	G568-K570 VanDerWaalsContact C-N 3.32Å; G568-K570 PolarHBondContact O-N 3.47Å; G568-V571 WeakPolarHBondContact O-CG2 3.37Å; G568-V571 PolarHBondContact O-N 2.6Å
569	L	98	Very high	94.8	Very high	41 Å²	41	20.3 Å²	20.3	22%	0.215	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-37.7	-171.9	-59.9	173.2	0	0	0	114.3	H506 I510 V511 V543 V571 D572	H506-L569 HydrophobicContact CB-CD1 4.08Å; H506-L569 PolarHBondContact CE1-O 2.83Å; H506-L569 PolarHBondContact NE2-O 3.21Å; H506-L569 VanDerWaalsContact NE2-O 3.15Å; I510-L569 WeakPolarHBondContact O-CD2 3.49Å; V511-L569 HydrophobicContact CB-CD2 4.16Å; V543-L569 HydrophobicContact CB-CD2 4.28Å; V543-L569 HydrophobicContact CG2-CD2 3.73Å; V543-L569 HydrophobicContact CG2-CG 4.39Å; L569-V571 PolarHBondContact O-N 3.33Å; L569-D572 PolarHBondContact O-N 3.09Å
570	K	98.4	Very high	94.9	Very high	40 Å²	40	20.2 Å²	20.2	17%	0.174	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-3.2	-173.3	-69.4	-167.2	-172.7	-177	0	115.7	G568 D572 I573 W574 V635 D636 R638	G568-K570 VanDerWaalsContact C-N 3.32Å; G568-K570 PolarHBondContact O-N 3.47Å; K570-D572 VanDerWaalsContact C-N 3.28Å; K570-I573 PolarHBondContact O-N 2.79Å; K570-W574 PolarHBondContact O-N 3.09Å; K570-V635 HydrophobicContact CB-CG1 4.15Å; K570-V635 HydrophobicContact CD-CG1 4.01Å; K570-V635 WeakPolarHBondContact CD-O 3.29Å; K570-V635 WeakPolarHBondContact CE-O 2.93Å; K570-V635 PolarHBondContact NZ-O 3.27Å; K570-D636 PolarHBondContact NZ-O 3.38Å; K570-R638 HydrophobicContact CD-CB 4.29Å; K570-R638 WeakPolarHBondContact CE-O 3.38Å; K570-R638 PolarHBondContact NZ-O 3.14Å; K570-R638 PolarHBondContact O-NH1 3.25Å
571	V	98.3	Very high	95	Very high	4 Å²	4	19.9 Å²	19.9	2%	0.024	12%	0.123	C	C	.	.	H	α-helix	trans	-65.5	-33.5	169.8	-56.6	0	0	0	0	111.9	V511 R513 A558 E560 I561 Y567 G568 L569 I573 W574 A575	V511-V571 HydrophobicContact CG2-CG2 3.47Å; V511-V571 VanDerWaalsContact CG2-CG2 3.47Å; R513-V571 HydrophobicContact CG-CG2 4.49Å; A558-V571 HydrophobicContact CB-CB 3.94Å; A558-V571 HydrophobicContact CB-CG1 3.91Å; E560-V571 HydrophobicContact CG-CG1 4.09Å; E560-V571 WeakPolarHBondContact OE1-CG1 3.33Å; I561-V571 HydrophobicContact CD1-CB 3.87Å; I561-V571 HydrophobicContact CD1-CG1 3.76Å; I561-V571 HydrophobicContact CD1-CG2 4.3Å; I561-V571 HydrophobicContact CG1-CB 4.48Å; I561-V571 HydrophobicContact CG1-CG1 3.81Å; Y567-V571 HydrophobicContact CD2-CG1 3.73Å; Y567-V571 HydrophobicContact CD2-CG2 4.27Å; Y567-V571 HydrophobicContact CG-CG1 3.97Å; G568-V571 WeakPolarHBondContact O-CG2 3.37Å; G568-V571 PolarHBondContact O-N 2.6Å; L569-V571 PolarHBondContact O-N 3.33Å; V571-I573 PolarHBondContact O-N 2.83Å; V571-W574 WeakPolarHBondContact O-CB 3.46Å; V571-W574 PolarHBondContact O-N 3.09Å; V571-A575 PolarHBondContact O-N 3.34Å; V571-A575 VanDerWaalsContact O-N 3.14Å
572	D	98.6	Very high	95.1	Very high	2 Å²	2	19.7 Å²	19.7	1%	0.011	12%	0.122	C	C	.	.	H	α-helix	trans	-66.4	-29.2	177.3	-66.5	-27.6	0	0	0	111.5	I502 H506 V511 H512 R513 I515 L569 K570 A576	I502-D572 HydrophobicContact CD1-CB 4.46Å; I502-D572 HydrophobicContact CG2-CB 4Å; H506-D572 IonicContact CD2-OD2 2.69Å; H506-D572 IonicContact CE1-OD2 2.77Å; H506-D572 IonicContact NE2-OD2 2.94Å; H506-D572 PolarHBondContact NE2-OD2 2.87Å; V511-D572 WeakPolarHBondContact CA-OD2 3.5Å; V511-D572 WeakPolarHBondContact CG2-OD2 3.16Å; H512-D572 WeakPolarHBondContact CB-OD1 3.43Å; H512-D572 PolarHBondContact N-OD1 3.35Å; H512-D572 VanDerWaalsContact N-OD1 3.14Å; H512-D572 PolarHBondContact N-OD2 3.47Å; R513-D572 PolarHBondContact N-OD1 3.29Å; I515-D572 HydrophobicContact CD1-CB 3.6Å; L569-D572 PolarHBondContact O-N 3.09Å; K570-D572 VanDerWaalsContact C-N 3.28Å; D572-A576 WeakPolarHBondContact O-CB 3.26Å; D572-A576 PolarHBondContact O-N 3Å
573	I	98.8	Very high	95.3	Very high	1 Å²	1	18.4 Å²	18.4	1%	0.005	12%	0.115	C	C	.	.	H	α-helix	trans	-72.9	-38.7	176	-53.5	-62.9	0	0	0	111.3	I502 K570 V571 A576 G577 M630 R638 Y639 A641 V644	I502-I573 HydrophobicContact CG2-CD1 3.84Å; K570-I573 PolarHBondContact O-N 2.79Å; V571-I573 PolarHBondContact O-N 2.83Å; I573-A576 PolarHBondContact O-N 3.39Å; I573-G577 PolarHBondContact O-N 3.5Å; I573-M630 HydrophobicContact CG2-CB 4.11Å; I573-M630 HydrophobicContact CG2-CE 4.16Å; I573-M630 HydrophobicContact CG2-CG 4.02Å; I573-R638 HydrophobicContact CG2-CG 4.44Å; I573-Y639 WeakPolarHBondContact CG2-O 2.93Å; I573-A641 HydrophobicContact CD1-CB 3.85Å; I573-V644 HydrophobicContact CG2-CG2 4.22Å
574	W	98.6	Very high	95.5	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-60.8	-48.8	173.7	176.5	-85.1	0	0	0	110.8	V557 A558 P559 K570 V571 A576 G577 V578 F590 I604 L631 V633	V557-W574 PolarHBondContact O-NE1 3.21Å; A558-W574 VanDerWaalsContact CA-CD1 3.5Å; A558-W574 HydrophobicContact CB-CB 3.84Å; A558-W574 HydrophobicContact CB-CD2 4.39Å; A558-W574 HydrophobicContact CB-CG 3.78Å; P559-W574 HydrophobicContact CG-CD2 4.41Å; P559-W574 HydrophobicContact CG-CE3 4.14Å; P559-W574 HydrophobicContact CG-CH2 3.43Å; P559-W574 VanDerWaalsContact CG-CH2 3.43Å; P559-W574 HydrophobicContact CG-CZ2 3.73Å; P559-W574 HydrophobicContact CG-CZ3 3.65Å; K570-W574 PolarHBondContact O-N 3.09Å; V571-W574 WeakPolarHBondContact O-CB 3.46Å; V571-W574 PolarHBondContact O-N 3.09Å; W574-A576 VanDerWaalsContact C-N 3.34Å; W574-A576 PolarHBondContact O-N 2.89Å; W574-G577 WeakPolarHBondContact O-CA 3.3Å; W574-G577 PolarHBondContact O-N 3.34Å; W574-V578 PolarHBondContact O-N 3.37Å; W574-F590 AromaticContact CE2-CE2 3.97Å; W574-F590 AromaticContact CH2-CE2 3.77Å; W574-F590 HydrophobicContact CH2-CE2 3.77Å; W574-F590 AromaticContact CH2-CZ 3.68Å; W574-F590 HydrophobicContact CH2-CZ 3.68Å; W574-F590 AromaticContact CZ2-CD2 3.98Å; W574-F590 HydrophobicContact CZ2-CD2 3.98Å; W574-F590 AromaticContact CZ2-CE2 3.23Å; W574-F590 HydrophobicContact CZ2-CE2 3.23Å; W574-F590 AromaticContact CZ2-CZ 3.66Å; W574-F590 HydrophobicContact CZ2-CZ 3.66Å; W574-I604 HydrophobicContact CZ2-CG2 4.05Å; W574-L631 HydrophobicContact CD2-CD2 3.74Å; W574-L631 HydrophobicContact CE3-CB 4.38Å; W574-L631 HydrophobicContact CE3-CD2 3.88Å; W574-L631 HydrophobicContact CG-CD2 4.14Å; W574-L631 HydrophobicContact CZ2-CD2 4.49Å; W574-L631 HydrophobicContact CZ3-CB 4.22Å; W574-L631 HydrophobicContact CZ3-CD2 4.32Å; W574-L631 VanDerWaalsContact CZ3-O 3.25Å; W574-L631 WeakPolarHBondContact CZ3-O 3.48Å; W574-L631 WeakPolarHBondContact O-CD2 3.45Å; W574-V633 HydrophobicContact CZ3-CG2 4.5Å
575	A	98.3	Very high	95.6	Very high	5 Å²	5	12.5 Å²	12.5	4%	0.041	8%	0.08	C	C	.	.	H	α-helix	trans	-58.4	-43.7	175.9	0	0	0	0	0	112.2	I515 V571 G577 V578 I579	I515-A575 HydrophobicContact CB-CB 3.95Å; I515-A575 HydrophobicContact CG2-CB 4.5Å; V571-A575 PolarHBondContact O-N 3.34Å; V571-A575 VanDerWaalsContact O-N 3.14Å; A575-G577 VanDerWaalsContact C-N 3.31Å; A575-G577 PolarHBondContact O-N 2.7Å; A575-V578 PolarHBondContact O-N 3.04Å; A575-I579 WeakPolarHBondContact O-CD1 3.3Å; A575-I579 VanDerWaalsContact O-CG1 3.25Å; A575-I579 WeakPolarHBondContact O-CG1 3.5Å; A575-I579 PolarHBondContact O-N 3.09Å
576	A	98.4	Very high	95.9	Very high	1 Å²	1	7.9 Å²	7.9	1%	0.008	5%	0.051	C	C	.	.	H	α-helix	trans	-63.3	-33.5	173.2	0	0	0	0	0	113.1	L498 I502 D572 I573 W574 I579 T580 M630	L498-A576 HydrophobicContact CD2-CB 3.82Å; L498-A576 HydrophobicContact CG-CB 4.27Å; I502-A576 HydrophobicContact CD1-CB 3.83Å; D572-A576 WeakPolarHBondContact O-CB 3.26Å; D572-A576 PolarHBondContact O-N 3Å; I573-A576 PolarHBondContact O-N 3.39Å; W574-A576 VanDerWaalsContact C-N 3.34Å; W574-A576 PolarHBondContact O-N 2.89Å; A576-I579 PolarHBondContact O-N 3.27Å; A576-T580 WeakPolarHBondContact O-CB 3.42Å; A576-T580 PolarHBondContact O-N 2.94Å; A576-T580 PolarHBondContact O-OG1 3.46Å; A576-M630 HydrophobicContact CB-CE 3.57Å
577	G	98.3	Very high	95.9	Very high	0 Å²	0	7.5 Å²	7.5	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-67.2	-44.2	174.6	0	0	0	0	0	112.5	I573 W574 A575 I579 T580 Y581	I573-G577 PolarHBondContact O-N 3.5Å; W574-G577 WeakPolarHBondContact O-CA 3.3Å; W574-G577 PolarHBondContact O-N 3.34Å; A575-G577 VanDerWaalsContact C-N 3.31Å; A575-G577 PolarHBondContact O-N 2.7Å; G577-I579 VanDerWaalsContact C-N 3.32Å; G577-I579 PolarHBondContact O-N 3.27Å; G577-T580 PolarHBondContact O-N 3.49Å; G577-Y581 PolarHBondContact O-N 2.91Å
578	V	97.7	Very high	95.8	Very high	0 Å²	0	7.8 Å²	7.8	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-59	-45.5	173	171.6	0	0	0	0	110.3	Y556 W574 A575 Y581 I582 P589 F590 L631	Y556-V578 HydrophobicContact CD1-CB 4.18Å; Y556-V578 HydrophobicContact CD1-CG1 3.51Å; Y556-V578 HydrophobicContact CE1-CG1 3.93Å; Y556-V578 HydrophobicContact CG-CG1 4.47Å; W574-V578 PolarHBondContact O-N 3.37Å; A575-V578 PolarHBondContact O-N 3.04Å; V578-Y581 PolarHBondContact O-N 3.47Å; V578-I582 HydrophobicContact CG1-CD1 3.93Å; V578-I582 WeakPolarHBondContact O-CD1 3.35Å; V578-I582 VanDerWaalsContact O-CG1 3.3Å; V578-I582 WeakPolarHBondContact O-CG1 3.47Å; V578-I582 PolarHBondContact O-N 3.06Å; V578-I582 VanDerWaalsContact O-N 3.09Å; V578-P589 HydrophobicContact CG1-CG 4.4Å; V578-P589 HydrophobicContact CG2-CG 4.31Å; V578-F590 HydrophobicContact CG2-CD2 4.49Å; V578-F590 HydrophobicContact CG2-CE2 4.33Å; V578-L631 HydrophobicContact CG2-CD2 3.87Å
579	I	96.4	Very high	95.8	Very high	3 Å²	3	7.9 Å²	7.9	2%	0.015	4%	0.042	C	C	.	.	H	α-helix	trans	-62.7	-44.4	176.8	-67.5	164.8	0	0	0	110.8	L476 L498 I515 P517 L520 Y556 A575 A576 G577 Y581 I582 L583	L476-I579 HydrophobicContact CD2-CG2 3.65Å; L498-I579 HydrophobicContact CD2-CD1 4.39Å; I515-I579 HydrophobicContact CG2-CD1 3.74Å; P517-I579 HydrophobicContact CG-CG1 4.39Å; L520-I579 HydrophobicContact CD1-CD1 3.87Å; L520-I579 HydrophobicContact CD1-CG2 4.33Å; Y556-I579 HydrophobicContact CD1-CG1 4.09Å; Y556-I579 HydrophobicContact CE1-CG1 4.11Å; A575-I579 WeakPolarHBondContact O-CD1 3.3Å; A575-I579 VanDerWaalsContact O-CG1 3.25Å; A575-I579 WeakPolarHBondContact O-CG1 3.5Å; A575-I579 PolarHBondContact O-N 3.09Å; A576-I579 PolarHBondContact O-N 3.27Å; G577-I579 VanDerWaalsContact C-N 3.32Å; G577-I579 PolarHBondContact O-N 3.27Å; I579-Y581 VanDerWaalsContact C-N 3.32Å; I579-Y581 PolarHBondContact O-N 2.94Å; I579-I582 CarbonylContact O-C 3.53Å; I579-I582 WeakPolarHBondContact O-CA 3.24Å; I579-I582 WeakPolarHBondContact O-CB 3.33Å; I579-I582 PolarHBondContact O-N 3.08Å; I579-I582 VanDerWaalsContact O-N 3.09Å; I579-L583 HydrophobicContact CG2-CD1 4.35Å; I579-L583 HydrophobicContact CG2-CG 4.21Å; I579-L583 WeakPolarHBondContact O-CG 3.45Å; I579-L583 PolarHBondContact O-N 3.39Å
580	T	97.1	Very high	95.5	Very high	1 Å²	1	6.2 Å²	6.2	1%	0.006	3%	0.033	C	C	.	.	H	α-helix	trans	-60.6	-41.1	178.1	-53.9	0	0	0	0	111.8	L495 A576 G577 I582 L583 V584 I627 W649	L495-T580 WeakPolarHBondContact CD1-OG1 3.42Å; L495-T580 HydrophobicContact CD2-CG2 3.91Å; A576-T580 WeakPolarHBondContact O-CB 3.42Å; A576-T580 PolarHBondContact O-N 2.94Å; A576-T580 PolarHBondContact O-OG1 3.46Å; G577-T580 PolarHBondContact O-N 3.49Å; T580-I582 VanDerWaalsContact C-N 3.35Å; T580-I582 PolarHBondContact O-N 2.96Å; T580-L583 WeakPolarHBondContact O-CB 3.46Å; T580-L583 PolarHBondContact O-N 3.01Å; T580-V584 WeakPolarHBondContact O-CG2 3.3Å; T580-V584 PolarHBondContact O-N 3.33Å; T580-V584 VanDerWaalsContact O-N 3.14Å; T580-I627 HydrophobicContact CG2-CD1 3.97Å; T580-I627 HydrophobicContact CG2-CG1 3.69Å; T580-W649 HydrophobicContact CG2-CH2 4.19Å; T580-W649 HydrophobicContact CG2-CZ3 4.04Å
581	Y	96.7	Very high	94.7	Very high	4 Å²	4	9.6 Å²	9.6	2%	0.016	5%	0.045	C	C	.	.	H	α-helix	trans	-59.5	-45.1	173.2	-171.2	-77.7	0	0	0	111.5	G577 V578 I579 V584 C585 F587 P589 L609 E610 F611 P612 W616 I627	G577-Y581 PolarHBondContact O-N 2.91Å; V578-Y581 PolarHBondContact O-N 3.47Å; I579-Y581 VanDerWaalsContact C-N 3.32Å; I579-Y581 PolarHBondContact O-N 2.94Å; Y581-V584 PolarHBondContact O-N 2.91Å; Y581-C585 WeakPolarHBondContact CD1-SG 3.43Å; Y581-C585 WeakPolarHBondContact CE1-SG 3.48Å; Y581-C585 PolarHBondContact O-N 3.1Å; Y581-C585 PolarHBondContact O-SG 3.37Å; Y581-F587 VanDerWaalsContact CD1-O 3.29Å; Y581-F587 WeakPolarHBondContact CD1-O 3.48Å; Y581-F587 AromaticContact CE1-CD2 3.96Å; Y581-F587 HydrophobicContact CE1-CD2 3.96Å; Y581-F587 AromaticContact CE1-CE2 3.74Å; Y581-F587 HydrophobicContact CE1-CE2 3.74Å; Y581-P589 HydrophobicContact CD1-CB 3.73Å; Y581-P589 HydrophobicContact CD1-CG 4.04Å; Y581-P589 HydrophobicContact CD2-CB 3.86Å; Y581-P589 HydrophobicContact CD2-CG 4.44Å; Y581-P589 HydrophobicContact CE1-CB 3.78Å; Y581-P589 HydrophobicContact CE2-CB 3.9Å; Y581-P589 HydrophobicContact CG-CB 3.78Å; Y581-P589 HydrophobicContact CG-CG 3.99Å; Y581-L609 HydrophobicContact CD2-CD1 3.83Å; Y581-L609 HydrophobicContact CE2-CD1 3.72Å; Y581-E610 VanDerWaalsContact CE2-O 3.3Å; Y581-E610 WeakPolarHBondContact CE2-O 3.38Å; Y581-E610 PolarHBondContact OH-O 3.5Å; Y581-F611 HydrophobicContact CD2-CD1 4.4Å; Y581-F611 HydrophobicContact CD2-CE1 4.07Å; Y581-F611 AromaticContact CE2-CD1 3.84Å; Y581-F611 HydrophobicContact CE2-CD1 3.84Å; Y581-F611 AromaticContact CE2-CE1 3.91Å; Y581-F611 HydrophobicContact CE2-CE1 3.91Å; Y581-P612 WeakPolarHBondContact OH-CD 3.41Å; Y581-W616 AromaticContact CD1-CZ2 3.92Å; Y581-W616 HydrophobicContact CD1-CZ2 3.92Å; Y581-W616 AromaticContact CD2-CH2 3.77Å; Y581-W616 HydrophobicContact CD2-CH2 3.77Å; Y581-W616 AromaticContact CD2-CZ2 3.39Å; Y581-W616 HydrophobicContact CD2-CZ2 3.39Å; Y581-W616 AromaticContact CE1-CZ2 3.86Å; Y581-W616 HydrophobicContact CE1-CZ2 3.86Å; Y581-W616 AromaticContact CE2-CE2 3.81Å; Y581-W616 HydrophobicContact CE2-CH2 4.08Å; Y581-W616 AromaticContact CE2-CZ2 3.33Å; Y581-W616 HydrophobicContact CE2-CZ2 3.33Å; Y581-W616 HydrophobicContact CG-CH2 4.13Å; Y581-W616 AromaticContact CG-CZ2 3.7Å; Y581-W616 HydrophobicContact CG-CZ2 3.7Å; Y581-W616 AromaticContact CZ-CE2 3.84Å; Y581-W616 AromaticContact CZ-CZ2 3.57Å; Y581-W616 AromaticContact CZ-NE1 3.64Å; Y581-W616 PolarHBondContact OH-NE1 3.35Å; Y581-I627 HydrophobicContact CD2-CG2 4.14Å
582	I	94.1	Very high	93.4	Very high	1 Å²	1	10.3 Å²	10.3	1%	0.005	5%	0.053	C	C	.	.	H	α-helix	trans	-65	-40.2	176.2	-61.3	157.2	0	0	0	111.9	F477 Y556 V578 I579 T580 V584 G586 F587 P588 F672	F477-I582 HydrophobicContact CE1-CG2 3.8Å; F477-I582 HydrophobicContact CZ-CG2 3.75Å; Y556-I582 HydrophobicContact CE1-CD1 3.71Å; V578-I582 HydrophobicContact CG1-CD1 3.93Å; V578-I582 WeakPolarHBondContact O-CD1 3.35Å; V578-I582 VanDerWaalsContact O-CG1 3.3Å; V578-I582 WeakPolarHBondContact O-CG1 3.47Å; V578-I582 PolarHBondContact O-N 3.06Å; V578-I582 VanDerWaalsContact O-N 3.09Å; I579-I582 CarbonylContact O-C 3.53Å; I579-I582 WeakPolarHBondContact O-CA 3.24Å; I579-I582 WeakPolarHBondContact O-CB 3.33Å; I579-I582 PolarHBondContact O-N 3.08Å; I579-I582 VanDerWaalsContact O-N 3.09Å; T580-I582 VanDerWaalsContact C-N 3.35Å; T580-I582 PolarHBondContact O-N 2.96Å; I582-V584 VanDerWaalsContact C-N 3.25Å; I582-V584 PolarHBondContact O-N 3.02Å; I582-G586 WeakPolarHBondContact O-CA 3.48Å; I582-G586 PolarHBondContact O-N 3.13Å; I582-F587 WeakPolarHBondContact CG1-O 3.38Å; I582-P588 HydrophobicContact CD1-CB 4.29Å; I582-P588 HydrophobicContact CG1-CB 4.29Å; I582-F672 HydrophobicContact CD1-CZ 4.01Å; I582-F672 HydrophobicContact CG1-CZ 4.31Å; I582-F672 HydrophobicContact CG2-CE2 3.81Å; I582-F672 HydrophobicContact CG2-CZ 3.92Å
583	L	92.1	Very high	91.9	Very high	4 Å²	4	15.4 Å²	15.4	2%	0.021	9%	0.089	C	C	.	.	H	α-helix	trans	-58.3	-38.2	177.2	-73.6	-177.4	0	0	0	111.9	L476 I480 Y486 A491 M494 I579 T580	L476-L583 HydrophobicContact CD1-CD2 4.01Å; L476-L583 HydrophobicContact CD2-CD2 3.9Å; L476-L583 HydrophobicContact CG-CD2 3.96Å; I480-L583 HydrophobicContact CD1-CD2 3.39Å; Y486-L583 VanDerWaalsContact CE1-O 3.29Å; Y486-L583 WeakPolarHBondContact CE1-O 3.4Å; Y486-L583 PolarHBondContact OH-O 2.78Å; A491-L583 HydrophobicContact CB-CB 4.09Å; M494-L583 HydrophobicContact CB-CD1 3.95Å; M494-L583 HydrophobicContact SD-CD1 4.48Å; M494-L583 HydrophobicContact SD-CD2 3.95Å; I579-L583 HydrophobicContact CG2-CD1 4.35Å; I579-L583 HydrophobicContact CG2-CG 4.21Å; I579-L583 WeakPolarHBondContact O-CG 3.45Å; I579-L583 PolarHBondContact O-N 3.39Å; T580-L583 WeakPolarHBondContact O-CB 3.46Å; T580-L583 PolarHBondContact O-N 3.01Å
584	V	92.7	Very high	90.3	Very high	4 Å²	4	18.5 Å²	18.5	2%	0.024	12%	0.121	C	C	.	.	H	α-helix	trans	-82.6	-50.8	-177.4	174.5	0	0	0	0	111.9	A491 T580 Y581 I582 W616 V619 W649 V664	A491-V584 HydrophobicContact CB-CG2 4.48Å; T580-V584 WeakPolarHBondContact O-CG2 3.3Å; T580-V584 PolarHBondContact O-N 3.33Å; T580-V584 VanDerWaalsContact O-N 3.14Å; Y581-V584 PolarHBondContact O-N 2.91Å; I582-V584 VanDerWaalsContact C-N 3.25Å; I582-V584 PolarHBondContact O-N 3.02Å; V584-W616 HydrophobicContact CB-CH2 3.87Å; V584-W616 HydrophobicContact CB-CZ3 4.19Å; V584-W616 HydrophobicContact CG1-CE3 4.19Å; V584-W616 HydrophobicContact CG1-CH2 3.77Å; V584-W616 HydrophobicContact CG1-CZ2 4.46Å; V584-W616 HydrophobicContact CG1-CZ3 3.64Å; V584-V619 HydrophobicContact CG1-CB 4.29Å; V584-V619 HydrophobicContact CG1-CG1 3.68Å; V584-V619 HydrophobicContact CG1-CG2 3.55Å; V584-W649 HydrophobicContact CG2-CH2 4.35Å; V584-W649 HydrophobicContact CG2-CZ2 4.25Å; V584-V664 WeakPolarHBondContact O-CG2 3.34Å
585	C	91.3	Very high	88.5	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-101.1	-16.5	-170.4	81.9	0	0	0	0	114.6	Y581 F587 W616 K667	Y581-C585 WeakPolarHBondContact CD1-SG 3.43Å; Y581-C585 WeakPolarHBondContact CE1-SG 3.48Å; Y581-C585 PolarHBondContact O-N 3.1Å; Y581-C585 PolarHBondContact O-SG 3.37Å; C585-F587 HydrophobicContact CB-CD1 4.39Å; C585-F587 HydrophobicContact CB-CE1 4.05Å; C585-F587 HydrophobicContact CB-CZ 4.23Å; C585-F587 WeakPolarHBondContact O-CD1 3.43Å; C585-F587 VanDerWaalsContact SG-CD2 3.59Å; C585-F587 PolarHBondContact SG-O 3.28Å; C585-W616 HydrophobicContact CB-CH2 4.46Å; C585-W616 HydrophobicContact CB-CZ2 3.51Å; C585-K667 WeakPolarHBondContact O-CD 3.45Å; C585-K667 WeakPolarHBondContact O-CE 3.21Å; C585-K667 PolarHBondContact O-NZ 2.86Å
586	G	90.7	Very high	87.5	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	18%	0.179	C	C	.	.	S	Bend	trans	90.1	12.7	177.7	0	0	0	0	0	116.3	I582 K667 I668	I582-G586 WeakPolarHBondContact O-CA 3.48Å; I582-G586 PolarHBondContact O-N 3.13Å; G586-K667 CarbonylContact O-C 3.58Å; G586-I668 PolarHBondContact O-N 2.89Å
587	F	90.8	Very high	86.5	Confident	13 Å²	13	34.9 Å²	34.9	6%	0.057	20%	0.199	C	C	.	.	S	Bend	trans	-158.2	160.6	-177.1	61.2	-106.7	0	0	0	112.9	Y581 I582 C585 P612 Y615 K667	Y581-F587 VanDerWaalsContact CD1-O 3.29Å; Y581-F587 WeakPolarHBondContact CD1-O 3.48Å; Y581-F587 AromaticContact CE1-CD2 3.96Å; Y581-F587 HydrophobicContact CE1-CD2 3.96Å; Y581-F587 AromaticContact CE1-CE2 3.74Å; Y581-F587 HydrophobicContact CE1-CE2 3.74Å; I582-F587 WeakPolarHBondContact CG1-O 3.38Å; C585-F587 HydrophobicContact CB-CD1 4.39Å; C585-F587 HydrophobicContact CB-CE1 4.05Å; C585-F587 HydrophobicContact CB-CZ 4.23Å; C585-F587 WeakPolarHBondContact O-CD1 3.43Å; C585-F587 VanDerWaalsContact SG-CD2 3.59Å; C585-F587 PolarHBondContact SG-O 3.28Å; F587-P612 HydrophobicContact CZ-CG 4.14Å; F587-Y615 AromaticContact CE1-CD2 3.71Å; F587-Y615 HydrophobicContact CE1-CD2 3.71Å; F587-Y615 HydrophobicContact CE1-CE2 4.15Å; F587-Y615 HydrophobicContact CE1-CG 4.11Å; F587-Y615 AromaticContact CZ-CD2 3.87Å; F587-Y615 HydrophobicContact CZ-CD2 3.87Å; F587-Y615 HydrophobicContact CZ-CE2 4.45Å; F587-K667 HydrophobicContact CD1-CD 4.25Å
588	P	92.5	Very high	85.7	Confident	16 Å²	16	41.5 Å²	41.5	10%	0.104	23%	0.23	C	C	.	.			trans	-75.3	146.5	-177.6	29.4	-35.4	0	0	0	113.1	T555 I582 R591	T555-P588 HydrophobicContact CG2-CB 3.63Å; T555-P588 HydrophobicContact CG2-CG 4.17Å; I582-P588 HydrophobicContact CD1-CB 4.29Å; I582-P588 HydrophobicContact CG1-CB 4.29Å; P588-R591 HydrophobicContact CG-CG 4.35Å; P588-R591 PolarHBondContact O-NE 2.96Å
589	P	94.2	Very high	85.1	Confident	25 Å²	25	42.5 Å²	42.5	16%	0.162	24%	0.238	C	C	.	.	S	Bend	trans	-68.1	-48.1	-179.7	24.8	-30	0	0	0	112.3	V578 Y581 L609 L631	V578-P589 HydrophobicContact CG1-CG 4.4Å; V578-P589 HydrophobicContact CG2-CG 4.31Å; Y581-P589 HydrophobicContact CD1-CB 3.73Å; Y581-P589 HydrophobicContact CD1-CG 4.04Å; Y581-P589 HydrophobicContact CD2-CB 3.86Å; Y581-P589 HydrophobicContact CD2-CG 4.44Å; Y581-P589 HydrophobicContact CE1-CB 3.78Å; Y581-P589 HydrophobicContact CE2-CB 3.9Å; Y581-P589 HydrophobicContact CG-CB 3.78Å; Y581-P589 HydrophobicContact CG-CG 3.99Å; P589-L609 HydrophobicContact CB-CD1 3.95Å; P589-L631 HydrophobicContact CG-CD1 4.26Å
590	F	91.8	Very high	84.7	Confident	6 Å²	6	43.2 Å²	43.2	3%	0.026	24%	0.242	C	C	.	.			trans	-92.8	137.3	179.3	-47.5	-66.5	0	0	0	110.5	W574 V578 L600 E603 I604 L631	W574-F590 AromaticContact CE2-CE2 3.97Å; W574-F590 AromaticContact CH2-CE2 3.77Å; W574-F590 HydrophobicContact CH2-CE2 3.77Å; W574-F590 AromaticContact CH2-CZ 3.68Å; W574-F590 HydrophobicContact CH2-CZ 3.68Å; W574-F590 AromaticContact CZ2-CD2 3.98Å; W574-F590 HydrophobicContact CZ2-CD2 3.98Å; W574-F590 AromaticContact CZ2-CE2 3.23Å; W574-F590 HydrophobicContact CZ2-CE2 3.23Å; W574-F590 AromaticContact CZ2-CZ 3.66Å; W574-F590 HydrophobicContact CZ2-CZ 3.66Å; V578-F590 HydrophobicContact CG2-CD2 4.49Å; V578-F590 HydrophobicContact CG2-CE2 4.33Å; F590-L600 HydrophobicContact CB-CD1 3.99Å; F590-E603 HydrophobicContact CB-CB 4.41Å; F590-I604 HydrophobicContact CB-CG1 3.88Å; F590-I604 HydrophobicContact CD2-CG1 4.02Å; F590-I604 HydrophobicContact CG-CG1 3.98Å; F590-L631 HydrophobicContact CE2-CD1 4.35Å; F590-L631 HydrophobicContact CE2-CD2 4.45Å; F590-L631 HydrophobicContact CZ-CD1 4.4Å
591	R	81.9	Confident	84.3	Confident	112 Å²	112	45 Å²	45	42%	0.423	25%	0.25	S	C	.	.			trans	-149.8	131	-177.8	-60.2	-178.1	-176.6	-167.3	2.3	110.8	P588 H671	P588-R591 HydrophobicContact CG-CG 4.35Å; P588-R591 PolarHBondContact O-NE 2.96Å; R591-H671 PolarHBondContact NH1-CE1 2.89Å; R591-H671 PolarHBondContact NH2-CE1 2.97Å; R591-H671 PolarHBondContact NH2-NE2 2.97Å
592	G	70.7	Confident	83.9	Confident	19 Å²	19	50.1 Å²	50.1	20%	0.196	27%	0.274	C	S	.	.			trans	-72.5	162.8	164	0	0	0	0	0	111.8	G594	G592-G594 VanDerWaalsContact C-N 3.26Å; G592-G594 PolarHBondContact O-N 2.87Å
593	S	67.4	Low	83.7	Confident	109 Å²	109	53 Å²	53	76%	0.762	29%	0.287	S	S	*	.	S	Bend	trans	-77.9	70.5	175.2	54.3	0	0	0	0	111.8
594	G	65.3	Low	83.7	Confident	66 Å²	66	52.8 Å²	52.8	68%	0.68	29%	0.286	S	S	*	.	S	Bend	trans	111.5	-139.2	-177.3	0	0	0	0	0	112.1	G592 D596	G592-G594 VanDerWaalsContact C-N 3.26Å; G592-G594 PolarHBondContact O-N 2.87Å; G594-D596 VanDerWaalsContact C-N 3.25Å
595	E	61.3	Low	83.7	Confident	180 Å²	180	56.2 Å²	56.2	84%	0.841	30%	0.304	S	S	*	.	S	Bend	trans	-86.9	8.2	176.4	-58.6	-171.7	134.6	0	0	113.1	Q597	E595-Q597 PolarHBondContact O-N 3.39Å
596	D	76	Confident	83.7	Confident	75 Å²	75	61.6 Å²	61.6	40%	0.401	33%	0.327	S	S	.	.			trans	-70.3	113.4	-179.1	-168.1	-40.5	0	0	0	111	G594 E598 A599 L600	G594-D596 VanDerWaalsContact C-N 3.25Å; D596-E598 WeakPolarHBondContact OD1-CB 3.47Å; D596-E598 PolarHBondContact OD1-N 2.94Å; D596-E598 VanDerWaalsContact OD1-N 3.16Å; D596-A599 HydrophobicContact CB-CB 3.92Å; D596-A599 WeakPolarHBondContact OD1-CB 3.32Å; D596-A599 PolarHBondContact OD1-N 3.11Å; D596-L600 PolarHBondContact O-N 3.43Å
597	Q	78	Confident	83.6	Confident	95 Å²	95	62.3 Å²	62.3	44%	0.444	34%	0.335	S	S	.	.	H	α-helix	trans	-81	-35.9	-178.3	-65.9	-167.6	-6	0	0	111.8	E595 A599 L600 F601	E595-Q597 PolarHBondContact O-N 3.39Å; Q597-A599 VanDerWaalsContact C-N 3.33Å; Q597-A599 PolarHBondContact O-N 2.9Å; Q597-L600 WeakPolarHBondContact O-CB 3.3Å; Q597-L600 PolarHBondContact O-N 3.49Å; Q597-F601 HydrophobicContact CB-CE2 4.14Å; Q597-F601 WeakPolarHBondContact O-CD2 3.13Å; Q597-F601 VanDerWaalsContact O-CG 3.31Å; Q597-F601 WeakPolarHBondContact O-CG 3.41Å; Q597-F601 PolarHBondContact O-N 3.23Å
598	E	81	Confident	83.7	Confident	139 Å²	139	67.3 Å²	67.3	65%	0.65	36%	0.358	S	S	*	.	H	α-helix	trans	-59	-43.6	173.5	-74.5	73.5	-173	0	0	111.2	D596 L600 F601 E602	D596-E598 WeakPolarHBondContact OD1-CB 3.47Å; D596-E598 PolarHBondContact OD1-N 2.94Å; D596-E598 VanDerWaalsContact OD1-N 3.16Å; E598-L600 PolarHBondContact O-N 3.09Å; E598-F601 PolarHBondContact O-N 2.93Å; E598-E602 PolarHBondContact O-N 3.09Å
599	A	84.6	Confident	83.8	Confident	20 Å²	20	68.2 Å²	68.2	17%	0.165	36%	0.362	C	S	.	.	H	α-helix	trans	-63.4	-38.4	174	0	0	0	0	0	112.8	D596 Q597 E602 E603	D596-A599 HydrophobicContact CB-CB 3.92Å; D596-A599 WeakPolarHBondContact OD1-CB 3.32Å; D596-A599 PolarHBondContact OD1-N 3.11Å; Q597-A599 VanDerWaalsContact C-N 3.33Å; Q597-A599 PolarHBondContact O-N 2.9Å; A599-E602 PolarHBondContact O-N 3.24Å; A599-E603 PolarHBondContact O-N 3.45Å
600	L	87.9	Confident	83.7	Confident	19 Å²	19	72.5 Å²	72.5	10%	0.099	38%	0.38	C	S	.	.	H	α-helix	trans	-64.4	-42.3	173	172.9	63.1	0	0	0	111.5	P554 F590 D596 Q597 E598 E603 I604	P554-L600 HydrophobicContact CB-CD2 4.04Å; F590-L600 HydrophobicContact CB-CD1 3.99Å; D596-L600 PolarHBondContact O-N 3.43Å; Q597-L600 WeakPolarHBondContact O-CB 3.3Å; Q597-L600 PolarHBondContact O-N 3.49Å; E598-L600 PolarHBondContact O-N 3.09Å; L600-E603 PolarHBondContact O-N 3.29Å; L600-I604 HydrophobicContact CD1-CD1 4.05Å; L600-I604 HydrophobicContact CD1-CG1 4.38Å; L600-I604 HydrophobicContact CG-CD1 3.97Å; L600-I604 WeakPolarHBondContact O-CG1 3.49Å; L600-I604 PolarHBondContact O-N 3.43Å
601	F	88.8	Confident	83.9	Confident	38 Å²	38	75 Å²	75	17%	0.167	39%	0.391	C	S	.	.	H	α-helix	trans	-66.7	-35.7	177.9	-68.9	-40.6	0	0	0	112.3	P554 V562 Q597 E598 I604 L605	P554-F601 HydrophobicContact CB-CE1 3.97Å; P554-F601 HydrophobicContact CB-CZ 4.1Å; P554-F601 HydrophobicContact CG-CZ 4.22Å; V562-F601 HydrophobicContact CG1-CB 3.79Å; V562-F601 HydrophobicContact CG1-CD1 3.95Å; V562-F601 HydrophobicContact CG1-CG 3.95Å; V562-F601 HydrophobicContact CG2-CD1 3.83Å; V562-F601 HydrophobicContact CG2-CE1 4.27Å; Q597-F601 HydrophobicContact CB-CE2 4.14Å; Q597-F601 WeakPolarHBondContact O-CD2 3.13Å; Q597-F601 VanDerWaalsContact O-CG 3.31Å; Q597-F601 WeakPolarHBondContact O-CG 3.41Å; Q597-F601 PolarHBondContact O-N 3.23Å; E598-F601 PolarHBondContact O-N 2.93Å; F601-I604 HydrophobicContact CD1-CD1 4.43Å; F601-I604 PolarHBondContact O-N 3.4Å; F601-L605 WeakPolarHBondContact O-CB 3.48Å; F601-L605 VanDerWaalsContact O-CG 3.24Å; F601-L605 WeakPolarHBondContact O-CG 3.47Å; F601-L605 PolarHBondContact O-N 2.79Å
602	E	88.9	Confident	84.4	Confident	112 Å²	112	71.7 Å²	71.7	52%	0.523	38%	0.384	S	S	.	.	H	α-helix	trans	-59.8	-45.9	170.7	-81.6	-161.3	-166.1	0	0	112.6	E598 A599 L605 K606	E598-E602 PolarHBondContact O-N 3.09Å; A599-E602 PolarHBondContact O-N 3.24Å; E602-L605 PolarHBondContact O-N 2.72Å; E602-K606 WeakPolarHBondContact O-CD 3.43Å; E602-K606 VanDerWaalsContact O-CG 3.22Å; E602-K606 WeakPolarHBondContact O-CG 3.46Å; E602-K606 PolarHBondContact O-N 3.4Å; E602-K606 IonicContact OE2-NZ 3.75Å; E602-K606 PolarHBondContact OE2-NZ 2.68Å
603	E	90.6	Very high	85.3	Confident	60 Å²	60	74.1 Å²	74.1	28%	0.28	40%	0.402	S	S	.	.	H	α-helix	trans	-67.2	-36.7	178.5	-66	-47.5	123.2	0	0	112.8	F590 A599 L600 K606 G607	F590-E603 HydrophobicContact CB-CB 4.41Å; A599-E603 PolarHBondContact O-N 3.45Å; L600-E603 PolarHBondContact O-N 3.29Å; E603-K606 PolarHBondContact O-N 3.19Å; E603-K606 WeakPolarHBondContact OE1-CD 3.3Å; E603-K606 IonicContact OE1-NZ 3.93Å; E603-K606 PolarHBondContact OE1-NZ 3.43Å; E603-G607 PolarHBondContact O-N 3.18Å
604	I	91.7	Very high	86.4	Confident	0 Å²	0	73 Å²	73	0%	0	39%	0.392	C	S	.	.	H	α-helix	trans	-62.1	-43.3	171.9	-70.9	168.5	0	0	0	110.8	P554 P559 V562 W574 F590 L600 F601 G607	P554-I604 WeakPolarHBondContact O-CD1 3.42Å; P559-I604 HydrophobicContact CB-CG2 4.4Å; P559-I604 HydrophobicContact CG-CG2 4.02Å; P559-I604 WeakPolarHBondContact CG-O 3.32Å; V562-I604 HydrophobicContact CG2-CG2 4.08Å; W574-I604 HydrophobicContact CZ2-CG2 4.05Å; F590-I604 HydrophobicContact CB-CG1 3.88Å; F590-I604 HydrophobicContact CD2-CG1 4.02Å; F590-I604 HydrophobicContact CG-CG1 3.98Å; L600-I604 HydrophobicContact CD1-CD1 4.05Å; L600-I604 HydrophobicContact CD1-CG1 4.38Å; L600-I604 HydrophobicContact CG-CD1 3.97Å; L600-I604 WeakPolarHBondContact O-CG1 3.49Å; L600-I604 PolarHBondContact O-N 3.43Å; F601-I604 HydrophobicContact CD1-CD1 4.43Å; F601-I604 PolarHBondContact O-N 3.4Å; I604-G607 PolarHBondContact O-N 3.26Å
605	L	91.6	Very high	87.5	Confident	77 Å²	77	75.3 Å²	75.3	40%	0.403	38%	0.381	S	S	.	.	H	α-helix	trans	-69.8	-34.5	178.8	-72.6	171.5	0	0	0	113.2	P559 V562 A563 F601 E602 G607	P559-L605 HydrophobicContact CB-CD2 4.38Å; V562-L605 HydrophobicContact CB-CD2 4.05Å; V562-L605 HydrophobicContact CB-CG 4.32Å; V562-L605 HydrophobicContact CG1-CD1 3.9Å; V562-L605 HydrophobicContact CG1-CD2 4.1Å; V562-L605 HydrophobicContact CG1-CG 3.91Å; A563-L605 HydrophobicContact CB-CD2 3.87Å; F601-L605 WeakPolarHBondContact O-CB 3.48Å; F601-L605 VanDerWaalsContact O-CG 3.24Å; F601-L605 WeakPolarHBondContact O-CG 3.47Å; F601-L605 PolarHBondContact O-N 2.79Å; E602-L605 PolarHBondContact O-N 2.72Å; L605-G607 VanDerWaalsContact C-N 3.33Å
606	K	91.8	Very high	89	Confident	112 Å²	112	66.9 Å²	66.9	49%	0.487	34%	0.342	S	S	.	.	H	α-helix	trans	-67.2	-36.5	170.7	-68.6	160.1	-159.9	166.9	0	111.2	E602 E603 H608	E602-K606 WeakPolarHBondContact O-CD 3.43Å; E602-K606 VanDerWaalsContact O-CG 3.22Å; E602-K606 WeakPolarHBondContact O-CG 3.46Å; E602-K606 PolarHBondContact O-N 3.4Å; E602-K606 IonicContact OE2-NZ 3.75Å; E602-K606 PolarHBondContact OE2-NZ 2.68Å; E603-K606 PolarHBondContact O-N 3.19Å; E603-K606 WeakPolarHBondContact OE1-CD 3.3Å; E603-K606 IonicContact OE1-NZ 3.93Å; E603-K606 PolarHBondContact OE1-NZ 3.43Å; K606-H608 PolarHBondContact O-N 3.4Å
607	G	89.9	Confident	89.7	Confident	16 Å²	16	67.9 Å²	67.9	17%	0.165	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	63	27.1	-177.3	0	0	0	0	0	113.7	E603 I604 L605 L609	E603-G607 PolarHBondContact O-N 3.18Å; I604-G607 PolarHBondContact O-N 3.26Å; L605-G607 VanDerWaalsContact C-N 3.33Å; G607-L609 PolarHBondContact O-N 3.43Å; G607-L609 VanDerWaalsContact O-N 3.09Å
608	H	91.4	Very high	90.1	Very high	118 Å²	118	68.9 Å²	68.9	55%	0.546	36%	0.356	S	S	.	.			trans	-73.8	103.1	-178.8	-164.1	59.5	0	0	0	110.2	K606 E610	K606-H608 PolarHBondContact O-N 3.4Å; H608-E610 IonicContact CD2-OE1 2.71Å; H608-E610 IonicContact NE2-OE1 2.65Å
609	L	94.1	Very high	90.6	Very high	34 Å²	34	62.7 Å²	62.7	18%	0.178	33%	0.327	C	S	.	.			trans	-94	108.7	-177.7	-179.3	62.1	0	0	0	110.7	Y581 P589 G607 F611 I627 L631	Y581-L609 HydrophobicContact CD2-CD1 3.83Å; Y581-L609 HydrophobicContact CE2-CD1 3.72Å; P589-L609 HydrophobicContact CB-CD1 3.95Å; G607-L609 PolarHBondContact O-N 3.43Å; G607-L609 VanDerWaalsContact O-N 3.09Å; L609-F611 HydrophobicContact CD1-CE1 4.49Å; L609-F611 HydrophobicContact CD2-CE1 4.33Å; L609-F611 HydrophobicContact CD2-CE2 4.19Å; L609-F611 HydrophobicContact CD2-CZ 3.66Å; L609-F611 HydrophobicContact CG-CE1 4.34Å; L609-F611 HydrophobicContact CG-CE2 4.28Å; L609-F611 HydrophobicContact CG-CZ 3.95Å; L609-I627 HydrophobicContact CD2-CG2 4.22Å; L609-L631 HydrophobicContact CD1-CD1 3.82Å; L609-L631 HydrophobicContact CD2-CB 4.28Å; L609-L631 HydrophobicContact CD2-CD1 4.21Å
610	E	93.8	Very high	91	Very high	116 Å²	116	63.4 Å²	63.4	54%	0.542	33%	0.331	S	S	.	.			trans	-100.4	146.7	174	-66.4	-171.6	176	0	0	112.7	Y581 H608 P612	Y581-E610 VanDerWaalsContact CE2-O 3.3Å; Y581-E610 WeakPolarHBondContact CE2-O 3.38Å; Y581-E610 PolarHBondContact OH-O 3.5Å; H608-E610 IonicContact CD2-OE1 2.71Å; H608-E610 IonicContact NE2-OE1 2.65Å; E610-P612 VanDerWaalsContact C-CD 3.45Å; E610-P612 VanDerWaalsContact O-CD 3.29Å; E610-P612 WeakPolarHBondContact O-CD 3.29Å
611	F	95.3	Very high	91.2	Very high	59 Å²	59	68.5 Å²	68.5	26%	0.259	35%	0.354	S	S	.	.			trans	-116.3	73.2	172.1	-62	-64.9	0	0	0	110.2	Y581 L609 W616 K624 I627	Y581-F611 HydrophobicContact CD2-CD1 4.4Å; Y581-F611 HydrophobicContact CD2-CE1 4.07Å; Y581-F611 AromaticContact CE2-CD1 3.84Å; Y581-F611 HydrophobicContact CE2-CD1 3.84Å; Y581-F611 AromaticContact CE2-CE1 3.91Å; Y581-F611 HydrophobicContact CE2-CE1 3.91Å; L609-F611 HydrophobicContact CD1-CE1 4.49Å; L609-F611 HydrophobicContact CD2-CE1 4.33Å; L609-F611 HydrophobicContact CD2-CE2 4.19Å; L609-F611 HydrophobicContact CD2-CZ 3.66Å; L609-F611 HydrophobicContact CG-CE1 4.34Å; L609-F611 HydrophobicContact CG-CE2 4.28Å; L609-F611 HydrophobicContact CG-CZ 3.95Å; F611-W616 VanDerWaalsContact C-CD1 3.45Å; F611-W616 HydrophobicContact CB-CB 3.88Å; F611-W616 HydrophobicContact CB-CD2 4.08Å; F611-W616 HydrophobicContact CB-CG 3.76Å; F611-W616 AromaticContact CD1-CD2 3.57Å; F611-W616 HydrophobicContact CD1-CD2 3.57Å; F611-W616 AromaticContact CD1-CE2 3.75Å; F611-W616 AromaticContact CD1-CE3 3.55Å; F611-W616 HydrophobicContact CD1-CE3 3.55Å; F611-W616 HydrophobicContact CD1-CG 4.18Å; F611-W616 HydrophobicContact CD1-CH2 4.02Å; F611-W616 AromaticContact CD1-CZ2 4Å; F611-W616 HydrophobicContact CD1-CZ2 4Å; F611-W616 AromaticContact CD1-CZ3 3.78Å; F611-W616 HydrophobicContact CD1-CZ3 3.78Å; F611-W616 HydrophobicContact CE1-CD2 4.48Å; F611-W616 HydrophobicContact CE1-CE3 4.13Å; F611-W616 HydrophobicContact CE1-CH2 4.04Å; F611-W616 HydrophobicContact CE1-CZ2 4.35Å; F611-W616 AromaticContact CE1-CZ3 3.89Å; F611-W616 HydrophobicContact CE1-CZ3 3.89Å; F611-W616 HydrophobicContact CG-CD2 4.26Å; F611-W616 HydrophobicContact CG-CE3 4.36Å; F611-W616 HydrophobicContact CG-CG 4.46Å; F611-K624 HydrophobicContact CD1-CG 4.19Å; F611-K624 HydrophobicContact CD2-CB 4.32Å; F611-K624 HydrophobicContact CD2-CD 4.32Å; F611-K624 HydrophobicContact CD2-CG 4.37Å; F611-K624 HydrophobicContact CE1-CB 4.21Å; F611-K624 HydrophobicContact CE1-CG 4.18Å; F611-K624 HydrophobicContact CE2-CB 3.9Å; F611-K624 HydrophobicContact CE2-CG 4.38Å; F611-K624 HydrophobicContact CG-CD 4.27Å; F611-K624 HydrophobicContact CG-CG 4.28Å; F611-K624 HydrophobicContact CZ-CB 3.83Å; F611-K624 HydrophobicContact CZ-CG 4.27Å; F611-I627 HydrophobicContact CE1-CG2 4.48Å
612	P	92.9	Very high	91.5	Very high	41 Å²	41	68.7 Å²	68.7	27%	0.266	36%	0.36	S	S	.	.			trans	-71.8	135.8	-166.6	27.4	-36.4	0	0	0	114.4	Y581 F587 E610 Y615	Y581-P612 WeakPolarHBondContact OH-CD 3.41Å; F587-P612 HydrophobicContact CZ-CG 4.14Å; E610-P612 VanDerWaalsContact C-CD 3.45Å; E610-P612 VanDerWaalsContact O-CD 3.29Å; E610-P612 WeakPolarHBondContact O-CD 3.29Å; P612-Y615 WeakPolarHBondContact O-CB 3.47Å; P612-Y615 PolarHBondContact O-N 3.46Å; P612-Y615 VanDerWaalsContact O-N 3.11Å
613	A	89.5	Confident	91.8	Very high	71 Å²	71	63.4 Å²	63.4	59%	0.587	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	151.4	171.4	0	0	0	0	0	112.3	Y615 D617	A613-Y615 VanDerWaalsContact C-N 3.28Å; A613-D617 WeakPolarHBondContact CA-OD1 3.31Å; A613-D617 VanDerWaalsContact CB-OD1 3.28Å; A613-D617 WeakPolarHBondContact CB-OD1 3.4Å
614	P	90.1	Very high	92.1	Very high	85 Å²	85	61.9 Å²	61.9	55%	0.552	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	cis	-87.1	15.2	-2	37.5	-36.9	0	0	0	113.1	D617	P614-D617 VanDerWaalsContact C-OD1 3.28Å; P614-D617 VanDerWaalsContact CA-OD1 3.26Å; P614-D617 WeakPolarHBondContact CA-OD1 3.43Å; P614-D617 WeakPolarHBondContact CA-OD2 3.37Å
615	Y	88.7	Confident	92.3	Very high	114 Å²	114	64.4 Å²	64.4	45%	0.447	35%	0.349	S	S	.	.	S	Bend	trans	-83	-18.9	-165.7	-52.6	-52.6	0	0	0	114.2	F587 P612 A613	F587-Y615 AromaticContact CE1-CD2 3.71Å; F587-Y615 HydrophobicContact CE1-CD2 3.71Å; F587-Y615 HydrophobicContact CE1-CE2 4.15Å; F587-Y615 HydrophobicContact CE1-CG 4.11Å; F587-Y615 AromaticContact CZ-CD2 3.87Å; F587-Y615 HydrophobicContact CZ-CD2 3.87Å; F587-Y615 HydrophobicContact CZ-CE2 4.45Å; P612-Y615 WeakPolarHBondContact O-CB 3.47Å; P612-Y615 PolarHBondContact O-N 3.46Å; P612-Y615 VanDerWaalsContact O-N 3.11Å; A613-Y615 VanDerWaalsContact C-N 3.28Å
616	W	92.6	Very high	92.6	Very high	3 Å²	3	60.7 Å²	60.7	1%	0.011	33%	0.33	C	S	.	.	S	Bend	trans	-116.2	-2.1	-176.5	-72.1	93	0	0	0	113.4	Y581 V584 C585 F611 N618 V619 K624 I627	Y581-W616 AromaticContact CD1-CZ2 3.92Å; Y581-W616 HydrophobicContact CD1-CZ2 3.92Å; Y581-W616 AromaticContact CD2-CH2 3.77Å; Y581-W616 HydrophobicContact CD2-CH2 3.77Å; Y581-W616 AromaticContact CD2-CZ2 3.39Å; Y581-W616 HydrophobicContact CD2-CZ2 3.39Å; Y581-W616 AromaticContact CE1-CZ2 3.86Å; Y581-W616 HydrophobicContact CE1-CZ2 3.86Å; Y581-W616 AromaticContact CE2-CE2 3.81Å; Y581-W616 HydrophobicContact CE2-CH2 4.08Å; Y581-W616 AromaticContact CE2-CZ2 3.33Å; Y581-W616 HydrophobicContact CE2-CZ2 3.33Å; Y581-W616 HydrophobicContact CG-CH2 4.13Å; Y581-W616 AromaticContact CG-CZ2 3.7Å; Y581-W616 HydrophobicContact CG-CZ2 3.7Å; Y581-W616 AromaticContact CZ-CE2 3.84Å; Y581-W616 AromaticContact CZ-CZ2 3.57Å; Y581-W616 AromaticContact CZ-NE1 3.64Å; Y581-W616 PolarHBondContact OH-NE1 3.35Å; V584-W616 HydrophobicContact CB-CH2 3.87Å; V584-W616 HydrophobicContact CB-CZ3 4.19Å; V584-W616 HydrophobicContact CG1-CE3 4.19Å; V584-W616 HydrophobicContact CG1-CH2 3.77Å; V584-W616 HydrophobicContact CG1-CZ2 4.46Å; V584-W616 HydrophobicContact CG1-CZ3 3.64Å; C585-W616 HydrophobicContact CB-CH2 4.46Å; C585-W616 HydrophobicContact CB-CZ2 3.51Å; F611-W616 VanDerWaalsContact C-CD1 3.45Å; F611-W616 HydrophobicContact CB-CB 3.88Å; F611-W616 HydrophobicContact CB-CD2 4.08Å; F611-W616 HydrophobicContact CB-CG 3.76Å; F611-W616 AromaticContact CD1-CD2 3.57Å; F611-W616 HydrophobicContact CD1-CD2 3.57Å; F611-W616 AromaticContact CD1-CE2 3.75Å; F611-W616 AromaticContact CD1-CE3 3.55Å; F611-W616 HydrophobicContact CD1-CE3 3.55Å; F611-W616 HydrophobicContact CD1-CG 4.18Å; F611-W616 HydrophobicContact CD1-CH2 4.02Å; F611-W616 AromaticContact CD1-CZ2 4Å; F611-W616 HydrophobicContact CD1-CZ2 4Å; F611-W616 AromaticContact CD1-CZ3 3.78Å; F611-W616 HydrophobicContact CD1-CZ3 3.78Å; F611-W616 HydrophobicContact CE1-CD2 4.48Å; F611-W616 HydrophobicContact CE1-CE3 4.13Å; F611-W616 HydrophobicContact CE1-CH2 4.04Å; F611-W616 HydrophobicContact CE1-CZ2 4.35Å; F611-W616 AromaticContact CE1-CZ3 3.89Å; F611-W616 HydrophobicContact CE1-CZ3 3.89Å; F611-W616 HydrophobicContact CG-CD2 4.26Å; F611-W616 HydrophobicContact CG-CE3 4.36Å; F611-W616 HydrophobicContact CG-CG 4.46Å; W616-N618 VanDerWaalsContact C-N 3.34Å; W616-N618 PolarHBondContact O-N 2.9Å; W616-V619 HydrophobicContact CE3-CB 3.91Å; W616-V619 HydrophobicContact CE3-CG1 3.67Å; W616-V619 HydrophobicContact CE3-CG2 4.01Å; W616-V619 HydrophobicContact CZ3-CB 4.5Å; W616-V619 HydrophobicContact CZ3-CG1 3.8Å; W616-V619 WeakPolarHBondContact O-CB 3.22Å; W616-V619 PolarHBondContact O-N 3.44Å; W616-K624 HydrophobicContact CE3-CD 4.48Å; W616-K624 HydrophobicContact CE3-CG 3.93Å; W616-K624 HydrophobicContact CZ3-CG 4.2Å; W616-K624 VanDerWaalsContact O-CE 3.32Å; W616-K624 WeakPolarHBondContact O-CE 3.13Å; W616-K624 PolarHBondContact O-NZ 2.62Å; W616-I627 HydrophobicContact CH2-CD1 3.65Å; W616-I627 HydrophobicContact CZ3-CD1 3.93Å
617	D	89.5	Confident	92.9	Very high	96 Å²	96	55.4 Å²	55.4	51%	0.513	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-41.3	-176.5	-52.5	17.9	0	0	0	111.7	A613 P614	A613-D617 WeakPolarHBondContact CA-OD1 3.31Å; A613-D617 VanDerWaalsContact CB-OD1 3.28Å; A613-D617 WeakPolarHBondContact CB-OD1 3.4Å; P614-D617 VanDerWaalsContact C-OD1 3.28Å; P614-D617 VanDerWaalsContact CA-OD1 3.26Å; P614-D617 WeakPolarHBondContact CA-OD1 3.43Å; P614-D617 WeakPolarHBondContact CA-OD2 3.37Å
618	N	87.4	Confident	93.3	Very high	117 Å²	117	57 Å²	57	63%	0.626	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.2	9.9	179.8	-60.8	-73.1	0	0	0	113.1	W616	W616-N618 VanDerWaalsContact C-N 3.34Å; W616-N618 PolarHBondContact O-N 2.9Å
619	V	91.8	Very high	93.6	Very high	8 Å²	8	51.7 Å²	51.7	5%	0.048	29%	0.29	C	S	.	.	S	Bend	trans	-94.9	135.9	179.9	175.1	0	0	0	0	110	E488 V584 W616 A623 K624 L662	E488-V619 WeakPolarHBondContact OE1-CA 3.5Å; V584-V619 HydrophobicContact CG1-CB 4.29Å; V584-V619 HydrophobicContact CG1-CG1 3.68Å; V584-V619 HydrophobicContact CG1-CG2 3.55Å; W616-V619 HydrophobicContact CE3-CB 3.91Å; W616-V619 HydrophobicContact CE3-CG1 3.67Å; W616-V619 HydrophobicContact CE3-CG2 4.01Å; W616-V619 HydrophobicContact CZ3-CB 4.5Å; W616-V619 HydrophobicContact CZ3-CG1 3.8Å; W616-V619 WeakPolarHBondContact O-CB 3.22Å; W616-V619 PolarHBondContact O-N 3.44Å; V619-A623 HydrophobicContact CG1-CB 3.86Å; V619-K624 HydrophobicContact CG1-CG 4.46Å; V619-K624 WeakPolarHBondContact O-CE 3.5Å; V619-K624 PolarHBondContact O-NZ 3.03Å; V619-L662 HydrophobicContact CG2-CD2 4.41Å
620	S	92.8	Very high	93.8	Very high	36 Å²	36	50.1 Å²	50.1	25%	0.252	28%	0.282	S	S	.	.			trans	-59.7	141.7	-179.5	78.1	0	0	0	0	112.8	E488 S622 A623 K624	E488-S620 PolarHBondContact OE1-N 2.89Å; E488-S620 VanDerWaalsContact OE2-CB 3.3Å; E488-S620 WeakPolarHBondContact OE2-CB 3.45Å; E488-S620 PolarHBondContact OE2-OG 2.73Å; S620-S622 PolarHBondContact O-N 3.23Å; S620-A623 WeakPolarHBondContact O-CB 3.34Å; S620-A623 PolarHBondContact O-N 3.32Å; S620-A623 VanDerWaalsContact O-N 3.09Å; S620-A623 PolarHBondContact OG-N 3.41Å; S620-K624 PolarHBondContact O-N 2.89Å
621	E	92.9	Very high	94	Very high	126 Å²	126	44.9 Å²	44.9	59%	0.589	26%	0.258	S	S	*	.	H	α-helix	trans	-66.4	-25.3	179.3	-153.3	56.2	-141.6	0	0	112	A623 K624 A625	E621-A623 VanDerWaalsContact C-N 3.33Å; E621-A623 PolarHBondContact O-N 3.48Å; E621-K624 PolarHBondContact O-N 3.45Å; E621-K624 WeakPolarHBondContact OE2-CD 3.35Å; E621-K624 WeakPolarHBondContact OE2-CE 3.45Å; E621-K624 IonicContact OE2-NZ 3.38Å; E621-K624 PolarHBondContact OE2-NZ 3.47Å; E621-A625 VanDerWaalsContact O-CB 3.31Å; E621-A625 WeakPolarHBondContact O-CB 3.32Å; E621-A625 PolarHBondContact O-N 3.48Å
622	S	94.3	Very high	94.2	Very high	42 Å²	42	44.7 Å²	44.7	29%	0.294	26%	0.258	S	S	.	.	H	α-helix	trans	-65.7	-33.8	173.2	-160.3	0	0	0	0	112.5	S620 L626	S620-S622 PolarHBondContact O-N 3.23Å; S622-L626 WeakPolarHBondContact O-CB 3.3Å; S622-L626 PolarHBondContact O-N 2.89Å; S622-L626 VanDerWaalsContact O-N 3.09Å
623	A	94.9	Very high	94.3	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.008	26%	0.261	C	S	.	.	H	α-helix	trans	-66.2	-47.8	173.1	0	0	0	0	0	111	V619 S620 E621 A625 L626 I627 W649	V619-A623 HydrophobicContact CG1-CB 3.86Å; S620-A623 WeakPolarHBondContact O-CB 3.34Å; S620-A623 PolarHBondContact O-N 3.32Å; S620-A623 VanDerWaalsContact O-N 3.09Å; S620-A623 PolarHBondContact OG-N 3.41Å; E621-A623 VanDerWaalsContact C-N 3.33Å; E621-A623 PolarHBondContact O-N 3.48Å; A623-A625 PolarHBondContact O-N 3.34Å; A623-L626 PolarHBondContact O-N 2.89Å; A623-I627 VanDerWaalsContact O-CG1 3.26Å; A623-I627 WeakPolarHBondContact O-CG1 3.4Å; A623-I627 PolarHBondContact O-N 2.87Å; A623-W649 HydrophobicContact CB-CD2 4.28Å; A623-W649 HydrophobicContact CB-CG 4.33Å; A623-W649 HydrophobicContact CB-CZ2 4.17Å
624	K	96.3	Very high	94.6	Very high	28 Å²	28	45.4 Å²	45.4	12%	0.122	25%	0.254	C	S	.	.	H	α-helix	trans	-62.5	-43.8	179.8	-60.5	177.7	-146.3	153.8	0	111.6	F611 W616 V619 S620 E621 I627 T628	F611-K624 HydrophobicContact CD1-CG 4.19Å; F611-K624 HydrophobicContact CD2-CB 4.32Å; F611-K624 HydrophobicContact CD2-CD 4.32Å; F611-K624 HydrophobicContact CD2-CG 4.37Å; F611-K624 HydrophobicContact CE1-CB 4.21Å; F611-K624 HydrophobicContact CE1-CG 4.18Å; F611-K624 HydrophobicContact CE2-CB 3.9Å; F611-K624 HydrophobicContact CE2-CG 4.38Å; F611-K624 HydrophobicContact CG-CD 4.27Å; F611-K624 HydrophobicContact CG-CG 4.28Å; F611-K624 HydrophobicContact CZ-CB 3.83Å; F611-K624 HydrophobicContact CZ-CG 4.27Å; W616-K624 HydrophobicContact CE3-CD 4.48Å; W616-K624 HydrophobicContact CE3-CG 3.93Å; W616-K624 HydrophobicContact CZ3-CG 4.2Å; W616-K624 VanDerWaalsContact O-CE 3.32Å; W616-K624 WeakPolarHBondContact O-CE 3.13Å; W616-K624 PolarHBondContact O-NZ 2.62Å; V619-K624 HydrophobicContact CG1-CG 4.46Å; V619-K624 WeakPolarHBondContact O-CE 3.5Å; V619-K624 PolarHBondContact O-NZ 3.03Å; S620-K624 PolarHBondContact O-N 2.89Å; E621-K624 PolarHBondContact O-N 3.45Å; E621-K624 WeakPolarHBondContact OE2-CD 3.35Å; E621-K624 WeakPolarHBondContact OE2-CE 3.45Å; E621-K624 IonicContact OE2-NZ 3.38Å; E621-K624 PolarHBondContact OE2-NZ 3.47Å; K624-I627 PolarHBondContact O-N 2.79Å; K624-T628 VanDerWaalsContact O-CB 3.3Å; K624-T628 WeakPolarHBondContact O-CB 3.4Å; K624-T628 PolarHBondContact O-N 3.2Å; K624-T628 PolarHBondContact O-OG1 3.23Å
625	A	96.5	Very high	94.9	Very high	52 Å²	52	43.9 Å²	43.9	43%	0.43	24%	0.243	S	C	.	.	H	α-helix	trans	-61.4	-44.2	175.1	0	0	0	0	0	112.5	E621 A623 T628 G629	E621-A625 VanDerWaalsContact O-CB 3.31Å; E621-A625 WeakPolarHBondContact O-CB 3.32Å; E621-A625 PolarHBondContact O-N 3.48Å; A623-A625 PolarHBondContact O-N 3.34Å; A625-T628 PolarHBondContact O-N 2.89Å; A625-G629 PolarHBondContact O-N 2.8Å
626	L	97.9	Very high	95.3	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-62.5	-49.3	176.2	173.2	57.1	0	0	0	112	L495 S622 A623 T628 G629 M630 Y639 V644 N647 W649 V650	L495-L626 HydrophobicContact CD2-CD2 3.68Å; L495-L626 HydrophobicContact CD2-CG 4.49Å; S622-L626 WeakPolarHBondContact O-CB 3.3Å; S622-L626 PolarHBondContact O-N 2.89Å; S622-L626 VanDerWaalsContact O-N 3.09Å; A623-L626 PolarHBondContact O-N 2.89Å; L626-T628 VanDerWaalsContact C-N 3.26Å; L626-T628 PolarHBondContact O-N 3.16Å; L626-G629 WeakPolarHBondContact O-CA 3.11Å; L626-G629 PolarHBondContact O-N 2.86Å; L626-M630 HydrophobicContact CD1-CG 4.11Å; L626-M630 HydrophobicContact CD1-SD 3.92Å; L626-M630 HydrophobicContact CG-SD 4.03Å; L626-M630 WeakPolarHBondContact O-CG 3.34Å; L626-M630 PolarHBondContact O-N 2.74Å; L626-Y639 HydrophobicContact CD1-CD2 3.9Å; L626-Y639 HydrophobicContact CD1-CE2 3.89Å; L626-V644 HydrophobicContact CD1-CG1 4.36Å; L626-V644 HydrophobicContact CD1-CG2 4.34Å; L626-N647 HydrophobicContact CD1-CB 3.96Å; L626-N647 HydrophobicContact CD2-CB 4.38Å; L626-W649 HydrophobicContact CD2-CB 4.18Å; L626-W649 HydrophobicContact CD2-CD2 4.36Å; L626-W649 HydrophobicContact CD2-CE3 3.65Å; L626-W649 HydrophobicContact CD2-CZ3 4.41Å; L626-V650 HydrophobicContact CD2-CG2 3.54Å
627	I	98.3	Very high	95.5	Very high	0 Å²	0	51 Å²	51	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-61	-39.6	178.8	-64.4	164.4	0	0	0	110.3	T580 Y581 L609 F611 W616 A623 K624 G629 M630 L631	T580-I627 HydrophobicContact CG2-CD1 3.97Å; T580-I627 HydrophobicContact CG2-CG1 3.69Å; Y581-I627 HydrophobicContact CD2-CG2 4.14Å; L609-I627 HydrophobicContact CD2-CG2 4.22Å; F611-I627 HydrophobicContact CE1-CG2 4.48Å; W616-I627 HydrophobicContact CH2-CD1 3.65Å; W616-I627 HydrophobicContact CZ3-CD1 3.93Å; A623-I627 VanDerWaalsContact O-CG1 3.26Å; A623-I627 WeakPolarHBondContact O-CG1 3.4Å; A623-I627 PolarHBondContact O-N 2.87Å; K624-I627 PolarHBondContact O-N 2.79Å; I627-G629 VanDerWaalsContact C-N 3.35Å; I627-G629 PolarHBondContact O-N 2.85Å; I627-M630 PolarHBondContact O-N 2.82Å; I627-M630 VanDerWaalsContact O-N 3.15Å; I627-L631 HydrophobicContact CG2-CD1 3.71Å; I627-L631 HydrophobicContact CG2-CG 4.24Å; I627-L631 WeakPolarHBondContact O-CB 3.35Å; I627-L631 PolarHBondContact O-N 3.2Å
628	T	98.1	Very high	95.9	Very high	51 Å²	51	46.4 Å²	46.4	31%	0.313	26%	0.26	S	S	.	.	H	α-helix	trans	-61.1	-40.2	173.8	-57.6	0	0	0	0	111.9	K624 A625 L626 Q632	K624-T628 VanDerWaalsContact O-CB 3.3Å; K624-T628 WeakPolarHBondContact O-CB 3.4Å; K624-T628 PolarHBondContact O-N 3.2Å; K624-T628 PolarHBondContact O-OG1 3.23Å; A625-T628 PolarHBondContact O-N 2.89Å; L626-T628 VanDerWaalsContact C-N 3.26Å; L626-T628 PolarHBondContact O-N 3.16Å; T628-Q632 WeakPolarHBondContact O-CG 3.5Å; T628-Q632 PolarHBondContact O-NE2 2.82Å
629	G	98.1	Very high	96.5	Very high	6 Å²	6	43.9 Å²	43.9	6%	0.062	24%	0.243	C	C	.	.	H	α-helix	trans	-67.6	-30.1	173.2	0	0	0	0	0	114.4	A625 L626 I627 R638 Y639	A625-G629 PolarHBondContact O-N 2.8Å; L626-G629 WeakPolarHBondContact O-CA 3.11Å; L626-G629 PolarHBondContact O-N 2.86Å; I627-G629 VanDerWaalsContact C-N 3.35Å; I627-G629 PolarHBondContact O-N 2.85Å; G629-R638 WeakPolarHBondContact O-CA 3.37Å; G629-Y639 PolarHBondContact O-N 3.38Å
630	M	98.6	Very high	96.8	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-81.5	-27	176.8	-65.8	176	77.2	0	0	113.5	L495 I573 A576 L626 I627 R638 Y639 V644	L495-M630 HydrophobicContact CD1-CE 3.95Å; L495-M630 HydrophobicContact CD2-SD 4.19Å; I573-M630 HydrophobicContact CG2-CB 4.11Å; I573-M630 HydrophobicContact CG2-CE 4.16Å; I573-M630 HydrophobicContact CG2-CG 4.02Å; A576-M630 HydrophobicContact CB-CE 3.57Å; L626-M630 HydrophobicContact CD1-CG 4.11Å; L626-M630 HydrophobicContact CD1-SD 3.92Å; L626-M630 HydrophobicContact CG-SD 4.03Å; L626-M630 WeakPolarHBondContact O-CG 3.34Å; L626-M630 PolarHBondContact O-N 2.74Å; I627-M630 PolarHBondContact O-N 2.82Å; I627-M630 VanDerWaalsContact O-N 3.15Å; M630-R638 VanDerWaalsContact O-CD 3.25Å; M630-R638 WeakPolarHBondContact O-CD 3.4Å; M630-R638 WeakPolarHBondContact O-CG 3.49Å; M630-Y639 HydrophobicContact CG-CD2 4.5Å; M630-V644 HydrophobicContact CE-CG1 4.13Å; M630-V644 HydrophobicContact CE-CG2 3.99Å; M630-V644 HydrophobicContact CG-CG2 3.71Å; M630-V644 HydrophobicContact SD-CG1 4.09Å; M630-V644 HydrophobicContact SD-CG2 3.9Å
631	L	98.3	Very high	97.1	Very high	6 Å²	6	44.3 Å²	44.3	3%	0.031	24%	0.244	C	C	.	.	S	Bend	trans	-104.8	30.8	-177.4	-63.8	-177.8	0	0	0	113.7	W574 V578 P589 F590 L609 I627	W574-L631 HydrophobicContact CD2-CD2 3.74Å; W574-L631 HydrophobicContact CE3-CB 4.38Å; W574-L631 HydrophobicContact CE3-CD2 3.88Å; W574-L631 HydrophobicContact CG-CD2 4.14Å; W574-L631 HydrophobicContact CZ2-CD2 4.49Å; W574-L631 HydrophobicContact CZ3-CB 4.22Å; W574-L631 HydrophobicContact CZ3-CD2 4.32Å; W574-L631 VanDerWaalsContact CZ3-O 3.25Å; W574-L631 WeakPolarHBondContact CZ3-O 3.48Å; W574-L631 WeakPolarHBondContact O-CD2 3.45Å; V578-L631 HydrophobicContact CG2-CD2 3.87Å; P589-L631 HydrophobicContact CG-CD1 4.26Å; F590-L631 HydrophobicContact CE2-CD1 4.35Å; F590-L631 HydrophobicContact CE2-CD2 4.45Å; F590-L631 HydrophobicContact CZ-CD1 4.4Å; L609-L631 HydrophobicContact CD1-CD1 3.82Å; L609-L631 HydrophobicContact CD2-CB 4.28Å; L609-L631 HydrophobicContact CD2-CD1 4.21Å; I627-L631 HydrophobicContact CG2-CD1 3.71Å; I627-L631 HydrophobicContact CG2-CG 4.24Å; I627-L631 WeakPolarHBondContact O-CB 3.35Å; I627-L631 PolarHBondContact O-N 3.2Å
632	Q	98.1	Very high	97.3	Very high	54 Å²	54	41 Å²	41	25%	0.252	23%	0.232	S	C	.	.			trans	-71.7	130.2	169.2	-66.8	-59.8	-46	0	0	111.4	T628 Q637 R638	T628-Q632 WeakPolarHBondContact O-CG 3.5Å; T628-Q632 PolarHBondContact O-NE2 2.82Å; Q632-Q637 HydrophobicContact CB-CB 4.31Å; Q632-Q637 HydrophobicContact CG-CB 4.23Å; Q632-R638 HydrophobicContact CB-CB 3.93Å; Q632-R638 HydrophobicContact CB-CG 4.35Å; Q632-R638 PolarHBondContact O-NE 3.26Å; Q632-R638 PolarHBondContact O-NH2 3.12Å
633	V	96	Very high	97.5	Very high	55 Å²	55	43.3 Å²	43.3	33%	0.333	24%	0.238	S	C	.	.	S	Bend	trans	-65.6	-42.7	172.2	-179.5	0	0	0	0	110.4	P559 W574 V635 R638	P559-V633 HydrophobicContact CB-CG1 4.03Å; P559-V633 HydrophobicContact CG-CG1 4.25Å; P559-V633 HydrophobicContact CG-CG2 4.3Å; W574-V633 HydrophobicContact CZ3-CG2 4.5Å; V633-V635 PolarHBondContact O-N 2.58Å; V633-V635 VanDerWaalsContact O-N 3.14Å; V633-R638 PolarHBondContact O-NH2 3.45Å
634	V	96.1	Very high	97.7	Very high	73 Å²	73	43.3 Å²	43.3	44%	0.442	24%	0.238	S	C	.	.	S	Bend	trans	-69.9	109.3	176.4	-178.9	0	0	0	0	109.5	D636 Q637 R638	V634-D636 VanDerWaalsContact C-N 3.25Å; V634-D636 PolarHBondContact O-N 3.43Å; V634-Q637 HydrophobicContact CB-CB 4.19Å; V634-Q637 HydrophobicContact CB-CG 4.11Å; V634-Q637 HydrophobicContact CG1-CB 4.3Å; V634-Q637 HydrophobicContact CG1-CG 3.86Å; V634-Q637 PolarHBondContact O-N 3.37Å; V634-R638 PolarHBondContact O-N 2.98Å
635	V	96.3	Very high	97.7	Very high	52 Å²	52	42.6 Å²	42.6	32%	0.315	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-38.1	-173.2	179.9	0	0	0	0	112.3	E560 K570 V633 R638	E560-V635 HydrophobicContact CB-CG2 4.27Å; E560-V635 HydrophobicContact CG-CG2 4.13Å; K570-V635 HydrophobicContact CB-CG1 4.15Å; K570-V635 HydrophobicContact CD-CG1 4.01Å; K570-V635 WeakPolarHBondContact CD-O 3.29Å; K570-V635 WeakPolarHBondContact CE-O 2.93Å; K570-V635 PolarHBondContact NZ-O 3.27Å; V633-V635 PolarHBondContact O-N 2.58Å; V633-V635 VanDerWaalsContact O-N 3.14Å; V635-R638 WeakPolarHBondContact O-CB 3.44Å; V635-R638 PolarHBondContact O-N 3.39Å
636	D	96.3	Very high	97.7	Very high	145 Å²	145	44.6 Å²	44.6	78%	0.775	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-36.9	179.6	-65.7	-42.8	0	0	0	113.1	K570 V634	K570-D636 PolarHBondContact NZ-O 3.38Å; V634-D636 VanDerWaalsContact C-N 3.25Å; V634-D636 PolarHBondContact O-N 3.43Å
637	Q	97.5	Very high	97.6	Very high	122 Å²	122	45.4 Å²	45.4	57%	0.57	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-26.6	177	-63.7	175.4	-5.5	0	0	112.4	Q632 V634	Q632-Q637 HydrophobicContact CB-CB 4.31Å; Q632-Q637 HydrophobicContact CG-CB 4.23Å; V634-Q637 HydrophobicContact CB-CB 4.19Å; V634-Q637 HydrophobicContact CB-CG 4.11Å; V634-Q637 HydrophobicContact CG1-CB 4.3Å; V634-Q637 HydrophobicContact CG1-CG 3.86Å; V634-Q637 PolarHBondContact O-N 3.37Å
638	R	98.5	Very high	97.3	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	27%	0.269	C	S	.	.	S	Bend	trans	-61.1	136.7	175.6	-161	-175.2	-57.7	150.4	7.5	111	E560 K570 I573 G629 M630 Q632 V633 V634 V635	E560-R638 IonicContact OE1-CZ 2.66Å; E560-R638 IonicContact OE1-NH1 2.73Å; E560-R638 PolarHBondContact OE1-NH1 2.99Å; E560-R638 IonicContact OE1-NH2 3.54Å; E560-R638 PolarHBondContact OE1-NH2 2.72Å; E560-R638 IonicContact OE2-CZ 2.66Å; E560-R638 IonicContact OE2-NH1 3.18Å; E560-R638 PolarHBondContact OE2-NH1 2.93Å; E560-R638 IonicContact OE2-NH2 3.99Å; E560-R638 PolarHBondContact OE2-NH2 2.98Å; K570-R638 HydrophobicContact CD-CB 4.29Å; K570-R638 WeakPolarHBondContact CE-O 3.38Å; K570-R638 PolarHBondContact NZ-O 3.14Å; K570-R638 PolarHBondContact O-NH1 3.25Å; I573-R638 HydrophobicContact CG2-CG 4.44Å; G629-R638 WeakPolarHBondContact O-CA 3.37Å; M630-R638 VanDerWaalsContact O-CD 3.25Å; M630-R638 WeakPolarHBondContact O-CD 3.4Å; M630-R638 WeakPolarHBondContact O-CG 3.49Å; Q632-R638 HydrophobicContact CB-CB 3.93Å; Q632-R638 HydrophobicContact CB-CG 4.35Å; Q632-R638 PolarHBondContact O-NE 3.26Å; Q632-R638 PolarHBondContact O-NH2 3.12Å; V633-R638 PolarHBondContact O-NH2 3.45Å; V634-R638 PolarHBondContact O-N 2.98Å; V635-R638 WeakPolarHBondContact O-CB 3.44Å; V635-R638 PolarHBondContact O-N 3.39Å
639	Y	98.6	Very high	97.1	Very high	64 Å²	64	47 Å²	47	25%	0.251	25%	0.254	S	S	.	.	P	Polyproline II helix	trans	-58.8	154.8	178.6	-71.7	0.4	0	0	0	112.9	I573 L626 G629 M630 Q643 V644	I573-Y639 WeakPolarHBondContact CG2-O 2.93Å; L626-Y639 HydrophobicContact CD1-CD2 3.9Å; L626-Y639 HydrophobicContact CD1-CE2 3.89Å; G629-Y639 PolarHBondContact O-N 3.38Å; M630-Y639 HydrophobicContact CG-CD2 4.5Å; Y639-Q643 HydrophobicContact CD2-CB 4.43Å; Y639-Q643 HydrophobicContact CG-CB 4.15Å; Y639-V644 HydrophobicContact CD2-CG2 4.27Å
640	T	98.6	Very high	96.9	Very high	49 Å²	49	47.3 Å²	47.3	30%	0.301	26%	0.255	S	S	.	.	P	Polyproline II helix	trans	-90.8	164	164.1	58.4	0	0	0	0	110.5	V642 Q643 V644	T640-V642 PolarHBondContact O-N 3.15Å; T640-V642 VanDerWaalsContact O-N 3.13Å; T640-Q643 PolarHBondContact O-N 2.99Å; T640-Q643 VanDerWaalsContact O-N 3.11Å; T640-Q643 WeakPolarHBondContact OG1-CG 3.26Å; T640-Q643 PolarHBondContact OG1-N 3.47Å; T640-Q643 PolarHBondContact OG1-OE1 2.9Å; T640-V644 WeakPolarHBondContact O-CG2 3.28Å; T640-V644 PolarHBondContact O-N 3.43Å
641	A	98.3	Very high	96.4	Very high	3 Å²	3	52.5 Å²	52.5	3%	0.025	28%	0.283	C	S	.	.	H	α-helix	trans	-57.9	-27.2	175	0	0	0	0	0	113.2	I502 K503 I573 L645	I502-A641 HydrophobicContact CB-CB 4.33Å; I502-A641 HydrophobicContact CG2-CB 4Å; K503-A641 HydrophobicContact CB-CB 3.71Å; I573-A641 HydrophobicContact CD1-CB 3.85Å; A641-L645 WeakPolarHBondContact O-CD1 3.49Å; A641-L645 WeakPolarHBondContact O-CG 3.21Å; A641-L645 PolarHBondContact O-N 3.19Å
642	V	98.1	Very high	95.2	Very high	56 Å²	56	53.3 Å²	53.3	34%	0.339	29%	0.292	S	S	.	.	H	α-helix	trans	-68	-54	173.7	179.8	0	0	0	0	110.1	K503 T640 V644 L645 D646	K503-V642 HydrophobicContact CD-CG2 4.01Å; K503-V642 HydrophobicContact CG-CG2 4.29Å; T640-V642 PolarHBondContact O-N 3.15Å; T640-V642 VanDerWaalsContact O-N 3.13Å; V642-V644 PolarHBondContact O-N 3.2Å; V642-L645 PolarHBondContact O-N 3.26Å; V642-D646 VanDerWaalsContact CG1-OD2 3.24Å; V642-D646 WeakPolarHBondContact CG1-OD2 3.47Å; V642-D646 PolarHBondContact O-N 3.17Å
643	Q	98.2	Very high	93.2	Very high	91 Å²	91	57.2 Å²	57.2	43%	0.425	32%	0.315	S	S	.	.	H	α-helix	trans	-62.1	-27.3	178.3	-69	161.5	-63.3	0	0	113.8	Y639 T640 N647	Y639-Q643 HydrophobicContact CD2-CB 4.43Å; Y639-Q643 HydrophobicContact CG-CB 4.15Å; T640-Q643 PolarHBondContact O-N 2.99Å; T640-Q643 VanDerWaalsContact O-N 3.11Å; T640-Q643 WeakPolarHBondContact OG1-CG 3.26Å; T640-Q643 PolarHBondContact OG1-N 3.47Å; T640-Q643 PolarHBondContact OG1-OE1 2.9Å; Q643-N647 PolarHBondContact O-N 3.29Å
644	V	98.3	Very high	91.2	Very high	1 Å²	1	59.6 Å²	59.6	1%	0.006	33%	0.334	C	S	.	.	H	α-helix	trans	-69.5	-44.1	171.5	172.6	0	0	0	0	111.2	L495 A499 I573 L626 M630 Y639 T640 V642 N647 V650	L495-V644 HydrophobicContact CD1-CG1 4.15Å; L495-V644 HydrophobicContact CD2-CG1 4.11Å; L495-V644 HydrophobicContact CG-CG1 4.15Å; A499-V644 HydrophobicContact CB-CB 4.33Å; A499-V644 HydrophobicContact CB-CG1 3.68Å; I573-V644 HydrophobicContact CG2-CG2 4.22Å; L626-V644 HydrophobicContact CD1-CG1 4.36Å; L626-V644 HydrophobicContact CD1-CG2 4.34Å; M630-V644 HydrophobicContact CE-CG1 4.13Å; M630-V644 HydrophobicContact CE-CG2 3.99Å; M630-V644 HydrophobicContact CG-CG2 3.71Å; M630-V644 HydrophobicContact SD-CG1 4.09Å; M630-V644 HydrophobicContact SD-CG2 3.9Å; Y639-V644 HydrophobicContact CD2-CG2 4.27Å; T640-V644 WeakPolarHBondContact O-CG2 3.28Å; T640-V644 PolarHBondContact O-N 3.43Å; V642-V644 PolarHBondContact O-N 3.2Å; V644-N647 WeakPolarHBondContact O-CB 3.29Å; V644-N647 PolarHBondContact O-N 3.11Å; V644-V650 WeakPolarHBondContact O-CB 3.46Å; V644-V650 WeakPolarHBondContact O-CG2 3.47Å
645	L	97.4	Very high	89.6	Confident	13 Å²	13	57.5 Å²	57.5	7%	0.068	32%	0.321	C	S	.	.	H	α-helix	trans	-70.5	-34.4	178.5	-74.7	165	0	0	0	113.1	F496 A499 K503 A641 V642 N647 V650 N651	F496-L645 HydrophobicContact CD2-CD2 3.55Å; F496-L645 HydrophobicContact CE2-CD2 3.8Å; F496-L645 HydrophobicContact CG-CD2 4.11Å; A499-L645 HydrophobicContact CB-CD1 4.44Å; A499-L645 HydrophobicContact CB-CD2 3.83Å; A499-L645 HydrophobicContact CB-CG 3.78Å; K503-L645 HydrophobicContact CB-CD1 4.1Å; K503-L645 HydrophobicContact CD-CD1 3.41Å; K503-L645 VanDerWaalsContact CD-CD1 3.41Å; K503-L645 HydrophobicContact CG-CD1 4.42Å; A641-L645 WeakPolarHBondContact O-CD1 3.49Å; A641-L645 WeakPolarHBondContact O-CG 3.21Å; A641-L645 PolarHBondContact O-N 3.19Å; V642-L645 PolarHBondContact O-N 3.26Å; L645-N647 PolarHBondContact O-N 3.39Å; L645-V650 HydrophobicContact CD2-CG1 4.23Å; L645-N651 WeakPolarHBondContact O-CB 3.31Å
646	D	96.1	Very high	87.6	Confident	94 Å²	94	58.6 Å²	58.6	50%	0.503	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-7.2	-180	-57.4	-23	0	0	0	112.5	V642	V642-D646 VanDerWaalsContact CG1-OD2 3.24Å; V642-D646 WeakPolarHBondContact CG1-OD2 3.47Å; V642-D646 PolarHBondContact O-N 3.17Å
647	N	95.6	Very high	85.4	Confident	17 Å²	17	58.6 Å²	58.6	9%	0.091	33%	0.326	C	S	.	.	S	Bend	trans	-67.8	140.6	-176.7	-173.6	-82.4	0	0	0	112.4	L626 Q643 V644 L645 W649 V650 N651	L626-N647 HydrophobicContact CD1-CB 3.96Å; L626-N647 HydrophobicContact CD2-CB 4.38Å; Q643-N647 PolarHBondContact O-N 3.29Å; V644-N647 WeakPolarHBondContact O-CB 3.29Å; V644-N647 PolarHBondContact O-N 3.11Å; L645-N647 PolarHBondContact O-N 3.39Å; N647-W649 PolarHBondContact O-N 3.32Å; N647-W649 VanDerWaalsContact O-N 3.08Å; N647-W649 WeakPolarHBondContact OD1-CB 3.45Å; N647-W649 PolarHBondContact OD1-N 3.41Å; N647-V650 PolarHBondContact O-N 3.42Å; N647-N651 WeakPolarHBondContact O-CB 3.47Å; N647-N651 PolarHBondContact O-N 3.11Å
648	P	92.6	Very high	83.1	Confident	82 Å²	82	61.8 Å²	61.8	53%	0.532	34%	0.338	S	S	.	.	H	α-helix	trans	-56.3	-25.9	179.5	-28.6	36.4	0	0	0	116.3	V650 G652	P648-V650 VanDerWaalsContact C-N 3.31Å; P648-G652 VanDerWaalsContact O-CA 3.26Å; P648-G652 WeakPolarHBondContact O-CA 3.18Å; P648-G652 PolarHBondContact O-N 3.39Å; P648-G652 VanDerWaalsContact O-N 3.08Å
649	W	94.1	Very high	81.4	Confident	2 Å²	2	63.2 Å²	63.2	1%	0.008	35%	0.353	C	S	.	.	H	α-helix	trans	-74.7	-21.3	175	-167.5	79.8	0	0	0	113.2	E488 A491 S492 L495 T580 V584 A623 L626 N647 L655	E488-W649 HydrophobicContact CB-CZ2 4.1Å; E488-W649 HydrophobicContact CG-CZ2 4.34Å; E488-W649 PolarHBondContact OE2-NE1 2.74Å; A491-W649 HydrophobicContact CB-CH2 3.79Å; A491-W649 HydrophobicContact CB-CZ2 4.2Å; S492-W649 WeakPolarHBondContact CB-O 3.13Å; S492-W649 PolarHBondContact OG-O 3.12Å; L495-W649 HydrophobicContact CB-CZ3 4.26Å; L495-W649 HydrophobicContact CD2-CE3 4.22Å; L495-W649 HydrophobicContact CD2-CZ3 3.84Å; T580-W649 HydrophobicContact CG2-CH2 4.19Å; T580-W649 HydrophobicContact CG2-CZ3 4.04Å; V584-W649 HydrophobicContact CG2-CH2 4.35Å; V584-W649 HydrophobicContact CG2-CZ2 4.25Å; A623-W649 HydrophobicContact CB-CD2 4.28Å; A623-W649 HydrophobicContact CB-CG 4.33Å; A623-W649 HydrophobicContact CB-CZ2 4.17Å; L626-W649 HydrophobicContact CD2-CB 4.18Å; L626-W649 HydrophobicContact CD2-CD2 4.36Å; L626-W649 HydrophobicContact CD2-CE3 3.65Å; L626-W649 HydrophobicContact CD2-CZ3 4.41Å; N647-W649 PolarHBondContact O-N 3.32Å; N647-W649 VanDerWaalsContact O-N 3.08Å; N647-W649 WeakPolarHBondContact OD1-CB 3.45Å; N647-W649 PolarHBondContact OD1-N 3.41Å; W649-L655 HydrophobicContact CD2-CD1 4.4Å; W649-L655 HydrophobicContact CG-CD1 4.28Å; W649-L655 VanDerWaalsContact O-CD1 3.27Å; W649-L655 WeakPolarHBondContact O-CD1 3.35Å
650	V	93.5	Very high	80.1	Confident	14 Å²	14	67 Å²	67	9%	0.085	37%	0.372	C	S	.	.	H	α-helix	trans	-106.3	-36.6	-175.7	176.4	0	0	0	0	112	L495 F496 L626 V644 L645 N647 P648	L495-V650 HydrophobicContact CD2-CG2 3.87Å; L495-V650 HydrophobicContact CG-CG2 4.3Å; F496-V650 HydrophobicContact CB-CG1 3.99Å; F496-V650 HydrophobicContact CD2-CG1 3.81Å; F496-V650 HydrophobicContact CG-CG1 4.41Å; L626-V650 HydrophobicContact CD2-CG2 3.54Å; V644-V650 WeakPolarHBondContact O-CB 3.46Å; V644-V650 WeakPolarHBondContact O-CG2 3.47Å; L645-V650 HydrophobicContact CD2-CG1 4.23Å; N647-V650 PolarHBondContact O-N 3.42Å; P648-V650 VanDerWaalsContact C-N 3.31Å
651	N	88.4	Confident	79.3	Confident	109 Å²	109	70.4 Å²	70.4	58%	0.583	39%	0.385	S	S	*	.	H	α-helix	trans	-98.2	-16.8	-178.2	-156.4	17.3	0	0	0	113.3	L645 N647	L645-N651 WeakPolarHBondContact O-CB 3.31Å; N647-N651 WeakPolarHBondContact O-CB 3.47Å; N647-N651 PolarHBondContact O-N 3.11Å
652	G	72.1	Confident	78.5	Confident	23 Å²	23	71.3 Å²	71.3	24%	0.237	39%	0.389	C	S	.	.			trans	-89.3	119.4	-171.5	0	0	0	0	0	113.6	P648 S654	P648-G652 VanDerWaalsContact O-CA 3.26Å; P648-G652 WeakPolarHBondContact O-CA 3.18Å; P648-G652 PolarHBondContact O-N 3.39Å; P648-G652 VanDerWaalsContact O-N 3.08Å; G652-S654 PolarHBondContact O-N 3.08Å
653	D	57.4	Low	77.7	Confident	136 Å²	136	72.6 Å²	72.6	73%	0.727	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-17.5	169.6	-91.1	-47.5	0	0	0	114	R489 L655	R489-D653 PolarHBondContact NH1-O 2.85Å; R489-D653 VanDerWaalsContact NH1-O 3.11Å; R489-D653 IonicContact NH2-OD1 2.68Å; R489-D653 PolarHBondContact NH2-OD1 2.9Å; D653-L655 PolarHBondContact O-N 2.94Å; D653-L655 VanDerWaalsContact O-N 3.07Å
654	S	52.8	Low	77	Confident	105 Å²	105	68.3 Å²	68.3	73%	0.734	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-12.7	179.9	40.1	0	0	0	0	116	G652 S656	G652-S654 PolarHBondContact O-N 3.08Å; S654-S656 VanDerWaalsContact C-N 3.29Å; S654-S656 PolarHBondContact O-N 3.14Å
655	L	62.8	Low	76	Confident	30 Å²	30	69.8 Å²	69.8	16%	0.157	40%	0.398	C	S	.	.	S	Bend	trans	-71.3	83.2	167.7	-72.3	-174.9	0	0	0	110.8	R489 W649 D653 E657	R489-L655 HydrophobicContact CB-CB 4.38Å; R489-L655 WeakPolarHBondContact CD-O 3.37Å; R489-L655 HydrophobicContact CG-CB 4.37Å; R489-L655 PolarHBondContact NH1-O 3.4Å; W649-L655 HydrophobicContact CD2-CD1 4.4Å; W649-L655 HydrophobicContact CG-CD1 4.28Å; W649-L655 VanDerWaalsContact O-CD1 3.27Å; W649-L655 WeakPolarHBondContact O-CD1 3.35Å; D653-L655 PolarHBondContact O-N 2.94Å; D653-L655 VanDerWaalsContact O-N 3.07Å; L655-E657 PolarHBondContact O-N 3.04Å
656	S	53.4	Low	75	Confident	74 Å²	74	72 Å²	72	52%	0.517	42%	0.424	S	S	.	.			trans	-49.2	133.4	-179	179	0	0	0	0	113.5	S654 K658 G659	S654-S656 VanDerWaalsContact C-N 3.29Å; S654-S656 PolarHBondContact O-N 3.14Å; S656-K658 PolarHBondContact O-N 2.99Å; S656-K658 PolarHBondContact OG-N 3.42Å; S656-G659 PolarHBondContact O-N 3.21Å
657	E	51.4	Low	74.3	Confident	145 Å²	145	69.5 Å²	69.5	68%	0.678	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-12.8	173.2	-62.8	-170.8	142.9	0	0	113.8	R485 L655 G659	R485-E657 PolarHBondContact NH1-O 3.01Å; R485-E657 PolarHBondContact NH2-O 3.4Å; L655-E657 PolarHBondContact O-N 3.04Å; E657-G659 VanDerWaalsContact C-N 3.33Å
658	K	49.8	Very low	73.7	Confident	190 Å²	190	68.7 Å²	68.7	83%	0.826	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	12.9	174	-62.5	-176.6	-179.1	177.2	0	113.3	S656	S656-K658 PolarHBondContact O-N 2.99Å; S656-K658 PolarHBondContact OG-N 3.42Å
659	G	61.1	Low	72.9	Confident	30 Å²	30	69.8 Å²	69.8	31%	0.309	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-53.6	149.8	174.6	0	0	0	0	0	113.4	R485 S656 E657	R485-G659 PolarHBondContact NH2-O 3.46Å; S656-G659 PolarHBondContact O-N 3.21Å; E657-G659 VanDerWaalsContact C-N 3.33Å
660	H	71.8	Confident	72.2	Confident	143 Å²	143	77.4 Å²	77.4	66%	0.662	43%	0.434	S	S	*	.	P	Polyproline II helix	trans	-59.4	143.1	179.3	-68.3	-78	0	0	0	111.3	L662	H660-L662 PolarHBondContact O-N 3.2Å
661	Q	81.6	Confident	71.3	Confident	121 Å²	121	80.2 Å²	80.2	57%	0.565	45%	0.446	S	S	*	.	P	Polyproline II helix	trans	-72.4	122.6	175.5	178.3	163.7	4.9	0	0	110	S484 Y486	S484-Q661 PolarHBondContact O-NE2 2.89Å; Y486-Q661 CarbonylContact O-C 3.55Å; Y486-Q661 WeakPolarHBondContact O-CA 3.43Å
662	L	81.3	Confident	70.6	Confident	21 Å²	21	77.5 Å²	77.5	11%	0.11	43%	0.429	C	S	.	.	P	Polyproline II helix	trans	-77.9	125.2	178.4	-61.3	175.3	0	0	0	109.8	Y486 E488 V619 H660 V664	Y486-L662 HydrophobicContact CD1-CB 4.2Å; Y486-L662 HydrophobicContact CD1-CD1 4.41Å; Y486-L662 HydrophobicContact CE1-CD1 4.16Å; Y486-L662 PolarHBondContact O-N 2.68Å; E488-L662 HydrophobicContact CG-CD1 4.04Å; E488-L662 HydrophobicContact CG-CD2 4.38Å; V619-L662 HydrophobicContact CG2-CD2 4.41Å; H660-L662 PolarHBondContact O-N 3.2Å; L662-V664 HydrophobicContact CB-CG2 3.37Å; L662-V664 HydrophobicContact CD1-CG2 4.47Å; L662-V664 PolarHBondContact O-N 2.66Å
663	A	82	Confident	69.8	Low	83 Å²	83	83.6 Å²	83.6	69%	0.686	46%	0.456	S	S	*	.			trans	-79.1	62.9	178.6	0	0	0	0	0	112.1	K667	A663-K667 WeakPolarHBondContact O-CD 3.44Å; A663-K667 WeakPolarHBondContact O-CE 3.45Å
664	V	83.1	Confident	69.8	Low	1 Å²	1	79 Å²	79	1%	0.006	43%	0.429	C	S	.	.			trans	-94.3	-47.6	-169.9	-164.1	0	0	0	0	112.9	I480 Y486 V584 L662 G666 K667 I668	I480-V664 HydrophobicContact CG2-CB 4.3Å; I480-V664 HydrophobicContact CG2-CG1 4.25Å; Y486-V664 HydrophobicContact CD1-CB 4.39Å; Y486-V664 HydrophobicContact CD1-CG2 3.82Å; Y486-V664 HydrophobicContact CE1-CB 4.46Å; Y486-V664 HydrophobicContact CE1-CG2 3.83Å; V584-V664 WeakPolarHBondContact O-CG2 3.34Å; L662-V664 HydrophobicContact CB-CG2 3.37Å; L662-V664 HydrophobicContact CD1-CG2 4.47Å; L662-V664 PolarHBondContact O-N 2.66Å; V664-G666 VanDerWaalsContact C-N 3.35Å; V664-G666 PolarHBondContact O-N 3.08Å; V664-K667 WeakPolarHBondContact O-CB 3.3Å; V664-K667 PolarHBondContact O-N 2.89Å; V664-I668 HydrophobicContact CG1-CD1 3.54Å; V664-I668 HydrophobicContact CG1-CG1 3.98Å; V664-I668 PolarHBondContact O-N 2.82Å; V664-I668 VanDerWaalsContact O-N 3.11Å
665	A	78.3	Confident	69.4	Low	33 Å²	33	76 Å²	76	27%	0.273	42%	0.415	S	S	.	.	H	α-helix	trans	-58.6	-37.5	-164.2	0	0	0	0	0	114.9	T481 K667 K669	T481-A665 HydrophobicContact CG2-CB 4.21Å; A665-K667 VanDerWaalsContact C-N 3.33Å; A665-K667 PolarHBondContact O-N 2.82Å; A665-K669 WeakPolarHBondContact O-CG 3.43Å; A665-K669 PolarHBondContact O-N 3.25Å
666	G	75.8	Confident	68.3	Low	60 Å²	60	80.9 Å²	80.9	62%	0.619	45%	0.449	S	S	*	.	H	α-helix	trans	-68.3	-30.4	176.6	0	0	0	0	0	113.6	V664 K670	V664-G666 VanDerWaalsContact C-N 3.35Å; V664-G666 PolarHBondContact O-N 3.08Å; G666-K670 PolarHBondContact O-N 2.92Å
667	K	82	Confident	68.3	Low	40 Å²	40	81.9 Å²	81.9	17%	0.174	44%	0.444	C	S	.	.	H	α-helix	trans	-77.7	-40.2	177.8	-59.6	167.9	175.9	172.2	0	111.5	C585 G586 F587 A663 V664 A665 K669 K670 H671	C585-K667 WeakPolarHBondContact O-CD 3.45Å; C585-K667 WeakPolarHBondContact O-CE 3.21Å; C585-K667 PolarHBondContact O-NZ 2.86Å; G586-K667 CarbonylContact O-C 3.58Å; F587-K667 HydrophobicContact CD1-CD 4.25Å; A663-K667 WeakPolarHBondContact O-CD 3.44Å; A663-K667 WeakPolarHBondContact O-CE 3.45Å; V664-K667 WeakPolarHBondContact O-CB 3.3Å; V664-K667 PolarHBondContact O-N 2.89Å; A665-K667 VanDerWaalsContact C-N 3.33Å; A665-K667 PolarHBondContact O-N 2.82Å; K667-K669 VanDerWaalsContact C-N 3.34Å; K667-K669 PolarHBondContact O-N 2.97Å; K667-K670 PolarHBondContact O-N 3.36Å; K667-K670 VanDerWaalsContact O-N 3.11Å; K667-H671 WeakPolarHBondContact O-CB 3.48Å; K667-H671 PolarHBondContact O-N 2.87Å
668	I	82.1	Confident	67.7	Low	0 Å²	0	82.6 Å²	82.6	0%	0	45%	0.451	C	S	.	.	H	α-helix	trans	-56.6	-49.5	173.8	-71.7	172.4	0	0	0	110	F477 I480 T481 G586 V664 K670 H671 F672	F477-I668 HydrophobicContact CB-CG2 3.87Å; F477-I668 HydrophobicContact CD1-CD1 3.93Å; F477-I668 HydrophobicContact CD1-CG1 4.48Å; F477-I668 HydrophobicContact CD1-CG2 4.02Å; F477-I668 HydrophobicContact CD2-CG2 3.95Å; F477-I668 HydrophobicContact CE1-CD1 4.2Å; F477-I668 HydrophobicContact CE2-CG2 4.48Å; F477-I668 HydrophobicContact CG-CG2 3.68Å; I480-I668 HydrophobicContact CB-CD1 4.14Å; I480-I668 HydrophobicContact CD1-CD1 3.9Å; I480-I668 HydrophobicContact CG2-CD1 3.77Å; T481-I668 HydrophobicContact CG2-CB 4.34Å; T481-I668 HydrophobicContact CG2-CG2 4.03Å; G586-I668 PolarHBondContact O-N 2.89Å; V664-I668 HydrophobicContact CG1-CD1 3.54Å; V664-I668 HydrophobicContact CG1-CG1 3.98Å; V664-I668 PolarHBondContact O-N 2.82Å; V664-I668 VanDerWaalsContact O-N 3.11Å; I668-K670 VanDerWaalsContact C-N 3.27Å; I668-K670 PolarHBondContact O-N 2.77Å; I668-H671 PolarHBondContact O-N 3.03Å; I668-F672 HydrophobicContact CG2-CD2 4.22Å; I668-F672 PolarHBondContact O-N 2.81Å
669	K	76.3	Confident	67.1	Low	106 Å²	106	80 Å²	80	46%	0.461	45%	0.446	S	S	.	.	H	α-helix	trans	-58	-38.2	176.8	-70.8	179.9	-178.3	179	0	112.7	T481 A665 K667 N673	T481-K669 HydrophobicContact CG2-CG 4.17Å; A665-K669 WeakPolarHBondContact O-CG 3.43Å; A665-K669 PolarHBondContact O-N 3.25Å; K667-K669 VanDerWaalsContact C-N 3.34Å; K667-K669 PolarHBondContact O-N 2.97Å; K669-N673 PolarHBondContact O-N 3.16Å
670	K	79.5	Confident	66.5	Low	161 Å²	161	80.7 Å²	80.7	70%	0.7	45%	0.454	S	S	*	.	H	α-helix	trans	-72.4	-36.9	177.2	-176.9	179.6	178	-177.7	0	113.9	G666 K667 I668	G666-K670 PolarHBondContact O-N 2.92Å; K667-K670 PolarHBondContact O-N 3.36Å; K667-K670 VanDerWaalsContact O-N 3.11Å; I668-K670 VanDerWaalsContact C-N 3.27Å; I668-K670 PolarHBondContact O-N 2.77Å
671	H	74.2	Confident	65.4	Low	73 Å²	73	76.4 Å²	76.4	34%	0.338	44%	0.437	S	S	.	.	H	α-helix	trans	-95.4	-21.1	-172	-80.3	-62.4	0	0	0	114.6	R591 K667 I668	R591-H671 PolarHBondContact NH1-CE1 2.89Å; R591-H671 PolarHBondContact NH2-CE1 2.97Å; R591-H671 PolarHBondContact NH2-NE2 2.97Å; K667-H671 WeakPolarHBondContact O-CB 3.48Å; K667-H671 PolarHBondContact O-N 2.87Å; I668-H671 PolarHBondContact O-N 3.03Å
672	F	74.3	Confident	64.1	Low	52 Å²	52	73.5 Å²	73.5	23%	0.228	43%	0.434	C	S	.	.	S	Bend	trans	-118.2	13.2	-179.6	-59.2	-84.7	0	0	0	113.1	F477 I582 I668 Y674	F477-F672 HydrophobicContact CD2-CB 4.35Å; F477-F672 HydrophobicContact CD2-CD2 4.37Å; F477-F672 HydrophobicContact CD2-CG 4.22Å; F477-F672 HydrophobicContact CE2-CB 4.14Å; F477-F672 AromaticContact CE2-CD1 3.71Å; F477-F672 HydrophobicContact CE2-CD1 3.71Å; F477-F672 AromaticContact CE2-CD2 3.66Å; F477-F672 HydrophobicContact CE2-CD2 3.66Å; F477-F672 AromaticContact CE2-CE1 3.96Å; F477-F672 HydrophobicContact CE2-CE1 3.96Å; F477-F672 AromaticContact CE2-CE2 3.93Å; F477-F672 HydrophobicContact CE2-CE2 3.93Å; F477-F672 AromaticContact CE2-CG 3.55Å; F477-F672 HydrophobicContact CE2-CG 3.55Å; F477-F672 HydrophobicContact CE2-CZ 4.07Å; F477-F672 HydrophobicContact CZ-CD1 4.35Å; F477-F672 AromaticContact CZ-CD2 3.98Å; F477-F672 HydrophobicContact CZ-CD2 3.98Å; F477-F672 HydrophobicContact CZ-CE1 4.16Å; F477-F672 AromaticContact CZ-CE2 3.79Å; F477-F672 HydrophobicContact CZ-CE2 3.79Å; F477-F672 HydrophobicContact CZ-CG 4.26Å; F477-F672 AromaticContact CZ-CZ 3.88Å; F477-F672 HydrophobicContact CZ-CZ 3.88Å; I582-F672 HydrophobicContact CD1-CZ 4.01Å; I582-F672 HydrophobicContact CG1-CZ 4.31Å; I582-F672 HydrophobicContact CG2-CE2 3.81Å; I582-F672 HydrophobicContact CG2-CZ 3.92Å; I668-F672 HydrophobicContact CG2-CD2 4.22Å; I668-F672 PolarHBondContact O-N 2.81Å; F672-Y674 PolarHBondContact O-N 2.82Å; F672-Y674 VanDerWaalsContact O-N 3.09Å
673	N	55.7	Low	63	Low	151 Å²	151	73.2 Å²	73.2	81%	0.807	44%	0.435	S	S	*	.			trans	46.9	39.5	179.3	-74.2	-24.3	0	0	0	113.9	K669 G675	K669-N673 PolarHBondContact O-N 3.16Å; N673-G675 PolarHBondContact O-N 2.91Å; N673-G675 VanDerWaalsContact O-N 3.09Å
674	Y	56.3	Low	62.2	Low	39 Å²	39	69.4 Å²	69.4	15%	0.153	40%	0.403	C	S	.	.			trans	-80.2	98.6	-164.4	-160.3	-89.5	0	0	0	112.7	D475 F477 D478 F672 K677	D475-Y674 PolarHBondContact OD2-OH 3.41Å; F477-Y674 HydrophobicContact CB-CD2 4.35Å; F477-Y674 HydrophobicContact CB-CE2 4.37Å; D478-Y674 WeakPolarHBondContact OD1-CE1 3.45Å; D478-Y674 PolarHBondContact OD1-OH 2.76Å; D478-Y674 PolarHBondContact OD2-OH 3.26Å; F672-Y674 PolarHBondContact O-N 2.82Å; F672-Y674 VanDerWaalsContact O-N 3.09Å; Y674-K677 WeakPolarHBondContact OH-CD 2.78Å; Y674-K677 WeakPolarHBondContact OH-CE 3.41Å; Y674-K677 PolarHBondContact OH-NZ 3.46Å
675	G	44.9	Very low	62	Low	43 Å²	43	69.5 Å²	69.5	44%	0.443	40%	0.404	S	S	.	.			trans	-80.3	156.3	176.7	0	0	0	0	0	113.6	N673 K677	N673-G675 PolarHBondContact O-N 2.91Å; N673-G675 VanDerWaalsContact O-N 3.09Å; G675-K677 PolarHBondContact O-N 3.41Å; G675-K677 VanDerWaalsContact O-N 3.1Å
676	P	40.3	Very low	62.1	Low	133 Å²	133	71.8 Å²	71.8	86%	0.864	42%	0.418	S	S	*	.			trans	-69.6	106.6	179.8	28.6	-34	0	0	0	111.6	L678	P676-L678 PolarHBondContact O-N 3.3Å
677	K	53.2	Low	62.2	Low	95 Å²	95	69.2 Å²	69.2	41%	0.413	39%	0.39	S	S	.	.			trans	-65	126.3	170.3	-64.9	177	-173.1	155.3	0	109.8	D475 D478 Y674 G675 N679 A683	D475-K677 IonicContact OD2-NZ 2.62Å; D475-K677 PolarHBondContact OD2-NZ 2.72Å; D478-K677 IonicContact OD2-NZ 2.72Å; D478-K677 PolarHBondContact OD2-NZ 3.38Å; D478-K677 VanDerWaalsContact OD2-NZ 3.08Å; Y674-K677 WeakPolarHBondContact OH-CD 2.78Å; Y674-K677 WeakPolarHBondContact OH-CE 3.41Å; Y674-K677 PolarHBondContact OH-NZ 3.46Å; G675-K677 PolarHBondContact O-N 3.41Å; G675-K677 VanDerWaalsContact O-N 3.1Å; K677-N679 PolarHBondContact O-N 2.78Å; K677-A683 HydrophobicContact CD-CB 4.11Å
678	L	37.5	Very low	62.1	Low	160 Å²	160	67.3 Å²	67.3	84%	0.838	38%	0.382	S	S	*	.			trans	-71.5	117.6	177.8	-83.2	159.2	0	0	0	111.7	P676	P676-L678 PolarHBondContact O-N 3.3Å
679	N	38.7	Very low	62	Low	135 Å²	135	68 Å²	68	72%	0.722	39%	0.386	S	S	*	.	S	Bend	trans	47.8	74.7	159.8	-64.1	-3.1	0	0	0	118.2	K677 T681	K677-N679 PolarHBondContact O-N 2.78Å; N679-T681 PolarHBondContact O-N 3.24Å; N679-T681 PolarHBondContact O-OG1 3.28Å
680	G	48.9	Very low	62.3	Low	45 Å²	45	64.5 Å²	64.5	46%	0.464	37%	0.374	S	S	.	.	S	Bend	trans	61.7	-2	137.7	0	0	0	0	0	120.2
681	T	47.4	Very low	62.4	Low	52 Å²	52	56.9 Å²	56.9	32%	0.319	34%	0.34	S	S	.	.	S	Bend	trans	-111	-31.6	-170.1	-44.5	0	0	0	0	112	L399 N679 V685	L399-T681 HydrophobicContact CD2-CG2 3.64Å; N679-T681 PolarHBondContact O-N 3.24Å; N679-T681 PolarHBondContact O-OG1 3.28Å; T681-V685 WeakPolarHBondContact O-CG2 3.18Å
682	A	54	Low	62.6	Low	60 Å²	60	53.5 Å²	53.5	50%	0.496	33%	0.325	S	S	.	.	S	Bend	trans	-95.7	-16	-177.3	0	0	0	0	0	114.3	G684 V685	A682-G684 PolarHBondContact O-N 2.74Å; A682-V685 WeakPolarHBondContact O-CB 3.34Å; A682-V685 PolarHBondContact O-N 2.82Å
683	A	58.9	Low	62.8	Low	16 Å²	16	51.2 Å²	51.2	13%	0.132	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-31.1	-161	0	0	0	0	0	114.3	K677	K677-A683 HydrophobicContact CD-CB 4.11Å
684	G	64.9	Low	64	Low	2 Å²	2	45.9 Å²	45.9	2%	0.021	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-5.6	168.9	0	0	0	0	0	115.1	A682	A682-G684 PolarHBondContact O-N 2.74Å
685	V	79.8	Confident	65	Low	4 Å²	4	44.3 Å²	44.3	2%	0.024	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-31	-167.4	-179.8	0	0	0	0	112.4	L399 V407 T681 A682 I687 I688 T689	L399-V685 HydrophobicContact CB-CB 4.48Å; L399-V685 HydrophobicContact CB-CG1 3.77Å; L399-V685 HydrophobicContact CB-CG2 3.87Å; L399-V685 HydrophobicContact CD1-CG2 4.28Å; V407-V685 HydrophobicContact CB-CG1 4.19Å; V407-V685 HydrophobicContact CG1-CG1 4.13Å; T681-V685 WeakPolarHBondContact O-CG2 3.18Å; A682-V685 WeakPolarHBondContact O-CB 3.34Å; A682-V685 PolarHBondContact O-N 2.82Å; V685-I687 VanDerWaalsContact C-N 3.3Å; V685-I687 PolarHBondContact O-N 2.71Å; V685-I688 CarbonylContact O-C 3.56Å; V685-I688 WeakPolarHBondContact O-CA 3.44Å; V685-I688 PolarHBondContact O-N 3.27Å; V685-T689 HydrophobicContact CG1-CG2 4.04Å; V685-T689 PolarHBondContact O-N 3.48Å; V685-T689 PolarHBondContact O-OG1 2.95Å
686	S	78.7	Confident	66	Low	80 Å²	80	46.5 Å²	46.5	56%	0.559	28%	0.279	S	S	*	.	H	α-helix	trans	-55.3	-44.6	-178.4	-170.9	0	0	0	0	112.4	I688 T689 T690	S686-I688 PolarHBondContact O-N 3.31Å; S686-T689 WeakPolarHBondContact CA-OG1 3.36Å; S686-T689 PolarHBondContact O-N 2.87Å; S686-T689 PolarHBondContact O-OG1 3.42Å; S686-T690 PolarHBondContact O-N 2.92Å; S686-T690 VanDerWaalsContact O-N 3.12Å; S686-T690 PolarHBondContact O-OG1 3.48Å
687	I	78.4	Confident	67	Low	6 Å²	6	49.6 Å²	49.6	3%	0.031	28%	0.279	C	S	.	.	H	α-helix	trans	-56.8	-33.6	172.3	-73.9	177.3	0	0	0	113.4	E518 N519 L521 D536 V685 T690	E518-I687 VanDerWaalsContact O-CD1 3.29Å; E518-I687 WeakPolarHBondContact O-CD1 3.46Å; E518-I687 WeakPolarHBondContact O-CG1 3.43Å; N519-I687 VanDerWaalsContact CA-CD1 3.5Å; L521-I687 HydrophobicContact CD1-CD1 3.86Å; L521-I687 HydrophobicContact CD2-CD1 3.48Å; L521-I687 VanDerWaalsContact CD2-CD1 3.48Å; L521-I687 HydrophobicContact CG-CD1 3.44Å; L521-I687 VanDerWaalsContact CG-CD1 3.44Å; D536-I687 HydrophobicContact CB-CG2 4.15Å; V685-I687 VanDerWaalsContact C-N 3.3Å; V685-I687 PolarHBondContact O-N 2.71Å; I687-T690 PolarHBondContact O-OG1 3.31Å; I687-T690 VanDerWaalsContact O-OG1 3.07Å
688	I	80.2	Confident	67.4	Low	0 Å²	0	47.7 Å²	47.7	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-87.3	-29.6	-175.9	-53.2	-179.3	0	0	0	109.6	V407 A420 K422 M468 V685 S686	V407-I688 HydrophobicContact CG1-CB 4.33Å; V407-I688 HydrophobicContact CG1-CG2 3.84Å; V407-I688 HydrophobicContact CG2-CB 4.15Å; V407-I688 HydrophobicContact CG2-CG2 3.75Å; V407-I688 WeakPolarHBondContact CG2-O 3.22Å; A420-I688 HydrophobicContact CB-CD1 3.58Å; A420-I688 HydrophobicContact CB-CG2 4.11Å; K422-I688 HydrophobicContact CB-CG2 3.96Å; K422-I688 HydrophobicContact CD-CG2 4.29Å; K422-I688 WeakPolarHBondContact CD-O 3.46Å; K422-I688 WeakPolarHBondContact CE-O 3.25Å; K422-I688 HydrophobicContact CG-CG2 4.41Å; K422-I688 WeakPolarHBondContact CG-O 3.28Å; K422-I688 PolarHBondContact NZ-O 2.84Å; M468-I688 HydrophobicContact SD-CG2 3.98Å; V685-I688 CarbonylContact O-C 3.56Å; V685-I688 WeakPolarHBondContact O-CA 3.44Å; V685-I688 PolarHBondContact O-N 3.27Å; S686-I688 PolarHBondContact O-N 3.31Å
689	T	80.4	Confident	68.4	Low	16 Å²	16	42.8 Å²	42.8	10%	0.098	25%	0.248	C	C	.	.	H	α-helix	trans	-73.1	-30.6	173.7	45.8	0	0	0	0	113.7	G400 V407 V685 S686	G400-T689 VanDerWaalsContact C-CG2 3.46Å; V407-T689 HydrophobicContact CB-CG2 3.93Å; V407-T689 HydrophobicContact CG2-CG2 3.5Å; V685-T689 HydrophobicContact CG1-CG2 4.04Å; V685-T689 PolarHBondContact O-N 3.48Å; V685-T689 PolarHBondContact O-OG1 2.95Å; S686-T689 WeakPolarHBondContact CA-OG1 3.36Å; S686-T689 PolarHBondContact O-N 2.87Å; S686-T689 PolarHBondContact O-OG1 3.42Å
690	T	82.4	Confident	69.4	Low	32 Å²	32	39.4 Å²	39.4	20%	0.196	23%	0.227	C	C	.	.			trans	-68.2	142.1	179.3	41.8	0	0	0	0	111.9	K422 D536 S686 I687	K422-T690 WeakPolarHBondContact CE-O 3.49Å; K422-T690 PolarHBondContact NZ-O 2.99Å; D536-T690 WeakPolarHBondContact OD2-CB 3.42Å; D536-T690 PolarHBondContact OD2-OG1 3.19Å; S686-T690 PolarHBondContact O-N 2.92Å; S686-T690 VanDerWaalsContact O-N 3.12Å; S686-T690 PolarHBondContact O-OG1 3.48Å; I687-T690 PolarHBondContact O-OG1 3.31Å; I687-T690 VanDerWaalsContact O-OG1 3.07Å
691	T	81	Confident	69.1	Low	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.249	C	C	.	.			trans	-120.6	162.3	173.1	71.7	0	0	0	0	110.6	F404 A405 L693 D694	F404-T691 HydrophobicContact CB-CG2 3.95Å; F404-T691 WeakPolarHBondContact CD2-OG1 3.39Å; A405-T691 HydrophobicContact CB-CG2 3.64Å; T691-L693 PolarHBondContact O-N 3.42Å; T691-L693 PolarHBondContact OG1-N 3Å; T691-D694 WeakPolarHBondContact CB-OD2 3.25Å; T691-D694 PolarHBondContact N-OD2 3.05Å; T691-D694 PolarHBondContact O-N 2.85Å; T691-D694 PolarHBondContact OG1-OD2 2.78Å
692	P	78.5	Confident	68.4	Low	3 Å²	3	48.1 Å²	48.1	2%	0.019	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-46.8	-28	167.2	-29.6	30.6	0	0	0	114.9	M435 I436 E439 G538 K695	M435-P692 HydrophobicContact CB-CB 3.83Å; M435-P692 HydrophobicContact CE-CB 4.08Å; M435-P692 VanDerWaalsContact CE-O 3.26Å; M435-P692 WeakPolarHBondContact CE-O 3.46Å; I436-P692 HydrophobicContact CD1-CB 4.46Å; I436-P692 HydrophobicContact CD1-CG 4.08Å; E439-P692 HydrophobicContact CB-CG 3.82Å; E439-P692 HydrophobicContact CG-CG 4.35Å; E439-P692 WeakPolarHBondContact OE2-CD 3.46Å; E439-P692 WeakPolarHBondContact OE2-CG 3.19Å; G538-P692 WeakPolarHBondContact O-CA 3.37Å; G538-P692 WeakPolarHBondContact O-CB 3.46Å; P692-K695 WeakPolarHBondContact O-CB 3.44Å; P692-K695 PolarHBondContact O-N 3.32Å
693	L	79	Confident	67.3	Low	4 Å²	4	54.5 Å²	54.5	2%	0.021	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-30.8	-176.3	-50.7	-173.9	0	0	0	112	F404 C429 K432 M435 I436 T691 K695 E696	F404-L693 HydrophobicContact CB-CD1 4.46Å; F404-L693 HydrophobicContact CD1-CB 4.12Å; F404-L693 HydrophobicContact CD1-CD1 3.54Å; F404-L693 HydrophobicContact CD1-CG 4.44Å; F404-L693 HydrophobicContact CD2-CB 3.6Å; F404-L693 HydrophobicContact CD2-CD1 4.45Å; F404-L693 HydrophobicContact CE1-CB 4.02Å; F404-L693 HydrophobicContact CE1-CD1 3.82Å; F404-L693 HydrophobicContact CE2-CB 3.5Å; F404-L693 VanDerWaalsContact CE2-CB 3.5Å; F404-L693 HydrophobicContact CG-CB 3.92Å; F404-L693 HydrophobicContact CG-CD1 3.9Å; F404-L693 HydrophobicContact CG-CG 4.43Å; F404-L693 HydrophobicContact CZ-CB 3.72Å; F404-L693 HydrophobicContact CZ-CD1 4.4Å; C429-L693 HydrophobicContact CB-CD1 3.98Å; K432-L693 HydrophobicContact CB-CD1 4.43Å; K432-L693 HydrophobicContact CB-CD2 3.56Å; K432-L693 HydrophobicContact CD-CD2 3.84Å; K432-L693 HydrophobicContact CG-CD2 4.35Å; M435-L693 HydrophobicContact CB-CD2 3.97Å; M435-L693 HydrophobicContact CE-CD2 4.12Å; M435-L693 HydrophobicContact CG-CD2 4.31Å; M435-L693 HydrophobicContact SD-CD2 3.59Å; M435-L693 VanDerWaalsContact SD-CD2 3.59Å; I436-L693 HydrophobicContact CD1-CD1 4.24Å; I436-L693 HydrophobicContact CD1-CG 3.99Å; T691-L693 PolarHBondContact O-N 3.42Å; T691-L693 PolarHBondContact OG1-N 3Å; L693-K695 PolarHBondContact O-N 2.65Å; L693-E696 PolarHBondContact O-N 2.72Å
694	D	79.9	Confident	65.8	Low	38 Å²	38	65.6 Å²	65.6	20%	0.203	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-67.3	-24.6	172.1	-57.5	-76.2	0	0	0	111.9	N403 T691 E696	N403-D694 PolarHBondContact ND2-OD1 3.33Å; T691-D694 WeakPolarHBondContact CB-OD2 3.25Å; T691-D694 PolarHBondContact N-OD2 3.05Å; T691-D694 PolarHBondContact O-N 2.85Å; T691-D694 PolarHBondContact OG1-OD2 2.78Å; D694-E696 VanDerWaalsContact C-N 3.28Å; D694-E696 PolarHBondContact O-N 2.77Å
695	K	77.5	Confident	64.3	Low	6 Å²	6	73.6 Å²	73.6	3%	0.026	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-75.8	-6	-179.8	-54.1	-73.9	-176.7	177	0	114	D514 D536 L539 P692 L693 K697 Q698 V699	D514-K695 IonicContact OD2-NZ 2.6Å; D514-K695 PolarHBondContact OD2-NZ 3.34Å; D536-K695 VanDerWaalsContact CG-CE 3.47Å; D536-K695 WeakPolarHBondContact OD1-CE 3.42Å; D536-K695 IonicContact OD1-NZ 3.5Å; D536-K695 PolarHBondContact OD1-NZ 3.43Å; D536-K695 WeakPolarHBondContact OD2-CE 3.18Å; D536-K695 IonicContact OD2-NZ 2.72Å; D536-K695 PolarHBondContact OD2-NZ 3.46Å; L539-K695 HydrophobicContact CD1-CB 4.22Å; L539-K695 HydrophobicContact CD1-CD 4.17Å; L539-K695 HydrophobicContact CD1-CG 4.4Å; L539-K695 HydrophobicContact CD2-CB 3.81Å; L539-K695 HydrophobicContact CD2-CG 4.32Å; L539-K695 HydrophobicContact CG-CB 3.89Å; L539-K695 HydrophobicContact CG-CD 4.11Å; L539-K695 HydrophobicContact CG-CG 3.92Å; P692-K695 WeakPolarHBondContact O-CB 3.44Å; P692-K695 PolarHBondContact O-N 3.32Å; L693-K695 PolarHBondContact O-N 2.65Å; K695-K697 PolarHBondContact O-N 3.48Å; K695-K697 VanDerWaalsContact O-N 3.1Å; K695-Q698 WeakPolarHBondContact O-CA 3.48Å; K695-Q698 WeakPolarHBondContact O-CB 3.44Å; K695-Q698 PolarHBondContact O-N 2.71Å; K695-V699 PolarHBondContact O-N 3.36Å
696	E	67.2	Low	61.9	Low	90 Å²	90	81.7 Å²	81.7	42%	0.421	38%	0.375	S	S	.	.	G	3₁₀ helix	trans	-57.3	-28.8	179.5	-77.7	-168	150.5	0	0	113.5	K432 L693 D694 Q698 V699	K432-E696 WeakPolarHBondContact CE-OE1 3.48Å; K432-E696 IonicContact NZ-OE1 2.73Å; K432-E696 PolarHBondContact NZ-OE1 3.01Å; K432-E696 IonicContact NZ-OE2 3.49Å; K432-E696 PolarHBondContact NZ-OE2 3.03Å; L693-E696 PolarHBondContact O-N 2.72Å; D694-E696 VanDerWaalsContact C-N 3.28Å; D694-E696 PolarHBondContact O-N 2.77Å; E696-Q698 VanDerWaalsContact C-N 3.27Å; E696-Q698 PolarHBondContact O-N 2.83Å; E696-V699 PolarHBondContact O-N 2.8Å
697	K	59.9	Low	59.5	Low	197 Å²	197	85.4 Å²	85.4	86%	0.857	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	-72.1	-18.6	174.2	-65.1	-179.4	-177.9	175	0	113.9	K695	K695-K697 PolarHBondContact O-N 3.48Å; K695-K697 VanDerWaalsContact O-N 3.1Å
698	Q	62.4	Low	57.1	Low	55 Å²	55	91.6 Å²	91.6	26%	0.257	43%	0.427	S	S	.	.	G	3₁₀ helix	trans	-96.4	0.6	176.9	-67.2	169.5	2.5	0	0	111.9	C551 G552 K695 E696	C551-Q698 WeakPolarHBondContact CA-O 3.33Å; G552-Q698 PolarHBondContact N-O 3.33Å; K695-Q698 WeakPolarHBondContact O-CA 3.48Å; K695-Q698 WeakPolarHBondContact O-CB 3.44Å; K695-Q698 PolarHBondContact O-N 2.71Å; E696-Q698 VanDerWaalsContact C-N 3.27Å; E696-Q698 PolarHBondContact O-N 2.83Å
699	V	57.8	Low	54.7	Low	57 Å²	57	100.6 Å²	100.6	35%	0.345	47%	0.466	S	S	.	.	B	Isolated β-bridge	trans	-98.4	101.4	171.5	-178.1	0	0	0	0	108.6	L539 V550 C551 K695 E696 R701	L539-V699 HydrophobicContact CD2-CG2 4.27Å; V550-V699 CarbonylContact O-C 3.1Å; V550-V699 WeakPolarHBondContact O-CA 2.99Å; C551-V699 HydrophobicContact CB-CG2 4.15Å; K695-V699 PolarHBondContact O-N 3.36Å; E696-V699 PolarHBondContact O-N 2.8Å; V699-R701 PolarHBondContact O-N 2.86Å
700	F	60.4	Low	52.2	Low	65 Å²	65	108 Å²	108	29%	0.285	50%	0.504	S	S	.	.			trans	-73	126.8	179	-58.4	-96.8	0	0	0	108.9	V550 P554 G702	V550-F700 HydrophobicContact CB-CB 3.99Å; V550-F700 HydrophobicContact CG1-CB 3.75Å; V550-F700 HydrophobicContact CG1-CD2 3.99Å; V550-F700 HydrophobicContact CG1-CG 4.16Å; V550-F700 PolarHBondContact O-N 2.97Å; P554-F700 HydrophobicContact CG-CE2 4.47Å; P554-F700 HydrophobicContact CG-CZ 3.81Å; F700-G702 PolarHBondContact O-N 3.26Å
701	R	41.4	Very low	49.6	Very low	244 Å²	244	111.4 Å²	111.4	92%	0.921	53%	0.529	S	S	*	.			trans	-80.8	86	178.9	-72	-171.3	176.1	-164.1	-1	110.3	V699	V699-R701 PolarHBondContact O-N 2.86Å
702	G	32.9	Very low	47	Very low	36 Å²	36	118 Å²	118	37%	0.371	57%	0.57	S	S	.	*			trans	-49.6	144.6	175	0	0	0	0	0	113.7	E564 F700 R704	E564-G702 WeakPolarHBondContact OE1-CA 3.39Å; F700-G702 PolarHBondContact O-N 3.26Å; G702-R704 PolarHBondContact O-N 3.47Å
703	R	32.2	Very low	44.5	Very low	194 Å²	194	126.8 Å²	126.8	73%	0.732	61%	0.611	S	S	*	*			trans	-80.1	113.7	173.9	-79.1	-175	171.9	-152.4	-1.4	108.3	H705	R703-H705 PolarHBondContact O-N 3.25Å
704	R	26.8	Very low	42	Very low	248 Å²	248	134.4 Å²	134.4	94%	0.936	65%	0.65	S	S	*	*			trans	-48.3	107.3	171.9	-71.8	-175.5	178.1	179.9	-1	111.2	G702	G702-R704 PolarHBondContact O-N 3.47Å
705	H	32.8	Very low	39.5	Very low	170 Å²	170	140.9 Å²	140.9	79%	0.787	68%	0.684	S	S	*	*			trans	-109.9	171.8	168.4	-102.8	-97.5	0	0	0	111.7	R703	R703-H705 PolarHBondContact O-N 3.25Å
706	Q	29.3	Very low	37.1	Very low	174 Å²	174	146.6 Å²	146.6	81%	0.813	72%	0.722	S	S	*	*			trans	-105	164.7	-158.6	-66.3	173.2	-13.2	0	0	113.1	V708	Q706-V708 PolarHBondContact O-N 3.24Å
707	D	28.4	Very low	35	Very low	159 Å²	159	147.4 Å²	147.4	85%	0.85	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-54.9	128.4	-175.7	-50.7	-97.8	0	0	0	113.9
708	V	29.5	Very low	33.4	Very low	136 Å²	136	143.9 Å²	143.9	82%	0.824	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-94.1	117.5	164.1	178.7	0	0	0	0	108.7	Q706	Q706-V708 PolarHBondContact O-N 3.24Å
709	K	29.1	Very low	31.7	Very low	188 Å²	188	144.5 Å²	144.5	82%	0.817	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-91.7	129.1	167.4	-75	-175	175.4	-178	0	110.1
710	L	28.7	Very low	30.2	Very low	171 Å²	171	146.4 Å²	146.4	90%	0.895	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-66.3	141.1	158.8	-78.2	79.5	0	0	0	109.3
711	S	26.8	Very low	28.5	Very low	104 Å²	104	148.8 Å²	148.8	73%	0.727	80%	0.801	S	S	*	*			trans	-134.9	106.2	173.8	58.8	0	0	0	0	110.1
712	T	26.2	Very low	27.8	Very low	139 Å²	139	142.9 Å²	142.9	85%	0.853	79%	0.792	S	S	*	*			trans	-60	132.9	171.4	-44	0	0	0	0	110.1
713	Q	26.6	Very low	27.5	Very low	188 Å²	188	147.2 Å²	147.2	88%	0.879	81%	0.811	S	S	*	*			trans	-86.4	134	173.4	-69.1	-171.6	-2.9	0	0	111.2
714	L	26	Very low	27.3	Very low	164 Å²	164	143.1 Å²	143.1	86%	0.859	81%	0.812	S	S	*	*			trans	-128	137.2	164.3	-82	166	0	0	0	107.4
715	L	27.7	Very low	27.3	Very low	173 Å²	173	140.5 Å²	140.5	91%	0.906	81%	0.811	S	S	*	*			trans	-78.9	140.6	-179.1	-67.2	103.5	0	0	0	111.7
716	P	27.6	Very low	27	Very low	127 Å²	127	141.5 Å²	141.5	83%	0.825	82%	0.818	S	S	*	*			trans	-85	145.9	155.1	-4	23.4	0	0	0	110.9
717	S	23	Very low	27	Very low	106 Å²	106	138.2 Å²	138.2	74%	0.741	82%	0.821	S	S	*	*			trans	-104.3	167.7	176.8	55.6	0	0	0	0	112.5
718	S	26.2	Very low	26.9	Very low	123 Å²	123	137.5 Å²	137.5	86%	0.86	82%	0.817	S	S	*	*			trans	63	140	161.6	53.8	0	0	0	0	119.2
719	G	26.1	Very low	27.6	Very low	69 Å²	69	136.5 Å²	136.5	71%	0.711	81%	0.813	S	S	*	*			cis	165.4	162.5	-9.5	0	0	0	0	0	113.7
720	A	25.7	Very low	27.6	Very low	97 Å²	97	132.8 Å²	132.8	80%	0.802	81%	0.806	S	S	*	*			trans	66.5	153.6	166.2	0	0	0	0	0	117.1
721	T	25.8	Very low	27.7	Very low	115 Å²	115	132.5 Å²	132.5	71%	0.706	80%	0.804	S	S	*	*			cis	-155.4	160.9	0.7	-15.8	0	0	0	0	110.7
722	T	26.4	Very low	28	Very low	119 Å²	119	132.4 Å²	132.4	73%	0.73	80%	0.803	S	S	*	*			trans	60.4	145	157.3	54.4	0	0	0	0	118.5
723	T	27.1	Very low	29	Very low	128 Å²	128	131 Å²	131	79%	0.785	80%	0.797	S	S	*	*			cis	-168.6	162.9	-3.6	21.4	0	0	0	0	107.7
724	S	26.6	Very low	29	Very low	108 Å²	108	131.3 Å²	131.3	76%	0.755	80%	0.798	S	S	*	*			cis	175.7	130.4	-29	178.7	0	0	0	0	107.6
725	E	27.1	Very low	29.3	Very low	193 Å²	193	130.5 Å²	130.5	90%	0.902	79%	0.794	S	S	*	*			trans	-145.7	165.3	167.3	-138.6	167.4	-148.4	0	0	111.9
726	M	28	Very low	29.3	Very low	190 Å²	190	131.9 Å²	131.9	94%	0.936	80%	0.796	S	S	*	*			trans	-104.2	138.4	-153	-58.5	178.2	179.6	0	0	115.4
727	A	29.1	Very low	29.4	Very low	105 Å²	105	133.5 Å²	133.5	87%	0.868	79%	0.792	S	S	*	*			trans	-161.2	141.4	137.9	0	0	0	0	0	110.9
728	N	26.6	Very low	29.5	Very low	144 Å²	144	134.9 Å²	134.9	77%	0.77	79%	0.79	S	S	*	*			trans	-143.5	149	172.3	-144.4	-13.1	0	0	0	105.7	V730	N728-V730 PolarHBondContact OD1-N 3.44Å
729	P	44.2	Very low	29.5	Very low	116 Å²	116	134 Å²	134	75%	0.753	78%	0.784	S	S	*	*				-149.9	143.6	76.3	37.7	-18.3	0	0	0	117.6
730	V	29.3	Very low	30.5	Very low	109 Å²	109	136.5 Å²	136.5	66%	0.661	79%	0.788	S	S	*	*				45.1	118.4	124.7	-171.7	0	0	0	0	119.8	N728	N728-V730 PolarHBondContact OD1-N 3.44Å
731	I	30.4	Very low	30.6	Very low	165 Å²	165	136.6 Å²	136.6	85%	0.846	78%	0.782	S	S	*	*				-158.7	153.3	115.1	-98.3	160.4	0	0	0	108.2
732	S	31.7	Very low	30.8	Very low	102 Å²	102	136.2 Å²	136.2	71%	0.713	79%	0.785	S	S	*	*			trans	-114.5	-158.9	-169.7	-52.6	0	0	0	0	111.9
733	P	47.3	Very low	31	Very low	111 Å²	111	134.6 Å²	134.6	72%	0.721	78%	0.783	S	S	*	*				-126.7	-176.4	-103.9	40.9	-23.9	0	0	0	113.6
734	E	28.3	Very low	31.2	Very low	193 Å²	193	135.6 Å²	135.6	90%	0.902	78%	0.784	S	S	*	*			trans	-150.8	161.8	138.1	-128.6	164.9	-179.2	0	0	111.8
735	L	31	Very low	31.3	Very low	148 Å²	148	136.5 Å²	136.5	78%	0.775	79%	0.785	S	S	*	*			trans	-130.3	155.1	-171.1	-72	159.5	0	0	0	109.1
736	E	29.1	Very low	31.5	Very low	202 Å²	202	133.2 Å²	133.2	94%	0.944	78%	0.778	S	S	*	*				-160.5	162.9	125.5	-116.3	176.9	-170.4	0	0	111.5
737	E	27.6	Very low	31.6	Very low	161 Å²	161	132 Å²	132	75%	0.752	77%	0.774	S	S	*	*			trans	-119.7	148	-155.4	-69.5	-166.1	110.7	0	0	115.9
738	L	26.9	Very low	31.8	Very low	135 Å²	135	132.1 Å²	132.1	71%	0.707	77%	0.769	S	S	*	*			trans	36.4	109.9	134.3	-58.9	168	0	0	0	120.6
739	S	25.6	Very low	32.8	Very low	105 Å²	105	130.5 Å²	130.5	73%	0.734	77%	0.766	S	S	*	*				66.4	175.8	115	-60.4	0	0	0	0	120.2
740	P	47.2	Very low	32.3	Very low	120 Å²	120	131.2 Å²	131.2	78%	0.779	77%	0.768	S	S	*	*			cis	-131.1	-163.9	-49.6	36	-18.8	0	0	0	112.4
741	S	27.3	Very low	32.6	Very low	99 Å²	99	131.2 Å²	131.2	69%	0.692	77%	0.773	S	S	*	*			trans	107.3	101.3	141	-153.6	0	0	0	0	120.5
742	S	30.9	Very low	33.7	Very low	108 Å²	108	128.4 Å²	128.4	76%	0.755	77%	0.766	S	S	*	*				78.6	144.2	122.5	-52.4	0	0	0	0	124.4
743	A	30.7	Very low	34	Very low	84 Å²	84	137 Å²	137	69%	0.694	79%	0.791	S	S	*	*			trans	83.7	105.4	146.5	0	0	0	0	0	121.1
744	D	29.7	Very low	33.3	Very low	150 Å²	150	138.3 Å²	138.3	80%	0.802	79%	0.794	S	S	*	*			trans	50.2	126.7	130.9	-53.7	-24.1	0	0	0	122
745	T	30.4	Very low	33.6	Very low	127 Å²	127	135.4 Å²	135.4	78%	0.779	79%	0.788	S	S	*	*				160.8	112.1	110.2	-66.8	0	0	0	0	112.1
746	V	30	Very low	33.7	Very low	124 Å²	124	134.7 Å²	134.7	75%	0.752	79%	0.789	S	S	*	*			trans	40.2	116.6	147.7	-173.9	0	0	0	0	119.5
747	L	30.4	Very low	34	Very low	163 Å²	163	130.7 Å²	130.7	85%	0.853	78%	0.78	S	S	*	*				-174.2	133	115.3	-99.2	176.6	0	0	0	111.6
748	S	32.8	Very low	34.4	Very low	109 Å²	109	128.8 Å²	128.8	76%	0.762	78%	0.782	S	S	*	*			trans	-94.8	151.8	158.2	-54.4	0	0	0	0	108.7
749	P	47.4	Very low	34.9	Very low	109 Å²	109	128.4 Å²	128.4	71%	0.708	79%	0.787	S	S	*	*				-148.7	158.3	111.4	39.8	-25.3	0	0	0	116.4
750	T	33.9	Very low	35.5	Very low	131 Å²	131	130.1 Å²	130.1	80%	0.804	79%	0.791	S	S	*	*			trans	49.6	108.2	144.9	55.6	0	0	0	0	121.8
751	S	35.4	Very low	34.6	Very low	109 Å²	109	130.8 Å²	130.8	76%	0.762	79%	0.791	S	S	*	*			trans	-47.8	158.4	134.3	-173.1	0	0	0	0	111.7
752	P	54.5	Low	35.2	Very low	106 Å²	106	133.5 Å²	133.5	69%	0.688	80%	0.8	S	S	*	*			cis	-138	163.1	22.4	42.2	-25.4	0	0	0	118.3
753	F	36.8	Very low	35.6	Very low	282 Å²	282	135.8 Å²	135.8	100%	1.237	80%	0.804	S	S	*	*				-150.6	0	128.6	-102	-70.4	0	0	0	109.1

Retrieved 753 of 753 residues in 234.1 ms (Link to these results)

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