Q4KXQ2_SCHMA Loading...

CAR

AlphaFold DB , UniProt , Accession Q4KXQ2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene CAR, Length 702 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.9	Very low	35.2	Very low	253 Å²	253	136.7 Å²	136.7	100%	1.246	82%	0.816	S	S	*	*				0	137	0	-71.2	177.1	173.2	0	0	106.8
2	D	38.7	Very low	34.7	Very low	144 Å²	144	137.6 Å²	137.6	77%	0.77	81%	0.814	S	S	*	*			trans	-122.6	146.4	177.6	-149.3	-11	0	0	0	105.6
3	P	40	Very low	34.4	Very low	130 Å²	130	138.3 Å²	138.3	84%	0.844	82%	0.82	S	S	*	*				-142.2	168.3	83.3	38.6	-23.1	0	0	0	114
4	G	36.3	Very low	34.1	Very low	55 Å²	55	139.2 Å²	139.2	57%	0.567	82%	0.819	S	S	*	*			cis	177.8	167.7	-5.2	0	0	0	0	0	111.7
5	A	34.7	Very low	33.9	Very low	97 Å²	97	134.7 Å²	134.7	80%	0.802	80%	0.804	S	S	*	*			trans	-75.1	141.3	-175.6	0	0	0	0	0	113.1
6	N	38.4	Very low	33.6	Very low	151 Å²	151	135.4 Å²	135.4	81%	0.807	80%	0.802	S	S	*	*			trans	-121.2	106.3	161.9	-91.2	-36.2	0	0	0	108.4	Y8	N6-Y8 PolarHBondContact O-N 2.93Å
7	D	34.4	Very low	33.4	Very low	161 Å²	161	135.1 Å²	135.1	86%	0.861	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-66.5	123.1	173.6	-81.1	-59.8	0	0	0	111
8	Y	33.9	Very low	33.2	Very low	209 Å²	209	140.3 Å²	140.3	82%	0.82	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-102.6	129.1	159.6	-92.2	-89.7	0	0	0	109.3	N6 S10	N6-Y8 PolarHBondContact O-N 2.93Å; Y8-S10 PolarHBondContact O-N 2.9Å
9	P	35.1	Very low	33.1	Very low	118 Å²	118	137.8 Å²	137.8	77%	0.766	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-66.4	131.5	-171.3	25.6	-34.1	0	0	0	111.4	G11	P9-G11 VanDerWaalsContact C-N 3.3Å; P9-G11 PolarHBondContact O-N 3.36Å
10	S	29.3	Very low	32.9	Very low	128 Å²	128	139.1 Å²	139.1	90%	0.895	80%	0.795	S	S	*	*			trans	-66	85.7	173.8	-72	0	0	0	0	111.1	Y8 N12	Y8-S10 PolarHBondContact O-N 2.9Å; S10-N12 PolarHBondContact O-N 2.9Å
11	G	29.4	Very low	32.8	Very low	58 Å²	58	136.6 Å²	136.6	60%	0.598	79%	0.786	S	S	*	*			trans	-57	119.2	178.4	0	0	0	0	0	111.2	P9 V13	P9-G11 VanDerWaalsContact C-N 3.3Å; P9-G11 PolarHBondContact O-N 3.36Å; G11-V13 VanDerWaalsContact O-CG2 3.24Å; G11-V13 WeakPolarHBondContact O-CG2 3.32Å; G11-V13 PolarHBondContact O-N 3.35Å
12	N	28.9	Very low	32.3	Very low	147 Å²	147	134.2 Å²	134.2	79%	0.786	77%	0.769	S	S	*	*			trans	-76.2	86.6	-171	-167.6	-9.7	0	0	0	111.3	S10 N14	S10-N12 PolarHBondContact O-N 2.9Å; N12-N14 PolarHBondContact O-N 2.96Å
13	V	30.7	Very low	31.8	Very low	147 Å²	147	138 Å²	138	89%	0.891	77%	0.772	S	S	*	*			trans	-74.5	60.3	-173.6	-161.2	0	0	0	0	112.6	G11	G11-V13 VanDerWaalsContact O-CG2 3.24Å; G11-V13 WeakPolarHBondContact O-CG2 3.32Å; G11-V13 PolarHBondContact O-N 3.35Å
14	N	30.9	Very low	31.2	Very low	151 Å²	151	139 Å²	139	81%	0.807	77%	0.769	S	S	*	*			trans	-146.1	31.9	-177.2	-132.5	-22.6	0	0	0	114.5	N12	N12-N14 PolarHBondContact O-N 2.96Å
15	A	30.6	Very low	30.8	Very low	72 Å²	72	141.7 Å²	141.7	60%	0.595	78%	0.779	S	S	*	*	S	Bend	trans	-118.8	-37.1	-177.1	0	0	0	0	0	115.6
16	N	29	Very low	30.4	Very low	146 Å²	146	142.4 Å²	142.4	78%	0.781	78%	0.778	S	S	*	*	G	3₁₀ helix	trans	-90.9	-1.5	-160.4	-72.6	-23	0	0	0	117	R18	N16-R18 VanDerWaalsContact C-N 3.34Å; N16-R18 PolarHBondContact O-N 3.23Å
17	L	31.4	Very low	30	Very low	130 Å²	130	138.8 Å²	138.8	68%	0.681	78%	0.777	S	S	*	*	G	3₁₀ helix	trans	-86.7	9.5	-177.5	-87	164.8	0	0	0	115.4
18	R	29.5	Very low	29.9	Very low	229 Å²	229	136.9 Å²	136.9	86%	0.864	77%	0.772	S	S	*	*	G	3₁₀ helix	trans	-95.1	-7.5	174.8	-70.4	-170.5	177.1	-167.3	2	114.7	N16	N16-R18 VanDerWaalsContact C-N 3.34Å; N16-R18 PolarHBondContact O-N 3.23Å
19	S	30.8	Very low	29.7	Very low	93 Å²	93	132.7 Å²	132.7	65%	0.65	77%	0.77	S	S	*	*			trans	-90.1	-16	-167.6	-55.4	0	0	0	0	115.7	S21	S19-S21 PolarHBondContact O-N 2.96Å
20	N	29.8	Very low	29.6	Very low	163 Å²	163	135 Å²	135	87%	0.872	78%	0.775	S	S	*	*			trans	-74.4	65.7	171.8	-84.1	2	0	0	0	111.6	F22	N20-F22 PolarHBondContact O-N 2.97Å
21	S	29.4	Very low	29.5	Very low	86 Å²	86	135 Å²	135	60%	0.601	77%	0.765	S	S	*	*			trans	-77.4	111.3	166.8	-72.2	0	0	0	0	109.1	S19 R23	S19-S21 PolarHBondContact O-N 2.96Å; S21-R23 PolarHBondContact O-N 3.35Å
22	F	28	Very low	29.7	Very low	203 Å²	203	139.4 Å²	139.4	89%	0.89	77%	0.774	S	S	*	*			trans	-65.1	82.6	162.1	-115.2	-94.9	0	0	0	108.9	N20 I24	N20-F22 PolarHBondContact O-N 2.97Å; F22-I24 VanDerWaalsContact C-N 3.31Å; F22-I24 PolarHBondContact O-N 3.47Å
23	R	27.1	Very low	29.8	Very low	223 Å²	223	136 Å²	136	84%	0.842	76%	0.762	S	S	*	*			trans	-71.1	89.2	171.1	-76	-167.5	179.3	-165.2	2.4	108.6	S21 S25	S21-R23 PolarHBondContact O-N 3.35Å; R23-S25 PolarHBondContact O-N 3.24Å
24	I	27.4	Very low	29.9	Very low	151 Å²	151	137.5 Å²	137.5	77%	0.774	76%	0.762	S	S	*	*			trans	-71.2	108.3	156.5	-61	177.1	0	0	0	105.7	F22 S26	F22-I24 VanDerWaalsContact C-N 3.31Å; F22-I24 PolarHBondContact O-N 3.47Å; I24-S26 PolarHBondContact O-N 2.98Å
25	S	27.8	Very low	29.8	Very low	112 Å²	112	136.9 Å²	136.9	78%	0.783	76%	0.759	S	S	*	*			trans	-63.9	108.2	179.4	-61.3	0	0	0	0	110.4	R23 G27	R23-S25 PolarHBondContact O-N 3.24Å; S25-G27 PolarHBondContact O-N 2.94Å
26	S	27.3	Very low	29.9	Very low	112 Å²	112	139.7 Å²	139.7	78%	0.783	76%	0.762	S	S	*	*			trans	-68.5	106.2	166.7	51.5	0	0	0	0	109	I24 T28	I24-S26 PolarHBondContact O-N 2.98Å; S26-T28 PolarHBondContact O-N 3.21Å
27	G	29.9	Very low	30.1	Very low	75 Å²	75	140.2 Å²	140.2	77%	0.773	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-62.2	125.1	175.3	0	0	0	0	0	111.1	S25	S25-G27 PolarHBondContact O-N 2.94Å
28	T	32.5	Very low	30	Very low	122 Å²	122	137.3 Å²	137.3	75%	0.748	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-76.4	132.6	174.5	46	0	0	0	0	110.6	S26	S26-T28 PolarHBondContact O-N 3.21Å
29	P	28.6	Very low	30.3	Very low	121 Å²	121	132.2 Å²	132.2	79%	0.786	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-76.2	137.9	169.8	32.1	-32.7	0	0	0	110.2
30	L	33.1	Very low	30.3	Very low	166 Å²	166	133 Å²	133	87%	0.869	77%	0.768	S	S	*	*			trans	-132.2	108.8	163.7	-90	172.6	0	0	0	110.2
31	D	28.2	Very low	30.4	Very low	127 Å²	127	130.5 Å²	130.5	68%	0.679	76%	0.764	S	S	*	*			trans	2.5	132.1	156.8	-145.5	-21.9	0	0	0	120.2	S33	D31-S33 PolarHBondContact OD1-N 2.9Å
32	N	33.6	Very low	30.5	Very low	151 Å²	151	133.1 Å²	133.1	81%	0.807	78%	0.776	S	S	*	*				-160.9	106.1	123.1	-112.4	-57.7	0	0	0	113.7
33	S	29.5	Very low	30.6	Very low	75 Å²	75	127 Å²	127	52%	0.524	77%	0.771	S	S	.	*				43.6	97.5	126.4	-51.3	0	0	0	0	120.5	D31	D31-S33 PolarHBondContact OD1-N 2.9Å
34	M	33.6	Very low	30.5	Very low	179 Å²	179	127.8 Å²	127.8	88%	0.882	78%	0.775	S	S	*	*				171.1	112.8	116.3	-91	174	-77.9	0	0	109.9
35	N	29.7	Very low	30.6	Very low	139 Å²	139	124.2 Å²	124.2	74%	0.743	78%	0.776	S	S	*	*				68.9	126.4	84.4	-143	16.7	0	0	0	111.5
36	I	32.4	Very low	30.6	Very low	130 Å²	130	124.2 Å²	124.2	67%	0.667	78%	0.776	S	S	*	*			cis	-156.4	146.2	43.5	-78	173.3	0	0	0	111.3
37	N	33.4	Very low	30.6	Very low	157 Å²	157	126.7 Å²	126.7	84%	0.84	78%	0.78	S	S	*	*			trans	35.9	152.9	155.5	-53	-13.9	0	0	0	122.2
38	G	28.8	Very low	30.6	Very low	69 Å²	69	130.2 Å²	130.2	71%	0.711	79%	0.787	S	S	*	*			cis	-169.6	-179.1	5.9	0	0	0	0	0	112.6
39	P	34.7	Very low	30.5	Very low	122 Å²	122	127.6 Å²	127.6	79%	0.792	78%	0.784	S	S	*	*			trans	-124.6	166.3	-148.8	41	-30.3	0	0	0	117.5
40	S	30.8	Very low	30.5	Very low	109 Å²	109	130.4 Å²	130.4	76%	0.762	79%	0.786	S	S	*	*				161.6	163.2	122.1	-74	0	0	0	0	117.2
41	S	33.7	Very low	30.3	Very low	112 Å²	112	130.3 Å²	130.3	78%	0.783	79%	0.787	S	S	*	*			trans	79.6	81.6	156.2	60.7	0	0	0	0	122.3
42	V	29.5	Very low	30.4	Very low	140 Å²	140	133.1 Å²	133.1	85%	0.848	79%	0.793	S	S	*	*			trans	9.8	132.2	133.1	-166.5	0	0	0	0	120
43	G	30.8	Very low	30.2	Very low	76 Å²	76	135.2 Å²	135.2	78%	0.784	80%	0.798	S	S	*	*			trans	-162.8	124.5	157.3	0	0	0	0	0	112.7
44	Y	25.8	Very low	30.1	Very low	238 Å²	238	136.5 Å²	136.5	93%	0.933	81%	0.807	S	S	*	*			trans	-82.6	140.3	-179.2	-96.2	-105.1	0	0	0	112.4
45	G	29.2	Very low	29.9	Very low	77 Å²	77	137.5 Å²	137.5	79%	0.794	81%	0.806	S	S	*	*			trans	-169.9	112.4	172.7	0	0	0	0	0	113.6
46	S	26.8	Very low	29.9	Very low	111 Å²	111	139.4 Å²	139.4	78%	0.776	82%	0.816	S	S	*	*			trans	-82.7	130.2	-174.5	-53.9	0	0	0	0	113.5
47	N	28.3	Very low	29.7	Very low	164 Å²	164	137.6 Å²	137.6	88%	0.877	81%	0.814	S	S	*	*			trans	174.3	114.7	134.8	-91.8	-40.9	0	0	0	110.9
48	T	30	Very low	29.9	Very low	149 Å²	149	136.5 Å²	136.5	91%	0.914	81%	0.807	S	S	*	*			trans	-78.1	124.8	172.1	35.7	0	0	0	0	111.1
49	G	29.7	Very low	30.1	Very low	67 Å²	67	139.9 Å²	139.9	69%	0.691	81%	0.809	S	S	*	*			trans	-72.9	157.9	-177.9	0	0	0	0	0	113.9	D51	G49-D51 PolarHBondContact O-N 3.07Å
50	H	28.6	Very low	29.9	Very low	181 Å²	181	144.1 Å²	144.1	84%	0.838	81%	0.809	S	S	*	*			trans	-77.8	106.6	170.8	-87.8	-76.8	0	0	0	111.4
51	D	30	Very low	30.2	Very low	163 Å²	163	144 Å²	144	87%	0.872	80%	0.804	S	S	*	*			trans	-65.7	131.3	166.9	-70.1	-42	0	0	0	111.5	G49	G49-D51 PolarHBondContact O-N 3.07Å
52	K	29	Very low	30.2	Very low	187 Å²	187	144.4 Å²	144.4	81%	0.813	79%	0.793	S	S	*	*			trans	-115.5	34.3	-170.9	-72.4	176.5	-176.1	165.6	0	113.6
53	E	29.4	Very low	30.6	Very low	194 Å²	194	140.7 Å²	140.7	91%	0.907	77%	0.771	S	S	*	*			trans	-108.1	95.7	-178.5	-62.8	-139.2	126.6	0	0	112.5
54	S	27.3	Very low	30.7	Very low	102 Å²	102	140.7 Å²	140.7	71%	0.713	75%	0.753	S	S	*	*			trans	-153.9	23.5	-176	48.8	0	0	0	0	116.7
55	F	29	Very low	31	Very low	200 Å²	200	135.6 Å²	135.6	88%	0.877	73%	0.733	S	S	*	*	S	Bend	trans	-140	18.8	-171.9	-99.7	-73.6	0	0	0	118.9
56	L	30.2	Very low	31.4	Very low	180 Å²	180	137.2 Å²	137.2	94%	0.942	73%	0.727	S	S	*	*			trans	-126.7	23.8	-171.2	-73.7	178.5	0	0	0	118.4
57	C	29	Very low	31.8	Very low	92 Å²	92	137.5 Å²	137.5	62%	0.622	72%	0.716	S	S	*	*	S	Bend	trans	-131.3	92	173.1	-171.5	0	0	0	0	113.3	R648	C57-R648 PolarHBondContact O-NH2 3.32Å
58	L	36	Very low	32.1	Very low	133 Å²	133	131.7 Å²	131.7	70%	0.696	69%	0.685	S	S	*	*	S	Bend	trans	-169.1	-18.4	168.1	-115.4	152.6	0	0	0	112.9
59	N	33.1	Very low	32.2	Very low	140 Å²	140	129.8 Å²	129.8	75%	0.749	67%	0.666	S	S	*	*	S	Bend	trans	-85	-10.5	-177.6	-69.1	-22	0	0	0	115.3
60	R	32.1	Very low	32.3	Very low	212 Å²	212	133.3 Å²	133.3	80%	0.8	66%	0.664	S	S	*	*	S	Bend	trans	-86.2	-27.7	-165.9	-157.8	177.2	-171.3	-172	3	114.6	T63	R60-T63 PolarHBondContact O-OG1 3.12Å; R60-T63 VanDerWaalsContact O-OG1 3.05Å
61	T	36.9	Very low	32.3	Very low	106 Å²	106	130.9 Å²	130.9	65%	0.65	65%	0.648	S	S	*	*	S	Bend	trans	-81.9	-18.8	179.9	46.4	0	0	0	0	113.4
62	Q	33.9	Very low	32.5	Very low	121 Å²	121	128 Å²	128	57%	0.565	63%	0.632	S	S	*	*	S	Bend	trans	-90.8	-8.9	-176.6	-163.9	166.3	98.3	0	0	113.6
63	T	36.4	Very low	32.7	Very low	61 Å²	61	124.9 Å²	124.9	37%	0.374	62%	0.62	S	S	.	*	S	Bend	trans	-84.6	-33.7	-177.3	38.6	0	0	0	0	114.4	R60	R60-T63 PolarHBondContact O-OG1 3.12Å; R60-T63 VanDerWaalsContact O-OG1 3.05Å
64	D	33.1	Very low	32.8	Very low	76 Å²	76	120.2 Å²	120.2	41%	0.406	61%	0.609	S	S	.	*	S	Bend	trans	-85.3	-25.8	-171.1	-59.4	-39.7	0	0	0	113.1	V66 P278	D64-V66 VanDerWaalsContact C-N 3.26Å; D64-V66 PolarHBondContact O-N 3.05Å; D64-P278 HydrophobicContact CB-CG 4.35Å
65	Y	33.9	Very low	33.1	Very low	132 Å²	132	120.8 Å²	120.8	52%	0.518	61%	0.608	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67.7	-21.7	-179.6	-164.3	-79.1	0	0	0	113.3	Q67 D663	Y65-Q67 PolarHBondContact O-N 3.32Å; Y65-D663 PolarHBondContact OH-OD1 3.48Å
66	V	36.5	Very low	33.4	Very low	110 Å²	110	118.9 Å²	118.9	67%	0.667	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87	-2.7	-169.8	-172.4	0	0	0	0	113.6	D64 N68	D64-V66 VanDerWaalsContact C-N 3.26Å; D64-V66 PolarHBondContact O-N 3.05Å; V66-N68 PolarHBondContact O-N 3.45Å
67	Q	36.3	Very low	33.5	Very low	117 Å²	117	115.7 Å²	115.7	55%	0.547	59%	0.585	S	S	.	*	S	Bend	trans	-76.9	-11.8	-163.6	-70.7	-170.1	-5.3	0	0	117.5	Y65	Y65-Q67 PolarHBondContact O-N 3.32Å
68	N	33.4	Very low	33.6	Very low	42 Å²	42	117 Å²	117	23%	0.225	59%	0.586	C	S	.	*	S	Bend	trans	-121	-1.2	-158.5	-63.2	-66.5	0	0	0	118.7	V66 F281 S282	V66-N68 PolarHBondContact O-N 3.45Å; N68-F281 WeakPolarHBondContact CB-O 3Å; N68-S282 WeakPolarHBondContact OD1-CB 3.48Å; N68-S282 PolarHBondContact OD1-OG 3.38Å
69	H	32.2	Very low	33.4	Very low	110 Å²	110	116.7 Å²	116.7	51%	0.509	59%	0.585	S	S	.	*			trans	-122.5	101.6	179.6	-92.7	-71.4	0	0	0	115	F281	H69-F281 AromaticContact NE2-CD1 3.34Å; H69-F281 VanDerWaalsContact NE2-CD1 3.34Å; H69-F281 WeakPolarHBondContact NE2-CD1 3.5Å; H69-F281 AromaticContact NE2-CE1 3.57Å
70	Q	32.5	Very low	33.3	Very low	140 Å²	140	115.5 Å²	115.5	65%	0.654	58%	0.583	S	S	*	*			trans	-149.2	99.6	167.2	-79.8	-168.1	-64.7	0	0	113.1
71	Y	28.1	Very low	33.3	Very low	130 Å²	130	112.2 Å²	112.2	51%	0.51	58%	0.581	S	S	.	*			trans	-157.3	171	138.8	-145	-99	0	0	0	112.5	Q73 R202 S287	Y71-Q73 HydrophobicContact CE1-CG 4.4Å; Y71-R202 VanDerWaalsContact CE1-NH1 3.31Å; Y71-R202 VanDerWaalsContact CE1-NH2 3.32Å; Y71-R202 VanDerWaalsContact CZ-NH1 3.34Å; Y71-R202 PolarHBondContact OH-NH1 3.31Å; Y71-S287 WeakPolarHBondContact CD1-OG 2.96Å
72	I	34.7	Very low	32.9	Very low	103 Å²	103	114 Å²	114	53%	0.528	59%	0.587	S	S	.	*			trans	79	137.5	177.7	-54.2	177.3	0	0	0	114.4	S287	I72-S287 WeakPolarHBondContact CG1-OG 3.23Å
73	Q	32.3	Very low	32.8	Very low	122 Å²	122	112.5 Å²	112.5	57%	0.57	59%	0.59	S	S	*	*			cis	-154.5	-171.8	-46.4	-140.9	163.6	-110.8	0	0	110.5	Y71	Y71-Q73 HydrophobicContact CE1-CG 4.4Å
74	S	31	Very low	32.6	Very low	96 Å²	96	116.9 Å²	116.9	67%	0.671	61%	0.606	S	S	*	*			trans	-163.8	167.8	169.9	53.2	0	0	0	0	107.3
75	V	34.4	Very low	32.4	Very low	113 Å²	113	123.5 Å²	123.5	69%	0.685	63%	0.627	S	S	*	*			cis	-151.2	168	11.2	-137	0	0	0	0	109.4
76	H	34.5	Very low	32	Very low	160 Å²	160	121.9 Å²	121.9	74%	0.741	63%	0.634	S	S	*	*				150.3	150.3	124.4	-81.6	-72.4	0	0	0	110.1
77	N	32.5	Very low	31.9	Very low	113 Å²	113	122.3 Å²	122.3	60%	0.604	64%	0.641	S	S	*	*			cis	-151.7	161.7	9.8	-145	31.3	0	0	0	113.6
78	D	31.5	Very low	31.5	Very low	119 Å²	119	123 Å²	123	64%	0.636	65%	0.649	S	S	*	*			trans	29.9	149.2	136.7	-64.8	-1.4	0	0	0	122.8
79	N	31.1	Very low	31.3	Very low	127 Å²	127	131 Å²	131	68%	0.679	68%	0.682	S	S	*	*			cis	-169.9	179.4	-6	-116.6	-42.1	0	0	0	111.8
80	T	32.8	Very low	31	Very low	116 Å²	116	133.4 Å²	133.4	71%	0.712	69%	0.694	S	S	*	*			trans	75.2	153.7	164.2	79.7	0	0	0	0	117.8
81	N	30.6	Very low	30.8	Very low	142 Å²	142	136 Å²	136	76%	0.759	70%	0.703	S	S	*	*			cis	-162	173	-26.8	-106.4	-19.7	0	0	0	111.1
82	N	30.2	Very low	31	Very low	145 Å²	145	134.4 Å²	134.4	78%	0.775	71%	0.711	S	S	*	*			trans	68.8	130.3	178	-73.6	-30.9	0	0	0	115.2
83	S	30.2	Very low	30.8	Very low	89 Å²	89	138.3 Å²	138.3	62%	0.622	73%	0.727	S	S	*	*			cis	82.4	145.5	47.2	92.2	0	0	0	0	112.6
84	H	32.4	Very low	30.8	Very low	153 Å²	153	138.7 Å²	138.7	71%	0.708	74%	0.743	S	S	*	*			cis	-152	170.9	18.1	-140.9	-78.1	0	0	0	112.5
85	Y	30.2	Very low	30.9	Very low	214 Å²	214	138 Å²	138	84%	0.839	75%	0.75	S	S	*	*			trans	78.5	158.8	165	-89.5	-83.7	0	0	0	121.6
86	C	25.3	Very low	30.7	Very low	99 Å²	99	138.5 Å²	138.5	67%	0.669	76%	0.759	S	S	*	*			trans	-159.1	151.5	-161.3	170.2	0	0	0	0	109.7
87	S	33.8	Very low	30.7	Very low	118 Å²	118	142.9 Å²	142.9	83%	0.825	77%	0.769	S	S	*	*			trans	-153.9	129.8	159.5	50.3	0	0	0	0	111
88	N	27.6	Very low	30.7	Very low	131 Å²	131	147 Å²	147	70%	0.701	78%	0.782	S	S	*	*			trans	-83.2	162.9	-176.8	-56.8	-48.5	0	0	0	112.5
89	F	28.8	Very low	31	Very low	211 Å²	211	150 Å²	150	93%	0.925	79%	0.792	S	S	*	*			trans	-145.6	142.8	132.9	-132.2	-87.6	0	0	0	111.1
90	E	26	Very low	31	Very low	161 Å²	161	149.6 Å²	149.6	75%	0.752	80%	0.796	S	S	*	*			trans	-111.4	-175.7	-168.6	-95.6	-168	105	0	0	113.4
91	F	28.8	Very low	30.9	Very low	194 Å²	194	152.4 Å²	152.4	85%	0.851	81%	0.806	S	S	*	*			trans	77.8	141.6	166.3	-111.9	-136.3	0	0	0	116.5
92	S	33.1	Very low	31.1	Very low	96 Å²	96	151.3 Å²	151.3	67%	0.671	81%	0.809	S	S	*	*			cis	-138.8	162.5	8	-47.7	0	0	0	0	112.4
93	Q	29.1	Very low	31.1	Very low	186 Å²	186	147.9 Å²	147.9	87%	0.869	81%	0.808	S	S	*	*			trans	-93.1	151.3	175.4	-54.2	176.6	20.2	0	0	112.9
94	S	32	Very low	31.5	Very low	130 Å²	130	148.1 Å²	148.1	91%	0.909	81%	0.805	S	S	*	*			trans	159.6	154	132.2	53	0	0	0	0	112.1
95	G	33.9	Very low	31.7	Very low	80 Å²	80	146.5 Å²	146.5	83%	0.825	81%	0.806	S	S	*	*			trans	135.1	60	171.6	0	0	0	0	0	116.8
96	S	31.3	Very low	32.3	Very low	124 Å²	124	144.1 Å²	144.1	87%	0.867	80%	0.795	S	S	*	*			trans	-69	129.6	178.8	-68.1	0	0	0	0	114.1
97	R	34	Very low	33.1	Very low	253 Å²	253	143.5 Å²	143.5	96%	0.955	79%	0.789	S	S	*	*			trans	-152.2	132	148	-108.9	172.5	-128.5	-148.6	1.6	110.3
98	K	32.4	Very low	33.6	Very low	198 Å²	198	147.6 Å²	147.6	86%	0.861	79%	0.786	S	S	*	*			trans	-95.6	142.7	-179.5	-56.2	170.5	-177.5	173.9	0	109.3
99	H	36.7	Very low	34.5	Very low	184 Å²	184	150 Å²	150	85%	0.852	79%	0.786	S	S	*	*			trans	-173.4	164.3	146.8	-100.8	-63.2	0	0	0	109.4
100	P	32.8	Very low	35.2	Very low	117 Å²	117	147.4 Å²	147.4	76%	0.76	77%	0.769	S	S	*	*			trans	-83.8	148.9	-143.5	31.1	-37.7	0	0	0	116.4
101	L	30.5	Very low	36.3	Very low	176 Å²	176	148.9 Å²	148.9	92%	0.921	77%	0.773	S	S	*	*			trans	-90.5	117.6	173.3	-67.6	170.3	0	0	0	110.7
102	S	33.8	Very low	37.1	Very low	119 Å²	119	143.9 Å²	143.9	83%	0.832	77%	0.768	S	S	*	*			trans	-121.2	147.8	168.7	-174.5	0	0	0	0	110.5
103	G	30.4	Very low	37.8	Very low	73 Å²	73	143.1 Å²	143.1	75%	0.753	78%	0.776	S	S	*	*			trans	68.4	66.4	165.3	0	0	0	0	0	117.4
104	V	39.6	Very low	39	Very low	94 Å²	94	137 Å²	137	57%	0.57	75%	0.748	S	S	*	*			trans	-120.4	77.7	166.3	-172.8	0	0	0	0	111.3	R106	V104-R106 HydrophobicContact CG1-CG 3.86Å
105	V	36.4	Very low	40.3	Very low	119 Å²	119	133.9 Å²	133.9	72%	0.721	73%	0.727	S	S	*	*			trans	-69.2	127	159.5	178.5	0	0	0	0	107.6
106	R	42	Very low	41.6	Very low	163 Å²	163	136.4 Å²	136.4	62%	0.615	72%	0.717	S	S	*	*			trans	-127	117	174.2	-87.2	-179.7	176.3	153.4	4.1	112.2	V104	V104-R106 HydrophobicContact CG1-CG 3.86Å
107	T	43	Very low	43.1	Very low	87 Å²	87	138.1 Å²	138.1	53%	0.534	71%	0.711	S	S	.	*			trans	-65.3	160.7	-178.2	52.4	0	0	0	0	112.6	R109	T107-R109 PolarHBondContact O-N 2.92Å
108	R	44.5	Very low	44.9	Very low	203 Å²	203	132.5 Å²	132.5	77%	0.766	70%	0.696	S	S	*	*	S	Bend	trans	-64.9	14.7	166.8	-66.7	-174.8	179.9	165.9	5	113.9
109	R	46.4	Very low	47.3	Very low	182 Å²	182	125.5 Å²	125.5	69%	0.687	66%	0.664	S	S	*	*			trans	-110.4	34.6	-162.2	-147.2	177.2	-166.8	163.3	7.5	114	T107	T107-R109 PolarHBondContact O-N 2.92Å
110	R	43.4	Very low	50	Low	156 Å²	156	120.3 Å²	120.3	59%	0.589	65%	0.645	S	S	*	*			trans	-131.7	34	174.2	-76.1	-166.5	171.9	-153.5	-4.4	113.3	A112	R110-A112 VanDerWaalsContact C-N 3.29Å
111	K	49.2	Very low	53	Low	192 Å²	192	114.8 Å²	114.8	84%	0.835	61%	0.609	S	S	*	*	S	Bend	trans	-79	-14.2	168.5	-164.4	169.7	179.7	-175.2	0	112.5
112	A	44.9	Very low	56	Low	89 Å²	89	110.1 Å²	110.1	74%	0.736	58%	0.584	S	S	*	*	S	Bend	trans	-98.4	141.5	164.9	0	0	0	0	0	110.5	R110	R110-A112 VanDerWaalsContact C-N 3.29Å
113	G	47.4	Very low	59	Low	81 Å²	81	104.5 Å²	104.5	84%	0.835	55%	0.545	S	S	*	.	S	Bend	trans	96.3	9.2	166.9	0	0	0	0	0	117.9
114	I	53.8	Low	62.1	Low	58 Å²	58	101.1 Å²	101.1	30%	0.297	51%	0.51	S	S	.	.			trans	-133	121.5	168	-56.7	178.4	0	0	0	106.9	E118 R119	I114-E118 HydrophobicContact CG2-CB 3.84Å; I114-E118 HydrophobicContact CG2-CG 4.24Å; I114-R119 HydrophobicContact CG2-CG 3.87Å; I114-R119 PolarHBondContact O-NH2 3.38Å
115	S	60.2	Low	64.6	Low	64 Å²	64	99.1 Å²	99.1	45%	0.448	51%	0.508	S	S	.	.			trans	-66.8	172.2	-180	73.2	0	0	0	0	111.5	E117 R119	S115-E117 VanDerWaalsContact C-N 3.29Å; S115-E117 WeakPolarHBondContact CB-OE2 3.35Å; S115-E117 PolarHBondContact O-N 3.42Å; S115-E117 PolarHBondContact OG-OE2 3.32Å; S115-R119 PolarHBondContact O-NE 2.91Å
116	E	61.4	Low	67.3	Low	132 Å²	132	96 Å²	96	62%	0.617	49%	0.485	S	S	*	.	S	Bend	trans	-67	-33.1	179.6	-65.7	-59.2	132.4	0	0	111.5	E118 R119	E116-E118 PolarHBondContact O-N 3.47Å; E116-R119 IonicContact OE1-CZ 2.81Å; E116-R119 IonicContact OE1-NH1 2.89Å; E116-R119 PolarHBondContact OE1-NH1 3.45Å; E116-R119 IonicContact OE1-NH2 4Å; E116-R119 PolarHBondContact OE1-NH2 3.23Å; E116-R119 IonicContact OE2-CZ 3.17Å; E116-R119 IonicContact OE2-NH1 2.73Å; E116-R119 PolarHBondContact OE2-NH1 3.37Å
117	E	62.6	Low	69.7	Low	160 Å²	160	93.3 Å²	93.3	75%	0.748	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-29.9	-176.3	-52.2	81.5	-178	0	0	113.7	S115 R119	S115-E117 VanDerWaalsContact C-N 3.29Å; S115-E117 WeakPolarHBondContact CB-OE2 3.35Å; S115-E117 PolarHBondContact O-N 3.42Å; S115-E117 PolarHBondContact OG-OE2 3.32Å; E117-R119 PolarHBondContact O-N 2.94Å
118	E	71.3	Confident	72.1	Confident	136 Å²	136	89.7 Å²	89.7	64%	0.636	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-6.4	-175.3	-168	175.9	-151.7	0	0	113.2	I114 E116 V120	I114-E118 HydrophobicContact CG2-CB 3.84Å; I114-E118 HydrophobicContact CG2-CG 4.24Å; E116-E118 PolarHBondContact O-N 3.47Å; E118-V120 PolarHBondContact O-N 3.49Å
119	R	83.9	Confident	74.3	Confident	51 Å²	51	83.4 Å²	83.4	19%	0.192	46%	0.455	C	S	.	.			trans	-84.7	79.3	-174.5	-62.4	-172.5	-155.7	140.5	14.2	113	I114 S115 E116 E117 A128	I114-R119 HydrophobicContact CG2-CG 3.87Å; I114-R119 PolarHBondContact O-NH2 3.38Å; S115-R119 PolarHBondContact O-NE 2.91Å; E116-R119 IonicContact OE1-CZ 2.81Å; E116-R119 IonicContact OE1-NH1 2.89Å; E116-R119 PolarHBondContact OE1-NH1 3.45Å; E116-R119 IonicContact OE1-NH2 4Å; E116-R119 PolarHBondContact OE1-NH2 3.23Å; E116-R119 IonicContact OE2-CZ 3.17Å; E116-R119 IonicContact OE2-NH1 2.73Å; E116-R119 PolarHBondContact OE2-NH1 3.37Å; E117-R119 PolarHBondContact O-N 2.94Å; R119-A128 HydrophobicContact CB-CB 4.43Å; R119-A128 VanDerWaalsContact O-CB 3.28Å; R119-A128 WeakPolarHBondContact O-CB 3.34Å; R119-A128 PolarHBondContact O-N 2.98Å
120	V	92.9	Very high	76.4	Confident	75 Å²	75	75.7 Å²	75.7	46%	0.455	43%	0.432	S	S	.	.	B	Isolated β-bridge	trans	-84.2	136.1	179.7	176.5	0	0	0	0	113.2	E118 I122 G125	E118-V120 PolarHBondContact O-N 3.49Å; V120-I122 PolarHBondContact O-N 2.88Å; V120-G125 WeakPolarHBondContact CG1-O 3.43Å
121	C	95.6	Very high	78.8	Confident	1 Å²	1	74.8 Å²	74.8	1%	0.007	43%	0.43	C	S	.	.			trans	-71.6	112.2	174.2	174.7	0	0	0	0	111.5	V123 C124 G125 E126 A128 C138	C121-V123 PolarHBondContact O-N 2.87Å; C121-C124 PolarHBondContact O-N 3.3Å; C121-C124 PolarHBondContact SG-SG 3.32Å; C121-G125 PolarHBondContact O-N 2.89Å; C121-E126 WeakPolarHBondContact CA-O 3.16Å; C121-E126 WeakPolarHBondContact CB-O 3.03Å; C121-E126 PolarHBondContact N-O 3.43Å; C121-A128 HydrophobicContact CB-CB 4.4Å; C121-C138 HydrophobicContact CB-CB 3.88Å; C121-C138 PolarHBondContact SG-N 3.39Å; C121-C138 VanDerWaalsContact SG-SG 3.7Å
122	I	94.3	Very high	80.9	Confident	78 Å²	78	66.7 Å²	66.7	40%	0.4	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-12.9	-175.8	72.1	-179.7	0	0	0	114.4	V120 R135 L136 V186	V120-I122 PolarHBondContact O-N 2.88Å; I122-R135 HydrophobicContact CD1-CB 3.89Å; I122-R135 HydrophobicContact CD1-CG 4.12Å; I122-L136 PolarHBondContact N-O 2.98Å; I122-V186 HydrophobicContact CD1-CB 3.73Å; I122-V186 HydrophobicContact CD1-CG1 4.32Å; I122-V186 HydrophobicContact CD1-CG2 3.93Å; I122-V186 HydrophobicContact CG1-CB 4Å; I122-V186 HydrophobicContact CG1-CG1 4.14Å; I122-V186 HydrophobicContact CG1-CG2 3.99Å
123	V	95.5	Very high	83.3	Confident	0 Å²	0	64 Å²	64	0%	0	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-32.7	175	178.2	0	0	0	0	112.3	C121 T137 I167 K182 V186 M188	C121-V123 PolarHBondContact O-N 2.87Å; V123-T137 HydrophobicContact CG2-CG2 3.96Å; V123-I167 HydrophobicContact CG1-CG2 4.25Å; V123-I167 VanDerWaalsContact O-O 3.05Å; V123-K182 HydrophobicContact CG1-CG 4.5Å; V123-K182 VanDerWaalsContact O-CD 3.26Å; V123-K182 WeakPolarHBondContact O-CD 3.39Å; V123-K182 WeakPolarHBondContact O-CE 3.44Å; V123-K182 PolarHBondContact O-NZ 3.44Å; V123-V186 HydrophobicContact CG2-CG2 3.67Å; V123-M188 HydrophobicContact CG2-SD 4.12Å
124	C	95.4	Very high	85.4	Confident	3 Å²	3	63.4 Å²	63.4	2%	0.02	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-150.6	12.1	-168	66.4	0	0	0	0	118	C121 E126 I167 E168 G169 R172	C121-C124 PolarHBondContact O-N 3.3Å; C121-C124 PolarHBondContact SG-SG 3.32Å; C124-E126 PolarHBondContact O-N 2.8Å; C124-E126 VanDerWaalsContact O-N 3.08Å; C124-I167 WeakPolarHBondContact CA-O 3.48Å; C124-I167 HydrophobicContact CB-CG2 4.23Å; C124-E168 WeakPolarHBondContact O-CA 3.38Å; C124-G169 PolarHBondContact O-N 2.89Å; C124-R172 HydrophobicContact CB-CB 4.32Å
125	G	93.2	Very high	87.4	Confident	51 Å²	51	64.9 Å²	64.9	53%	0.526	35%	0.347	S	S	.	.	S	Bend	trans	78	-15.4	173.7	0	0	0	0	0	116.2	V120 C121	V120-G125 WeakPolarHBondContact CG1-O 3.43Å; C121-G125 PolarHBondContact O-N 2.89Å
126	E	92.9	Very high	89	Confident	54 Å²	54	63.7 Å²	63.7	25%	0.252	34%	0.335	S	S	.	.	S	Bend	trans	-80.8	161.6	-179.7	-71.8	-157.1	-157.2	0	0	114.7	C121 C124 A128 G169 R172	C121-E126 WeakPolarHBondContact CA-O 3.16Å; C121-E126 WeakPolarHBondContact CB-O 3.03Å; C121-E126 PolarHBondContact N-O 3.43Å; C124-E126 PolarHBondContact O-N 2.8Å; C124-E126 VanDerWaalsContact O-N 3.08Å; E126-A128 PolarHBondContact O-N 2.84Å; E126-G169 WeakPolarHBondContact OE1-CA 3.43Å; E126-R172 IonicContact OE1-CZ 2.96Å; E126-R172 IonicContact OE1-NE 3.86Å; E126-R172 IonicContact OE1-NH1 3.71Å; E126-R172 PolarHBondContact OE1-NH1 3.48Å; E126-R172 IonicContact OE1-NH2 3.82Å; E126-R172 PolarHBondContact OE1-NH2 2.94Å; E126-R172 IonicContact OE2-CZ 2.76Å; E126-R172 IonicContact OE2-NH1 3.34Å; E126-R172 PolarHBondContact OE2-NH1 3.43Å; E126-R172 IonicContact OE2-NH2 3.58Å; E126-R172 PolarHBondContact OE2-NH2 2.9Å
127	P	91.5	Very high	90.6	Very high	107 Å²	107	57.4 Å²	57.4	70%	0.695	31%	0.306	S	S	*	.	B	Isolated β-bridge	trans	-52.4	133.7	179.9	-28.9	36.5	0	0	0	113.9	C138	P127-C138 WeakPolarHBondContact O-CA 3.34Å; P127-C138 WeakPolarHBondContact O-CB 3.44Å
128	A	93.1	Very high	92.2	Very high	10 Å²	10	50 Å²	50	8%	0.083	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-95.4	122.8	-174.9	0	0	0	0	0	112	R119 C121 E126 G130 L136 T137	R119-A128 HydrophobicContact CB-CB 4.43Å; R119-A128 VanDerWaalsContact O-CB 3.28Å; R119-A128 WeakPolarHBondContact O-CB 3.34Å; R119-A128 PolarHBondContact O-N 2.98Å; C121-A128 HydrophobicContact CB-CB 4.4Å; E126-A128 PolarHBondContact O-N 2.84Å; A128-G130 PolarHBondContact O-N 2.92Å; A128-L136 HydrophobicContact CB-CD1 3.67Å; A128-L136 HydrophobicContact CB-CG 3.75Å; A128-T137 CarbonylContact C-O 3.57Å; A128-T137 WeakPolarHBondContact CA-O 3.33Å
129	S	91.7	Very high	93.3	Very high	72 Å²	72	48 Å²	48	50%	0.503	26%	0.263	S	S	.	.			trans	-70.3	-10.7	175	55.8	0	0	0	0	113.1	T137 E139	S129-T137 PolarHBondContact N-O 3.35Å; S129-E139 PolarHBondContact OG-N 3.44Å; S129-E139 PolarHBondContact OG-OE2 2.75Å
130	G	91.1	Very high	93.8	Very high	20 Å²	20	47.6 Å²	47.6	21%	0.206	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	147.1	-157.8	170.4	0	0	0	0	0	112.9	A128 N132 L136 T137	A128-G130 PolarHBondContact O-N 2.92Å; G130-N132 PolarHBondContact O-N 2.86Å; G130-N132 PolarHBondContact O-ND2 3.33Å; G130-L136 WeakPolarHBondContact O-CA 3.43Å; G130-T137 PolarHBondContact O-N 3.27Å
131	Y	93.2	Very high	94	Very high	137 Å²	137	44 Å²	44	54%	0.537	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	106.2	171.6	-77.1	-96.3	0	0	0	110	R135 L136	Y131-R135 WeakPolarHBondContact CA-O 3.43Å; Y131-L136 HydrophobicContact CE2-CD1 4.45Å
132	N	93.8	Very high	94.1	Very high	22 Å²	22	46.6 Å²	46.6	12%	0.118	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	132.6	172.6	-52	-81.8	0	0	0	109.1	G130 D134 R135 T137 K142	G130-N132 PolarHBondContact O-N 2.86Å; G130-N132 PolarHBondContact O-ND2 3.33Å; N132-D134 VanDerWaalsContact C-N 3.27Å; N132-D134 PolarHBondContact O-N 3.48Å; N132-R135 PolarHBondContact N-O 3.44Å; N132-R135 PolarHBondContact O-N 3.27Å; N132-R135 VanDerWaalsContact O-O 3.07Å; N132-T137 WeakPolarHBondContact CB-OG1 3.49Å; N132-T137 PolarHBondContact ND2-O 2.64Å; N132-T137 PolarHBondContact ND2-OG1 2.69Å; N132-T137 VanDerWaalsContact ND2-OG1 3.12Å; N132-K142 HydrophobicContact CB-CB 3.84Å; N132-K142 HydrophobicContact CB-CD 4.42Å; N132-K142 HydrophobicContact CB-CG 3.81Å; N132-K142 WeakPolarHBondContact OD1-CD 3.38Å; N132-K142 WeakPolarHBondContact OD1-CE 3.44Å; N132-K142 WeakPolarHBondContact OD1-CG 3.47Å
133	F	94.9	Very high	94.1	Very high	32 Å²	32	44.2 Å²	44.2	14%	0.14	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	51	46.8	-178.8	-50	-79.5	0	0	0	112.2	R135 K142 F145 R146 M188 K189 L192 I193	F133-R135 VanDerWaalsContact C-N 3.31Å; F133-R135 PolarHBondContact O-N 2.9Å; F133-K142 HydrophobicContact CE2-CB 4.42Å; F133-K142 HydrophobicContact CE2-CG 3.93Å; F133-F145 HydrophobicContact CB-CD1 4.08Å; F133-F145 HydrophobicContact CB-CE1 3.96Å; F133-F145 HydrophobicContact CD1-CD1 4.02Å; F133-F145 HydrophobicContact CD1-CE1 4.05Å; F133-F145 AromaticContact CD2-CD1 3.67Å; F133-F145 HydrophobicContact CD2-CD1 3.67Å; F133-F145 HydrophobicContact CD2-CE1 4.35Å; F133-F145 HydrophobicContact CD2-CG 4.49Å; F133-F145 HydrophobicContact CE1-CD1 4.45Å; F133-F145 HydrophobicContact CE2-CD1 4.1Å; F133-F145 AromaticContact CG-CD1 3.63Å; F133-F145 HydrophobicContact CG-CD1 3.63Å; F133-F145 AromaticContact CG-CE1 3.85Å; F133-F145 HydrophobicContact CG-CE1 3.85Å; F133-F145 HydrophobicContact CZ-CD1 4.48Å; F133-R146 HydrophobicContact CE2-CB 4.44Å; F133-R146 HydrophobicContact CZ-CB 4Å; F133-R146 HydrophobicContact CZ-CG 4.45Å; F133-M188 HydrophobicContact CB-CB 4.27Å; F133-M188 HydrophobicContact CB-CE 4.05Å; F133-M188 HydrophobicContact CD2-CE 3.64Å; F133-M188 HydrophobicContact CG-CE 4.25Å; F133-M188 WeakPolarHBondContact O-CA 3.3Å; F133-K189 PolarHBondContact O-N 3.13Å; F133-L192 HydrophobicContact CD1-CB 3.97Å; F133-L192 WeakPolarHBondContact CE1-O 3.43Å; F133-I193 HydrophobicContact CD1-CG1 3.9Å; F133-I193 HydrophobicContact CE1-CB 4.43Å; F133-I193 HydrophobicContact CE1-CG1 3.46Å; F133-I193 VanDerWaalsContact CE1-CG1 3.46Å; F133-I193 HydrophobicContact CZ-CG1 4.21Å
134	D	91.9	Very high	94.1	Very high	69 Å²	69	45 Å²	45	37%	0.369	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.7	11.2	-173.9	-80.1	10.9	0	0	0	117.5	N132 K189 L192	N132-D134 VanDerWaalsContact C-N 3.27Å; N132-D134 PolarHBondContact O-N 3.48Å; D134-K189 HydrophobicContact CB-CD 3.99Å; D134-K189 HydrophobicContact CB-CG 4.29Å; D134-K189 VanDerWaalsContact OD2-CD 3.31Å; D134-K189 WeakPolarHBondContact OD2-CD 3.23Å; D134-K189 VanDerWaalsContact OD2-CE 3.25Å; D134-K189 WeakPolarHBondContact OD2-CE 3.44Å; D134-K189 IonicContact OD2-NZ 2.7Å; D134-K189 PolarHBondContact OD2-NZ 3.11Å; D134-L192 HydrophobicContact CB-CD1 4.41Å; D134-L192 WeakPolarHBondContact OD1-CD1 3.4Å
135	R	94.9	Very high	94.2	Very high	88 Å²	88	44.9 Å²	44.9	33%	0.332	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	141.8	-179.5	-65.2	-61.2	-180	-94.3	-0.8	115.3	I122 Y131 N132 F133 T137 V186 G187 M188	I122-R135 HydrophobicContact CD1-CB 3.89Å; I122-R135 HydrophobicContact CD1-CG 4.12Å; Y131-R135 WeakPolarHBondContact CA-O 3.43Å; N132-R135 PolarHBondContact N-O 3.44Å; N132-R135 PolarHBondContact O-N 3.27Å; N132-R135 VanDerWaalsContact O-O 3.07Å; F133-R135 VanDerWaalsContact C-N 3.31Å; F133-R135 PolarHBondContact O-N 2.9Å; R135-T137 HydrophobicContact CB-CG2 4.26Å; R135-T137 PolarHBondContact O-N 3.03Å; R135-T137 VanDerWaalsContact O-N 3.11Å; R135-T137 PolarHBondContact O-OG1 2.98Å; R135-V186 WeakPolarHBondContact CD-O 3.48Å; R135-V186 PolarHBondContact NE-O 3.07Å; R135-G187 WeakPolarHBondContact CG-O 3.49Å; R135-G187 PolarHBondContact NE-O 2.99Å; R135-M188 HydrophobicContact CB-CG 4.03Å; R135-M188 HydrophobicContact CG-CG 4.16Å
136	L	94.7	Very high	94.2	Very high	40 Å²	40	50 Å²	50	21%	0.209	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	107.1	178.2	-175.7	66.1	0	0	0	110.2	I122 A128 G130 Y131	I122-L136 PolarHBondContact N-O 2.98Å; A128-L136 HydrophobicContact CB-CD1 3.67Å; A128-L136 HydrophobicContact CB-CG 3.75Å; G130-L136 WeakPolarHBondContact O-CA 3.43Å; Y131-L136 HydrophobicContact CE2-CD1 4.45Å
137	T	95.1	Very high	94.2	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	151.3	-166.4	45.6	0	0	0	0	113.1	V123 A128 S129 G130 N132 R135 C141 M188	V123-T137 HydrophobicContact CG2-CG2 3.96Å; A128-T137 CarbonylContact C-O 3.57Å; A128-T137 WeakPolarHBondContact CA-O 3.33Å; S129-T137 PolarHBondContact N-O 3.35Å; G130-T137 PolarHBondContact O-N 3.27Å; N132-T137 WeakPolarHBondContact CB-OG1 3.49Å; N132-T137 PolarHBondContact ND2-O 2.64Å; N132-T137 PolarHBondContact ND2-OG1 2.69Å; N132-T137 VanDerWaalsContact ND2-OG1 3.12Å; R135-T137 HydrophobicContact CB-CG2 4.26Å; R135-T137 PolarHBondContact O-N 3.03Å; R135-T137 VanDerWaalsContact O-N 3.11Å; R135-T137 PolarHBondContact O-OG1 2.98Å; T137-C141 HydrophobicContact CG2-CB 4.45Å; T137-M188 HydrophobicContact CG2-CE 4.24Å; T137-M188 HydrophobicContact CG2-SD 3.99Å
138	C	95.7	Very high	94.4	Very high	5 Å²	5	50.9 Å²	50.9	3%	0.034	24%	0.243	C	C	.	.			trans	-74.7	157.6	172.5	73.7	0	0	0	0	112	C121 P127 S140 C141 K142	C121-C138 HydrophobicContact CB-CB 3.88Å; C121-C138 PolarHBondContact SG-N 3.39Å; C121-C138 VanDerWaalsContact SG-SG 3.7Å; P127-C138 WeakPolarHBondContact O-CA 3.34Å; P127-C138 WeakPolarHBondContact O-CB 3.44Å; C138-S140 PolarHBondContact O-N 3.38Å; C138-S140 PolarHBondContact SG-OG 3.38Å; C138-S140 VanDerWaalsContact SG-OG 3.38Å; C138-C141 PolarHBondContact O-N 2.99Å; C138-C141 VanDerWaalsContact SG-SG 3.61Å; C138-K142 PolarHBondContact O-N 2.57Å; C138-K142 VanDerWaalsContact O-N 3.11Å
139	E	94.4	Very high	94.4	Very high	94 Å²	94	51.1 Å²	51.1	44%	0.439	25%	0.245	S	C	.	.	H	α-helix	trans	-56.4	-36.9	-178.2	-164.6	60.8	-156.4	0	0	112.6	S129 C141 K142 A143	S129-E139 PolarHBondContact OG-N 3.44Å; S129-E139 PolarHBondContact OG-OE2 2.75Å; E139-C141 VanDerWaalsContact C-N 3.32Å; E139-C141 PolarHBondContact O-N 3.46Å; E139-K142 VanDerWaalsContact CD-CD 3.42Å; E139-K142 WeakPolarHBondContact O-CB 3.34Å; E139-K142 PolarHBondContact O-N 3.1Å; E139-K142 WeakPolarHBondContact OE1-CD 3.39Å; E139-K142 WeakPolarHBondContact OE1-CE 3.22Å; E139-K142 IonicContact OE1-NZ 2.94Å; E139-K142 PolarHBondContact OE1-NZ 3.43Å; E139-K142 WeakPolarHBondContact OE2-CD 3.48Å; E139-K142 IonicContact OE2-NZ 3.68Å; E139-K142 PolarHBondContact OE2-NZ 2.67Å; E139-A143 WeakPolarHBondContact O-CB 3.48Å; E139-A143 PolarHBondContact O-N 2.76Å
140	S	94.9	Very high	94.4	Very high	41 Å²	41	52.1 Å²	52.1	29%	0.287	24%	0.244	S	C	.	.	H	α-helix	trans	-67.3	-30.5	177.3	87.1	0	0	0	0	113.1	C138 F144 R172 R179	C138-S140 PolarHBondContact O-N 3.38Å; C138-S140 PolarHBondContact SG-OG 3.38Å; C138-S140 VanDerWaalsContact SG-OG 3.38Å; S140-F144 WeakPolarHBondContact O-CB 3.18Å; S140-F144 PolarHBondContact O-N 3.34Å; S140-R172 PolarHBondContact OG-NH1 2.95Å; S140-R179 VanDerWaalsContact C-NH2 3.27Å; S140-R179 PolarHBondContact O-NH2 3.43Å; S140-R179 PolarHBondContact OG-NH2 2.8Å
141	C	97.2	Very high	94.4	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-76.7	-42.3	175.6	-75.5	0	0	0	0	111.8	T137 C138 E139 F144 F145 R179	T137-C141 HydrophobicContact CG2-CB 4.45Å; C138-C141 PolarHBondContact O-N 2.99Å; C138-C141 VanDerWaalsContact SG-SG 3.61Å; E139-C141 VanDerWaalsContact C-N 3.32Å; E139-C141 PolarHBondContact O-N 3.46Å; C141-F144 PolarHBondContact O-N 3.01Å; C141-F145 VanDerWaalsContact O-CB 3.28Å; C141-F145 WeakPolarHBondContact O-CB 3.28Å; C141-F145 PolarHBondContact O-N 2.81Å; C141-R179 PolarHBondContact SG-NH2 3.08Å
142	K	96	Very high	94.2	Very high	56 Å²	56	52.6 Å²	52.6	24%	0.243	25%	0.251	C	S	.	.	H	α-helix	trans	-53.6	-52.9	169.3	172.4	-156.4	-165.3	-175.6	0	111.5	N132 F133 C138 E139 F144 F145 R146	N132-K142 HydrophobicContact CB-CB 3.84Å; N132-K142 HydrophobicContact CB-CD 4.42Å; N132-K142 HydrophobicContact CB-CG 3.81Å; N132-K142 WeakPolarHBondContact OD1-CD 3.38Å; N132-K142 WeakPolarHBondContact OD1-CE 3.44Å; N132-K142 WeakPolarHBondContact OD1-CG 3.47Å; F133-K142 HydrophobicContact CE2-CB 4.42Å; F133-K142 HydrophobicContact CE2-CG 3.93Å; C138-K142 PolarHBondContact O-N 2.57Å; C138-K142 VanDerWaalsContact O-N 3.11Å; E139-K142 VanDerWaalsContact CD-CD 3.42Å; E139-K142 WeakPolarHBondContact O-CB 3.34Å; E139-K142 PolarHBondContact O-N 3.1Å; E139-K142 WeakPolarHBondContact OE1-CD 3.39Å; E139-K142 WeakPolarHBondContact OE1-CE 3.22Å; E139-K142 IonicContact OE1-NZ 2.94Å; E139-K142 PolarHBondContact OE1-NZ 3.43Å; E139-K142 WeakPolarHBondContact OE2-CD 3.48Å; E139-K142 IonicContact OE2-NZ 3.68Å; E139-K142 PolarHBondContact OE2-NZ 2.67Å; K142-F144 VanDerWaalsContact C-N 3.33Å; K142-F144 PolarHBondContact O-N 3.44Å; K142-F145 PolarHBondContact O-N 3.48Å; K142-R146 WeakPolarHBondContact O-CB 2.89Å; K142-R146 PolarHBondContact O-N 3.5Å
143	A	94.8	Very high	93.7	Very high	27 Å²	27	60.9 Å²	60.9	22%	0.223	28%	0.28	C	S	.	.	H	α-helix	trans	-70.4	-25.5	179.7	0	0	0	0	0	113.7	E139 R147	E139-A143 WeakPolarHBondContact O-CB 3.48Å; E139-A143 PolarHBondContact O-N 2.76Å; A143-R147 WeakPolarHBondContact O-CG 3.44Å; A143-R147 PolarHBondContact O-NE 3.42Å
144	F	96.4	Very high	93.2	Very high	17 Å²	17	66.4 Å²	66.4	8%	0.075	31%	0.311	C	S	.	.	H	α-helix	trans	-74.3	-46.5	171.6	173.7	-91.4	0	0	0	111.9	S140 C141 K142 R147 N148 P176 R179 L180	S140-F144 WeakPolarHBondContact O-CB 3.18Å; S140-F144 PolarHBondContact O-N 3.34Å; C141-F144 PolarHBondContact O-N 3.01Å; K142-F144 VanDerWaalsContact C-N 3.33Å; K142-F144 PolarHBondContact O-N 3.44Å; F144-R147 PolarHBondContact O-N 3.11Å; F144-N148 WeakPolarHBondContact CE2-ND2 3.5Å; F144-N148 HydrophobicContact CZ-CB 4.47Å; F144-N148 PolarHBondContact O-N 2.85Å; F144-N148 PolarHBondContact O-ND2 3.05Å; F144-P176 HydrophobicContact CE2-CB 4.28Å; F144-P176 HydrophobicContact CZ-CB 4.41Å; F144-P176 WeakPolarHBondContact CZ-O 3.19Å; F144-R179 HydrophobicContact CD1-CG 3.8Å; F144-R179 HydrophobicContact CE1-CB 3.9Å; F144-R179 HydrophobicContact CE1-CG 3.64Å; F144-R179 HydrophobicContact CG-CG 4.35Å; F144-R179 HydrophobicContact CZ-CB 3.91Å; F144-R179 HydrophobicContact CZ-CG 4.05Å; F144-L180 HydrophobicContact CE1-CB 3.87Å; F144-L180 HydrophobicContact CE1-CD1 4.31Å; F144-L180 HydrophobicContact CZ-CB 4.16Å
145	F	96.5	Very high	93.1	Very high	0 Å²	0	70.6 Å²	70.6	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-63.3	-50	-178.2	-173.8	-101.4	0	0	0	111.2	F133 C141 K142 R147 N148 A149 L180 C183 L184 M188 K189 R190 I193	F133-F145 HydrophobicContact CB-CD1 4.08Å; F133-F145 HydrophobicContact CB-CE1 3.96Å; F133-F145 HydrophobicContact CD1-CD1 4.02Å; F133-F145 HydrophobicContact CD1-CE1 4.05Å; F133-F145 AromaticContact CD2-CD1 3.67Å; F133-F145 HydrophobicContact CD2-CD1 3.67Å; F133-F145 HydrophobicContact CD2-CE1 4.35Å; F133-F145 HydrophobicContact CD2-CG 4.49Å; F133-F145 HydrophobicContact CE1-CD1 4.45Å; F133-F145 HydrophobicContact CE2-CD1 4.1Å; F133-F145 AromaticContact CG-CD1 3.63Å; F133-F145 HydrophobicContact CG-CD1 3.63Å; F133-F145 AromaticContact CG-CE1 3.85Å; F133-F145 HydrophobicContact CG-CE1 3.85Å; F133-F145 HydrophobicContact CZ-CD1 4.48Å; C141-F145 VanDerWaalsContact O-CB 3.28Å; C141-F145 WeakPolarHBondContact O-CB 3.28Å; C141-F145 PolarHBondContact O-N 2.81Å; K142-F145 PolarHBondContact O-N 3.48Å; F145-R147 PolarHBondContact O-N 3.16Å; F145-R147 VanDerWaalsContact O-N 3.08Å; F145-N148 PolarHBondContact O-N 3.48Å; F145-A149 HydrophobicContact CD1-CB 4.14Å; F145-A149 HydrophobicContact CD2-CB 3.77Å; F145-A149 HydrophobicContact CE1-CB 3.88Å; F145-A149 HydrophobicContact CE2-CB 3.5Å; F145-A149 VanDerWaalsContact CE2-CB 3.5Å; F145-A149 HydrophobicContact CG-CB 4.09Å; F145-A149 HydrophobicContact CZ-CB 3.55Å; F145-A149 WeakPolarHBondContact O-CB 3.41Å; F145-A149 PolarHBondContact O-N 2.96Å; F145-L180 HydrophobicContact CD2-CD1 3.93Å; F145-L180 HydrophobicContact CE2-CD1 4.23Å; F145-C183 HydrophobicContact CD2-CB 3.63Å; F145-C183 HydrophobicContact CE2-CB 4.12Å; F145-L184 HydrophobicContact CE2-CD2 3.92Å; F145-L184 HydrophobicContact CE2-CG 4.41Å; F145-L184 HydrophobicContact CZ-CD2 4.32Å; F145-M188 HydrophobicContact CB-CE 3.64Å; F145-M188 HydrophobicContact CB-SD 4.25Å; F145-M188 HydrophobicContact CD1-CB 4.29Å; F145-M188 HydrophobicContact CD1-CE 3.94Å; F145-M188 HydrophobicContact CD2-CB 3.89Å; F145-M188 HydrophobicContact CD2-CE 4.26Å; F145-M188 HydrophobicContact CD2-SD 4.11Å; F145-M188 HydrophobicContact CE1-CB 3.99Å; F145-M188 HydrophobicContact CE2-CB 3.55Å; F145-M188 HydrophobicContact CG-CB 4.25Å; F145-M188 HydrophobicContact CG-CE 3.69Å; F145-M188 HydrophobicContact CG-SD 4.14Å; F145-M188 HydrophobicContact CZ-CB 3.62Å; F145-M188 VanDerWaalsContact CZ-O 3.25Å; F145-M188 WeakPolarHBondContact CZ-O 3.28Å; F145-K189 WeakPolarHBondContact CE1-O 3.3Å; F145-R190 HydrophobicContact CZ-CB 4.3Å; F145-I193 HydrophobicContact CD1-CD1 3.95Å; F145-I193 HydrophobicContact CD1-CG1 4.47Å; F145-I193 HydrophobicContact CE1-CD1 3.78Å; F145-I193 HydrophobicContact CE1-CG1 4.29Å
146	R	94.7	Very high	92.8	Very high	159 Å²	159	67.3 Å²	67.3	60%	0.6	32%	0.315	S	S	*	.	H	α-helix	trans	-52.5	-32.4	175.1	-172.6	175	69.7	-176	0.7	113.5	F133 K142 I193	F133-R146 HydrophobicContact CE2-CB 4.44Å; F133-R146 HydrophobicContact CZ-CB 4Å; F133-R146 HydrophobicContact CZ-CG 4.45Å; K142-R146 WeakPolarHBondContact O-CB 2.89Å; K142-R146 PolarHBondContact O-N 3.5Å; R146-I193 HydrophobicContact CG-CG2 4.46Å
147	R	92.8	Very high	92.6	Very high	162 Å²	162	72.2 Å²	72.2	61%	0.611	34%	0.335	S	S	*	.	H	α-helix	trans	-87.2	-11.8	-178.1	-77.3	-172.7	-66.1	163.9	-2.8	114.9	A143 F144 F145 K151	A143-R147 WeakPolarHBondContact O-CG 3.44Å; A143-R147 PolarHBondContact O-NE 3.42Å; F144-R147 PolarHBondContact O-N 3.11Å; F145-R147 PolarHBondContact O-N 3.16Å; F145-R147 VanDerWaalsContact O-N 3.08Å; R147-K151 WeakPolarHBondContact O-CE 3.34Å; R147-K151 PolarHBondContact O-NZ 3.36Å
148	N	94.9	Very high	92.3	Very high	18 Å²	18	75.7 Å²	75.7	10%	0.096	36%	0.363	C	S	.	.	H	α-helix	trans	-137.1	-22.2	-169.9	-58.8	-68.3	0	0	0	115.3	F144 F145 L150 K151 I156 L180	F144-N148 WeakPolarHBondContact CE2-ND2 3.5Å; F144-N148 HydrophobicContact CZ-CB 4.47Å; F144-N148 PolarHBondContact O-N 2.85Å; F144-N148 PolarHBondContact O-ND2 3.05Å; F145-N148 PolarHBondContact O-N 3.48Å; N148-L150 PolarHBondContact O-N 3.39Å; N148-K151 PolarHBondContact O-N 2.98Å; N148-K151 PolarHBondContact OD1-NZ 3.37Å; N148-I156 HydrophobicContact CB-CD1 4.48Å; N148-L180 HydrophobicContact CB-CD2 4.32Å
149	A	93.7	Very high	92.2	Very high	14 Å²	14	76.3 Å²	76.3	12%	0.116	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-10.9	-176.3	0	0	0	0	0	115.3	F145 L180 R190 I193	F145-A149 HydrophobicContact CD1-CB 4.14Å; F145-A149 HydrophobicContact CD2-CB 3.77Å; F145-A149 HydrophobicContact CE1-CB 3.88Å; F145-A149 HydrophobicContact CE2-CB 3.5Å; F145-A149 VanDerWaalsContact CE2-CB 3.5Å; F145-A149 HydrophobicContact CG-CB 4.09Å; F145-A149 HydrophobicContact CZ-CB 3.55Å; F145-A149 WeakPolarHBondContact O-CB 3.41Å; F145-A149 PolarHBondContact O-N 2.96Å; A149-L180 HydrophobicContact CB-CD1 3.96Å; A149-R190 HydrophobicContact CB-CB 4.33Å; A149-I193 HydrophobicContact CB-CD1 3.76Å
150	L	91.7	Very high	92	Very high	94 Å²	94	78.6 Å²	78.6	49%	0.492	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.8	4.8	171.5	-59.5	-175.7	0	0	0	113.3	N148 R190 I193	N148-L150 PolarHBondContact O-N 3.39Å; L150-R190 HydrophobicContact CD2-CB 4.26Å; L150-I193 HydrophobicContact CD1-CB 3.99Å; L150-I193 HydrophobicContact CD1-CG2 3.57Å; L150-I193 HydrophobicContact CG-CB 4.36Å; L150-I193 HydrophobicContact CG-CD1 4.12Å; L150-I193 HydrophobicContact CG-CG2 4.22Å
151	K	90	Very high	91.7	Very high	95 Å²	95	85 Å²	85	41%	0.413	40%	0.401	S	S	.	.	S	Bend	trans	-84.1	146.5	176.9	-73.9	-178.1	178.8	163.1	0	111	R147 N148 K155 I156	R147-K151 WeakPolarHBondContact O-CE 3.34Å; R147-K151 PolarHBondContact O-NZ 3.36Å; N148-K151 PolarHBondContact O-N 2.98Å; N148-K151 PolarHBondContact OD1-NZ 3.37Å; K151-K155 HydrophobicContact CB-CB 4.48Å; K151-K155 HydrophobicContact CD-CB 4.41Å; K151-I156 HydrophobicContact CB-CD1 4.27Å; K151-I156 HydrophobicContact CB-CG1 4.3Å; K151-I156 HydrophobicContact CD-CG1 4.4Å
152	P	88.2	Confident	91.1	Very high	72 Å²	72	88.6 Å²	88.6	47%	0.468	44%	0.438	S	S	.	.			trans	-52.1	145	159.6	-23.9	34.1	0	0	0	110.9	D154 K155	P152-D154 PolarHBondContact O-N 3.06Å; P152-D154 VanDerWaalsContact O-N 3.14Å; P152-K155 HydrophobicContact CB-CG 4.43Å; P152-K155 HydrophobicContact CG-CD 4.38Å; P152-K155 PolarHBondContact O-N 3.5Å
153	R	84.1	Confident	90.8	Very high	196 Å²	196	87.1 Å²	87.1	74%	0.74	44%	0.439	S	S	*	.	G	3₁₀ helix	trans	-57	-34.5	-173.9	-165	177.1	-169	172.7	3.1	112	K155 I156	R153-K155 VanDerWaalsContact C-N 3.27Å; R153-K155 PolarHBondContact O-N 2.91Å; R153-I156 WeakPolarHBondContact O-CB 3.43Å; R153-I156 PolarHBondContact O-N 3.43Å; R153-I156 VanDerWaalsContact O-N 3.16Å
154	D	85.5	Confident	90.5	Very high	147 Å²	147	89.7 Å²	89.7	79%	0.786	47%	0.468	S	S	*	.	G	3₁₀ helix	trans	-74.8	-18.5	-174.6	-29.6	-73.7	0	0	0	112	P152 I156	P152-D154 PolarHBondContact O-N 3.06Å; P152-D154 VanDerWaalsContact O-N 3.14Å; D154-I156 PolarHBondContact O-N 3.34Å
155	K	88.3	Confident	90.3	Very high	157 Å²	157	89.7 Å²	89.7	68%	0.683	47%	0.47	S	S	*	.	G	3₁₀ helix	trans	-88	14.5	172	-58.7	-167.8	-178.4	-174.9	0	112.8	K151 P152 R153	K151-K155 HydrophobicContact CB-CB 4.48Å; K151-K155 HydrophobicContact CD-CB 4.41Å; P152-K155 HydrophobicContact CB-CG 4.43Å; P152-K155 HydrophobicContact CG-CD 4.38Å; P152-K155 PolarHBondContact O-N 3.5Å; R153-K155 VanDerWaalsContact C-N 3.27Å; R153-K155 PolarHBondContact O-N 2.91Å
156	I	88.4	Confident	90.1	Very high	20 Å²	20	92.3 Å²	92.3	10%	0.103	49%	0.492	C	S	.	.	S	Bend	trans	-125.6	125.7	175.8	-60	158.1	0	0	0	107.6	N148 K151 R153 D154 A158 P176 L180	N148-I156 HydrophobicContact CB-CD1 4.48Å; K151-I156 HydrophobicContact CB-CD1 4.27Å; K151-I156 HydrophobicContact CB-CG1 4.3Å; K151-I156 HydrophobicContact CD-CG1 4.4Å; R153-I156 WeakPolarHBondContact O-CB 3.43Å; R153-I156 PolarHBondContact O-N 3.43Å; R153-I156 VanDerWaalsContact O-N 3.16Å; D154-I156 PolarHBondContact O-N 3.34Å; I156-A158 PolarHBondContact O-N 3.21Å; I156-A158 VanDerWaalsContact O-N 3.1Å; I156-P176 HydrophobicContact CG2-CB 3.9Å; I156-L180 HydrophobicContact CD1-CD2 3.49Å; I156-L180 VanDerWaalsContact CD1-CD2 3.49Å
157	K	90.4	Very high	90	Very high	142 Å²	142	84.9 Å²	84.9	62%	0.617	46%	0.464	S	S	*	.			trans	-54.4	120.7	-179.7	-175.2	176.2	179.3	176.2	0	110.5	P176	K157-P176 HydrophobicContact CB-CG 4.39Å
158	A	89.1	Confident	89.8	Confident	73 Å²	73	82 Å²	82	60%	0.603	46%	0.457	S	S	*	.			trans	-58.3	161.8	179.1	0	0	0	0	0	112.3	I156 N160	I156-A158 PolarHBondContact O-N 3.21Å; I156-A158 VanDerWaalsContact O-N 3.1Å; A158-N160 PolarHBondContact O-N 2.88Å
159	C	93.3	Very high	89.1	Confident	19 Å²	19	82.3 Å²	82.3	13%	0.128	47%	0.465	C	S	.	.			trans	-79.1	112.6	178.1	-171.8	0	0	0	0	110.7	R161 G162 G163 C165 C175 C178	C159-R161 PolarHBondContact O-N 3.13Å; C159-R161 PolarHBondContact SG-N 3.38Å; C159-R161 VanDerWaalsContact SG-N 3.41Å; C159-G162 PolarHBondContact O-N 3.49Å; C159-G163 PolarHBondContact SG-O 2.86Å; C159-C165 PolarHBondContact SG-SG 3.28Å; C159-C175 VanDerWaalsContact SG-SG 3.6Å; C159-C178 VanDerWaalsContact SG-SG 3.68Å
160	N	90.5	Very high	88.5	Confident	141 Å²	141	86.8 Å²	86.8	75%	0.754	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-14.8	170.9	-73	55	0	0	0	114.3	A158	A158-N160 PolarHBondContact O-N 2.88Å
161	R	88.7	Confident	87.9	Confident	175 Å²	175	87.7 Å²	87.7	66%	0.66	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.4	19.2	179.7	-61.6	-170.7	-71.6	-149.9	-0.9	113.2	C159 G163 C165	C159-R161 PolarHBondContact O-N 3.13Å; C159-R161 PolarHBondContact SG-N 3.38Å; C159-R161 VanDerWaalsContact SG-N 3.41Å; R161-G163 PolarHBondContact O-N 3.21Å; R161-C165 PolarHBondContact NE-SG 3.38Å; R161-C165 PolarHBondContact NH2-SG 3.43Å
162	G	86.1	Confident	87.6	Confident	76 Å²	76	84.3 Å²	84.3	78%	0.784	47%	0.473	S	S	*	.	S	Bend	trans	73.9	-42.2	-177.4	0	0	0	0	0	114.6	C159	C159-G162 PolarHBondContact O-N 3.49Å
163	G	89.3	Confident	87.5	Confident	25 Å²	25	87.6 Å²	87.6	26%	0.258	48%	0.48	S	S	.	.	S	Bend	trans	-173.7	-155.2	177.7	0	0	0	0	0	111.4	C159 R161 C165 C178	C159-G163 PolarHBondContact SG-O 2.86Å; R161-G163 PolarHBondContact O-N 3.21Å; G163-C165 PolarHBondContact O-N 3.44Å; G163-C178 VanDerWaalsContact C-SG 3.55Å
164	G	87.9	Confident	87.7	Confident	81 Å²	81	84.7 Å²	84.7	84%	0.835	47%	0.474	S	S	*	.			trans	62.9	5.3	157.7	0	0	0	0	0	118.8	A166	G164-A166 PolarHBondContact O-N 3.47Å
165	C	93.1	Very high	88.1	Confident	17 Å²	17	78 Å²	78	12%	0.115	44%	0.439	C	S	.	.			trans	-59.9	130.2	-178.9	-73.5	0	0	0	0	112	C159 R161 G163 I167 C175 C178	C159-C165 PolarHBondContact SG-SG 3.28Å; R161-C165 PolarHBondContact NE-SG 3.38Å; R161-C165 PolarHBondContact NH2-SG 3.43Å; G163-C165 PolarHBondContact O-N 3.44Å; C165-I167 HydrophobicContact CB-CD1 4.47Å; C165-I167 WeakPolarHBondContact O-CG1 3.49Å; C165-I167 PolarHBondContact O-N 3.01Å; C165-C175 HydrophobicContact CB-CB 3.8Å; C165-C178 HydrophobicContact CB-CB 3.82Å
166	A	91	Very high	88.4	Confident	56 Å²	56	72.2 Å²	72.2	46%	0.463	42%	0.418	S	S	.	.			trans	-56.4	135.2	167.2	0	0	0	0	0	110.9	G164	G164-A166 PolarHBondContact O-N 3.47Å
167	I	92.4	Very high	88.6	Confident	3 Å²	3	72.7 Å²	72.7	2%	0.015	42%	0.422	C	S	.	.			trans	-128.4	86.1	-177.3	-55.5	-61.5	0	0	0	106.3	V123 C124 C165 R172 C178 R179 K182	V123-I167 HydrophobicContact CG1-CG2 4.25Å; V123-I167 VanDerWaalsContact O-O 3.05Å; C124-I167 WeakPolarHBondContact CA-O 3.48Å; C124-I167 HydrophobicContact CB-CG2 4.23Å; C165-I167 HydrophobicContact CB-CD1 4.47Å; C165-I167 WeakPolarHBondContact O-CG1 3.49Å; C165-I167 PolarHBondContact O-N 3.01Å; I167-R172 HydrophobicContact CG2-CB 3.77Å; I167-C178 HydrophobicContact CD1-CB 4.28Å; I167-R179 HydrophobicContact CD1-CB 4.03Å; I167-R179 HydrophobicContact CG2-CB 4.48Å; I167-R179 HydrophobicContact CG2-CG 4.13Å; I167-K182 HydrophobicContact CB-CD 3.7Å; I167-K182 HydrophobicContact CG1-CD 4.07Å; I167-K182 HydrophobicContact CG2-CD 4.16Å; I167-K182 PolarHBondContact O-NZ 3.43Å
168	E	89.5	Confident	88.9	Confident	102 Å²	102	66.1 Å²	66.1	48%	0.477	40%	0.395	S	S	.	.			trans	-134.3	158.5	176	-72.2	105.5	-118.3	0	0	110.2	C124 N170 Q171 R172	C124-E168 WeakPolarHBondContact O-CA 3.38Å; E168-N170 PolarHBondContact O-N 3.44Å; E168-Q171 CarbonylContact O-C 3.58Å; E168-Q171 WeakPolarHBondContact O-CA 3.26Å; E168-Q171 WeakPolarHBondContact O-CB 3.24Å; E168-Q171 PolarHBondContact O-N 2.99Å; E168-R172 PolarHBondContact O-N 3.4Å
169	G	81	Confident	89.2	Confident	24 Å²	24	63.5 Å²	63.5	25%	0.247	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	45.9	-129.7	162.1	0	0	0	0	0	114.7	C124 E126 R172	C124-G169 PolarHBondContact O-N 2.89Å; E126-G169 WeakPolarHBondContact OE1-CA 3.43Å; G169-R172 WeakPolarHBondContact O-CD 3.24Å; G169-R172 WeakPolarHBondContact O-CG 3.45Å; G169-R172 PolarHBondContact O-NE 2.86Å
170	N	79.3	Confident	89.4	Confident	107 Å²	107	63.4 Å²	63.4	57%	0.572	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-25.2	170	-93.4	-52.1	0	0	0	114.1	E168 R172 K173	E168-N170 PolarHBondContact O-N 3.44Å; N170-R172 PolarHBondContact O-N 3.39Å; N170-R172 VanDerWaalsContact O-N 3.16Å; N170-K173 PolarHBondContact O-N 2.94Å; N170-K173 PolarHBondContact OD1-NZ 2.88Å
171	Q	80.4	Confident	89.6	Confident	113 Å²	113	61.4 Å²	61.4	53%	0.528	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-61.2	-25.4	-177	-65.8	-66.1	-11.5	0	0	113.4	E168 K173 H174	E168-Q171 CarbonylContact O-C 3.58Å; E168-Q171 WeakPolarHBondContact O-CA 3.26Å; E168-Q171 WeakPolarHBondContact O-CB 3.24Å; E168-Q171 PolarHBondContact O-N 2.99Å; Q171-K173 PolarHBondContact O-N 3.25Å; Q171-H174 PolarHBondContact O-N 3.32Å; Q171-H174 PolarHBondContact O-ND1 3.12Å; Q171-H174 PolarHBondContact OE1-CE1 2.91Å; Q171-H174 PolarHBondContact OE1-ND1 2.83Å
172	R	83.2	Confident	89.9	Confident	24 Å²	24	56.1 Å²	56.1	9%	0.091	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-53.3	-7.7	172.3	74.5	-168	165	-166.9	-17.2	115.7	C124 E126 S140 I167 E168 G169 N170 R179	C124-R172 HydrophobicContact CB-CB 4.32Å; E126-R172 IonicContact OE1-CZ 2.96Å; E126-R172 IonicContact OE1-NE 3.86Å; E126-R172 IonicContact OE1-NH1 3.71Å; E126-R172 PolarHBondContact OE1-NH1 3.48Å; E126-R172 IonicContact OE1-NH2 3.82Å; E126-R172 PolarHBondContact OE1-NH2 2.94Å; E126-R172 IonicContact OE2-CZ 2.76Å; E126-R172 IonicContact OE2-NH1 3.34Å; E126-R172 PolarHBondContact OE2-NH1 3.43Å; E126-R172 IonicContact OE2-NH2 3.58Å; E126-R172 PolarHBondContact OE2-NH2 2.9Å; S140-R172 PolarHBondContact OG-NH1 2.95Å; I167-R172 HydrophobicContact CG2-CB 3.77Å; E168-R172 PolarHBondContact O-N 3.4Å; G169-R172 WeakPolarHBondContact O-CD 3.24Å; G169-R172 WeakPolarHBondContact O-CG 3.45Å; G169-R172 PolarHBondContact O-NE 2.86Å; N170-R172 PolarHBondContact O-N 3.39Å; N170-R172 VanDerWaalsContact O-N 3.16Å; R172-R179 WeakPolarHBondContact O-CD 3.47Å; R172-R179 PolarHBondContact O-NH1 2.8Å
173	K	87.1	Confident	90.5	Very high	141 Å²	141	52.5 Å²	52.5	61%	0.613	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-81.5	-28.8	175.1	-68.2	170.8	178.3	162.7	0	112.9	N170 Q171	N170-K173 PolarHBondContact O-N 2.94Å; N170-K173 PolarHBondContact OD1-NZ 2.88Å; Q171-K173 PolarHBondContact O-N 3.25Å
174	H	87.2	Confident	90.8	Very high	135 Å²	135	55.3 Å²	55.3	63%	0.625	31%	0.306	S	S	*	.	S	Bend	trans	-72.8	-34.7	-165.1	-68	118	0	0	0	115.9	Q171	Q171-H174 PolarHBondContact O-N 3.32Å; Q171-H174 PolarHBondContact O-ND1 3.12Å; Q171-H174 PolarHBondContact OE1-CE1 2.91Å; Q171-H174 PolarHBondContact OE1-ND1 2.83Å
175	C	94	Very high	91.2	Very high	7 Å²	7	55.5 Å²	55.5	5%	0.047	30%	0.3	C	S	.	.			trans	-125.6	97.2	-179.9	-171.4	0	0	0	0	111.8	C159 C165 S177 C178 R179	C159-C175 VanDerWaalsContact SG-SG 3.6Å; C165-C175 HydrophobicContact CB-CB 3.8Å; C175-S177 VanDerWaalsContact C-N 3.31Å; C175-S177 PolarHBondContact O-N 2.63Å; C175-C178 HydrophobicContact CB-CB 4.18Å; C175-C178 PolarHBondContact SG-N 2.94Å; C175-C178 VanDerWaalsContact SG-SG 3.61Å; C175-R179 WeakPolarHBondContact O-CB 3.38Å; C175-R179 PolarHBondContact O-N 2.74Å
176	P	93.7	Very high	91.3	Very high	36 Å²	36	56.5 Å²	56.5	23%	0.234	31%	0.305	C	S	.	.	H	α-helix	trans	-57.6	-41	173.4	-27.1	36.9	0	0	0	113	F144 I156 K157 R179 L180	F144-P176 HydrophobicContact CE2-CB 4.28Å; F144-P176 HydrophobicContact CZ-CB 4.41Å; F144-P176 WeakPolarHBondContact CZ-O 3.19Å; I156-P176 HydrophobicContact CG2-CB 3.9Å; K157-P176 HydrophobicContact CB-CG 4.39Å; P176-R179 PolarHBondContact O-N 2.68Å; P176-L180 PolarHBondContact O-N 3.41Å
177	S	94.4	Very high	91.5	Very high	29 Å²	29	54.8 Å²	54.8	20%	0.203	29%	0.294	C	S	.	.	H	α-helix	trans	-56.4	-61.9	177.7	-176.6	0	0	0	0	111.8	C175 R179 L180 E181	C175-S177 VanDerWaalsContact C-N 3.31Å; C175-S177 PolarHBondContact O-N 2.63Å; S177-R179 VanDerWaalsContact C-N 3.26Å; S177-R179 PolarHBondContact O-N 2.91Å; S177-L180 PolarHBondContact O-N 3.12Å; S177-E181 WeakPolarHBondContact O-CB 3.35Å; S177-E181 PolarHBondContact O-N 3.43Å
178	C	95.8	Very high	91.7	Very high	5 Å²	5	55 Å²	55	3%	0.034	30%	0.295	C	S	.	.	H	α-helix	trans	-65.6	-26.1	-179	-63.8	0	0	0	0	113.2	C159 G163 C165 I167 C175 K182	C159-C178 VanDerWaalsContact SG-SG 3.68Å; G163-C178 VanDerWaalsContact C-SG 3.55Å; C165-C178 HydrophobicContact CB-CB 3.82Å; I167-C178 HydrophobicContact CD1-CB 4.28Å; C175-C178 HydrophobicContact CB-CB 4.18Å; C175-C178 PolarHBondContact SG-N 2.94Å; C175-C178 VanDerWaalsContact SG-SG 3.61Å; C178-K182 WeakPolarHBondContact O-CB 3.39Å; C178-K182 PolarHBondContact O-N 3.27Å
179	R	96.1	Very high	91.9	Very high	17 Å²	17	53.6 Å²	53.6	6%	0.064	29%	0.287	C	S	.	.	H	α-helix	trans	-67	-43.4	171.5	-172.4	177.4	-174.5	168.4	0.7	111.7	S140 C141 F144 I167 R172 C175 P176 S177 K182 C183	S140-R179 VanDerWaalsContact C-NH2 3.27Å; S140-R179 PolarHBondContact O-NH2 3.43Å; S140-R179 PolarHBondContact OG-NH2 2.8Å; C141-R179 PolarHBondContact SG-NH2 3.08Å; F144-R179 HydrophobicContact CD1-CG 3.8Å; F144-R179 HydrophobicContact CE1-CB 3.9Å; F144-R179 HydrophobicContact CE1-CG 3.64Å; F144-R179 HydrophobicContact CG-CG 4.35Å; F144-R179 HydrophobicContact CZ-CB 3.91Å; F144-R179 HydrophobicContact CZ-CG 4.05Å; I167-R179 HydrophobicContact CD1-CB 4.03Å; I167-R179 HydrophobicContact CG2-CB 4.48Å; I167-R179 HydrophobicContact CG2-CG 4.13Å; R172-R179 WeakPolarHBondContact O-CD 3.47Å; R172-R179 PolarHBondContact O-NH1 2.8Å; C175-R179 WeakPolarHBondContact O-CB 3.38Å; C175-R179 PolarHBondContact O-N 2.74Å; P176-R179 PolarHBondContact O-N 2.68Å; S177-R179 VanDerWaalsContact C-N 3.26Å; S177-R179 PolarHBondContact O-N 2.91Å; R179-K182 PolarHBondContact O-N 2.77Å; R179-C183 PolarHBondContact O-N 3.01Å; R179-C183 PolarHBondContact O-SG 2.95Å
180	L	96.1	Very high	92.4	Very high	18 Å²	18	60.1 Å²	60.1	9%	0.094	30%	0.304	C	S	.	.	H	α-helix	trans	-69.1	-41.5	177.7	-175.8	63.8	0	0	0	111.2	F144 F145 N148 A149 I156 P176 S177 K182 C183 L184	F144-L180 HydrophobicContact CE1-CB 3.87Å; F144-L180 HydrophobicContact CE1-CD1 4.31Å; F144-L180 HydrophobicContact CZ-CB 4.16Å; F145-L180 HydrophobicContact CD2-CD1 3.93Å; F145-L180 HydrophobicContact CE2-CD1 4.23Å; N148-L180 HydrophobicContact CB-CD2 4.32Å; A149-L180 HydrophobicContact CB-CD1 3.96Å; I156-L180 HydrophobicContact CD1-CD2 3.49Å; I156-L180 VanDerWaalsContact CD1-CD2 3.49Å; P176-L180 PolarHBondContact O-N 3.41Å; S177-L180 PolarHBondContact O-N 3.12Å; L180-K182 PolarHBondContact O-N 2.97Å; L180-C183 WeakPolarHBondContact O-CB 3.49Å; L180-C183 PolarHBondContact O-N 2.95Å; L180-C183 VanDerWaalsContact O-N 3.15Å; L180-L184 HydrophobicContact CG-CD1 4.15Å; L180-L184 WeakPolarHBondContact O-CG 3.34Å; L180-L184 PolarHBondContact O-N 3.2Å
181	E	95.2	Very high	93	Very high	98 Å²	98	61 Å²	61	46%	0.458	31%	0.305	S	S	.	.	H	α-helix	trans	-53.2	-50.3	171	-175.6	172.6	-134.4	0	0	111.4	S177 C183 L184 A185	S177-E181 WeakPolarHBondContact O-CB 3.35Å; S177-E181 PolarHBondContact O-N 3.43Å; E181-C183 PolarHBondContact O-N 3.29Å; E181-L184 PolarHBondContact O-N 2.87Å; E181-A185 VanDerWaalsContact O-CB 3.28Å; E181-A185 WeakPolarHBondContact O-CB 3.47Å; E181-A185 PolarHBondContact O-N 3.44Å
182	K	96	Very high	93.4	Very high	65 Å²	65	58.7 Å²	58.7	28%	0.283	30%	0.296	S	S	.	.	H	α-helix	trans	-64.5	-37.1	175.6	-164.9	176.2	-178.6	-175.6	0	112.7	V123 I167 C178 R179 L180 A185 V186	V123-K182 HydrophobicContact CG1-CG 4.5Å; V123-K182 VanDerWaalsContact O-CD 3.26Å; V123-K182 WeakPolarHBondContact O-CD 3.39Å; V123-K182 WeakPolarHBondContact O-CE 3.44Å; V123-K182 PolarHBondContact O-NZ 3.44Å; I167-K182 HydrophobicContact CB-CD 3.7Å; I167-K182 HydrophobicContact CG1-CD 4.07Å; I167-K182 HydrophobicContact CG2-CD 4.16Å; I167-K182 PolarHBondContact O-NZ 3.43Å; C178-K182 WeakPolarHBondContact O-CB 3.39Å; C178-K182 PolarHBondContact O-N 3.27Å; R179-K182 PolarHBondContact O-N 2.77Å; L180-K182 PolarHBondContact O-N 2.97Å; K182-A185 PolarHBondContact O-N 3.22Å; K182-V186 WeakPolarHBondContact O-CG1 3.26Å; K182-V186 WeakPolarHBondContact O-CG2 3.43Å; K182-V186 PolarHBondContact O-N 3.12Å
183	C	96.9	Very high	93.7	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-61.2	-43.3	173.7	-67.4	0	0	0	0	112	F145 R179 L180 E181 V186 G187 M188	F145-C183 HydrophobicContact CD2-CB 3.63Å; F145-C183 HydrophobicContact CE2-CB 4.12Å; R179-C183 PolarHBondContact O-N 3.01Å; R179-C183 PolarHBondContact O-SG 2.95Å; L180-C183 WeakPolarHBondContact O-CB 3.49Å; L180-C183 PolarHBondContact O-N 2.95Å; L180-C183 VanDerWaalsContact O-N 3.15Å; E181-C183 PolarHBondContact O-N 3.29Å; C183-V186 VanDerWaalsContact O-CG2 3.29Å; C183-V186 WeakPolarHBondContact O-CG2 3.24Å; C183-G187 PolarHBondContact O-N 2.78Å; C183-M188 HydrophobicContact CB-CB 4.47Å; C183-M188 HydrophobicContact CB-CG 4.34Å; C183-M188 HydrophobicContact CB-SD 3.64Å; C183-M188 VanDerWaalsContact O-CB 3.26Å; C183-M188 WeakPolarHBondContact O-CB 3.22Å; C183-M188 WeakPolarHBondContact O-CG 3.23Å; C183-M188 PolarHBondContact O-N 3.09Å
184	L	96	Very high	93.4	Very high	83 Å²	83	54.4 Å²	54.4	44%	0.435	28%	0.281	S	S	.	.	H	α-helix	trans	-70.3	-41.7	177.3	-67.8	168.3	0	0	0	111.3	F145 L180 E181 V186 G187	F145-L184 HydrophobicContact CE2-CD2 3.92Å; F145-L184 HydrophobicContact CE2-CG 4.41Å; F145-L184 HydrophobicContact CZ-CD2 4.32Å; L180-L184 HydrophobicContact CG-CD1 4.15Å; L180-L184 WeakPolarHBondContact O-CG 3.34Å; L180-L184 PolarHBondContact O-N 3.2Å; E181-L184 PolarHBondContact O-N 2.87Å; L184-V186 PolarHBondContact O-N 3.48Å; L184-G187 VanDerWaalsContact O-CA 3.31Å; L184-G187 WeakPolarHBondContact O-CA 3.31Å; L184-G187 PolarHBondContact O-N 2.97Å
185	A	96.1	Very high	92.9	Very high	85 Å²	85	51 Å²	51	70%	0.702	27%	0.27	S	S	*	.	H	α-helix	trans	-64.7	-35.3	179.5	0	0	0	0	0	113.4	E181 K182 G187	E181-A185 VanDerWaalsContact O-CB 3.28Å; E181-A185 WeakPolarHBondContact O-CB 3.47Å; E181-A185 PolarHBondContact O-N 3.44Å; K182-A185 PolarHBondContact O-N 3.22Å; A185-G187 PolarHBondContact O-N 2.9Å
186	V	95.2	Very high	91.7	Very high	38 Å²	38	54.7 Å²	54.7	23%	0.23	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-8.5	170.1	-57.2	0	0	0	0	112.9	I122 V123 R135 K182 C183 L184 M188	I122-V186 HydrophobicContact CD1-CB 3.73Å; I122-V186 HydrophobicContact CD1-CG1 4.32Å; I122-V186 HydrophobicContact CD1-CG2 3.93Å; I122-V186 HydrophobicContact CG1-CB 4Å; I122-V186 HydrophobicContact CG1-CG1 4.14Å; I122-V186 HydrophobicContact CG1-CG2 3.99Å; V123-V186 HydrophobicContact CG2-CG2 3.67Å; R135-V186 WeakPolarHBondContact CD-O 3.48Å; R135-V186 PolarHBondContact NE-O 3.07Å; K182-V186 WeakPolarHBondContact O-CG1 3.26Å; K182-V186 WeakPolarHBondContact O-CG2 3.43Å; K182-V186 PolarHBondContact O-N 3.12Å; C183-V186 VanDerWaalsContact O-CG2 3.29Å; C183-V186 WeakPolarHBondContact O-CG2 3.24Å; L184-V186 PolarHBondContact O-N 3.48Å; V186-M188 HydrophobicContact CG2-CG 4.12Å
187	G	95.1	Very high	90.6	Very high	21 Å²	21	59.1 Å²	59.1	22%	0.216	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.5	38.6	177.1	0	0	0	0	0	115.1	R135 C183 L184 A185	R135-G187 WeakPolarHBondContact CG-O 3.49Å; R135-G187 PolarHBondContact NE-O 2.99Å; C183-G187 PolarHBondContact O-N 2.78Å; L184-G187 VanDerWaalsContact O-CA 3.31Å; L184-G187 WeakPolarHBondContact O-CA 3.31Å; L184-G187 PolarHBondContact O-N 2.97Å; A185-G187 PolarHBondContact O-N 2.9Å
188	M	96.8	Very high	89.2	Confident	7 Å²	7	61.9 Å²	61.9	3%	0.034	32%	0.32	C	S	.	.			trans	-70.5	130.6	165.7	-66.3	-175.5	74.8	0	0	110.6	V123 F133 R135 T137 F145 C183 V186	V123-M188 HydrophobicContact CG2-SD 4.12Å; F133-M188 HydrophobicContact CB-CB 4.27Å; F133-M188 HydrophobicContact CB-CE 4.05Å; F133-M188 HydrophobicContact CD2-CE 3.64Å; F133-M188 HydrophobicContact CG-CE 4.25Å; F133-M188 WeakPolarHBondContact O-CA 3.3Å; R135-M188 HydrophobicContact CB-CG 4.03Å; R135-M188 HydrophobicContact CG-CG 4.16Å; T137-M188 HydrophobicContact CG2-CE 4.24Å; T137-M188 HydrophobicContact CG2-SD 3.99Å; F145-M188 HydrophobicContact CB-CE 3.64Å; F145-M188 HydrophobicContact CB-SD 4.25Å; F145-M188 HydrophobicContact CD1-CB 4.29Å; F145-M188 HydrophobicContact CD1-CE 3.94Å; F145-M188 HydrophobicContact CD2-CB 3.89Å; F145-M188 HydrophobicContact CD2-CE 4.26Å; F145-M188 HydrophobicContact CD2-SD 4.11Å; F145-M188 HydrophobicContact CE1-CB 3.99Å; F145-M188 HydrophobicContact CE2-CB 3.55Å; F145-M188 HydrophobicContact CG-CB 4.25Å; F145-M188 HydrophobicContact CG-CE 3.69Å; F145-M188 HydrophobicContact CG-SD 4.14Å; F145-M188 HydrophobicContact CZ-CB 3.62Å; F145-M188 VanDerWaalsContact CZ-O 3.25Å; F145-M188 WeakPolarHBondContact CZ-O 3.28Å; C183-M188 HydrophobicContact CB-CB 4.47Å; C183-M188 HydrophobicContact CB-CG 4.34Å; C183-M188 HydrophobicContact CB-SD 3.64Å; C183-M188 VanDerWaalsContact O-CB 3.26Å; C183-M188 WeakPolarHBondContact O-CB 3.22Å; C183-M188 WeakPolarHBondContact O-CG 3.23Å; C183-M188 PolarHBondContact O-N 3.09Å; V186-M188 HydrophobicContact CG2-CG 4.12Å
189	K	93.5	Very high	87.9	Confident	73 Å²	73	66.1 Å²	66.1	32%	0.317	34%	0.343	S	S	.	.			trans	-89.9	117.8	-172.3	-76.8	-172.8	169.5	170.4	0	114.2	F133 D134 F145 E191 L192	F133-K189 PolarHBondContact O-N 3.13Å; D134-K189 HydrophobicContact CB-CD 3.99Å; D134-K189 HydrophobicContact CB-CG 4.29Å; D134-K189 VanDerWaalsContact OD2-CD 3.31Å; D134-K189 WeakPolarHBondContact OD2-CD 3.23Å; D134-K189 VanDerWaalsContact OD2-CE 3.25Å; D134-K189 WeakPolarHBondContact OD2-CE 3.44Å; D134-K189 IonicContact OD2-NZ 2.7Å; D134-K189 PolarHBondContact OD2-NZ 3.11Å; F145-K189 WeakPolarHBondContact CE1-O 3.3Å; K189-E191 WeakPolarHBondContact CA-OE2 3.38Å; K189-E191 VanDerWaalsContact CB-CD 3.49Å; K189-E191 HydrophobicContact CB-CG 4.21Å; K189-E191 WeakPolarHBondContact CB-OE2 3.2Å; K189-E191 HydrophobicContact CD-CG 4.37Å; K189-E191 WeakPolarHBondContact CD-OE1 3.22Å; K189-E191 WeakPolarHBondContact CE-OE1 3.47Å; K189-E191 WeakPolarHBondContact CG-OE1 3.32Å; K189-L192 HydrophobicContact CB-CB 4.37Å; K189-L192 HydrophobicContact CB-CD1 3.92Å; K189-L192 HydrophobicContact CB-CG 3.93Å; K189-L192 HydrophobicContact CD-CD1 3.94Å; K189-L192 HydrophobicContact CD-CG 4.25Å; K189-L192 PolarHBondContact O-N 3.12Å
190	R	92.7	Very high	86.5	Confident	160 Å²	160	71.6 Å²	71.6	60%	0.604	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-73.3	-28.1	177.5	62.3	-179.4	172.5	-175.6	-2.4	112.8	F145 A149 L150 L192 I193	F145-R190 HydrophobicContact CZ-CB 4.3Å; A149-R190 HydrophobicContact CB-CB 4.33Å; L150-R190 HydrophobicContact CD2-CB 4.26Å; R190-L192 PolarHBondContact O-N 3.17Å; R190-I193 WeakPolarHBondContact O-CB 3.41Å; R190-I193 PolarHBondContact O-N 2.81Å
191	E	90.6	Very high	84.9	Confident	126 Å²	126	77 Å²	77	59%	0.589	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-66	-14.9	175.4	65.1	-88.1	-150.7	0	0	113.5	K189 I193	K189-E191 WeakPolarHBondContact CA-OE2 3.38Å; K189-E191 VanDerWaalsContact CB-CD 3.49Å; K189-E191 HydrophobicContact CB-CG 4.21Å; K189-E191 WeakPolarHBondContact CB-OE2 3.2Å; K189-E191 HydrophobicContact CD-CG 4.37Å; K189-E191 WeakPolarHBondContact CD-OE1 3.22Å; K189-E191 WeakPolarHBondContact CE-OE1 3.47Å; K189-E191 WeakPolarHBondContact CG-OE1 3.32Å; E191-I193 VanDerWaalsContact C-N 3.34Å
192	L	89.1	Confident	83.4	Confident	64 Å²	64	78 Å²	78	34%	0.335	39%	0.393	S	S	.	.	G	3₁₀ helix	trans	-91.7	8.4	171.7	-61.6	-179.2	0	0	0	112.8	F133 D134 K189 R190	F133-L192 HydrophobicContact CD1-CB 3.97Å; F133-L192 WeakPolarHBondContact CE1-O 3.43Å; D134-L192 HydrophobicContact CB-CD1 4.41Å; D134-L192 WeakPolarHBondContact OD1-CD1 3.4Å; K189-L192 HydrophobicContact CB-CB 4.37Å; K189-L192 HydrophobicContact CB-CD1 3.92Å; K189-L192 HydrophobicContact CB-CG 3.93Å; K189-L192 HydrophobicContact CD-CD1 3.94Å; K189-L192 HydrophobicContact CD-CG 4.25Å; K189-L192 PolarHBondContact O-N 3.12Å; R190-L192 PolarHBondContact O-N 3.17Å
193	I	89.2	Confident	81.8	Confident	18 Å²	18	78.6 Å²	78.6	9%	0.092	41%	0.41	C	S	.	.	S	Bend	trans	-94.6	129.7	168.9	-57.2	168.3	0	0	0	108.3	F133 F145 R146 A149 L150 R190 E191	F133-I193 HydrophobicContact CD1-CG1 3.9Å; F133-I193 HydrophobicContact CE1-CB 4.43Å; F133-I193 HydrophobicContact CE1-CG1 3.46Å; F133-I193 VanDerWaalsContact CE1-CG1 3.46Å; F133-I193 HydrophobicContact CZ-CG1 4.21Å; F145-I193 HydrophobicContact CD1-CD1 3.95Å; F145-I193 HydrophobicContact CD1-CG1 4.47Å; F145-I193 HydrophobicContact CE1-CD1 3.78Å; F145-I193 HydrophobicContact CE1-CG1 4.29Å; R146-I193 HydrophobicContact CG-CG2 4.46Å; A149-I193 HydrophobicContact CB-CD1 3.76Å; L150-I193 HydrophobicContact CD1-CB 3.99Å; L150-I193 HydrophobicContact CD1-CG2 3.57Å; L150-I193 HydrophobicContact CG-CB 4.36Å; L150-I193 HydrophobicContact CG-CD1 4.12Å; L150-I193 HydrophobicContact CG-CG2 4.22Å; R190-I193 WeakPolarHBondContact O-CB 3.41Å; R190-I193 PolarHBondContact O-N 2.81Å; E191-I193 VanDerWaalsContact C-N 3.34Å
194	L	82.7	Confident	80.2	Confident	57 Å²	57	86.6 Å²	86.6	30%	0.298	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-64.7	131.5	178.5	-165.4	70.5	0	0	0	110.6	K198 L199	L194-K198 HydrophobicContact CD1-CB 4.15Å; L194-K198 HydrophobicContact CD1-CD 4.23Å; L194-K198 HydrophobicContact CD2-CB 4.03Å; L194-K198 HydrophobicContact CG-CB 3.9Å; L194-L199 HydrophobicContact CD2-CD2 3.91Å; L194-L199 HydrophobicContact CD2-CG 4.3Å
195	P	75.9	Confident	78.2	Confident	63 Å²	63	88.1 Å²	88.1	41%	0.409	46%	0.46	S	S	.	.	P	Polyproline II helix	trans	-58.1	149.8	178.5	-27.1	35.8	0	0	0	113.4	E197 K198 L199	P195-E197 VanDerWaalsContact C-N 3.32Å; P195-E197 PolarHBondContact O-N 2.89Å; P195-K198 PolarHBondContact O-N 3.47Å; P195-K198 VanDerWaalsContact O-N 3.09Å; P195-L199 PolarHBondContact O-N 3.49Å
196	P	69.4	Low	76.2	Confident	85 Å²	85	95.7 Å²	95.7	55%	0.552	47%	0.47	S	S	*	.	H	α-helix	trans	-58.5	-40	-176	22.4	-33	0	0	0	113.2	K198 L199 E200	P196-K198 VanDerWaalsContact C-N 3.28Å; P196-K198 PolarHBondContact O-N 2.78Å; P196-L199 WeakPolarHBondContact O-CA 3.45Å; P196-L199 WeakPolarHBondContact O-CB 3.42Å; P196-L199 PolarHBondContact O-N 3.15Å; P196-E200 PolarHBondContact O-N 3.15Å
197	E	70.6	Confident	74.1	Confident	129 Å²	129	105.3 Å²	105.3	60%	0.603	50%	0.502	S	S	*	.	H	α-helix	trans	-51.7	-42.9	174.6	-177.1	-173.4	-159.4	0	0	112.9	P195 L199 E200 Q201	P195-E197 VanDerWaalsContact C-N 3.32Å; P195-E197 PolarHBondContact O-N 2.89Å; E197-L199 VanDerWaalsContact C-N 3.3Å; E197-L199 PolarHBondContact O-N 3.04Å; E197-E200 PolarHBondContact O-N 2.85Å; E197-Q201 WeakPolarHBondContact O-CG 3.41Å; E197-Q201 PolarHBondContact O-N 3.07Å
198	K	65.1	Low	71.8	Confident	87 Å²	87	115.2 Å²	115.2	38%	0.378	53%	0.533	S	S	.	.	H	α-helix	trans	-78.6	-11.4	177.8	-69.6	-169.2	176	-173.1	0	113.5	L194 P195 P196	L194-K198 HydrophobicContact CD1-CB 4.15Å; L194-K198 HydrophobicContact CD1-CD 4.23Å; L194-K198 HydrophobicContact CD2-CB 4.03Å; L194-K198 HydrophobicContact CG-CB 3.9Å; P195-K198 PolarHBondContact O-N 3.47Å; P195-K198 VanDerWaalsContact O-N 3.09Å; P196-K198 VanDerWaalsContact C-N 3.28Å; P196-K198 PolarHBondContact O-N 2.78Å
199	L	67.8	Low	69.3	Low	95 Å²	95	124.2 Å²	124.2	50%	0.497	57%	0.572	S	S	.	*	H	α-helix	trans	-84.5	-42.1	169.5	-66.2	168.9	0	0	0	110.8	L194 P195 P196 E197 Q201 R202 A203	L194-L199 HydrophobicContact CD2-CD2 3.91Å; L194-L199 HydrophobicContact CD2-CG 4.3Å; P195-L199 PolarHBondContact O-N 3.49Å; P196-L199 WeakPolarHBondContact O-CA 3.45Å; P196-L199 WeakPolarHBondContact O-CB 3.42Å; P196-L199 PolarHBondContact O-N 3.15Å; E197-L199 VanDerWaalsContact C-N 3.3Å; E197-L199 PolarHBondContact O-N 3.04Å; L199-Q201 VanDerWaalsContact C-N 3.35Å; L199-Q201 PolarHBondContact O-N 3.35Å; L199-R202 PolarHBondContact O-N 3.34Å; L199-A203 PolarHBondContact O-N 2.94Å
200	E	66.7	Low	67	Low	131 Å²	131	129.1 Å²	129.1	61%	0.612	60%	0.596	S	S	*	*	H	α-helix	trans	-62.8	-38.9	177.7	-69.7	178.6	175.2	0	0	112.6	P196 E197 R202 A203	P196-E200 PolarHBondContact O-N 3.15Å; E197-E200 PolarHBondContact O-N 2.85Å; E200-R202 PolarHBondContact O-N 3.35Å; E200-A203 PolarHBondContact O-N 3.36Å; E200-A203 VanDerWaalsContact O-N 3.07Å
201	Q	62.7	Low	64.9	Low	131 Å²	131	130 Å²	130	61%	0.612	61%	0.606	S	S	*	*	H	α-helix	trans	-58.4	-27.8	172.8	-71	174	11.8	0	0	113.2	E197 L199	E197-Q201 WeakPolarHBondContact O-CG 3.41Å; E197-Q201 PolarHBondContact O-N 3.07Å; L199-Q201 VanDerWaalsContact C-N 3.35Å; L199-Q201 PolarHBondContact O-N 3.35Å
202	R	62.9	Low	62.4	Low	120 Å²	120	128.5 Å²	128.5	45%	0.453	61%	0.61	S	S	.	*	H	α-helix	trans	-91.9	-17	175.3	-78.4	-178.8	163.8	-174.9	-4.8	114.2	Y71 L199 E200 S287	Y71-R202 VanDerWaalsContact CE1-NH1 3.31Å; Y71-R202 VanDerWaalsContact CE1-NH2 3.32Å; Y71-R202 VanDerWaalsContact CZ-NH1 3.34Å; Y71-R202 PolarHBondContact OH-NH1 3.31Å; L199-R202 PolarHBondContact O-N 3.34Å; E200-R202 PolarHBondContact O-N 3.35Å; R202-S287 PolarHBondContact NH2-OG 3.13Å; R202-S287 VanDerWaalsContact NH2-OG 3.14Å
203	A	63.7	Low	60	Low	78 Å²	78	130.5 Å²	130.5	65%	0.645	63%	0.627	S	S	*	*	H	α-helix	trans	-80.1	-16.3	-179.6	0	0	0	0	0	113.6	L199 E200 P205	L199-A203 PolarHBondContact O-N 2.94Å; E200-A203 PolarHBondContact O-N 3.36Å; E200-A203 VanDerWaalsContact O-N 3.07Å; A203-P205 WeakPolarHBondContact O-CD 3.38Å
204	K	61.7	Low	58	Low	167 Å²	167	138.8 Å²	138.8	73%	0.726	67%	0.665	S	S	*	*	S	Bend	trans	-70.5	115	179.2	-69.5	-178.1	179.9	179.8	0	111	R206	K204-R206 PolarHBondContact O-N 3.43Å
205	P	54.9	Low	55.8	Low	115 Å²	115	143.2 Å²	143.2	75%	0.747	69%	0.689	S	S	*	*			trans	-73.3	122.5	-175	28.8	-34.2	0	0	0	111.6	A203 R207	A203-P205 WeakPolarHBondContact O-CD 3.38Å; P205-R207 PolarHBondContact O-N 3.15Å
206	R	54.1	Low	54.2	Low	245 Å²	245	146.4 Å²	146.4	93%	0.925	71%	0.713	S	S	*	*			trans	-67.3	93.9	168.6	-84.8	-176.2	157.4	-167.5	-7.4	109.8	K204 R208	K204-R206 PolarHBondContact O-N 3.43Å; R206-R208 PolarHBondContact O-N 2.73Å
207	R	51.4	Low	52.9	Low	240 Å²	240	147.8 Å²	147.8	91%	0.906	73%	0.725	S	S	*	*			trans	-60	90	170.8	-76.9	-173.9	170.1	-171	-3.4	110.7	P205 K209	P205-R207 PolarHBondContact O-N 3.15Å; R207-K209 PolarHBondContact O-N 3.24Å
208	R	47.2	Very low	51.5	Low	228 Å²	228	147.3 Å²	147.3	86%	0.86	74%	0.736	S	S	*	*			trans	-70.4	104.5	165.8	-74.5	-177.2	168.7	177.4	-4.1	108.3	R206 H210	R206-R208 PolarHBondContact O-N 2.73Å; R208-H210 PolarHBondContact O-N 3.13Å
209	K	43.4	Very low	50.2	Low	197 Å²	197	148.7 Å²	148.7	86%	0.857	76%	0.756	S	S	*	*			trans	-68.2	119	166.4	-84.3	-168.8	171.9	-170.9	0	108.5	R207	R207-K209 PolarHBondContact O-N 3.24Å
210	H	44.7	Very low	48.9	Very low	175 Å²	175	149.4 Å²	149.4	81%	0.81	77%	0.767	S	S	*	*			trans	-86.7	128.9	168.2	-133.7	-98	0	0	0	108.4	R208	R208-H210 PolarHBondContact O-N 3.13Å
211	H	49	Very low	47.8	Very low	178 Å²	178	151.6 Å²	151.6	82%	0.824	78%	0.777	S	S	*	*			trans	-147	121.5	159.4	-95.4	-74.3	0	0	0	107.3
212	S	38.5	Very low	46.7	Very low	96 Å²	96	151.2 Å²	151.2	67%	0.671	78%	0.779	S	S	*	*			trans	-81	141.3	173.1	-163.7	0	0	0	0	109.5
213	P	38.6	Very low	45.5	Very low	105 Å²	105	152.2 Å²	152.2	68%	0.682	79%	0.792	S	S	*	*			trans	-71.8	155.2	152.2	33.7	-32.1	0	0	0	109.6
214	Q	46	Very low	44.2	Very low	192 Å²	192	155.3 Å²	155.3	90%	0.897	80%	0.797	S	S	*	*			trans	-138.2	122.2	157.1	-79.8	-172.2	-56.6	0	0	107.1
215	D	37.8	Very low	43.1	Very low	151 Å²	151	154 Å²	154	81%	0.807	80%	0.804	S	S	*	*			trans	-88.5	141.5	172.1	-60.1	-68.5	0	0	0	109.8
216	S	42.2	Very low	42.3	Very low	129 Å²	129	151.9 Å²	151.9	90%	0.902	80%	0.802	S	S	*	*			trans	-161	125.4	160.5	-78.7	0	0	0	0	109.7
217	S	41.5	Very low	41.8	Very low	115 Å²	115	146.2 Å²	146.2	80%	0.804	80%	0.797	S	S	*	*			trans	-109.9	127.7	-174.1	55.2	0	0	0	0	112.1
218	S	40.7	Very low	41.3	Very low	119 Å²	119	140.5 Å²	140.5	83%	0.832	79%	0.794	S	S	*	*			trans	-176.9	142.7	146.7	48	0	0	0	0	111.5
219	S	38.6	Very low	41.1	Very low	116 Å²	116	134.9 Å²	134.9	81%	0.811	79%	0.79	S	S	*	*			trans	-114.4	-177.8	172.8	-52.5	0	0	0	0	109.4
220	P	39.7	Very low	41.1	Very low	110 Å²	110	132.7 Å²	132.7	71%	0.714	79%	0.793	S	S	*	*				-130.4	165.6	-74.9	38.8	-25.1	0	0	0	112.3
221	Q	43.9	Very low	40.8	Very low	176 Å²	176	127.7 Å²	127.7	82%	0.822	79%	0.788	S	S	*	*			trans	-169.3	145.1	150.7	-111	158.4	70.6	0	0	116.1
222	N	40.6	Very low	40.5	Very low	123 Å²	123	124.5 Å²	124.5	66%	0.658	79%	0.786	S	S	*	*			trans	69	106.8	145.8	-59.1	-17.8	0	0	0	123.5
223	L	37.8	Very low	40.7	Very low	141 Å²	141	125 Å²	125	74%	0.738	79%	0.789	S	S	*	*				61.1	103.1	124.6	-73.5	129.7	0	0	0	122.4
224	L	36.9	Very low	40.8	Very low	143 Å²	143	126.2 Å²	126.2	75%	0.749	79%	0.79	S	S	*	*				54.2	133	118.5	-91.2	71.1	0	0	0	122.9
225	T	38.2	Very low	40.6	Very low	141 Å²	141	121.6 Å²	121.6	87%	0.865	78%	0.775	S	S	*	*			trans	67.3	141.2	152.9	58.4	0	0	0	0	118.4
226	G	36.6	Very low	40.6	Very low	69 Å²	69	121.2 Å²	121.2	71%	0.711	77%	0.773	S	S	*	*			cis	-159.7	176.4	-0.9	0	0	0	0	0	112.6
227	P	43.9	Very low	40.4	Very low	126 Å²	126	118.9 Å²	118.9	82%	0.818	76%	0.762	S	S	*	*			trans	-108.4	144.5	-160.2	38	-32.7	0	0	0	116.9
228	S	40.5	Very low	40.2	Very low	120 Å²	120	123.7 Å²	123.7	84%	0.839	76%	0.764	S	S	*	*			trans	176.4	157.7	159.1	-86.2	0	0	0	0	109.4
229	S	44.1	Very low	40.2	Very low	110 Å²	110	122.4 Å²	122.4	77%	0.769	75%	0.752	S	S	*	*			cis	-161.6	157.1	-7.5	45.8	0	0	0	0	111.6
230	V	42.8	Very low	40.2	Very low	152 Å²	152	122.6 Å²	122.6	92%	0.921	75%	0.751	S	S	*	*			trans	-22	148.7	177	-68	0	0	0	0	123.1
231	G	38.6	Very low	40.1	Very low	69 Å²	69	127.8 Å²	127.8	71%	0.711	76%	0.758	S	S	*	*			trans	128.6	146.7	143.5	0	0	0	0	0	116.2
232	S	42.4	Very low	39.8	Very low	112 Å²	112	126.8 Å²	126.8	78%	0.783	76%	0.757	S	S	*	*			cis	-165.7	146.5	-14.2	-82.4	0	0	0	0	110.4
233	S	44	Very low	39.8	Very low	105 Å²	105	126.4 Å²	126.4	73%	0.734	76%	0.761	S	S	*	*			trans	63.3	158.6	156	-73.2	0	0	0	0	118.7
234	N	40.2	Very low	39.7	Very low	132 Å²	132	124.7 Å²	124.7	71%	0.706	76%	0.761	S	S	*	*			cis	-165.1	161.9	-8.2	-106.5	16.1	0	0	0	106.9
235	T	42.2	Very low	40	Very low	94 Å²	94	123.8 Å²	123.8	58%	0.577	76%	0.764	S	S	*	*			cis	-171.2	151	-16.8	22.7	0	0	0	0	108.7
236	N	37.7	Very low	39.8	Very low	144 Å²	144	124.3 Å²	124.3	77%	0.77	76%	0.761	S	S	*	*			trans	69.1	149.7	159.3	-55.1	-18.1	0	0	0	117.2
237	A	36.9	Very low	39.5	Very low	80 Å²	80	126.8 Å²	126.8	66%	0.661	76%	0.762	S	S	*	*			cis	-163.8	166.8	-3.8	0	0	0	0	0	107.7
238	Y	37.8	Very low	39	Very low	215 Å²	215	126.7 Å²	126.7	84%	0.843	76%	0.759	S	S	*	*			cis	-152.5	179.8	-2.4	-109.5	-21.7	0	0	0	109
239	P	41.5	Very low	38.6	Very low	92 Å²	92	126 Å²	126	60%	0.597	76%	0.755	S	S	*	*			trans	-106.2	165.4	-147.5	40.4	-37.4	0	0	0	117.8
240	P	38.8	Very low	38.4	Very low	120 Å²	120	126.3 Å²	126.3	78%	0.779	76%	0.757	S	S	*	*			trans	-91.8	168.8	167.8	38.5	-35.3	0	0	0	113.1
241	Y	37.7	Very low	38.1	Very low	220 Å²	220	127.6 Å²	127.6	86%	0.863	75%	0.752	S	S	*	*			trans	-131.4	138.8	167.9	-84.1	-80.5	0	0	0	113.4
242	L	37.6	Very low	38.1	Very low	155 Å²	155	128.4 Å²	128.4	81%	0.812	75%	0.745	S	S	*	*			trans	-141.3	140.7	171.2	-118.7	152.7	0	0	0	105.6
243	P	39	Very low	37.7	Very low	114 Å²	114	130.9 Å²	130.9	74%	0.74	74%	0.744	S	S	*	*				-146.4	136.7	111	32.8	-14.7	0	0	0	112.9
244	S	36.9	Very low	37.2	Very low	105 Å²	105	134 Å²	134	73%	0.734	75%	0.747	S	S	*	*				86.5	131.6	85	-54.9	0	0	0	0	115.1
245	P	42.1	Very low	36.9	Very low	124 Å²	124	131.3 Å²	131.3	81%	0.805	75%	0.751	S	S	*	*			trans	-103.4	169.5	175.3	40.3	-34.7	0	0	0	113.1
246	L	34	Very low	36.3	Very low	153 Å²	153	131.6 Å²	131.6	80%	0.801	76%	0.756	S	S	*	*			trans	-171.5	130.6	157.4	-108.6	168.7	0	0	0	113.7
247	T	31.6	Very low	36.1	Very low	120 Å²	120	132.2 Å²	132.2	74%	0.736	76%	0.76	S	S	*	*			trans	55.3	159.9	151.9	44.2	0	0	0	0	120.5
248	T	33.2	Very low	35.7	Very low	124 Å²	124	136.6 Å²	136.6	76%	0.761	77%	0.767	S	S	*	*			cis	-148.6	178.2	17.1	-23	0	0	0	0	112.8
249	S	32.2	Very low	35.5	Very low	106 Å²	106	133.1 Å²	133.1	74%	0.741	77%	0.768	S	S	*	*			trans	-28.6	160.7	167.7	55.3	0	0	0	0	119.4
250	S	38.1	Very low	34.9	Very low	117 Å²	117	132.1 Å²	132.1	82%	0.818	76%	0.763	S	S	*	*			cis	-155.3	165.7	34.7	59.6	0	0	0	0	118.4
251	H	36.7	Very low	34.3	Very low	179 Å²	179	136.1 Å²	136.1	83%	0.829	76%	0.764	S	S	*	*			trans	-72.2	-173.8	171.4	-107.3	-18.7	0	0	0	114.6
252	P	39	Very low	34	Very low	86 Å²	86	133.6 Å²	133.6	56%	0.558	77%	0.766	S	S	*	*			cis	-143.7	-168.5	-31.9	40.7	-22	0	0	0	115.4
253	Q	35.2	Very low	33.5	Very low	163 Å²	163	131.3 Å²	131.3	76%	0.762	76%	0.762	S	S	*	*			trans	70	160.8	153.1	-76.2	169.3	12.4	0	0	118.3
254	H	33.7	Very low	33.2	Very low	171 Å²	171	131.7 Å²	131.7	79%	0.792	77%	0.768	S	S	*	*			cis	-148.5	163.6	-3	-138	-69.3	0	0	0	110.2
255	G	32.6	Very low	32.6	Very low	76 Å²	76	136.1 Å²	136.1	78%	0.784	77%	0.774	S	S	*	*			trans	139.6	123.6	152.7	0	0	0	0	0	116.8
256	S	30.3	Very low	32.1	Very low	100 Å²	100	137 Å²	137	70%	0.699	78%	0.777	S	S	*	*			trans	-120.2	162.1	174	56.7	0	0	0	0	111.2
257	N	33.7	Very low	31.7	Very low	157 Å²	157	135 Å²	135	84%	0.84	78%	0.776	S	S	*	*				-176.2	160.6	116.4	-88.1	-6	0	0	0	112.6
258	Q	28.8	Very low	31.5	Very low	172 Å²	172	132.9 Å²	132.9	80%	0.804	78%	0.778	S	S	*	*			trans	-120.2	145.4	179.5	-56	172.1	5.1	0	0	109.5
259	T	32.8	Very low	31.2	Very low	142 Å²	142	131.6 Å²	131.6	87%	0.871	78%	0.78	S	S	*	*			trans	-149.2	79.3	162.8	26.5	0	0	0	0	112.2
260	S	27.9	Very low	31.1	Very low	71 Å²	71	132 Å²	132	50%	0.497	78%	0.783	S	S	.	*				32.3	114.9	114.9	-55.7	0	0	0	0	120.2
261	Y	26.3	Very low	30.6	Very low	203 Å²	203	137.2 Å²	137.2	80%	0.796	79%	0.785	S	S	*	*			trans	45	131.3	137.6	-28.5	-58.9	0	0	0	121.5
262	N	31.7	Very low	30.3	Very low	168 Å²	168	134.7 Å²	134.7	90%	0.898	78%	0.784	S	S	*	*				-162.4	160.5	105.6	-107.7	-32.7	0	0	0	113.6
263	S	27.2	Very low	29.7	Very low	106 Å²	106	138.2 Å²	138.2	74%	0.741	80%	0.797	S	S	*	*			trans	-111.6	152.1	-176.7	57.4	0	0	0	0	112.7
264	S	32.7	Very low	29.4	Very low	123 Å²	123	139 Å²	139	86%	0.86	80%	0.801	S	S	*	*			trans	-143.3	132.6	163.8	-59.1	0	0	0	0	111.4
265	F	25.3	Very low	29.1	Very low	197 Å²	197	138.4 Å²	138.4	86%	0.864	80%	0.802	S	S	*	*			trans	-68.7	158	166.4	-102.5	-123.2	0	0	0	110.9
266	V	30.3	Very low	28.9	Very low	143 Å²	143	142.1 Å²	142.1	87%	0.867	80%	0.803	S	S	*	*				-171.2	147.4	121.3	140.9	0	0	0	0	110.4
267	S	26.5	Very low	28.7	Very low	110 Å²	110	143.4 Å²	143.4	77%	0.769	80%	0.802	S	S	*	*			trans	-80.8	152.1	-175.2	-48.8	0	0	0	0	113.6
268	G	26.4	Very low	28.7	Very low	76 Å²	76	139.6 Å²	139.6	78%	0.784	79%	0.786	S	S	*	*			trans	174.9	89.3	169.2	0	0	0	0	0	118.2
269	A	27.3	Very low	28.8	Very low	98 Å²	98	137.9 Å²	137.9	81%	0.81	79%	0.787	S	S	*	*			trans	45.6	143.5	145	0	0	0	0	0	124.2
270	S	30	Very low	28.6	Very low	115 Å²	115	137.5 Å²	137.5	80%	0.804	77%	0.773	S	S	*	*			trans	69.4	105.2	146.7	-60	0	0	0	0	121.2
271	R	28.6	Very low	28.7	Very low	226 Å²	226	138 Å²	138	85%	0.853	77%	0.766	S	S	*	*			trans	-71.7	153	158.4	-77.6	179.2	166.5	-179.1	-3.5	112.1
272	P	30.2	Very low	28.8	Very low	126 Å²	126	132.1 Å²	132.1	82%	0.818	76%	0.755	S	S	*	*				-105.4	162.4	125.5	-16.6	33.3	0	0	0	113.5
273	L	26.8	Very low	28.8	Very low	159 Å²	159	126.2 Å²	126.2	83%	0.832	73%	0.727	S	S	*	*			trans	-84.4	128.8	-178.7	-64.5	168.6	0	0	0	111.3
274	H	29	Very low	28.9	Very low	179 Å²	179	130.8 Å²	130.8	83%	0.829	73%	0.729	S	S	*	*			trans	-110.3	144.3	168.3	-131.7	-88.5	0	0	0	111.2	I276	H274-I276 PolarHBondContact O-N 3.4Å; H274-I276 VanDerWaalsContact O-N 3.16Å
275	L	25.8	Very low	28.8	Very low	159 Å²	159	129.2 Å²	129.2	83%	0.832	71%	0.714	S	S	*	*			trans	-71.3	106	-172.5	-161.9	73.9	0	0	0	110.9
276	I	28.6	Very low	28.9	Very low	154 Å²	154	126.4 Å²	126.4	79%	0.79	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-81.2	121.2	-179.8	-62	177.6	0	0	0	109.8	H274	H274-I276 PolarHBondContact O-N 3.4Å; H274-I276 VanDerWaalsContact O-N 3.16Å
277	N	27.6	Very low	28.7	Very low	127 Å²	127	121 Å²	121	68%	0.679	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-66.6	155	175.7	-68.8	-66.6	0	0	0	111.7	V279	N277-V279 PolarHBondContact O-N 3Å
278	P	32	Very low	28.7	Very low	78 Å²	78	120.7 Å²	120.7	51%	0.506	68%	0.675	S	S	.	*	P	Polyproline II helix	trans	-54.8	129.5	171.6	23.9	-34.3	0	0	0	110.6	D64 K280	D64-P278 HydrophobicContact CB-CG 4.35Å; P278-K280 PolarHBondContact O-N 2.68Å
279	V	32.6	Very low	28.9	Very low	136 Å²	136	125.9 Å²	125.9	82%	0.824	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-62.5	123.2	-172	179.4	0	0	0	0	110	N277 F281	N277-V279 PolarHBondContact O-N 3Å; V279-F281 PolarHBondContact O-N 3.13Å
280	K	28.8	Very low	28.8	Very low	133 Å²	133	127 Å²	127	58%	0.578	68%	0.679	S	S	*	*			trans	-73.5	97.4	-178.3	-72.9	-172.5	174.7	-172.2	0	110.4	P278 S282	P278-K280 PolarHBondContact O-N 2.68Å; K280-S282 VanDerWaalsContact C-N 3.27Å; K280-S282 PolarHBondContact O-N 3.07Å
281	F	30	Very low	28.7	Very low	82 Å²	82	125.9 Å²	125.9	36%	0.36	67%	0.671	S	S	.	*			trans	-67	84.5	172.8	-159.6	-73.6	0	0	0	110.3	N68 H69 V279 N582	N68-F281 WeakPolarHBondContact CB-O 3Å; H69-F281 AromaticContact NE2-CD1 3.34Å; H69-F281 VanDerWaalsContact NE2-CD1 3.34Å; H69-F281 WeakPolarHBondContact NE2-CD1 3.5Å; H69-F281 AromaticContact NE2-CE1 3.57Å; V279-F281 PolarHBondContact O-N 3.13Å; F281-N582 HydrophobicContact CE2-CB 4.48Å; F281-N582 VanDerWaalsContact CE2-OD1 3.25Å; F281-N582 WeakPolarHBondContact CE2-OD1 3.44Å
282	S	27.2	Very low	28.6	Very low	79 Å²	79	120.7 Å²	120.7	55%	0.552	66%	0.66	S	S	*	*			trans	-132.3	93.3	-173.5	-158.3	0	0	0	0	109.9	N68 K280	N68-S282 WeakPolarHBondContact OD1-CB 3.48Å; N68-S282 PolarHBondContact OD1-OG 3.38Å; K280-S282 VanDerWaalsContact C-N 3.27Å; K280-S282 PolarHBondContact O-N 3.07Å
283	S	33	Very low	28.5	Very low	45 Å²	45	119.7 Å²	119.7	32%	0.315	65%	0.647	S	S	.	*			trans	-141.5	142.9	170.2	52.9	0	0	0	0	110.8
284	Y	27.4	Very low	28.3	Very low	201 Å²	201	117.2 Å²	117.2	79%	0.788	64%	0.644	S	S	*	*			trans	-67.1	142.4	-174.3	-77.9	-114.7	0	0	0	111.6
285	V	31	Very low	28.3	Very low	90 Å²	90	116.2 Å²	116.2	55%	0.545	64%	0.644	S	S	.	*			trans	-128.8	127.9	156.1	-172.4	0	0	0	0	108.3
286	N	28	Very low	28.3	Very low	138 Å²	138	113.2 Å²	113.2	74%	0.738	63%	0.632	S	S	*	*			trans	-83.1	160.2	-175.1	-110.8	-41.2	0	0	0	112.5
287	S	26.1	Very low	28.2	Very low	31 Å²	31	112.4 Å²	112.4	22%	0.217	63%	0.634	C	S	.	*			trans	-102.5	105.8	-167.1	-37.9	0	0	0	0	113.3	Y71 I72 R202	Y71-S287 WeakPolarHBondContact CD1-OG 2.96Å; I72-S287 WeakPolarHBondContact CG1-OG 3.23Å; R202-S287 PolarHBondContact NH2-OG 3.13Å; R202-S287 VanDerWaalsContact NH2-OG 3.14Å
288	S	27.4	Very low	28.3	Very low	103 Å²	103	112.1 Å²	112.1	72%	0.72	63%	0.633	S	S	*	*			trans	-163.7	147.3	162.6	50.6	0	0	0	0	110.8
289	H	30.3	Very low	27.9	Very low	184 Å²	184	114 Å²	114	85%	0.852	64%	0.643	S	S	*	*			trans	67.2	79	-176.2	-65.6	-89	0	0	0	116
290	C	24.8	Very low	27.9	Very low	123 Å²	123	116.7 Å²	116.7	83%	0.831	64%	0.644	S	S	*	*			trans	-152.6	89.1	135.2	-168.6	0	0	0	0	107.2
291	S	26.9	Very low	27.6	Very low	90 Å²	90	117.3 Å²	117.3	63%	0.629	65%	0.654	S	S	*	*			trans	-88.3	162.9	150.1	-56.8	0	0	0	0	106.9
292	D	26.8	Very low	27.6	Very low	117 Å²	117	119.2 Å²	119.2	63%	0.626	68%	0.677	S	S	*	*			trans	62.8	84.1	155.8	-38.8	-39.4	0	0	0	116.3	A702	D292-A702 WeakPolarHBondContact CB-OXT 3.44Å
293	L	28.5	Very low	27.4	Very low	105 Å²	105	121.1 Å²	121.1	55%	0.55	69%	0.691	S	S	.	*				-153.2	101.5	119.5	-145.4	75.6	0	0	0	111.4
294	S	23.5	Very low	27.2	Very low	108 Å²	108	124.1 Å²	124.1	76%	0.755	71%	0.712	S	S	*	*			trans	-92.7	115	169.5	50.8	0	0	0	0	110
295	L	27.4	Very low	27.1	Very low	158 Å²	158	120.7 Å²	120.7	83%	0.827	71%	0.712	S	S	*	*			trans	-98.3	107.6	160.4	-91.7	165	0	0	0	108.8
296	T	25.9	Very low	27	Very low	95 Å²	95	123.7 Å²	123.7	58%	0.583	72%	0.724	S	S	*	*			trans	-67	147.2	168.6	49.8	0	0	0	0	109.9	D298	T296-D298 WeakPolarHBondContact CB-OD2 3.43Å; T296-D298 PolarHBondContact OG1-OD2 2.64Å
297	T	27.4	Very low	27.1	Very low	137 Å²	137	125.7 Å²	125.7	84%	0.84	73%	0.729	S	S	*	*			trans	-107.1	81.5	159.6	44.3	0	0	0	0	107.5
298	D	28.4	Very low	27	Very low	121 Å²	121	130.3 Å²	130.3	65%	0.647	76%	0.756	S	S	*	*			trans	-66	139.8	178.7	-70.7	-64.9	0	0	0	111.3	T296	T296-D298 WeakPolarHBondContact CB-OD2 3.43Å; T296-D298 PolarHBondContact OG1-OD2 2.64Å
299	T	25.3	Very low	27.1	Very low	119 Å²	119	135.5 Å²	135.5	73%	0.73	77%	0.765	S	S	*	*			trans	-101.1	109.9	-172.6	-62.7	0	0	0	0	110
300	F	31.1	Very low	26.9	Very low	192 Å²	192	134.6 Å²	134.6	84%	0.842	76%	0.761	S	S	*	*			trans	-127.5	100.8	167.7	-84.2	-78	0	0	0	111.9
301	N	23.3	Very low	27	Very low	146 Å²	146	135.2 Å²	135.2	78%	0.781	77%	0.766	S	S	*	*			trans	-74.9	134.6	155.2	-76.1	-36	0	0	0	108.8
302	S	29.3	Very low	27	Very low	121 Å²	121	137.1 Å²	137.1	85%	0.846	77%	0.769	S	S	*	*			trans	-161	143.7	150	-84.3	0	0	0	0	109.6
303	S	24.3	Very low	27	Very low	120 Å²	120	141.7 Å²	141.7	84%	0.839	78%	0.783	S	S	*	*			trans	-115.8	121.8	-166.5	-57.9	0	0	0	0	112.4
304	S	29.1	Very low	27	Very low	108 Å²	108	141.6 Å²	141.6	76%	0.755	79%	0.789	S	S	*	*			trans	-169.5	125.8	150.7	34.7	0	0	0	0	107.2
305	T	24.4	Very low	27.2	Very low	129 Å²	129	143.6 Å²	143.6	79%	0.791	79%	0.791	S	S	*	*				58.4	92.4	52.8	72.1	0	0	0	0	113.9
306	L	29.8	Very low	27.5	Very low	152 Å²	152	142.1 Å²	142.1	80%	0.796	79%	0.794	S	S	*	*				-164.4	128.5	127.4	-104.5	162.3	0	0	0	112.8
307	E	28.2	Very low	27.6	Very low	181 Å²	181	142.1 Å²	142.1	85%	0.846	80%	0.798	S	S	*	*			trans	42.5	133.8	150.8	-76.9	166.1	-165.1	0	0	125
308	T	24.9	Very low	27.8	Very low	127 Å²	127	143.3 Å²	143.3	78%	0.779	80%	0.798	S	S	*	*			trans	-77.3	150.4	169.7	47.8	0	0	0	0	113.6
309	K	30.3	Very low	27.8	Very low	213 Å²	213	147 Å²	147	93%	0.926	81%	0.808	S	S	*	*			trans	-143.7	132.8	143.2	-107.4	161.2	-172.9	168.5	0	110.2
310	E	25.2	Very low	28	Very low	165 Å²	165	148.1 Å²	148.1	77%	0.771	81%	0.808	S	S	*	*			trans	-90.7	149.7	-177.2	-60.1	-176.3	126.4	0	0	111.8
311	C	27	Very low	28	Very low	136 Å²	136	144.2 Å²	144.2	92%	0.919	80%	0.802	S	S	*	*			trans	-140.7	112.2	162.9	-79.1	0	0	0	0	108.4
312	N	26.6	Very low	28.3	Very low	130 Å²	130	143.9 Å²	143.9	70%	0.695	81%	0.805	S	S	*	*			trans	-93.7	130.4	-177.5	-84.5	-68	0	0	0	111.8
313	F	28.1	Very low	28.5	Very low	212 Å²	212	146.1 Å²	146.1	93%	0.93	81%	0.806	S	S	*	*			trans	-147.8	156.4	148.5	-81.6	-67.7	0	0	0	109.6
314	P	28.1	Very low	28.8	Very low	104 Å²	104	143.1 Å²	143.1	68%	0.675	79%	0.794	S	S	*	*			trans	-119	164.4	-136.9	41.6	-34.5	0	0	0	117.7
315	N	27.9	Very low	28.9	Very low	149 Å²	149	146.2 Å²	146.2	80%	0.797	79%	0.794	S	S	*	*			trans	53.6	87.5	147.9	-68.2	-14.3	0	0	0	120.4
316	S	32.1	Very low	29.3	Very low	127 Å²	127	145.4 Å²	145.4	89%	0.888	79%	0.794	S	S	*	*				-144.8	139.7	114	58.6	0	0	0	0	109.1
317	S	28.5	Very low	29.4	Very low	96 Å²	96	145.7 Å²	145.7	67%	0.671	80%	0.796	S	S	*	*			trans	-128.3	111	-164.8	-80.8	0	0	0	0	114.2
318	I	31.1	Very low	29.7	Very low	161 Å²	161	145 Å²	145	83%	0.826	79%	0.793	S	S	*	*			trans	-128.8	102.7	151.3	-59.5	-178.5	0	0	0	107.6	I320	I318-I320 HydrophobicContact CG2-CG1 4.3Å
319	K	29.4	Very low	30.3	Very low	198 Å²	198	144.6 Å²	144.6	86%	0.861	79%	0.785	S	S	*	*			trans	-105.8	105.3	175.4	-72.8	-176.5	177.6	178.5	0	109.9
320	I	30.2	Very low	30.6	Very low	143 Å²	143	141.7 Å²	141.7	73%	0.733	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-102.6	129.2	166.7	-60.5	179.1	0	0	0	107.6	I318 V322	I318-I320 HydrophobicContact CG2-CG1 4.3Å; I320-V322 PolarHBondContact O-N 2.81Å
321	P	31.2	Very low	31.2	Very low	111 Å²	111	139.1 Å²	139.1	72%	0.721	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-74.7	125.4	-172.4	28.5	-34.2	0	0	0	112.3
322	V	29.5	Very low	31.5	Very low	139 Å²	139	133.5 Å²	133.5	84%	0.842	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-73	125.5	173.4	179.4	0	0	0	0	110.1	I320	I320-V322 PolarHBondContact O-N 2.81Å
323	I	32.9	Very low	31.8	Very low	167 Å²	167	130.7 Å²	130.7	86%	0.856	71%	0.713	S	S	*	*			trans	-129.9	123.5	164.1	-60.3	-179.9	0	0	0	106.2
324	G	30.6	Very low	32.1	Very low	58 Å²	58	125.6 Å²	125.6	60%	0.598	70%	0.699	S	S	*	*			trans	-103.7	166.8	-157.2	0	0	0	0	0	117.6
325	K	29.9	Very low	32.3	Very low	173 Å²	173	126.5 Å²	126.5	75%	0.752	70%	0.698	S	S	*	*			trans	54.9	73.3	146.9	-59.3	-170.3	174.5	-170.9	0	117.7	E617	K325-E617 IonicContact NZ-OE2 2.96Å; K325-E617 PolarHBondContact NZ-OE2 3.35Å
326	S	34.2	Very low	32.4	Very low	112 Å²	112	124.5 Å²	124.5	78%	0.783	68%	0.684	S	S	*	*			trans	-163.6	147.7	130.7	45.9	0	0	0	0	112.1	E328	S326-E328 PolarHBondContact O-N 2.78Å; S326-E328 VanDerWaalsContact O-N 3.12Å
327	D	31.6	Very low	32.4	Very low	158 Å²	158	123.6 Å²	123.6	85%	0.845	67%	0.669	S	S	*	*			trans	-75.2	92.5	179.2	-80	-59.9	0	0	0	112.3
328	E	34.8	Very low	32.4	Very low	166 Å²	166	125.8 Å²	125.8	78%	0.776	67%	0.669	S	S	*	*			trans	-107.9	134.2	151.8	-71.3	-140.4	118.6	0	0	110.4	S326 F330	S326-E328 PolarHBondContact O-N 2.78Å; S326-E328 VanDerWaalsContact O-N 3.12Å; E328-F330 PolarHBondContact O-N 3.09Å
329	L	37.2	Very low	32.3	Very low	119 Å²	119	125.4 Å²	125.4	62%	0.623	67%	0.668	S	S	*	*			trans	-67.9	88.2	166.6	-72.9	174.7	0	0	0	108.2	M331	L329-M331 PolarHBondContact O-N 3.35Å
330	F	36.4	Very low	32.4	Very low	152 Å²	152	124.3 Å²	124.3	67%	0.667	67%	0.671	S	S	*	*			trans	-65.1	97.3	-172.7	-155.9	-102.2	0	0	0	110.2	E328 P333	E328-F330 PolarHBondContact O-N 3.09Å; F330-P333 HydrophobicContact CE1-CG 4.43Å
331	M	37	Very low	32.3	Very low	110 Å²	110	125.1 Å²	125.1	54%	0.542	68%	0.677	S	S	.	*	P	Polyproline II helix	trans	-58.5	127.1	163.8	-75.3	-151.3	76.3	0	0	107.5	L329 W635 T651	L329-M331 PolarHBondContact O-N 3.35Å; M331-W635 HydrophobicContact CE-CH2 4.36Å; M331-W635 HydrophobicContact CE-CZ3 4.41Å; M331-T651 HydrophobicContact CE-CG2 4.18Å
332	P	34	Very low	32.3	Very low	18 Å²	18	128.3 Å²	128.3	12%	0.117	68%	0.682	C	S	.	*	P	Polyproline II helix	trans	-58.2	127.4	179.3	22.9	-32.4	0	0	0	108.8	V334 L632 W635	P332-V334 PolarHBondContact O-N 3.17Å; P332-L632 HydrophobicContact CB-CD2 3.89Å; P332-W635 HydrophobicContact CG-CB 4.44Å; P332-W635 HydrophobicContact CG-CD2 3.86Å; P332-W635 HydrophobicContact CG-CG 3.73Å; P332-W635 HydrophobicContact CG-CZ2 4.46Å
333	P	33.2	Very low	32.5	Very low	71 Å²	71	130.7 Å²	130.7	46%	0.461	68%	0.681	S	S	.	*	P	Polyproline II helix	trans	-60	137	-176.7	23.5	-33.6	0	0	0	109.6	F330 N335	F330-P333 HydrophobicContact CE1-CG 4.43Å; P333-N335 PolarHBondContact O-N 3.07Å
334	V	33.3	Very low	32.2	Very low	105 Å²	105	132.6 Å²	132.6	64%	0.636	68%	0.684	S	S	*	*			trans	-71.6	78.4	176.3	-176.2	0	0	0	0	108.4	P332 Q336 M409	P332-V334 PolarHBondContact O-N 3.17Å; V334-Q336 PolarHBondContact O-N 3.21Å; V334-M409 HydrophobicContact CG1-CE 3.56Å; V334-M409 HydrophobicContact CG1-SD 3.9Å
335	N	32.6	Very low	32.3	Very low	123 Å²	123	137.3 Å²	137.3	66%	0.658	69%	0.694	S	S	*	*			trans	-70.9	96.5	-169.9	-84.7	-15.9	0	0	0	111.6	P333 D337	P333-N335 PolarHBondContact O-N 3.07Å; N335-D337 PolarHBondContact O-N 3.43Å
336	Q	29.7	Very low	32.2	Very low	107 Å²	107	134.6 Å²	134.6	50%	0.5	70%	0.697	S	S	.	*			trans	-72.2	73.5	150.2	-65.4	-172.5	-37.2	0	0	109.5	V334	V334-Q336 PolarHBondContact O-N 3.21Å
337	D	32	Very low	31.7	Very low	109 Å²	109	137.2 Å²	137.2	58%	0.583	70%	0.701	S	S	*	*			trans	-155.2	105.3	164.6	-99.1	-22.7	0	0	0	109	N335 R374	N335-D337 PolarHBondContact O-N 3.43Å; D337-R374 IonicContact OD2-CZ 3.78Å; D337-R374 IonicContact OD2-NH2 2.69Å; D337-R374 PolarHBondContact OD2-NH2 2.73Å
338	Q	28.5	Very low	31.6	Very low	142 Å²	142	139.2 Å²	139.2	66%	0.664	71%	0.705	S	S	*	*			trans	-86	118.5	165.5	-67.2	169.9	-69.1	0	0	107.9
339	N	29.7	Very low	31.1	Very low	152 Å²	152	136.5 Å²	136.5	81%	0.813	71%	0.705	S	S	*	*			trans	162.2	77.5	152.5	-95	-64.4	0	0	0	110.7
340	L	31.1	Very low	30.9	Very low	176 Å²	176	136.9 Å²	136.9	92%	0.921	72%	0.718	S	S	*	*			trans	-147.3	64.4	160.8	-79.6	-175.4	0	0	0	108.3
341	N	29.2	Very low	30.8	Very low	160 Å²	160	138.2 Å²	138.2	86%	0.856	73%	0.726	S	S	*	*	S	Bend	trans	-160.5	69.6	170.9	-127.8	24.6	0	0	0	109.6
342	E	31.8	Very low	30.4	Very low	177 Å²	177	141.7 Å²	141.7	83%	0.827	74%	0.741	S	S	*	*			trans	-172.4	159	166.6	-114.2	168.5	-139.4	0	0	109.6
343	K	32.9	Very low	30.4	Very low	189 Å²	189	146.4 Å²	146.4	82%	0.822	77%	0.774	S	S	*	*			trans	68	57.4	177.4	-54.2	-164	176.6	-162.2	0	117
344	F	27.2	Very low	30.3	Very low	208 Å²	208	149.4 Å²	149.4	91%	0.912	79%	0.787	S	S	*	*				-83.5	161.2	118.7	-118	-101	0	0	0	108.7
345	L	31	Very low	30.5	Very low	157 Å²	157	150 Å²	150	82%	0.822	80%	0.795	S	S	*	*	S	Bend	trans	86.5	131.8	-177.1	-57.3	170.9	0	0	0	118.1
346	S	28.1	Very low	30.7	Very low	116 Å²	116	151.5 Å²	151.5	81%	0.811	80%	0.796	S	S	*	*			trans	64.3	119.9	158.3	-54.7	0	0	0	0	120.6
347	L	25.3	Very low	31.1	Very low	166 Å²	166	150.2 Å²	150.2	87%	0.869	80%	0.798	S	S	*	*			trans	-70.3	145.5	159.5	-71.5	63.6	0	0	0	109.3
348	E	27.5	Very low	31.5	Very low	200 Å²	200	154.8 Å²	154.8	94%	0.935	81%	0.813	S	S	*	*				-163.3	162.5	128.1	-115.3	171.1	-169	0	0	111.2
349	S	25.9	Very low	32.2	Very low	109 Å²	109	153 Å²	153	76%	0.762	81%	0.812	S	S	*	*			trans	-98.9	136.2	-163.3	53.8	0	0	0	0	114.3
350	S	32.7	Very low	32.6	Very low	128 Å²	128	156.8 Å²	156.8	90%	0.895	82%	0.815	S	S	*	*			trans	-156.5	143	161.5	-85.3	0	0	0	0	113.4
351	Q	33.9	Very low	33.1	Very low	180 Å²	180	156.4 Å²	156.4	84%	0.841	81%	0.808	S	S	*	*			trans	-75.1	152.1	-156.5	-63.4	151.1	-16.5	0	0	116.9
352	Q	29.1	Very low	33.5	Very low	182 Å²	182	152.7 Å²	152.7	85%	0.85	81%	0.807	S	S	*	*			trans	30	126.8	139.5	-63.4	172.1	-23.9	0	0	121.7
353	S	33.1	Very low	34.2	Very low	117 Å²	117	152.4 Å²	152.4	82%	0.818	81%	0.81	S	S	*	*				-173.4	127.4	126.5	37.9	0	0	0	0	112.8
354	D	31	Very low	34.5	Very low	135 Å²	135	146.5 Å²	146.5	72%	0.722	79%	0.792	S	S	*	*			trans	-83.8	112.8	178.6	-94.4	-57	0	0	0	112.4
355	S	38.2	Very low	35.4	Very low	117 Å²	117	145.5 Å²	145.5	82%	0.818	80%	0.796	S	S	*	*			trans	-102.7	90.2	-176.2	51.6	0	0	0	0	113.6
356	F	37.8	Very low	36.1	Very low	155 Å²	155	144.8 Å²	144.8	68%	0.68	79%	0.791	S	S	*	*			trans	-61.6	138.7	173.5	-78.5	-98.5	0	0	0	112.7	K358	F356-K358 PolarHBondContact O-N 3.11Å
357	C	36.3	Very low	37	Very low	80 Å²	80	145.8 Å²	145.8	54%	0.541	78%	0.783	S	S	.	*			trans	-79.6	78.3	-171.2	-171.8	0	0	0	0	113.7	T359 K370	C357-T359 PolarHBondContact O-N 2.9Å; C357-K370 PolarHBondContact SG-NZ 2.96Å
358	K	40.4	Very low	38.1	Very low	205 Å²	205	140.8 Å²	140.8	89%	0.891	76%	0.761	S	S	*	*			trans	-61.9	89.1	175.3	-67.7	-178	179.1	177.8	0	113.3	F356	F356-K358 PolarHBondContact O-N 3.11Å
359	T	44.7	Very low	39	Very low	104 Å²	104	140.3 Å²	140.3	64%	0.638	75%	0.751	S	S	*	*			trans	-142.8	130.3	158.8	51.5	0	0	0	0	110.6	C357	C357-T359 PolarHBondContact O-N 2.9Å
360	R	37.1	Very low	40.2	Very low	232 Å²	232	141.4 Å²	141.4	88%	0.875	74%	0.742	S	S	*	*	S	Bend	trans	-55.2	160.3	-173.6	-68.8	178.7	173	172.5	-3.7	114.5
361	H	42.6	Very low	40.6	Very low	167 Å²	167	139 Å²	139	77%	0.773	73%	0.725	S	S	*	*			trans	82.2	87.5	-167.5	-57.5	-85.6	0	0	0	114.3	L363	H361-L363 PolarHBondContact O-N 3.17Å
362	G	37.6	Very low	41	Very low	82 Å²	82	134.3 Å²	134.3	85%	0.845	73%	0.725	S	S	*	*			trans	-83.6	97.7	-179.2	0	0	0	0	0	113.3
363	L	45.8	Very low	42	Very low	171 Å²	171	129.7 Å²	129.7	90%	0.895	73%	0.726	S	S	*	*			trans	-138.9	34.8	170.6	-68.9	172.3	0	0	0	111.1	H361	H361-L363 PolarHBondContact O-N 3.17Å
364	C	38.8	Very low	42.9	Very low	66 Å²	66	130.9 Å²	130.9	45%	0.446	71%	0.712	S	S	.	*			trans	-148.1	88.9	-179.4	-169.6	0	0	0	0	110.1	I366	C364-I366 PolarHBondContact O-N 3.32Å
365	L	45.7	Very low	44	Very low	187 Å²	187	127.4 Å²	127.4	98%	0.979	70%	0.696	S	S	*	*			trans	-80.4	5.3	-178.4	-77.9	162.2	0	0	0	114.2
366	I	46.5	Very low	44.8	Very low	141 Å²	141	129.2 Å²	129.2	72%	0.723	69%	0.689	S	S	*	*	S	Bend	trans	-118.8	137.3	-176.6	-56.8	178	0	0	0	109.9	C364 C368	C364-I366 PolarHBondContact O-N 3.32Å; I366-C368 PolarHBondContact O-N 3.38Å
367	Q	47.5	Very low	45.8	Very low	138 Å²	138	122.7 Å²	122.7	65%	0.645	66%	0.663	S	S	*	*			trans	-63.1	96.3	-173.7	-69.5	-174.9	-8.6	0	0	113.2	R369	Q367-R369 VanDerWaalsContact C-N 3.29Å; Q367-R369 PolarHBondContact O-N 3.23Å
368	C	47.3	Very low	46.8	Very low	60 Å²	60	126.1 Å²	126.1	41%	0.405	67%	0.671	S	S	.	*			trans	-76.3	74.9	173.4	-176.5	0	0	0	0	111.8	I366	I366-C368 PolarHBondContact O-N 3.38Å
369	R	48.1	Very low	47.7	Very low	190 Å²	190	120.7 Å²	120.7	72%	0.717	65%	0.649	S	S	*	*			trans	-53.4	140	170.6	-83.5	-173.9	167.6	-174.4	-4.8	110.9	Q367	Q367-R369 VanDerWaalsContact C-N 3.29Å; Q367-R369 PolarHBondContact O-N 3.23Å
370	K	49.6	Very low	48.4	Very low	133 Å²	133	125.8 Å²	125.8	58%	0.578	66%	0.656	S	S	*	*			trans	-113.9	137.1	173.4	-62.8	170.4	-169.9	151.5	0	108.5	C357	C357-K370 PolarHBondContact SG-NZ 2.96Å
371	S	41	Very low	49.4	Very low	77 Å²	77	118.4 Å²	118.4	54%	0.538	64%	0.641	S	S	.	*	B	Isolated β-bridge	trans	-137.6	151.6	164.6	60.9	0	0	0	0	109.4	G373 R374	S371-G373 PolarHBondContact O-N 3.5Å; S371-R374 PolarHBondContact O-N 3Å
372	G	42.7	Very low	50	Low	82 Å²	82	112.5 Å²	112.5	85%	0.845	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	52.4	28.3	174.1	0	0	0	0	0	116.1	R374	G372-R374 PolarHBondContact O-N 2.88Å; G372-R374 VanDerWaalsContact O-N 3.07Å
373	G	50.9	Low	51.1	Low	84 Å²	84	115.6 Å²	115.6	87%	0.866	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	67.1	2.2	-175.5	0	0	0	0	0	115.9	S371	S371-G373 PolarHBondContact O-N 3.5Å
374	R	51	Low	52	Low	142 Å²	142	112.5 Å²	112.5	54%	0.536	59%	0.588	S	S	.	*	B	Isolated β-bridge	trans	-98.4	130.5	-179.9	-65.2	179.2	178.8	-172.2	0.5	109.8	D337 S371 G372 F376	D337-R374 IonicContact OD2-CZ 3.78Å; D337-R374 IonicContact OD2-NH2 2.69Å; D337-R374 PolarHBondContact OD2-NH2 2.73Å; S371-R374 PolarHBondContact O-N 3Å; G372-R374 PolarHBondContact O-N 2.88Å; G372-R374 VanDerWaalsContact O-N 3.07Å; R374-F376 HydrophobicContact CB-CE2 4.36Å
375	T	55.4	Low	52.9	Low	62 Å²	62	117 Å²	117	38%	0.38	60%	0.595	S	S	.	*			trans	-98.5	106.4	177.1	56.3	0	0	0	0	109.9	C377 S386	T375-C377 PolarHBondContact O-N 2.86Å; T375-S386 PolarHBondContact OG1-OG 3.17Å
376	F	53.2	Low	53.6	Low	155 Å²	155	110.1 Å²	110.1	68%	0.68	56%	0.563	S	S	*	*			trans	-73.5	11.3	178.2	-66.1	-85.5	0	0	0	114.3	R374 Q378	R374-F376 HydrophobicContact CB-CE2 4.36Å; F376-Q378 PolarHBondContact O-N 2.89Å
377	C	60.8	Low	54.3	Low	19 Å²	19	105.7 Å²	105.7	13%	0.128	55%	0.547	C	S	.	.			trans	-70.3	119.6	-177.2	-175.6	0	0	0	0	112.3	T375 H379 C382	T375-C377 PolarHBondContact O-N 2.86Å; C377-H379 VanDerWaalsContact C-N 3.33Å; C377-H379 PolarHBondContact O-N 2.83Å; C377-H379 PolarHBondContact SG-ND1 3.01Å; C377-C382 HydrophobicContact CB-CB 3.94Å; C377-C382 VanDerWaalsContact SG-CB 3.51Å; C377-C382 PolarHBondContact SG-SG 2.93Å
378	Q	56.3	Low	55	Low	152 Å²	152	108.2 Å²	108.2	71%	0.71	55%	0.551	S	S	*	*			trans	-75	-15.9	179.9	-65.4	-148.3	32	0	0	114.3	F376 R380 R383	F376-Q378 PolarHBondContact O-N 2.89Å; Q378-R380 PolarHBondContact O-N 3Å; Q378-R383 VanDerWaalsContact O-CZ 3.28Å; Q378-R383 PolarHBondContact O-NE 3.05Å; Q378-R383 PolarHBondContact O-NH2 3.34Å
379	H	59.2	Low	55.6	Low	91 Å²	91	113.2 Å²	113.2	42%	0.421	57%	0.565	S	S	.	*			trans	-59.8	132.7	-175.2	-58.6	136.7	0	0	0	113.1	C377 S381 C382 R383	C377-H379 VanDerWaalsContact C-N 3.33Å; C377-H379 PolarHBondContact O-N 2.83Å; C377-H379 PolarHBondContact SG-ND1 3.01Å; H379-S381 PolarHBondContact O-N 3.16Å; H379-C382 HydrophobicContact CB-CB 4.23Å; H379-C382 PolarHBondContact O-N 3.48Å; H379-R383 PolarHBondContact O-N 2.98Å
380	R	58.4	Low	56	Low	210 Å²	210	113.2 Å²	113.2	79%	0.792	57%	0.565	S	S	*	*	H	α-helix	trans	-53.2	-41.3	179.4	-168	-179.7	-174.5	-141.2	5.5	112.1	Q378 R383 L384	Q378-R380 PolarHBondContact O-N 3Å; R380-R383 PolarHBondContact O-N 3.35Å; R380-L384 HydrophobicContact CG-CD1 4.2Å; R380-L384 WeakPolarHBondContact O-CB 3.34Å; R380-L384 WeakPolarHBondContact O-CD1 3.07Å; R380-L384 VanDerWaalsContact O-CG 3.23Å; R380-L384 WeakPolarHBondContact O-CG 3.26Å; R380-L384 PolarHBondContact O-N 2.9Å
381	S	59	Low	56.4	Low	78 Å²	78	116.3 Å²	116.3	55%	0.545	57%	0.574	S	S	.	*	H	α-helix	trans	-61.5	-41.6	175.3	52.5	0	0	0	0	113.3	H379 R385	H379-S381 PolarHBondContact O-N 3.16Å; S381-R385 PolarHBondContact O-N 3.24Å
382	C	55.3	Low	57	Low	43 Å²	43	117.6 Å²	117.6	29%	0.291	57%	0.574	S	S	.	*	H	α-helix	trans	-71.3	-44.1	176.5	-66.9	0	0	0	0	111.9	C377 H379 L384 R385 S386	C377-C382 HydrophobicContact CB-CB 3.94Å; C377-C382 VanDerWaalsContact SG-CB 3.51Å; C377-C382 PolarHBondContact SG-SG 2.93Å; H379-C382 HydrophobicContact CB-CB 4.23Å; H379-C382 PolarHBondContact O-N 3.48Å; C382-L384 VanDerWaalsContact C-N 3.28Å; C382-L384 PolarHBondContact O-N 3.07Å; C382-R385 PolarHBondContact O-N 2.8Å; C382-S386 PolarHBondContact O-N 3.35Å; C382-S386 PolarHBondContact O-OG 3.34Å
383	R	61.6	Low	57.4	Low	147 Å²	147	124.3 Å²	124.3	56%	0.555	57%	0.573	S	S	*	*	H	α-helix	trans	-56.4	-44.3	172.8	-60.4	-170.5	-149.6	-153.7	5.2	110.8	Q378 H379 R380 S386 A387	Q378-R383 VanDerWaalsContact O-CZ 3.28Å; Q378-R383 PolarHBondContact O-NE 3.05Å; Q378-R383 PolarHBondContact O-NH2 3.34Å; H379-R383 PolarHBondContact O-N 2.98Å; R380-R383 PolarHBondContact O-N 3.35Å; R383-S386 PolarHBondContact O-N 3.27Å; R383-A387 WeakPolarHBondContact O-CB 3.1Å; R383-A387 PolarHBondContact O-N 3.16Å
384	L	63.8	Low	57.3	Low	106 Å²	106	129.7 Å²	129.7	56%	0.555	57%	0.568	S	S	*	*	H	α-helix	trans	-65.1	-43.2	175.8	-74	168.2	0	0	0	113.2	R380 C382 A387 R388	R380-L384 HydrophobicContact CG-CD1 4.2Å; R380-L384 WeakPolarHBondContact O-CB 3.34Å; R380-L384 WeakPolarHBondContact O-CD1 3.07Å; R380-L384 VanDerWaalsContact O-CG 3.23Å; R380-L384 WeakPolarHBondContact O-CG 3.26Å; R380-L384 PolarHBondContact O-N 2.9Å; C382-L384 VanDerWaalsContact C-N 3.28Å; C382-L384 PolarHBondContact O-N 3.07Å; L384-A387 PolarHBondContact O-N 3.49Å; L384-R388 WeakPolarHBondContact O-CB 3.4Å; L384-R388 PolarHBondContact O-N 3.35Å
385	R	58.1	Low	57.2	Low	161 Å²	161	133.1 Å²	133.1	61%	0.608	58%	0.581	S	S	*	*	H	α-helix	trans	-63.5	-41.1	175	-82.7	-169.7	174.6	-165.2	0.2	112.1	S381 C382 R388 K389	S381-R385 PolarHBondContact O-N 3.24Å; C382-R385 PolarHBondContact O-N 2.8Å; R385-R388 PolarHBondContact O-N 3.47Å; R385-K389 PolarHBondContact O-N 3.18Å
386	S	59.9	Low	56.6	Low	42 Å²	42	134.4 Å²	134.4	29%	0.294	59%	0.591	S	S	.	*	H	α-helix	trans	-66.3	-40	175.6	-70.3	0	0	0	0	112.1	T375 C382 R383 K389 R390	T375-S386 PolarHBondContact OG1-OG 3.17Å; C382-S386 PolarHBondContact O-N 3.35Å; C382-S386 PolarHBondContact O-OG 3.34Å; R383-S386 PolarHBondContact O-N 3.27Å; S386-K389 PolarHBondContact O-N 3.24Å; S386-R390 WeakPolarHBondContact O-CB 3.37Å; S386-R390 WeakPolarHBondContact O-CG 3.39Å; S386-R390 PolarHBondContact O-N 2.91Å
387	A	61.5	Low	56.2	Low	48 Å²	48	132.6 Å²	132.6	40%	0.397	59%	0.593	S	S	.	*	H	α-helix	trans	-63.6	-41.5	171.5	0	0	0	0	0	112.5	R383 L384 R390 R391	R383-A387 WeakPolarHBondContact O-CB 3.1Å; R383-A387 PolarHBondContact O-N 3.16Å; L384-A387 PolarHBondContact O-N 3.49Å; A387-R390 PolarHBondContact O-N 3Å; A387-R391 WeakPolarHBondContact O-CG 3.45Å; A387-R391 PolarHBondContact O-N 3.22Å
388	R	62.1	Low	55.4	Low	191 Å²	191	136.9 Å²	136.9	72%	0.721	62%	0.623	S	S	*	*	H	α-helix	trans	-67.2	-39.7	177.9	-157.8	170.5	-174.3	172.5	0.5	111.6	L384 R385 R391 L392	L384-R388 WeakPolarHBondContact O-CB 3.4Å; L384-R388 PolarHBondContact O-N 3.35Å; R385-R388 PolarHBondContact O-N 3.47Å; R388-R391 PolarHBondContact O-N 3Å; R388-L392 HydrophobicContact CG-CD1 4.24Å; R388-L392 WeakPolarHBondContact O-CD1 3.39Å; R388-L392 PolarHBondContact O-N 3.26Å
389	K	58.9	Low	54.9	Low	165 Å²	165	134.3 Å²	134.3	72%	0.717	62%	0.622	S	S	*	*	H	α-helix	trans	-64.5	-40.7	170.5	-88.2	-168.3	170.6	-173.2	0	112.8	R385 S386 R391 L392 R393	R385-K389 PolarHBondContact O-N 3.18Å; S386-K389 PolarHBondContact O-N 3.24Å; K389-R391 VanDerWaalsContact C-N 3.32Å; K389-R391 PolarHBondContact O-N 2.98Å; K389-L392 PolarHBondContact O-N 3.43Å; K389-R393 PolarHBondContact O-N 3.38Å
390	R	58.3	Low	53.8	Low	189 Å²	189	133.9 Å²	133.9	71%	0.713	64%	0.642	S	S	*	*	H	α-helix	trans	-62.1	-36.8	172.7	-77.7	179.9	172.4	-174	-4.5	112.2	S386 A387 R394	S386-R390 WeakPolarHBondContact O-CB 3.37Å; S386-R390 WeakPolarHBondContact O-CG 3.39Å; S386-R390 PolarHBondContact O-N 2.91Å; A387-R390 PolarHBondContact O-N 3Å; R390-R394 PolarHBondContact O-N 2.89Å
391	R	56.4	Low	52.9	Low	199 Å²	199	129.2 Å²	129.2	75%	0.751	64%	0.642	S	S	*	*	H	α-helix	trans	-70.6	-42.3	173.5	-73	-176.5	-178.9	-173.4	0.8	112.9	A387 R388 K389 R394 R395	A387-R391 WeakPolarHBondContact O-CG 3.45Å; A387-R391 PolarHBondContact O-N 3.22Å; R388-R391 PolarHBondContact O-N 3Å; K389-R391 VanDerWaalsContact C-N 3.32Å; K389-R391 PolarHBondContact O-N 2.98Å; R391-R394 PolarHBondContact O-N 3.21Å; R391-R394 VanDerWaalsContact O-N 3.13Å; R391-R395 PolarHBondContact O-N 2.93Å
392	L	54.9	Low	52	Low	104 Å²	104	135.1 Å²	135.1	55%	0.545	66%	0.658	S	S	.	*	H	α-helix	trans	-63.1	-42.6	175.6	-97.2	74.7	0	0	0	112.2	R388 K389 R394 R395 C396	R388-L392 HydrophobicContact CG-CD1 4.24Å; R388-L392 WeakPolarHBondContact O-CD1 3.39Å; R388-L392 PolarHBondContact O-N 3.26Å; K389-L392 PolarHBondContact O-N 3.43Å; L392-R394 PolarHBondContact O-N 3.35Å; L392-R394 VanDerWaalsContact O-N 3.11Å; L392-R395 PolarHBondContact O-N 3.46Å; L392-C396 PolarHBondContact O-N 2.93Å; L392-C396 PolarHBondContact O-SG 2.7Å
393	R	51.5	Low	50.8	Low	222 Å²	222	138.6 Å²	138.6	84%	0.838	68%	0.681	S	S	*	*	H	α-helix	trans	-60.2	-20.2	174.2	-81.8	-168.3	169.3	-163.1	-3.7	114	K389	K389-R393 PolarHBondContact O-N 3.38Å
394	R	48.9	Very low	49.5	Very low	198 Å²	198	141.5 Å²	141.5	75%	0.747	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.2	4.4	172	-71.2	-173.7	174.6	-165.9	-2.1	114.1	R390 R391 L392	R390-R394 PolarHBondContact O-N 2.89Å; R391-R394 PolarHBondContact O-N 3.21Å; R391-R394 VanDerWaalsContact O-N 3.13Å; L392-R394 PolarHBondContact O-N 3.35Å; L392-R394 VanDerWaalsContact O-N 3.11Å
395	R	47	Very low	48	Very low	213 Å²	213	146.2 Å²	146.2	80%	0.804	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.4	-5.4	-177.6	-137.6	-177.8	-162.4	-162.5	3.8	114.8	R391 L392	R391-R395 PolarHBondContact O-N 2.93Å; L392-R395 PolarHBondContact O-N 3.46Å
396	C	43.1	Very low	46.9	Very low	90 Å²	90	142.6 Å²	142.6	61%	0.608	71%	0.708	S	S	*	*			trans	-96.5	23.9	177.7	-61.5	0	0	0	0	113.4	L392 S398	L392-C396 PolarHBondContact O-N 2.93Å; L392-C396 PolarHBondContact O-SG 2.7Å; C396-S398 VanDerWaalsContact C-N 3.34Å
397	T	45.2	Very low	45.8	Very low	117 Å²	117	143.4 Å²	143.4	72%	0.718	71%	0.712	S	S	*	*			trans	-98.1	29.3	-179.8	56.6	0	0	0	0	112.4
398	S	45.1	Very low	45	Very low	108 Å²	108	146.9 Å²	146.9	76%	0.755	72%	0.723	S	S	*	*	S	Bend	trans	-129.1	15.8	-172.9	65	0	0	0	0	113.7	C396	C396-S398 VanDerWaalsContact C-N 3.34Å
399	S	45.7	Very low	44.4	Very low	99 Å²	99	141.8 Å²	141.8	69%	0.692	71%	0.709	S	S	*	*	S	Bend	trans	-142.5	150.5	166.9	53.2	0	0	0	0	109	S401	S399-S401 PolarHBondContact O-N 2.66Å; S399-S401 VanDerWaalsContact O-N 3.12Å
400	G	35.8	Very low	44.3	Very low	82 Å²	82	140.8 Å²	140.8	85%	0.845	71%	0.707	S	S	*	*	S	Bend	trans	-67.7	106.7	-158.5	0	0	0	0	0	115.4
401	S	39.7	Very low	44.7	Very low	112 Å²	112	134 Å²	134	78%	0.783	68%	0.684	S	S	*	*	S	Bend	trans	-163.4	118.8	156.9	-86.1	0	0	0	0	111.1	S399 C403	S399-S401 PolarHBondContact O-N 2.66Å; S399-S401 VanDerWaalsContact O-N 3.12Å; S401-C403 PolarHBondContact O-N 3.21Å
402	K	39.3	Very low	45.7	Very low	202 Å²	202	128.3 Å²	128.3	88%	0.878	67%	0.671	S	S	*	*			trans	12.8	92.4	171.4	-67.9	-179	178.6	178.3	0	115.3	F404	K402-F404 PolarHBondContact O-N 3.14Å
403	C	29.4	Very low	47.1	Very low	116 Å²	116	126.7 Å²	126.7	78%	0.784	67%	0.669	S	S	*	*			trans	-57.2	103.4	176.8	-64.3	0	0	0	0	111.7	S401 R405	S401-C403 PolarHBondContact O-N 3.21Å; C403-R405 VanDerWaalsContact C-N 3.29Å; C403-R405 PolarHBondContact O-N 3.02Å
404	F	35.2	Very low	49	Very low	207 Å²	207	116.3 Å²	116.3	91%	0.908	63%	0.63	S	S	*	*			trans	-58.7	98	156.6	-91.4	-93.3	0	0	0	107.6	K402 S406	K402-F404 PolarHBondContact O-N 3.14Å; F404-S406 PolarHBondContact O-N 3.22Å
405	R	32.7	Very low	51	Low	205 Å²	205	110.1 Å²	110.1	77%	0.774	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-51.9	130.8	162.3	-72.1	-175.9	173.6	-168.7	-1.5	106.2	C403	C403-R405 VanDerWaalsContact C-N 3.29Å; C403-R405 PolarHBondContact O-N 3.02Å
406	S	35.2	Very low	53.2	Low	85 Å²	85	104.6 Å²	104.6	59%	0.594	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-50.5	133.1	160	-66.5	0	0	0	0	106.4	F404 L408	F404-S406 PolarHBondContact O-N 3.22Å; S406-L408 PolarHBondContact O-N 3.32Å
407	P	36.7	Very low	55.7	Low	59 Å²	59	106.2 Å²	106.2	38%	0.383	60%	0.602	S	S	.	*	P	Polyproline II helix	trans	-48.9	121.7	178.1	-28.5	35.2	0	0	0	108.2	M409	P407-M409 PolarHBondContact O-N 3.16Å
408	L	43.7	Very low	58.1	Low	121 Å²	121	100.9 Å²	100.9	63%	0.634	57%	0.569	S	S	*	*	P	Polyproline II helix	trans	-52.2	145.4	165.5	-84.5	102.5	0	0	0	106.2	S406 H410	S406-L408 PolarHBondContact O-N 3.32Å; L408-H410 PolarHBondContact O-CD2 3.34Å; L408-H410 PolarHBondContact O-N 2.92Å
409	M	50.8	Low	60.5	Low	84 Å²	84	97.1 Å²	97.1	41%	0.414	54%	0.54	S	S	.	.			trans	-59.5	89	179.4	-72.5	-70.2	152.3	0	0	108.7	V334 P407 I411 L647	V334-M409 HydrophobicContact CG1-CE 3.56Å; V334-M409 HydrophobicContact CG1-SD 3.9Å; P407-M409 PolarHBondContact O-N 3.16Å; M409-I411 PolarHBondContact O-N 3.22Å; M409-L647 HydrophobicContact CB-CD2 4.48Å; M409-L647 HydrophobicContact CG-CD2 4.4Å
410	H	55.6	Low	63	Low	145 Å²	145	95.7 Å²	95.7	67%	0.671	53%	0.53	S	S	*	.			trans	-64.9	111.3	-179.6	-96.3	-93.9	0	0	0	105.7	L408 T412	L408-H410 PolarHBondContact O-CD2 3.34Å; L408-H410 PolarHBondContact O-N 2.92Å; H410-T412 PolarHBondContact O-N 3.24Å
411	I	66.8	Low	65.9	Low	47 Å²	47	93.1 Å²	93.1	24%	0.241	50%	0.499	C	S	.	.			trans	-77.1	86.6	174.3	-63.7	-178.6	0	0	0	104.7	M409 S413 W640 G643 S644	M409-I411 PolarHBondContact O-N 3.22Å; I411-S413 PolarHBondContact O-N 3Å; I411-W640 VanDerWaalsContact CG2-CA 3.49Å; I411-W640 HydrophobicContact CG2-CB 4.05Å; I411-G643 VanDerWaalsContact CD1-C 3.43Å; I411-S644 VanDerWaalsContact CD1-N 3.26Å
412	T	76.7	Confident	68.7	Low	78 Å²	78	87.8 Å²	87.8	48%	0.479	46%	0.462	S	S	.	.	P	Polyproline II helix	trans	-53.1	136	164.4	48.9	0	0	0	0	107.8	H410	H410-T412 PolarHBondContact O-N 3.24Å
413	S	85.9	Confident	71.4	Confident	70 Å²	70	83.2 Å²	83.2	49%	0.49	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-54.8	158.1	164.5	53.4	0	0	0	0	110.4	I411	I411-S413 PolarHBondContact O-N 3Å
414	P	90.6	Very high	74.7	Confident	4 Å²	4	79.3 Å²	79.3	3%	0.026	42%	0.423	C	S	.	.	P	Polyproline II helix	trans	-54.1	163.9	158.2	28.8	-37.9	0	0	0	110.9	P416 L419 F633 Y637 W640	P414-P416 WeakPolarHBondContact O-CD 3.32Å; P414-L419 HydrophobicContact CG-CD2 4.14Å; P414-F633 HydrophobicContact CB-CD2 4.02Å; P414-F633 HydrophobicContact CB-CE2 3.57Å; P414-F633 HydrophobicContact CB-CZ 3.99Å; P414-Y637 HydrophobicContact CB-CD2 4.31Å; P414-Y637 HydrophobicContact CG-CD2 4.07Å; P414-W640 HydrophobicContact CG-CD2 4.48Å; P414-W640 HydrophobicContact CG-CE3 4.36Å
415	D	91.4	Very high	77.7	Confident	69 Å²	69	69.5 Å²	69.5	37%	0.369	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-57.4	119.9	168.2	174.7	-16.5	0	0	0	109.1	H417 L418 L419 F633	D415-H417 WeakPolarHBondContact OD1-CA 3.31Å; D415-H417 WeakPolarHBondContact OD1-CB 3.49Å; D415-H417 PolarHBondContact OD1-N 3.43Å; D415-L418 HydrophobicContact CB-CB 3.9Å; D415-L418 PolarHBondContact OD1-N 2.89Å; D415-L418 VanDerWaalsContact OD1-N 3.11Å; D415-L419 VanDerWaalsContact O-CB 3.24Å; D415-L419 WeakPolarHBondContact O-CB 3.48Å; D415-L419 PolarHBondContact O-N 3.13Å; D415-F633 HydrophobicContact CB-CD2 4.42Å
416	P	93.5	Very high	80.8	Confident	96 Å²	96	60.6 Å²	60.6	62%	0.623	35%	0.349	S	S	*	.	H	α-helix	trans	-70.5	-30	-176.1	29.4	-35	0	0	0	112.8	P414 S420	P414-P416 WeakPolarHBondContact O-CD 3.32Å; P416-S420 WeakPolarHBondContact O-CB 3.31Å; P416-S420 PolarHBondContact O-N 3.36Å
417	H	94.2	Very high	83.8	Confident	125 Å²	125	62.7 Å²	62.7	58%	0.579	35%	0.348	S	S	*	.	H	α-helix	trans	-71.3	-47.4	176.4	177.1	64.4	0	0	0	110.1	D415 L419 S420 C421	D415-H417 WeakPolarHBondContact OD1-CA 3.31Å; D415-H417 WeakPolarHBondContact OD1-CB 3.49Å; D415-H417 PolarHBondContact OD1-N 3.43Å; H417-L419 VanDerWaalsContact C-N 3.32Å; H417-L419 PolarHBondContact O-N 3.11Å; H417-S420 PolarHBondContact O-N 3.38Å; H417-C421 PolarHBondContact O-N 3.33Å; H417-C421 PolarHBondContact O-SG 2.87Å
418	L	95.3	Very high	86.7	Confident	5 Å²	5	64.6 Å²	64.6	3%	0.026	35%	0.348	C	S	.	.	H	α-helix	trans	-66.2	-35	177.6	-165.8	58	0	0	0	112.1	D415 C421 L422 P469 Y470 Y630 F633	D415-L418 HydrophobicContact CB-CB 3.9Å; D415-L418 PolarHBondContact OD1-N 2.89Å; D415-L418 VanDerWaalsContact OD1-N 3.11Å; L418-C421 PolarHBondContact O-N 3.26Å; L418-L422 HydrophobicContact CG-CD1 4.27Å; L418-L422 WeakPolarHBondContact O-CB 3.49Å; L418-L422 WeakPolarHBondContact O-CD1 3.46Å; L418-L422 VanDerWaalsContact O-CG 3.26Å; L418-L422 WeakPolarHBondContact O-CG 3.39Å; L418-L422 PolarHBondContact O-N 3.14Å; L418-P469 HydrophobicContact CD1-CG 3.77Å; L418-Y470 HydrophobicContact CD1-CE2 4.05Å; L418-Y470 HydrophobicContact CD2-CE2 4.15Å; L418-Y630 HydrophobicContact CD1-CE1 3.66Å; L418-Y630 HydrophobicContact CD2-CD1 4.23Å; L418-Y630 HydrophobicContact CD2-CE1 4.16Å; L418-Y630 HydrophobicContact CG-CE1 4.15Å; L418-F633 HydrophobicContact CB-CD2 4.01Å; L418-F633 HydrophobicContact CB-CE2 4.14Å; L418-F633 HydrophobicContact CD2-CB 3.95Å; L418-F633 HydrophobicContact CD2-CD2 3.77Å; L418-F633 HydrophobicContact CD2-CG 4.04Å; L418-F633 HydrophobicContact CG-CD2 3.96Å; L418-F633 HydrophobicContact CG-CE2 4.32Å; L418-F633 HydrophobicContact CG-CG 4.49Å
419	L	97.1	Very high	89.2	Confident	29 Å²	29	58.9 Å²	58.9	15%	0.152	32%	0.318	C	S	.	.	H	α-helix	trans	-60.8	-46.1	171.7	176.1	61.5	0	0	0	111.3	P414 D415 H417 L422 Q423 I599 F633 Y637	P414-L419 HydrophobicContact CG-CD2 4.14Å; D415-L419 VanDerWaalsContact O-CB 3.24Å; D415-L419 WeakPolarHBondContact O-CB 3.48Å; D415-L419 PolarHBondContact O-N 3.13Å; H417-L419 VanDerWaalsContact C-N 3.32Å; H417-L419 PolarHBondContact O-N 3.11Å; L419-L422 PolarHBondContact O-N 2.8Å; L419-Q423 HydrophobicContact CD1-CG 4.39Å; L419-Q423 WeakPolarHBondContact O-CG 3.29Å; L419-Q423 PolarHBondContact O-N 3.4Å; L419-I599 HydrophobicContact CD1-CD1 4.45Å; L419-I599 HydrophobicContact CD1-CG1 4.4Å; L419-I599 HydrophobicContact CD1-CG2 3.89Å; L419-F633 HydrophobicContact CB-CE2 3.93Å; L419-F633 HydrophobicContact CB-CZ 4Å; L419-F633 HydrophobicContact CD1-CZ 4.02Å; L419-Y637 HydrophobicContact CD1-CD2 4.39Å; L419-Y637 HydrophobicContact CD1-CE2 3.96Å
420	S	97.1	Very high	91.4	Very high	69 Å²	69	59.3 Å²	59.3	48%	0.483	32%	0.315	S	S	.	.	H	α-helix	trans	-63.1	-42.3	177.2	-176.6	0	0	0	0	112.2	P416 H417 L422 Q423 G424	P416-S420 WeakPolarHBondContact O-CB 3.31Å; P416-S420 PolarHBondContact O-N 3.36Å; H417-S420 PolarHBondContact O-N 3.38Å; S420-L422 VanDerWaalsContact C-N 3.34Å; S420-L422 PolarHBondContact O-N 3.34Å; S420-Q423 PolarHBondContact O-N 3.37Å; S420-G424 PolarHBondContact O-N 2.97Å
421	C	96.9	Very high	93.2	Very high	28 Å²	28	55.3 Å²	55.3	19%	0.189	30%	0.297	C	S	.	.	H	α-helix	trans	-60.8	-42.1	174.1	-62.5	0	0	0	0	112	H417 L418 G424 C425	H417-C421 PolarHBondContact O-N 3.33Å; H417-C421 PolarHBondContact O-SG 2.87Å; L418-C421 PolarHBondContact O-N 3.26Å; C421-G424 PolarHBondContact O-N 3.3Å; C421-C425 PolarHBondContact O-N 3.5Å; C421-C425 PolarHBondContact O-SG 3.23Å
422	L	97.9	Very high	94.6	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-68.6	-38	177.5	-72	166	0	0	0	112.1	L418 L419 S420 C425 V426 L468 I599 M602 Y630 F633	L418-L422 HydrophobicContact CG-CD1 4.27Å; L418-L422 WeakPolarHBondContact O-CB 3.49Å; L418-L422 WeakPolarHBondContact O-CD1 3.46Å; L418-L422 VanDerWaalsContact O-CG 3.26Å; L418-L422 WeakPolarHBondContact O-CG 3.39Å; L418-L422 PolarHBondContact O-N 3.14Å; L419-L422 PolarHBondContact O-N 2.8Å; S420-L422 VanDerWaalsContact C-N 3.34Å; S420-L422 PolarHBondContact O-N 3.34Å; L422-C425 WeakPolarHBondContact O-CB 3.24Å; L422-C425 PolarHBondContact O-N 3.12Å; L422-V426 WeakPolarHBondContact O-CG2 3.31Å; L422-V426 PolarHBondContact O-N 3.1Å; L422-L468 HydrophobicContact CD2-CD2 3.97Å; L422-I599 HydrophobicContact CB-CD1 4.31Å; L422-M602 HydrophobicContact CD2-CB 4.17Å; L422-M602 HydrophobicContact CD2-CG 3.53Å; L422-Y630 HydrophobicContact CD1-CE1 4.42Å; L422-Y630 HydrophobicContact CD2-CE1 4.06Å; L422-Y630 HydrophobicContact CG-CE1 4.46Å; L422-F633 HydrophobicContact CD1-CD1 3.75Å; L422-F633 HydrophobicContact CD1-CD2 4.44Å; L422-F633 HydrophobicContact CD1-CE1 3.35Å; L422-F633 HydrophobicContact CD1-CE2 4.07Å; L422-F633 HydrophobicContact CD1-CG 4.3Å; L422-F633 HydrophobicContact CD1-CZ 3.53Å
423	Q	97.7	Very high	95.4	Very high	105 Å²	105	51.7 Å²	51.7	49%	0.491	28%	0.277	S	S	.	.	H	α-helix	trans	-60.1	-45	171.3	-74.8	170.2	-39.3	0	0	111.6	L419 S420 C425 V426 H427 I599	L419-Q423 HydrophobicContact CD1-CG 4.39Å; L419-Q423 WeakPolarHBondContact O-CG 3.29Å; L419-Q423 PolarHBondContact O-N 3.4Å; S420-Q423 PolarHBondContact O-N 3.37Å; Q423-C425 VanDerWaalsContact C-N 3.32Å; Q423-C425 PolarHBondContact O-N 2.71Å; Q423-V426 PolarHBondContact O-N 2.72Å; Q423-H427 PolarHBondContact O-N 3.48Å; Q423-I599 HydrophobicContact CB-CD1 4.27Å; Q423-I599 HydrophobicContact CG-CD1 3.55Å; Q423-I599 HydrophobicContact CG-CG1 4.47Å
424	G	97.8	Very high	95.7	Very high	35 Å²	35	50.7 Å²	50.7	36%	0.361	27%	0.268	S	S	.	.	H	α-helix	trans	-61.7	-37.1	174.2	0	0	0	0	0	113.2	S420 C421 R428	S420-G424 PolarHBondContact O-N 2.97Å; C421-G424 PolarHBondContact O-N 3.3Å; G424-R428 WeakPolarHBondContact O-CG 3.43Å; G424-R428 PolarHBondContact O-N 2.95Å
425	C	98.3	Very high	95.3	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-67.4	-40.8	173.4	-66.4	0	0	0	0	112.5	C421 L422 Q423 R428 I429 V464 M602	C421-C425 PolarHBondContact O-N 3.5Å; C421-C425 PolarHBondContact O-SG 3.23Å; L422-C425 WeakPolarHBondContact O-CB 3.24Å; L422-C425 PolarHBondContact O-N 3.12Å; Q423-C425 VanDerWaalsContact C-N 3.32Å; Q423-C425 PolarHBondContact O-N 2.71Å; C425-R428 PolarHBondContact O-N 2.97Å; C425-I429 WeakPolarHBondContact O-CG1 3.42Å; C425-I429 PolarHBondContact O-N 3.12Å; C425-V464 HydrophobicContact CB-CG1 3.87Å; C425-M602 HydrophobicContact CB-CE 3.71Å; C425-M602 HydrophobicContact CB-CG 4.04Å; C425-M602 HydrophobicContact CB-SD 4Å
426	V	98.2	Very high	95	Very high	19 Å²	19	57 Å²	57	12%	0.115	31%	0.306	C	S	.	.	H	α-helix	trans	-62.5	-42.6	176.4	166.8	0	0	0	0	111.4	L422 Q423 R428 I429 R430 F497 D598 I599 M602	L422-V426 WeakPolarHBondContact O-CG2 3.31Å; L422-V426 PolarHBondContact O-N 3.1Å; Q423-V426 PolarHBondContact O-N 2.72Å; V426-R428 VanDerWaalsContact C-N 3.33Å; V426-R428 PolarHBondContact O-N 3.08Å; V426-I429 PolarHBondContact O-N 3.42Å; V426-I429 VanDerWaalsContact O-N 3.15Å; V426-R430 HydrophobicContact CG1-CG 4.3Å; V426-R430 WeakPolarHBondContact O-CB 3.45Å; V426-R430 WeakPolarHBondContact O-CG 3.38Å; V426-R430 PolarHBondContact O-N 3.13Å; V426-F497 HydrophobicContact CG2-CE1 4.26Å; V426-D598 HydrophobicContact CG1-CB 3.62Å; V426-D598 HydrophobicContact CG2-CB 3.99Å; V426-D598 WeakPolarHBondContact CG2-O 3.45Å; V426-I599 HydrophobicContact CG2-CD1 4.01Å; V426-M602 HydrophobicContact CG2-CB 3.8Å; V426-M602 HydrophobicContact CG2-CG 4.28Å
427	H	97.5	Very high	94.5	Very high	128 Å²	128	53.9 Å²	53.9	59%	0.593	28%	0.283	S	S	*	.	H	α-helix	trans	-56.5	-48.1	174.9	-171.4	76.7	0	0	0	111.1	Q423 I429 R430 E431	Q423-H427 PolarHBondContact O-N 3.48Å; H427-I429 VanDerWaalsContact C-N 3.26Å; H427-I429 PolarHBondContact O-N 2.94Å; H427-R430 CarbonylContact O-C 3.53Å; H427-R430 PolarHBondContact O-N 3.06Å; H427-E431 IonicContact CD2-OE1 2.89Å; H427-E431 PolarHBondContact O-N 3.39Å
428	R	97.4	Very high	93.7	Very high	100 Å²	100	56 Å²	56	38%	0.377	29%	0.293	S	S	.	.	H	α-helix	trans	-66.8	-19	177.6	-66.6	-176.7	-173.6	-62.6	5.2	115.6	G424 C425 V426 E431 V464 H467	G424-R428 WeakPolarHBondContact O-CG 3.43Å; G424-R428 PolarHBondContact O-N 2.95Å; C425-R428 PolarHBondContact O-N 2.97Å; V426-R428 VanDerWaalsContact C-N 3.33Å; V426-R428 PolarHBondContact O-N 3.08Å; R428-E431 WeakPolarHBondContact CA-OE1 3.28Å; R428-E431 WeakPolarHBondContact CG-OE1 3.19Å; R428-E431 IonicContact NH1-OE1 3.37Å; R428-V464 HydrophobicContact CB-CG2 3.89Å; R428-H467 VanDerWaalsContact CD-CD2 3.45Å; R428-H467 WeakPolarHBondContact CD-CD2 3.42Å; R428-H467 PolarHBondContact NE-CD2 2.92Å; R428-H467 PolarHBondContact NE-NE2 2.83Å
429	I	97	Very high	93.2	Very high	1 Å²	1	56.6 Å²	56.6	1%	0.005	30%	0.296	C	S	.	.	H	α-helix	trans	-77.2	-47.2	166.8	-69.8	173.3	0	0	0	109.2	C425 V426 H427 V464 Y494 F497 F498 M602	C425-I429 WeakPolarHBondContact O-CG1 3.42Å; C425-I429 PolarHBondContact O-N 3.12Å; V426-I429 PolarHBondContact O-N 3.42Å; V426-I429 VanDerWaalsContact O-N 3.15Å; H427-I429 VanDerWaalsContact C-N 3.26Å; H427-I429 PolarHBondContact O-N 2.94Å; I429-V464 HydrophobicContact CD1-CG1 4.22Å; I429-V464 HydrophobicContact CG1-CG1 4.02Å; I429-V464 HydrophobicContact CG1-CG2 3.89Å; I429-Y494 HydrophobicContact CB-CE2 4.36Å; I429-Y494 HydrophobicContact CD1-CD2 4.47Å; I429-Y494 HydrophobicContact CG1-CD2 4.25Å; I429-Y494 HydrophobicContact CG1-CE2 4.08Å; I429-Y494 HydrophobicContact CG2-CD2 4.24Å; I429-Y494 HydrophobicContact CG2-CE2 3.85Å; I429-F497 HydrophobicContact CD1-CD2 4.37Å; I429-F497 HydrophobicContact CD1-CE1 4.01Å; I429-F497 HydrophobicContact CD1-CE2 3.79Å; I429-F497 HydrophobicContact CD1-CZ 3.57Å; I429-F497 HydrophobicContact CG2-CB 4.08Å; I429-F497 HydrophobicContact CG2-CD1 3.92Å; I429-F497 HydrophobicContact CG2-CD2 4.22Å; I429-F497 HydrophobicContact CG2-CE1 4.37Å; I429-F497 HydrophobicContact CG2-CG 3.83Å; I429-F498 HydrophobicContact CG2-CE2 3.82Å; I429-F498 HydrophobicContact CG2-CZ 3.83Å; I429-F498 WeakPolarHBondContact O-CZ 3.48Å; I429-M602 HydrophobicContact CD1-SD 3.59Å; I429-M602 VanDerWaalsContact CD1-SD 3.59Å
430	R	96.1	Very high	92.4	Very high	92 Å²	92	59.2 Å²	59.2	35%	0.347	31%	0.308	S	S	.	.	H	α-helix	trans	-76.5	-15.3	-172.8	-69.8	-68.4	-174.3	-164.2	-4.3	115.8	V426 H427 F497 D598	V426-R430 HydrophobicContact CG1-CG 4.3Å; V426-R430 WeakPolarHBondContact O-CB 3.45Å; V426-R430 WeakPolarHBondContact O-CG 3.38Å; V426-R430 PolarHBondContact O-N 3.13Å; H427-R430 CarbonylContact O-C 3.53Å; H427-R430 PolarHBondContact O-N 3.06Å; R430-F497 PolarHBondContact NH1-O 3.46Å; R430-F497 PolarHBondContact NH2-O 3.07Å; R430-D598 IonicContact CZ-OD1 3.19Å; R430-D598 IonicContact CZ-OD2 2.91Å; R430-D598 IonicContact NE-OD2 3.37Å; R430-D598 PolarHBondContact NE-OD2 3.16Å; R430-D598 VanDerWaalsContact NH2-CG 3.27Å; R430-D598 IonicContact NH2-OD1 3.27Å; R430-D598 PolarHBondContact NH2-OD1 3.17Å; R430-D598 IonicContact NH2-OD2 3.01Å; R430-D598 PolarHBondContact NH2-OD2 2.96Å
431	E	94.7	Very high	91.4	Very high	61 Å²	61	59.7 Å²	59.7	29%	0.285	31%	0.308	S	S	.	.	S	Bend	trans	-45.7	138.2	168.2	-79.1	163.2	-151.6	0	0	110.6	H427 R428 R460	H427-E431 IonicContact CD2-OE1 2.89Å; H427-E431 PolarHBondContact O-N 3.39Å; R428-E431 WeakPolarHBondContact CA-OE1 3.28Å; R428-E431 WeakPolarHBondContact CG-OE1 3.19Å; R428-E431 IonicContact NH1-OE1 3.37Å; E431-R460 PolarHBondContact O-NH1 3.19Å
432	P	94.9	Very high	90.2	Very high	48 Å²	48	60.6 Å²	60.6	31%	0.312	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-60.5	152.3	171.6	-23.8	34.9	0	0	0	112.1	R460 P509 L511 L517	P432-R460 PolarHBondContact O-NH2 2.92Å; P432-P509 WeakPolarHBondContact CA-O 3.45Å; P432-P509 HydrophobicContact CB-CB 4.22Å; P432-P509 HydrophobicContact CG-CB 4.39Å; P432-L511 HydrophobicContact CB-CB 4.24Å; P432-L517 HydrophobicContact CB-CD1 3.8Å; P432-L517 HydrophobicContact CG-CD1 3.66Å
433	F	93.6	Very high	89	Confident	1 Å²	1	66.3 Å²	66.3	0%	0.004	35%	0.351	C	S	.	.	B	Isolated β-bridge	trans	-71.7	127.9	165.7	-75.7	-95.6	0	0	0	109.7	E437 L439 A456 Y494 Y508 P509 V510 L511	F433-E437 WeakPolarHBondContact CA-OE2 3.32Å; F433-E437 HydrophobicContact CD1-CB 3.93Å; F433-L439 HydrophobicContact CB-CD2 4.5Å; F433-L439 HydrophobicContact CD1-CB 4.19Å; F433-L439 HydrophobicContact CD1-CD2 4.47Å; F433-L439 HydrophobicContact CD2-CD2 3.92Å; F433-L439 HydrophobicContact CE1-CD1 4.36Å; F433-L439 HydrophobicContact CE2-CD2 4.23Å; F433-L439 HydrophobicContact CG-CB 4.4Å; F433-L439 HydrophobicContact CG-CD2 4.05Å; F433-L439 HydrophobicContact CZ-CD1 4.35Å; F433-A456 HydrophobicContact CE1-CB 4.07Å; F433-Y494 WeakPolarHBondContact CZ-OH 3.28Å; F433-Y508 AromaticContact CE2-CD1 3.76Å; F433-Y508 HydrophobicContact CE2-CD1 3.76Å; F433-Y508 HydrophobicContact CE2-CE1 4.36Å; F433-Y508 HydrophobicContact CE2-CG 4.33Å; F433-P509 PolarHBondContact N-O 3.25Å; F433-V510 HydrophobicContact CB-CG2 4.33Å; F433-V510 WeakPolarHBondContact O-CA 3.48Å; F433-L511 PolarHBondContact O-N 3.08Å
434	T	91.7	Very high	88	Confident	49 Å²	49	62.4 Å²	62.4	30%	0.301	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-80.5	164.1	174.2	70.1	0	0	0	0	111.3	D436 E437	T434-D436 PolarHBondContact O-N 3.35Å; T434-D436 VanDerWaalsContact O-N 3.17Å; T434-E437 PolarHBondContact N-OE2 3.47Å; T434-E437 PolarHBondContact O-N 3.45Å
435	P	84.1	Confident	86.9	Confident	65 Å²	65	65.3 Å²	65.3	42%	0.422	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-28.9	177.2	-26.8	36.4	0	0	0	114.3	E437 L511 T513	P435-E437 VanDerWaalsContact C-N 3.32Å; P435-L511 WeakPolarHBondContact CD-O 3.15Å; P435-L511 WeakPolarHBondContact CG-O 3.36Å; P435-T513 HydrophobicContact CB-CG2 3.84Å; P435-T513 HydrophobicContact CG-CG2 3.79Å
436	D	84.6	Confident	86	Confident	142 Å²	142	67.1 Å²	67.1	76%	0.759	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-24.5	176.3	-45.1	-71.6	0	0	0	112.8	T434 Q438	T434-D436 PolarHBondContact O-N 3.35Å; T434-D436 VanDerWaalsContact O-N 3.17Å; D436-Q438 PolarHBondContact O-N 2.76Å; D436-Q438 VanDerWaalsContact O-N 3.16Å
437	E	82.4	Confident	85.1	Confident	29 Å²	29	67.1 Å²	67.1	14%	0.136	36%	0.358	C	S	.	.	S	Bend	trans	-86	83	176.3	-65.2	177.6	110.3	0	0	109.7	F433 T434 P435 L439 R460 R463	F433-E437 WeakPolarHBondContact CA-OE2 3.32Å; F433-E437 HydrophobicContact CD1-CB 3.93Å; T434-E437 PolarHBondContact N-OE2 3.47Å; T434-E437 PolarHBondContact O-N 3.45Å; P435-E437 VanDerWaalsContact C-N 3.32Å; E437-L439 VanDerWaalsContact C-N 3.26Å; E437-L439 PolarHBondContact O-N 2.87Å; E437-R460 VanDerWaalsContact CD-NH2 3.29Å; E437-R460 IonicContact OE1-CZ 2.68Å; E437-R460 IonicContact OE1-NE 3.26Å; E437-R460 PolarHBondContact OE1-NE 2.85Å; E437-R460 IonicContact OE1-NH2 3.58Å; E437-R460 PolarHBondContact OE1-NH2 3.4Å; E437-R460 VanDerWaalsContact OE1-NH2 3.14Å; E437-R460 IonicContact OE2-CZ 3.84Å; E437-R460 IonicContact OE2-NH2 3.69Å; E437-R460 PolarHBondContact OE2-NH2 3.05Å; E437-R463 IonicContact OE1-CZ 3.06Å; E437-R463 IonicContact OE1-NH1 2.74Å; E437-R463 PolarHBondContact OE1-NH1 3.2Å; E437-R463 IonicContact OE1-NH2 2.77Å; E437-R463 PolarHBondContact OE1-NH2 2.94Å
438	Q	78.5	Confident	84.6	Confident	170 Å²	170	62.3 Å²	62.3	79%	0.794	34%	0.335	S	S	*	.			trans	-53.5	72.1	-176.3	-63.2	178.9	-24.5	0	0	115	D436 E440	D436-Q438 PolarHBondContact O-N 2.76Å; D436-Q438 VanDerWaalsContact O-N 3.16Å; Q438-E440 PolarHBondContact O-N 2.89Å
439	L	84.7	Confident	84	Confident	18 Å²	18	61.1 Å²	61.1	9%	0.094	33%	0.334	C	S	.	.			trans	-79.4	107.5	173.1	-177.9	68.3	0	0	0	108.8	F433 E437 T441 A456 Y508 V510	F433-L439 HydrophobicContact CB-CD2 4.5Å; F433-L439 HydrophobicContact CD1-CB 4.19Å; F433-L439 HydrophobicContact CD1-CD2 4.47Å; F433-L439 HydrophobicContact CD2-CD2 3.92Å; F433-L439 HydrophobicContact CE1-CD1 4.36Å; F433-L439 HydrophobicContact CE2-CD2 4.23Å; F433-L439 HydrophobicContact CG-CB 4.4Å; F433-L439 HydrophobicContact CG-CD2 4.05Å; F433-L439 HydrophobicContact CZ-CD1 4.35Å; E437-L439 VanDerWaalsContact C-N 3.26Å; E437-L439 PolarHBondContact O-N 2.87Å; L439-T441 VanDerWaalsContact O-CG2 3.32Å; L439-T441 WeakPolarHBondContact O-CG2 3.37Å; L439-T441 PolarHBondContact O-N 2.76Å; L439-A456 HydrophobicContact CB-CB 4.37Å; L439-A456 HydrophobicContact CD1-CB 4.28Å; L439-Y508 HydrophobicContact CD2-CD2 4.25Å; L439-Y508 HydrophobicContact CD2-CG 4.11Å; L439-V510 HydrophobicContact CD2-CG2 3.99Å
440	E	79.9	Confident	83.4	Confident	84 Å²	84	61.4 Å²	61.4	39%	0.393	34%	0.336	S	S	.	.			trans	-64.4	100.6	179.4	-66.5	-176.1	-173	0	0	111	Q438 R453	Q438-E440 PolarHBondContact O-N 2.89Å; E440-R453 HydrophobicContact CB-CB 4.32Å; E440-R453 HydrophobicContact CB-CG 4.12Å; E440-R453 WeakPolarHBondContact O-CG 3.13Å; E440-R453 PolarHBondContact O-NE 3.37Å
441	T	75	Confident	83.1	Confident	79 Å²	79	57.3 Å²	57.3	49%	0.485	32%	0.32	S	S	.	.			trans	-77.3	-31	-175.3	63.7	0	0	0	0	112.7	L439 R453 V520	L439-T441 VanDerWaalsContact O-CG2 3.32Å; L439-T441 WeakPolarHBondContact O-CG2 3.37Å; L439-T441 PolarHBondContact O-N 2.76Å; T441-R453 PolarHBondContact O-NH2 2.88Å; T441-V520 HydrophobicContact CG2-CB 4.4Å; T441-V520 HydrophobicContact CG2-CG1 3.79Å; T441-V520 HydrophobicContact CG2-CG2 3.84Å
442	G	72	Confident	82.9	Confident	47 Å²	47	55.5 Å²	55.5	49%	0.485	31%	0.312	S	S	.	.	S	Bend	trans	-65.5	170.4	-173.3	0	0	0	0	0	115.5	A444 R453	G442-A444 PolarHBondContact O-N 2.67Å; G442-R453 VanDerWaalsContact O-CZ 3.25Å; G442-R453 PolarHBondContact O-NH2 3.2Å
443	I	73.2	Confident	82.5	Confident	119 Å²	119	54.1 Å²	54.1	61%	0.61	30%	0.301	S	S	*	.	P	Polyproline II helix	trans	-72.4	123.5	177.7	-61.2	170.3	0	0	0	109.3	V445 D526	I443-V445 PolarHBondContact O-N 2.89Å; I443-D526 HydrophobicContact CG2-CB 4.03Å
444	A	75.9	Confident	82.3	Confident	24 Å²	24	54.8 Å²	54.8	20%	0.198	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-75.2	117.1	172.1	0	0	0	0	0	110.5	G442 Q449 E450	G442-A444 PolarHBondContact O-N 2.67Å; A444-Q449 HydrophobicContact CB-CB 3.88Å; A444-E450 HydrophobicContact CB-CB 3.82Å; A444-E450 WeakPolarHBondContact CB-OE2 3.45Å
445	V	74.4	Confident	82.4	Confident	96 Å²	96	53.4 Å²	53.4	58%	0.582	30%	0.295	S	S	*	.			trans	-97.6	-20.3	179.6	-172	0	0	0	0	111.4	I443	I443-V445 PolarHBondContact O-N 2.89Å
446	T	79.6	Confident	82.8	Confident	37 Å²	37	50.6 Å²	50.6	23%	0.227	28%	0.277	C	S	.	.	S	Bend	trans	-119.5	161.9	173	71.7	0	0	0	0	112.3	E448 Q449 E450	T446-E448 VanDerWaalsContact C-N 3.29Å; T446-E448 PolarHBondContact O-N 3.35Å; T446-Q449 PolarHBondContact O-N 3.4Å; T446-Q449 WeakPolarHBondContact OG1-CG 3.41Å; T446-Q449 PolarHBondContact OG1-N 2.86Å; T446-E450 PolarHBondContact O-N 3.35Å
447	L	80.8	Confident	83.3	Confident	19 Å²	19	44 Å²	44	10%	0.099	24%	0.242	C	C	.	.	H	α-helix	trans	-66.4	-35	175.6	-168.1	67.6	0	0	0	111	Q449 E450 Y451 F576 F674 L677 L678	L447-Q449 VanDerWaalsContact C-N 3.35Å; L447-Q449 PolarHBondContact O-N 2.91Å; L447-E450 PolarHBondContact O-N 3Å; L447-Y451 HydrophobicContact CD1-CD2 4.31Å; L447-Y451 HydrophobicContact CD1-CE2 4.01Å; L447-Y451 HydrophobicContact CG-CD2 4.21Å; L447-Y451 HydrophobicContact CG-CE2 4.15Å; L447-Y451 VanDerWaalsContact O-CD2 3.3Å; L447-Y451 WeakPolarHBondContact O-CD2 3.36Å; L447-Y451 PolarHBondContact O-N 3.19Å; L447-F576 HydrophobicContact CD1-CD2 4.13Å; L447-F576 HydrophobicContact CD1-CE2 3.44Å; L447-F576 VanDerWaalsContact CD1-CE2 3.44Å; L447-F576 HydrophobicContact CD1-CZ 4.04Å; L447-F674 HydrophobicContact CD2-CB 4.37Å; L447-L677 HydrophobicContact CD2-CB 4.29Å; L447-L678 HydrophobicContact CB-CD2 3.97Å; L447-L678 HydrophobicContact CD2-CD2 3.87Å; L447-L678 HydrophobicContact CD2-CG 4.33Å; L447-L678 HydrophobicContact CG-CD2 3.68Å
448	E	86.6	Confident	83.9	Confident	27 Å²	27	42.7 Å²	42.7	13%	0.126	24%	0.236	C	C	.	.	H	α-helix	trans	-58.8	-42.5	172.9	-68.9	76	-173.5	0	0	112.2	T446 Y451 N452 L678 S679 L683	T446-E448 VanDerWaalsContact C-N 3.29Å; T446-E448 PolarHBondContact O-N 3.35Å; E448-Y451 PolarHBondContact O-N 3.39Å; E448-N452 WeakPolarHBondContact O-CB 3.45Å; E448-N452 PolarHBondContact O-N 3.12Å; E448-N452 PolarHBondContact O-ND2 3.11Å; E448-L678 HydrophobicContact CB-CD2 4.48Å; E448-L678 HydrophobicContact CG-CD2 4.01Å; E448-S679 PolarHBondContact OE1-N 3.49Å; E448-L683 HydrophobicContact CB-CD2 4.25Å; E448-L683 HydrophobicContact CG-CD2 4.32Å
449	Q	85.4	Confident	84.7	Confident	76 Å²	76	40.3 Å²	40.3	36%	0.355	22%	0.22	S	C	.	.	H	α-helix	trans	-64.5	-46	176.8	-74.4	172.2	-36.5	0	0	111.7	A444 T446 L447 Y451 N452 R453	A444-Q449 HydrophobicContact CB-CB 3.88Å; T446-Q449 PolarHBondContact O-N 3.4Å; T446-Q449 WeakPolarHBondContact OG1-CG 3.41Å; T446-Q449 PolarHBondContact OG1-N 2.86Å; L447-Q449 VanDerWaalsContact C-N 3.35Å; L447-Q449 PolarHBondContact O-N 2.91Å; Q449-Y451 PolarHBondContact O-N 2.9Å; Q449-N452 PolarHBondContact O-N 3.42Å; Q449-N452 VanDerWaalsContact O-N 3.17Å; Q449-R453 WeakPolarHBondContact O-CB 3.49Å; Q449-R453 PolarHBondContact O-N 3.01Å
450	E	83.6	Confident	85.2	Confident	7 Å²	7	39.6 Å²	39.6	3%	0.033	22%	0.216	C	C	.	.	H	α-helix	trans	-64.7	-28.9	178.4	-174	72.9	165.5	0	0	112.3	A444 T446 L447 R453 M454 L525	A444-E450 HydrophobicContact CB-CB 3.82Å; A444-E450 WeakPolarHBondContact CB-OE2 3.45Å; T446-E450 PolarHBondContact O-N 3.35Å; L447-E450 PolarHBondContact O-N 3Å; E450-R453 WeakPolarHBondContact OE2-CD 3.39Å; E450-R453 IonicContact OE2-NH1 2.86Å; E450-R453 PolarHBondContact OE2-NH1 2.73Å; E450-M454 HydrophobicContact CG-CE 4.5Å; E450-M454 WeakPolarHBondContact O-CE 3.41Å; E450-L525 HydrophobicContact CG-CD2 3.73Å; E450-L525 WeakPolarHBondContact OE1-CD2 3.45Å; E450-L525 VanDerWaalsContact OE1-CG 3.3Å; E450-L525 WeakPolarHBondContact OE1-CG 3.28Å; E450-L525 PolarHBondContact OE1-N 3.39Å
451	Y	89.7	Confident	86.1	Confident	6 Å²	6	35.7 Å²	35.7	2%	0.024	20%	0.198	C	C	.	.	H	α-helix	trans	-74.9	-42.7	171.6	-87.8	-111.9	0	0	0	112.1	L447 E448 Q449 R453 M454 Y488 M671 A675 L678 M687	L447-Y451 HydrophobicContact CD1-CD2 4.31Å; L447-Y451 HydrophobicContact CD1-CE2 4.01Å; L447-Y451 HydrophobicContact CG-CD2 4.21Å; L447-Y451 HydrophobicContact CG-CE2 4.15Å; L447-Y451 VanDerWaalsContact O-CD2 3.3Å; L447-Y451 WeakPolarHBondContact O-CD2 3.36Å; L447-Y451 PolarHBondContact O-N 3.19Å; E448-Y451 PolarHBondContact O-N 3.39Å; Q449-Y451 PolarHBondContact O-N 2.9Å; Y451-R453 VanDerWaalsContact C-N 3.28Å; Y451-R453 PolarHBondContact O-N 3.45Å; Y451-M454 WeakPolarHBondContact O-CB 3.46Å; Y451-M454 PolarHBondContact O-N 2.96Å; Y451-Y488 HydrophobicContact CE1-CE1 4.16Å; Y451-M671 PolarHBondContact OH-O 3.39Å; Y451-A675 HydrophobicContact CE1-CB 4.03Å; Y451-L678 HydrophobicContact CD1-CD1 3.5Å; Y451-L678 HydrophobicContact CD2-CD1 4.13Å; Y451-L678 HydrophobicContact CD2-CD2 4.22Å; Y451-L678 HydrophobicContact CE1-CD1 3.8Å; Y451-L678 HydrophobicContact CE2-CD1 4.38Å; Y451-L678 HydrophobicContact CG-CD1 3.69Å; Y451-L678 HydrophobicContact CG-CD2 4.31Å; Y451-M687 HydrophobicContact CD1-CE 3.64Å; Y451-M687 HydrophobicContact CG-CE 4.28Å; Y451-M687 WeakPolarHBondContact O-CE 3.39Å; Y451-M687 WeakPolarHBondContact O-CG 3.5Å
452	N	90.1	Very high	87.1	Confident	23 Å²	23	34 Å²	34	12%	0.123	19%	0.185	C	C	.	.	H	α-helix	trans	-61.4	-36.2	176.1	-70	-17.2	0	0	0	112.1	E448 Q449 M454 D455 G682 L683 S684	E448-N452 WeakPolarHBondContact O-CB 3.45Å; E448-N452 PolarHBondContact O-N 3.12Å; E448-N452 PolarHBondContact O-ND2 3.11Å; Q449-N452 PolarHBondContact O-N 3.42Å; Q449-N452 VanDerWaalsContact O-N 3.17Å; N452-M454 PolarHBondContact O-N 3.44Å; N452-D455 WeakPolarHBondContact O-CB 3.14Å; N452-D455 PolarHBondContact O-N 3.33Å; N452-G682 PolarHBondContact ND2-O 2.94Å; N452-L683 VanDerWaalsContact OD1-CA 3.3Å; N452-L683 WeakPolarHBondContact OD1-CA 3.15Å; N452-S684 PolarHBondContact OD1-N 3.32Å
453	R	87.1	Confident	88.3	Confident	19 Å²	19	36.8 Å²	36.8	7%	0.072	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-24.3	171.6	-162.2	173.9	-153.9	-168.3	4.8	114.4	E440 T441 G442 Q449 E450 Y451 S523	E440-R453 HydrophobicContact CB-CB 4.32Å; E440-R453 HydrophobicContact CB-CG 4.12Å; E440-R453 WeakPolarHBondContact O-CG 3.13Å; E440-R453 PolarHBondContact O-NE 3.37Å; T441-R453 PolarHBondContact O-NH2 2.88Å; G442-R453 VanDerWaalsContact O-CZ 3.25Å; G442-R453 PolarHBondContact O-NH2 3.2Å; Q449-R453 WeakPolarHBondContact O-CB 3.49Å; Q449-R453 PolarHBondContact O-N 3.01Å; E450-R453 WeakPolarHBondContact OE2-CD 3.39Å; E450-R453 IonicContact OE2-NH1 2.86Å; E450-R453 PolarHBondContact OE2-NH1 2.73Å; Y451-R453 VanDerWaalsContact C-N 3.28Å; Y451-R453 PolarHBondContact O-N 3.45Å; R453-S523 PolarHBondContact NH1-O 3.17Å
454	M	90.1	Very high	89.4	Confident	15 Å²	15	31.3 Å²	31.3	7%	0.074	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-16	176	-52.4	-173.2	-166.7	0	0	113.4	E450 Y451 N452 A456 C457 I458 I491 M671 M687	E450-M454 HydrophobicContact CG-CE 4.5Å; E450-M454 WeakPolarHBondContact O-CE 3.41Å; Y451-M454 WeakPolarHBondContact O-CB 3.46Å; Y451-M454 PolarHBondContact O-N 2.96Å; N452-M454 PolarHBondContact O-N 3.44Å; M454-A456 PolarHBondContact O-N 3.48Å; M454-C457 PolarHBondContact O-N 3.17Å; M454-I458 HydrophobicContact CB-CD1 3.87Å; M454-I458 HydrophobicContact CB-CG1 4.48Å; M454-I458 WeakPolarHBondContact O-CB 3.14Å; M454-I458 VanDerWaalsContact O-CG1 3.27Å; M454-I458 WeakPolarHBondContact O-CG1 3.21Å; M454-I458 PolarHBondContact O-N 2.87Å; M454-I491 HydrophobicContact CB-CG1 4.39Å; M454-I491 HydrophobicContact CG-CG1 4.46Å; M454-I491 HydrophobicContact SD-CG1 4.33Å; M454-M671 HydrophobicContact CE-CE 3.86Å; M454-M671 HydrophobicContact SD-CE 3.74Å; M454-M687 HydrophobicContact CB-CE 4.48Å; M454-M687 HydrophobicContact CB-SD 4.4Å
455	D	92.7	Very high	90.5	Very high	20 Å²	20	30.2 Å²	30.2	11%	0.107	14%	0.144	C	C	.	.	H	α-helix	trans	-55.8	-53.5	-173.1	-178.7	116.7	0	0	0	112.4	N452 C457 I458 R459 S684 L686 M687	N452-D455 WeakPolarHBondContact O-CB 3.14Å; N452-D455 PolarHBondContact O-N 3.33Å; D455-C457 VanDerWaalsContact C-N 3.34Å; D455-C457 PolarHBondContact O-N 2.86Å; D455-I458 PolarHBondContact O-N 3.43Å; D455-I458 VanDerWaalsContact O-N 3.09Å; D455-R459 VanDerWaalsContact CG-NH2 3.31Å; D455-R459 WeakPolarHBondContact O-CG 3.33Å; D455-R459 PolarHBondContact O-N 3.44Å; D455-R459 IonicContact OD1-CZ 2.68Å; D455-R459 IonicContact OD1-NE 2.73Å; D455-R459 IonicContact OD1-NH2 3.43Å; D455-R459 PolarHBondContact OD1-NH2 2.95Å; D455-R459 IonicContact OD2-CZ 3.19Å; D455-R459 VanDerWaalsContact OD2-CZ 3.23Å; D455-R459 IonicContact OD2-NE 2.8Å; D455-R459 PolarHBondContact OD2-NE 3.41Å; D455-R459 IonicContact OD2-NH2 3.96Å; D455-R459 PolarHBondContact OD2-NH2 2.84Å; D455-S684 VanDerWaalsContact OD1-CB 3.3Å; D455-S684 WeakPolarHBondContact OD1-CB 3.29Å; D455-S684 PolarHBondContact OD1-OG 3.19Å; D455-L686 WeakPolarHBondContact OD1-CB 3.29Å; D455-M687 HydrophobicContact CB-CG 4.31Å
456	A	92.9	Very high	91.5	Very high	6 Å²	6	31.9 Å²	31.9	5%	0.05	14%	0.143	C	C	.	.	H	α-helix	trans	-59	-43.9	-179.8	0	0	0	0	0	112.2	F433 L439 M454 R459 R460	F433-A456 HydrophobicContact CE1-CB 4.07Å; L439-A456 HydrophobicContact CB-CB 4.37Å; L439-A456 HydrophobicContact CD1-CB 4.28Å; M454-A456 PolarHBondContact O-N 3.48Å; A456-R459 PolarHBondContact O-N 3.32Å; A456-R460 PolarHBondContact O-N 3.4Å
457	C	94.6	Very high	92.3	Very high	3 Å²	3	34.5 Å²	34.5	2%	0.02	15%	0.153	C	C	.	.	H	α-helix	trans	-63.9	-41.5	175.1	-65.5	0	0	0	0	111.7	M454 D455 R460 I461 I491 Y494	M454-C457 PolarHBondContact O-N 3.17Å; D455-C457 VanDerWaalsContact C-N 3.34Å; D455-C457 PolarHBondContact O-N 2.86Å; C457-R460 PolarHBondContact O-N 3.38Å; C457-I461 VanDerWaalsContact O-CG1 3.27Å; C457-I461 WeakPolarHBondContact O-CG1 3.32Å; C457-I461 PolarHBondContact O-N 3.18Å; C457-I491 HydrophobicContact CB-CD1 3.39Å; C457-Y494 HydrophobicContact CB-CD1 4Å; C457-Y494 HydrophobicContact CB-CE1 3.75Å
458	I	95.1	Very high	93.1	Very high	2 Å²	2	33.6 Å²	33.6	1%	0.01	15%	0.148	C	C	.	.	H	α-helix	trans	-64.9	-42.6	176.4	-70.7	166.9	0	0	0	111.2	M454 D455 R460 I461 I462 I487 I491 L686 M687	M454-I458 HydrophobicContact CB-CD1 3.87Å; M454-I458 HydrophobicContact CB-CG1 4.48Å; M454-I458 WeakPolarHBondContact O-CB 3.14Å; M454-I458 VanDerWaalsContact O-CG1 3.27Å; M454-I458 WeakPolarHBondContact O-CG1 3.21Å; M454-I458 PolarHBondContact O-N 2.87Å; D455-I458 PolarHBondContact O-N 3.43Å; D455-I458 VanDerWaalsContact O-N 3.09Å; I458-R460 PolarHBondContact O-N 2.8Å; I458-I461 PolarHBondContact O-N 3.42Å; I458-I462 HydrophobicContact CG2-CD1 3.81Å; I458-I462 WeakPolarHBondContact O-CB 3.49Å; I458-I462 VanDerWaalsContact O-CG1 3.26Å; I458-I462 WeakPolarHBondContact O-CG1 3.29Å; I458-I462 PolarHBondContact O-N 3.3Å; I458-I487 HydrophobicContact CB-CD1 4.5Å; I458-I487 HydrophobicContact CD1-CG1 4.1Å; I458-I487 HydrophobicContact CG1-CD1 4.05Å; I458-I487 HydrophobicContact CG1-CG1 3.99Å; I458-I487 HydrophobicContact CG2-CD1 3.98Å; I458-I487 HydrophobicContact CG2-CG1 4.16Å; I458-I491 HydrophobicContact CG1-CD1 4.4Å; I458-L686 HydrophobicContact CB-CD2 4.38Å; I458-L686 HydrophobicContact CG2-CD1 4.49Å; I458-L686 HydrophobicContact CG2-CD2 3.86Å; I458-L686 HydrophobicContact CG2-CG 4.22Å; I458-M687 HydrophobicContact CD1-CE 4.19Å; I458-M687 HydrophobicContact CD1-SD 3.48Å; I458-M687 WeakPolarHBondContact CD1-SD 3.37Å
459	R	95.8	Very high	93.5	Very high	119 Å²	119	33.7 Å²	33.7	45%	0.449	15%	0.151	S	C	.	.	H	α-helix	trans	-60.3	-34.8	172.5	-68.7	-173.2	-157.4	-88.8	-20.7	112.4	D455 A456 R463 L686	D455-R459 VanDerWaalsContact CG-NH2 3.31Å; D455-R459 WeakPolarHBondContact O-CG 3.33Å; D455-R459 PolarHBondContact O-N 3.44Å; D455-R459 IonicContact OD1-CZ 2.68Å; D455-R459 IonicContact OD1-NE 2.73Å; D455-R459 IonicContact OD1-NH2 3.43Å; D455-R459 PolarHBondContact OD1-NH2 2.95Å; D455-R459 IonicContact OD2-CZ 3.19Å; D455-R459 VanDerWaalsContact OD2-CZ 3.23Å; D455-R459 IonicContact OD2-NE 2.8Å; D455-R459 PolarHBondContact OD2-NE 3.41Å; D455-R459 IonicContact OD2-NH2 3.96Å; D455-R459 PolarHBondContact OD2-NH2 2.84Å; A456-R459 PolarHBondContact O-N 3.32Å; R459-R463 PolarHBondContact O-N 2.9Å; R459-R463 PolarHBondContact O-NE 2.86Å; R459-L686 HydrophobicContact CG-CD2 3.5Å
460	R	96	Very high	94	Very high	4 Å²	4	32.9 Å²	32.9	2%	0.015	15%	0.145	C	C	.	.	H	α-helix	trans	-74.7	-43.1	176.7	-165.9	171.8	-88.5	-156.9	-10	112.1	E431 P432 E437 A456 C457 I458 I462 R463 V464 Y494	E431-R460 PolarHBondContact O-NH1 3.19Å; P432-R460 PolarHBondContact O-NH2 2.92Å; E437-R460 VanDerWaalsContact CD-NH2 3.29Å; E437-R460 IonicContact OE1-CZ 2.68Å; E437-R460 IonicContact OE1-NE 3.26Å; E437-R460 PolarHBondContact OE1-NE 2.85Å; E437-R460 IonicContact OE1-NH2 3.58Å; E437-R460 PolarHBondContact OE1-NH2 3.4Å; E437-R460 VanDerWaalsContact OE1-NH2 3.14Å; E437-R460 IonicContact OE2-CZ 3.84Å; E437-R460 IonicContact OE2-NH2 3.69Å; E437-R460 PolarHBondContact OE2-NH2 3.05Å; A456-R460 PolarHBondContact O-N 3.4Å; C457-R460 PolarHBondContact O-N 3.38Å; I458-R460 PolarHBondContact O-N 2.8Å; R460-I462 VanDerWaalsContact C-N 3.3Å; R460-I462 PolarHBondContact O-N 3.21Å; R460-R463 WeakPolarHBondContact O-CB 3.46Å; R460-R463 PolarHBondContact O-N 2.98Å; R460-V464 HydrophobicContact CG-CG2 4.43Å; R460-V464 WeakPolarHBondContact O-CG2 3.38Å; R460-V464 PolarHBondContact O-N 3.06Å; R460-Y494 VanDerWaalsContact CD-OH 3.24Å; R460-Y494 WeakPolarHBondContact CD-OH 3.36Å; R460-Y494 HydrophobicContact CG-CE2 4.46Å
461	I	97.3	Very high	94.5	Very high	2 Å²	2	32.8 Å²	32.8	1%	0.01	15%	0.145	C	C	.	.	H	α-helix	trans	-53.5	-48.1	170.5	-68.1	162.4	0	0	0	110.4	C457 I458 R463 V464 V465 I487 L490 I491 Y494	C457-I461 VanDerWaalsContact O-CG1 3.27Å; C457-I461 WeakPolarHBondContact O-CG1 3.32Å; C457-I461 PolarHBondContact O-N 3.18Å; I458-I461 PolarHBondContact O-N 3.42Å; I461-R463 VanDerWaalsContact C-N 3.28Å; I461-R463 PolarHBondContact O-N 3.27Å; I461-V464 PolarHBondContact O-N 3.2Å; I461-V465 HydrophobicContact CG2-CG1 4.25Å; I461-V465 WeakPolarHBondContact O-CG1 3.44Å; I461-V465 WeakPolarHBondContact O-CG2 3.09Å; I461-V465 PolarHBondContact O-N 3.32Å; I461-I487 HydrophobicContact CG2-CD1 4.34Å; I461-L490 HydrophobicContact CG2-CB 4.27Å; I461-L490 HydrophobicContact CG2-CD1 4.45Å; I461-I491 HydrophobicContact CD1-CB 4.32Å; I461-I491 HydrophobicContact CD1-CD1 3.98Å; I461-Y494 HydrophobicContact CD1-CD1 4.34Å; I461-Y494 HydrophobicContact CD1-CD2 4.29Å; I461-Y494 HydrophobicContact CD1-CG 3.82Å; I461-Y494 HydrophobicContact CG1-CD1 4.42Å; I461-Y494 HydrophobicContact CG1-CD2 3.59Å; I461-Y494 HydrophobicContact CG1-CE2 4.33Å; I461-Y494 HydrophobicContact CG1-CG 3.66Å
462	I	96.6	Very high	94.6	Very high	42 Å²	42	36.1 Å²	36.1	22%	0.215	17%	0.169	C	C	.	.	H	α-helix	trans	-63.5	-29.6	179.3	-68.6	166.7	0	0	0	112.5	I458 R460 K466 L483 L686	I458-I462 HydrophobicContact CG2-CD1 3.81Å; I458-I462 WeakPolarHBondContact O-CB 3.49Å; I458-I462 VanDerWaalsContact O-CG1 3.26Å; I458-I462 WeakPolarHBondContact O-CG1 3.29Å; I458-I462 PolarHBondContact O-N 3.3Å; R460-I462 VanDerWaalsContact C-N 3.3Å; R460-I462 PolarHBondContact O-N 3.21Å; I462-K466 WeakPolarHBondContact O-CD 3.28Å; I462-K466 WeakPolarHBondContact O-CE 3.35Å; I462-K466 VanDerWaalsContact O-CG 3.31Å; I462-K466 WeakPolarHBondContact O-CG 3.36Å; I462-L483 HydrophobicContact CG1-CD1 4.23Å; I462-L483 HydrophobicContact CG1-CD2 4.03Å; I462-L686 HydrophobicContact CD1-CD1 4.44Å
463	R	96.5	Very high	94.6	Very high	106 Å²	106	40.8 Å²	40.8	40%	0.4	19%	0.19	S	C	.	.	H	α-helix	trans	-73.4	-49.5	170.3	-79.5	175.1	-74	160.2	-1.8	111.5	E437 R459 R460 I461 V465 K466 H467	E437-R463 IonicContact OE1-CZ 3.06Å; E437-R463 IonicContact OE1-NH1 2.74Å; E437-R463 PolarHBondContact OE1-NH1 3.2Å; E437-R463 IonicContact OE1-NH2 2.77Å; E437-R463 PolarHBondContact OE1-NH2 2.94Å; R459-R463 PolarHBondContact O-N 2.9Å; R459-R463 PolarHBondContact O-NE 2.86Å; R460-R463 WeakPolarHBondContact O-CB 3.46Å; R460-R463 PolarHBondContact O-N 2.98Å; I461-R463 VanDerWaalsContact C-N 3.28Å; I461-R463 PolarHBondContact O-N 3.27Å; R463-V465 PolarHBondContact O-N 2.8Å; R463-K466 PolarHBondContact O-N 3.36Å; R463-H467 PolarHBondContact O-CD2 3.32Å
464	V	97.7	Very high	94.7	Very high	4 Å²	4	40.3 Å²	40.3	2%	0.024	19%	0.189	C	C	.	.	H	α-helix	trans	-59.6	-49.2	-177.6	173.1	0	0	0	0	111.7	C425 R428 I429 R460 I461 K466 H467 M602	C425-V464 HydrophobicContact CB-CG1 3.87Å; R428-V464 HydrophobicContact CB-CG2 3.89Å; I429-V464 HydrophobicContact CD1-CG1 4.22Å; I429-V464 HydrophobicContact CG1-CG1 4.02Å; I429-V464 HydrophobicContact CG1-CG2 3.89Å; R460-V464 HydrophobicContact CG-CG2 4.43Å; R460-V464 WeakPolarHBondContact O-CG2 3.38Å; R460-V464 PolarHBondContact O-N 3.06Å; I461-V464 PolarHBondContact O-N 3.2Å; V464-K466 PolarHBondContact O-N 3.15Å; V464-K466 VanDerWaalsContact O-N 3.16Å; V464-H467 WeakPolarHBondContact O-CB 3.38Å; V464-H467 PolarHBondContact O-N 3.05Å; V464-M602 HydrophobicContact CG1-CE 3.94Å; V464-M602 HydrophobicContact CG1-SD 4.47Å
465	V	97.6	Very high	94.7	Very high	1 Å²	1	41 Å²	41	1%	0.006	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-67	-19.8	-174.7	-58.2	0	0	0	0	113.8	I461 R463 H467 L468 F471 L483 L605 L609	I461-V465 HydrophobicContact CG2-CG1 4.25Å; I461-V465 WeakPolarHBondContact O-CG1 3.44Å; I461-V465 WeakPolarHBondContact O-CG2 3.09Å; I461-V465 PolarHBondContact O-N 3.32Å; R463-V465 PolarHBondContact O-N 2.8Å; V465-H467 PolarHBondContact O-N 2.96Å; V465-L468 HydrophobicContact CB-CD1 4.16Å; V465-L468 HydrophobicContact CG1-CD1 4.24Å; V465-L468 WeakPolarHBondContact O-CB 3.24Å; V465-L468 PolarHBondContact O-N 2.87Å; V465-L468 VanDerWaalsContact O-N 3.12Å; V465-F471 HydrophobicContact CG2-CD1 4.36Å; V465-F471 HydrophobicContact CG2-CE1 4.04Å; V465-F471 HydrophobicContact CG2-CE2 4.35Å; V465-F471 HydrophobicContact CG2-CZ 4.03Å; V465-F471 WeakPolarHBondContact O-CB 3.47Å; V465-F471 WeakPolarHBondContact O-CD1 3.48Å; V465-F471 WeakPolarHBondContact O-CG 3.47Å; V465-L483 HydrophobicContact CG2-CD2 4.06Å; V465-L605 HydrophobicContact CG1-CD2 4.28Å; V465-L609 HydrophobicContact CB-CD2 3.75Å; V465-L609 HydrophobicContact CG1-CD2 3.79Å; V465-L609 HydrophobicContact CG2-CD2 4.42Å
466	K	96.8	Very high	94.7	Very high	131 Å²	131	48.3 Å²	48.3	57%	0.57	23%	0.231	S	C	*	.	G	3₁₀ helix	trans	-66.5	-16.4	172.6	-71.3	171	-176.3	-179.8	0	113.4	I462 R463 V464 F471	I462-K466 WeakPolarHBondContact O-CD 3.28Å; I462-K466 WeakPolarHBondContact O-CE 3.35Å; I462-K466 VanDerWaalsContact O-CG 3.31Å; I462-K466 WeakPolarHBondContact O-CG 3.36Å; R463-K466 PolarHBondContact O-N 3.36Å; V464-K466 PolarHBondContact O-N 3.15Å; V464-K466 VanDerWaalsContact O-N 3.16Å; K466-F471 HydrophobicContact CG-CE1 4.21Å
467	H	96.1	Very high	94.7	Very high	92 Å²	92	52.2 Å²	52.2	43%	0.426	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-92.2	-0.4	174.2	-61.9	-72.8	0	0	0	113.7	R428 R463 V464 V465	R428-H467 VanDerWaalsContact CD-CD2 3.45Å; R428-H467 WeakPolarHBondContact CD-CD2 3.42Å; R428-H467 PolarHBondContact NE-CD2 2.92Å; R428-H467 PolarHBondContact NE-NE2 2.83Å; R463-H467 PolarHBondContact O-CD2 3.32Å; V464-H467 WeakPolarHBondContact O-CB 3.38Å; V464-H467 PolarHBondContact O-N 3.05Å; V465-H467 PolarHBondContact O-N 2.96Å
468	L	97.1	Very high	94.6	Very high	1 Å²	1	52 Å²	52	1%	0.005	25%	0.254	C	S	.	.	S	Bend	trans	-79	123.2	170.7	-66.8	173.8	0	0	0	109.3	L422 V465 Y470 F471 M602 A606 L609 Y630	L422-L468 HydrophobicContact CD2-CD2 3.97Å; V465-L468 HydrophobicContact CB-CD1 4.16Å; V465-L468 HydrophobicContact CG1-CD1 4.24Å; V465-L468 WeakPolarHBondContact O-CB 3.24Å; V465-L468 PolarHBondContact O-N 2.87Å; V465-L468 VanDerWaalsContact O-N 3.12Å; L468-Y470 PolarHBondContact O-N 2.86Å; L468-F471 HydrophobicContact CB-CB 4.01Å; L468-F471 WeakPolarHBondContact O-CB 3.35Å; L468-F471 PolarHBondContact O-N 3.48Å; L468-M602 HydrophobicContact CD1-CE 4.03Å; L468-M602 HydrophobicContact CD2-CE 3.85Å; L468-M602 HydrophobicContact CG-CE 4.22Å; L468-A606 HydrophobicContact CD1-CB 4.24Å; L468-L609 HydrophobicContact CD1-CD2 3.78Å; L468-Y630 WeakPolarHBondContact CB-OH 3.4Å; L468-Y630 HydrophobicContact CD2-CE1 4.28Å
469	P	94.3	Very high	94.6	Very high	28 Å²	28	54 Å²	54	18%	0.182	26%	0.264	C	S	.	.	H	α-helix	trans	-54.8	-54.8	-171.6	17.4	-31	0	0	0	112.3	L418 F471 S472	L418-P469 HydrophobicContact CD1-CG 3.77Å; P469-F471 PolarHBondContact O-N 3.28Å; P469-S472 WeakPolarHBondContact O-CB 3.39Å; P469-S472 PolarHBondContact O-N 3.11Å; P469-S472 PolarHBondContact O-OG 3Å
470	Y	95.5	Very high	94.3	Very high	59 Å²	59	52.1 Å²	52.1	23%	0.231	26%	0.262	C	S	.	.	H	α-helix	trans	-62.1	-18.4	178.7	-55.1	-71.2	0	0	0	114.6	L418 L468 E473 V474 A626 A629 Y630	L418-Y470 HydrophobicContact CD1-CE2 4.05Å; L418-Y470 HydrophobicContact CD2-CE2 4.15Å; L468-Y470 PolarHBondContact O-N 2.86Å; Y470-E473 WeakPolarHBondContact CD1-OE2 3.35Å; Y470-E473 PolarHBondContact O-N 3.4Å; Y470-V474 WeakPolarHBondContact O-CG1 3.4Å; Y470-V474 PolarHBondContact O-N 3.36Å; Y470-A626 HydrophobicContact CG-CB 4.05Å; Y470-A629 HydrophobicContact CD2-CB 4.28Å; Y470-A629 HydrophobicContact CE1-CB 4.26Å; Y470-A629 HydrophobicContact CE2-CB 3.53Å; Y470-Y630 HydrophobicContact CD2-CD2 4.31Å; Y470-Y630 AromaticContact CD2-CE2 3.54Å; Y470-Y630 HydrophobicContact CD2-CE2 3.54Å; Y470-Y630 AromaticContact CD2-CZ 3.74Å; Y470-Y630 HydrophobicContact CE2-CE2 4.35Å; Y470-Y630 HydrophobicContact CG-CE2 4.37Å
471	F	96	Very high	94.1	Very high	5 Å²	5	53.5 Å²	53.5	2%	0.022	27%	0.272	C	S	.	.	H	α-helix	trans	-73	-33.8	174.9	-171.7	-102.1	0	0	0	110.9	V465 K466 L468 P469 E473 Q479 L483 L609 F610	V465-F471 HydrophobicContact CG2-CD1 4.36Å; V465-F471 HydrophobicContact CG2-CE1 4.04Å; V465-F471 HydrophobicContact CG2-CE2 4.35Å; V465-F471 HydrophobicContact CG2-CZ 4.03Å; V465-F471 WeakPolarHBondContact O-CB 3.47Å; V465-F471 WeakPolarHBondContact O-CD1 3.48Å; V465-F471 WeakPolarHBondContact O-CG 3.47Å; K466-F471 HydrophobicContact CG-CE1 4.21Å; L468-F471 HydrophobicContact CB-CB 4.01Å; L468-F471 WeakPolarHBondContact O-CB 3.35Å; L468-F471 PolarHBondContact O-N 3.48Å; P469-F471 PolarHBondContact O-N 3.28Å; F471-E473 VanDerWaalsContact C-N 3.29Å; F471-E473 PolarHBondContact O-N 3.15Å; F471-Q479 HydrophobicContact CD1-CG 4.08Å; F471-Q479 HydrophobicContact CD2-CG 4.3Å; F471-Q479 HydrophobicContact CE1-CB 3.99Å; F471-Q479 HydrophobicContact CE1-CG 3.75Å; F471-Q479 HydrophobicContact CE2-CB 3.96Å; F471-Q479 HydrophobicContact CE2-CG 3.99Å; F471-Q479 HydrophobicContact CG-CG 4.36Å; F471-Q479 HydrophobicContact CZ-CB 3.54Å; F471-Q479 HydrophobicContact CZ-CG 3.71Å; F471-Q479 VanDerWaalsContact O-CG 3.24Å; F471-Q479 WeakPolarHBondContact O-CG 3.34Å; F471-Q479 PolarHBondContact O-NE2 3.22Å; F471-L483 HydrophobicContact CE2-CG 4.45Å; F471-L483 HydrophobicContact CZ-CD1 3.96Å; F471-L483 HydrophobicContact CZ-CG 4.12Å; F471-L609 HydrophobicContact CD2-CD1 4.44Å; F471-L609 HydrophobicContact CD2-CD2 3.65Å; F471-L609 HydrophobicContact CD2-CG 4.25Å; F471-L609 HydrophobicContact CE2-CD1 4.13Å; F471-L609 HydrophobicContact CE2-CD2 4.13Å; F471-L609 HydrophobicContact CE2-CG 4.43Å; F471-L609 HydrophobicContact CG-CD2 4.36Å; F471-F610 HydrophobicContact CB-CZ 3.88Å; F471-F610 HydrophobicContact CD2-CE1 4.38Å; F471-F610 HydrophobicContact CD2-CZ 4.23Å
472	S	90.3	Very high	94	Very high	76 Å²	76	53.4 Å²	53.4	53%	0.531	27%	0.272	S	S	.	.	H	α-helix	trans	-65.5	-34.1	172.8	75.6	0	0	0	0	112.2	P469 Q479	P469-S472 WeakPolarHBondContact O-CB 3.39Å; P469-S472 PolarHBondContact O-N 3.11Å; P469-S472 PolarHBondContact O-OG 3Å; S472-Q479 PolarHBondContact O-NE2 3.21Å
473	E	90	Very high	93.9	Very high	122 Å²	122	52.6 Å²	52.6	57%	0.57	27%	0.268	S	S	*	.	H	α-helix	trans	-76.5	-36.1	-173.2	-65	168.6	-150.7	0	0	114.7	Y470 F471 G475	Y470-E473 WeakPolarHBondContact CD1-OE2 3.35Å; Y470-E473 PolarHBondContact O-N 3.4Å; F471-E473 VanDerWaalsContact C-N 3.29Å; F471-E473 PolarHBondContact O-N 3.15Å; E473-G475 PolarHBondContact O-N 3.4Å
474	V	89.8	Confident	93.7	Very high	8 Å²	8	52.1 Å²	52.1	5%	0.048	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-7.2	-173.1	-66.2	0	0	0	0	114.9	Y470 A478 Q479 L482 F610 P622 V623	Y470-V474 WeakPolarHBondContact O-CG1 3.4Å; Y470-V474 PolarHBondContact O-N 3.36Å; V474-A478 HydrophobicContact CB-CB 3.98Å; V474-A478 HydrophobicContact CG2-CB 4.04Å; V474-A478 VanDerWaalsContact O-CB 3.3Å; V474-A478 WeakPolarHBondContact O-CB 3.35Å; V474-Q479 HydrophobicContact CG2-CG 4Å; V474-L482 HydrophobicContact CG2-CD1 4.27Å; V474-F610 HydrophobicContact CG1-CD1 4.43Å; V474-F610 HydrophobicContact CG1-CE1 4.04Å; V474-F610 HydrophobicContact CG2-CE1 4.32Å; V474-P622 HydrophobicContact CG1-CB 4.06Å; V474-P622 HydrophobicContact CG1-CG 4.47Å; V474-V623 HydrophobicContact CB-CG2 4.08Å; V474-V623 HydrophobicContact CG1-CG2 3.77Å
475	G	90.2	Very high	93.3	Very high	29 Å²	29	54 Å²	54	30%	0.299	28%	0.277	S	S	.	.			trans	81.4	153.2	178.2	0	0	0	0	0	114.5	E473 A478 Q479	E473-G475 PolarHBondContact O-N 3.4Å; G475-A478 PolarHBondContact O-N 3.34Å; G475-A478 VanDerWaalsContact O-N 3.16Å; G475-Q479 WeakPolarHBondContact O-CG 3.26Å; G475-Q479 PolarHBondContact O-N 2.95Å
476	K	92.8	Very high	93.1	Very high	174 Å²	174	54 Å²	54	76%	0.757	28%	0.277	S	S	*	.	H	α-helix	trans	-54.6	-41.5	-171.3	-63.2	-178.2	-178.4	177.8	0	115	Q479 L480	K476-Q479 PolarHBondContact O-N 3.28Å; K476-L480 WeakPolarHBondContact O-CB 3.47Å; K476-L480 PolarHBondContact O-N 2.93Å; K476-L480 VanDerWaalsContact O-N 3.12Å
477	P	91.7	Very high	93	Very high	88 Å²	88	48 Å²	48	57%	0.571	25%	0.252	S	S	*	.	H	α-helix	trans	-64	-42.1	178.3	-23	35.3	0	0	0	112.7	S481 L619	P477-S481 PolarHBondContact O-N 3.3Å; P477-S481 VanDerWaalsContact O-N 3.09Å; P477-L619 HydrophobicContact CB-CD1 4.05Å
478	A	92.6	Very high	92.9	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-67.7	-47.2	176.3	0	0	0	0	0	111.1	V474 G475 L480 S481 L482 L619 V623	V474-A478 HydrophobicContact CB-CB 3.98Å; V474-A478 HydrophobicContact CG2-CB 4.04Å; V474-A478 VanDerWaalsContact O-CB 3.3Å; V474-A478 WeakPolarHBondContact O-CB 3.35Å; G475-A478 PolarHBondContact O-N 3.34Å; G475-A478 VanDerWaalsContact O-N 3.16Å; A478-L480 PolarHBondContact O-N 2.82Å; A478-S481 PolarHBondContact O-N 2.7Å; A478-S481 VanDerWaalsContact O-N 3.12Å; A478-L482 WeakPolarHBondContact O-CB 3.44Å; A478-L482 VanDerWaalsContact O-CG 3.26Å; A478-L482 WeakPolarHBondContact O-CG 3.32Å; A478-L482 PolarHBondContact O-N 3.05Å; A478-L619 HydrophobicContact CB-CB 4.48Å; A478-L619 HydrophobicContact CB-CD1 4.44Å; A478-L619 HydrophobicContact CB-CD2 4.42Å; A478-V623 HydrophobicContact CB-CG2 4.18Å
479	Q	94.9	Very high	92.8	Very high	44 Å²	44	43.7 Å²	43.7	21%	0.206	23%	0.232	C	C	.	.	H	α-helix	trans	-48	-46.1	175.5	-73	169.5	1.9	0	0	112.2	F471 S472 V474 G475 K476 L483	F471-Q479 HydrophobicContact CD1-CG 4.08Å; F471-Q479 HydrophobicContact CD2-CG 4.3Å; F471-Q479 HydrophobicContact CE1-CB 3.99Å; F471-Q479 HydrophobicContact CE1-CG 3.75Å; F471-Q479 HydrophobicContact CE2-CB 3.96Å; F471-Q479 HydrophobicContact CE2-CG 3.99Å; F471-Q479 HydrophobicContact CG-CG 4.36Å; F471-Q479 HydrophobicContact CZ-CB 3.54Å; F471-Q479 HydrophobicContact CZ-CG 3.71Å; F471-Q479 VanDerWaalsContact O-CG 3.24Å; F471-Q479 WeakPolarHBondContact O-CG 3.34Å; F471-Q479 PolarHBondContact O-NE2 3.22Å; S472-Q479 PolarHBondContact O-NE2 3.21Å; V474-Q479 HydrophobicContact CG2-CG 4Å; G475-Q479 WeakPolarHBondContact O-CG 3.26Å; G475-Q479 PolarHBondContact O-N 2.95Å; K476-Q479 PolarHBondContact O-N 3.28Å; Q479-L483 WeakPolarHBondContact O-CG 3.46Å; Q479-L483 PolarHBondContact O-N 3.12Å
480	L	91.5	Very high	92.9	Very high	78 Å²	78	42.4 Å²	42.4	41%	0.408	22%	0.223	S	C	.	.	H	α-helix	trans	-69.8	-43.3	-179	-171.6	58.1	0	0	0	112.4	K476 A478 R484	K476-L480 WeakPolarHBondContact O-CB 3.47Å; K476-L480 PolarHBondContact O-N 2.93Å; K476-L480 VanDerWaalsContact O-N 3.12Å; A478-L480 PolarHBondContact O-N 2.82Å; L480-R484 WeakPolarHBondContact O-CB 3.5Å; L480-R484 WeakPolarHBondContact O-CD 3.35Å; L480-R484 VanDerWaalsContact O-CG 3.24Å; L480-R484 WeakPolarHBondContact O-CG 2.92Å; L480-R484 PolarHBondContact O-N 3.05Å
481	S	91.6	Very high	92.8	Very high	34 Å²	34	40 Å²	40	24%	0.238	21%	0.214	C	C	.	.	H	α-helix	trans	-64.1	-47.7	175	-166.9	0	0	0	0	112.1	P477 A478 L483 R484 T485 D612	P477-S481 PolarHBondContact O-N 3.3Å; P477-S481 VanDerWaalsContact O-N 3.09Å; A478-S481 PolarHBondContact O-N 2.7Å; A478-S481 VanDerWaalsContact O-N 3.12Å; S481-L483 VanDerWaalsContact C-N 3.31Å; S481-L483 PolarHBondContact O-N 2.99Å; S481-R484 PolarHBondContact O-N 2.88Å; S481-R484 VanDerWaalsContact O-N 3.14Å; S481-T485 WeakPolarHBondContact O-CB 3.4Å; S481-T485 PolarHBondContact O-N 2.72Å; S481-T485 PolarHBondContact O-OG1 3.01Å; S481-T485 VanDerWaalsContact O-OG1 3.14Å; S481-D612 PolarHBondContact OG-OD2 3.08Å
482	L	94.9	Very high	92.7	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-56.8	-44.8	-179.8	-69.6	-175.3	0	0	0	111.9	V474 A478 N486 L609 F610 D612 L615 V623	V474-L482 HydrophobicContact CG2-CD1 4.27Å; A478-L482 WeakPolarHBondContact O-CB 3.44Å; A478-L482 VanDerWaalsContact O-CG 3.26Å; A478-L482 WeakPolarHBondContact O-CG 3.32Å; A478-L482 PolarHBondContact O-N 3.05Å; L482-N486 VanDerWaalsContact O-CB 3.32Å; L482-N486 WeakPolarHBondContact O-CB 3.26Å; L482-N486 PolarHBondContact O-N 2.86Å; L482-N486 VanDerWaalsContact O-N 3.12Å; L482-N486 PolarHBondContact O-ND2 2.99Å; L482-L609 HydrophobicContact CB-CD1 4.23Å; L482-L609 WeakPolarHBondContact CD2-O 3.4Å; L482-F610 HydrophobicContact CD1-CD1 3.5Å; L482-F610 HydrophobicContact CD1-CE1 3.77Å; L482-F610 HydrophobicContact CD1-CG 4.42Å; L482-D612 HydrophobicContact CD2-CB 3.6Å; L482-L615 HydrophobicContact CD2-CD1 4.04Å; L482-V623 HydrophobicContact CD1-CG1 4.46Å; L482-V623 HydrophobicContact CD1-CG2 4.1Å; L482-V623 HydrophobicContact CD2-CG1 3.79Å; L482-V623 HydrophobicContact CD2-CG2 4.28Å; L482-V623 HydrophobicContact CG-CG2 4.48Å
483	L	94.8	Very high	92.9	Very high	25 Å²	25	36.6 Å²	36.6	13%	0.131	19%	0.19	C	C	.	.	H	α-helix	trans	-60.4	-57.3	172.6	-79	170.9	0	0	0	110.9	I462 V465 F471 Q479 S481 T485 N486 I487 L490 L609	I462-L483 HydrophobicContact CG1-CD1 4.23Å; I462-L483 HydrophobicContact CG1-CD2 4.03Å; V465-L483 HydrophobicContact CG2-CD2 4.06Å; F471-L483 HydrophobicContact CE2-CG 4.45Å; F471-L483 HydrophobicContact CZ-CD1 3.96Å; F471-L483 HydrophobicContact CZ-CG 4.12Å; Q479-L483 WeakPolarHBondContact O-CG 3.46Å; Q479-L483 PolarHBondContact O-N 3.12Å; S481-L483 VanDerWaalsContact C-N 3.31Å; S481-L483 PolarHBondContact O-N 2.99Å; L483-T485 PolarHBondContact O-N 3.38Å; L483-N486 PolarHBondContact O-N 3.21Å; L483-I487 WeakPolarHBondContact O-CB 3.25Å; L483-I487 PolarHBondContact O-N 3.11Å; L483-L490 HydrophobicContact CD2-CD1 4.46Å; L483-L609 HydrophobicContact CD2-CD1 4.36Å
484	R	90.6	Very high	93.2	Very high	96 Å²	96	30.8 Å²	30.8	36%	0.362	16%	0.163	S	C	.	.	H	α-helix	trans	-58.9	-42	-175.5	-74.4	167.7	173.6	-175.8	0.1	112.8	L480 S481 E689 Q693 R694	L480-R484 WeakPolarHBondContact O-CB 3.5Å; L480-R484 WeakPolarHBondContact O-CD 3.35Å; L480-R484 VanDerWaalsContact O-CG 3.24Å; L480-R484 WeakPolarHBondContact O-CG 2.92Å; L480-R484 PolarHBondContact O-N 3.05Å; S481-R484 PolarHBondContact O-N 2.88Å; S481-R484 VanDerWaalsContact O-N 3.14Å; R484-E689 IonicContact CZ-OE1 3.01Å; R484-E689 IonicContact NE-OE1 3.35Å; R484-E689 PolarHBondContact NE-OE1 2.81Å; R484-E689 IonicContact NH2-OE1 2.81Å; R484-E689 PolarHBondContact NH2-OE1 2.84Å; R484-Q693 VanDerWaalsContact CZ-NE2 3.31Å; R484-R694 PolarHBondContact O-NH2 3.46Å
485	T	90	Very high	93.4	Very high	42 Å²	42	30.7 Å²	30.7	26%	0.258	16%	0.163	S	C	.	.	H	α-helix	trans	-67.4	-46.3	177.7	-62.8	0	0	0	0	112	S481 L483 D612 R694	S481-T485 WeakPolarHBondContact O-CB 3.4Å; S481-T485 PolarHBondContact O-N 2.72Å; S481-T485 PolarHBondContact O-OG1 3.01Å; S481-T485 VanDerWaalsContact O-OG1 3.14Å; L483-T485 PolarHBondContact O-N 3.38Å; T485-D612 VanDerWaalsContact CB-OD2 3.3Å; T485-D612 WeakPolarHBondContact CB-OD2 3.44Å; T485-D612 HydrophobicContact CG2-CB 4.33Å; T485-D612 PolarHBondContact OG1-OD2 3.31Å; T485-R694 PolarHBondContact O-NH2 3.06Å
486	N	94.6	Very high	93.6	Very high	2 Å²	2	29.7 Å²	29.7	1%	0.011	15%	0.151	C	C	.	.	H	α-helix	trans	-98.6	-4.8	-167.5	-69.5	-65.2	0	0	0	115.9	L482 L483 Y488 G489 L490 K608 L609 S611	L482-N486 VanDerWaalsContact O-CB 3.32Å; L482-N486 WeakPolarHBondContact O-CB 3.26Å; L482-N486 PolarHBondContact O-N 2.86Å; L482-N486 VanDerWaalsContact O-N 3.12Å; L482-N486 PolarHBondContact O-ND2 2.99Å; L483-N486 PolarHBondContact O-N 3.21Å; N486-Y488 VanDerWaalsContact C-N 3.31Å; N486-Y488 PolarHBondContact O-N 3.37Å; N486-Y488 VanDerWaalsContact O-N 3.12Å; N486-G489 WeakPolarHBondContact O-CA 3.31Å; N486-G489 PolarHBondContact O-N 3.38Å; N486-L490 HydrophobicContact CB-CD1 4.16Å; N486-L490 HydrophobicContact CB-CG 4.2Å; N486-L490 WeakPolarHBondContact O-CG 3.28Å; N486-L490 PolarHBondContact O-N 3.08Å; N486-K608 VanDerWaalsContact CG-O 3.31Å; N486-K608 PolarHBondContact ND2-O 3.23Å; N486-K608 WeakPolarHBondContact OD1-CE 3.26Å; N486-K608 PolarHBondContact OD1-NZ 3.02Å; N486-K608 PolarHBondContact OD1-O 3.24Å; N486-L609 PolarHBondContact ND2-O 3.44Å; N486-S611 PolarHBondContact ND2-O 3.26Å; N486-S611 PolarHBondContact OD1-O 3.32Å; N486-S611 VanDerWaalsContact OD1-O 3.1Å
487	I	94.7	Very high	93.7	Very high	6 Å²	6	21.8 Å²	21.8	3%	0.031	12%	0.117	C	C	.	.	H	α-helix	trans	-54.1	-39.1	-168.6	-164.8	60.3	0	0	0	115.1	I458 I461 L483 G489 L490 I491 V690	I458-I487 HydrophobicContact CB-CD1 4.5Å; I458-I487 HydrophobicContact CD1-CG1 4.1Å; I458-I487 HydrophobicContact CG1-CD1 4.05Å; I458-I487 HydrophobicContact CG1-CG1 3.99Å; I458-I487 HydrophobicContact CG2-CD1 3.98Å; I458-I487 HydrophobicContact CG2-CG1 4.16Å; I461-I487 HydrophobicContact CG2-CD1 4.34Å; L483-I487 WeakPolarHBondContact O-CB 3.25Å; L483-I487 PolarHBondContact O-N 3.11Å; I487-G489 VanDerWaalsContact C-N 3.29Å; I487-G489 PolarHBondContact O-N 3.02Å; I487-L490 HydrophobicContact CD1-CB 4.38Å; I487-L490 HydrophobicContact CD1-CD1 4.49Å; I487-L490 PolarHBondContact O-N 3.21Å; I487-L490 VanDerWaalsContact O-N 3.14Å; I487-I491 WeakPolarHBondContact O-CG2 3.25Å; I487-I491 PolarHBondContact O-N 3.16Å; I487-V690 HydrophobicContact CG2-CG1 3.74Å
488	Y	93.4	Very high	93.8	Very high	2 Å²	2	17.9 Å²	17.9	1%	0.008	9%	0.091	C	C	.	.	H	α-helix	trans	-66.5	-26	176.4	-64.6	-35.1	0	0	0	114.1	Y451 N486 I491 V492 M671 T672 A675 V690 C691	Y451-Y488 HydrophobicContact CE1-CE1 4.16Å; N486-Y488 VanDerWaalsContact C-N 3.31Å; N486-Y488 PolarHBondContact O-N 3.37Å; N486-Y488 VanDerWaalsContact O-N 3.12Å; Y488-I491 WeakPolarHBondContact O-CG2 3.31Å; Y488-V492 WeakPolarHBondContact O-CG2 3.49Å; Y488-M671 HydrophobicContact CD1-CB 4.26Å; Y488-M671 HydrophobicContact CD1-CE 3.74Å; Y488-M671 HydrophobicContact CD1-SD 4.26Å; Y488-M671 HydrophobicContact CD2-CB 3.9Å; Y488-M671 HydrophobicContact CE1-CE 4.41Å; Y488-M671 HydrophobicContact CE2-CB 4.37Å; Y488-M671 HydrophobicContact CG-CB 3.86Å; Y488-M671 HydrophobicContact CG-CE 4.26Å; Y488-M671 HydrophobicContact CG-SD 4.18Å; Y488-T672 WeakPolarHBondContact CD2-OG1 3.44Å; Y488-A675 WeakPolarHBondContact OH-CB 3.49Å; Y488-V690 HydrophobicContact CE1-CG1 3.97Å; Y488-C691 PolarHBondContact OH-SG 2.88Å
489	G	94	Very high	93.8	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-82.8	-32.9	170.3	0	0	0	0	0	112.2	N486 I487 L493	N486-G489 WeakPolarHBondContact O-CA 3.31Å; N486-G489 PolarHBondContact O-N 3.38Å; I487-G489 VanDerWaalsContact C-N 3.29Å; I487-G489 PolarHBondContact O-N 3.02Å; G489-L493 WeakPolarHBondContact O-CG 3.39Å; G489-L493 PolarHBondContact O-N 3.3Å
490	L	96.4	Very high	93.5	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-69.6	-38.1	177.2	-63.8	172.6	0	0	0	112.2	I461 L483 N486 I487 L493 Y494 L605 K608 L609	I461-L490 HydrophobicContact CG2-CB 4.27Å; I461-L490 HydrophobicContact CG2-CD1 4.45Å; L483-L490 HydrophobicContact CD2-CD1 4.46Å; N486-L490 HydrophobicContact CB-CD1 4.16Å; N486-L490 HydrophobicContact CB-CG 4.2Å; N486-L490 WeakPolarHBondContact O-CG 3.28Å; N486-L490 PolarHBondContact O-N 3.08Å; I487-L490 HydrophobicContact CD1-CB 4.38Å; I487-L490 HydrophobicContact CD1-CD1 4.49Å; I487-L490 PolarHBondContact O-N 3.21Å; I487-L490 VanDerWaalsContact O-N 3.14Å; L490-L493 PolarHBondContact O-N 3.02Å; L490-Y494 WeakPolarHBondContact O-CB 3.43Å; L490-Y494 PolarHBondContact O-N 3.07Å; L490-L605 HydrophobicContact CD2-CD2 3.87Å; L490-L605 HydrophobicContact CD2-CG 4Å; L490-K608 HydrophobicContact CD2-CB 4.19Å; L490-K608 HydrophobicContact CD2-CG 4Å; L490-K608 HydrophobicContact CG-CG 4.47Å; L490-L609 HydrophobicContact CD1-CD1 3.77Å; L490-L609 HydrophobicContact CD2-CB 4.09Å
491	I	94.3	Very high	93.2	Very high	8 Å²	8	21 Å²	21	4%	0.041	10%	0.099	C	C	.	.	H	α-helix	trans	-66.1	-40.7	176.1	-172.2	59.9	0	0	0	111.6	M454 C457 I458 I461 I487 Y488 Y494 S495 M671	M454-I491 HydrophobicContact CB-CG1 4.39Å; M454-I491 HydrophobicContact CG-CG1 4.46Å; M454-I491 HydrophobicContact SD-CG1 4.33Å; C457-I491 HydrophobicContact CB-CD1 3.39Å; I458-I491 HydrophobicContact CG1-CD1 4.4Å; I461-I491 HydrophobicContact CD1-CB 4.32Å; I461-I491 HydrophobicContact CD1-CD1 3.98Å; I487-I491 WeakPolarHBondContact O-CG2 3.25Å; I487-I491 PolarHBondContact O-N 3.16Å; Y488-I491 WeakPolarHBondContact O-CG2 3.31Å; I491-Y494 HydrophobicContact CD1-CD1 4.35Å; I491-Y494 PolarHBondContact O-N 3.41Å; I491-S495 WeakPolarHBondContact O-CB 3.41Å; I491-S495 PolarHBondContact O-N 3.28Å; I491-S495 PolarHBondContact O-OG 2.87Å; I491-S495 VanDerWaalsContact O-OG 3.07Å; I491-M671 HydrophobicContact CG2-CE 4.09Å
492	V	93.2	Very high	93	Very high	5 Å²	5	27.5 Å²	27.5	3%	0.03	13%	0.131	C	C	.	.	H	α-helix	trans	-63.9	-46.4	173.6	174.3	0	0	0	0	110.7	Y488 Y494 S495 S496 F587 L664 L667 M671	Y488-V492 WeakPolarHBondContact O-CG2 3.49Å; V492-Y494 VanDerWaalsContact C-N 3.34Å; V492-Y494 PolarHBondContact O-N 3.45Å; V492-S495 PolarHBondContact O-N 2.96Å; V492-S496 PolarHBondContact O-N 2.71Å; V492-F587 HydrophobicContact CG1-CE1 4.09Å; V492-F587 HydrophobicContact CG1-CZ 4.47Å; V492-F587 WeakPolarHBondContact O-CE1 3.39Å; V492-L664 HydrophobicContact CB-CD1 3.77Å; V492-L664 HydrophobicContact CG1-CD1 3.64Å; V492-L667 HydrophobicContact CG1-CD1 4.38Å; V492-M671 HydrophobicContact CG2-SD 4.31Å
493	L	95.6	Very high	92.6	Very high	5 Å²	5	31.3 Å²	31.3	3%	0.026	15%	0.151	C	C	.	.	H	α-helix	trans	-65.4	-35.4	177.6	-69.8	174.8	0	0	0	112.9	G489 L490 S496 F497 L590 V604 L605 K608 L664	G489-L493 WeakPolarHBondContact O-CG 3.39Å; G489-L493 PolarHBondContact O-N 3.3Å; L490-L493 PolarHBondContact O-N 3.02Å; L493-S496 WeakPolarHBondContact O-CB 3.26Å; L493-S496 PolarHBondContact O-N 3.48Å; L493-S496 PolarHBondContact O-OG 2.88Å; L493-F497 WeakPolarHBondContact O-CD2 3.31Å; L493-L590 HydrophobicContact CD2-CD1 3.97Å; L493-L590 HydrophobicContact CD2-CD2 4.09Å; L493-V604 HydrophobicContact CD1-CG1 4.05Å; L493-V604 HydrophobicContact CD2-CG1 3.81Å; L493-L605 HydrophobicContact CB-CB 4.32Å; L493-L605 HydrophobicContact CB-CD1 4.26Å; L493-L605 HydrophobicContact CB-CG 4.27Å; L493-L605 HydrophobicContact CD1-CB 4.47Å; L493-K608 HydrophobicContact CD1-CB 3.55Å; L493-K608 HydrophobicContact CD1-CG 3.9Å; L493-L664 HydrophobicContact CD1-CD2 3.67Å; L493-L664 HydrophobicContact CD2-CD2 4.21Å; L493-L664 HydrophobicContact CG-CD1 4.39Å; L493-L664 HydrophobicContact CG-CD2 3.84Å
494	Y	96.6	Very high	92.1	Very high	1 Å²	1	36.3 Å²	36.3	0%	0.004	17%	0.167	C	C	.	.	H	α-helix	trans	-66.1	-48.8	173.5	174.6	-88.8	0	0	0	111.9	I429 F433 C457 R460 I461 L490 I491 V492 S496 F497 F498 Y508	I429-Y494 HydrophobicContact CB-CE2 4.36Å; I429-Y494 HydrophobicContact CD1-CD2 4.47Å; I429-Y494 HydrophobicContact CG1-CD2 4.25Å; I429-Y494 HydrophobicContact CG1-CE2 4.08Å; I429-Y494 HydrophobicContact CG2-CD2 4.24Å; I429-Y494 HydrophobicContact CG2-CE2 3.85Å; F433-Y494 WeakPolarHBondContact CZ-OH 3.28Å; C457-Y494 HydrophobicContact CB-CD1 4Å; C457-Y494 HydrophobicContact CB-CE1 3.75Å; R460-Y494 VanDerWaalsContact CD-OH 3.24Å; R460-Y494 WeakPolarHBondContact CD-OH 3.36Å; R460-Y494 HydrophobicContact CG-CE2 4.46Å; I461-Y494 HydrophobicContact CD1-CD1 4.34Å; I461-Y494 HydrophobicContact CD1-CD2 4.29Å; I461-Y494 HydrophobicContact CD1-CG 3.82Å; I461-Y494 HydrophobicContact CG1-CD1 4.42Å; I461-Y494 HydrophobicContact CG1-CD2 3.59Å; I461-Y494 HydrophobicContact CG1-CE2 4.33Å; I461-Y494 HydrophobicContact CG1-CG 3.66Å; L490-Y494 WeakPolarHBondContact O-CB 3.43Å; L490-Y494 PolarHBondContact O-N 3.07Å; I491-Y494 HydrophobicContact CD1-CD1 4.35Å; I491-Y494 PolarHBondContact O-N 3.41Å; V492-Y494 VanDerWaalsContact C-N 3.34Å; V492-Y494 PolarHBondContact O-N 3.45Å; Y494-S496 PolarHBondContact O-N 2.83Å; Y494-F497 WeakPolarHBondContact O-CB 3.25Å; Y494-F497 WeakPolarHBondContact O-CD2 3.36Å; Y494-F497 PolarHBondContact O-N 2.91Å; Y494-F497 VanDerWaalsContact O-N 3.13Å; Y494-F498 HydrophobicContact CD1-CE2 4.33Å; Y494-F498 HydrophobicContact CE1-CD2 4.28Å; Y494-F498 AromaticContact CE1-CE2 3.7Å; Y494-F498 HydrophobicContact CE1-CE2 3.7Å; Y494-F498 HydrophobicContact CE2-CE2 4.19Å; Y494-F498 AromaticContact CZ-CE2 3.6Å; Y494-Y508 HydrophobicContact CE1-CE1 4.09Å
495	S	93.4	Very high	91.9	Very high	6 Å²	6	35.5 Å²	35.5	4%	0.042	17%	0.167	C	C	.	.	H	α-helix	trans	-59	-30.2	175.7	-67.6	0	0	0	0	112.2	I491 V492 F497 F498 F499 L506 Y508	I491-S495 WeakPolarHBondContact O-CB 3.41Å; I491-S495 PolarHBondContact O-N 3.28Å; I491-S495 PolarHBondContact O-OG 2.87Å; I491-S495 VanDerWaalsContact O-OG 3.07Å; V492-S495 PolarHBondContact O-N 2.96Å; S495-F497 PolarHBondContact O-N 3.35Å; S495-F497 VanDerWaalsContact O-N 3.1Å; S495-F498 PolarHBondContact O-N 3.25Å; S495-F499 PolarHBondContact O-N 3.1Å; S495-L506 WeakPolarHBondContact O-CD2 3.24Å; S495-Y508 PolarHBondContact OG-OH 3.03Å
496	S	93.4	Very high	91.9	Very high	8 Å²	8	33.5 Å²	33.5	6%	0.056	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-14.6	178.4	84.1	0	0	0	0	114.8	V492 L493 Y494 F498 R601	V492-S496 PolarHBondContact O-N 2.71Å; L493-S496 WeakPolarHBondContact O-CB 3.26Å; L493-S496 PolarHBondContact O-N 3.48Å; L493-S496 PolarHBondContact O-OG 2.88Å; Y494-S496 PolarHBondContact O-N 2.83Å; S496-F498 VanDerWaalsContact C-N 3.34Å; S496-R601 PolarHBondContact O-NE 2.55Å; S496-R601 PolarHBondContact O-NH2 3.47Å
497	F	95.4	Very high	91.7	Very high	7 Å²	7	37.2 Å²	37.2	3%	0.031	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-31.7	169.2	-73	-103.7	0	0	0	111.8	V426 I429 R430 L493 Y494 S495 D598 R601 M602 L605	V426-F497 HydrophobicContact CG2-CE1 4.26Å; I429-F497 HydrophobicContact CD1-CD2 4.37Å; I429-F497 HydrophobicContact CD1-CE1 4.01Å; I429-F497 HydrophobicContact CD1-CE2 3.79Å; I429-F497 HydrophobicContact CD1-CZ 3.57Å; I429-F497 HydrophobicContact CG2-CB 4.08Å; I429-F497 HydrophobicContact CG2-CD1 3.92Å; I429-F497 HydrophobicContact CG2-CD2 4.22Å; I429-F497 HydrophobicContact CG2-CE1 4.37Å; I429-F497 HydrophobicContact CG2-CG 3.83Å; R430-F497 PolarHBondContact NH1-O 3.46Å; R430-F497 PolarHBondContact NH2-O 3.07Å; L493-F497 WeakPolarHBondContact O-CD2 3.31Å; Y494-F497 WeakPolarHBondContact O-CB 3.25Å; Y494-F497 WeakPolarHBondContact O-CD2 3.36Å; Y494-F497 PolarHBondContact O-N 2.91Å; Y494-F497 VanDerWaalsContact O-N 3.13Å; S495-F497 PolarHBondContact O-N 3.35Å; S495-F497 VanDerWaalsContact O-N 3.1Å; F497-D598 HydrophobicContact CD1-CB 4.16Å; F497-D598 HydrophobicContact CE1-CB 3.85Å; F497-R601 HydrophobicContact CD1-CB 4.33Å; F497-R601 HydrophobicContact CD2-CB 4.3Å; F497-R601 HydrophobicContact CE1-CB 3.72Å; F497-R601 HydrophobicContact CE1-CG 4.45Å; F497-R601 HydrophobicContact CE2-CB 3.7Å; F497-R601 HydrophobicContact CE2-CG 4.48Å; F497-R601 HydrophobicContact CZ-CB 3.38Å; F497-R601 HydrophobicContact CZ-CG 4.4Å; F497-M602 HydrophobicContact CZ-CB 4.15Å; F497-M602 HydrophobicContact CZ-SD 4.38Å; F497-L605 HydrophobicContact CE2-CD1 4.18Å
498	F	94.1	Very high	91.6	Very high	6 Å²	6	37.3 Å²	37.3	3%	0.026	17%	0.168	C	C	.	.	S	Bend	trans	-103.8	2.9	-172.4	-55.8	-84.5	0	0	0	113.4	I429 Y494 S495 S496 E500 L506 R507 Y508 P509	I429-F498 HydrophobicContact CG2-CE2 3.82Å; I429-F498 HydrophobicContact CG2-CZ 3.83Å; I429-F498 WeakPolarHBondContact O-CZ 3.48Å; Y494-F498 HydrophobicContact CD1-CE2 4.33Å; Y494-F498 HydrophobicContact CE1-CD2 4.28Å; Y494-F498 AromaticContact CE1-CE2 3.7Å; Y494-F498 HydrophobicContact CE1-CE2 3.7Å; Y494-F498 HydrophobicContact CE2-CE2 4.19Å; Y494-F498 AromaticContact CZ-CE2 3.6Å; S495-F498 PolarHBondContact O-N 3.25Å; S496-F498 VanDerWaalsContact C-N 3.34Å; F498-E500 PolarHBondContact O-N 2.89Å; F498-L506 CarbonylContact O-C 3.58Å; F498-L506 VanDerWaalsContact O-CA 3.31Å; F498-L506 WeakPolarHBondContact O-CA 3.42Å; F498-R507 PolarHBondContact O-N 2.91Å; F498-Y508 HydrophobicContact CB-CD1 4.01Å; F498-Y508 HydrophobicContact CB-CE1 3.92Å; F498-Y508 AromaticContact CD1-CD1 3.66Å; F498-Y508 HydrophobicContact CD1-CD1 3.66Å; F498-Y508 HydrophobicContact CD1-CE1 4.15Å; F498-Y508 AromaticContact CD2-CD1 3.75Å; F498-Y508 HydrophobicContact CD2-CD1 3.75Å; F498-Y508 AromaticContact CD2-CE1 3.36Å; F498-Y508 HydrophobicContact CD2-CE1 3.36Å; F498-Y508 AromaticContact CE1-CD1 4Å; F498-Y508 HydrophobicContact CE1-CD1 4Å; F498-Y508 HydrophobicContact CE2-CD1 4.09Å; F498-Y508 AromaticContact CE2-CE1 3.83Å; F498-Y508 HydrophobicContact CE2-CE1 3.83Å; F498-Y508 AromaticContact CG-CD1 3.51Å; F498-Y508 HydrophobicContact CG-CD1 3.51Å; F498-Y508 AromaticContact CG-CE1 3.53Å; F498-Y508 HydrophobicContact CG-CE1 3.53Å; F498-Y508 HydrophobicContact CG-CG 4.47Å; F498-Y508 HydrophobicContact CZ-CD1 4.18Å; F498-Y508 HydrophobicContact CZ-CE1 4.38Å; F498-P509 HydrophobicContact CE1-CG 4.2Å
499	F	92.3	Very high	91.6	Very high	14 Å²	14	38.4 Å²	38.4	6%	0.061	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	119	178.7	-179.6	-104.1	0	0	0	111.3	S495 R501 R504 L506 V584 F587	S495-F499 PolarHBondContact O-N 3.1Å; F499-R501 HydrophobicContact CD1-CB 4.49Å; F499-R501 HydrophobicContact CE1-CB 4.01Å; F499-R501 HydrophobicContact CE1-CG 4.41Å; F499-R504 HydrophobicContact CE2-CB 4.33Å; F499-R504 HydrophobicContact CZ-CB 4.24Å; F499-R504 HydrophobicContact CZ-CG 4.41Å; F499-L506 HydrophobicContact CB-CD2 3.79Å; F499-L506 HydrophobicContact CD2-CD2 4.06Å; F499-L506 HydrophobicContact CG-CD2 4.44Å; F499-V584 HydrophobicContact CE2-CG1 4.12Å; F499-V584 HydrophobicContact CZ-CG1 4.16Å; F499-F587 HydrophobicContact CB-CB 4.4Å; F499-F587 HydrophobicContact CB-CD1 4.4Å; F499-F587 HydrophobicContact CB-CG 4.39Å; F499-F587 HydrophobicContact CD1-CB 3.72Å; F499-F587 HydrophobicContact CD2-CB 3.64Å; F499-F587 AromaticContact CD2-CD2 3.83Å; F499-F587 HydrophobicContact CD2-CD2 3.83Å; F499-F587 AromaticContact CD2-CG 3.81Å; F499-F587 HydrophobicContact CD2-CG 3.81Å; F499-F587 HydrophobicContact CE1-CB 3.73Å; F499-F587 HydrophobicContact CE2-CB 3.67Å; F499-F587 HydrophobicContact CE2-CD2 4.05Å; F499-F587 HydrophobicContact CE2-CG 4.17Å; F499-F587 HydrophobicContact CG-CB 3.66Å; F499-F587 HydrophobicContact CG-CD1 4.49Å; F499-F587 HydrophobicContact CG-CD2 4.47Å; F499-F587 HydrophobicContact CG-CG 4.02Å; F499-F587 HydrophobicContact CZ-CB 3.7Å
500	E	88.8	Confident	91.5	Very high	71 Å²	71	39.5 Å²	39.5	33%	0.332	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	108.2	171.9	-76.6	-179.3	-151.9	0	0	109.7	F498 D502 I503 R504 K505 R507	F498-E500 PolarHBondContact O-N 2.89Å; E500-D502 VanDerWaalsContact C-N 3.32Å; E500-D502 PolarHBondContact O-N 2.97Å; E500-I503 HydrophobicContact CB-CD1 3.99Å; E500-I503 HydrophobicContact CB-CG1 3.7Å; E500-I503 WeakPolarHBondContact O-CG1 3.4Å; E500-I503 PolarHBondContact O-N 3.47Å; E500-R504 WeakPolarHBondContact O-CA 3.4Å; E500-R504 PolarHBondContact O-N 2.82Å; E500-K505 PolarHBondContact N-O 3.15Å; E500-R507 WeakPolarHBondContact OE1-CD 3.36Å; E500-R507 IonicContact OE1-CZ 2.75Å; E500-R507 IonicContact OE1-NE 3.26Å; E500-R507 IonicContact OE1-NH1 2.69Å; E500-R507 PolarHBondContact OE1-NH1 3.02Å; E500-R507 WeakPolarHBondContact OE2-CD 3.43Å; E500-R507 IonicContact OE2-CZ 3.17Å; E500-R507 IonicContact OE2-NE 2.66Å; E500-R507 IonicContact OE2-NH1 3.75Å; E500-R507 PolarHBondContact OE2-NH1 3.07Å
501	R	86.3	Confident	91.4	Very high	104 Å²	104	42.4 Å²	42.4	39%	0.392	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-33.8	-172.6	-177.3	168.2	-176.6	161.9	7	114.7	F499 I503 R504 D591	F499-R501 HydrophobicContact CD1-CB 4.49Å; F499-R501 HydrophobicContact CE1-CB 4.01Å; F499-R501 HydrophobicContact CE1-CG 4.41Å; R501-I503 VanDerWaalsContact C-N 3.32Å; R501-I503 PolarHBondContact O-N 3.25Å; R501-R504 WeakPolarHBondContact O-CG 3.45Å; R501-R504 PolarHBondContact O-N 2.9Å; R501-D591 WeakPolarHBondContact CD-OD2 3.18Å; R501-D591 IonicContact CZ-OD2 3.4Å; R501-D591 IonicContact NE-OD2 3.74Å; R501-D591 IonicContact NH1-OD2 2.78Å; R501-D591 PolarHBondContact NH1-OD2 3.44Å
502	D	86.4	Confident	91.1	Very high	169 Å²	169	45.9 Å²	45.9	90%	0.904	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-31.7	-178.1	-62.4	-48.3	0	0	0	112.5	E500	E500-D502 VanDerWaalsContact C-N 3.32Å; E500-D502 PolarHBondContact O-N 2.97Å
503	I	86	Confident	90.9	Very high	81 Å²	81	52 Å²	52	42%	0.415	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	-12.1	175	61.6	171.9	0	0	0	113.3	E500 R501 K505 R507 T521	E500-I503 HydrophobicContact CB-CD1 3.99Å; E500-I503 HydrophobicContact CB-CG1 3.7Å; E500-I503 WeakPolarHBondContact O-CG1 3.4Å; E500-I503 PolarHBondContact O-N 3.47Å; R501-I503 VanDerWaalsContact C-N 3.32Å; R501-I503 PolarHBondContact O-N 3.25Å; I503-K505 VanDerWaalsContact C-N 3.25Å; I503-K505 HydrophobicContact CD1-CB 4.09Å; I503-K505 HydrophobicContact CG1-CB 4.18Å; I503-K505 PolarHBondContact O-N 3.45Å; I503-R507 HydrophobicContact CD1-CG 4.06Å; I503-T521 HydrophobicContact CD1-CG2 4.44Å
504	R	85.3	Confident	90.6	Very high	129 Å²	129	57 Å²	57	49%	0.487	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.5	36.9	-175.2	-56.7	-179.2	79.5	-139.7	7.5	113.9	F499 E500 R501 V584 D588	F499-R504 HydrophobicContact CE2-CB 4.33Å; F499-R504 HydrophobicContact CZ-CB 4.24Å; F499-R504 HydrophobicContact CZ-CG 4.41Å; E500-R504 WeakPolarHBondContact O-CA 3.4Å; E500-R504 PolarHBondContact O-N 2.82Å; R501-R504 WeakPolarHBondContact O-CG 3.45Å; R501-R504 PolarHBondContact O-N 2.9Å; R504-V584 HydrophobicContact CB-CG1 3.98Å; R504-V584 VanDerWaalsContact CZ-CG1 3.45Å; R504-D588 IonicContact CZ-OD2 3.6Å; R504-D588 VanDerWaalsContact CZ-OD2 3.27Å; R504-D588 IonicContact NE-OD1 2.85Å; R504-D588 IonicContact NE-OD2 3.98Å; R504-D588 PolarHBondContact NE-OD2 2.96Å; R504-D588 IonicContact NH2-OD2 2.83Å; R504-D588 PolarHBondContact NH2-OD2 2.7Å
505	K	86.1	Confident	90.2	Very high	80 Å²	80	59.2 Å²	59.2	35%	0.348	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	167.9	178.1	-65.3	-170.1	-178	-159.3	0	111	E500 I503 T521 S523	E500-K505 PolarHBondContact N-O 3.15Å; I503-K505 VanDerWaalsContact C-N 3.25Å; I503-K505 HydrophobicContact CD1-CB 4.09Å; I503-K505 HydrophobicContact CG1-CB 4.18Å; I503-K505 PolarHBondContact O-N 3.45Å; K505-T521 HydrophobicContact CB-CG2 3.87Å; K505-T521 HydrophobicContact CD-CG2 3.64Å; K505-T521 HydrophobicContact CG-CG2 4.39Å; K505-S523 WeakPolarHBondContact CE-OG 3.4Å; K505-S523 PolarHBondContact NZ-OG 3.33Å
506	L	89.1	Confident	90.1	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	135.7	172.7	-54.3	-178.6	0	0	0	109.5	S495 F498 F499 Y508 T521 V522 M524 F587	S495-L506 WeakPolarHBondContact O-CD2 3.24Å; F498-L506 CarbonylContact O-C 3.58Å; F498-L506 VanDerWaalsContact O-CA 3.31Å; F498-L506 WeakPolarHBondContact O-CA 3.42Å; F499-L506 HydrophobicContact CB-CD2 3.79Å; F499-L506 HydrophobicContact CD2-CD2 4.06Å; F499-L506 HydrophobicContact CG-CD2 4.44Å; L506-Y508 HydrophobicContact CB-CD2 4.42Å; L506-Y508 HydrophobicContact CB-CE2 3.88Å; L506-Y508 HydrophobicContact CD1-CE2 4.05Å; L506-Y508 WeakPolarHBondContact CD1-OH 3.37Å; L506-T521 CarbonylContact O-C 3.54Å; L506-T521 WeakPolarHBondContact O-CA 3.49Å; L506-V522 HydrophobicContact CB-CB 4.19Å; L506-V522 HydrophobicContact CD1-CG1 4.46Å; L506-V522 PolarHBondContact N-O 2.64Å; L506-V522 PolarHBondContact O-N 3.47Å; L506-M524 HydrophobicContact CD1-CG 3.62Å; L506-M524 HydrophobicContact CD1-SD 3.54Å; L506-M524 VanDerWaalsContact CD1-SD 3.54Å; L506-M524 HydrophobicContact CG-CG 3.93Å; L506-M524 HydrophobicContact CG-SD 4.49Å; L506-F587 HydrophobicContact CD2-CE2 4.27Å; L506-F587 HydrophobicContact CD2-CZ 4.21Å
507	R	91.2	Very high	90	Very high	80 Å²	80	69 Å²	69	30%	0.302	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	108.3	172.5	-82.9	-179.8	63.9	-145.7	2.8	110.6	F498 E500 I503 T519 V520 T521	F498-R507 PolarHBondContact O-N 2.91Å; E500-R507 WeakPolarHBondContact OE1-CD 3.36Å; E500-R507 IonicContact OE1-CZ 2.75Å; E500-R507 IonicContact OE1-NE 3.26Å; E500-R507 IonicContact OE1-NH1 2.69Å; E500-R507 PolarHBondContact OE1-NH1 3.02Å; E500-R507 WeakPolarHBondContact OE2-CD 3.43Å; E500-R507 IonicContact OE2-CZ 3.17Å; E500-R507 IonicContact OE2-NE 2.66Å; E500-R507 IonicContact OE2-NH1 3.75Å; E500-R507 PolarHBondContact OE2-NH1 3.07Å; I503-R507 HydrophobicContact CD1-CG 4.06Å; R507-T519 PolarHBondContact NE-OG1 3.14Å; R507-T519 PolarHBondContact NH2-OG1 2.78Å; R507-V520 WeakPolarHBondContact CA-O 3.48Å; R507-T521 HydrophobicContact CG-CG2 4.16Å; R507-T521 WeakPolarHBondContact CG-OG1 3.46Å
508	Y	92.5	Very high	89.8	Confident	8 Å²	8	70.4 Å²	70.4	3%	0.031	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	131	179.9	-67.2	-74.8	0	0	0	110.5	F433 L439 Y494 S495 F498 L506 T519 V520 V522	F433-Y508 AromaticContact CE2-CD1 3.76Å; F433-Y508 HydrophobicContact CE2-CD1 3.76Å; F433-Y508 HydrophobicContact CE2-CE1 4.36Å; F433-Y508 HydrophobicContact CE2-CG 4.33Å; L439-Y508 HydrophobicContact CD2-CD2 4.25Å; L439-Y508 HydrophobicContact CD2-CG 4.11Å; Y494-Y508 HydrophobicContact CE1-CE1 4.09Å; S495-Y508 PolarHBondContact OG-OH 3.03Å; F498-Y508 HydrophobicContact CB-CD1 4.01Å; F498-Y508 HydrophobicContact CB-CE1 3.92Å; F498-Y508 AromaticContact CD1-CD1 3.66Å; F498-Y508 HydrophobicContact CD1-CD1 3.66Å; F498-Y508 HydrophobicContact CD1-CE1 4.15Å; F498-Y508 AromaticContact CD2-CD1 3.75Å; F498-Y508 HydrophobicContact CD2-CD1 3.75Å; F498-Y508 AromaticContact CD2-CE1 3.36Å; F498-Y508 HydrophobicContact CD2-CE1 3.36Å; F498-Y508 AromaticContact CE1-CD1 4Å; F498-Y508 HydrophobicContact CE1-CD1 4Å; F498-Y508 HydrophobicContact CE2-CD1 4.09Å; F498-Y508 AromaticContact CE2-CE1 3.83Å; F498-Y508 HydrophobicContact CE2-CE1 3.83Å; F498-Y508 AromaticContact CG-CD1 3.51Å; F498-Y508 HydrophobicContact CG-CD1 3.51Å; F498-Y508 AromaticContact CG-CE1 3.53Å; F498-Y508 HydrophobicContact CG-CE1 3.53Å; F498-Y508 HydrophobicContact CG-CG 4.47Å; F498-Y508 HydrophobicContact CZ-CD1 4.18Å; F498-Y508 HydrophobicContact CZ-CE1 4.38Å; L506-Y508 HydrophobicContact CB-CD2 4.42Å; L506-Y508 HydrophobicContact CB-CE2 3.88Å; L506-Y508 HydrophobicContact CD1-CE2 4.05Å; L506-Y508 WeakPolarHBondContact CD1-OH 3.37Å; Y508-T519 CarbonylContact O-C 3.58Å; Y508-T519 WeakPolarHBondContact O-CA 3.47Å; Y508-V520 PolarHBondContact N-O 2.66Å; Y508-V520 PolarHBondContact O-N 3.4Å; Y508-V522 HydrophobicContact CD2-CB 4.04Å; Y508-V522 HydrophobicContact CD2-CG2 3.71Å; Y508-V522 HydrophobicContact CE2-CB 3.93Å; Y508-V522 HydrophobicContact CE2-CG1 4.31Å; Y508-V522 HydrophobicContact CE2-CG2 3.89Å
509	P	93.3	Very high	89.6	Confident	25 Å²	25	73.5 Å²	73.5	16%	0.162	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	129.7	168	27.6	-30.4	0	0	0	109.7	P432 F433 F498 L517 T518	P432-P509 WeakPolarHBondContact CA-O 3.45Å; P432-P509 HydrophobicContact CB-CB 4.22Å; P432-P509 HydrophobicContact CG-CB 4.39Å; F433-P509 PolarHBondContact N-O 3.25Å; F498-P509 HydrophobicContact CE1-CG 4.2Å; P509-L517 HydrophobicContact CB-CD1 4.03Å; P509-T518 WeakPolarHBondContact CA-O 3.36Å
510	V	92.6	Very high	89.3	Confident	22 Å²	22	74.2 Å²	74.2	13%	0.133	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	127.4	179.4	-175.3	0	0	0	0	109.2	F433 L439 T518 V520	F433-V510 HydrophobicContact CB-CG2 4.33Å; F433-V510 WeakPolarHBondContact O-CA 3.48Å; L439-V510 HydrophobicContact CD2-CG2 3.99Å; V510-T518 PolarHBondContact N-O 2.94Å; V510-T518 PolarHBondContact O-N 3.34Å; V510-T518 PolarHBondContact O-OG1 3.34Å; V510-V520 HydrophobicContact CB-CG2 4.14Å; V510-V520 HydrophobicContact CG2-CB 4.04Å; V510-V520 HydrophobicContact CG2-CG2 3.56Å
511	L	92.5	Very high	89.2	Confident	61 Å²	61	73.9 Å²	73.9	32%	0.319	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	120.8	173.3	-168.6	72	0	0	0	108.4	P432 F433 P435 G515	P432-L511 HydrophobicContact CB-CB 4.24Å; F433-L511 PolarHBondContact O-N 3.08Å; P435-L511 WeakPolarHBondContact CD-O 3.15Å; P435-L511 WeakPolarHBondContact CG-O 3.36Å; L511-G515 VanDerWaalsContact CD1-O 3.24Å; L511-G515 WeakPolarHBondContact CD1-O 3.33Å
512	Q	88.9	Confident	88.8	Confident	81 Å²	81	69.2 Å²	69.2	38%	0.379	37%	0.368	S	S	.	.			trans	-75.8	169.4	174	-72.3	-172.1	130.6	0	0	111.7	D514 G515 Q516 T518	Q512-D514 WeakPolarHBondContact CB-OD1 3.46Å; Q512-D514 PolarHBondContact O-N 3.03Å; Q512-G515 PolarHBondContact O-N 2.75Å; Q512-Q516 PolarHBondContact N-O 2.66Å; Q512-T518 HydrophobicContact CG-CG2 3.88Å
513	T	88.3	Confident	87.9	Confident	134 Å²	134	61.7 Å²	61.7	82%	0.822	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-17.9	-179.9	46.5	0	0	0	0	114.4	P435 G515	P435-T513 HydrophobicContact CB-CG2 3.84Å; P435-T513 HydrophobicContact CG-CG2 3.79Å; T513-G515 VanDerWaalsContact C-N 3.34Å
514	D	89.9	Confident	86.7	Confident	111 Å²	111	59.6 Å²	59.6	59%	0.594	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	-2.1	171.4	65.9	-13.4	0	0	0	113.2	Q512 Q516	Q512-D514 WeakPolarHBondContact CB-OD1 3.46Å; Q512-D514 PolarHBondContact O-N 3.03Å; D514-Q516 VanDerWaalsContact C-N 3.33Å; D514-Q516 VanDerWaalsContact OD1-CB 3.23Å; D514-Q516 WeakPolarHBondContact OD1-CB 3.27Å; D514-Q516 PolarHBondContact OD1-N 2.69Å; D514-Q516 WeakPolarHBondContact OD2-CB 3.19Å
515	G	88.3	Confident	85.3	Confident	47 Å²	47	54 Å²	54	49%	0.485	30%	0.297	S	S	.	.	S	Bend	trans	81.6	3.5	-173.3	0	0	0	0	0	114.6	L511 Q512 T513 L517	L511-G515 VanDerWaalsContact CD1-O 3.24Å; L511-G515 WeakPolarHBondContact CD1-O 3.33Å; Q512-G515 PolarHBondContact O-N 2.75Å; T513-G515 VanDerWaalsContact C-N 3.34Å; G515-L517 PolarHBondContact O-N 2.96Å
516	Q	91.6	Very high	83.8	Confident	113 Å²	113	52.4 Å²	52.4	53%	0.528	29%	0.293	S	S	.	.			trans	-72.4	124.3	175.4	-176.4	178.2	72.1	0	0	110.5	Q512 D514 T518	Q512-Q516 PolarHBondContact N-O 2.66Å; D514-Q516 VanDerWaalsContact C-N 3.33Å; D514-Q516 VanDerWaalsContact OD1-CB 3.23Å; D514-Q516 WeakPolarHBondContact OD1-CB 3.27Å; D514-Q516 PolarHBondContact OD1-N 2.69Å; D514-Q516 WeakPolarHBondContact OD2-CB 3.19Å; Q516-T518 HydrophobicContact CG-CG2 4.33Å; Q516-T518 PolarHBondContact O-N 3.26Å
517	L	92	Very high	81.8	Confident	106 Å²	106	60.2 Å²	60.2	56%	0.555	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.2	121.8	171.4	-178.9	62.4	0	0	0	110.4	P432 P509 G515	P432-L517 HydrophobicContact CB-CD1 3.8Å; P432-L517 HydrophobicContact CG-CD1 3.66Å; P509-L517 HydrophobicContact CB-CD1 4.03Å; G515-L517 PolarHBondContact O-N 2.96Å
518	T	91.4	Very high	79.5	Confident	37 Å²	37	57.5 Å²	57.5	23%	0.227	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	169.7	175.7	64.3	0	0	0	0	110.6	P509 V510 Q512 Q516	P509-T518 WeakPolarHBondContact CA-O 3.36Å; V510-T518 PolarHBondContact N-O 2.94Å; V510-T518 PolarHBondContact O-N 3.34Å; V510-T518 PolarHBondContact O-OG1 3.34Å; Q512-T518 HydrophobicContact CG-CG2 3.88Å; Q516-T518 HydrophobicContact CG-CG2 4.33Å; Q516-T518 PolarHBondContact O-N 3.26Å
519	T	89.6	Confident	76.8	Confident	71 Å²	71	60.9 Å²	60.9	44%	0.436	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	118.4	168.6	65.5	0	0	0	0	110.6	R507 Y508	R507-T519 PolarHBondContact NE-OG1 3.14Å; R507-T519 PolarHBondContact NH2-OG1 2.78Å; Y508-T519 CarbonylContact O-C 3.58Å; Y508-T519 WeakPolarHBondContact O-CA 3.47Å
520	V	86.2	Confident	74	Confident	28 Å²	28	63.9 Å²	63.9	17%	0.17	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	119.3	173.2	175.4	0	0	0	0	109.2	T441 R507 Y508 V510 V522	T441-V520 HydrophobicContact CG2-CB 4.4Å; T441-V520 HydrophobicContact CG2-CG1 3.79Å; T441-V520 HydrophobicContact CG2-CG2 3.84Å; R507-V520 WeakPolarHBondContact CA-O 3.48Å; Y508-V520 PolarHBondContact N-O 2.66Å; Y508-V520 PolarHBondContact O-N 3.4Å; V510-V520 HydrophobicContact CB-CG2 4.14Å; V510-V520 HydrophobicContact CG2-CB 4.04Å; V510-V520 HydrophobicContact CG2-CG2 3.56Å; V520-V522 HydrophobicContact CG1-CG2 4.19Å; V520-V522 PolarHBondContact O-N 2.84Å
521	T	85	Confident	71.2	Confident	65 Å²	65	68.6 Å²	68.6	40%	0.399	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	102.3	172.2	-55.7	0	0	0	0	109.8	I503 K505 L506 R507 S523	I503-T521 HydrophobicContact CD1-CG2 4.44Å; K505-T521 HydrophobicContact CB-CG2 3.87Å; K505-T521 HydrophobicContact CD-CG2 3.64Å; K505-T521 HydrophobicContact CG-CG2 4.39Å; L506-T521 CarbonylContact O-C 3.54Å; L506-T521 WeakPolarHBondContact O-CA 3.49Å; R507-T521 HydrophobicContact CG-CG2 4.16Å; R507-T521 WeakPolarHBondContact CG-OG1 3.46Å; T521-S523 PolarHBondContact O-N 2.96Å
522	V	78.5	Confident	68.4	Low	6 Å²	6	70.4 Å²	70.4	4%	0.036	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	104.7	168.3	168.1	0	0	0	0	107.9	L506 Y508 V520 M524	L506-V522 HydrophobicContact CB-CB 4.19Å; L506-V522 HydrophobicContact CD1-CG1 4.46Å; L506-V522 PolarHBondContact N-O 2.64Å; L506-V522 PolarHBondContact O-N 3.47Å; Y508-V522 HydrophobicContact CD2-CB 4.04Å; Y508-V522 HydrophobicContact CD2-CG2 3.71Å; Y508-V522 HydrophobicContact CE2-CB 3.93Å; Y508-V522 HydrophobicContact CE2-CG1 4.31Å; Y508-V522 HydrophobicContact CE2-CG2 3.89Å; V520-V522 HydrophobicContact CG1-CG2 4.19Å; V520-V522 PolarHBondContact O-N 2.84Å; V522-M524 PolarHBondContact O-N 3.03Å
523	S	67.7	Low	65.6	Low	10 Å²	10	73.7 Å²	73.7	7%	0.07	44%	0.443	C	S	.	.			trans	-57.7	122.9	150.6	-60.1	0	0	0	0	107.4	R453 K505 T521 L525 D526	R453-S523 PolarHBondContact NH1-O 3.17Å; K505-S523 WeakPolarHBondContact CE-OG 3.4Å; K505-S523 PolarHBondContact NZ-OG 3.33Å; T521-S523 PolarHBondContact O-N 2.96Å; S523-L525 PolarHBondContact O-N 3.18Å; S523-D526 WeakPolarHBondContact CB-OD1 3.14Å; S523-D526 VanDerWaalsContact CB-OD2 3.25Å; S523-D526 WeakPolarHBondContact CB-OD2 3.34Å; S523-D526 PolarHBondContact OG-OD1 3.4Å; S523-D526 PolarHBondContact OG-OD2 2.73Å
524	M	60.1	Low	62.8	Low	38 Å²	38	71.7 Å²	71.7	19%	0.187	44%	0.435	C	S	.	.	S	Bend	trans	-66.4	121.9	157.2	-73.5	-69.9	-60	0	0	106.8	L506 V522 T583 F587	L506-M524 HydrophobicContact CD1-CG 3.62Å; L506-M524 HydrophobicContact CD1-SD 3.54Å; L506-M524 VanDerWaalsContact CD1-SD 3.54Å; L506-M524 HydrophobicContact CG-CG 3.93Å; L506-M524 HydrophobicContact CG-SD 4.49Å; V522-M524 PolarHBondContact O-N 3.03Å; M524-T583 HydrophobicContact CE-CG2 4.38Å; M524-F587 HydrophobicContact CG-CE2 4.19Å
525	L	55.8	Low	60.1	Low	11 Å²	11	72.9 Å²	72.9	6%	0.058	45%	0.446	C	S	.	.	S	Bend	trans	61.3	61.9	164.1	-46.2	146.5	0	0	0	113	E450 S523 F576 Y579 K580	E450-L525 HydrophobicContact CG-CD2 3.73Å; E450-L525 WeakPolarHBondContact OE1-CD2 3.45Å; E450-L525 VanDerWaalsContact OE1-CG 3.3Å; E450-L525 WeakPolarHBondContact OE1-CG 3.28Å; E450-L525 PolarHBondContact OE1-N 3.39Å; S523-L525 PolarHBondContact O-N 3.18Å; L525-F576 HydrophobicContact CB-CZ 4.47Å; L525-F576 HydrophobicContact CD2-CE1 4.24Å; L525-F576 HydrophobicContact CD2-CE2 3.61Å; L525-F576 HydrophobicContact CD2-CZ 3.36Å; L525-Y579 HydrophobicContact CD1-CD1 4.12Å; L525-Y579 HydrophobicContact CD1-CE1 3.72Å; L525-Y579 HydrophobicContact CD2-CD1 4.46Å; L525-Y579 HydrophobicContact CD2-CE1 4.01Å; L525-K580 HydrophobicContact CB-CB 4.19Å; L525-K580 HydrophobicContact CB-CD 3.52Å; L525-K580 HydrophobicContact CB-CG 3.49Å; L525-K580 VanDerWaalsContact CB-CG 3.49Å; L525-K580 HydrophobicContact CD1-CB 3.85Å; L525-K580 HydrophobicContact CD1-CG 3.73Å; L525-K580 HydrophobicContact CG-CG 4.09Å; L525-K580 WeakPolarHBondContact O-CD 3.48Å; L525-K580 WeakPolarHBondContact O-CE 3.44Å; L525-K580 PolarHBondContact O-NZ 2.86Å
526	D	54.7	Low	57.3	Low	47 Å²	47	78.4 Å²	78.4	25%	0.251	46%	0.464	S	S	.	.			trans	-52.4	165.8	178.4	-84.8	-54.8	0	0	0	114.1	I443 S523 V528 K580	I443-D526 HydrophobicContact CG2-CB 4.03Å; S523-D526 WeakPolarHBondContact CB-OD1 3.14Å; S523-D526 VanDerWaalsContact CB-OD2 3.25Å; S523-D526 WeakPolarHBondContact CB-OD2 3.34Å; S523-D526 PolarHBondContact OG-OD1 3.4Å; S523-D526 PolarHBondContact OG-OD2 2.73Å; D526-V528 PolarHBondContact O-N 3.2Å; D526-K580 PolarHBondContact O-NZ 3.15Å
527	E	48.3	Very low	54.6	Low	163 Å²	163	79.2 Å²	79.2	76%	0.762	47%	0.472	S	S	*	.			trans	-55.3	124	-179.8	-66.4	-174.3	176.9	0	0	111.6	A529	E527-A529 PolarHBondContact O-N 2.81Å
528	V	42.6	Very low	51.7	Low	23 Å²	23	79 Å²	79	14%	0.139	48%	0.477	C	S	.	.			trans	-63.9	103.4	165.2	173.1	0	0	0	0	106.4	D526 T530 L549 R573	D526-V528 PolarHBondContact O-N 3.2Å; V528-T530 PolarHBondContact O-N 3.08Å; V528-L549 HydrophobicContact CB-CD1 4.2Å; V528-L549 HydrophobicContact CG1-CD1 3.38Å; V528-L549 HydrophobicContact CG2-CD1 3.73Å; V528-R573 PolarHBondContact O-NH2 2.82Å
529	A	36.3	Very low	49.1	Very low	80 Å²	80	84.2 Å²	84.2	66%	0.661	50%	0.504	S	S	*	.			trans	-48.7	110.1	-167.9	0	0	0	0	0	112	E527	E527-A529 PolarHBondContact O-N 2.81Å
530	T	34.3	Very low	46.3	Very low	87 Å²	87	87.8 Å²	87.8	53%	0.534	52%	0.52	S	S	.	.			trans	-65.1	128.8	158	45.3	0	0	0	0	107.1	V528 S532	V528-T530 PolarHBondContact O-N 3.08Å; T530-S532 PolarHBondContact O-N 3.23Å
531	P	33.8	Very low	43.7	Very low	121 Å²	121	92.5 Å²	92.5	79%	0.786	55%	0.549	S	S	*	.			trans	-62.2	107.9	173.7	26	-32.6	0	0	0	108.3	T533	P531-T533 PolarHBondContact O-N 3.41Å; P531-T533 VanDerWaalsContact O-N 3.15Å
532	S	34.1	Very low	41	Very low	100 Å²	100	96.7 Å²	96.7	70%	0.699	57%	0.567	S	S	*	*			trans	-68.3	108.6	176.8	41.6	0	0	0	0	108.7	T530 S534	T530-S532 PolarHBondContact O-N 3.23Å; S532-S534 PolarHBondContact O-N 3.15Å
533	T	28.7	Very low	38.7	Very low	149 Å²	149	102.3 Å²	102.3	91%	0.914	61%	0.607	S	S	*	*			trans	-63.4	99.3	177.9	44.8	0	0	0	0	110.5	P531	P531-T533 PolarHBondContact O-N 3.41Å; P531-T533 VanDerWaalsContact O-N 3.15Å
534	S	29.2	Very low	36.7	Very low	92 Å²	92	105 Å²	105	64%	0.643	64%	0.637	S	S	*	*			trans	-153	163.3	168	61.8	0	0	0	0	108.6	S532	S532-S534 PolarHBondContact O-N 3.15Å
535	V	34.6	Very low	35.3	Very low	136 Å²	136	109 Å²	109	82%	0.824	67%	0.668	S	S	*	*	S	Bend	trans	71.2	122.9	-163.1	-168.5	0	0	0	0	112.4
536	N	30	Very low	34.1	Very low	163 Å²	163	117.2 Å²	117.2	87%	0.872	70%	0.7	S	S	*	*			trans	-96.3	122.7	177.6	-41.2	-73.8	0	0	0	108.6
537	D	33.4	Very low	33.5	Very low	130 Å²	130	119.2 Å²	119.2	70%	0.695	72%	0.715	S	S	*	*			trans	-158.8	120.3	161.6	-146.5	-27.6	0	0	0	109.6
538	P	31.8	Very low	33.3	Very low	102 Å²	102	118.1 Å²	118.1	66%	0.662	71%	0.708	S	S	*	*	S	Bend	trans	-80.5	-28.9	-175.8	-14.1	30.5	0	0	0	114.4
539	D	36.6	Very low	33.4	Very low	147 Å²	147	119.8 Å²	119.8	79%	0.786	72%	0.716	S	S	*	*	S	Bend	trans	-104.6	15.8	-149.9	-68.6	-48	0	0	0	115.5
540	N	31.5	Very low	33.8	Very low	146 Å²	146	118.2 Å²	118.2	78%	0.781	70%	0.696	S	S	*	*			trans	-123.8	58.9	-177.7	-152	-13.8	0	0	0	113.8
541	V	30.4	Very low	34.1	Very low	126 Å²	126	120.5 Å²	120.5	76%	0.764	70%	0.701	S	S	*	*			trans	-107.1	96.9	178.1	-178.4	0	0	0	0	111.4
542	I	29.7	Very low	34.4	Very low	153 Å²	153	115.7 Å²	115.7	79%	0.785	67%	0.67	S	S	*	*	S	Bend	trans	-164.5	130.2	145.7	-97.1	142.7	0	0	0	109.6
543	S	29.1	Very low	34.7	Very low	125 Å²	125	116.1 Å²	116.1	87%	0.874	67%	0.665	S	S	*	*	S	Bend	trans	69.8	54.1	168.5	68.1	0	0	0	0	120.5
544	G	26.5	Very low	35.4	Very low	67 Å²	67	114 Å²	114	69%	0.691	66%	0.656	S	S	*	*			trans	-175.8	154.7	160.1	0	0	0	0	0	111.3
545	S	29.2	Very low	36	Very low	122 Å²	122	112.1 Å²	112.1	85%	0.853	64%	0.636	S	S	*	*			cis	-147.1	111.4	-9	-74.8	0	0	0	0	109.2
546	Y	32.1	Very low	36.2	Very low	182 Å²	182	114.8 Å²	114.8	71%	0.714	63%	0.631	S	S	*	*			trans	-77.1	150.6	173.8	-74.6	-83.4	0	0	0	111.3	K548	Y546-K548 PolarHBondContact O-N 2.85Å
547	P	41.8	Very low	36.8	Very low	90 Å²	90	111.9 Å²	111.9	58%	0.584	62%	0.624	S	S	*	*			trans	-55.6	126.6	176.9	-25.9	34.9	0	0	0	112.3	L549	P547-L549 PolarHBondContact O-N 2.86Å
548	K	44	Very low	37	Very low	139 Å²	139	114.3 Å²	114.3	60%	0.604	63%	0.628	S	S	*	*	G	3₁₀ helix	trans	-70.3	-0.7	-171.1	-74.6	-173.4	173.8	178.6	0	115.9	Y546 L550 Q551	Y546-K548 PolarHBondContact O-N 2.85Å; K548-L550 PolarHBondContact O-N 3.37Å; K548-Q551 PolarHBondContact O-N 3.09Å
549	L	45.1	Very low	37.3	Very low	59 Å²	59	114.6 Å²	114.6	31%	0.309	63%	0.633	S	S	.	*	G	3₁₀ helix	trans	-56.9	-12.8	-175	-82.1	166	0	0	0	116.4	V528 P547	V528-L549 HydrophobicContact CB-CD1 4.2Å; V528-L549 HydrophobicContact CG1-CD1 3.38Å; V528-L549 HydrophobicContact CG2-CD1 3.73Å; P547-L549 PolarHBondContact O-N 2.86Å
550	L	44.6	Very low	37.6	Very low	46 Å²	46	119.2 Å²	119.2	24%	0.241	64%	0.639	C	S	.	*	G	3₁₀ helix	trans	-130.8	36.2	-178.7	-74.6	166.1	0	0	0	112.7	K548 F555 A569 L572	K548-L550 PolarHBondContact O-N 3.37Å; L550-F555 HydrophobicContact CD2-CD2 4.33Å; L550-F555 HydrophobicContact CD2-CE2 3.84Å; L550-F555 HydrophobicContact CD2-CZ 3.98Å; L550-A569 HydrophobicContact CD1-CB 3.46Å; L550-A569 VanDerWaalsContact CD1-CB 3.46Å; L550-L572 HydrophobicContact CD1-CD1 4.46Å; L550-L572 HydrophobicContact CD2-CD1 3.98Å
551	Q	40.1	Very low	37.9	Very low	135 Å²	135	115.4 Å²	115.4	63%	0.631	62%	0.623	S	S	*	*			trans	-94.1	16.7	172.6	-68.9	-167.1	-21.1	0	0	114.3	K548 N553	K548-Q551 PolarHBondContact O-N 3.09Å; Q551-N553 PolarHBondContact O-N 3.13Å
552	S	39.9	Very low	38.6	Very low	21 Å²	21	118.7 Å²	118.7	15%	0.147	62%	0.622	C	S	.	*			trans	-65.9	130.9	168.4	58.3	0	0	0	0	110.4	S554 F555	S552-S554 PolarHBondContact O-N 3.19Å; S552-F555 PolarHBondContact O-N 2.79Å; S552-F555 VanDerWaalsContact O-N 3.17Å
553	N	40.5	Very low	39.4	Very low	109 Å²	109	114.9 Å²	114.9	58%	0.583	61%	0.609	S	S	*	*	G	3₁₀ helix	trans	-62.1	-20.1	-164.1	-83.9	-42.8	0	0	0	114.8	Q551 F555 R556	Q551-N553 PolarHBondContact O-N 3.13Å; N553-F555 PolarHBondContact O-N 2.96Å; N553-R556 PolarHBondContact O-N 3.1Å
554	S	43.2	Very low	40.6	Very low	104 Å²	104	114 Å²	114	73%	0.727	60%	0.595	S	S	*	*	G	3₁₀ helix	trans	-63.3	-21.1	178.1	-157.7	0	0	0	0	114	S552 R556	S552-S554 PolarHBondContact O-N 3.19Å; S554-R556 VanDerWaalsContact C-N 3.34Å; S554-R556 PolarHBondContact O-N 2.89Å
555	F	42.4	Very low	41.9	Very low	52 Å²	52	115.6 Å²	115.6	23%	0.228	58%	0.584	C	S	.	*	G	3₁₀ helix	trans	-77.3	-8.9	-178.7	-86.1	-82.1	0	0	0	115.6	L550 S552 N553 S557 F558 Y568	L550-F555 HydrophobicContact CD2-CD2 4.33Å; L550-F555 HydrophobicContact CD2-CE2 3.84Å; L550-F555 HydrophobicContact CD2-CZ 3.98Å; S552-F555 PolarHBondContact O-N 2.79Å; S552-F555 VanDerWaalsContact O-N 3.17Å; N553-F555 PolarHBondContact O-N 2.96Å; F555-S557 PolarHBondContact O-N 3.03Å; F555-F558 PolarHBondContact O-N 3.2Å; F555-Y568 HydrophobicContact CE1-CD1 4.31Å; F555-Y568 AromaticContact CE1-CE1 3.78Å; F555-Y568 HydrophobicContact CE1-CE1 3.78Å; F555-Y568 AromaticContact CZ-CE1 3.98Å; F555-Y568 HydrophobicContact CZ-CE1 3.98Å
556	R	39.3	Very low	43	Very low	193 Å²	193	112.3 Å²	112.3	73%	0.728	56%	0.564	S	S	*	*	G	3₁₀ helix	trans	-64.5	-21.4	-177.5	-66.9	-172.3	-177.8	-141.2	0.9	113.9	N553 S554 F558 S559	N553-R556 PolarHBondContact O-N 3.1Å; S554-R556 VanDerWaalsContact C-N 3.34Å; S554-R556 PolarHBondContact O-N 2.89Å; R556-F558 VanDerWaalsContact C-N 3.31Å; R556-F558 PolarHBondContact O-N 2.87Å; R556-S559 PolarHBondContact O-OG 3.46Å
557	S	41.5	Very low	44.3	Very low	102 Å²	102	108.9 Å²	108.9	71%	0.713	56%	0.558	S	S	*	*	G	3₁₀ helix	trans	-72.6	-12.5	-176.1	-49.8	0	0	0	0	115.4	F555	F555-S557 PolarHBondContact O-N 3.03Å
558	F	38.5	Very low	45.1	Very low	180 Å²	180	110 Å²	110	79%	0.789	55%	0.551	S	S	*	*	G	3₁₀ helix	trans	-100	36.3	179.5	-85.2	-80.8	0	0	0	113.6	F555 R556 R560	F555-F558 PolarHBondContact O-N 3.2Å; R556-F558 VanDerWaalsContact C-N 3.31Å; R556-F558 PolarHBondContact O-N 2.87Å; F558-R560 PolarHBondContact O-N 2.65Å
559	S	37.9	Very low	46.1	Very low	108 Å²	108	105 Å²	105	76%	0.755	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	14.8	-164.9	7.1	0	0	0	0	116.6	R556	R556-S559 PolarHBondContact O-OG 3.46Å
560	R	42.4	Very low	47.2	Very low	245 Å²	245	107.5 Å²	107.5	93%	0.925	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.4	4.1	-166.7	-123.6	176.9	-170.5	172.3	4.8	118	F558	F558-R560 PolarHBondContact O-N 2.65Å
561	C	38.8	Very low	48.6	Very low	66 Å²	66	106.7 Å²	106.7	45%	0.446	55%	0.55	S	S	.	.			trans	-157.5	100.8	168.6	-150.4	0	0	0	0	113.7	S563 N564	C561-S563 VanDerWaalsContact C-N 3.31Å; C561-S563 PolarHBondContact O-N 2.97Å; C561-N564 HydrophobicContact CB-CB 4.49Å; C561-N564 PolarHBondContact O-N 3.35Å
562	R	43.3	Very low	50.2	Low	195 Å²	195	101.4 Å²	101.4	74%	0.736	53%	0.526	S	S	*	.	H	α-helix	trans	-61.6	-31.7	-171.7	-154.1	176.4	-171.9	-175.2	1.6	114.1	Q565 A566	R562-Q565 PolarHBondContact O-N 2.98Å; R562-A566 PolarHBondContact O-N 3.35Å
563	S	48	Very low	51.8	Low	73 Å²	73	105.3 Å²	105.3	51%	0.51	54%	0.537	S	S	.	.	H	α-helix	trans	-69.4	-36.3	178.7	48.8	0	0	0	0	113.6	C561 Q565 N567	C561-S563 VanDerWaalsContact C-N 3.31Å; C561-S563 PolarHBondContact O-N 2.97Å; S563-Q565 VanDerWaalsContact C-N 3.32Å; S563-Q565 PolarHBondContact O-N 3.46Å; S563-N567 PolarHBondContact O-N 2.9Å
564	N	53.6	Low	53.6	Low	107 Å²	107	106.3 Å²	106.3	57%	0.572	54%	0.538	S	S	*	.	H	α-helix	trans	-67.5	-34.9	177.3	-73.6	-17.8	0	0	0	111.8	C561 Y568	C561-N564 HydrophobicContact CB-CB 4.49Å; C561-N564 PolarHBondContact O-N 3.35Å; N564-Y568 WeakPolarHBondContact O-CB 3.38Å; N564-Y568 PolarHBondContact O-N 2.85Å
565	Q	53.4	Low	55.4	Low	100 Å²	100	104.7 Å²	104.7	47%	0.467	52%	0.519	S	S	.	.	H	α-helix	trans	-67.7	-40	179.8	-166.2	174.8	18.9	0	0	111.9	R562 S563 Y568 A569	R562-Q565 PolarHBondContact O-N 2.98Å; S563-Q565 VanDerWaalsContact C-N 3.32Å; S563-Q565 PolarHBondContact O-N 3.46Å; Q565-Y568 PolarHBondContact O-N 3.35Å; Q565-A569 WeakPolarHBondContact O-CB 3.35Å; Q565-A569 PolarHBondContact O-N 3.42Å
566	A	51.8	Low	57.2	Low	52 Å²	52	103.4 Å²	103.4	43%	0.43	51%	0.514	S	S	.	.	H	α-helix	trans	-63.1	-47.2	175.2	0	0	0	0	0	112.1	R562 Y568 A569 M570	R562-A566 PolarHBondContact O-N 3.35Å; A566-Y568 VanDerWaalsContact C-N 3.32Å; A566-Y568 PolarHBondContact O-N 3.14Å; A566-A569 PolarHBondContact O-N 3.4Å; A566-M570 PolarHBondContact O-N 2.81Å
567	N	59.5	Low	59.1	Low	110 Å²	110	97.4 Å²	97.4	59%	0.588	49%	0.494	S	S	*	.	H	α-helix	trans	-62.5	-38.6	177.9	-68.2	-16.9	0	0	0	112.3	S563 G571	S563-N567 PolarHBondContact O-N 2.9Å; N567-G571 PolarHBondContact O-N 3.41Å
568	Y	58.6	Low	61.1	Low	113 Å²	113	95.3 Å²	95.3	44%	0.443	48%	0.475	S	S	.	.	H	α-helix	trans	-68.5	-40.2	175.8	-175.6	-108.2	0	0	0	112.2	F555 N564 Q565 A566 G571 L572	F555-Y568 HydrophobicContact CE1-CD1 4.31Å; F555-Y568 AromaticContact CE1-CE1 3.78Å; F555-Y568 HydrophobicContact CE1-CE1 3.78Å; F555-Y568 AromaticContact CZ-CE1 3.98Å; F555-Y568 HydrophobicContact CZ-CE1 3.98Å; N564-Y568 WeakPolarHBondContact O-CB 3.38Å; N564-Y568 PolarHBondContact O-N 2.85Å; Q565-Y568 PolarHBondContact O-N 3.35Å; A566-Y568 VanDerWaalsContact C-N 3.32Å; A566-Y568 PolarHBondContact O-N 3.14Å; Y568-G571 PolarHBondContact O-N 3.39Å; Y568-L572 HydrophobicContact CD1-CD1 3.98Å; Y568-L572 HydrophobicContact CD1-CG 4.47Å; Y568-L572 HydrophobicContact CE1-CD1 3.42Å; Y568-L572 VanDerWaalsContact CE1-CD1 3.42Å; Y568-L572 HydrophobicContact CE1-CG 4.06Å; Y568-L572 HydrophobicContact CE2-CG 4.45Å; Y568-L572 PolarHBondContact O-N 2.85Å
569	A	65.7	Low	63.3	Low	34 Å²	34	87.2 Å²	87.2	28%	0.281	44%	0.439	S	S	.	.	H	α-helix	trans	-63.2	-39.4	174.8	0	0	0	0	0	112.8	L550 Q565 A566 R573	L550-A569 HydrophobicContact CD1-CB 3.46Å; L550-A569 VanDerWaalsContact CD1-CB 3.46Å; Q565-A569 WeakPolarHBondContact O-CB 3.35Å; Q565-A569 PolarHBondContact O-N 3.42Å; A566-A569 PolarHBondContact O-N 3.4Å; A569-R573 PolarHBondContact O-N 3.42Å
570	M	67.9	Low	65.4	Low	113 Å²	113	82.9 Å²	82.9	56%	0.557	41%	0.406	S	S	*	.	H	α-helix	trans	-63.2	-48.3	172.7	-73.4	-178.4	65	0	0	111.6	A566 L572 R573 E574	A566-M570 PolarHBondContact O-N 2.81Å; M570-L572 VanDerWaalsContact C-N 3.35Å; M570-L572 PolarHBondContact O-N 3.07Å; M570-R573 WeakPolarHBondContact O-CB 3.48Å; M570-R573 PolarHBondContact O-N 3.42Å; M570-R573 VanDerWaalsContact O-N 3.09Å; M570-E574 PolarHBondContact O-N 3.48Å
571	G	73.9	Confident	67.4	Low	28 Å²	28	74.6 Å²	74.6	29%	0.289	39%	0.386	S	S	.	.	H	α-helix	trans	-59.6	-41.6	177.8	0	0	0	0	0	113.3	N567 Y568 R573 E574 E575	N567-G571 PolarHBondContact O-N 3.41Å; Y568-G571 PolarHBondContact O-N 3.39Å; G571-R573 PolarHBondContact O-N 2.81Å; G571-E574 PolarHBondContact O-N 3.04Å; G571-E575 WeakPolarHBondContact O-CG 3.35Å; G571-E575 PolarHBondContact O-N 3.02Å
572	L	73.5	Confident	69.7	Low	24 Å²	24	73 Å²	73	13%	0.126	37%	0.373	C	S	.	.	H	α-helix	trans	-64.1	-37.4	173.8	-77.2	-179.2	0	0	0	112.7	L550 Y568 M570 F576 L677	L550-L572 HydrophobicContact CD1-CD1 4.46Å; L550-L572 HydrophobicContact CD2-CD1 3.98Å; Y568-L572 HydrophobicContact CD1-CD1 3.98Å; Y568-L572 HydrophobicContact CD1-CG 4.47Å; Y568-L572 HydrophobicContact CE1-CD1 3.42Å; Y568-L572 VanDerWaalsContact CE1-CD1 3.42Å; Y568-L572 HydrophobicContact CE1-CG 4.06Å; Y568-L572 HydrophobicContact CE2-CG 4.45Å; Y568-L572 PolarHBondContact O-N 2.85Å; M570-L572 VanDerWaalsContact C-N 3.35Å; M570-L572 PolarHBondContact O-N 3.07Å; L572-F576 VanDerWaalsContact O-CB 3.29Å; L572-F576 WeakPolarHBondContact O-CB 3.33Å; L572-F576 PolarHBondContact O-N 2.66Å; L572-L677 HydrophobicContact CD1-CD1 4.25Å; L572-L677 HydrophobicContact CD2-CD1 3.76Å
573	R	74.3	Confident	71.8	Confident	103 Å²	103	63.7 Å²	63.7	39%	0.389	34%	0.338	S	S	.	.	H	α-helix	trans	-64.2	-45.9	173.7	-169.2	-177.4	-176.9	-157.5	5.8	110.7	V528 A569 M570 G571 E575 F576 E577	V528-R573 PolarHBondContact O-NH2 2.82Å; A569-R573 PolarHBondContact O-N 3.42Å; M570-R573 WeakPolarHBondContact O-CB 3.48Å; M570-R573 PolarHBondContact O-N 3.42Å; M570-R573 VanDerWaalsContact O-N 3.09Å; G571-R573 PolarHBondContact O-N 2.81Å; R573-E575 PolarHBondContact O-N 3.48Å; R573-F576 PolarHBondContact O-N 2.83Å; R573-E577 HydrophobicContact CG-CG 4.34Å; R573-E577 WeakPolarHBondContact O-CG 3.38Å; R573-E577 PolarHBondContact O-N 3.12Å
574	E	78.9	Confident	73.6	Confident	130 Å²	130	61.3 Å²	61.3	61%	0.607	32%	0.321	S	S	*	.	H	α-helix	trans	-59.9	-44.1	176.5	-71.5	172.1	-163.2	0	0	112.4	M570 G571 F576 L578	M570-E574 PolarHBondContact O-N 3.48Å; G571-E574 PolarHBondContact O-N 3.04Å; E574-F576 VanDerWaalsContact C-N 3.34Å; E574-F576 PolarHBondContact O-N 3.24Å; E574-L578 VanDerWaalsContact O-CB 3.24Å; E574-L578 WeakPolarHBondContact O-CB 3.49Å; E574-L578 PolarHBondContact O-N 2.81Å
575	E	79.6	Confident	75.3	Confident	70 Å²	70	58.5 Å²	58.5	33%	0.327	31%	0.312	S	S	.	.	H	α-helix	trans	-65.2	-36.5	174.8	-70.1	-149.2	112.8	0	0	112.6	G571 R573 Y579 R670 F674	G571-E575 WeakPolarHBondContact O-CG 3.35Å; G571-E575 PolarHBondContact O-N 3.02Å; R573-E575 PolarHBondContact O-N 3.48Å; E575-Y579 WeakPolarHBondContact O-CB 3.47Å; E575-Y579 PolarHBondContact O-N 2.78Å; E575-R670 VanDerWaalsContact CD-NH1 3.31Å; E575-R670 IonicContact OE1-CZ 3.95Å; E575-R670 VanDerWaalsContact OE1-CZ 3.26Å; E575-R670 IonicContact OE1-NH1 2.84Å; E575-R670 PolarHBondContact OE1-NH1 3Å; E575-R670 IonicContact OE1-NH2 2.71Å; E575-R670 PolarHBondContact OE1-NH2 3.44Å; E575-R670 IonicContact OE2-NH1 2.72Å; E575-F674 HydrophobicContact CB-CZ 4.29Å
576	F	79.9	Confident	77	Confident	26 Å²	26	54.3 Å²	54.3	11%	0.114	30%	0.295	C	S	.	.	H	α-helix	trans	-67.6	-52.3	177.2	-172.6	-115.5	0	0	0	111.5	L447 L525 L572 R573 E574 L578 Y579 K580 F674	L447-F576 HydrophobicContact CD1-CD2 4.13Å; L447-F576 HydrophobicContact CD1-CE2 3.44Å; L447-F576 VanDerWaalsContact CD1-CE2 3.44Å; L447-F576 HydrophobicContact CD1-CZ 4.04Å; L525-F576 HydrophobicContact CB-CZ 4.47Å; L525-F576 HydrophobicContact CD2-CE1 4.24Å; L525-F576 HydrophobicContact CD2-CE2 3.61Å; L525-F576 HydrophobicContact CD2-CZ 3.36Å; L572-F576 VanDerWaalsContact O-CB 3.29Å; L572-F576 WeakPolarHBondContact O-CB 3.33Å; L572-F576 PolarHBondContact O-N 2.66Å; R573-F576 PolarHBondContact O-N 2.83Å; E574-F576 VanDerWaalsContact C-N 3.34Å; E574-F576 PolarHBondContact O-N 3.24Å; F576-L578 VanDerWaalsContact C-N 3.28Å; F576-L578 PolarHBondContact O-N 3.44Å; F576-Y579 HydrophobicContact CD2-CD1 4.45Å; F576-Y579 CarbonylContact O-C 3.5Å; F576-Y579 WeakPolarHBondContact O-CA 3.31Å; F576-Y579 WeakPolarHBondContact O-CB 3.25Å; F576-Y579 PolarHBondContact O-N 2.88Å; F576-K580 VanDerWaalsContact O-CG 3.31Å; F576-K580 WeakPolarHBondContact O-CG 3.47Å; F576-K580 PolarHBondContact O-N 2.88Å; F576-F674 HydrophobicContact CB-CE1 4.23Å; F576-F674 HydrophobicContact CB-CZ 4.34Å; F576-F674 HydrophobicContact CD2-CD1 4.45Å; F576-F674 HydrophobicContact CD2-CE1 4.19Å; F576-F674 HydrophobicContact CD2-CZ 4.33Å
577	E	79.8	Confident	78.8	Confident	67 Å²	67	52 Å²	52	31%	0.313	28%	0.275	S	S	.	.	H	α-helix	trans	-56.7	-40.1	175.3	-62.9	-58.2	148.2	0	0	111.6	R573 K580 S581	R573-E577 HydrophobicContact CG-CG 4.34Å; R573-E577 WeakPolarHBondContact O-CG 3.38Å; R573-E577 PolarHBondContact O-N 3.12Å; E577-K580 WeakPolarHBondContact O-CB 3.43Å; E577-K580 PolarHBondContact O-N 3.29Å; E577-K580 VanDerWaalsContact OE1-CE 3.29Å; E577-K580 WeakPolarHBondContact OE1-CE 3.47Å; E577-K580 IonicContact OE1-NZ 3.62Å; E577-K580 PolarHBondContact OE1-NZ 3.31Å; E577-K580 WeakPolarHBondContact OE2-CD 3.37Å; E577-K580 WeakPolarHBondContact OE2-CE 3.47Å; E577-K580 IonicContact OE2-NZ 3.14Å; E577-K580 PolarHBondContact OE2-NZ 3.45Å; E577-S581 PolarHBondContact O-N 3.2Å
578	L	84.1	Confident	80.3	Confident	58 Å²	58	48.1 Å²	48.1	30%	0.304	25%	0.254	S	S	.	.	H	α-helix	trans	-62.9	-40.6	173	177.4	59.4	0	0	0	112.1	E574 F576 S581 N582	E574-L578 VanDerWaalsContact O-CB 3.24Å; E574-L578 WeakPolarHBondContact O-CB 3.49Å; E574-L578 PolarHBondContact O-N 2.81Å; F576-L578 VanDerWaalsContact C-N 3.28Å; F576-L578 PolarHBondContact O-N 3.44Å; L578-S581 PolarHBondContact O-N 3.08Å; L578-N582 WeakPolarHBondContact O-CB 3.47Å; L578-N582 PolarHBondContact O-N 2.96Å; L578-N582 PolarHBondContact O-ND2 3.44Å; L578-N582 VanDerWaalsContact O-ND2 3.07Å
579	Y	84.5	Confident	81.8	Confident	9 Å²	9	44.8 Å²	44.8	4%	0.035	24%	0.242	C	C	.	.	H	α-helix	trans	-64.1	-37.8	173.2	162.1	-98.8	0	0	0	112.6	L525 E575 F576 N582 T583 L667 R670 M671 F674	L525-Y579 HydrophobicContact CD1-CD1 4.12Å; L525-Y579 HydrophobicContact CD1-CE1 3.72Å; L525-Y579 HydrophobicContact CD2-CD1 4.46Å; L525-Y579 HydrophobicContact CD2-CE1 4.01Å; E575-Y579 WeakPolarHBondContact O-CB 3.47Å; E575-Y579 PolarHBondContact O-N 2.78Å; F576-Y579 HydrophobicContact CD2-CD1 4.45Å; F576-Y579 CarbonylContact O-C 3.5Å; F576-Y579 WeakPolarHBondContact O-CA 3.31Å; F576-Y579 WeakPolarHBondContact O-CB 3.25Å; F576-Y579 PolarHBondContact O-N 2.88Å; Y579-N582 PolarHBondContact O-N 3.26Å; Y579-T583 VanDerWaalsContact CE2-OG1 3.28Å; Y579-T583 WeakPolarHBondContact CE2-OG1 3.33Å; Y579-T583 WeakPolarHBondContact O-CB 3.31Å; Y579-T583 PolarHBondContact O-N 3.05Å; Y579-T583 PolarHBondContact O-OG1 2.99Å; Y579-L667 HydrophobicContact CD2-CD2 4.25Å; Y579-L667 HydrophobicContact CE2-CD2 4.26Å; Y579-R670 HydrophobicContact CD2-CB 3.9Å; Y579-M671 HydrophobicContact CE2-CG 3.66Å; Y579-M671 VanDerWaalsContact OH-CG 3.28Å; Y579-M671 WeakPolarHBondContact OH-CG 3.3Å; Y579-M671 PolarHBondContact OH-SD 2.8Å; Y579-F674 HydrophobicContact CD1-CD2 4.36Å; Y579-F674 HydrophobicContact CD1-CE2 4.02Å; Y579-F674 HydrophobicContact CD2-CE2 4.21Å; Y579-F674 HydrophobicContact CG-CD2 4.25Å; Y579-F674 AromaticContact CG-CE2 3.64Å; Y579-F674 HydrophobicContact CG-CE2 3.64Å
580	K	82.6	Confident	83.1	Confident	17 Å²	17	44 Å²	44	7%	0.074	23%	0.233	C	C	.	.	H	α-helix	trans	-57.7	-53.4	171.5	-43.4	-177.1	-179.7	179.9	0	110.8	L525 D526 F576 E577 N582 T583 V584	L525-K580 HydrophobicContact CB-CB 4.19Å; L525-K580 HydrophobicContact CB-CD 3.52Å; L525-K580 HydrophobicContact CB-CG 3.49Å; L525-K580 VanDerWaalsContact CB-CG 3.49Å; L525-K580 HydrophobicContact CD1-CB 3.85Å; L525-K580 HydrophobicContact CD1-CG 3.73Å; L525-K580 HydrophobicContact CG-CG 4.09Å; L525-K580 WeakPolarHBondContact O-CD 3.48Å; L525-K580 WeakPolarHBondContact O-CE 3.44Å; L525-K580 PolarHBondContact O-NZ 2.86Å; D526-K580 PolarHBondContact O-NZ 3.15Å; F576-K580 VanDerWaalsContact O-CG 3.31Å; F576-K580 WeakPolarHBondContact O-CG 3.47Å; F576-K580 PolarHBondContact O-N 2.88Å; E577-K580 WeakPolarHBondContact O-CB 3.43Å; E577-K580 PolarHBondContact O-N 3.29Å; E577-K580 VanDerWaalsContact OE1-CE 3.29Å; E577-K580 WeakPolarHBondContact OE1-CE 3.47Å; E577-K580 IonicContact OE1-NZ 3.62Å; E577-K580 PolarHBondContact OE1-NZ 3.31Å; E577-K580 WeakPolarHBondContact OE2-CD 3.37Å; E577-K580 WeakPolarHBondContact OE2-CE 3.47Å; E577-K580 IonicContact OE2-NZ 3.14Å; E577-K580 PolarHBondContact OE2-NZ 3.45Å; K580-N582 VanDerWaalsContact C-N 3.32Å; K580-N582 PolarHBondContact O-N 2.7Å; K580-T583 WeakPolarHBondContact O-CB 3.46Å; K580-T583 PolarHBondContact O-N 2.96Å; K580-V584 WeakPolarHBondContact O-CG2 3.48Å; K580-V584 PolarHBondContact O-N 2.86Å
581	S	84.1	Confident	84.3	Confident	72 Å²	72	40.2 Å²	40.2	50%	0.503	22%	0.215	S	C	.	.	H	α-helix	trans	-57	-45.4	-178.6	-172	0	0	0	0	111.8	E577 L578 T583 V584 A585	E577-S581 PolarHBondContact O-N 3.2Å; L578-S581 PolarHBondContact O-N 3.08Å; S581-T583 PolarHBondContact O-N 3.24Å; S581-V584 PolarHBondContact O-N 3.07Å; S581-A585 VanDerWaalsContact O-CB 3.31Å; S581-A585 WeakPolarHBondContact O-CB 3.49Å; S581-A585 PolarHBondContact O-N 3.23Å
582	N	86.3	Confident	85.2	Confident	31 Å²	31	43.6 Å²	43.6	17%	0.166	22%	0.224	C	C	.	.	H	α-helix	trans	-65.1	-35.9	175.9	-68.4	-30.2	0	0	0	112.9	F281 L578 Y579 K580 A586 L667	F281-N582 HydrophobicContact CE2-CB 4.48Å; F281-N582 VanDerWaalsContact CE2-OD1 3.25Å; F281-N582 WeakPolarHBondContact CE2-OD1 3.44Å; L578-N582 WeakPolarHBondContact O-CB 3.47Å; L578-N582 PolarHBondContact O-N 2.96Å; L578-N582 PolarHBondContact O-ND2 3.44Å; L578-N582 VanDerWaalsContact O-ND2 3.07Å; Y579-N582 PolarHBondContact O-N 3.26Å; K580-N582 VanDerWaalsContact C-N 3.32Å; K580-N582 PolarHBondContact O-N 2.7Å; N582-A586 WeakPolarHBondContact O-CB 3.45Å; N582-A586 PolarHBondContact O-N 3.27Å; N582-L667 HydrophobicContact CB-CD2 3.86Å
583	T	87.6	Confident	86.1	Confident	1 Å²	1	42.9 Å²	42.9	1%	0.006	22%	0.22	C	C	.	.	H	α-helix	trans	-69.1	-44.5	178.3	-57	0	0	0	0	111.1	M524 Y579 K580 S581 A586 F587	M524-T583 HydrophobicContact CE-CG2 4.38Å; Y579-T583 VanDerWaalsContact CE2-OG1 3.28Å; Y579-T583 WeakPolarHBondContact CE2-OG1 3.33Å; Y579-T583 WeakPolarHBondContact O-CB 3.31Å; Y579-T583 PolarHBondContact O-N 3.05Å; Y579-T583 PolarHBondContact O-OG1 2.99Å; K580-T583 WeakPolarHBondContact O-CB 3.46Å; K580-T583 PolarHBondContact O-N 2.96Å; S581-T583 PolarHBondContact O-N 3.24Å; T583-A586 PolarHBondContact O-N 3.27Å; T583-F587 HydrophobicContact CG2-CD2 4.3Å; T583-F587 HydrophobicContact CG2-CE2 3.74Å; T583-F587 HydrophobicContact CG2-CZ 4.27Å; T583-F587 WeakPolarHBondContact O-CD2 3.47Å; T583-F587 PolarHBondContact O-N 3.42Å
584	V	86.8	Confident	87	Confident	23 Å²	23	38.4 Å²	38.4	14%	0.139	20%	0.204	C	C	.	.	H	α-helix	trans	-65.9	-40.4	174.6	-174.8	0	0	0	0	111.2	F499 R504 K580 S581 A586 F587 D588	F499-V584 HydrophobicContact CE2-CG1 4.12Å; F499-V584 HydrophobicContact CZ-CG1 4.16Å; R504-V584 HydrophobicContact CB-CG1 3.98Å; R504-V584 VanDerWaalsContact CZ-CG1 3.45Å; K580-V584 WeakPolarHBondContact O-CG2 3.48Å; K580-V584 PolarHBondContact O-N 2.86Å; S581-V584 PolarHBondContact O-N 3.07Å; V584-A586 VanDerWaalsContact C-N 3.28Å; V584-A586 PolarHBondContact O-N 3.14Å; V584-F587 WeakPolarHBondContact O-CB 3.32Å; V584-F587 PolarHBondContact O-N 3.37Å; V584-F587 VanDerWaalsContact O-N 3.14Å; V584-D588 PolarHBondContact O-N 2.88Å
585	A	88.1	Confident	87.6	Confident	48 Å²	48	33.6 Å²	33.6	40%	0.397	19%	0.189	S	C	.	.	H	α-helix	trans	-62.4	-33.6	174.4	0	0	0	0	0	113	S581 H589	S581-A585 VanDerWaalsContact O-CB 3.31Å; S581-A585 WeakPolarHBondContact O-CB 3.49Å; S581-A585 PolarHBondContact O-N 3.23Å; A585-H589 WeakPolarHBondContact O-CB 3.48Å; A585-H589 PolarHBondContact O-N 2.67Å
586	A	89.1	Confident	88	Confident	12 Å²	12	35.9 Å²	35.9	10%	0.099	21%	0.213	C	C	.	.	H	α-helix	trans	-71.5	-35.9	172.9	0	0	0	0	0	112.4	N582 T583 V584 H589 L590 L667	N582-A586 WeakPolarHBondContact O-CB 3.45Å; N582-A586 PolarHBondContact O-N 3.27Å; T583-A586 PolarHBondContact O-N 3.27Å; V584-A586 VanDerWaalsContact C-N 3.28Å; V584-A586 PolarHBondContact O-N 3.14Å; A586-H589 PolarHBondContact O-N 3.03Å; A586-L590 WeakPolarHBondContact O-CB 3.38Å; A586-L590 VanDerWaalsContact O-CG 3.25Å; A586-L590 WeakPolarHBondContact O-CG 3.37Å; A586-L590 PolarHBondContact O-N 3.45Å; A586-L667 HydrophobicContact CB-CD1 3.54Å
587	F	91.1	Very high	88.8	Confident	4 Å²	4	36.1 Å²	36.1	2%	0.018	22%	0.216	C	C	.	.	H	α-helix	trans	-63.3	-45.7	170	-69.9	-51.7	0	0	0	111.8	V492 F499 L506 M524 T583 V584 H589 L590 D591	V492-F587 HydrophobicContact CG1-CE1 4.09Å; V492-F587 HydrophobicContact CG1-CZ 4.47Å; V492-F587 WeakPolarHBondContact O-CE1 3.39Å; F499-F587 HydrophobicContact CB-CB 4.4Å; F499-F587 HydrophobicContact CB-CD1 4.4Å; F499-F587 HydrophobicContact CB-CG 4.39Å; F499-F587 HydrophobicContact CD1-CB 3.72Å; F499-F587 HydrophobicContact CD2-CB 3.64Å; F499-F587 AromaticContact CD2-CD2 3.83Å; F499-F587 HydrophobicContact CD2-CD2 3.83Å; F499-F587 AromaticContact CD2-CG 3.81Å; F499-F587 HydrophobicContact CD2-CG 3.81Å; F499-F587 HydrophobicContact CE1-CB 3.73Å; F499-F587 HydrophobicContact CE2-CB 3.67Å; F499-F587 HydrophobicContact CE2-CD2 4.05Å; F499-F587 HydrophobicContact CE2-CG 4.17Å; F499-F587 HydrophobicContact CG-CB 3.66Å; F499-F587 HydrophobicContact CG-CD1 4.49Å; F499-F587 HydrophobicContact CG-CD2 4.47Å; F499-F587 HydrophobicContact CG-CG 4.02Å; F499-F587 HydrophobicContact CZ-CB 3.7Å; L506-F587 HydrophobicContact CD2-CE2 4.27Å; L506-F587 HydrophobicContact CD2-CZ 4.21Å; M524-F587 HydrophobicContact CG-CE2 4.19Å; T583-F587 HydrophobicContact CG2-CD2 4.3Å; T583-F587 HydrophobicContact CG2-CE2 3.74Å; T583-F587 HydrophobicContact CG2-CZ 4.27Å; T583-F587 WeakPolarHBondContact O-CD2 3.47Å; T583-F587 PolarHBondContact O-N 3.42Å; V584-F587 WeakPolarHBondContact O-CB 3.32Å; V584-F587 PolarHBondContact O-N 3.37Å; V584-F587 VanDerWaalsContact O-N 3.14Å; F587-H589 VanDerWaalsContact C-N 3.31Å; F587-H589 PolarHBondContact O-N 2.89Å; F587-L590 PolarHBondContact O-N 3.35Å; F587-D591 WeakPolarHBondContact O-CB 3.15Å; F587-D591 PolarHBondContact O-N 3.01Å
588	D	90.1	Very high	89.6	Confident	27 Å²	27	34.1 Å²	34.1	14%	0.144	21%	0.207	C	C	.	.	H	α-helix	trans	-59.2	-39.9	175.6	-72.7	-46.4	0	0	0	112.1	R504 V584 E592	R504-D588 IonicContact CZ-OD2 3.6Å; R504-D588 VanDerWaalsContact CZ-OD2 3.27Å; R504-D588 IonicContact NE-OD1 2.85Å; R504-D588 IonicContact NE-OD2 3.98Å; R504-D588 PolarHBondContact NE-OD2 2.96Å; R504-D588 IonicContact NH2-OD2 2.83Å; R504-D588 PolarHBondContact NH2-OD2 2.7Å; V584-D588 PolarHBondContact O-N 2.88Å; D588-E592 WeakPolarHBondContact O-CB 3.44Å; D588-E592 PolarHBondContact O-N 3.25Å; D588-E592 VanDerWaalsContact O-N 3.08Å
589	H	91	Very high	90.3	Very high	44 Å²	44	32.2 Å²	32.2	20%	0.204	20%	0.197	C	C	.	.	H	α-helix	trans	-71.6	-42.8	176.1	-173.3	-154.8	0	0	0	112.1	A585 A586 F587 E592 L593 R656 D663	A585-H589 WeakPolarHBondContact O-CB 3.48Å; A585-H589 PolarHBondContact O-N 2.67Å; A586-H589 PolarHBondContact O-N 3.03Å; F587-H589 VanDerWaalsContact C-N 3.31Å; F587-H589 PolarHBondContact O-N 2.89Å; H589-E592 PolarHBondContact O-N 2.7Å; H589-L593 VanDerWaalsContact O-CG 3.3Å; H589-L593 WeakPolarHBondContact O-CG 3.38Å; H589-L593 PolarHBondContact O-N 3.25Å; H589-L593 VanDerWaalsContact O-N 3.15Å; H589-R656 PolarHBondContact NE2-NH2 2.67Å; H589-D663 IonicContact CE1-OD2 2.66Å; H589-D663 PolarHBondContact CE1-OD2 3.13Å; H589-D663 IonicContact ND1-OD2 3.21Å; H589-D663 PolarHBondContact ND1-OD2 2.92Å
590	L	92.1	Very high	90.8	Very high	16 Å²	16	32.2 Å²	32.2	8%	0.084	20%	0.197	C	C	.	.	H	α-helix	trans	-61	-44.8	176	-76.8	168.6	0	0	0	111.1	L493 A586 F587 L593 V594	L493-L590 HydrophobicContact CD2-CD1 3.97Å; L493-L590 HydrophobicContact CD2-CD2 4.09Å; A586-L590 WeakPolarHBondContact O-CB 3.38Å; A586-L590 VanDerWaalsContact O-CG 3.25Å; A586-L590 WeakPolarHBondContact O-CG 3.37Å; A586-L590 PolarHBondContact O-N 3.45Å; F587-L590 PolarHBondContact O-N 3.35Å; L590-L593 PolarHBondContact O-N 3.3Å; L590-L593 VanDerWaalsContact O-N 3.12Å; L590-V594 WeakPolarHBondContact O-CG2 3.06Å; L590-V594 PolarHBondContact O-N 3.05Å
591	D	92.4	Very high	91.5	Very high	35 Å²	35	32.1 Å²	32.1	19%	0.187	20%	0.196	C	C	.	.	H	α-helix	trans	-62.1	-41.8	175.3	179.5	74.3	0	0	0	112.4	R501 F587 L593 V594 G595 R601	R501-D591 WeakPolarHBondContact CD-OD2 3.18Å; R501-D591 IonicContact CZ-OD2 3.4Å; R501-D591 IonicContact NE-OD2 3.74Å; R501-D591 IonicContact NH1-OD2 2.78Å; R501-D591 PolarHBondContact NH1-OD2 3.44Å; F587-D591 WeakPolarHBondContact O-CB 3.15Å; F587-D591 PolarHBondContact O-N 3.01Å; D591-L593 PolarHBondContact O-N 3.05Å; D591-V594 PolarHBondContact O-N 3.29Å; D591-G595 VanDerWaalsContact O-CA 3.31Å; D591-G595 WeakPolarHBondContact O-CA 3.37Å; D591-G595 PolarHBondContact O-N 3.08Å; D591-R601 IonicContact OD1-NH2 3.32Å
592	E	92.5	Very high	92.2	Very high	99 Å²	99	28.7 Å²	28.7	46%	0.463	17%	0.172	S	C	.	.	H	α-helix	trans	-60.6	-26.9	174.1	-159.4	-137.3	130.3	0	0	113.2	D588 H589 R656	D588-E592 WeakPolarHBondContact O-CB 3.44Å; D588-E592 PolarHBondContact O-N 3.25Å; D588-E592 VanDerWaalsContact O-N 3.08Å; H589-E592 PolarHBondContact O-N 2.7Å; E592-R656 IonicContact OE1-CZ 2.76Å; E592-R656 VanDerWaalsContact OE1-CZ 3.24Å; E592-R656 IonicContact OE1-NH1 3.57Å; E592-R656 PolarHBondContact OE1-NH1 2.95Å; E592-R656 IonicContact OE1-NH2 2.67Å; E592-R656 PolarHBondContact OE1-NH2 3.03Å; E592-R656 IonicContact OE2-NH2 3.83Å; E592-R656 PolarHBondContact OE2-NH2 3.38Å
593	L	94.1	Very high	92.7	Very high	8 Å²	8	27.2 Å²	27.2	4%	0.042	17%	0.165	C	C	.	.	H	α-helix	trans	-86.8	-44.9	177.6	-64.6	175.1	0	0	0	113.1	H589 L590 D591 L653 R656 I657 A660	H589-L593 VanDerWaalsContact O-CG 3.3Å; H589-L593 WeakPolarHBondContact O-CG 3.38Å; H589-L593 PolarHBondContact O-N 3.25Å; H589-L593 VanDerWaalsContact O-N 3.15Å; L590-L593 PolarHBondContact O-N 3.3Å; L590-L593 VanDerWaalsContact O-N 3.12Å; D591-L593 PolarHBondContact O-N 3.05Å; L593-L653 HydrophobicContact CB-CD1 4.2Å; L593-L653 HydrophobicContact CD2-CD1 3.97Å; L593-L653 VanDerWaalsContact O-CD1 3.26Å; L593-L653 WeakPolarHBondContact O-CD1 3.42Å; L593-R656 HydrophobicContact CD2-CB 3.47Å; L593-R656 VanDerWaalsContact CD2-CB 3.47Å; L593-R656 HydrophobicContact CD2-CG 4.32Å; L593-I657 HydrophobicContact CB-CG1 4.12Å; L593-I657 HydrophobicContact CD1-CG1 4.29Å; L593-A660 HydrophobicContact CD1-CB 3.79Å
594	V	93.3	Very high	93.2	Very high	10 Å²	10	27.5 Å²	27.5	6%	0.061	17%	0.166	C	C	.	.	H	α-helix	trans	-102.3	-19.9	-170.1	-48	0	0	0	0	113.9	L590 D591 S596 D597 L600 R601	L590-V594 WeakPolarHBondContact O-CG2 3.06Å; L590-V594 PolarHBondContact O-N 3.05Å; D591-V594 PolarHBondContact O-N 3.29Å; V594-S596 PolarHBondContact O-N 2.91Å; V594-D597 VanDerWaalsContact O-CB 3.32Å; V594-D597 WeakPolarHBondContact O-CB 3.45Å; V594-D597 PolarHBondContact O-N 3.06Å; V594-L600 HydrophobicContact CB-CB 4.44Å; V594-L600 HydrophobicContact CB-CD2 4.12Å; V594-L600 HydrophobicContact CB-CG 4.09Å; V594-L600 HydrophobicContact CG1-CD2 4.31Å; V594-L600 HydrophobicContact CG1-CG 4Å; V594-R601 HydrophobicContact CB-CG 4.29Å; V594-R601 HydrophobicContact CG2-CG 3.58Å
595	G	89.9	Confident	93.7	Very high	29 Å²	29	26.5 Å²	26.5	30%	0.299	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.7	-134.3	-176.4	0	0	0	0	0	112.4	D591 D597 R601	D591-G595 VanDerWaalsContact O-CA 3.31Å; D591-G595 WeakPolarHBondContact O-CA 3.37Å; D591-G595 PolarHBondContact O-N 3.08Å; G595-D597 VanDerWaalsContact C-N 3.29Å; G595-D597 PolarHBondContact O-N 3.18Å; G595-R601 PolarHBondContact O-NH1 2.8Å; G595-R601 PolarHBondContact O-NH2 2.89Å
596	S	89.8	Confident	94.2	Very high	117 Å²	117	24.2 Å²	24.2	82%	0.818	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.2	10	174.3	51.4	0	0	0	0	114.5	V594 D598	V594-S596 PolarHBondContact O-N 2.91Å; S596-D598 PolarHBondContact O-N 3.1Å
597	D	95.9	Very high	94.6	Very high	32 Å²	32	23.8 Å²	23.8	17%	0.171	14%	0.138	C	C	.	.			trans	-84.9	95.1	-177.8	-164	-39.4	0	0	0	111.7	V594 G595 I599 L600 R601 Y637	V594-D597 VanDerWaalsContact O-CB 3.32Å; V594-D597 WeakPolarHBondContact O-CB 3.45Å; V594-D597 PolarHBondContact O-N 3.06Å; G595-D597 VanDerWaalsContact C-N 3.29Å; G595-D597 PolarHBondContact O-N 3.18Å; D597-I599 VanDerWaalsContact C-N 3.32Å; D597-I599 PolarHBondContact O-N 2.67Å; D597-I599 PolarHBondContact OD1-N 2.89Å; D597-I599 VanDerWaalsContact OD1-N 3.11Å; D597-L600 HydrophobicContact CB-CB 3.75Å; D597-L600 HydrophobicContact CB-CD2 4.33Å; D597-L600 WeakPolarHBondContact O-CB 3.43Å; D597-L600 PolarHBondContact O-N 3.02Å; D597-L600 WeakPolarHBondContact OD1-CB 3.49Å; D597-L600 PolarHBondContact OD1-N 3.33Å; D597-R601 PolarHBondContact O-N 2.9Å; D597-Y637 PolarHBondContact OD1-OH 3.21Å; D597-Y637 VanDerWaalsContact OD2-CE1 3.31Å; D597-Y637 WeakPolarHBondContact OD2-CE1 3.44Å; D597-Y637 PolarHBondContact OD2-OH 3.3Å
598	D	96.8	Very high	94.8	Very high	25 Å²	25	24.2 Å²	24.2	13%	0.134	14%	0.139	C	C	.	.	H	α-helix	trans	-73	-20.9	179.9	-78.6	-5.5	0	0	0	113.9	V426 R430 F497 S596 L600 R601 M602	V426-D598 HydrophobicContact CG1-CB 3.62Å; V426-D598 HydrophobicContact CG2-CB 3.99Å; V426-D598 WeakPolarHBondContact CG2-O 3.45Å; R430-D598 IonicContact CZ-OD1 3.19Å; R430-D598 IonicContact CZ-OD2 2.91Å; R430-D598 IonicContact NE-OD2 3.37Å; R430-D598 PolarHBondContact NE-OD2 3.16Å; R430-D598 VanDerWaalsContact NH2-CG 3.27Å; R430-D598 IonicContact NH2-OD1 3.27Å; R430-D598 PolarHBondContact NH2-OD1 3.17Å; R430-D598 IonicContact NH2-OD2 3.01Å; R430-D598 PolarHBondContact NH2-OD2 2.96Å; F497-D598 HydrophobicContact CD1-CB 4.16Å; F497-D598 HydrophobicContact CE1-CB 3.85Å; S596-D598 PolarHBondContact O-N 3.1Å; D598-L600 VanDerWaalsContact C-N 3.34Å; D598-R601 WeakPolarHBondContact OD1-CD 3.48Å; D598-R601 IonicContact OD1-CZ 2.68Å; D598-R601 IonicContact OD1-NE 3.79Å; D598-R601 IonicContact OD1-NH1 2.86Å; D598-R601 PolarHBondContact OD1-NH1 2.85Å; D598-M602 VanDerWaalsContact O-CB 3.29Å; D598-M602 WeakPolarHBondContact O-CB 3.03Å; D598-M602 PolarHBondContact O-N 3.06Å
599	I	97.6	Very high	95.2	Very high	17 Å²	17	22.9 Å²	22.9	9%	0.087	13%	0.132	C	C	.	.	H	α-helix	trans	-72.5	-36.6	171.7	-59.2	-63	0	0	0	109.5	L419 L422 Q423 V426 D597 M602 S603 F633 Y637	L419-I599 HydrophobicContact CD1-CD1 4.45Å; L419-I599 HydrophobicContact CD1-CG1 4.4Å; L419-I599 HydrophobicContact CD1-CG2 3.89Å; L422-I599 HydrophobicContact CB-CD1 4.31Å; Q423-I599 HydrophobicContact CB-CD1 4.27Å; Q423-I599 HydrophobicContact CG-CD1 3.55Å; Q423-I599 HydrophobicContact CG-CG1 4.47Å; V426-I599 HydrophobicContact CG2-CD1 4.01Å; D597-I599 VanDerWaalsContact C-N 3.32Å; D597-I599 PolarHBondContact O-N 2.67Å; D597-I599 PolarHBondContact OD1-N 2.89Å; D597-I599 VanDerWaalsContact OD1-N 3.11Å; I599-M602 PolarHBondContact O-N 2.82Å; I599-S603 VanDerWaalsContact O-CB 3.31Å; I599-S603 WeakPolarHBondContact O-CB 3.23Å; I599-S603 PolarHBondContact O-N 2.74Å; I599-S603 PolarHBondContact O-OG 2.94Å; I599-F633 HydrophobicContact CG2-CE1 4.01Å; I599-F633 HydrophobicContact CG2-CZ 4.22Å; I599-Y637 HydrophobicContact CB-CE1 4.28Å; I599-Y637 HydrophobicContact CB-CE2 4.17Å; I599-Y637 HydrophobicContact CG2-CD2 4.04Å; I599-Y637 HydrophobicContact CG2-CE1 4.18Å; I599-Y637 HydrophobicContact CG2-CE2 3.61Å
600	L	96.9	Very high	95.4	Very high	9 Å²	9	20.9 Å²	20.9	5%	0.047	12%	0.123	C	C	.	.	H	α-helix	trans	-64.7	-46.1	171.6	-170.1	53.2	0	0	0	111.1	V594 D597 D598 S603 V604 L634 I638 I657	V594-L600 HydrophobicContact CB-CB 4.44Å; V594-L600 HydrophobicContact CB-CD2 4.12Å; V594-L600 HydrophobicContact CB-CG 4.09Å; V594-L600 HydrophobicContact CG1-CD2 4.31Å; V594-L600 HydrophobicContact CG1-CG 4Å; D597-L600 HydrophobicContact CB-CB 3.75Å; D597-L600 HydrophobicContact CB-CD2 4.33Å; D597-L600 WeakPolarHBondContact O-CB 3.43Å; D597-L600 PolarHBondContact O-N 3.02Å; D597-L600 WeakPolarHBondContact OD1-CB 3.49Å; D597-L600 PolarHBondContact OD1-N 3.33Å; D598-L600 VanDerWaalsContact C-N 3.34Å; L600-S603 PolarHBondContact O-N 3.29Å; L600-V604 WeakPolarHBondContact O-CG2 3.3Å; L600-V604 PolarHBondContact O-N 3.3Å; L600-V604 VanDerWaalsContact O-N 3.11Å; L600-L634 HydrophobicContact CD1-CD1 3.31Å; L600-I638 HydrophobicContact CD1-CD1 3.92Å; L600-I638 HydrophobicContact CD1-CG1 3.76Å; L600-I657 HydrophobicContact CD1-CD1 3.84Å; L600-I657 HydrophobicContact CD2-CD1 4.28Å; L600-I657 HydrophobicContact CG-CD1 4.24Å
601	R	97.1	Very high	95.3	Very high	15 Å²	15	21 Å²	21	6%	0.057	13%	0.125	C	C	.	.	H	α-helix	trans	-54.8	-52	169.9	-73.5	-174.1	175.8	72	14.3	112.3	S496 F497 D591 V594 G595 D597 D598 S603 V604 L605	S496-R601 PolarHBondContact O-NE 2.55Å; S496-R601 PolarHBondContact O-NH2 3.47Å; F497-R601 HydrophobicContact CD1-CB 4.33Å; F497-R601 HydrophobicContact CD2-CB 4.3Å; F497-R601 HydrophobicContact CE1-CB 3.72Å; F497-R601 HydrophobicContact CE1-CG 4.45Å; F497-R601 HydrophobicContact CE2-CB 3.7Å; F497-R601 HydrophobicContact CE2-CG 4.48Å; F497-R601 HydrophobicContact CZ-CB 3.38Å; F497-R601 HydrophobicContact CZ-CG 4.4Å; D591-R601 IonicContact OD1-NH2 3.32Å; V594-R601 HydrophobicContact CB-CG 4.29Å; V594-R601 HydrophobicContact CG2-CG 3.58Å; G595-R601 PolarHBondContact O-NH1 2.8Å; G595-R601 PolarHBondContact O-NH2 2.89Å; D597-R601 PolarHBondContact O-N 2.9Å; D598-R601 WeakPolarHBondContact OD1-CD 3.48Å; D598-R601 IonicContact OD1-CZ 2.68Å; D598-R601 IonicContact OD1-NE 3.79Å; D598-R601 IonicContact OD1-NH1 2.86Å; D598-R601 PolarHBondContact OD1-NH1 2.85Å; R601-S603 VanDerWaalsContact C-N 3.29Å; R601-S603 PolarHBondContact O-N 3.25Å; R601-V604 PolarHBondContact O-N 2.9Å; R601-V604 VanDerWaalsContact O-N 3.13Å; R601-L605 PolarHBondContact O-N 2.82Å
602	M	97.8	Very high	94.9	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-65.8	-33.2	-176	-168.2	62.8	-154.8	0	0	112.1	L422 C425 V426 I429 V464 L468 F497 D598 I599 L605 A606	L422-M602 HydrophobicContact CD2-CB 4.17Å; L422-M602 HydrophobicContact CD2-CG 3.53Å; C425-M602 HydrophobicContact CB-CE 3.71Å; C425-M602 HydrophobicContact CB-CG 4.04Å; C425-M602 HydrophobicContact CB-SD 4Å; V426-M602 HydrophobicContact CG2-CB 3.8Å; V426-M602 HydrophobicContact CG2-CG 4.28Å; I429-M602 HydrophobicContact CD1-SD 3.59Å; I429-M602 VanDerWaalsContact CD1-SD 3.59Å; V464-M602 HydrophobicContact CG1-CE 3.94Å; V464-M602 HydrophobicContact CG1-SD 4.47Å; L468-M602 HydrophobicContact CD1-CE 4.03Å; L468-M602 HydrophobicContact CD2-CE 3.85Å; L468-M602 HydrophobicContact CG-CE 4.22Å; F497-M602 HydrophobicContact CZ-CB 4.15Å; F497-M602 HydrophobicContact CZ-SD 4.38Å; D598-M602 VanDerWaalsContact O-CB 3.29Å; D598-M602 WeakPolarHBondContact O-CB 3.03Å; D598-M602 PolarHBondContact O-N 3.06Å; I599-M602 PolarHBondContact O-N 2.82Å; M602-L605 HydrophobicContact CE-CD2 3.97Å; M602-L605 PolarHBondContact O-N 3.05Å; M602-L605 HydrophobicContact SD-CB 4.49Å; M602-L605 HydrophobicContact SD-CD1 4.49Å; M602-L605 HydrophobicContact SD-CD2 4.38Å; M602-A606 WeakPolarHBondContact O-CB 3.3Å; M602-A606 PolarHBondContact O-N 3.25Å
603	S	97.5	Very high	93.9	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-63.8	-42.6	172.4	-59.9	0	0	0	0	111.8	I599 L600 R601 A606 I607 F633	I599-S603 VanDerWaalsContact O-CB 3.31Å; I599-S603 WeakPolarHBondContact O-CB 3.23Å; I599-S603 PolarHBondContact O-N 2.74Å; I599-S603 PolarHBondContact O-OG 2.94Å; L600-S603 PolarHBondContact O-N 3.29Å; R601-S603 VanDerWaalsContact C-N 3.29Å; R601-S603 PolarHBondContact O-N 3.25Å; S603-A606 PolarHBondContact O-N 3.44Å; S603-I607 VanDerWaalsContact O-CG1 3.28Å; S603-I607 WeakPolarHBondContact O-CG1 3.27Å; S603-I607 PolarHBondContact O-N 3.4Å; S603-F633 WeakPolarHBondContact OG-CE1 3.43Å
604	V	97.2	Very high	93.2	Very high	7 Å²	7	24.9 Å²	24.9	4%	0.042	16%	0.156	C	C	.	.	H	α-helix	trans	-65.8	-41.3	175.6	174.5	0	0	0	0	111.1	L493 L600 R601 I607 K608 I657 F661	L493-V604 HydrophobicContact CD1-CG1 4.05Å; L493-V604 HydrophobicContact CD2-CG1 3.81Å; L600-V604 WeakPolarHBondContact O-CG2 3.3Å; L600-V604 PolarHBondContact O-N 3.3Å; L600-V604 VanDerWaalsContact O-N 3.11Å; R601-V604 PolarHBondContact O-N 2.9Å; R601-V604 VanDerWaalsContact O-N 3.13Å; V604-I607 PolarHBondContact O-N 2.95Å; V604-K608 PolarHBondContact O-N 3.48Å; V604-I657 HydrophobicContact CG2-CG2 3.56Å; V604-F661 HydrophobicContact CG1-CE1 4.45Å; V604-F661 HydrophobicContact CG1-CE2 4.12Å; V604-F661 HydrophobicContact CG1-CZ 3.76Å
605	L	97.8	Very high	92.7	Very high	3 Å²	3	24.9 Å²	24.9	2%	0.016	16%	0.156	C	C	.	.	H	α-helix	trans	-61.2	-44.5	174.6	-167.6	156.8	0	0	0	111.8	V465 L490 L493 F497 R601 M602 K608 L609	V465-L605 HydrophobicContact CG1-CD2 4.28Å; L490-L605 HydrophobicContact CD2-CD2 3.87Å; L490-L605 HydrophobicContact CD2-CG 4Å; L493-L605 HydrophobicContact CB-CB 4.32Å; L493-L605 HydrophobicContact CB-CD1 4.26Å; L493-L605 HydrophobicContact CB-CG 4.27Å; L493-L605 HydrophobicContact CD1-CB 4.47Å; F497-L605 HydrophobicContact CE2-CD1 4.18Å; R601-L605 PolarHBondContact O-N 2.82Å; M602-L605 HydrophobicContact CE-CD2 3.97Å; M602-L605 PolarHBondContact O-N 3.05Å; M602-L605 HydrophobicContact SD-CB 4.49Å; M602-L605 HydrophobicContact SD-CD1 4.49Å; M602-L605 HydrophobicContact SD-CD2 4.38Å; L605-K608 WeakPolarHBondContact O-CB 3.48Å; L605-K608 PolarHBondContact O-N 3.11Å; L605-L609 PolarHBondContact O-N 3.02Å
606	A	97.9	Very high	92.4	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-63.5	-44.2	175.7	0	0	0	0	0	112.2	L468 M602 S603 K608 L609 F610 Y630	L468-A606 HydrophobicContact CD1-CB 4.24Å; M602-A606 WeakPolarHBondContact O-CB 3.3Å; M602-A606 PolarHBondContact O-N 3.25Å; S603-A606 PolarHBondContact O-N 3.44Å; A606-K608 VanDerWaalsContact C-N 3.26Å; A606-K608 PolarHBondContact O-N 2.77Å; A606-L609 WeakPolarHBondContact O-CB 3.44Å; A606-L609 PolarHBondContact O-N 3.14Å; A606-L609 VanDerWaalsContact O-N 3.16Å; A606-F610 VanDerWaalsContact O-CD2 3.24Å; A606-F610 WeakPolarHBondContact O-CD2 3.35Å; A606-F610 PolarHBondContact O-N 2.8Å; A606-Y630 HydrophobicContact CB-CD1 3.56Å; A606-Y630 HydrophobicContact CB-CD2 3.85Å; A606-Y630 HydrophobicContact CB-CE1 3.76Å; A606-Y630 HydrophobicContact CB-CE2 4.04Å; A606-Y630 HydrophobicContact CB-CG 3.63Å
607	I	97.4	Very high	92.3	Very high	3 Å²	3	25.5 Å²	25.5	2%	0.015	15%	0.145	C	C	.	.	H	α-helix	trans	-61.6	-36.2	175.1	-66.2	163.9	0	0	0	111.1	S603 V604 S611 R627 L634 F661	S603-I607 VanDerWaalsContact O-CG1 3.28Å; S603-I607 WeakPolarHBondContact O-CG1 3.27Å; S603-I607 PolarHBondContact O-N 3.4Å; V604-I607 PolarHBondContact O-N 2.95Å; I607-S611 PolarHBondContact O-OG 3.26Å; I607-R627 HydrophobicContact CG2-CG 4.42Å; I607-L634 HydrophobicContact CD1-CB 4.03Å; I607-L634 HydrophobicContact CD1-CD2 3.57Å; I607-L634 HydrophobicContact CD1-CG 4.36Å; I607-F661 HydrophobicContact CB-CE1 4.39Å; I607-F661 HydrophobicContact CB-CZ 3.88Å; I607-F661 HydrophobicContact CG2-CE1 3.95Å; I607-F661 HydrophobicContact CG2-CE2 4.29Å; I607-F661 HydrophobicContact CG2-CZ 3.56Å
608	K	96.8	Very high	91.8	Very high	12 Å²	12	30.6 Å²	30.6	5%	0.052	17%	0.172	C	C	.	.	H	α-helix	trans	-66	-43.1	173.7	179.7	52.5	-179.5	164.4	0	112.1	N486 L490 L493 V604 L605 A606 F610 S611 F661 L664 E668	N486-K608 VanDerWaalsContact CG-O 3.31Å; N486-K608 PolarHBondContact ND2-O 3.23Å; N486-K608 WeakPolarHBondContact OD1-CE 3.26Å; N486-K608 PolarHBondContact OD1-NZ 3.02Å; N486-K608 PolarHBondContact OD1-O 3.24Å; L490-K608 HydrophobicContact CD2-CB 4.19Å; L490-K608 HydrophobicContact CD2-CG 4Å; L490-K608 HydrophobicContact CG-CG 4.47Å; L493-K608 HydrophobicContact CD1-CB 3.55Å; L493-K608 HydrophobicContact CD1-CG 3.9Å; V604-K608 PolarHBondContact O-N 3.48Å; L605-K608 WeakPolarHBondContact O-CB 3.48Å; L605-K608 PolarHBondContact O-N 3.11Å; A606-K608 VanDerWaalsContact C-N 3.26Å; A606-K608 PolarHBondContact O-N 2.77Å; K608-F610 PolarHBondContact O-N 3.26Å; K608-S611 WeakPolarHBondContact O-CB 3.49Å; K608-S611 PolarHBondContact O-N 2.89Å; K608-S611 VanDerWaalsContact O-N 3.13Å; K608-F661 HydrophobicContact CB-CE1 3.96Å; K608-L664 HydrophobicContact CD-CD2 4.14Å; K608-L664 HydrophobicContact CG-CD2 4.19Å; K608-E668 WeakPolarHBondContact CE-OE1 3.41Å; K608-E668 IonicContact NZ-OE1 2.67Å; K608-E668 PolarHBondContact NZ-OE1 2.86Å; K608-E668 IonicContact NZ-OE2 2.7Å; K608-E668 PolarHBondContact NZ-OE2 2.95Å
609	L	97.3	Very high	91.4	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-56.4	-47.5	179.4	178.8	64.3	0	0	0	111.9	V465 L468 F471 L482 L483 N486 L490 L605 A606 S611	V465-L609 HydrophobicContact CB-CD2 3.75Å; V465-L609 HydrophobicContact CG1-CD2 3.79Å; V465-L609 HydrophobicContact CG2-CD2 4.42Å; L468-L609 HydrophobicContact CD1-CD2 3.78Å; F471-L609 HydrophobicContact CD2-CD1 4.44Å; F471-L609 HydrophobicContact CD2-CD2 3.65Å; F471-L609 HydrophobicContact CD2-CG 4.25Å; F471-L609 HydrophobicContact CE2-CD1 4.13Å; F471-L609 HydrophobicContact CE2-CD2 4.13Å; F471-L609 HydrophobicContact CE2-CG 4.43Å; F471-L609 HydrophobicContact CG-CD2 4.36Å; L482-L609 HydrophobicContact CB-CD1 4.23Å; L482-L609 WeakPolarHBondContact CD2-O 3.4Å; L483-L609 HydrophobicContact CD2-CD1 4.36Å; N486-L609 PolarHBondContact ND2-O 3.44Å; L490-L609 HydrophobicContact CD1-CD1 3.77Å; L490-L609 HydrophobicContact CD2-CB 4.09Å; L605-L609 PolarHBondContact O-N 3.02Å; A606-L609 WeakPolarHBondContact O-CB 3.44Å; A606-L609 PolarHBondContact O-N 3.14Å; A606-L609 VanDerWaalsContact O-N 3.16Å; L609-S611 PolarHBondContact O-N 3.39Å
610	F	96.3	Very high	91.1	Very high	2 Å²	2	34.5 Å²	34.5	1%	0.009	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	22.2	179.7	-60.7	-77.8	0	0	0	114.1	F471 V474 L482 A606 K608 V623 A626 R627 Y630	F471-F610 HydrophobicContact CB-CZ 3.88Å; F471-F610 HydrophobicContact CD2-CE1 4.38Å; F471-F610 HydrophobicContact CD2-CZ 4.23Å; V474-F610 HydrophobicContact CG1-CD1 4.43Å; V474-F610 HydrophobicContact CG1-CE1 4.04Å; V474-F610 HydrophobicContact CG2-CE1 4.32Å; L482-F610 HydrophobicContact CD1-CD1 3.5Å; L482-F610 HydrophobicContact CD1-CE1 3.77Å; L482-F610 HydrophobicContact CD1-CG 4.42Å; A606-F610 VanDerWaalsContact O-CD2 3.24Å; A606-F610 WeakPolarHBondContact O-CD2 3.35Å; A606-F610 PolarHBondContact O-N 2.8Å; K608-F610 PolarHBondContact O-N 3.26Å; F610-V623 HydrophobicContact CB-CG1 4.28Å; F610-V623 HydrophobicContact CD1-CG1 4.44Å; F610-A626 HydrophobicContact CB-CB 4.37Å; F610-A626 HydrophobicContact CD1-CB 3.46Å; F610-A626 VanDerWaalsContact CD1-CB 3.46Å; F610-A626 HydrophobicContact CD2-CB 4.07Å; F610-A626 HydrophobicContact CE1-CB 3.67Å; F610-A626 HydrophobicContact CE2-CB 4.28Å; F610-A626 HydrophobicContact CG-CB 3.69Å; F610-A626 HydrophobicContact CZ-CB 4.08Å; F610-R627 HydrophobicContact CB-CB 3.78Å; F610-R627 HydrophobicContact CB-CG 4.38Å; F610-R627 WeakPolarHBondContact O-CD 3.44Å; F610-Y630 AromaticContact CD2-CD2 3.86Å; F610-Y630 HydrophobicContact CD2-CD2 3.86Å; F610-Y630 AromaticContact CD2-CE2 3.85Å; F610-Y630 HydrophobicContact CD2-CE2 3.85Å; F610-Y630 AromaticContact CE2-CD2 3.94Å; F610-Y630 HydrophobicContact CE2-CD2 3.94Å; F610-Y630 AromaticContact CE2-CE2 3.43Å; F610-Y630 HydrophobicContact CE2-CE2 3.43Å; F610-Y630 VanDerWaalsContact CE2-CE2 3.43Å; F610-Y630 HydrophobicContact CZ-CE2 4.35Å
611	S	90.1	Very high	90.8	Very high	18 Å²	18	38 Å²	38	13%	0.126	21%	0.21	C	C	.	.			trans	-103.4	79.1	175.6	-66.8	0	0	0	0	111.4	N486 I607 K608 L609 R627	N486-S611 PolarHBondContact ND2-O 3.26Å; N486-S611 PolarHBondContact OD1-O 3.32Å; N486-S611 VanDerWaalsContact OD1-O 3.1Å; I607-S611 PolarHBondContact O-OG 3.26Å; K608-S611 WeakPolarHBondContact O-CB 3.49Å; K608-S611 PolarHBondContact O-N 2.89Å; K608-S611 VanDerWaalsContact O-N 3.13Å; L609-S611 PolarHBondContact O-N 3.39Å; S611-R627 PolarHBondContact OG-NE 3Å; S611-R627 VanDerWaalsContact OG-NE 3.13Å; S611-R627 PolarHBondContact OG-NH2 3.11Å
612	D	82.1	Confident	90.6	Very high	12 Å²	12	39.7 Å²	39.7	6%	0.064	22%	0.223	C	C	.	.			trans	-131.6	124.1	170.2	-166.9	-15.5	0	0	0	110.5	S481 L482 T485 S614 L615	S481-D612 PolarHBondContact OG-OD2 3.08Å; L482-D612 HydrophobicContact CD2-CB 3.6Å; T485-D612 VanDerWaalsContact CB-OD2 3.3Å; T485-D612 WeakPolarHBondContact CB-OD2 3.44Å; T485-D612 HydrophobicContact CG2-CB 4.33Å; T485-D612 PolarHBondContact OG1-OD2 3.31Å; D612-S614 WeakPolarHBondContact OD1-CB 3.09Å; D612-S614 PolarHBondContact OD1-N 2.93Å; D612-S614 PolarHBondContact OD1-OG 3.34Å; D612-L615 HydrophobicContact CB-CD1 4.03Å; D612-L615 HydrophobicContact CB-CG 4.13Å
613	N	71.6	Confident	90.4	Very high	119 Å²	119	39.9 Å²	39.9	64%	0.636	22%	0.224	S	C	*	.	S	Bend	trans	-100.1	-7.5	179.4	-69.9	14.6	0	0	0	112.5
614	S	79.9	Confident	90.2	Very high	92 Å²	92	46.2 Å²	46.2	64%	0.643	25%	0.252	S	S	*	.	S	Bend	trans	-94.3	-6.7	-174.5	66.7	0	0	0	0	114.5	D612	D612-S614 WeakPolarHBondContact OD1-CB 3.09Å; D612-S614 PolarHBondContact OD1-N 2.93Å; D612-S614 PolarHBondContact OD1-OG 3.34Å
615	L	83.5	Confident	89.9	Confident	10 Å²	10	48.4 Å²	48.4	5%	0.052	27%	0.271	C	S	.	.	S	Bend	trans	-56.2	146.2	172.1	-72.7	168.5	0	0	0	112.8	L482 D612 L619 R620 V623	L482-L615 HydrophobicContact CD2-CD1 4.04Å; D612-L615 HydrophobicContact CB-CD1 4.03Å; D612-L615 HydrophobicContact CB-CG 4.13Å; L615-L619 HydrophobicContact CB-CB 4.36Å; L615-L619 HydrophobicContact CD2-CB 4.25Å; L615-L619 HydrophobicContact CD2-CD1 4.22Å; L615-R620 HydrophobicContact CB-CG 3.89Å; L615-R620 WeakPolarHBondContact O-CD 3.49Å; L615-R620 WeakPolarHBondContact O-CG 3.36Å; L615-V623 HydrophobicContact CD1-CB 4.03Å; L615-V623 HydrophobicContact CD1-CG1 3.92Å; L615-V623 HydrophobicContact CD1-CG2 3.72Å
616	S	84	Confident	89.8	Confident	62 Å²	62	48.3 Å²	48.3	43%	0.434	27%	0.27	S	S	.	.			trans	-57.6	150.2	170.3	58.5	0	0	0	0	111.6	D618 L619 R620	S616-D618 PolarHBondContact O-N 3.42Å; S616-D618 VanDerWaalsContact O-N 3.1Å; S616-L619 PolarHBondContact O-N 2.73Å; S616-L619 WeakPolarHBondContact OG-CG 3.28Å; S616-R620 VanDerWaalsContact O-CG 3.22Å; S616-R620 WeakPolarHBondContact O-CG 3.33Å; S616-R620 PolarHBondContact O-N 2.98Å
617	E	86	Confident	89.7	Confident	98 Å²	98	52.1 Å²	52.1	46%	0.458	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-48.4	-41.3	-176.1	-76.8	-77.4	-8.3	0	0	112.5	K325 L619 R620 P621	K325-E617 IonicContact NZ-OE2 2.96Å; K325-E617 PolarHBondContact NZ-OE2 3.35Å; E617-L619 VanDerWaalsContact C-N 3.34Å; E617-L619 PolarHBondContact O-N 2.96Å; E617-R620 VanDerWaalsContact CD-CZ 3.45Å; E617-R620 PolarHBondContact O-N 3.18Å; E617-R620 IonicContact OE1-CZ 3.82Å; E617-R620 IonicContact OE1-NH1 2.84Å; E617-R620 PolarHBondContact OE1-NH1 2.99Å; E617-R620 IonicContact OE1-NH2 3.23Å; E617-R620 IonicContact OE2-CZ 3.39Å; E617-R620 IonicContact OE2-NH1 3.97Å; E617-R620 PolarHBondContact OE2-NH1 3.18Å; E617-R620 IonicContact OE2-NH2 2.64Å; E617-R620 PolarHBondContact OE2-NH2 2.94Å; E617-P621 WeakPolarHBondContact O-CD 3.4Å
618	D	87.1	Confident	89.5	Confident	139 Å²	139	56.5 Å²	56.5	74%	0.743	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-67.4	-29.6	-177.8	-42.6	-71.2	0	0	0	113.8	S616	S616-D618 PolarHBondContact O-N 3.42Å; S616-D618 VanDerWaalsContact O-N 3.1Å
619	L	88.5	Confident	89.4	Confident	41 Å²	41	56.9 Å²	56.9	22%	0.215	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-89.3	-15.8	-178.2	-62.9	179.6	0	0	0	113	P477 A478 L615 S616 E617 P622 V623	P477-L619 HydrophobicContact CB-CD1 4.05Å; A478-L619 HydrophobicContact CB-CB 4.48Å; A478-L619 HydrophobicContact CB-CD1 4.44Å; A478-L619 HydrophobicContact CB-CD2 4.42Å; L615-L619 HydrophobicContact CB-CB 4.36Å; L615-L619 HydrophobicContact CD2-CB 4.25Å; L615-L619 HydrophobicContact CD2-CD1 4.22Å; S616-L619 PolarHBondContact O-N 2.73Å; S616-L619 WeakPolarHBondContact OG-CG 3.28Å; E617-L619 VanDerWaalsContact C-N 3.34Å; E617-L619 PolarHBondContact O-N 2.96Å; L619-P622 WeakPolarHBondContact O-CD 3.47Å; L619-V623 WeakPolarHBondContact O-CG2 3.35Å
620	R	90.2	Very high	89.4	Confident	83 Å²	83	56.9 Å²	56.9	31%	0.313	31%	0.31	S	S	.	.	H	α-helix	trans	-69.5	-39.8	-177.2	-50.6	-148.5	-57.3	-96.4	169.8	114.5	L615 S616 E617 V623 F624	L615-R620 HydrophobicContact CB-CG 3.89Å; L615-R620 WeakPolarHBondContact O-CD 3.49Å; L615-R620 WeakPolarHBondContact O-CG 3.36Å; S616-R620 VanDerWaalsContact O-CG 3.22Å; S616-R620 WeakPolarHBondContact O-CG 3.33Å; S616-R620 PolarHBondContact O-N 2.98Å; E617-R620 VanDerWaalsContact CD-CZ 3.45Å; E617-R620 PolarHBondContact O-N 3.18Å; E617-R620 IonicContact OE1-CZ 3.82Å; E617-R620 IonicContact OE1-NH1 2.84Å; E617-R620 PolarHBondContact OE1-NH1 2.99Å; E617-R620 IonicContact OE1-NH2 3.23Å; E617-R620 IonicContact OE2-CZ 3.39Å; E617-R620 IonicContact OE2-NH1 3.97Å; E617-R620 PolarHBondContact OE2-NH1 3.18Å; E617-R620 IonicContact OE2-NH2 2.64Å; E617-R620 PolarHBondContact OE2-NH2 2.94Å; R620-V623 PolarHBondContact O-N 3.02Å; R620-F624 WeakPolarHBondContact O-CB 3.49Å; R620-F624 PolarHBondContact O-N 3.07Å
621	P	91.5	Very high	89.4	Confident	82 Å²	82	58 Å²	58	53%	0.532	32%	0.318	S	S	.	.	H	α-helix	trans	-56.8	-50.6	-177.5	-26.2	33.9	0	0	0	115.6	E617 F624 A625	E617-P621 WeakPolarHBondContact O-CD 3.4Å; P621-F624 PolarHBondContact O-N 3.35Å; P621-A625 PolarHBondContact O-N 2.68Å
622	P	91.8	Very high	89.6	Confident	51 Å²	51	60.6 Å²	60.6	33%	0.331	33%	0.33	S	S	.	.	H	α-helix	trans	-69.2	-34.9	-179.9	29.5	-36.5	0	0	0	111.9	V474 L619 A625 A626	V474-P622 HydrophobicContact CG1-CB 4.06Å; V474-P622 HydrophobicContact CG1-CG 4.47Å; L619-P622 WeakPolarHBondContact O-CD 3.47Å; P622-A625 PolarHBondContact O-N 2.91Å; P622-A626 WeakPolarHBondContact O-CB 3.06Å; P622-A626 PolarHBondContact O-N 3.14Å
623	V	94	Very high	90.3	Very high	4 Å²	4	60.4 Å²	60.4	2%	0.024	33%	0.328	C	S	.	.	H	α-helix	trans	-64.5	-42.3	174.7	171.3	0	0	0	0	111.6	V474 A478 L482 F610 L615 L619 R620 A626 R627	V474-V623 HydrophobicContact CB-CG2 4.08Å; V474-V623 HydrophobicContact CG1-CG2 3.77Å; A478-V623 HydrophobicContact CB-CG2 4.18Å; L482-V623 HydrophobicContact CD1-CG1 4.46Å; L482-V623 HydrophobicContact CD1-CG2 4.1Å; L482-V623 HydrophobicContact CD2-CG1 3.79Å; L482-V623 HydrophobicContact CD2-CG2 4.28Å; L482-V623 HydrophobicContact CG-CG2 4.48Å; F610-V623 HydrophobicContact CB-CG1 4.28Å; F610-V623 HydrophobicContact CD1-CG1 4.44Å; L615-V623 HydrophobicContact CD1-CB 4.03Å; L615-V623 HydrophobicContact CD1-CG1 3.92Å; L615-V623 HydrophobicContact CD1-CG2 3.72Å; L619-V623 WeakPolarHBondContact O-CG2 3.35Å; R620-V623 PolarHBondContact O-N 3.02Å; V623-A626 PolarHBondContact O-N 2.92Å; V623-R627 WeakPolarHBondContact O-CB 3.38Å; V623-R627 PolarHBondContact O-N 3.45Å
624	F	92.8	Very high	91.5	Very high	132 Å²	132	54.7 Å²	54.7	58%	0.579	30%	0.298	S	S	*	.	H	α-helix	trans	-64.1	-41.9	175.1	-180	-91.8	0	0	0	111.8	R620 P621 R627 Q628	R620-F624 WeakPolarHBondContact O-CB 3.49Å; R620-F624 PolarHBondContact O-N 3.07Å; P621-F624 PolarHBondContact O-N 3.35Å; F624-R627 PolarHBondContact O-N 3.16Å; F624-Q628 WeakPolarHBondContact O-CB 3.44Å; F624-Q628 PolarHBondContact O-N 3.27Å
625	A	92	Very high	92.2	Very high	53 Å²	53	51.4 Å²	51.4	44%	0.438	27%	0.271	S	S	.	.	H	α-helix	trans	-61.7	-46.7	175.4	0	0	0	0	0	111.7	P621 P622 R627 Q628 A629	P621-A625 PolarHBondContact O-N 2.68Å; P622-A625 PolarHBondContact O-N 2.91Å; A625-R627 PolarHBondContact O-N 3.25Å; A625-Q628 PolarHBondContact O-N 3.28Å; A625-A629 PolarHBondContact O-N 2.98Å
626	A	94.9	Very high	92.7	Very high	1 Å²	1	52.9 Å²	52.9	1%	0.008	28%	0.279	C	S	.	.	H	α-helix	trans	-57.3	-49.6	174.8	0	0	0	0	0	112.1	Y470 F610 P622 V623 Q628 A629 Y630	Y470-A626 HydrophobicContact CG-CB 4.05Å; F610-A626 HydrophobicContact CB-CB 4.37Å; F610-A626 HydrophobicContact CD1-CB 3.46Å; F610-A626 VanDerWaalsContact CD1-CB 3.46Å; F610-A626 HydrophobicContact CD2-CB 4.07Å; F610-A626 HydrophobicContact CE1-CB 3.67Å; F610-A626 HydrophobicContact CE2-CB 4.28Å; F610-A626 HydrophobicContact CG-CB 3.69Å; F610-A626 HydrophobicContact CZ-CB 4.08Å; P622-A626 WeakPolarHBondContact O-CB 3.06Å; P622-A626 PolarHBondContact O-N 3.14Å; V623-A626 PolarHBondContact O-N 2.92Å; A626-Q628 VanDerWaalsContact C-N 3.31Å; A626-Q628 PolarHBondContact O-N 3.05Å; A626-A629 PolarHBondContact O-N 3.41Å; A626-Y630 VanDerWaalsContact O-CD2 3.23Å; A626-Y630 WeakPolarHBondContact O-CD2 3.28Å; A626-Y630 PolarHBondContact O-N 3.14Å; A626-Y630 VanDerWaalsContact O-N 3.13Å
627	R	96	Very high	93.3	Very high	80 Å²	80	50.5 Å²	50.5	30%	0.302	26%	0.261	S	S	.	.	H	α-helix	trans	-58.7	-42.2	176.2	-167.9	-174.5	-178.8	176.5	1.7	111.8	I607 F610 S611 V623 F624 A625 T631	I607-R627 HydrophobicContact CG2-CG 4.42Å; F610-R627 HydrophobicContact CB-CB 3.78Å; F610-R627 HydrophobicContact CB-CG 4.38Å; F610-R627 WeakPolarHBondContact O-CD 3.44Å; S611-R627 PolarHBondContact OG-NE 3Å; S611-R627 VanDerWaalsContact OG-NE 3.13Å; S611-R627 PolarHBondContact OG-NH2 3.11Å; V623-R627 WeakPolarHBondContact O-CB 3.38Å; V623-R627 PolarHBondContact O-N 3.45Å; F624-R627 PolarHBondContact O-N 3.16Å; A625-R627 PolarHBondContact O-N 3.25Å; R627-T631 VanDerWaalsContact O-CB 3.32Å; R627-T631 WeakPolarHBondContact O-CB 3.03Å; R627-T631 PolarHBondContact O-N 3.03Å; R627-T631 PolarHBondContact O-OG1 2.91Å
628	Q	94.1	Very high	93.7	Very high	95 Å²	95	46.3 Å²	46.3	44%	0.444	24%	0.241	S	C	.	.	H	α-helix	trans	-65.5	-41	177.6	-177.2	170.1	97.5	0	0	111.7	F624 A625 A626 T631 L632	F624-Q628 WeakPolarHBondContact O-CB 3.44Å; F624-Q628 PolarHBondContact O-N 3.27Å; A625-Q628 PolarHBondContact O-N 3.28Å; A626-Q628 VanDerWaalsContact C-N 3.31Å; A626-Q628 PolarHBondContact O-N 3.05Å; Q628-T631 PolarHBondContact O-N 3.39Å; Q628-L632 HydrophobicContact CG-CD1 4Å; Q628-L632 HydrophobicContact CG-CG 4.37Å; Q628-L632 WeakPolarHBondContact O-CB 3.47Å; Q628-L632 WeakPolarHBondContact O-CG 3.42Å; Q628-L632 PolarHBondContact O-N 2.86Å
629	A	94.7	Very high	94	Very high	20 Å²	20	40.9 Å²	40.9	17%	0.165	21%	0.211	C	C	.	.	H	α-helix	trans	-59.4	-51.2	176.6	0	0	0	0	0	111.9	Y470 A625 A626 T631 L632 F633	Y470-A629 HydrophobicContact CD2-CB 4.28Å; Y470-A629 HydrophobicContact CE1-CB 4.26Å; Y470-A629 HydrophobicContact CE2-CB 3.53Å; A625-A629 PolarHBondContact O-N 2.98Å; A626-A629 PolarHBondContact O-N 3.41Å; A629-T631 VanDerWaalsContact C-N 3.31Å; A629-T631 PolarHBondContact O-N 2.93Å; A629-L632 PolarHBondContact O-N 3.48Å; A629-F633 WeakPolarHBondContact O-CB 3.25Å; A629-F633 PolarHBondContact O-N 3.32Å
630	Y	97.1	Very high	94.3	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-64.7	-32.9	175.7	-69.5	-70.1	0	0	0	113.1	L418 L422 L468 Y470 A606 F610 A626 F633 L634	L418-Y630 HydrophobicContact CD1-CE1 3.66Å; L418-Y630 HydrophobicContact CD2-CD1 4.23Å; L418-Y630 HydrophobicContact CD2-CE1 4.16Å; L418-Y630 HydrophobicContact CG-CE1 4.15Å; L422-Y630 HydrophobicContact CD1-CE1 4.42Å; L422-Y630 HydrophobicContact CD2-CE1 4.06Å; L422-Y630 HydrophobicContact CG-CE1 4.46Å; L468-Y630 WeakPolarHBondContact CB-OH 3.4Å; L468-Y630 HydrophobicContact CD2-CE1 4.28Å; Y470-Y630 HydrophobicContact CD2-CD2 4.31Å; Y470-Y630 AromaticContact CD2-CE2 3.54Å; Y470-Y630 HydrophobicContact CD2-CE2 3.54Å; Y470-Y630 AromaticContact CD2-CZ 3.74Å; Y470-Y630 HydrophobicContact CE2-CE2 4.35Å; Y470-Y630 HydrophobicContact CG-CE2 4.37Å; A606-Y630 HydrophobicContact CB-CD1 3.56Å; A606-Y630 HydrophobicContact CB-CD2 3.85Å; A606-Y630 HydrophobicContact CB-CE1 3.76Å; A606-Y630 HydrophobicContact CB-CE2 4.04Å; A606-Y630 HydrophobicContact CB-CG 3.63Å; F610-Y630 AromaticContact CD2-CD2 3.86Å; F610-Y630 HydrophobicContact CD2-CD2 3.86Å; F610-Y630 AromaticContact CD2-CE2 3.85Å; F610-Y630 HydrophobicContact CD2-CE2 3.85Å; F610-Y630 AromaticContact CE2-CD2 3.94Å; F610-Y630 HydrophobicContact CE2-CD2 3.94Å; F610-Y630 AromaticContact CE2-CE2 3.43Å; F610-Y630 HydrophobicContact CE2-CE2 3.43Å; F610-Y630 VanDerWaalsContact CE2-CE2 3.43Å; F610-Y630 HydrophobicContact CZ-CE2 4.35Å; A626-Y630 VanDerWaalsContact O-CD2 3.23Å; A626-Y630 WeakPolarHBondContact O-CD2 3.28Å; A626-Y630 PolarHBondContact O-N 3.14Å; A626-Y630 VanDerWaalsContact O-N 3.13Å; Y630-F633 PolarHBondContact O-N 2.97Å; Y630-L634 VanDerWaalsContact O-CB 3.31Å; Y630-L634 WeakPolarHBondContact O-CB 3.34Å; Y630-L634 PolarHBondContact O-N 3.4Å
631	T	95.7	Very high	94.4	Very high	27 Å²	27	43.4 Å²	43.4	17%	0.166	22%	0.22	C	C	.	.	H	α-helix	trans	-67.8	-39.2	176	-57.7	0	0	0	0	112	R627 Q628 A629 W635 Y654	R627-T631 VanDerWaalsContact O-CB 3.32Å; R627-T631 WeakPolarHBondContact O-CB 3.03Å; R627-T631 PolarHBondContact O-N 3.03Å; R627-T631 PolarHBondContact O-OG1 2.91Å; Q628-T631 PolarHBondContact O-N 3.39Å; A629-T631 VanDerWaalsContact C-N 3.31Å; A629-T631 PolarHBondContact O-N 2.93Å; T631-W635 PolarHBondContact O-N 2.84Å; T631-W635 VanDerWaalsContact O-N 3.13Å; T631-Y654 HydrophobicContact CG2-CE2 4.49Å; T631-Y654 VanDerWaalsContact CG2-OH 3.22Å; T631-Y654 WeakPolarHBondContact CG2-OH 3.41Å
632	L	94.6	Very high	94.4	Very high	72 Å²	72	40.2 Å²	40.2	38%	0.377	20%	0.201	S	C	.	.	H	α-helix	trans	-71.4	-37.5	173.9	-70.5	172	0	0	0	112.1	P332 Q628 A629 W635 N636	P332-L632 HydrophobicContact CB-CD2 3.89Å; Q628-L632 HydrophobicContact CG-CD1 4Å; Q628-L632 HydrophobicContact CG-CG 4.37Å; Q628-L632 WeakPolarHBondContact O-CB 3.47Å; Q628-L632 WeakPolarHBondContact O-CG 3.42Å; Q628-L632 PolarHBondContact O-N 2.86Å; A629-L632 PolarHBondContact O-N 3.48Å; L632-W635 PolarHBondContact O-N 3.38Å; L632-N636 WeakPolarHBondContact O-CB 3.48Å; L632-N636 PolarHBondContact O-N 2.91Å; L632-N636 PolarHBondContact O-ND2 2.93Å
633	F	96.4	Very high	94.3	Very high	7 Å²	7	38.9 Å²	38.9	3%	0.031	20%	0.196	C	C	.	.	H	α-helix	trans	-58.2	-52.3	171.2	-179.2	-85	0	0	0	110.7	P414 D415 L418 L419 L422 I599 S603 A629 Y630 W635 N636 Y637	P414-F633 HydrophobicContact CB-CD2 4.02Å; P414-F633 HydrophobicContact CB-CE2 3.57Å; P414-F633 HydrophobicContact CB-CZ 3.99Å; D415-F633 HydrophobicContact CB-CD2 4.42Å; L418-F633 HydrophobicContact CB-CD2 4.01Å; L418-F633 HydrophobicContact CB-CE2 4.14Å; L418-F633 HydrophobicContact CD2-CB 3.95Å; L418-F633 HydrophobicContact CD2-CD2 3.77Å; L418-F633 HydrophobicContact CD2-CG 4.04Å; L418-F633 HydrophobicContact CG-CD2 3.96Å; L418-F633 HydrophobicContact CG-CE2 4.32Å; L418-F633 HydrophobicContact CG-CG 4.49Å; L419-F633 HydrophobicContact CB-CE2 3.93Å; L419-F633 HydrophobicContact CB-CZ 4Å; L419-F633 HydrophobicContact CD1-CZ 4.02Å; L422-F633 HydrophobicContact CD1-CD1 3.75Å; L422-F633 HydrophobicContact CD1-CD2 4.44Å; L422-F633 HydrophobicContact CD1-CE1 3.35Å; L422-F633 HydrophobicContact CD1-CE2 4.07Å; L422-F633 HydrophobicContact CD1-CG 4.3Å; L422-F633 HydrophobicContact CD1-CZ 3.53Å; I599-F633 HydrophobicContact CG2-CE1 4.01Å; I599-F633 HydrophobicContact CG2-CZ 4.22Å; S603-F633 WeakPolarHBondContact OG-CE1 3.43Å; A629-F633 WeakPolarHBondContact O-CB 3.25Å; A629-F633 PolarHBondContact O-N 3.32Å; Y630-F633 PolarHBondContact O-N 2.97Å; F633-W635 VanDerWaalsContact C-N 3.33Å; F633-W635 PolarHBondContact O-N 2.88Å; F633-N636 PolarHBondContact O-N 2.89Å; F633-N636 VanDerWaalsContact O-N 3.15Å; F633-Y637 HydrophobicContact CE1-CD2 4.05Å; F633-Y637 HydrophobicContact CE1-CG 4.14Å; F633-Y637 HydrophobicContact CZ-CD2 4.05Å; F633-Y637 VanDerWaalsContact O-CB 3.22Å; F633-Y637 WeakPolarHBondContact O-CB 3.32Å; F633-Y637 PolarHBondContact O-N 2.79Å
634	L	96.3	Very high	93.8	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-52.7	-48.9	177	178.3	70.7	0	0	0	111.7	L600 I607 Y630 N636 Y637 I638 Y654 I657	L600-L634 HydrophobicContact CD1-CD1 3.31Å; I607-L634 HydrophobicContact CD1-CB 4.03Å; I607-L634 HydrophobicContact CD1-CD2 3.57Å; I607-L634 HydrophobicContact CD1-CG 4.36Å; Y630-L634 VanDerWaalsContact O-CB 3.31Å; Y630-L634 WeakPolarHBondContact O-CB 3.34Å; Y630-L634 PolarHBondContact O-N 3.4Å; L634-N636 PolarHBondContact O-N 3.38Å; L634-Y637 PolarHBondContact O-N 3.45Å; L634-I638 HydrophobicContact CD1-CD1 3.75Å; L634-I638 HydrophobicContact CD1-CG1 4.28Å; L634-I638 HydrophobicContact CG-CD1 3.89Å; L634-I638 VanDerWaalsContact O-CG1 3.28Å; L634-I638 WeakPolarHBondContact O-CG1 3.32Å; L634-I638 PolarHBondContact O-N 2.97Å; L634-Y654 HydrophobicContact CD2-CD2 3.98Å; L634-Y654 HydrophobicContact CD2-CE2 3.96Å; L634-Y654 HydrophobicContact CG-CD2 4.05Å; L634-Y654 HydrophobicContact CG-CE2 4.21Å; L634-I657 HydrophobicContact CD2-CG2 4.05Å
635	W	95	Very high	93.3	Very high	23 Å²	23	46.8 Å²	46.8	9%	0.087	24%	0.242	C	C	.	.	H	α-helix	trans	-59.3	-45.7	177.4	173.6	-112.6	0	0	0	113	M331 P332 T631 L632 F633 R639 T651 Y654	M331-W635 HydrophobicContact CE-CH2 4.36Å; M331-W635 HydrophobicContact CE-CZ3 4.41Å; P332-W635 HydrophobicContact CG-CB 4.44Å; P332-W635 HydrophobicContact CG-CD2 3.86Å; P332-W635 HydrophobicContact CG-CG 3.73Å; P332-W635 HydrophobicContact CG-CZ2 4.46Å; T631-W635 PolarHBondContact O-N 2.84Å; T631-W635 VanDerWaalsContact O-N 3.13Å; L632-W635 PolarHBondContact O-N 3.38Å; F633-W635 VanDerWaalsContact C-N 3.33Å; F633-W635 PolarHBondContact O-N 2.88Å; W635-R639 WeakPolarHBondContact O-CB 3.24Å; W635-R639 WeakPolarHBondContact O-CD 3.42Å; W635-R639 WeakPolarHBondContact O-CG 3.33Å; W635-R639 PolarHBondContact O-N 2.88Å; W635-T651 HydrophobicContact CH2-CG2 3.99Å; W635-T651 HydrophobicContact CZ3-CG2 4.11Å; W635-Y654 HydrophobicContact CB-CD2 4.18Å; W635-Y654 HydrophobicContact CB-CE2 3.8Å; W635-Y654 AromaticContact CE3-CD1 3.61Å; W635-Y654 HydrophobicContact CE3-CD1 3.61Å; W635-Y654 AromaticContact CE3-CD2 3.92Å; W635-Y654 HydrophobicContact CE3-CD2 3.92Å; W635-Y654 AromaticContact CE3-CE1 3.97Å; W635-Y654 HydrophobicContact CE3-CE1 3.97Å; W635-Y654 HydrophobicContact CE3-CE2 4.25Å; W635-Y654 AromaticContact CE3-CG 3.58Å; W635-Y654 HydrophobicContact CE3-CG 3.58Å; W635-Y654 AromaticContact CZ3-CD1 3.84Å; W635-Y654 HydrophobicContact CZ3-CD1 3.84Å; W635-Y654 HydrophobicContact CZ3-CE1 4.41Å; W635-Y654 HydrophobicContact CZ3-CG 4.05Å
636	N	94.4	Very high	93.2	Very high	40 Å²	40	50.6 Å²	50.6	21%	0.214	25%	0.245	C	C	.	.	H	α-helix	trans	-72	-40.4	-179.7	-71.6	-21.2	0	0	0	111.8	L632 F633 L634 R639 W640	L632-N636 WeakPolarHBondContact O-CB 3.48Å; L632-N636 PolarHBondContact O-N 2.91Å; L632-N636 PolarHBondContact O-ND2 2.93Å; F633-N636 PolarHBondContact O-N 2.89Å; F633-N636 VanDerWaalsContact O-N 3.15Å; L634-N636 PolarHBondContact O-N 3.38Å; N636-R639 PolarHBondContact O-N 3.35Å; N636-R639 PolarHBondContact OD1-NH1 2.84Å; N636-W640 VanDerWaalsContact O-CB 3.23Å; N636-W640 WeakPolarHBondContact O-CB 3.45Å; N636-W640 PolarHBondContact O-N 3.05Å
637	Y	96.2	Very high	92.9	Very high	13 Å²	13	52.9 Å²	52.9	5%	0.051	26%	0.257	C	S	.	.	H	α-helix	trans	-60.8	-51.8	178.6	-174.2	-93.1	0	0	0	112.1	P414 L419 D597 I599 F633 L634 R639 W640 Q641	P414-Y637 HydrophobicContact CB-CD2 4.31Å; P414-Y637 HydrophobicContact CG-CD2 4.07Å; L419-Y637 HydrophobicContact CD1-CD2 4.39Å; L419-Y637 HydrophobicContact CD1-CE2 3.96Å; D597-Y637 PolarHBondContact OD1-OH 3.21Å; D597-Y637 VanDerWaalsContact OD2-CE1 3.31Å; D597-Y637 WeakPolarHBondContact OD2-CE1 3.44Å; D597-Y637 PolarHBondContact OD2-OH 3.3Å; I599-Y637 HydrophobicContact CB-CE1 4.28Å; I599-Y637 HydrophobicContact CB-CE2 4.17Å; I599-Y637 HydrophobicContact CG2-CD2 4.04Å; I599-Y637 HydrophobicContact CG2-CE1 4.18Å; I599-Y637 HydrophobicContact CG2-CE2 3.61Å; F633-Y637 HydrophobicContact CE1-CD2 4.05Å; F633-Y637 HydrophobicContact CE1-CG 4.14Å; F633-Y637 HydrophobicContact CZ-CD2 4.05Å; F633-Y637 VanDerWaalsContact O-CB 3.22Å; F633-Y637 WeakPolarHBondContact O-CB 3.32Å; F633-Y637 PolarHBondContact O-N 2.79Å; L634-Y637 PolarHBondContact O-N 3.45Å; Y637-R639 VanDerWaalsContact C-N 3.29Å; Y637-R639 PolarHBondContact O-N 3.17Å; Y637-W640 HydrophobicContact CE2-CZ3 4.46Å; Y637-W640 PolarHBondContact O-N 3.25Å; Y637-W640 VanDerWaalsContact O-N 3.15Å; Y637-Q641 HydrophobicContact CD1-CG 4.26Å; Y637-Q641 HydrophobicContact CE1-CG 3.79Å; Y637-Q641 PolarHBondContact O-N 2.98Å; Y637-Q641 PolarHBondContact OH-NE2 3.48Å
638	I	95.3	Very high	92.6	Very high	9 Å²	9	56.4 Å²	56.4	5%	0.046	27%	0.27	C	S	.	.	H	α-helix	trans	-60.3	-40.9	177.9	-63.6	166.7	0	0	0	110.7	L600 L634 A642 A650 L653 Y654 I657	L600-I638 HydrophobicContact CD1-CD1 3.92Å; L600-I638 HydrophobicContact CD1-CG1 3.76Å; L634-I638 HydrophobicContact CD1-CD1 3.75Å; L634-I638 HydrophobicContact CD1-CG1 4.28Å; L634-I638 HydrophobicContact CG-CD1 3.89Å; L634-I638 VanDerWaalsContact O-CG1 3.28Å; L634-I638 WeakPolarHBondContact O-CG1 3.32Å; L634-I638 PolarHBondContact O-N 2.97Å; I638-A642 WeakPolarHBondContact O-CB 3.32Å; I638-A642 PolarHBondContact O-N 2.94Å; I638-A650 HydrophobicContact CG2-CB 3.93Å; I638-L653 HydrophobicContact CG2-CB 4.46Å; I638-L653 HydrophobicContact CG2-CD2 4.07Å; I638-L653 HydrophobicContact CG2-CG 4.42Å; I638-Y654 HydrophobicContact CD1-CD2 4.25Å; I638-I657 HydrophobicContact CD1-CD1 3.91Å
639	R	93.7	Very high	92.5	Very high	26 Å²	26	55.3 Å²	55.3	10%	0.098	27%	0.273	C	S	.	.	H	α-helix	trans	-67.9	-35.4	177.7	-72.9	173.9	59.3	-128.8	-2.7	112.8	W635 N636 Y637 G643 L647 A650	W635-R639 WeakPolarHBondContact O-CB 3.24Å; W635-R639 WeakPolarHBondContact O-CD 3.42Å; W635-R639 WeakPolarHBondContact O-CG 3.33Å; W635-R639 PolarHBondContact O-N 2.88Å; N636-R639 PolarHBondContact O-N 3.35Å; N636-R639 PolarHBondContact OD1-NH1 2.84Å; Y637-R639 VanDerWaalsContact C-N 3.29Å; Y637-R639 PolarHBondContact O-N 3.17Å; R639-G643 PolarHBondContact O-N 3.27Å; R639-G643 VanDerWaalsContact O-N 3.07Å; R639-L647 HydrophobicContact CB-CD1 4.46Å; R639-L647 HydrophobicContact CG-CD1 3.75Å; R639-A650 HydrophobicContact CG-CB 4.14Å
640	W	93.8	Very high	92.4	Very high	114 Å²	114	54.5 Å²	54.5	43%	0.432	27%	0.267	S	S	.	.	H	α-helix	trans	-67	-50.4	176.4	-178.3	77.3	0	0	0	111.6	I411 P414 N636 Y637 A642 G643	I411-W640 VanDerWaalsContact CG2-CA 3.49Å; I411-W640 HydrophobicContact CG2-CB 4.05Å; P414-W640 HydrophobicContact CG-CD2 4.48Å; P414-W640 HydrophobicContact CG-CE3 4.36Å; N636-W640 VanDerWaalsContact O-CB 3.23Å; N636-W640 WeakPolarHBondContact O-CB 3.45Å; N636-W640 PolarHBondContact O-N 3.05Å; Y637-W640 HydrophobicContact CE2-CZ3 4.46Å; Y637-W640 PolarHBondContact O-N 3.25Å; Y637-W640 VanDerWaalsContact O-N 3.15Å; W640-A642 PolarHBondContact O-N 3.37Å; W640-G643 PolarHBondContact O-N 3.37Å
641	Q	92.6	Very high	92.3	Very high	62 Å²	62	56.7 Å²	56.7	29%	0.29	28%	0.28	S	S	.	.	H	α-helix	trans	-60.2	-40.9	173.6	-71.6	-72.4	23.2	0	0	113.1	Y637 R646	Y637-Q641 HydrophobicContact CD1-CG 4.26Å; Y637-Q641 HydrophobicContact CE1-CG 3.79Å; Y637-Q641 PolarHBondContact O-N 2.98Å; Y637-Q641 PolarHBondContact OH-NE2 3.48Å; Q641-R646 PolarHBondContact O-NH2 3.45Å
642	A	91.2	Very high	92.2	Very high	16 Å²	16	60 Å²	60	13%	0.132	29%	0.293	C	S	.	.	H	α-helix	trans	-67.9	-38	-179.6	0	0	0	0	0	112.8	I638 W640 R646 A650	I638-A642 WeakPolarHBondContact O-CB 3.32Å; I638-A642 PolarHBondContact O-N 2.94Å; W640-A642 PolarHBondContact O-N 3.37Å; A642-R646 HydrophobicContact CB-CB 4.04Å; A642-R646 WeakPolarHBondContact O-CB 3.48Å; A642-R646 PolarHBondContact O-NE 3.39Å; A642-R646 PolarHBondContact O-NH2 2.84Å; A642-A650 HydrophobicContact CB-CB 3.63Å
643	G	89.3	Confident	92.2	Very high	23 Å²	23	58.8 Å²	58.8	24%	0.237	29%	0.287	C	S	.	.			trans	72	172	-174.1	0	0	0	0	0	113.8	I411 R639 W640 K645 R646	I411-G643 VanDerWaalsContact CD1-C 3.43Å; R639-G643 PolarHBondContact O-N 3.27Å; R639-G643 VanDerWaalsContact O-N 3.07Å; W640-G643 PolarHBondContact O-N 3.37Å; G643-K645 PolarHBondContact O-N 3.27Å; G643-K645 VanDerWaalsContact O-N 3.13Å; G643-R646 PolarHBondContact O-N 2.97Å; G643-R646 VanDerWaalsContact O-N 3.07Å
644	S	83.8	Confident	92.2	Very high	97 Å²	97	58.6 Å²	58.6	68%	0.678	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-58.6	-31.9	-170.6	56.3	0	0	0	0	114.3	I411	I411-S644 VanDerWaalsContact CD1-N 3.26Å
645	K	82.4	Confident	92.1	Very high	204 Å²	204	60.8 Å²	60.8	89%	0.887	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-73.3	-21	-179.9	-62.6	-174.2	179.5	-176.9	0	114.2	G643	G643-K645 PolarHBondContact O-N 3.27Å; G643-K645 VanDerWaalsContact O-N 3.13Å
646	R	89.1	Confident	92.2	Very high	133 Å²	133	63.5 Å²	63.5	50%	0.502	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-119.6	18.8	-171.7	-59.3	-177.7	-68	-171.4	4.1	113.9	Q641 A642 G643 R648 S649 A650	Q641-R646 PolarHBondContact O-NH2 3.45Å; A642-R646 HydrophobicContact CB-CB 4.04Å; A642-R646 WeakPolarHBondContact O-CB 3.48Å; A642-R646 PolarHBondContact O-NE 3.39Å; A642-R646 PolarHBondContact O-NH2 2.84Å; G643-R646 PolarHBondContact O-N 2.97Å; G643-R646 VanDerWaalsContact O-N 3.07Å; R646-R648 PolarHBondContact O-N 2.95Å; R646-R648 VanDerWaalsContact O-N 3.12Å; R646-S649 PolarHBondContact O-N 3.31Å; R646-S649 VanDerWaalsContact O-N 3.08Å; R646-A650 PolarHBondContact O-N 2.89Å
647	L	89.7	Confident	92.2	Very high	50 Å²	50	61.8 Å²	61.8	26%	0.262	31%	0.305	S	S	.	.	H	α-helix	trans	-57.3	-28.5	-176.8	-178.9	58.6	0	0	0	114.4	M409 R639 T651	M409-L647 HydrophobicContact CB-CD2 4.48Å; M409-L647 HydrophobicContact CG-CD2 4.4Å; R639-L647 HydrophobicContact CB-CD1 4.46Å; R639-L647 HydrophobicContact CG-CD1 3.75Å; L647-T651 PolarHBondContact O-N 3.29Å; L647-T651 VanDerWaalsContact O-N 3.09Å; L647-T651 PolarHBondContact O-OG1 2.68Å
648	R	90	Very high	92	Very high	154 Å²	154	63.4 Å²	63.4	58%	0.581	32%	0.315	S	S	*	.	H	α-helix	trans	-65.6	-52.6	173.1	-173.3	-177.7	-171.6	159	5	111.4	C57 R646 A650 T651 E652	C57-R648 PolarHBondContact O-NH2 3.32Å; R646-R648 PolarHBondContact O-N 2.95Å; R646-R648 VanDerWaalsContact O-N 3.12Å; R648-A650 VanDerWaalsContact C-N 3.28Å; R648-A650 PolarHBondContact O-N 3.36Å; R648-T651 WeakPolarHBondContact O-CB 3.41Å; R648-T651 PolarHBondContact O-N 2.94Å; R648-E652 PolarHBondContact O-N 2.99Å
649	S	91.4	Very high	91.8	Very high	72 Å²	72	66.2 Å²	66.2	50%	0.503	33%	0.329	S	S	.	.	H	α-helix	trans	-61.4	-36.5	177.2	-48.3	0	0	0	0	111.8	R646 T651 E652 L653	R646-S649 PolarHBondContact O-N 3.31Å; R646-S649 VanDerWaalsContact O-N 3.08Å; S649-T651 VanDerWaalsContact C-N 3.33Å; S649-T651 PolarHBondContact O-N 3.01Å; S649-E652 PolarHBondContact O-N 3.33Å; S649-L653 VanDerWaalsContact O-CB 3.31Å; S649-L653 WeakPolarHBondContact O-CB 3.31Å; S649-L653 PolarHBondContact O-N 2.93Å
650	A	93.2	Very high	91.7	Very high	3 Å²	3	65.4 Å²	65.4	3%	0.025	33%	0.327	C	S	.	.	H	α-helix	trans	-59.4	-42.8	171.6	0	0	0	0	0	112.6	I638 R639 A642 R646 R648 Y654	I638-A650 HydrophobicContact CG2-CB 3.93Å; R639-A650 HydrophobicContact CG-CB 4.14Å; A642-A650 HydrophobicContact CB-CB 3.63Å; R646-A650 PolarHBondContact O-N 2.89Å; R648-A650 VanDerWaalsContact C-N 3.28Å; R648-A650 PolarHBondContact O-N 3.36Å; A650-Y654 WeakPolarHBondContact O-CB 3.4Å; A650-Y654 PolarHBondContact O-N 3.47Å
651	T	93.3	Very high	91.7	Very high	46 Å²	46	61.5 Å²	61.5	28%	0.282	31%	0.314	S	S	.	.	H	α-helix	trans	-69.9	-39.5	179.6	-54.2	0	0	0	0	111.5	M331 W635 L647 R648 S649 A655	M331-T651 HydrophobicContact CE-CG2 4.18Å; W635-T651 HydrophobicContact CH2-CG2 3.99Å; W635-T651 HydrophobicContact CZ3-CG2 4.11Å; L647-T651 PolarHBondContact O-N 3.29Å; L647-T651 VanDerWaalsContact O-N 3.09Å; L647-T651 PolarHBondContact O-OG1 2.68Å; R648-T651 WeakPolarHBondContact O-CB 3.41Å; R648-T651 PolarHBondContact O-N 2.94Å; S649-T651 VanDerWaalsContact C-N 3.33Å; S649-T651 PolarHBondContact O-N 3.01Å; T651-A655 WeakPolarHBondContact O-CB 3.43Å; T651-A655 PolarHBondContact O-N 2.92Å; T651-A655 VanDerWaalsContact O-N 3.08Å
652	E	93.9	Very high	91.5	Very high	95 Å²	95	63.4 Å²	63.4	44%	0.444	33%	0.325	S	S	.	.	H	α-helix	trans	-66.5	-45.3	175.6	-176.6	167.2	-168.8	0	0	112	R648 S649 A655 R656	R648-E652 PolarHBondContact O-N 2.99Å; S649-E652 PolarHBondContact O-N 3.33Å; E652-A655 PolarHBondContact O-N 3.47Å; E652-R656 WeakPolarHBondContact O-CG 3.39Å; E652-R656 PolarHBondContact O-N 2.98Å
653	L	95.4	Very high	91.1	Very high	47 Å²	47	64.1 Å²	64.1	25%	0.246	33%	0.326	C	S	.	.	H	α-helix	trans	-60.5	-47.8	176	175.6	55.7	0	0	0	111.7	L593 I638 S649 A655 R656 I657	L593-L653 HydrophobicContact CB-CD1 4.2Å; L593-L653 HydrophobicContact CD2-CD1 3.97Å; L593-L653 VanDerWaalsContact O-CD1 3.26Å; L593-L653 WeakPolarHBondContact O-CD1 3.42Å; I638-L653 HydrophobicContact CG2-CB 4.46Å; I638-L653 HydrophobicContact CG2-CD2 4.07Å; I638-L653 HydrophobicContact CG2-CG 4.42Å; S649-L653 VanDerWaalsContact O-CB 3.31Å; S649-L653 WeakPolarHBondContact O-CB 3.31Å; S649-L653 PolarHBondContact O-N 2.93Å; L653-A655 VanDerWaalsContact C-N 3.29Å; L653-A655 PolarHBondContact O-N 3.36Å; L653-R656 PolarHBondContact O-N 3.47Å; L653-R656 VanDerWaalsContact O-N 3.16Å; L653-I657 HydrophobicContact CD1-CD1 3.8Å; L653-I657 HydrophobicContact CD1-CG1 4Å; L653-I657 HydrophobicContact CG-CD1 3.9Å; L653-I657 WeakPolarHBondContact O-CG1 3.3Å; L653-I657 PolarHBondContact O-N 3.24Å
654	Y	96	Very high	91.2	Very high	4 Å²	4	63.4 Å²	63.4	2%	0.016	32%	0.317	C	S	.	.	H	α-helix	trans	-56	-43.3	174.2	174.7	-97.5	0	0	0	111.9	T631 L634 W635 I638 A650 I657 L658	T631-Y654 HydrophobicContact CG2-CE2 4.49Å; T631-Y654 VanDerWaalsContact CG2-OH 3.22Å; T631-Y654 WeakPolarHBondContact CG2-OH 3.41Å; L634-Y654 HydrophobicContact CD2-CD2 3.98Å; L634-Y654 HydrophobicContact CD2-CE2 3.96Å; L634-Y654 HydrophobicContact CG-CD2 4.05Å; L634-Y654 HydrophobicContact CG-CE2 4.21Å; W635-Y654 HydrophobicContact CB-CD2 4.18Å; W635-Y654 HydrophobicContact CB-CE2 3.8Å; W635-Y654 AromaticContact CE3-CD1 3.61Å; W635-Y654 HydrophobicContact CE3-CD1 3.61Å; W635-Y654 AromaticContact CE3-CD2 3.92Å; W635-Y654 HydrophobicContact CE3-CD2 3.92Å; W635-Y654 AromaticContact CE3-CE1 3.97Å; W635-Y654 HydrophobicContact CE3-CE1 3.97Å; W635-Y654 HydrophobicContact CE3-CE2 4.25Å; W635-Y654 AromaticContact CE3-CG 3.58Å; W635-Y654 HydrophobicContact CE3-CG 3.58Å; W635-Y654 AromaticContact CZ3-CD1 3.84Å; W635-Y654 HydrophobicContact CZ3-CD1 3.84Å; W635-Y654 HydrophobicContact CZ3-CE1 4.41Å; W635-Y654 HydrophobicContact CZ3-CG 4.05Å; I638-Y654 HydrophobicContact CD1-CD2 4.25Å; A650-Y654 WeakPolarHBondContact O-CB 3.4Å; A650-Y654 PolarHBondContact O-N 3.47Å; Y654-I657 PolarHBondContact O-N 3.04Å; Y654-L658 HydrophobicContact CD1-CD1 4.12Å; Y654-L658 HydrophobicContact CE1-CD1 3.5Å; Y654-L658 HydrophobicContact CE1-CG 4.35Å; Y654-L658 HydrophobicContact CE2-CD1 4.47Å; Y654-L658 WeakPolarHBondContact O-CG 3.14Å; Y654-L658 PolarHBondContact O-N 2.91Å
655	A	94.8	Very high	91.5	Very high	45 Å²	45	64.2 Å²	64.2	37%	0.372	31%	0.305	S	S	.	.	H	α-helix	trans	-66.2	-38.5	176.8	0	0	0	0	0	113	T651 E652 L653 L658 I659	T651-A655 WeakPolarHBondContact O-CB 3.43Å; T651-A655 PolarHBondContact O-N 2.92Å; T651-A655 VanDerWaalsContact O-N 3.08Å; E652-A655 PolarHBondContact O-N 3.47Å; L653-A655 VanDerWaalsContact C-N 3.29Å; L653-A655 PolarHBondContact O-N 3.36Å; A655-L658 PolarHBondContact O-N 3.38Å; A655-I659 WeakPolarHBondContact O-CG1 3.43Å; A655-I659 PolarHBondContact O-N 3.07Å
656	R	95.7	Very high	91.8	Very high	81 Å²	81	57.5 Å²	57.5	31%	0.306	28%	0.282	S	S	.	.	H	α-helix	trans	-65.7	-43.3	174.6	-70.8	-175.9	66.4	-172.8	-3.7	112	H589 E592 L593 E652 L653 L658 I659 A660	H589-R656 PolarHBondContact NE2-NH2 2.67Å; E592-R656 IonicContact OE1-CZ 2.76Å; E592-R656 VanDerWaalsContact OE1-CZ 3.24Å; E592-R656 IonicContact OE1-NH1 3.57Å; E592-R656 PolarHBondContact OE1-NH1 2.95Å; E592-R656 IonicContact OE1-NH2 2.67Å; E592-R656 PolarHBondContact OE1-NH2 3.03Å; E592-R656 IonicContact OE2-NH2 3.83Å; E592-R656 PolarHBondContact OE2-NH2 3.38Å; L593-R656 HydrophobicContact CD2-CB 3.47Å; L593-R656 VanDerWaalsContact CD2-CB 3.47Å; L593-R656 HydrophobicContact CD2-CG 4.32Å; E652-R656 WeakPolarHBondContact O-CG 3.39Å; E652-R656 PolarHBondContact O-N 2.98Å; L653-R656 PolarHBondContact O-N 3.47Å; L653-R656 VanDerWaalsContact O-N 3.16Å; R656-L658 VanDerWaalsContact C-N 3.33Å; R656-L658 PolarHBondContact O-N 2.97Å; R656-I659 WeakPolarHBondContact O-CA 3.43Å; R656-I659 WeakPolarHBondContact O-CB 3.39Å; R656-I659 PolarHBondContact O-N 3.16Å; R656-A660 PolarHBondContact O-N 3.34Å
657	I	95.3	Very high	91.8	Very high	4 Å²	4	51.6 Å²	51.6	2%	0.021	26%	0.26	C	S	.	.	H	α-helix	trans	-59	-43.2	175.4	-71.6	169.5	0	0	0	111	L593 L600 V604 L634 I638 L653 Y654 I659 A660 F661	L593-I657 HydrophobicContact CB-CG1 4.12Å; L593-I657 HydrophobicContact CD1-CG1 4.29Å; L600-I657 HydrophobicContact CD1-CD1 3.84Å; L600-I657 HydrophobicContact CD2-CD1 4.28Å; L600-I657 HydrophobicContact CG-CD1 4.24Å; V604-I657 HydrophobicContact CG2-CG2 3.56Å; L634-I657 HydrophobicContact CD2-CG2 4.05Å; I638-I657 HydrophobicContact CD1-CD1 3.91Å; L653-I657 HydrophobicContact CD1-CD1 3.8Å; L653-I657 HydrophobicContact CD1-CG1 4Å; L653-I657 HydrophobicContact CG-CD1 3.9Å; L653-I657 WeakPolarHBondContact O-CG1 3.3Å; L653-I657 PolarHBondContact O-N 3.24Å; Y654-I657 PolarHBondContact O-N 3.04Å; I657-I659 PolarHBondContact O-N 2.82Å; I657-A660 PolarHBondContact O-N 2.85Å; I657-F661 HydrophobicContact CG2-CE2 4.4Å; I657-F661 VanDerWaalsContact O-CD2 3.28Å; I657-F661 WeakPolarHBondContact O-CD2 3.3Å
658	L	92.2	Very high	91.9	Very high	47 Å²	47	49.4 Å²	49.4	25%	0.246	25%	0.248	C	C	.	.	H	α-helix	trans	-64.8	-25.3	175	-70.5	-177.2	0	0	0	113.8	Y654 A655 R656	Y654-L658 HydrophobicContact CD1-CD1 4.12Å; Y654-L658 HydrophobicContact CE1-CD1 3.5Å; Y654-L658 HydrophobicContact CE1-CG 4.35Å; Y654-L658 HydrophobicContact CE2-CD1 4.47Å; Y654-L658 WeakPolarHBondContact O-CG 3.14Å; Y654-L658 PolarHBondContact O-N 2.91Å; A655-L658 PolarHBondContact O-N 3.38Å; R656-L658 VanDerWaalsContact C-N 3.33Å; R656-L658 PolarHBondContact O-N 2.97Å
659	I	91.4	Very high	91.9	Very high	68 Å²	68	45.7 Å²	45.7	35%	0.349	24%	0.239	S	C	.	.	H	α-helix	trans	-77.7	-36.8	174.5	-69.4	164.7	0	0	0	111.1	A655 R656 I657 F661 I662	A655-I659 WeakPolarHBondContact O-CG1 3.43Å; A655-I659 PolarHBondContact O-N 3.07Å; R656-I659 WeakPolarHBondContact O-CA 3.43Å; R656-I659 WeakPolarHBondContact O-CB 3.39Å; R656-I659 PolarHBondContact O-N 3.16Å; I657-I659 PolarHBondContact O-N 2.82Å; I659-F661 PolarHBondContact O-N 3.04Å; I659-F661 VanDerWaalsContact O-N 3.08Å; I659-I662 VanDerWaalsContact O-CB 3.28Å; I659-I662 WeakPolarHBondContact O-CB 3.48Å; I659-I662 WeakPolarHBondContact O-CG1 3.36Å; I659-I662 PolarHBondContact O-N 3.2Å
660	A	91.8	Very high	91.8	Very high	8 Å²	8	45 Å²	45	7%	0.066	23%	0.225	C	C	.	.	H	α-helix	trans	-60.3	-20.6	-179.7	0	0	0	0	0	114.2	L593 R656 I657 I662 D663 L664	L593-A660 HydrophobicContact CD1-CB 3.79Å; R656-A660 PolarHBondContact O-N 3.34Å; I657-A660 PolarHBondContact O-N 2.85Å; A660-I662 PolarHBondContact O-N 3.35Å; A660-D663 WeakPolarHBondContact O-CB 3.42Å; A660-D663 PolarHBondContact O-N 3.03Å; A660-L664 PolarHBondContact O-N 3.07Å
661	F	92.9	Very high	91.6	Very high	33 Å²	33	45 Å²	45	15%	0.145	23%	0.225	C	C	.	.	H	α-helix	trans	-61.5	-22.9	169.2	-76	-91	0	0	0	113.6	V604 I607 K608 I657 I659 R665	V604-F661 HydrophobicContact CG1-CE1 4.45Å; V604-F661 HydrophobicContact CG1-CE2 4.12Å; V604-F661 HydrophobicContact CG1-CZ 3.76Å; I607-F661 HydrophobicContact CB-CE1 4.39Å; I607-F661 HydrophobicContact CB-CZ 3.88Å; I607-F661 HydrophobicContact CG2-CE1 3.95Å; I607-F661 HydrophobicContact CG2-CE2 4.29Å; I607-F661 HydrophobicContact CG2-CZ 3.56Å; K608-F661 HydrophobicContact CB-CE1 3.96Å; I657-F661 HydrophobicContact CG2-CE2 4.4Å; I657-F661 VanDerWaalsContact O-CD2 3.28Å; I657-F661 WeakPolarHBondContact O-CD2 3.3Å; I659-F661 PolarHBondContact O-N 3.04Å; I659-F661 VanDerWaalsContact O-N 3.08Å; F661-R665 VanDerWaalsContact O-CB 3.25Å; F661-R665 WeakPolarHBondContact O-CB 3.37Å; F661-R665 PolarHBondContact O-N 3.46Å
662	I	88	Confident	91.4	Very high	102 Å²	102	44 Å²	44	52%	0.523	22%	0.219	S	C	.	.	H	α-helix	trans	-76	-42.2	175.6	-55.3	173.5	0	0	0	110.1	I659 A660 R665 T666	I659-I662 VanDerWaalsContact O-CB 3.28Å; I659-I662 WeakPolarHBondContact O-CB 3.48Å; I659-I662 WeakPolarHBondContact O-CG1 3.36Å; I659-I662 PolarHBondContact O-N 3.2Å; A660-I662 PolarHBondContact O-N 3.35Å; I662-R665 PolarHBondContact O-N 2.9Å; I662-T666 PolarHBondContact O-N 3.25Å; I662-T666 VanDerWaalsContact O-N 3.13Å; I662-T666 PolarHBondContact O-OG1 3.09Å
663	D	83.5	Confident	91.1	Very high	31 Å²	31	43.4 Å²	43.4	17%	0.166	22%	0.216	C	C	.	.	H	α-helix	trans	-59.8	-51.2	173.7	-53.5	-21.1	0	0	0	109.6	Y65 H589 A660 R665 T666 L667	Y65-D663 PolarHBondContact OH-OD1 3.48Å; H589-D663 IonicContact CE1-OD2 2.66Å; H589-D663 PolarHBondContact CE1-OD2 3.13Å; H589-D663 IonicContact ND1-OD2 3.21Å; H589-D663 PolarHBondContact ND1-OD2 2.92Å; A660-D663 WeakPolarHBondContact O-CB 3.42Å; A660-D663 PolarHBondContact O-N 3.03Å; D663-R665 VanDerWaalsContact C-N 3.34Å; D663-R665 PolarHBondContact O-N 3.36Å; D663-T666 VanDerWaalsContact O-CB 3.31Å; D663-T666 WeakPolarHBondContact O-CB 3.47Å; D663-T666 PolarHBondContact O-N 3.44Å; D663-L667 PolarHBondContact O-N 3.31Å
664	L	90.9	Very high	90.7	Very high	8 Å²	8	41.7 Å²	41.7	4%	0.042	21%	0.207	C	C	.	.	H	α-helix	trans	-57.5	-43.9	177.3	-174	67.7	0	0	0	112.2	V492 L493 K608 A660 T666 L667 E668	V492-L664 HydrophobicContact CB-CD1 3.77Å; V492-L664 HydrophobicContact CG1-CD1 3.64Å; L493-L664 HydrophobicContact CD1-CD2 3.67Å; L493-L664 HydrophobicContact CD2-CD2 4.21Å; L493-L664 HydrophobicContact CG-CD1 4.39Å; L493-L664 HydrophobicContact CG-CD2 3.84Å; K608-L664 HydrophobicContact CD-CD2 4.14Å; K608-L664 HydrophobicContact CG-CD2 4.19Å; A660-L664 PolarHBondContact O-N 3.07Å; L664-T666 PolarHBondContact O-N 2.98Å; L664-L667 PolarHBondContact O-N 3.27Å; L664-L667 VanDerWaalsContact O-N 3.14Å; L664-E668 WeakPolarHBondContact O-CG 3.41Å; L664-E668 PolarHBondContact O-N 2.78Å
665	R	91.2	Very high	90.3	Very high	114 Å²	114	42 Å²	42	43%	0.43	21%	0.21	S	C	.	.	H	α-helix	trans	-63.4	-28.5	177.5	-177.7	56.9	-171.4	158.7	6	112.7	F661 I662 D663 E668 I669	F661-R665 VanDerWaalsContact O-CB 3.25Å; F661-R665 WeakPolarHBondContact O-CB 3.37Å; F661-R665 PolarHBondContact O-N 3.46Å; I662-R665 PolarHBondContact O-N 2.9Å; D663-R665 VanDerWaalsContact C-N 3.34Å; D663-R665 PolarHBondContact O-N 3.36Å; R665-E668 VanDerWaalsContact CD-OE2 3.26Å; R665-E668 WeakPolarHBondContact CD-OE2 3.31Å; R665-E668 IonicContact CZ-OE2 2.88Å; R665-E668 IonicContact NE-OE2 2.96Å; R665-E668 IonicContact NH1-OE2 3.24Å; R665-E668 PolarHBondContact NH1-OE2 2.99Å; R665-I669 HydrophobicContact CG-CD1 4.4Å; R665-I669 WeakPolarHBondContact O-CD1 3.42Å; R665-I669 VanDerWaalsContact O-CG1 3.32Å; R665-I669 WeakPolarHBondContact O-CG1 3.32Å; R665-I669 PolarHBondContact O-N 3.46Å
666	T	88.8	Confident	90	Very high	63 Å²	63	45.7 Å²	45.7	39%	0.387	22%	0.218	S	C	.	.	H	α-helix	trans	-71.3	-38.6	175.9	-54.4	0	0	0	0	111.2	I662 D663 L664 R670	I662-T666 PolarHBondContact O-N 3.25Å; I662-T666 VanDerWaalsContact O-N 3.13Å; I662-T666 PolarHBondContact O-OG1 3.09Å; D663-T666 VanDerWaalsContact O-CB 3.31Å; D663-T666 WeakPolarHBondContact O-CB 3.47Å; D663-T666 PolarHBondContact O-N 3.44Å; L664-T666 PolarHBondContact O-N 2.98Å; T666-R670 PolarHBondContact O-N 3.5Å
667	L	89.3	Confident	89.5	Confident	8 Å²	8	44.1 Å²	44.1	4%	0.042	22%	0.215	C	C	.	.	H	α-helix	trans	-66	-44.6	172.3	-65	179.9	0	0	0	112.3	V492 Y579 N582 A586 D663 L664 I669 R670 M671	V492-L667 HydrophobicContact CG1-CD1 4.38Å; Y579-L667 HydrophobicContact CD2-CD2 4.25Å; Y579-L667 HydrophobicContact CE2-CD2 4.26Å; N582-L667 HydrophobicContact CB-CD2 3.86Å; A586-L667 HydrophobicContact CB-CD1 3.54Å; D663-L667 PolarHBondContact O-N 3.31Å; L664-L667 PolarHBondContact O-N 3.27Å; L664-L667 VanDerWaalsContact O-N 3.14Å; L667-I669 PolarHBondContact O-N 3.45Å; L667-R670 PolarHBondContact O-N 2.88Å; L667-M671 WeakPolarHBondContact O-CG 3.31Å; L667-M671 PolarHBondContact O-N 3.27Å
668	E	91	Very high	89	Confident	4 Å²	4	44.7 Å²	44.7	2%	0.019	22%	0.218	C	C	.	.	H	α-helix	trans	-54.8	-39.5	176.7	-72.7	163.9	-136.5	0	0	113.2	K608 L664 R665 T672	K608-E668 WeakPolarHBondContact CE-OE1 3.41Å; K608-E668 IonicContact NZ-OE1 2.67Å; K608-E668 PolarHBondContact NZ-OE1 2.86Å; K608-E668 IonicContact NZ-OE2 2.7Å; K608-E668 PolarHBondContact NZ-OE2 2.95Å; L664-E668 WeakPolarHBondContact O-CG 3.41Å; L664-E668 PolarHBondContact O-N 2.78Å; R665-E668 VanDerWaalsContact CD-OE2 3.26Å; R665-E668 WeakPolarHBondContact CD-OE2 3.31Å; R665-E668 IonicContact CZ-OE2 2.88Å; R665-E668 IonicContact NE-OE2 2.96Å; R665-E668 IonicContact NH1-OE2 3.24Å; R665-E668 PolarHBondContact NH1-OE2 2.99Å; E668-T672 WeakPolarHBondContact O-CB 3.06Å; E668-T672 PolarHBondContact O-N 3.32Å; E668-T672 PolarHBondContact O-OG1 2.83Å
669	I	89.3	Confident	88.7	Confident	77 Å²	77	43.9 Å²	43.9	40%	0.395	22%	0.216	S	C	.	.	H	α-helix	trans	-66.3	-48.8	176.8	-68.8	164.7	0	0	0	109.1	R665 L667 M671 T672 E673	R665-I669 HydrophobicContact CG-CD1 4.4Å; R665-I669 WeakPolarHBondContact O-CD1 3.42Å; R665-I669 VanDerWaalsContact O-CG1 3.32Å; R665-I669 WeakPolarHBondContact O-CG1 3.32Å; R665-I669 PolarHBondContact O-N 3.46Å; L667-I669 PolarHBondContact O-N 3.45Å; I669-M671 PolarHBondContact O-N 2.6Å; I669-T672 CarbonylContact O-C 3.52Å; I669-T672 WeakPolarHBondContact O-CA 3.48Å; I669-T672 WeakPolarHBondContact O-CB 3.23Å; I669-T672 PolarHBondContact O-N 3.47Å; I669-E673 WeakPolarHBondContact O-CG 3.24Å; I669-E673 PolarHBondContact O-N 2.85Å
670	R	89.2	Confident	88.5	Confident	57 Å²	57	43.7 Å²	43.7	22%	0.215	22%	0.216	C	C	.	.	H	α-helix	trans	-59.6	-43.4	177.1	-74.3	-61	-164	165.7	5.3	112.8	E575 Y579 T666 L667 T672 E673 F674	E575-R670 VanDerWaalsContact CD-NH1 3.31Å; E575-R670 IonicContact OE1-CZ 3.95Å; E575-R670 VanDerWaalsContact OE1-CZ 3.26Å; E575-R670 IonicContact OE1-NH1 2.84Å; E575-R670 PolarHBondContact OE1-NH1 3Å; E575-R670 IonicContact OE1-NH2 2.71Å; E575-R670 PolarHBondContact OE1-NH2 3.44Å; E575-R670 IonicContact OE2-NH1 2.72Å; Y579-R670 HydrophobicContact CD2-CB 3.9Å; T666-R670 PolarHBondContact O-N 3.5Å; L667-R670 PolarHBondContact O-N 2.88Å; R670-T672 VanDerWaalsContact C-N 3.32Å; R670-T672 PolarHBondContact O-N 2.81Å; R670-E673 PolarHBondContact O-N 2.86Å; R670-F674 HydrophobicContact CB-CE2 4.34Å; R670-F674 WeakPolarHBondContact O-CD2 3.34Å; R670-F674 PolarHBondContact O-N 3.44Å
671	M	89.5	Confident	88.3	Confident	2 Å²	2	49.5 Å²	49.5	1%	0.01	25%	0.246	C	C	.	.	H	α-helix	trans	-59.6	-42.1	171.9	-65.9	-176.1	79.7	0	0	111.8	Y451 M454 Y488 I491 V492 Y579 L667 I669 E673 F674 A675	Y451-M671 PolarHBondContact OH-O 3.39Å; M454-M671 HydrophobicContact CE-CE 3.86Å; M454-M671 HydrophobicContact SD-CE 3.74Å; Y488-M671 HydrophobicContact CD1-CB 4.26Å; Y488-M671 HydrophobicContact CD1-CE 3.74Å; Y488-M671 HydrophobicContact CD1-SD 4.26Å; Y488-M671 HydrophobicContact CD2-CB 3.9Å; Y488-M671 HydrophobicContact CE1-CE 4.41Å; Y488-M671 HydrophobicContact CE2-CB 4.37Å; Y488-M671 HydrophobicContact CG-CB 3.86Å; Y488-M671 HydrophobicContact CG-CE 4.26Å; Y488-M671 HydrophobicContact CG-SD 4.18Å; I491-M671 HydrophobicContact CG2-CE 4.09Å; V492-M671 HydrophobicContact CG2-SD 4.31Å; Y579-M671 HydrophobicContact CE2-CG 3.66Å; Y579-M671 VanDerWaalsContact OH-CG 3.28Å; Y579-M671 WeakPolarHBondContact OH-CG 3.3Å; Y579-M671 PolarHBondContact OH-SD 2.8Å; L667-M671 WeakPolarHBondContact O-CG 3.31Å; L667-M671 PolarHBondContact O-N 3.27Å; I669-M671 PolarHBondContact O-N 2.6Å; M671-E673 VanDerWaalsContact C-N 3.28Å; M671-E673 PolarHBondContact O-N 3.23Å; M671-F674 PolarHBondContact O-N 2.87Å; M671-A675 WeakPolarHBondContact O-CB 3.39Å; M671-A675 PolarHBondContact O-N 3.17Å
672	T	89.7	Confident	88	Confident	25 Å²	25	49.8 Å²	49.8	15%	0.153	26%	0.258	C	S	.	.	H	α-helix	trans	-64.5	-30.8	177.1	-55.1	0	0	0	0	112.7	Y488 E668 I669 R670 R694	Y488-T672 WeakPolarHBondContact CD2-OG1 3.44Å; E668-T672 WeakPolarHBondContact O-CB 3.06Å; E668-T672 PolarHBondContact O-N 3.32Å; E668-T672 PolarHBondContact O-OG1 2.83Å; I669-T672 CarbonylContact O-C 3.52Å; I669-T672 WeakPolarHBondContact O-CA 3.48Å; I669-T672 WeakPolarHBondContact O-CB 3.23Å; I669-T672 PolarHBondContact O-N 3.47Å; R670-T672 VanDerWaalsContact C-N 3.32Å; R670-T672 PolarHBondContact O-N 2.81Å; T672-R694 PolarHBondContact OG1-NH1 3.3Å
673	E	87.7	Confident	88.2	Confident	84 Å²	84	45.1 Å²	45.1	39%	0.393	23%	0.234	S	C	.	.	H	α-helix	trans	-74.2	-46.5	172.9	-62.4	-49.1	122.4	0	0	112.2	I669 R670 M671 A675 K676	I669-E673 WeakPolarHBondContact O-CG 3.24Å; I669-E673 PolarHBondContact O-N 2.85Å; R670-E673 PolarHBondContact O-N 2.86Å; M671-E673 VanDerWaalsContact C-N 3.28Å; M671-E673 PolarHBondContact O-N 3.23Å; E673-A675 VanDerWaalsContact C-N 3.25Å; E673-A675 PolarHBondContact O-N 3.17Å; E673-K676 WeakPolarHBondContact O-CB 3.25Å; E673-K676 PolarHBondContact O-N 2.74Å; E673-K676 VanDerWaalsContact O-N 3.08Å; E673-K676 WeakPolarHBondContact OE1-CE 2.96Å; E673-K676 IonicContact OE1-NZ 3.78Å; E673-K676 PolarHBondContact OE1-NZ 3.49Å; E673-K676 WeakPolarHBondContact OE2-CE 3.18Å; E673-K676 IonicContact OE2-NZ 2.81Å; E673-K676 PolarHBondContact OE2-NZ 3.33Å
674	F	86.7	Confident	88.6	Confident	10 Å²	10	44.7 Å²	44.7	4%	0.044	23%	0.233	C	C	.	.	H	α-helix	trans	-60.6	-35	175.9	-71.7	-62	0	0	0	112.5	L447 E575 F576 Y579 R670 M671 K676 L677	L447-F674 HydrophobicContact CD2-CB 4.37Å; E575-F674 HydrophobicContact CB-CZ 4.29Å; F576-F674 HydrophobicContact CB-CE1 4.23Å; F576-F674 HydrophobicContact CB-CZ 4.34Å; F576-F674 HydrophobicContact CD2-CD1 4.45Å; F576-F674 HydrophobicContact CD2-CE1 4.19Å; F576-F674 HydrophobicContact CD2-CZ 4.33Å; Y579-F674 HydrophobicContact CD1-CD2 4.36Å; Y579-F674 HydrophobicContact CD1-CE2 4.02Å; Y579-F674 HydrophobicContact CD2-CE2 4.21Å; Y579-F674 HydrophobicContact CG-CD2 4.25Å; Y579-F674 AromaticContact CG-CE2 3.64Å; Y579-F674 HydrophobicContact CG-CE2 3.64Å; R670-F674 HydrophobicContact CB-CE2 4.34Å; R670-F674 WeakPolarHBondContact O-CD2 3.34Å; R670-F674 PolarHBondContact O-N 3.44Å; M671-F674 PolarHBondContact O-N 2.87Å; F674-K676 PolarHBondContact O-N 3.34Å; F674-K676 VanDerWaalsContact O-N 3.11Å; F674-L677 HydrophobicContact CD1-CD1 4.19Å; F674-L677 WeakPolarHBondContact O-CB 3.43Å; F674-L677 PolarHBondContact O-N 2.95Å
675	A	88.1	Confident	88.7	Confident	11 Å²	11	49.5 Å²	49.5	9%	0.091	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-59.7	-21.1	176.4	0	0	0	0	0	114	Y451 Y488 M671 E673 L677 L678	Y451-A675 HydrophobicContact CE1-CB 4.03Å; Y488-A675 WeakPolarHBondContact OH-CB 3.49Å; M671-A675 WeakPolarHBondContact O-CB 3.39Å; M671-A675 PolarHBondContact O-N 3.17Å; E673-A675 VanDerWaalsContact C-N 3.25Å; E673-A675 PolarHBondContact O-N 3.17Å; A675-L677 VanDerWaalsContact C-N 3.3Å; A675-L678 HydrophobicContact CB-CD1 4.31Å
676	K	87	Confident	88.8	Confident	122 Å²	122	45.3 Å²	45.3	53%	0.53	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-78.4	-11.7	176.1	-57.5	172.9	-167.6	172	0	113.6	E673 F674	E673-K676 WeakPolarHBondContact O-CB 3.25Å; E673-K676 PolarHBondContact O-N 2.74Å; E673-K676 VanDerWaalsContact O-N 3.08Å; E673-K676 WeakPolarHBondContact OE1-CE 2.96Å; E673-K676 IonicContact OE1-NZ 3.78Å; E673-K676 PolarHBondContact OE1-NZ 3.49Å; E673-K676 WeakPolarHBondContact OE2-CE 3.18Å; E673-K676 IonicContact OE2-NZ 2.81Å; E673-K676 PolarHBondContact OE2-NZ 3.33Å; F674-K676 PolarHBondContact O-N 3.34Å; F674-K676 VanDerWaalsContact O-N 3.11Å
677	L	85	Confident	89	Confident	48 Å²	48	42.3 Å²	42.3	25%	0.251	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-93.2	-13.5	-179.4	-54.3	179.2	0	0	0	113	L447 L572 F674 A675	L447-L677 HydrophobicContact CD2-CB 4.29Å; L572-L677 HydrophobicContact CD1-CD1 4.25Å; L572-L677 HydrophobicContact CD2-CD1 3.76Å; F674-L677 HydrophobicContact CD1-CD1 4.19Å; F674-L677 WeakPolarHBondContact O-CB 3.43Å; F674-L677 PolarHBondContact O-N 2.95Å; A675-L677 VanDerWaalsContact C-N 3.3Å
678	L	85.5	Confident	89.1	Confident	17 Å²	17	46.6 Å²	46.6	9%	0.089	25%	0.248	C	C	.	.	S	Bend	trans	-71.9	141.5	-174.9	-66.6	168.6	0	0	0	112.7	L447 E448 Y451 A675 L680 L683	L447-L678 HydrophobicContact CB-CD2 3.97Å; L447-L678 HydrophobicContact CD2-CD2 3.87Å; L447-L678 HydrophobicContact CD2-CG 4.33Å; L447-L678 HydrophobicContact CG-CD2 3.68Å; E448-L678 HydrophobicContact CB-CD2 4.48Å; E448-L678 HydrophobicContact CG-CD2 4.01Å; Y451-L678 HydrophobicContact CD1-CD1 3.5Å; Y451-L678 HydrophobicContact CD2-CD1 4.13Å; Y451-L678 HydrophobicContact CD2-CD2 4.22Å; Y451-L678 HydrophobicContact CE1-CD1 3.8Å; Y451-L678 HydrophobicContact CE2-CD1 4.38Å; Y451-L678 HydrophobicContact CG-CD1 3.69Å; Y451-L678 HydrophobicContact CG-CD2 4.31Å; A675-L678 HydrophobicContact CB-CD1 4.31Å; L678-L680 PolarHBondContact O-N 3.09Å; L678-L683 HydrophobicContact CB-CD1 4.22Å; L678-L683 HydrophobicContact CD1-CD1 3.93Å; L678-L683 HydrophobicContact CD1-CD2 4.15Å; L678-L683 HydrophobicContact CD2-CD2 4.27Å
679	S	85.3	Confident	89.2	Confident	29 Å²	29	50.1 Å²	50.1	20%	0.203	26%	0.264	C	S	.	.			trans	-76.1	112.1	161.9	-162.9	0	0	0	0	109.9	E448 D681 G682	E448-S679 PolarHBondContact OE1-N 3.49Å; S679-D681 PolarHBondContact O-N 3.4Å; S679-D681 VanDerWaalsContact O-N 3.11Å; S679-G682 PolarHBondContact O-N 2.94Å
680	L	87.9	Confident	89.2	Confident	64 Å²	64	47.5 Å²	47.5	34%	0.335	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-55.6	-31.5	179.7	-69	-179.5	0	0	0	113.1	L678 G682 L683 R688 C691	L678-L680 PolarHBondContact O-N 3.09Å; L680-G682 VanDerWaalsContact C-N 3.31Å; L680-G682 PolarHBondContact O-N 3.07Å; L680-L683 HydrophobicContact CD2-CD1 4.12Å; L680-L683 PolarHBondContact O-N 2.95Å; L680-R688 HydrophobicContact CB-CG 4.36Å; L680-R688 PolarHBondContact O-NE 3.21Å; L680-R688 PolarHBondContact O-NH2 3.29Å; L680-C691 HydrophobicContact CD2-CB 4.1Å
681	D	88.6	Confident	89.2	Confident	131 Å²	131	45 Å²	45	70%	0.701	24%	0.244	S	C	*	.	G	3₁₀ helix	trans	-64.8	-31.9	177.5	-55.4	-48.5	0	0	0	113.3	S679 L683 R688	S679-D681 PolarHBondContact O-N 3.4Å; S679-D681 VanDerWaalsContact O-N 3.11Å; D681-L683 VanDerWaalsContact C-N 3.29Å; D681-R688 PolarHBondContact O-NH2 3.23Å
682	G	86	Confident	88.9	Confident	38 Å²	38	46.5 Å²	46.5	39%	0.392	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-82.2	-4.9	178.3	0	0	0	0	0	114	N452 S679 L680	N452-G682 PolarHBondContact ND2-O 2.94Å; S679-G682 PolarHBondContact O-N 2.94Å; L680-G682 VanDerWaalsContact C-N 3.31Å; L680-G682 PolarHBondContact O-N 3.07Å
683	L	91.8	Very high	87.7	Confident	5 Å²	5	48.4 Å²	48.4	3%	0.026	26%	0.261	C	S	.	.	S	Bend	trans	-91	147.4	178.7	-63	-179.8	0	0	0	112.5	E448 N452 L678 L680 D681 M687 R688 C691	E448-L683 HydrophobicContact CB-CD2 4.25Å; E448-L683 HydrophobicContact CG-CD2 4.32Å; N452-L683 VanDerWaalsContact OD1-CA 3.3Å; N452-L683 WeakPolarHBondContact OD1-CA 3.15Å; L678-L683 HydrophobicContact CB-CD1 4.22Å; L678-L683 HydrophobicContact CD1-CD1 3.93Å; L678-L683 HydrophobicContact CD1-CD2 4.15Å; L678-L683 HydrophobicContact CD2-CD2 4.27Å; L680-L683 HydrophobicContact CD2-CD1 4.12Å; L680-L683 PolarHBondContact O-N 2.95Å; D681-L683 VanDerWaalsContact C-N 3.29Å; L683-M687 HydrophobicContact CB-CB 4.11Å; L683-M687 HydrophobicContact CD1-CB 4.49Å; L683-M687 HydrophobicContact CD2-CB 4.38Å; L683-R688 HydrophobicContact CB-CB 4.28Å; L683-R688 PolarHBondContact O-NH2 2.91Å; L683-C691 HydrophobicContact CD1-CB 3.95Å
684	S	92.2	Very high	86.5	Confident	22 Å²	22	46.4 Å²	46.4	15%	0.154	25%	0.25	C	C	.	.			trans	-54.4	157.6	168	90.7	0	0	0	0	111	N452 D455 L686 M687 R688	N452-S684 PolarHBondContact OD1-N 3.32Å; D455-S684 VanDerWaalsContact OD1-CB 3.3Å; D455-S684 WeakPolarHBondContact OD1-CB 3.29Å; D455-S684 PolarHBondContact OD1-OG 3.19Å; S684-L686 PolarHBondContact O-N 2.99Å; S684-L686 VanDerWaalsContact O-N 3.15Å; S684-L686 PolarHBondContact OG-N 2.91Å; S684-M687 PolarHBondContact O-N 3.23Å; S684-M687 WeakPolarHBondContact OG-CG 3.33Å; S684-M687 PolarHBondContact OG-N 3.22Å; S684-M687 VanDerWaalsContact OG-N 3.08Å; S684-R688 VanDerWaalsContact O-CB 3.23Å; S684-R688 WeakPolarHBondContact O-CB 3.11Å; S684-R688 PolarHBondContact O-N 3.49Å
685	P	92.8	Very high	84.6	Confident	108 Å²	108	49 Å²	49	70%	0.701	27%	0.269	S	S	*	.	H	α-helix	trans	-55.9	-34.9	179.5	-26.8	35.5	0	0	0	114	E689	P685-E689 PolarHBondContact O-N 3.48Å
686	L	93.1	Very high	82.4	Confident	26 Å²	26	53.7 Å²	53.7	14%	0.136	29%	0.293	C	S	.	.	H	α-helix	trans	-78.6	-42.5	179.8	177.9	59.4	0	0	0	111.8	D455 I458 R459 I462 S684 R688 E689 V690	D455-L686 WeakPolarHBondContact OD1-CB 3.29Å; I458-L686 HydrophobicContact CB-CD2 4.38Å; I458-L686 HydrophobicContact CG2-CD1 4.49Å; I458-L686 HydrophobicContact CG2-CD2 3.86Å; I458-L686 HydrophobicContact CG2-CG 4.22Å; R459-L686 HydrophobicContact CG-CD2 3.5Å; I462-L686 HydrophobicContact CD1-CD1 4.44Å; S684-L686 PolarHBondContact O-N 2.99Å; S684-L686 VanDerWaalsContact O-N 3.15Å; S684-L686 PolarHBondContact OG-N 2.91Å; L686-R688 VanDerWaalsContact C-N 3.29Å; L686-R688 PolarHBondContact O-N 3.42Å; L686-E689 PolarHBondContact O-N 3.25Å; L686-V690 WeakPolarHBondContact O-CG2 3.2Å; L686-V690 PolarHBondContact O-N 2.9Å
687	M	92.7	Very high	80.3	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-66.9	-33.4	175	-66.9	-50.7	-63.2	0	0	111.7	Y451 M454 D455 I458 L683 S684 V690 C691	Y451-M687 HydrophobicContact CD1-CE 3.64Å; Y451-M687 HydrophobicContact CG-CE 4.28Å; Y451-M687 WeakPolarHBondContact O-CE 3.39Å; Y451-M687 WeakPolarHBondContact O-CG 3.5Å; M454-M687 HydrophobicContact CB-CE 4.48Å; M454-M687 HydrophobicContact CB-SD 4.4Å; D455-M687 HydrophobicContact CB-CG 4.31Å; I458-M687 HydrophobicContact CD1-CE 4.19Å; I458-M687 HydrophobicContact CD1-SD 3.48Å; I458-M687 WeakPolarHBondContact CD1-SD 3.37Å; L683-M687 HydrophobicContact CB-CB 4.11Å; L683-M687 HydrophobicContact CD1-CB 4.49Å; L683-M687 HydrophobicContact CD2-CB 4.38Å; S684-M687 PolarHBondContact O-N 3.23Å; S684-M687 WeakPolarHBondContact OG-CG 3.33Å; S684-M687 PolarHBondContact OG-N 3.22Å; S684-M687 VanDerWaalsContact OG-N 3.08Å; M687-V690 PolarHBondContact O-N 3.5Å; M687-C691 WeakPolarHBondContact O-CB 3.41Å; M687-C691 PolarHBondContact O-N 2.94Å; M687-C691 PolarHBondContact O-SG 3.25Å; M687-C691 VanDerWaalsContact O-SG 3.35Å
688	R	92.9	Very high	77.7	Confident	99 Å²	99	55 Å²	55	37%	0.374	32%	0.321	S	S	.	.	H	α-helix	trans	-61.4	-42.8	170.5	-167.9	178	-58.4	173.6	7.2	111.7	L680 D681 L683 S684 L686 S692	L680-R688 HydrophobicContact CB-CG 4.36Å; L680-R688 PolarHBondContact O-NE 3.21Å; L680-R688 PolarHBondContact O-NH2 3.29Å; D681-R688 PolarHBondContact O-NH2 3.23Å; L683-R688 HydrophobicContact CB-CB 4.28Å; L683-R688 PolarHBondContact O-NH2 2.91Å; S684-R688 VanDerWaalsContact O-CB 3.23Å; S684-R688 WeakPolarHBondContact O-CB 3.11Å; S684-R688 PolarHBondContact O-N 3.49Å; L686-R688 VanDerWaalsContact C-N 3.29Å; L686-R688 PolarHBondContact O-N 3.42Å; R688-S692 WeakPolarHBondContact O-CB 3.37Å; R688-S692 PolarHBondContact O-N 3.06Å; R688-S692 PolarHBondContact O-OG 2.93Å
689	E	91.3	Very high	75.2	Confident	77 Å²	77	58.5 Å²	58.5	36%	0.36	35%	0.346	S	S	.	.	H	α-helix	trans	-62.7	-48.9	173.1	-167.4	-168.9	156	0	0	111.6	R484 P685 L686 C691 S692 Q693	R484-E689 IonicContact CZ-OE1 3.01Å; R484-E689 IonicContact NE-OE1 3.35Å; R484-E689 PolarHBondContact NE-OE1 2.81Å; R484-E689 IonicContact NH2-OE1 2.81Å; R484-E689 PolarHBondContact NH2-OE1 2.84Å; P685-E689 PolarHBondContact O-N 3.48Å; L686-E689 PolarHBondContact O-N 3.25Å; E689-C691 VanDerWaalsContact C-N 3.35Å; E689-C691 PolarHBondContact O-N 2.94Å; E689-S692 PolarHBondContact O-OG 2.96Å; E689-Q693 PolarHBondContact OE1-NE2 3.41Å; E689-Q693 VanDerWaalsContact OE1-NE2 3.15Å
690	V	90.3	Very high	72.6	Confident	22 Å²	22	63.1 Å²	63.1	13%	0.133	37%	0.374	C	S	.	.	H	α-helix	trans	-60.1	-40.7	-178.3	166.7	0	0	0	0	112.6	I487 Y488 L686 M687	I487-V690 HydrophobicContact CG2-CG1 3.74Å; Y488-V690 HydrophobicContact CE1-CG1 3.97Å; L686-V690 WeakPolarHBondContact O-CG2 3.2Å; L686-V690 PolarHBondContact O-N 2.9Å; M687-V690 PolarHBondContact O-N 3.5Å
691	C	89.2	Confident	69.7	Low	6 Å²	6	62.7 Å²	62.7	4%	0.041	38%	0.376	C	S	.	.	H	α-helix	trans	-83	-44.9	-178.2	-66.3	0	0	0	0	113	Y488 L680 L683 M687 E689 Q693 R694	Y488-C691 PolarHBondContact OH-SG 2.88Å; L680-C691 HydrophobicContact CD2-CB 4.1Å; L683-C691 HydrophobicContact CD1-CB 3.95Å; M687-C691 WeakPolarHBondContact O-CB 3.41Å; M687-C691 PolarHBondContact O-N 2.94Å; M687-C691 PolarHBondContact O-SG 3.25Å; M687-C691 VanDerWaalsContact O-SG 3.35Å; E689-C691 VanDerWaalsContact C-N 3.35Å; E689-C691 PolarHBondContact O-N 2.94Å; C691-Q693 VanDerWaalsContact C-N 3.33Å; C691-Q693 PolarHBondContact O-N 3.24Å; C691-R694 WeakPolarHBondContact O-CB 3.35Å; C691-R694 PolarHBondContact O-N 3.44Å
692	S	82.3	Confident	66.8	Low	33 Å²	33	62.7 Å²	62.7	23%	0.231	39%	0.394	C	S	.	.	H	α-helix	trans	-61.5	-35.7	-174.2	57.6	0	0	0	0	113.9	R688 E689 R694 S695	R688-S692 WeakPolarHBondContact O-CB 3.37Å; R688-S692 PolarHBondContact O-N 3.06Å; R688-S692 PolarHBondContact O-OG 2.93Å; E689-S692 PolarHBondContact O-OG 2.96Å; S692-R694 PolarHBondContact O-N 3.03Å; S692-S695 PolarHBondContact O-N 3.48Å; S692-S695 PolarHBondContact O-OG 3.26Å
693	Q	64.3	Low	65.8	Low	64 Å²	64	64 Å²	64	30%	0.299	39%	0.394	S	S	.	.	H	α-helix	trans	-71.3	-16	179.8	-64.1	179.7	30.1	0	0	112.8	R484 E689 C691	R484-Q693 VanDerWaalsContact CZ-NE2 3.31Å; E689-Q693 PolarHBondContact OE1-NE2 3.41Å; E689-Q693 VanDerWaalsContact OE1-NE2 3.15Å; C691-Q693 VanDerWaalsContact C-N 3.33Å; C691-Q693 PolarHBondContact O-N 3.24Å
694	R	63.1	Low	64.4	Low	42 Å²	42	67.1 Å²	67.1	16%	0.158	41%	0.414	C	S	.	.	H	α-helix	trans	-87.9	-17	176	-64.9	178.9	174.7	-112.4	-6.3	113.4	R484 T485 T672 C691 S692	R484-R694 PolarHBondContact O-NH2 3.46Å; T485-R694 PolarHBondContact O-NH2 3.06Å; T672-R694 PolarHBondContact OG1-NH1 3.3Å; C691-R694 WeakPolarHBondContact O-CB 3.35Å; C691-R694 PolarHBondContact O-N 3.44Å; S692-R694 PolarHBondContact O-N 3.03Å
695	S	47.6	Very low	62.9	Low	65 Å²	65	69.6 Å²	69.6	46%	0.455	43%	0.428	S	S	.	.	H	α-helix	trans	-75.6	-37.2	172.4	57.3	0	0	0	0	112.4	S692 L697 G698	S692-S695 PolarHBondContact O-N 3.48Å; S692-S695 PolarHBondContact O-OG 3.26Å; S695-L697 VanDerWaalsContact C-N 3.31Å; S695-L697 PolarHBondContact O-N 3.15Å; S695-G698 PolarHBondContact O-N 2.97Å
696	N	41	Very low	61.1	Low	109 Å²	109	67.3 Å²	67.3	58%	0.583	41%	0.412	S	S	*	.	G	3₁₀ helix	trans	-73.3	-21.7	-174.6	-64.4	1.7	0	0	0	113.5	G698 S699	N696-G698 PolarHBondContact O-N 2.74Å; N696-G698 VanDerWaalsContact O-N 3.11Å; N696-S699 PolarHBondContact O-N 2.93Å; N696-S699 PolarHBondContact O-OG 2.91Å; N696-S699 VanDerWaalsContact O-OG 3.05Å
697	L	42.5	Very low	59.1	Low	134 Å²	134	69.9 Å²	69.9	70%	0.702	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-66.8	-4.5	173.3	-81	161.6	0	0	0	113.9	S695	S695-L697 VanDerWaalsContact C-N 3.31Å; S695-L697 PolarHBondContact O-N 3.15Å
698	G	32.4	Very low	56.9	Low	64 Å²	64	74.5 Å²	74.5	66%	0.66	46%	0.458	S	S	*	.	G	3₁₀ helix	trans	-103.8	3.3	173.8	0	0	0	0	0	115.4	S695 N696	S695-G698 PolarHBondContact O-N 2.97Å; N696-G698 PolarHBondContact O-N 2.74Å; N696-G698 VanDerWaalsContact O-N 3.11Å
699	S	31.5	Very low	54.3	Low	90 Å²	90	72.8 Å²	72.8	63%	0.629	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.5	-8.5	-173.3	60.4	0	0	0	0	115.7	N696	N696-S699 PolarHBondContact O-N 2.93Å; N696-S699 PolarHBondContact O-OG 2.91Å; N696-S699 VanDerWaalsContact O-OG 3.05Å
700	T	31.5	Very low	51.5	Low	127 Å²	127	72.5 Å²	72.5	78%	0.779	47%	0.472	S	S	*	.	S	Bend	trans	-112.3	19.6	178.6	61.3	0	0	0	0	113.1
701	S	27.7	Very low	48.2	Very low	55 Å²	55	76.7 Å²	76.7	39%	0.385	50%	0.5	S	S	.	.			trans	-150.2	89.4	175.1	65	0	0	0	0	109.3
702	A	26.1	Very low	44.5	Very low	131 Å²	131	83.1 Å²	83.1	100%	1.083	54%	0.542	S	S	*	.			trans	-126.8	0	164.3	0	0	0	0	0	107.3	D292	D292-A702 WeakPolarHBondContact CB-OXT 3.44Å

Retrieved 702 of 702 residues in 434.1 ms (Link to these results)

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