A0A0D9R4J6_CHLSB Loading...

Proton myo-inositol cotransporter

H(+)-myo-inositol cotransporter. Can also transport related stereoisomers.

AlphaFold DB , UniProt , Accession A0A0D9R4J6, Species CHLSB (Chlorocebus sabaeus, Green monkey), Gene SLC2A13, Length 647 aa.

Structure Viewer

Loading PAE data...

(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	33.2	Very low	26.1	Very low	247 Å²	247	169.4 Å²	169.4	100%	1.217	86%	0.862	S	S	*	*				0	119.3	0	-92.3	174.9	164.1	0	0	108.9
2	S	27.3	Very low	26	Very low	130 Å²	130	165 Å²	165	91%	0.909	85%	0.85	S	S	*	*			trans	48.6	133.4	158	-141	0	0	0	0	124
3	R	25.4	Very low	26	Very low	235 Å²	235	165.5 Å²	165.5	89%	0.887	85%	0.853	S	S	*	*			trans	-74.7	157.4	173.8	-68.8	166.9	161.3	165.6	-7.2	114
4	K	27	Very low	26	Very low	199 Å²	199	170.6 Å²	170.6	87%	0.865	86%	0.856	S	S	*	*				-177.8	112.7	129.1	-99.4	175.3	178.9	-175.7	0	106.9
5	A	26.9	Very low	26	Very low	98 Å²	98	166.3 Å²	166.3	81%	0.81	85%	0.849	S	S	*	*				51.7	136.7	80.2	0	0	0	0	0	112.3
6	S	24.1	Very low	26	Very low	104 Å²	104	165.8 Å²	165.8	73%	0.727	85%	0.847	S	S	*	*			cis	173.2	128.5	-4.6	160.2	0	0	0	0	102.2
7	E	25	Very low	25.9	Very low	193 Å²	193	162.3 Å²	162.3	90%	0.902	84%	0.841	S	S	*	*			trans	-158.4	104.9	157.3	-117	167.9	-161.3	0	0	110.5
8	N	22.7	Very low	25.8	Very low	154 Å²	154	159.6 Å²	159.6	82%	0.824	84%	0.839	S	S	*	*			trans	-74.3	131.8	165.9	-77.8	-29.6	0	0	0	108.5
9	V	25.7	Very low	25.9	Very low	112 Å²	112	159.9 Å²	159.9	68%	0.679	84%	0.841	S	S	*	*			trans	-134.5	107.7	155.9	-178.4	0	0	0	0	108.9	Y11	V9-Y11 HydrophobicContact CG1-CD2 3.63Å; V9-Y11 HydrophobicContact CG1-CE2 3.35Å
10	E	23.5	Very low	26.1	Very low	170 Å²	170	161.7 Å²	161.7	79%	0.794	85%	0.847	S	S	*	*			trans	-82.2	129.5	173.3	-170.4	175.5	-158.2	0	0	108
11	Y	26.1	Very low	26	Very low	221 Å²	221	157.1 Å²	157.1	87%	0.867	84%	0.839	S	S	*	*			trans	-128.6	114.5	164.7	-87.7	-71.1	0	0	0	111.3	V9	V9-Y11 HydrophobicContact CG1-CD2 3.63Å; V9-Y11 HydrophobicContact CG1-CE2 3.35Å
12	T	25.3	Very low	25.8	Very low	117 Å²	117	153.9 Å²	153.9	72%	0.718	82%	0.82	S	S	*	*			trans	-81.1	142	-172.9	-31.3	0	0	0	0	111.7
13	L	26.1	Very low	25.7	Very low	171 Å²	171	160 Å²	160	90%	0.895	82%	0.823	S	S	*	*			trans	-65	124.9	163.3	-91.5	149.9	0	0	0	111.4
14	R	25.6	Very low	25.6	Very low	237 Å²	237	158.8 Å²	158.8	89%	0.894	82%	0.819	S	S	*	*			trans	-147.8	112.4	156.4	-89.6	-168.9	176.5	175.7	-0.9	112.7
15	S	26	Very low	25.6	Very low	106 Å²	106	159.4 Å²	159.4	74%	0.741	82%	0.816	S	S	*	*			trans	35.4	115.3	130.7	-178.4	0	0	0	0	121.6
16	L	25.5	Very low	25.4	Very low	158 Å²	158	162.3 Å²	162.3	83%	0.827	81%	0.81	S	S	*	*				34.3	135.6	120.7	-90.7	153	0	0	0	122.2
17	S	24.6	Very low	25.4	Very low	107 Å²	107	164.9 Å²	164.9	75%	0.748	81%	0.811	S	S	*	*			trans	86.9	100.1	148.3	77.5	0	0	0	0	119
18	S	24.7	Very low	25.3	Very low	114 Å²	114	165.1 Å²	165.1	80%	0.797	81%	0.812	S	S	*	*			trans	171.5	158	131.3	56	0	0	0	0	109.6
19	L	27.7	Very low	25.3	Very low	166 Å²	166	166.3 Å²	166.3	87%	0.869	81%	0.813	S	S	*	*			trans	97.5	57.9	175.6	-56.7	160.1	0	0	0	116.2
20	M	29.3	Very low	25.9	Very low	195 Å²	195	166 Å²	166	96%	0.961	81%	0.812	S	S	*	*				-73.5	136.8	126.1	-85.8	-164.5	-73.5	0	0	108.5
21	G	24.6	Very low	25.9	Very low	66 Å²	66	165.8 Å²	165.8	68%	0.68	82%	0.817	S	S	*	*			trans	172	81.5	170.6	0	0	0	0	0	114
22	E	28	Very low	25.8	Very low	178 Å²	178	159.8 Å²	159.8	83%	0.832	81%	0.813	S	S	*	*			trans	48.5	126.6	133	-73.7	-169.6	134.5	0	0	121.2
23	R	25.3	Very low	25.8	Very low	258 Å²	258	158.4 Å²	158.4	97%	0.974	81%	0.814	S	S	*	*				-161.2	135.1	118.8	-107.7	168.2	-165.5	-168.8	4.9	113.6
24	R	24.6	Very low	25.7	Very low	211 Å²	211	156.1 Å²	156.1	80%	0.796	81%	0.812	S	S	*	*			trans	-78.4	167.2	-176.8	-92.2	172.5	162.3	167.6	-4.3	114.8
25	R	26.2	Very low	25.6	Very low	212 Å²	212	149.2 Å²	149.2	80%	0.8	81%	0.805	S	S	*	*			trans	81.5	140.7	145.9	-88.2	174.3	175.5	179.3	-1.7	115.8
26	K	23.6	Very low	25.6	Very low	159 Å²	159	149.5 Å²	149.5	69%	0.691	81%	0.814	S	S	*	*			cis	-166.9	135.5	30.1	-116.4	172.3	178.1	-172.9	0	107.4
27	Q	23.2	Very low	25.5	Very low	158 Å²	158	145 Å²	145	74%	0.738	81%	0.806	S	S	*	*				82.1	107.9	94.7	-167.6	171.9	12.4	0	0	115.2
28	Q	22.6	Very low	25.6	Very low	197 Å²	197	149.3 Å²	149.3	92%	0.921	81%	0.814	S	S	*	*			trans	-169.2	123.5	131	-137.6	143.3	-8.3	0	0	113
29	E	23.3	Very low	25.5	Very low	180 Å²	180	149.3 Å²	149.3	84%	0.841	81%	0.813	S	S	*	*			trans	-121	174.3	156	-119.9	-177.1	-179.7	0	0	104.7
30	P	38.9	Very low	25.4	Very low	104 Å²	104	147.3 Å²	147.3	68%	0.675	81%	0.813	S	S	*	*			cis	-136.3	-177.1	2.3	34.8	-12.8	0	0	0	113.5
31	D	22.8	Very low	25.2	Very low	167 Å²	167	145.5 Å²	145.5	89%	0.893	81%	0.806	S	S	*	*			trans	-167.9	156.4	131.5	-95.2	-19.7	0	0	0	112.1
32	A	24.8	Very low	25.3	Very low	95 Å²	95	150.1 Å²	150.1	79%	0.785	81%	0.814	S	S	*	*			trans	-107.9	168.3	-144.5	0	0	0	0	0	116.6
33	A	24.6	Very low	25.1	Very low	88 Å²	88	146.5 Å²	146.5	73%	0.727	82%	0.815	S	S	*	*			trans	102.6	123.5	134.1	0	0	0	0	0	121.8
34	S	23.1	Very low	25.1	Very low	122 Å²	122	139.4 Å²	139.4	85%	0.853	81%	0.812	S	S	*	*			trans	76.9	146.7	145.3	79.5	0	0	0	0	118.8
35	A	24.6	Very low	25	Very low	92 Å²	92	133.8 Å²	133.8	76%	0.76	81%	0.81	S	S	*	*			cis	-176.5	154.8	-19.8	0	0	0	0	0	106.4
36	A	25.4	Very low	24.9	Very low	112 Å²	112	133 Å²	133	93%	0.926	82%	0.815	S	S	*	*			trans	69.8	136	166.6	0	0	0	0	0	117.7
37	G	24	Very low	24.9	Very low	63 Å²	63	131.2 Å²	131.2	65%	0.649	82%	0.823	S	S	*	*			cis	175.9	151.5	1.1	0	0	0	0	0	109.2
38	E	26.3	Very low	25	Very low	199 Å²	199	128.7 Å²	128.7	93%	0.93	82%	0.823	S	S	*	*			trans	57.3	144.4	150.7	-70.2	-179.9	146.4	0	0	119.6
39	C	23.6	Very low	25.1	Very low	113 Å²	113	125.9 Å²	125.9	76%	0.764	82%	0.819	S	S	*	*			cis	-176.3	128.4	-6.6	-173	0	0	0	0	104.9
40	S	25.4	Very low	25.1	Very low	124 Å²	124	123.2 Å²	123.2	87%	0.867	82%	0.821	S	S	*	*			trans	-174.3	81.6	149.1	52.3	0	0	0	0	109.6
41	L	24.4	Very low	24.7	Very low	157 Å²	157	126.5 Å²	126.5	82%	0.822	83%	0.832	S	S	*	*			trans	-78.8	137.8	157.6	-91.2	157.2	0	0	0	108.6
42	L	25.9	Very low	24.8	Very low	163 Å²	163	127.5 Å²	127.5	85%	0.853	83%	0.831	S	S	*	*				152.7	103.1	120.2	-81.3	174.4	0	0	0	110.7
43	A	24.2	Very low	24.9	Very low	103 Å²	103	128.1 Å²	128.1	85%	0.851	83%	0.83	S	S	*	*	S	Bend		165.9	89.7	121.9	0	0	0	0	0	110.1
44	A	25.2	Very low	25	Very low	109 Å²	109	128.9 Å²	128.9	90%	0.901	84%	0.836	S	S	*	*			trans	-178.7	71.9	148.5	0	0	0	0	0	109.6
45	A	22.8	Very low	25.1	Very low	92 Å²	92	126.6 Å²	126.6	76%	0.76	83%	0.831	S	S	*	*			trans	-139.6	108.6	160.7	0	0	0	0	0	106.9
46	E	24.6	Very low	25.6	Very low	195 Å²	195	128 Å²	128	91%	0.911	84%	0.843	S	S	*	*				167.9	113.3	124	-92.4	179.8	179.1	0	0	109.7
47	S	23.3	Very low	26	Very low	123 Å²	123	126.1 Å²	126.1	86%	0.86	83%	0.834	S	S	*	*			trans	170.2	87.2	130.5	177.1	0	0	0	0	108.6
48	S	25.2	Very low	26.5	Very low	105 Å²	105	125 Å²	125	73%	0.734	82%	0.824	S	S	*	*			trans	-89.5	124.6	158.2	50.4	0	0	0	0	108.2
49	T	24.1	Very low	27.1	Very low	137 Å²	137	118.2 Å²	118.2	84%	0.84	81%	0.806	S	S	*	*				170.2	113.7	128.9	34.1	0	0	0	0	111.3
50	S	24.1	Very low	28.2	Very low	124 Å²	124	118.2 Å²	118.2	87%	0.867	80%	0.803	S	S	*	*				-168.2	113	125.8	52.2	0	0	0	0	109
51	L	30.6	Very low	29.3	Very low	174 Å²	174	113.6 Å²	113.6	91%	0.911	78%	0.775	S	S	*	*			trans	-82.9	126.6	166.3	-120.4	103.1	0	0	0	107.6
52	Q	25.1	Very low	30.6	Very low	187 Å²	187	110.4 Å²	110.4	87%	0.874	76%	0.759	S	S	*	*			trans	-163.9	122.3	145.8	-109.1	164.7	24	0	0	112.7
53	S	26.3	Very low	31.9	Very low	109 Å²	109	109 Å²	109	76%	0.762	75%	0.751	S	S	*	*			trans	37.6	116.9	151.1	66	0	0	0	0	120.6
54	A	26.6	Very low	33.2	Very low	104 Å²	104	109.1 Å²	109.1	86%	0.86	73%	0.734	S	S	*	*				176.4	127.9	118.1	0	0	0	0	0	112.1
55	G	25.4	Very low	34.5	Very low	73 Å²	73	110.6 Å²	110.6	75%	0.753	72%	0.716	S	S	*	*			trans	66.8	107.2	134.9	0	0	0	0	0	119.4	G57	G55-G57 PolarHBondContact O-N 3.35Å
56	A	35.6	Very low	35.9	Very low	121 Å²	121	108.4 Å²	108.4	100%	1	70%	0.698	S	S	*	*	S	Bend	trans	-55.5	101.8	152.7	0	0	0	0	0	110
57	G	34.3	Very low	37.1	Very low	73 Å²	73	101.5 Å²	101.5	75%	0.753	67%	0.674	S	S	*	*			trans	-167.2	8.5	-179.8	0	0	0	0	0	116	G55	G55-G57 PolarHBondContact O-N 3.35Å
58	G	33.4	Very low	38.3	Very low	41 Å²	41	103.6 Å²	103.6	42%	0.423	66%	0.664	S	S	.	*			trans	-86.8	-12	-170.5	0	0	0	0	0	116.9	V60 D62	G58-V60 PolarHBondContact O-N 3.38Å; G58-D62 PolarHBondContact O-N 2.88Å
59	G	40.2	Very low	39.2	Very low	55 Å²	55	106.7 Å²	106.7	57%	0.567	66%	0.659	S	S	*	*	H	α-helix	trans	-64.6	-36.8	-165.5	0	0	0	0	0	115.5	L63	G59-L63 WeakPolarHBondContact O-CB 3.01Å; G59-L63 PolarHBondContact O-N 3.42Å
60	V	46	Very low	40.2	Very low	113 Å²	113	106.6 Å²	106.6	69%	0.685	65%	0.649	S	S	*	*	H	α-helix	trans	-81.4	-42.5	-173.4	-178.2	0	0	0	0	111.7	G58 D62 L63 E64	G58-V60 PolarHBondContact O-N 3.38Å; V60-D62 VanDerWaalsContact C-N 3.35Å; V60-D62 PolarHBondContact O-N 3.35Å; V60-L63 PolarHBondContact O-N 2.93Å; V60-E64 VanDerWaalsContact O-CB 3.22Å; V60-E64 WeakPolarHBondContact O-CB 3.48Å; V60-E64 PolarHBondContact O-N 2.71Å
61	G	47.4	Very low	41.3	Very low	27 Å²	27	108.9 Å²	108.9	28%	0.278	64%	0.644	S	S	.	*	H	α-helix	trans	-71	-29	-179.3	0	0	0	0	0	113.7	R65	G61-R65 VanDerWaalsContact O-CB 3.31Å; G61-R65 WeakPolarHBondContact O-CB 3.31Å; G61-R65 PolarHBondContact O-N 3Å
62	D	51.6	Low	41.6	Very low	91 Å²	91	108.5 Å²	108.5	49%	0.487	64%	0.637	S	S	.	*	H	α-helix	trans	-78.7	-35.5	173.6	-69.8	-23.1	0	0	0	111.8	G58 V60 E64 R65 A66	G58-D62 PolarHBondContact O-N 2.88Å; V60-D62 VanDerWaalsContact C-N 3.35Å; V60-D62 PolarHBondContact O-N 3.35Å; D62-E64 VanDerWaalsContact C-N 3.34Å; D62-R65 IonicContact OD1-CZ 3.65Å; D62-R65 IonicContact OD1-NH1 3.65Å; D62-R65 PolarHBondContact OD1-NH1 3Å; D62-R65 IonicContact OD1-NH2 3.41Å; D62-A66 WeakPolarHBondContact O-CB 3.16Å; D62-A66 PolarHBondContact O-N 3.3Å
63	L	54.2	Low	42.2	Very low	132 Å²	132	106.8 Å²	106.8	69%	0.691	63%	0.629	S	S	*	*	H	α-helix	trans	-66.3	-37	170.2	-129	92.5	0	0	0	111.7	G59 V60 A66 A67	G59-L63 WeakPolarHBondContact O-CB 3.01Å; G59-L63 PolarHBondContact O-N 3.42Å; V60-L63 PolarHBondContact O-N 2.93Å; L63-A66 PolarHBondContact O-N 3.16Å; L63-A67 WeakPolarHBondContact O-CA 3.16Å; L63-A67 WeakPolarHBondContact O-CB 3.45Å; L63-A67 PolarHBondContact O-N 3.03Å
64	E	51.6	Low	43.4	Very low	107 Å²	107	104.5 Å²	104.5	50%	0.5	61%	0.609	S	S	.	*	H	α-helix	trans	-75.9	-34.8	-179.8	-161.2	174	-176.3	0	0	111.4	V60 D62 R68	V60-E64 VanDerWaalsContact O-CB 3.22Å; V60-E64 WeakPolarHBondContact O-CB 3.48Å; V60-E64 PolarHBondContact O-N 2.71Å; D62-E64 VanDerWaalsContact C-N 3.34Å; E64-R68 VanDerWaalsContact O-CB 3.26Å; E64-R68 WeakPolarHBondContact O-CB 3.39Å; E64-R68 VanDerWaalsContact O-CG 3.25Å; E64-R68 WeakPolarHBondContact O-CG 3.44Å; E64-R68 PolarHBondContact O-N 3.44Å
65	R	52.8	Low	44.7	Very low	139 Å²	139	108.3 Å²	108.3	53%	0.525	61%	0.609	S	S	.	*	H	α-helix	trans	-70.7	-35.9	167.5	-90.2	-178.2	-96.8	108.6	2.6	112.4	G61 D62 R69	G61-R65 VanDerWaalsContact O-CB 3.31Å; G61-R65 WeakPolarHBondContact O-CB 3.31Å; G61-R65 PolarHBondContact O-N 3Å; D62-R65 IonicContact OD1-CZ 3.65Å; D62-R65 IonicContact OD1-NH1 3.65Å; D62-R65 PolarHBondContact OD1-NH1 3Å; D62-R65 IonicContact OD1-NH2 3.41Å; R65-R69 VanDerWaalsContact O-CB 3.3Å; R65-R69 WeakPolarHBondContact O-CB 3.23Å; R65-R69 WeakPolarHBondContact O-CG 3.38Å; R65-R69 PolarHBondContact O-N 3.29Å
66	A	50.7	Low	46.6	Very low	46 Å²	46	106.7 Å²	106.7	38%	0.38	58%	0.584	S	S	.	*	H	α-helix	trans	-68.2	-44.9	173.5	0	0	0	0	0	110.9	D62 L63 R68 R69 Q70	D62-A66 WeakPolarHBondContact O-CB 3.16Å; D62-A66 PolarHBondContact O-N 3.3Å; L63-A66 PolarHBondContact O-N 3.16Å; A66-R68 PolarHBondContact O-N 3.42Å; A66-R69 CarbonylContact O-C 3.26Å; A66-R69 WeakPolarHBondContact O-CB 3.46Å; A66-R69 PolarHBondContact O-N 3.01Å; A66-R69 VanDerWaalsContact O-N 3.14Å; A66-Q70 WeakPolarHBondContact O-CB 3.44Å; A66-Q70 PolarHBondContact O-N 2.76Å
67	A	50.8	Low	48.5	Very low	50 Å²	50	102.3 Å²	102.3	41%	0.413	55%	0.546	S	S	.	.	H	α-helix	trans	-63.7	-39.4	174.8	0	0	0	0	0	111.8	L63 Q70 F71	L63-A67 WeakPolarHBondContact O-CA 3.16Å; L63-A67 WeakPolarHBondContact O-CB 3.45Å; L63-A67 PolarHBondContact O-N 3.03Å; A67-Q70 PolarHBondContact O-N 3.27Å; A67-F71 WeakPolarHBondContact O-CB 3.5Å; A67-F71 PolarHBondContact O-N 3.4Å
68	R	47.8	Very low	50.6	Low	168 Å²	168	102.5 Å²	102.5	63%	0.634	54%	0.54	S	S	*	.	H	α-helix	trans	-66.3	-36.8	170.9	-79.3	-179.7	-175.7	-150.9	3.5	112.7	E64 A66 Q72	E64-R68 VanDerWaalsContact O-CB 3.26Å; E64-R68 WeakPolarHBondContact O-CB 3.39Å; E64-R68 VanDerWaalsContact O-CG 3.25Å; E64-R68 WeakPolarHBondContact O-CG 3.44Å; E64-R68 PolarHBondContact O-N 3.44Å; A66-R68 PolarHBondContact O-N 3.42Å; R68-Q72 WeakPolarHBondContact O-CB 3.21Å; R68-Q72 WeakPolarHBondContact O-CG 3.3Å; R68-Q72 PolarHBondContact O-N 3.04Å
69	R	45.4	Very low	52.9	Low	169 Å²	169	104.1 Å²	104.1	64%	0.638	54%	0.535	S	S	*	.	H	α-helix	trans	-69.5	-36.1	173.5	-78.4	175.3	-179.1	-176.8	0.8	111.9	R65 A66 Q72 Q73	R65-R69 VanDerWaalsContact O-CB 3.3Å; R65-R69 WeakPolarHBondContact O-CB 3.23Å; R65-R69 WeakPolarHBondContact O-CG 3.38Å; R65-R69 PolarHBondContact O-N 3.29Å; A66-R69 CarbonylContact O-C 3.26Å; A66-R69 WeakPolarHBondContact O-CB 3.46Å; A66-R69 PolarHBondContact O-N 3.01Å; A66-R69 VanDerWaalsContact O-N 3.14Å; R69-Q72 CarbonylContact O-C 3.59Å; R69-Q72 PolarHBondContact O-N 3.25Å; R69-Q73 WeakPolarHBondContact O-CB 3.5Å; R69-Q73 PolarHBondContact O-N 3.43Å
70	Q	44.2	Very low	54.9	Low	136 Å²	136	101.6 Å²	101.6	64%	0.636	51%	0.509	S	S	*	.	H	α-helix	trans	-68.5	-43	173.6	-125.3	157.5	-32.1	0	0	111	A66 A67 Q72 Q73 D74	A66-Q70 WeakPolarHBondContact O-CB 3.44Å; A66-Q70 PolarHBondContact O-N 2.76Å; A67-Q70 PolarHBondContact O-N 3.27Å; Q70-Q72 PolarHBondContact O-N 3.46Å; Q70-Q73 CarbonylContact O-C 3.51Å; Q70-Q73 PolarHBondContact O-N 3.29Å; Q70-D74 PolarHBondContact O-N 3.1Å
71	F	46.3	Very low	56.7	Low	172 Å²	172	100.1 Å²	100.1	75%	0.754	49%	0.492	S	S	*	.	H	α-helix	trans	-62.5	-26.8	170.6	-116.5	-88.8	0	0	0	113.1	A67	A67-F71 WeakPolarHBondContact O-CB 3.5Å; A67-F71 PolarHBondContact O-N 3.4Å
72	Q	38.5	Very low	58.5	Low	165 Å²	165	102.2 Å²	102.2	77%	0.771	50%	0.499	S	S	*	.	H	α-helix	trans	-87.7	-11.9	174.4	-79.5	178.1	-35.1	0	0	113.3	R68 R69 Q70	R68-Q72 WeakPolarHBondContact O-CB 3.21Å; R68-Q72 WeakPolarHBondContact O-CG 3.3Å; R68-Q72 PolarHBondContact O-N 3.04Å; R69-Q72 CarbonylContact O-C 3.59Å; R69-Q72 PolarHBondContact O-N 3.25Å; Q70-Q72 PolarHBondContact O-N 3.46Å
73	Q	37.5	Very low	60.1	Low	151 Å²	151	97.9 Å²	97.9	71%	0.706	48%	0.476	S	S	*	.			trans	-107.9	16.4	179.1	-88.9	179	-41.7	0	0	113.6	R69 Q70 E75	R69-Q73 WeakPolarHBondContact O-CB 3.5Å; R69-Q73 PolarHBondContact O-N 3.43Å; Q70-Q73 CarbonylContact O-C 3.51Å; Q70-Q73 PolarHBondContact O-N 3.29Å; Q73-E75 VanDerWaalsContact C-N 3.26Å; Q73-E75 PolarHBondContact O-N 2.98Å
74	D	50	Low	61.5	Low	62 Å²	62	91.9 Å²	91.9	33%	0.332	45%	0.445	S	S	.	.			trans	-73.6	86.4	165.9	-76.8	-29.7	0	0	0	109	Q70 T76 Q285	Q70-D74 PolarHBondContact O-N 3.1Å; D74-T76 PolarHBondContact O-N 3.24Å; D74-Q285 HydrophobicContact CB-CG 4.46Å; D74-Q285 VanDerWaalsContact CG-NE2 3.25Å; D74-Q285 PolarHBondContact OD2-NE2 3.13Å
75	E	55.4	Low	63.1	Low	184 Å²	184	90 Å²	90	86%	0.86	44%	0.441	S	S	*	.			trans	-61	106.4	169.3	-70.6	-152.9	160	0	0	108.8	Q73 P77	Q73-E75 VanDerWaalsContact C-N 3.26Å; Q73-E75 PolarHBondContact O-N 2.98Å; E75-P77 WeakPolarHBondContact O-CD 3.27Å
76	T	64.7	Low	64.8	Low	39 Å²	39	86.5 Å²	86.5	24%	0.239	43%	0.43	C	S	.	.			trans	-55.9	124.9	171.7	50	0	0	0	0	108.5	D74 A78 Y81 P200 L203	D74-T76 PolarHBondContact O-N 3.24Å; T76-A78 PolarHBondContact O-N 2.88Å; T76-Y81 WeakPolarHBondContact OG1-CE2 3.33Å; T76-P200 HydrophobicContact CG2-CG 4.31Å; T76-L203 HydrophobicContact CG2-CD1 3.79Å
77	P	75.8	Confident	66.4	Low	29 Å²	29	84.3 Å²	84.3	19%	0.188	41%	0.412	C	S	.	.			trans	-55.4	134.3	-175.5	-25.9	33.3	0	0	0	110.7	E75 F79 V80 M281	E75-P77 WeakPolarHBondContact O-CD 3.27Å; P77-F79 HydrophobicContact CB-CB 4.16Å; P77-F79 PolarHBondContact O-N 3.47Å; P77-V80 PolarHBondContact O-N 3.24Å; P77-M281 WeakPolarHBondContact CD-O 3.34Å; P77-M281 WeakPolarHBondContact CG-O 3.25Å
78	A	78.8	Confident	68.2	Low	77 Å²	77	82 Å²	82	64%	0.636	39%	0.392	S	S	*	.	H	α-helix	trans	-51	-28.3	174.5	0	0	0	0	0	112.1	T76 V80 Y81 V82	T76-A78 PolarHBondContact O-N 2.88Å; A78-V80 VanDerWaalsContact C-N 3.28Å; A78-V80 PolarHBondContact O-N 3.33Å; A78-Y81 PolarHBondContact O-N 3.03Å; A78-V82 WeakPolarHBondContact O-CG2 3.49Å; A78-V82 PolarHBondContact O-N 3.17Å; A78-V82 VanDerWaalsContact O-N 3.12Å
79	F	82.1	Confident	70.2	Confident	74 Å²	74	75.3 Å²	75.3	33%	0.325	37%	0.369	S	S	.	.	H	α-helix	trans	-49.7	-41.4	171.5	-175.5	-107.6	0	0	0	114	P77 Y81 V82 V83 P259 M281	P77-F79 HydrophobicContact CB-CB 4.16Å; P77-F79 PolarHBondContact O-N 3.47Å; F79-Y81 PolarHBondContact O-N 3.03Å; F79-V82 PolarHBondContact O-N 3.35Å; F79-V83 HydrophobicContact CD1-CG2 4.04Å; F79-V83 HydrophobicContact CD2-CG2 4.42Å; F79-V83 HydrophobicContact CE1-CG2 3.71Å; F79-V83 HydrophobicContact CE2-CG2 4.12Å; F79-V83 HydrophobicContact CG-CG2 4.38Å; F79-V83 HydrophobicContact CZ-CG2 3.75Å; F79-V83 WeakPolarHBondContact O-CG2 3.38Å; F79-V83 PolarHBondContact O-N 3.29Å; F79-P259 HydrophobicContact CE1-CG 4.28Å; F79-P259 HydrophobicContact CZ-CG 3.98Å; F79-M281 HydrophobicContact CD1-CG 4.3Å; F79-M281 HydrophobicContact CE1-CG 4.05Å
80	V	82.1	Confident	72.3	Confident	3 Å²	3	67.3 Å²	67.3	2%	0.018	34%	0.339	C	S	.	.	H	α-helix	trans	-65.5	-40.1	-179.1	178.9	0	0	0	0	111.3	P77 A78 V83 A84 L207 M281	P77-V80 PolarHBondContact O-N 3.24Å; A78-V80 VanDerWaalsContact C-N 3.28Å; A78-V80 PolarHBondContact O-N 3.33Å; V80-V83 PolarHBondContact O-N 3.1Å; V80-A84 WeakPolarHBondContact O-CB 3.26Å; V80-A84 PolarHBondContact O-N 3.24Å; V80-L207 HydrophobicContact CG1-CD1 3.93Å; V80-M281 VanDerWaalsContact CG2-O 3.24Å; V80-M281 WeakPolarHBondContact CG2-O 3.3Å
81	Y	82.8	Confident	74.5	Confident	82 Å²	82	61 Å²	61	32%	0.322	31%	0.311	S	S	.	.	H	α-helix	trans	-67.4	-39.8	176.3	-68.4	-77.1	0	0	0	111.7	T76 A78 F79 A84 V85 L203 R206 L207	T76-Y81 WeakPolarHBondContact OG1-CE2 3.33Å; A78-Y81 PolarHBondContact O-N 3.03Å; F79-Y81 PolarHBondContact O-N 3.03Å; Y81-A84 PolarHBondContact O-N 3.29Å; Y81-V85 WeakPolarHBondContact O-CG2 3.18Å; Y81-V85 PolarHBondContact O-N 2.93Å; Y81-L203 WeakPolarHBondContact OH-CD1 3.42Å; Y81-R206 PolarHBondContact OH-NH2 3.42Å; Y81-L207 HydrophobicContact CD1-CD2 4.07Å; Y81-L207 HydrophobicContact CE1-CD2 4.07Å
82	V	85.9	Confident	76.8	Confident	70 Å²	70	54.5 Å²	54.5	42%	0.424	28%	0.282	S	S	.	.	H	α-helix	trans	-60.3	-49.1	174	175.4	0	0	0	0	110.3	A78 F79 A84 V85 F86	A78-V82 WeakPolarHBondContact O-CG2 3.49Å; A78-V82 PolarHBondContact O-N 3.17Å; A78-V82 VanDerWaalsContact O-N 3.12Å; F79-V82 PolarHBondContact O-N 3.35Å; V82-A84 VanDerWaalsContact C-N 3.32Å; V82-A84 PolarHBondContact O-N 3.46Å; V82-V85 PolarHBondContact O-N 3.29Å; V82-F86 HydrophobicContact CG1-CD2 3.76Å; V82-F86 HydrophobicContact CG1-CE2 3.9Å; V82-F86 WeakPolarHBondContact O-CD2 3.21Å; V82-F86 PolarHBondContact O-N 3.07Å
83	V	85.2	Confident	79.5	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.006	25%	0.246	C	C	.	.	H	α-helix	trans	-59.3	-44.4	177.6	-178.6	0	0	0	0	110.8	F79 V80 S87 Y194 V198 L258	F79-V83 HydrophobicContact CD1-CG2 4.04Å; F79-V83 HydrophobicContact CD2-CG2 4.42Å; F79-V83 HydrophobicContact CE1-CG2 3.71Å; F79-V83 HydrophobicContact CE2-CG2 4.12Å; F79-V83 HydrophobicContact CG-CG2 4.38Å; F79-V83 HydrophobicContact CZ-CG2 3.75Å; F79-V83 WeakPolarHBondContact O-CG2 3.38Å; F79-V83 PolarHBondContact O-N 3.29Å; V80-V83 PolarHBondContact O-N 3.1Å; V83-S87 VanDerWaalsContact O-CB 3.28Å; V83-S87 WeakPolarHBondContact O-CB 3.37Å; V83-S87 PolarHBondContact O-N 2.88Å; V83-S87 PolarHBondContact O-OG 3.48Å; V83-Y194 HydrophobicContact CG1-CE1 3.58Å; V83-V198 HydrophobicContact CB-CG1 4.41Å; V83-V198 HydrophobicContact CG1-CG1 4.01Å; V83-L258 HydrophobicContact CB-CD2 4.26Å; V83-L258 HydrophobicContact CG1-CD2 4.36Å; V83-L258 HydrophobicContact CG2-CD2 3.58Å
84	A	82.8	Confident	82	Confident	5 Å²	5	41.2 Å²	41.2	4%	0.041	22%	0.22	C	C	.	.	H	α-helix	trans	-62.8	-43.8	179.8	0	0	0	0	0	112.5	V80 Y81 V82 S87 A88 L207	V80-A84 WeakPolarHBondContact O-CB 3.26Å; V80-A84 PolarHBondContact O-N 3.24Å; Y81-A84 PolarHBondContact O-N 3.29Å; V82-A84 VanDerWaalsContact C-N 3.32Å; V82-A84 PolarHBondContact O-N 3.46Å; A84-S87 PolarHBondContact O-N 2.98Å; A84-A88 VanDerWaalsContact O-CB 3.3Å; A84-A88 WeakPolarHBondContact O-CB 3.41Å; A84-A88 PolarHBondContact O-N 3.33Å; A84-L207 HydrophobicContact CB-CD2 4.04Å
85	V	85.8	Confident	84.1	Confident	68 Å²	68	38.3 Å²	38.3	41%	0.412	20%	0.204	S	C	.	.	H	α-helix	trans	-66	-47	178.8	168.9	0	0	0	0	111.5	Y81 V82 S87 A88 L89 F214	Y81-V85 WeakPolarHBondContact O-CG2 3.18Å; Y81-V85 PolarHBondContact O-N 2.93Å; V82-V85 PolarHBondContact O-N 3.29Å; V85-S87 VanDerWaalsContact C-N 3.26Å; V85-S87 PolarHBondContact O-N 3.22Å; V85-A88 PolarHBondContact O-N 3.31Å; V85-L89 PolarHBondContact O-N 3.44Å; V85-F214 HydrophobicContact CG1-CE1 4.44Å; V85-F214 HydrophobicContact CG1-CZ 4.09Å
86	F	87.4	Confident	85.9	Confident	66 Å²	66	29.7 Å²	29.7	29%	0.289	16%	0.164	S	C	.	.	H	α-helix	trans	-62.8	-35.8	176	-88.1	-84.5	0	0	0	112	V82 L89 I250 F255 L258	V82-F86 HydrophobicContact CG1-CD2 3.76Å; V82-F86 HydrophobicContact CG1-CE2 3.9Å; V82-F86 WeakPolarHBondContact O-CD2 3.21Å; V82-F86 PolarHBondContact O-N 3.07Å; F86-L89 HydrophobicContact CD1-CD1 4.03Å; F86-L89 WeakPolarHBondContact O-CB 3.48Å; F86-L89 PolarHBondContact O-N 3.3Å; F86-I250 HydrophobicContact CE1-CG2 4.08Å; F86-F255 HydrophobicContact CB-CE2 4.45Å; F86-L258 HydrophobicContact CB-CD1 3.87Å
87	S	85.6	Confident	87.3	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-65.7	-44	174.1	-55.1	0	0	0	0	111.5	V83 A84 V85 L89 G90 V191 Y194 F255	V83-S87 VanDerWaalsContact O-CB 3.28Å; V83-S87 WeakPolarHBondContact O-CB 3.37Å; V83-S87 PolarHBondContact O-N 2.88Å; V83-S87 PolarHBondContact O-OG 3.48Å; A84-S87 PolarHBondContact O-N 2.98Å; V85-S87 VanDerWaalsContact C-N 3.26Å; V85-S87 PolarHBondContact O-N 3.22Å; S87-L89 PolarHBondContact O-N 3.44Å; S87-L89 VanDerWaalsContact O-N 3.16Å; S87-G90 PolarHBondContact O-N 2.93Å; S87-G90 VanDerWaalsContact O-N 3.09Å; S87-V191 WeakPolarHBondContact O-CG1 3.36Å; S87-Y194 VanDerWaalsContact OG-CD1 3.23Å; S87-Y194 WeakPolarHBondContact OG-CD1 3.07Å; S87-Y194 VanDerWaalsContact OG-CE1 3.27Å; S87-Y194 WeakPolarHBondContact OG-CE1 3.44Å; S87-F255 WeakPolarHBondContact OG-CZ 3.41Å
88	A	87.6	Confident	88	Confident	0 Å²	0	27 Å²	27	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-64.7	-16.6	-179.5	0	0	0	0	0	113.4	A84 V85 G90 G91 F92 I210 F214	A84-A88 VanDerWaalsContact O-CB 3.3Å; A84-A88 WeakPolarHBondContact O-CB 3.41Å; A84-A88 PolarHBondContact O-N 3.33Å; V85-A88 PolarHBondContact O-N 3.31Å; A88-G90 PolarHBondContact O-N 3.41Å; A88-G91 WeakPolarHBondContact O-CA 3.09Å; A88-G91 PolarHBondContact O-N 2.91Å; A88-F92 PolarHBondContact O-N 2.94Å; A88-I210 HydrophobicContact CB-CG2 4.19Å; A88-F214 VanDerWaalsContact C-CD1 3.5Å; A88-F214 HydrophobicContact CB-CB 4.07Å; A88-F214 HydrophobicContact CB-CD1 3.65Å; A88-F214 HydrophobicContact CB-CD2 3.89Å; A88-F214 HydrophobicContact CB-CE1 4.02Å; A88-F214 HydrophobicContact CB-CE2 4.22Å; A88-F214 HydrophobicContact CB-CG 3.59Å; A88-F214 HydrophobicContact CB-CZ 4.3Å; A88-F214 WeakPolarHBondContact O-CB 3.47Å; A88-F214 VanDerWaalsContact O-CD1 3.32Å; A88-F214 WeakPolarHBondContact O-CD1 3.1Å
89	L	91.1	Very high	88.6	Confident	29 Å²	29	23.3 Å²	23.3	15%	0.152	12%	0.116	C	C	.	.	H	α-helix	trans	-57.2	-29.9	169.9	-68.9	175.5	0	0	0	112.8	V85 F86 S87 G91 F92 L93 F214 I250 Q251	V85-L89 PolarHBondContact O-N 3.44Å; F86-L89 HydrophobicContact CD1-CD1 4.03Å; F86-L89 WeakPolarHBondContact O-CB 3.48Å; F86-L89 PolarHBondContact O-N 3.3Å; S87-L89 PolarHBondContact O-N 3.44Å; S87-L89 VanDerWaalsContact O-N 3.16Å; L89-G91 VanDerWaalsContact C-N 3.33Å; L89-F92 WeakPolarHBondContact O-CB 3.44Å; L89-F92 PolarHBondContact O-N 3.12Å; L89-L93 WeakPolarHBondContact O-CG 3.29Å; L89-L93 PolarHBondContact O-N 3.36Å; L89-F214 HydrophobicContact CD2-CE1 4.26Å; L89-I250 HydrophobicContact CD1-CG2 3.99Å; L89-Q251 HydrophobicContact CB-CB 4.18Å; L89-Q251 HydrophobicContact CB-CG 4.26Å; L89-Q251 HydrophobicContact CD1-CB 4.22Å
90	G	89.1	Confident	89.2	Confident	1 Å²	1	19.9 Å²	19.9	1%	0.01	10%	0.101	C	C	.	.	H	α-helix	trans	-67.1	-35.1	173.6	0	0	0	0	0	112.6	S87 A88 L93 F94	S87-G90 PolarHBondContact O-N 2.93Å; S87-G90 VanDerWaalsContact O-N 3.09Å; A88-G90 PolarHBondContact O-N 3.41Å; G90-L93 PolarHBondContact O-N 2.9Å; G90-F94 PolarHBondContact O-N 2.89Å
91	G	90.2	Very high	89.7	Confident	4 Å²	4	19.9 Å²	19.9	4%	0.041	10%	0.101	C	C	.	.	H	α-helix	trans	-65.4	-41.5	169.1	0	0	0	0	0	111.8	A88 L89 L93 F94 G95 N211 I215	A88-G91 WeakPolarHBondContact O-CA 3.09Å; A88-G91 PolarHBondContact O-N 2.91Å; L89-G91 VanDerWaalsContact C-N 3.33Å; G91-L93 PolarHBondContact O-N 3.23Å; G91-F94 PolarHBondContact O-N 3.34Å; G91-G95 PolarHBondContact O-N 3.09Å; G91-N211 WeakPolarHBondContact CA-OD1 3.38Å; G91-I215 WeakPolarHBondContact O-CA 3.49Å; G91-I215 VanDerWaalsContact O-CG1 3.28Å; G91-I215 WeakPolarHBondContact O-CG1 3.15Å
92	F	94.6	Very high	90	Very high	35 Å²	35	16.1 Å²	16.1	15%	0.154	9%	0.087	C	C	.	.	H	α-helix	trans	-59.4	-43.1	174.8	-179	-86	0	0	0	112.6	A88 L89 F94 G95 Y96 F214 G218 F221 P247	A88-F92 PolarHBondContact O-N 2.94Å; L89-F92 WeakPolarHBondContact O-CB 3.44Å; L89-F92 PolarHBondContact O-N 3.12Å; F92-F94 PolarHBondContact O-N 3.42Å; F92-G95 PolarHBondContact O-N 2.96Å; F92-Y96 HydrophobicContact CE1-CD2 4.01Å; F92-Y96 HydrophobicContact CZ-CD2 4.31Å; F92-Y96 VanDerWaalsContact O-CB 3.3Å; F92-Y96 WeakPolarHBondContact O-CB 3.41Å; F92-Y96 PolarHBondContact O-N 3.39Å; F92-F214 WeakPolarHBondContact CA-O 3.39Å; F92-F214 HydrophobicContact CB-CB 4.25Å; F92-F214 HydrophobicContact CB-CD1 3.98Å; F92-G218 VanDerWaalsContact CD2-CA 3.48Å; F92-F221 HydrophobicContact CE2-CB 4.02Å; F92-F221 HydrophobicContact CE2-CG 4.38Å; F92-F221 HydrophobicContact CZ-CB 3.94Å; F92-F221 AromaticContact CZ-CD1 3.71Å; F92-F221 HydrophobicContact CZ-CD1 3.71Å; F92-F221 HydrophobicContact CZ-CE1 4.48Å; F92-F221 AromaticContact CZ-CG 3.94Å; F92-F221 HydrophobicContact CZ-CG 3.94Å; F92-P247 HydrophobicContact CD1-CB 4.14Å; F92-P247 HydrophobicContact CD1-CG 4.26Å; F92-P247 HydrophobicContact CE1-CB 4.23Å; F92-P247 HydrophobicContact CE1-CG 4.02Å
93	L	94.1	Very high	90.3	Very high	3 Å²	3	12.9 Å²	12.9	2%	0.016	7%	0.067	C	C	.	.	H	α-helix	trans	-61.9	-41.9	176.7	-73.4	169.4	0	0	0	112.6	L89 G90 G91 Y96 D97 F157 A244 P247 A248	L89-L93 WeakPolarHBondContact O-CG 3.29Å; L89-L93 PolarHBondContact O-N 3.36Å; G90-L93 PolarHBondContact O-N 2.9Å; G91-L93 PolarHBondContact O-N 3.23Å; L93-Y96 PolarHBondContact O-N 3.36Å; L93-D97 PolarHBondContact O-N 2.95Å; L93-F157 HydrophobicContact CB-CD1 4.3Å; L93-F157 HydrophobicContact CB-CD2 4.32Å; L93-F157 HydrophobicContact CB-CE1 3.97Å; L93-F157 HydrophobicContact CB-CE2 4.01Å; L93-F157 HydrophobicContact CB-CG 4.46Å; L93-F157 HydrophobicContact CB-CZ 3.81Å; L93-F157 HydrophobicContact CD1-CB 4.3Å; L93-F157 HydrophobicContact CD1-CD2 3.64Å; L93-F157 HydrophobicContact CD1-CE2 4Å; L93-F157 HydrophobicContact CD1-CG 3.95Å; L93-A244 WeakPolarHBondContact CD2-O 3.48Å; L93-P247 HydrophobicContact CD2-CB 3.97Å; L93-P247 HydrophobicContact CD2-CG 3.67Å; L93-A248 HydrophobicContact CD1-CB 3.92Å; L93-A248 HydrophobicContact CD2-CB 4.02Å
94	F	91.2	Very high	90.6	Very high	34 Å²	34	12.8 Å²	12.8	15%	0.149	7%	0.067	C	C	.	.	H	α-helix	trans	-60.7	-46.7	173.6	167.6	-134.4	0	0	0	111.6	G90 G91 F92 Y96 T98 I184 I215 W552	G90-F94 PolarHBondContact O-N 2.89Å; G91-F94 PolarHBondContact O-N 3.34Å; F92-F94 PolarHBondContact O-N 3.42Å; F94-Y96 VanDerWaalsContact C-N 3.34Å; F94-Y96 PolarHBondContact O-N 3.4Å; F94-T98 PolarHBondContact O-N 3.39Å; F94-T98 VanDerWaalsContact O-N 3.15Å; F94-T98 PolarHBondContact O-OG1 2.91Å; F94-I184 HydrophobicContact CB-CG2 4.3Å; F94-I184 HydrophobicContact CD2-CD1 4.32Å; F94-I184 HydrophobicContact CD2-CG1 4.38Å; F94-I184 HydrophobicContact CD2-CG2 3.36Å; F94-I184 HydrophobicContact CE2-CG2 3.92Å; F94-I184 HydrophobicContact CG-CG2 4.01Å; F94-I215 HydrophobicContact CD1-CD1 3.86Å; F94-I215 HydrophobicContact CD1-CG1 3.9Å; F94-I215 HydrophobicContact CD1-CG2 3.78Å; F94-I215 HydrophobicContact CE1-CD1 4.22Å; F94-I215 HydrophobicContact CE1-CG2 3.91Å; F94-W552 HydrophobicContact CE2-CH2 4.29Å; F94-W552 HydrophobicContact CZ-CH2 4.24Å
95	G	93	Very high	90.9	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-60.4	-43.1	175.1	0	0	0	0	0	113.2	G91 F92 T98 G99 I215 Q219	G91-G95 PolarHBondContact O-N 3.09Å; F92-G95 PolarHBondContact O-N 2.96Å; G95-T98 PolarHBondContact O-N 3.17Å; G95-G99 PolarHBondContact O-N 2.89Å; G95-I215 WeakPolarHBondContact CA-O 3.5Å; G95-Q219 VanDerWaalsContact O-CA 3.27Å; G95-Q219 WeakPolarHBondContact O-CA 3.35Å; G95-Q219 WeakPolarHBondContact O-CG 3.32Å; G95-Q219 PolarHBondContact O-N 3.42Å
96	Y	95.1	Very high	91	Very high	3 Å²	3	9.8 Å²	9.8	1%	0.012	5%	0.048	C	C	.	.	H	α-helix	trans	-61.6	-49.4	-179.4	-172.8	-80.9	0	0	0	111.1	F92 L93 F94 T98 G99 V100 F221 A222 V225 M240 L243 A244	F92-Y96 HydrophobicContact CE1-CD2 4.01Å; F92-Y96 HydrophobicContact CZ-CD2 4.31Å; F92-Y96 VanDerWaalsContact O-CB 3.3Å; F92-Y96 WeakPolarHBondContact O-CB 3.41Å; F92-Y96 PolarHBondContact O-N 3.39Å; L93-Y96 PolarHBondContact O-N 3.36Å; F94-Y96 VanDerWaalsContact C-N 3.34Å; F94-Y96 PolarHBondContact O-N 3.4Å; Y96-T98 VanDerWaalsContact C-N 3.25Å; Y96-T98 PolarHBondContact O-N 3.1Å; Y96-G99 PolarHBondContact O-N 2.52Å; Y96-V100 HydrophobicContact CD1-CB 4.3Å; Y96-V100 HydrophobicContact CD1-CG1 4.28Å; Y96-V100 HydrophobicContact CE1-CB 4.06Å; Y96-V100 HydrophobicContact CE1-CG1 4.28Å; Y96-V100 HydrophobicContact CE1-CG2 4.09Å; Y96-V100 WeakPolarHBondContact O-CB 3.36Å; Y96-V100 VanDerWaalsContact O-CG1 3.29Å; Y96-V100 WeakPolarHBondContact O-CG1 3.3Å; Y96-V100 PolarHBondContact O-N 3.34Å; Y96-F221 HydrophobicContact CD2-CD1 4.17Å; Y96-F221 AromaticContact CE2-CD1 3.95Å; Y96-F221 HydrophobicContact CE2-CD1 3.95Å; Y96-F221 HydrophobicContact CE2-CE1 4.34Å; Y96-A222 HydrophobicContact CD1-CB 4.33Å; Y96-A222 HydrophobicContact CD2-CB 3.66Å; Y96-A222 HydrophobicContact CE2-CB 3.93Å; Y96-A222 HydrophobicContact CG-CB 3.88Å; Y96-A222 VanDerWaalsContact O-CB 3.23Å; Y96-A222 WeakPolarHBondContact O-CB 3.15Å; Y96-V225 HydrophobicContact CE2-CG2 4.37Å; Y96-M240 PolarHBondContact OH-O 3.5Å; Y96-L243 WeakPolarHBondContact OH-CB 3.29Å; Y96-A244 HydrophobicContact CD1-CB 3.63Å; Y96-A244 HydrophobicContact CE1-CB 3.59Å
97	D	93.3	Very high	91	Very high	11 Å²	11	6.8 Å²	6.8	6%	0.059	4%	0.035	C	C	.	.	H	α-helix	trans	-60	-37.9	177	-176.9	74.5	0	0	0	111.8	L93 V100 V101 T126 R177 V180 I184	L93-D97 PolarHBondContact O-N 2.95Å; D97-V100 WeakPolarHBondContact O-CG1 3.41Å; D97-V101 WeakPolarHBondContact O-CG2 3.39Å; D97-V101 PolarHBondContact O-N 3.47Å; D97-T126 WeakPolarHBondContact OD2-CG2 3.37Å; D97-R177 IonicContact OD1-NH1 2.78Å; D97-R177 PolarHBondContact OD1-NH1 3.4Å; D97-R177 IonicContact OD2-NH1 3.45Å; D97-V180 HydrophobicContact CB-CG1 4.25Å; D97-V180 WeakPolarHBondContact OD1-CG1 3.28Å; D97-I184 HydrophobicContact CB-CD1 3.91Å; D97-I184 WeakPolarHBondContact OD2-CD1 3.44Å
98	T	89.8	Confident	91.1	Very high	0 Å²	0	6.9 Å²	6.9	0%	0	4%	0.035	C	C	.	.	H	α-helix	trans	-65.9	-42.7	176.4	-57.8	0	0	0	0	112.7	F94 G95 Y96 Q219 M344 Y345	F94-T98 PolarHBondContact O-N 3.39Å; F94-T98 VanDerWaalsContact O-N 3.15Å; F94-T98 PolarHBondContact O-OG1 2.91Å; G95-T98 PolarHBondContact O-N 3.17Å; Y96-T98 VanDerWaalsContact C-N 3.25Å; Y96-T98 PolarHBondContact O-N 3.1Å; T98-Q219 HydrophobicContact CG2-CG 4.29Å; T98-M344 HydrophobicContact CG2-CB 4.01Å; T98-Y345 HydrophobicContact CG2-CD1 3.99Å; T98-Y345 HydrophobicContact CG2-CE1 3.59Å
99	G	91.6	Very high	90.9	Very high	1 Å²	1	7.3 Å²	7.3	1%	0.01	4%	0.037	C	C	.	.	H	α-helix	trans	-72.4	-45.4	-179.3	0	0	0	0	0	113.1	G95 Y96 V101 S102	G95-G99 PolarHBondContact O-N 2.89Å; Y96-G99 PolarHBondContact O-N 2.52Å; G99-V101 VanDerWaalsContact C-N 3.26Å; G99-V101 PolarHBondContact O-N 3.05Å; G99-S102 VanDerWaalsContact O-CB 3.26Å; G99-S102 WeakPolarHBondContact O-CB 3.41Å; G99-S102 PolarHBondContact O-N 2.97Å; G99-S102 VanDerWaalsContact O-N 3.09Å
100	V	94.4	Very high	90.2	Very high	2 Å²	2	8.2 Å²	8.2	1%	0.012	4%	0.038	C	C	.	.	H	α-helix	trans	-66.1	-27.9	-172.4	74.9	0	0	0	0	112.8	Y96 D97 S102 A104 A222 D226 M240 L241	Y96-V100 HydrophobicContact CD1-CB 4.3Å; Y96-V100 HydrophobicContact CD1-CG1 4.28Å; Y96-V100 HydrophobicContact CE1-CB 4.06Å; Y96-V100 HydrophobicContact CE1-CG1 4.28Å; Y96-V100 HydrophobicContact CE1-CG2 4.09Å; Y96-V100 WeakPolarHBondContact O-CB 3.36Å; Y96-V100 VanDerWaalsContact O-CG1 3.29Å; Y96-V100 WeakPolarHBondContact O-CG1 3.3Å; Y96-V100 PolarHBondContact O-N 3.34Å; D97-V100 WeakPolarHBondContact O-CG1 3.41Å; V100-S102 PolarHBondContact O-N 3.26Å; V100-A104 WeakPolarHBondContact O-CB 3.38Å; V100-A104 PolarHBondContact O-N 3.33Å; V100-A104 VanDerWaalsContact O-N 3.07Å; V100-A222 HydrophobicContact CB-CB 3.99Å; V100-D226 WeakPolarHBondContact CA-OD2 3.26Å; V100-D226 VanDerWaalsContact CG2-OD1 3.24Å; V100-D226 WeakPolarHBondContact CG2-OD1 3.25Å; V100-D226 VanDerWaalsContact O-OD2 3.11Å; V100-M240 VanDerWaalsContact CG2-C 3.47Å; V100-M240 HydrophobicContact CG2-CB 3.72Å; V100-M240 VanDerWaalsContact CG2-O 3.3Å; V100-M240 WeakPolarHBondContact CG2-O 3.38Å; V100-L241 HydrophobicContact CB-CD2 4.41Å; V100-L241 HydrophobicContact CG1-CD2 3.65Å; V100-L241 HydrophobicContact CG2-CD2 3.9Å
101	V	92.4	Very high	89.9	Confident	3 Å²	3	11.5 Å²	11.5	2%	0.018	5%	0.054	C	C	.	.	H	α-helix	trans	-58.6	-40.4	175.4	172.1	0	0	0	0	110.4	D97 G99 M105 V123 Y345	D97-V101 WeakPolarHBondContact O-CG2 3.39Å; D97-V101 PolarHBondContact O-N 3.47Å; G99-V101 VanDerWaalsContact C-N 3.26Å; G99-V101 PolarHBondContact O-N 3.05Å; V101-M105 HydrophobicContact CG1-CE 4.23Å; V101-M105 WeakPolarHBondContact O-CB 3.47Å; V101-M105 PolarHBondContact O-N 3.42Å; V101-V123 HydrophobicContact CG1-CG2 3.76Å; V101-Y345 HydrophobicContact CB-CD1 4.36Å; V101-Y345 HydrophobicContact CG1-CD1 4.37Å
102	S	90.9	Very high	89.4	Confident	3 Å²	3	13 Å²	13	2%	0.021	6%	0.061	C	C	.	.	H	α-helix	trans	-60.5	-51.7	-172.1	-166.1	0	0	0	0	112.1	G99 V100 M344 Y345 S347 A348	G99-S102 VanDerWaalsContact O-CB 3.26Å; G99-S102 WeakPolarHBondContact O-CB 3.41Å; G99-S102 PolarHBondContact O-N 2.97Å; G99-S102 VanDerWaalsContact O-N 3.09Å; V100-S102 PolarHBondContact O-N 3.26Å; S102-M344 WeakPolarHBondContact CB-O 3.44Å; S102-M344 PolarHBondContact OG-O 2.9Å; S102-Y345 VanDerWaalsContact CA-O 3.24Å; S102-Y345 WeakPolarHBondContact CA-O 3.22Å; S102-S347 WeakPolarHBondContact OG-CB 3.43Å; S102-S347 PolarHBondContact OG-N 3.35Å; S102-A348 WeakPolarHBondContact O-CB 3.4Å; S102-A348 PolarHBondContact OG-N 2.96Å
103	G	90.2	Very high	88.6	Confident	1 Å²	1	14 Å²	14	1%	0.01	7%	0.072	C	C	.	.	H	α-helix	trans	-78.8	-39.9	178.4	0	0	0	0	0	113	M105 L106 D226	G103-M105 VanDerWaalsContact C-N 3.26Å; G103-M105 PolarHBondContact O-N 3.22Å; G103-L106 PolarHBondContact O-N 3.21Å; G103-D226 WeakPolarHBondContact CA-OD2 3.22Å; G103-D226 PolarHBondContact N-OD2 2.92Å
104	A	91.9	Very high	88	Confident	0 Å²	0	14 Å²	14	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-63.6	-30.5	179.8	0	0	0	0	0	112.9	V100 L106 L107 L108 W237 M240 L241	V100-A104 WeakPolarHBondContact O-CB 3.38Å; V100-A104 PolarHBondContact O-N 3.33Å; V100-A104 VanDerWaalsContact O-N 3.07Å; A104-L106 VanDerWaalsContact C-N 3.32Å; A104-L106 PolarHBondContact O-N 3.36Å; A104-L107 PolarHBondContact O-N 3.4Å; A104-L108 HydrophobicContact CB-CD1 4.32Å; A104-L108 WeakPolarHBondContact O-CB 3.35Å; A104-L108 WeakPolarHBondContact O-CG 3.24Å; A104-L108 PolarHBondContact O-N 2.88Å; A104-W237 HydrophobicContact CB-CB 4.46Å; A104-M240 HydrophobicContact CB-CB 4.48Å; A104-M240 HydrophobicContact CB-SD 4.09Å; A104-L241 HydrophobicContact CB-CD2 4.16Å; A104-L241 HydrophobicContact CB-CG 4.43Å
105	M	89.4	Confident	87.5	Confident	3 Å²	3	16.8 Å²	16.8	2%	0.015	9%	0.088	C	C	.	.	H	α-helix	trans	-59.6	-40.3	-178.8	-171.9	63	79.2	0	0	112.3	V101 G103 L107 L108 K109 Q119 V123	V101-M105 HydrophobicContact CG1-CE 4.23Å; V101-M105 WeakPolarHBondContact O-CB 3.47Å; V101-M105 PolarHBondContact O-N 3.42Å; G103-M105 VanDerWaalsContact C-N 3.26Å; G103-M105 PolarHBondContact O-N 3.22Å; M105-L107 VanDerWaalsContact C-N 3.31Å; M105-L107 PolarHBondContact O-N 2.83Å; M105-L108 PolarHBondContact O-N 3.02Å; M105-K109 VanDerWaalsContact O-CB 3.25Å; M105-K109 WeakPolarHBondContact O-CB 3.36Å; M105-K109 PolarHBondContact O-N 3.44Å; M105-Q119 HydrophobicContact CE-CB 4.01Å; M105-Q119 HydrophobicContact CE-CG 4.44Å; M105-Q119 HydrophobicContact CG-CG 4.39Å; M105-Q119 HydrophobicContact SD-CB 3.86Å; M105-Q119 HydrophobicContact SD-CG 3.62Å; M105-V123 HydrophobicContact CE-CG2 3.7Å
106	L	87.3	Confident	87.1	Confident	6 Å²	6	17.3 Å²	17.3	3%	0.031	9%	0.092	C	C	.	.	H	α-helix	trans	-60.3	-41.4	178.4	-69.4	-175.4	0	0	0	111.9	G103 A104 A348 Q352 A362 I363	G103-L106 PolarHBondContact O-N 3.21Å; A104-L106 VanDerWaalsContact C-N 3.32Å; A104-L106 PolarHBondContact O-N 3.36Å; L106-A348 HydrophobicContact CD1-CB 3.74Å; L106-A348 HydrophobicContact CG-CB 4.21Å; L106-Q352 HydrophobicContact CD2-CB 4.31Å; L106-A362 HydrophobicContact CD1-CB 4.13Å; L106-I363 HydrophobicContact CD1-CG1 4.03Å
107	L	87.8	Confident	86.7	Confident	3 Å²	3	21.8 Å²	21.8	2%	0.016	12%	0.116	C	C	.	.	H	α-helix	trans	-73.7	-41.9	178.1	-78.3	72.1	0	0	0	111.6	A104 M105 R110 Q111 W237 M240 I363	A104-L107 PolarHBondContact O-N 3.4Å; M105-L107 VanDerWaalsContact C-N 3.31Å; M105-L107 PolarHBondContact O-N 2.83Å; L107-R110 PolarHBondContact O-N 3.42Å; L107-Q111 WeakPolarHBondContact O-CG 3.33Å; L107-Q111 PolarHBondContact O-N 3.13Å; L107-W237 HydrophobicContact CB-CB 4.16Å; L107-W237 HydrophobicContact CD2-CB 4.4Å; L107-M240 HydrophobicContact CD2-CE 3.98Å; L107-I363 HydrophobicContact CD1-CD1 3.69Å
108	L	87.9	Confident	86.6	Confident	3 Å²	3	23.3 Å²	23.3	2%	0.016	12%	0.121	C	C	.	.	H	α-helix	trans	-62.9	-45.4	179.6	-79.3	168.8	0	0	0	111.9	A104 M105 R110 Q111 L112 L114 L173 W237 L241	A104-L108 HydrophobicContact CB-CD1 4.32Å; A104-L108 WeakPolarHBondContact O-CB 3.35Å; A104-L108 WeakPolarHBondContact O-CG 3.24Å; A104-L108 PolarHBondContact O-N 2.88Å; M105-L108 PolarHBondContact O-N 3.02Å; L108-R110 PolarHBondContact O-N 3.19Å; L108-Q111 PolarHBondContact O-N 3.46Å; L108-L112 HydrophobicContact CD2-CD1 3.91Å; L108-L112 WeakPolarHBondContact O-CB 3.46Å; L108-L112 PolarHBondContact O-N 3.44Å; L108-L114 HydrophobicContact CB-CD1 3.99Å; L108-L173 HydrophobicContact CD1-CD2 3.96Å; L108-L173 HydrophobicContact CD2-CD1 4.36Å; L108-L173 HydrophobicContact CD2-CD2 3.73Å; L108-L173 HydrophobicContact CG-CD2 4.44Å; L108-W237 HydrophobicContact CD2-CD2 3.6Å; L108-W237 HydrophobicContact CD2-CE3 3.53Å; L108-W237 HydrophobicContact CD2-CG 4.13Å; L108-W237 HydrophobicContact CD2-CH2 4.21Å; L108-W237 HydrophobicContact CD2-CZ2 4.28Å; L108-W237 HydrophobicContact CD2-CZ3 3.85Å; L108-W237 HydrophobicContact CG-CB 4.46Å; L108-W237 HydrophobicContact CG-CD2 4.3Å; L108-W237 HydrophobicContact CG-CE3 4.32Å; L108-W237 HydrophobicContact CG-CG 4.38Å; L108-L241 HydrophobicContact CD1-CD1 4.41Å
109	K	83.1	Confident	86.6	Confident	9 Å²	9	23.5 Å²	23.5	4%	0.039	12%	0.122	C	C	.	.	H	α-helix	trans	-53.5	-44.8	176.8	-176.8	-170.9	-175.3	-155	0	111.2	M105 S113 L114 Y497 N498	M105-K109 VanDerWaalsContact O-CB 3.25Å; M105-K109 WeakPolarHBondContact O-CB 3.36Å; M105-K109 PolarHBondContact O-N 3.44Å; K109-S113 VanDerWaalsContact O-CA 3.28Å; K109-S113 WeakPolarHBondContact O-CA 3.44Å; K109-S113 PolarHBondContact O-N 2.9Å; K109-S113 VanDerWaalsContact O-N 3.13Å; K109-L114 PolarHBondContact O-N 3.03Å; K109-Y497 HydrophobicContact CD-CE1 4.44Å; K109-Y497 VanDerWaalsContact CE-CE1 3.45Å; K109-N498 PolarHBondContact NZ-ND2 3.45Å
110	R	77.8	Confident	86.7	Confident	47 Å²	47	23.7 Å²	23.7	18%	0.177	12%	0.123	C	C	.	.	H	α-helix	trans	-71.2	-43	-178.3	-171.9	173.3	74.1	-169.9	-6.9	113.2	L107 L108 D359 N475	L107-R110 PolarHBondContact O-N 3.42Å; L108-R110 PolarHBondContact O-N 3.19Å; R110-D359 IonicContact CZ-OD2 2.74Å; R110-D359 IonicContact NH1-OD2 2.76Å; R110-D359 PolarHBondContact NH1-OD2 3.36Å; R110-N475 WeakPolarHBondContact CD-ND2 3.47Å; R110-N475 WeakPolarHBondContact CD-OD1 3.33Å; R110-N475 WeakPolarHBondContact CG-OD1 3.43Å
111	Q	81.5	Confident	86.6	Confident	71 Å²	71	26.3 Å²	26.3	33%	0.332	14%	0.136	S	C	.	.	H	α-helix	trans	-81.4	-32.5	-174.9	-69.8	-167.5	5.3	0	0	114.1	L107 L108 Q233 K234	L107-Q111 WeakPolarHBondContact O-CG 3.33Å; L107-Q111 PolarHBondContact O-N 3.13Å; L108-Q111 PolarHBondContact O-N 3.46Å; Q111-Q233 PolarHBondContact NE2-O 3.04Å; Q111-K234 PolarHBondContact NE2-O 3.32Å; Q111-K234 PolarHBondContact OE1-O 3.32Å
112	L	81.3	Confident	86.6	Confident	36 Å²	36	26.3 Å²	26.3	19%	0.188	14%	0.136	C	C	.	.	H	α-helix	trans	-108	9	-176.5	-65.4	175.4	0	0	0	113	L108 L114 L173	L108-L112 HydrophobicContact CD2-CD1 3.91Å; L108-L112 WeakPolarHBondContact O-CB 3.46Å; L108-L112 PolarHBondContact O-N 3.44Å; L112-L114 HydrophobicContact CB-CD1 4.49Å; L112-L114 HydrophobicContact CB-CD2 3.79Å; L112-L114 HydrophobicContact CB-CG 3.91Å; L112-L114 PolarHBondContact O-N 3.3Å; L112-L173 HydrophobicContact CD1-CD2 4.26Å
113	S	76.4	Confident	86.6	Confident	56 Å²	56	26.3 Å²	26.3	39%	0.392	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	44.7	60.4	-178.4	57.6	0	0	0	0	111.3	K109	K109-S113 VanDerWaalsContact O-CA 3.28Å; K109-S113 WeakPolarHBondContact O-CA 3.44Å; K109-S113 PolarHBondContact O-N 2.9Å; K109-S113 VanDerWaalsContact O-N 3.13Å
114	L	81	Confident	86.8	Confident	3 Å²	3	26.5 Å²	26.5	2%	0.016	14%	0.137	C	C	.	.			trans	-88	114.9	-174.4	-56.6	176.5	0	0	0	111.4	L108 K109 L112 W118 Q119 L122 K170	L108-L114 HydrophobicContact CB-CD1 3.99Å; K109-L114 PolarHBondContact O-N 3.03Å; L112-L114 HydrophobicContact CB-CD1 4.49Å; L112-L114 HydrophobicContact CB-CD2 3.79Å; L112-L114 HydrophobicContact CB-CG 3.91Å; L112-L114 PolarHBondContact O-N 3.3Å; L114-W118 HydrophobicContact CB-CB 4.11Å; L114-W118 HydrophobicContact CD2-CB 4.09Å; L114-Q119 HydrophobicContact CB-CG 4.06Å; L114-Q119 PolarHBondContact O-NE2 3.4Å; L114-Q119 VanDerWaalsContact O-NE2 3.11Å; L114-L122 HydrophobicContact CD1-CD1 3.72Å; L114-K170 HydrophobicContact CD2-CB 3.92Å; L114-K170 HydrophobicContact CD2-CD 4.31Å
115	D	82.4	Confident	86.9	Confident	92 Å²	92	27.2 Å²	27.2	49%	0.492	14%	0.142	S	C	.	.			trans	-64.1	165.2	169.8	-52.7	-37.2	0	0	0	111.5	L117 W118 Q119	D115-L117 VanDerWaalsContact C-N 3.27Å; D115-L117 PolarHBondContact O-N 3.01Å; D115-W118 PolarHBondContact O-N 3.12Å; D115-Q119 PolarHBondContact O-N 3.27Å; D115-Q119 VanDerWaalsContact O-N 3.08Å
116	A	82.9	Confident	87	Confident	10 Å²	10	27.3 Å²	27.3	8%	0.083	14%	0.143	C	C	.	.	H	α-helix	trans	-52.5	-43.9	179	0	0	0	0	0	112.7	W118 Q119 E120 L563 E567	A116-W118 VanDerWaalsContact C-N 3.3Å; A116-W118 PolarHBondContact O-N 3.25Å; A116-Q119 PolarHBondContact O-N 2.99Å; A116-E120 WeakPolarHBondContact O-CG 3.27Å; A116-E120 PolarHBondContact O-N 2.96Å; A116-L563 HydrophobicContact CB-CB 3.96Å; A116-L563 HydrophobicContact CB-CD1 4.23Å; A116-E567 VanDerWaalsContact CB-OE1 3.26Å; A116-E567 WeakPolarHBondContact CB-OE1 3.35Å
117	L	88.3	Confident	87.2	Confident	97 Å²	97	27.1 Å²	27.1	51%	0.508	14%	0.142	S	C	.	.	H	α-helix	trans	-58.8	-39.9	176.6	-170.9	149.8	0	0	0	112.5	D115 L121	D115-L117 VanDerWaalsContact C-N 3.27Å; D115-L117 PolarHBondContact O-N 3.01Å; L117-L121 WeakPolarHBondContact O-CB 3.33Å; L117-L121 PolarHBondContact O-N 3.43Å
118	W	90.3	Very high	87.4	Confident	43 Å²	43	28 Å²	28	16%	0.163	15%	0.151	C	C	.	.	H	α-helix	trans	-70.3	-39	178.6	-82.6	106.7	0	0	0	112.1	L114 D115 A116 L121 L122 K170 E171 L174	L114-W118 HydrophobicContact CB-CB 4.11Å; L114-W118 HydrophobicContact CD2-CB 4.09Å; D115-W118 PolarHBondContact O-N 3.12Å; A116-W118 VanDerWaalsContact C-N 3.3Å; A116-W118 PolarHBondContact O-N 3.25Å; W118-L121 HydrophobicContact CE3-CD2 4.07Å; W118-L121 HydrophobicContact CH2-CD2 4.49Å; W118-L121 HydrophobicContact CZ3-CD2 3.87Å; W118-L121 PolarHBondContact O-N 3.01Å; W118-L122 WeakPolarHBondContact O-CB 3.46Å; W118-L122 VanDerWaalsContact O-CG 3.25Å; W118-L122 WeakPolarHBondContact O-CG 3.42Å; W118-L122 PolarHBondContact O-N 3.26Å; W118-K170 HydrophobicContact CD2-CD 4Å; W118-K170 HydrophobicContact CE3-CD 4.31Å; W118-K170 HydrophobicContact CG-CD 4.5Å; W118-K170 HydrophobicContact CH2-CD 4.38Å; W118-K170 HydrophobicContact CZ2-CD 4.07Å; W118-K170 HydrophobicContact CZ3-CD 4.49Å; W118-K170 HydrophobicContact CZ3-CG 4.5Å; W118-E171 WeakPolarHBondContact CH2-OE1 3.15Å; W118-L174 HydrophobicContact CZ3-CD2 4.33Å
119	Q	90.6	Very high	87.7	Confident	5 Å²	5	28.3 Å²	28.3	2%	0.023	16%	0.155	C	C	.	.	H	α-helix	trans	-62.8	-49	175.3	-63	178.1	50.6	0	0	110.5	M105 L114 D115 A116 L121 L122 V123 L563	M105-Q119 HydrophobicContact CE-CB 4.01Å; M105-Q119 HydrophobicContact CE-CG 4.44Å; M105-Q119 HydrophobicContact CG-CG 4.39Å; M105-Q119 HydrophobicContact SD-CB 3.86Å; M105-Q119 HydrophobicContact SD-CG 3.62Å; L114-Q119 HydrophobicContact CB-CG 4.06Å; L114-Q119 PolarHBondContact O-NE2 3.4Å; L114-Q119 VanDerWaalsContact O-NE2 3.11Å; D115-Q119 PolarHBondContact O-N 3.27Å; D115-Q119 VanDerWaalsContact O-N 3.08Å; A116-Q119 PolarHBondContact O-N 2.99Å; Q119-L121 PolarHBondContact O-N 3.35Å; Q119-L122 PolarHBondContact O-N 2.89Å; Q119-V123 WeakPolarHBondContact O-CG2 3.35Å; Q119-V123 PolarHBondContact O-N 3.37Å; Q119-V123 VanDerWaalsContact O-N 3.15Å; Q119-L563 HydrophobicContact CB-CD1 3.74Å; Q119-L563 HydrophobicContact CG-CD1 4.46Å
120	E	92.1	Very high	88.1	Confident	5 Å²	5	28 Å²	28	2%	0.023	15%	0.153	C	C	.	.	H	α-helix	trans	-61.6	-41.1	176.6	-73.8	175.3	159.7	0	0	112.7	A116 V123 S124 Y346 T561 F562 L563 H564	A116-E120 WeakPolarHBondContact O-CG 3.27Å; A116-E120 PolarHBondContact O-N 2.96Å; E120-V123 PolarHBondContact O-N 2.96Å; E120-S124 WeakPolarHBondContact O-CB 3.49Å; E120-S124 PolarHBondContact O-N 2.88Å; E120-S124 PolarHBondContact O-OG 3.26Å; E120-Y346 WeakPolarHBondContact CA-OH 3.39Å; E120-T561 VanDerWaalsContact OE1-C 3.32Å; E120-F562 PolarHBondContact OE1-N 2.96Å; E120-L563 HydrophobicContact CG-CB 4.09Å; E120-L563 HydrophobicContact CG-CD1 4.13Å; E120-L563 HydrophobicContact CG-CG 4.15Å; E120-L563 WeakPolarHBondContact OE1-CA 3.41Å; E120-L563 WeakPolarHBondContact OE1-CB 3.44Å; E120-L563 PolarHBondContact OE1-N 3.37Å; E120-H564 VanDerWaalsContact CD-ND1 3.33Å; E120-H564 PolarHBondContact OE1-N 2.89Å; E120-H564 IonicContact OE1-ND1 3.66Å; E120-H564 PolarHBondContact OE1-ND1 2.83Å; E120-H564 IonicContact OE2-CE1 3.51Å; E120-H564 PolarHBondContact OE2-CE1 2.96Å; E120-H564 IonicContact OE2-CG 2.59Å; E120-H564 IonicContact OE2-ND1 3.4Å; E120-H564 PolarHBondContact OE2-ND1 3.22Å
121	L	93.4	Very high	88.6	Confident	56 Å²	56	26.4 Å²	26.4	29%	0.293	15%	0.151	S	C	.	.	H	α-helix	trans	-64.1	-40.4	177.2	-175.3	62.6	0	0	0	111.8	L117 W118 Q119 S124 S125 L174	L117-L121 WeakPolarHBondContact O-CB 3.33Å; L117-L121 PolarHBondContact O-N 3.43Å; W118-L121 HydrophobicContact CE3-CD2 4.07Å; W118-L121 HydrophobicContact CH2-CD2 4.49Å; W118-L121 HydrophobicContact CZ3-CD2 3.87Å; W118-L121 PolarHBondContact O-N 3.01Å; Q119-L121 PolarHBondContact O-N 3.35Å; L121-S124 WeakPolarHBondContact CA-OG 3.23Å; L121-S124 PolarHBondContact O-OG 3.5Å; L121-S125 WeakPolarHBondContact O-CB 3.37Å; L121-S125 PolarHBondContact O-N 2.89Å; L121-S125 PolarHBondContact O-OG 3.29Å; L121-L174 HydrophobicContact CD2-CD2 4.08Å; L121-L174 HydrophobicContact CG-CD1 4.09Å; L121-L174 HydrophobicContact CG-CD2 4.45Å
122	L	92.3	Very high	89	Confident	3 Å²	3	27.7 Å²	27.7	2%	0.016	16%	0.163	C	C	.	.	H	α-helix	trans	-63.7	-43.1	177.3	-75.5	168.4	0	0	0	112.3	L114 W118 Q119 S125 T126 L173 L174 R177	L114-L122 HydrophobicContact CD1-CD1 3.72Å; W118-L122 WeakPolarHBondContact O-CB 3.46Å; W118-L122 VanDerWaalsContact O-CG 3.25Å; W118-L122 WeakPolarHBondContact O-CG 3.42Å; W118-L122 PolarHBondContact O-N 3.26Å; Q119-L122 PolarHBondContact O-N 2.89Å; L122-S125 PolarHBondContact O-OG 3.41Å; L122-T126 PolarHBondContact O-OG1 3.21Å; L122-T126 VanDerWaalsContact O-OG1 3.07Å; L122-L173 HydrophobicContact CD1-CD2 3.7Å; L122-L173 HydrophobicContact CD2-CB 4.3Å; L122-L173 HydrophobicContact CD2-CD2 3.83Å; L122-L173 HydrophobicContact CD2-CG 3.93Å; L122-L173 HydrophobicContact CG-CD2 4.44Å; L122-L174 HydrophobicContact CD2-CB 4.11Å; L122-L174 HydrophobicContact CD2-CD1 4.24Å; L122-R177 HydrophobicContact CD2-CG 4.22Å
123	V	91.9	Very high	89.4	Confident	3 Å²	3	26.3 Å²	26.3	2%	0.018	16%	0.156	C	C	.	.	H	α-helix	trans	-69.7	-52.8	179	178.3	0	0	0	0	110.6	V101 M105 Q119 E120 S125 T126 V127 Y345 Y346	V101-V123 HydrophobicContact CG1-CG2 3.76Å; M105-V123 HydrophobicContact CE-CG2 3.7Å; Q119-V123 WeakPolarHBondContact O-CG2 3.35Å; Q119-V123 PolarHBondContact O-N 3.37Å; Q119-V123 VanDerWaalsContact O-N 3.15Å; E120-V123 PolarHBondContact O-N 2.96Å; V123-S125 PolarHBondContact O-N 3.44Å; V123-T126 WeakPolarHBondContact O-CB 3.45Å; V123-T126 PolarHBondContact O-N 3.29Å; V123-V127 PolarHBondContact O-N 3.22Å; V123-Y345 HydrophobicContact CG1-CD1 4.01Å; V123-Y345 HydrophobicContact CG1-CD2 3.23Å; V123-Y345 HydrophobicContact CG1-CE1 4.36Å; V123-Y345 HydrophobicContact CG1-CE2 3.65Å; V123-Y345 HydrophobicContact CG1-CG 3.45Å; V123-Y345 VanDerWaalsContact CG1-CG 3.45Å; V123-Y346 HydrophobicContact CG2-CE1 4.17Å
124	S	92.5	Very high	89.8	Confident	5 Å²	5	24.3 Å²	24.3	4%	0.035	14%	0.143	C	C	.	.	H	α-helix	trans	-70.6	-32.8	-173.4	61.2	0	0	0	0	114.9	E120 L121 T126 V127 G128 L560	E120-S124 WeakPolarHBondContact O-CB 3.49Å; E120-S124 PolarHBondContact O-N 2.88Å; E120-S124 PolarHBondContact O-OG 3.26Å; L121-S124 WeakPolarHBondContact CA-OG 3.23Å; L121-S124 PolarHBondContact O-OG 3.5Å; S124-T126 VanDerWaalsContact C-N 3.27Å; S124-T126 PolarHBondContact O-N 2.91Å; S124-V127 PolarHBondContact O-N 2.95Å; S124-G128 PolarHBondContact O-N 3.29Å; S124-L560 WeakPolarHBondContact OG-CD2 3.08Å; S124-L560 WeakPolarHBondContact OG-CG 3.33Å
125	S	93.8	Very high	89.8	Confident	15 Å²	15	30.2 Å²	30.2	11%	0.105	17%	0.174	C	C	.	.	H	α-helix	trans	-61.8	-37.9	177.6	58.1	0	0	0	0	111.6	L121 L122 V123 G128 A129 L174	L121-S125 WeakPolarHBondContact O-CB 3.37Å; L121-S125 PolarHBondContact O-N 2.89Å; L121-S125 PolarHBondContact O-OG 3.29Å; L122-S125 PolarHBondContact O-OG 3.41Å; V123-S125 PolarHBondContact O-N 3.44Å; S125-G128 PolarHBondContact O-N 3.38Å; S125-A129 WeakPolarHBondContact O-CB 3.15Å; S125-A129 PolarHBondContact O-N 2.93Å; S125-L174 WeakPolarHBondContact OG-CD1 3.48Å
126	T	92.6	Very high	89.9	Confident	5 Å²	5	28 Å²	28	3%	0.031	17%	0.169	C	C	.	.	H	α-helix	trans	-60.8	-49.3	174.4	-49.7	0	0	0	0	110.8	D97 L122 V123 S124 A129 A130 R177 G181 I184	D97-T126 WeakPolarHBondContact OD2-CG2 3.37Å; L122-T126 PolarHBondContact O-OG1 3.21Å; L122-T126 VanDerWaalsContact O-OG1 3.07Å; V123-T126 WeakPolarHBondContact O-CB 3.45Å; V123-T126 PolarHBondContact O-N 3.29Å; S124-T126 VanDerWaalsContact C-N 3.27Å; S124-T126 PolarHBondContact O-N 2.91Å; T126-A129 PolarHBondContact O-N 2.99Å; T126-A130 WeakPolarHBondContact O-CB 3.35Å; T126-A130 PolarHBondContact O-N 2.78Å; T126-R177 WeakPolarHBondContact OG1-CB 3.47Å; T126-R177 WeakPolarHBondContact OG1-CD 3.5Å; T126-G181 VanDerWaalsContact O-CA 3.3Å; T126-G181 WeakPolarHBondContact O-CA 3.26Å; T126-I184 HydrophobicContact CG2-CD1 3.86Å
127	V	91.1	Very high	89.6	Confident	3 Å²	3	27.5 Å²	27.5	2%	0.018	17%	0.165	C	C	.	.	H	α-helix	trans	-65	-39.5	177.7	-178.1	0	0	0	0	111.5	V123 S124 A130 A131 Y345 W552 N555 V556	V123-V127 PolarHBondContact O-N 3.22Å; S124-V127 PolarHBondContact O-N 2.95Å; V127-A130 CarbonylContact O-C 3.5Å; V127-A130 WeakPolarHBondContact O-CB 3.2Å; V127-A130 PolarHBondContact O-N 3.35Å; V127-A131 PolarHBondContact O-N 3.45Å; V127-Y345 HydrophobicContact CG2-CE2 4.06Å; V127-Y345 VanDerWaalsContact CG2-OH 3.24Å; V127-Y345 WeakPolarHBondContact CG2-OH 3.37Å; V127-W552 HydrophobicContact CG1-CE3 3.69Å; V127-W552 HydrophobicContact CG1-CZ3 3.99Å; V127-N555 HydrophobicContact CG1-CB 3.78Å; V127-N555 WeakPolarHBondContact CG1-ND2 3.35Å; V127-V556 HydrophobicContact CB-CG2 4.06Å; V127-V556 HydrophobicContact CG1-CG2 3.68Å
128	G	92.3	Very high	89	Confident	20 Å²	20	24.7 Å²	24.7	21%	0.206	16%	0.159	C	C	.	.	H	α-helix	trans	-66.2	-43	177.8	0	0	0	0	0	112.2	S124 S125 A130 A131 V132	S124-G128 PolarHBondContact O-N 3.29Å; S125-G128 PolarHBondContact O-N 3.38Å; G128-A130 VanDerWaalsContact C-N 3.32Å; G128-A130 PolarHBondContact O-N 2.98Å; G128-A131 WeakPolarHBondContact O-CB 3.31Å; G128-A131 PolarHBondContact O-N 3.42Å; G128-V132 WeakPolarHBondContact O-CG2 3.31Å; G128-V132 PolarHBondContact O-N 2.9Å
129	A	94.1	Very high	88.5	Confident	11 Å²	11	25.9 Å²	25.9	9%	0.091	18%	0.178	C	C	.	.	H	α-helix	trans	-63.4	-38.6	172	0	0	0	0	0	111.6	S125 T126 V132 S133 L178 L182	S125-A129 WeakPolarHBondContact O-CB 3.15Å; S125-A129 PolarHBondContact O-N 2.93Å; T126-A129 PolarHBondContact O-N 2.99Å; A129-V132 PolarHBondContact O-N 3.47Å; A129-S133 WeakPolarHBondContact O-CB 3.25Å; A129-S133 PolarHBondContact O-N 3.17Å; A129-S133 PolarHBondContact O-OG 3.22Å; A129-L178 HydrophobicContact CB-CD2 4.04Å; A129-L178 WeakPolarHBondContact CB-O 3.42Å; A129-L182 HydrophobicContact CB-CD2 4.18Å; A129-L182 HydrophobicContact CB-CG 4.25Å
130	A	90.8	Very high	88.2	Confident	1 Å²	1	27.8 Å²	27.8	1%	0.008	19%	0.188	C	C	.	.	H	α-helix	trans	-62.6	-41.1	172.5	0	0	0	0	0	112	T126 V127 G128 S133 A134 G181 I184 G185 W552	T126-A130 WeakPolarHBondContact O-CB 3.35Å; T126-A130 PolarHBondContact O-N 2.78Å; V127-A130 CarbonylContact O-C 3.5Å; V127-A130 WeakPolarHBondContact O-CB 3.2Å; V127-A130 PolarHBondContact O-N 3.35Å; G128-A130 VanDerWaalsContact C-N 3.32Å; G128-A130 PolarHBondContact O-N 2.98Å; A130-S133 WeakPolarHBondContact CA-OG 3.29Å; A130-S133 PolarHBondContact O-N 3.5Å; A130-S133 PolarHBondContact O-OG 3.45Å; A130-A134 WeakPolarHBondContact O-CB 3.3Å; A130-A134 PolarHBondContact O-N 3.44Å; A130-G181 WeakPolarHBondContact CA-O 3.18Å; A130-G181 WeakPolarHBondContact CB-O 3.28Å; A130-G181 PolarHBondContact N-O 2.68Å; A130-I184 HydrophobicContact CB-CB 4.11Å; A130-I184 HydrophobicContact CB-CG2 3.88Å; A130-G185 VanDerWaalsContact O-CA 3.29Å; A130-G185 WeakPolarHBondContact O-CA 3.12Å; A130-W552 HydrophobicContact CB-CE3 4.42Å; A130-W552 HydrophobicContact CB-CH2 4.18Å; A130-W552 HydrophobicContact CB-CZ3 4.01Å
131	A	88.7	Confident	87.8	Confident	15 Å²	15	27.9 Å²	27.9	12%	0.124	19%	0.189	C	C	.	.	H	α-helix	trans	-59.9	-50.7	176.5	0	0	0	0	0	111.8	V127 G128 S133 A134 L135 W552	V127-A131 PolarHBondContact O-N 3.45Å; G128-A131 WeakPolarHBondContact O-CB 3.31Å; G128-A131 PolarHBondContact O-N 3.42Å; A131-S133 PolarHBondContact O-N 2.87Å; A131-A134 PolarHBondContact O-N 3.03Å; A131-L135 WeakPolarHBondContact O-CG 3.43Å; A131-L135 PolarHBondContact O-N 2.78Å; A131-L135 VanDerWaalsContact O-N 3.13Å; A131-W552 HydrophobicContact CB-CB 3.59Å; A131-W552 HydrophobicContact CB-CG 4.13Å
132	V	90.6	Very high	87.1	Confident	98 Å²	98	26.5 Å²	26.5	59%	0.594	19%	0.188	S	C	*	.	H	α-helix	trans	-62.6	-45.5	-179.5	173.4	0	0	0	0	110.9	G128 A129 L135 A136	G128-V132 WeakPolarHBondContact O-CG2 3.31Å; G128-V132 PolarHBondContact O-N 2.9Å; A129-V132 PolarHBondContact O-N 3.47Å; V132-L135 PolarHBondContact O-N 3.43Å; V132-A136 PolarHBondContact O-N 3.28Å
133	S	89.7	Confident	86.7	Confident	6 Å²	6	30.6 Å²	30.6	4%	0.042	21%	0.213	C	C	.	.	H	α-helix	trans	-73.3	-30.1	-178.8	59.1	0	0	0	0	113.5	A129 A130 A131 A136 G137 L182 G185	A129-S133 WeakPolarHBondContact O-CB 3.25Å; A129-S133 PolarHBondContact O-N 3.17Å; A129-S133 PolarHBondContact O-OG 3.22Å; A130-S133 WeakPolarHBondContact CA-OG 3.29Å; A130-S133 PolarHBondContact O-N 3.5Å; A130-S133 PolarHBondContact O-OG 3.45Å; A131-S133 PolarHBondContact O-N 2.87Å; S133-A136 PolarHBondContact O-N 3.41Å; S133-G137 WeakPolarHBondContact O-CA 3.36Å; S133-G137 PolarHBondContact O-N 2.85Å; S133-L182 WeakPolarHBondContact CB-O 3.45Å; S133-L182 WeakPolarHBondContact OG-CA 3.38Å; S133-L182 PolarHBondContact OG-O 3.16Å; S133-G185 VanDerWaalsContact OG-CA 3.23Å; S133-G185 WeakPolarHBondContact OG-CA 3.5Å
134	A	84.4	Confident	86.5	Confident	15 Å²	15	36.5 Å²	36.5	12%	0.124	24%	0.238	C	C	.	.	H	α-helix	trans	-66.2	-41.2	172	0	0	0	0	0	111.6	A130 A131 G137	A130-A134 WeakPolarHBondContact O-CB 3.3Å; A130-A134 PolarHBondContact O-N 3.44Å; A131-A134 PolarHBondContact O-N 3.03Å; A134-G137 PolarHBondContact O-N 3.21Å
135	L	81.4	Confident	86.3	Confident	126 Å²	126	36.2 Å²	36.2	66%	0.66	24%	0.237	S	C	*	.	H	α-helix	trans	-64	-43.6	174.4	-69.8	172.6	0	0	0	111.7	A131 V132 G137	A131-L135 WeakPolarHBondContact O-CG 3.43Å; A131-L135 PolarHBondContact O-N 2.78Å; A131-L135 VanDerWaalsContact O-N 3.13Å; V132-L135 PolarHBondContact O-N 3.43Å; L135-G137 VanDerWaalsContact C-N 3.27Å; L135-G137 PolarHBondContact O-N 2.93Å
136	A	83.9	Confident	86.1	Confident	46 Å²	46	36.7 Å²	36.7	38%	0.38	24%	0.236	S	C	.	.	H	α-helix	trans	-69.6	-25.6	173.8	0	0	0	0	0	113	V132 S133 G138 A139 L140	V132-A136 PolarHBondContact O-N 3.28Å; S133-A136 PolarHBondContact O-N 3.41Å; A136-G138 VanDerWaalsContact C-N 3.27Å; A136-G138 PolarHBondContact O-N 2.74Å; A136-A139 PolarHBondContact O-N 2.78Å; A136-A139 VanDerWaalsContact O-N 3.12Å; A136-L140 HydrophobicContact CB-CD1 4.37Å; A136-L140 PolarHBondContact O-N 2.88Å
137	G	76.8	Confident	86.1	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-58.4	-34.8	-176.6	0	0	0	0	0	113.4	S133 A134 L135 L140 N141	S133-G137 WeakPolarHBondContact O-CA 3.36Å; S133-G137 PolarHBondContact O-N 2.85Å; A134-G137 PolarHBondContact O-N 3.21Å; L135-G137 VanDerWaalsContact C-N 3.27Å; L135-G137 PolarHBondContact O-N 2.93Å; G137-L140 PolarHBondContact O-N 2.9Å; G137-N141 VanDerWaalsContact O-CB 3.29Å; G137-N141 WeakPolarHBondContact O-CB 3.43Å; G137-N141 PolarHBondContact O-N 2.94Å; G137-N141 PolarHBondContact O-ND2 2.96Å
138	G	75	Confident	86.1	Confident	37 Å²	37	42.1 Å²	42.1	38%	0.381	26%	0.264	S	S	.	.	H	α-helix	trans	-60.7	-46.7	174.7	0	0	0	0	0	112.7	A136 G142	A136-G138 VanDerWaalsContact C-N 3.27Å; A136-G138 PolarHBondContact O-N 2.74Å; G138-G142 PolarHBondContact O-N 3.37Å
139	A	79.8	Confident	86.1	Confident	69 Å²	69	41.3 Å²	41.3	57%	0.57	26%	0.256	S	S	*	.	H	α-helix	trans	-68	-42.8	177	0	0	0	0	0	111.6	A136 N141 G142 V143	A136-A139 PolarHBondContact O-N 2.78Å; A136-A139 VanDerWaalsContact O-N 3.12Å; A139-N141 VanDerWaalsContact C-N 3.33Å; A139-N141 PolarHBondContact O-N 3.11Å; A139-G142 PolarHBondContact O-N 3.48Å; A139-V143 WeakPolarHBondContact O-CG2 3.49Å; A139-V143 PolarHBondContact O-N 3.34Å
140	L	84.9	Confident	86	Confident	44 Å²	44	40.8 Å²	40.8	23%	0.23	25%	0.252	C	S	.	.	H	α-helix	trans	-56.4	-46.6	175.4	-78.8	160.4	0	0	0	111.5	A136 G137 G142 V143 F144 I186	A136-L140 HydrophobicContact CB-CD1 4.37Å; A136-L140 PolarHBondContact O-N 2.88Å; G137-L140 PolarHBondContact O-N 2.9Å; L140-G142 VanDerWaalsContact C-N 3.32Å; L140-G142 PolarHBondContact O-N 3.24Å; L140-V143 PolarHBondContact O-N 3.49Å; L140-F144 HydrophobicContact CD2-CD2 3.75Å; L140-F144 HydrophobicContact CD2-CE2 3.84Å; L140-F144 PolarHBondContact O-N 3.3Å; L140-I186 HydrophobicContact CD1-CD1 4.34Å; L140-I186 HydrophobicContact CD1-CG1 4.4Å
141	N	83.8	Confident	86.2	Confident	8 Å²	8	42.1 Å²	42.1	4%	0.043	26%	0.259	C	S	.	.	H	α-helix	trans	-65	-33.8	179.7	-74.6	-20.4	0	0	0	112.8	G137 A139 G145 R146 A149 T190	G137-N141 VanDerWaalsContact O-CB 3.29Å; G137-N141 WeakPolarHBondContact O-CB 3.43Å; G137-N141 PolarHBondContact O-N 2.94Å; G137-N141 PolarHBondContact O-ND2 2.96Å; A139-N141 VanDerWaalsContact C-N 3.33Å; A139-N141 PolarHBondContact O-N 3.11Å; N141-G145 WeakPolarHBondContact O-CA 3.34Å; N141-G145 PolarHBondContact O-N 3.5Å; N141-R146 PolarHBondContact O-NH1 3.47Å; N141-A149 WeakPolarHBondContact OD1-CB 3.34Å; N141-T190 PolarHBondContact ND2-OG1 3.36Å; N141-T190 VanDerWaalsContact OD1-CG2 3.31Å; N141-T190 WeakPolarHBondContact OD1-CG2 3.23Å; N141-T190 PolarHBondContact OD1-OG1 2.85Å; N141-T190 VanDerWaalsContact OD1-OG1 3.07Å
142	G	79.3	Confident	86.5	Confident	26 Å²	26	45.1 Å²	45.1	27%	0.268	27%	0.272	S	S	.	.	H	α-helix	trans	-70.3	-42.8	175	0	0	0	0	0	113.1	G138 A139 L140 W264 K268	G138-G142 PolarHBondContact O-N 3.37Å; A139-G142 PolarHBondContact O-N 3.48Å; L140-G142 VanDerWaalsContact C-N 3.32Å; L140-G142 PolarHBondContact O-N 3.24Å; G142-W264 PolarHBondContact O-NE1 3.41Å; G142-K268 PolarHBondContact O-NZ 2.99Å
143	V	84.1	Confident	86.7	Confident	89 Å²	89	40.5 Å²	40.5	54%	0.539	24%	0.244	S	C	.	.	H	α-helix	trans	-78.6	-53.9	-176.2	177.5	0	0	0	0	111.9	A139 L140	A139-V143 WeakPolarHBondContact O-CG2 3.49Å; A139-V143 PolarHBondContact O-N 3.34Å; L140-V143 PolarHBondContact O-N 3.49Å
144	F	87	Confident	86.9	Confident	127 Å²	127	40.2 Å²	40.2	56%	0.557	24%	0.242	S	C	*	.	H	α-helix	trans	-96.2	-15.6	-169.6	-64	-71.3	0	0	0	114.3	L140 A148	L140-F144 HydrophobicContact CD2-CD2 3.75Å; L140-F144 HydrophobicContact CD2-CE2 3.84Å; L140-F144 PolarHBondContact O-N 3.3Å; F144-A148 HydrophobicContact CB-CB 4Å; F144-A148 WeakPolarHBondContact O-CB 3.43Å
145	G	88.1	Confident	87.5	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	25%	0.253	C	S	.	.			trans	88.9	170.8	-173	0	0	0	0	0	112.8	N141 A149 E260 W264	N141-G145 WeakPolarHBondContact O-CA 3.34Å; N141-G145 PolarHBondContact O-N 3.5Å; G145-A149 PolarHBondContact O-N 2.99Å; G145-E260 WeakPolarHBondContact CA-OE2 3.4Å; G145-W264 VanDerWaalsContact CA-CE2 3.49Å
146	R	90	Very high	88.2	Confident	24 Å²	24	37.3 Å²	37.3	9%	0.091	23%	0.231	C	C	.	.	H	α-helix	trans	-80.1	-38.6	-172.5	-72.3	61.5	168.5	149.2	1.2	110.5	N141 A148 A149 I150 T190 Y194 E197 E260 W264	N141-R146 PolarHBondContact O-NH1 3.47Å; R146-A148 PolarHBondContact O-N 3.49Å; R146-A149 PolarHBondContact O-N 3.42Å; R146-I150 WeakPolarHBondContact O-CG1 3.39Å; R146-I150 PolarHBondContact O-N 3.26Å; R146-T190 HydrophobicContact CB-CG2 3.92Å; R146-T190 HydrophobicContact CG-CG2 4.12Å; R146-Y194 HydrophobicContact CB-CD2 3.62Å; R146-Y194 HydrophobicContact CB-CE2 4.5Å; R146-Y194 HydrophobicContact CB-CG 4.24Å; R146-Y194 HydrophobicContact CG-CD2 4.28Å; R146-E197 IonicContact CZ-OE1 3.24Å; R146-E197 IonicContact CZ-OE2 3.14Å; R146-E197 IonicContact NE-OE1 3.86Å; R146-E197 PolarHBondContact NE-OE1 3.29Å; R146-E197 IonicContact NE-OE2 3.39Å; R146-E197 PolarHBondContact NE-OE2 2.99Å; R146-E197 IonicContact NH2-OE1 2.61Å; R146-E197 PolarHBondContact NH2-OE1 3.22Å; R146-E197 IonicContact NH2-OE2 3.39Å; R146-E260 WeakPolarHBondContact CA-OE1 3.46Å; R146-E260 WeakPolarHBondContact CB-OE1 3.37Å; R146-E260 VanDerWaalsContact N-CD 3.33Å; R146-E260 PolarHBondContact N-OE1 3.18Å; R146-E260 PolarHBondContact N-OE2 2.71Å; R146-E260 VanDerWaalsContact N-OE2 3.17Å; R146-W264 VanDerWaalsContact NH1-CD1 3.25Å
147	R	91.9	Very high	88.7	Confident	81 Å²	81	35.3 Å²	35.3	31%	0.306	21%	0.214	S	C	.	.	H	α-helix	trans	-61.2	-46.6	178.2	-178.7	-174.6	172.6	-155.3	0.1	111.2	I150 L151 F255 L256 L258 E260	R147-I150 PolarHBondContact O-N 3.07Å; R147-L151 HydrophobicContact CG-CD1 4.21Å; R147-L151 WeakPolarHBondContact O-CG 3.41Å; R147-L151 PolarHBondContact O-N 2.73Å; R147-F255 HydrophobicContact CG-CD1 4.36Å; R147-F255 PolarHBondContact NE-O 2.96Å; R147-L256 PolarHBondContact NH2-O 2.96Å; R147-L258 VanDerWaalsContact CD-O 3.27Å; R147-L258 WeakPolarHBondContact CD-O 3.26Å; R147-L258 PolarHBondContact NE-O 3.42Å; R147-E260 HydrophobicContact CB-CB 4.48Å; R147-E260 WeakPolarHBondContact CB-OE2 3.4Å; R147-E260 PolarHBondContact N-OE1 2.66Å; R147-E260 VanDerWaalsContact N-OE1 3.1Å; R147-E260 PolarHBondContact N-OE2 3.49Å
148	A	92.2	Very high	89.6	Confident	41 Å²	41	37.1 Å²	37.1	34%	0.339	23%	0.225	S	C	.	.	H	α-helix	trans	-64	-41.1	179.3	0	0	0	0	0	112	F144 R146 L151 L152	F144-A148 HydrophobicContact CB-CB 4Å; F144-A148 WeakPolarHBondContact O-CB 3.43Å; R146-A148 PolarHBondContact O-N 3.49Å; A148-L151 PolarHBondContact O-N 2.85Å; A148-L152 WeakPolarHBondContact O-CB 3.48Å; A148-L152 PolarHBondContact O-N 3.16Å
149	A	91.9	Very high	90.7	Very high	4 Å²	4	37.7 Å²	37.7	3%	0.033	23%	0.226	C	C	.	.	H	α-helix	trans	-64.7	-40.3	176.3	0	0	0	0	0	112.5	N141 G145 R146 L152 A153 I186 T190	N141-A149 WeakPolarHBondContact OD1-CB 3.34Å; G145-A149 PolarHBondContact O-N 2.99Å; R146-A149 PolarHBondContact O-N 3.42Å; A149-L152 PolarHBondContact O-N 2.75Å; A149-A153 WeakPolarHBondContact O-CB 3.35Å; A149-A153 PolarHBondContact O-N 3.5Å; A149-I186 HydrophobicContact CB-CG2 4.06Å; A149-I186 WeakPolarHBondContact O-CG2 3.35Å; A149-T190 HydrophobicContact CB-CG2 3.96Å
150	I	92.7	Very high	91.4	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-66.1	-42.8	175	-68	167.8	0	0	0	111.2	R146 R147 L152 A153 S154 T190 V191 Y194 Q251 F255	R146-I150 WeakPolarHBondContact O-CG1 3.39Å; R146-I150 PolarHBondContact O-N 3.26Å; R147-I150 PolarHBondContact O-N 3.07Å; I150-L152 VanDerWaalsContact C-N 3.33Å; I150-L152 PolarHBondContact O-N 2.76Å; I150-A153 PolarHBondContact O-N 3.34Å; I150-S154 PolarHBondContact O-N 3.47Å; I150-S154 PolarHBondContact O-OG 3.05Å; I150-T190 HydrophobicContact CD1-CG2 4.05Å; I150-T190 HydrophobicContact CG1-CG2 3.68Å; I150-V191 HydrophobicContact CD1-CG2 4.38Å; I150-V191 HydrophobicContact CG1-CG2 4.38Å; I150-Y194 HydrophobicContact CD1-CD1 4.06Å; I150-Y194 HydrophobicContact CD1-CG 4.04Å; I150-Q251 HydrophobicContact CG2-CG 4.38Å; I150-Q251 VanDerWaalsContact CG2-NE2 3.28Å; I150-F255 HydrophobicContact CB-CD1 4.08Å; I150-F255 HydrophobicContact CB-CE1 4.08Å; I150-F255 HydrophobicContact CB-CG 4.45Å; I150-F255 HydrophobicContact CB-CZ 4.43Å; I150-F255 HydrophobicContact CD1-CD1 4.23Å; I150-F255 HydrophobicContact CD1-CE1 3.4Å; I150-F255 HydrophobicContact CD1-CZ 3.59Å; I150-F255 HydrophobicContact CG1-CE1 4.32Å; I150-F255 HydrophobicContact CG2-CD1 3.81Å; I150-F255 HydrophobicContact CG2-CD2 3.69Å; I150-F255 HydrophobicContact CG2-CE1 3.83Å; I150-F255 HydrophobicContact CG2-CE2 3.7Å; I150-F255 HydrophobicContact CG2-CG 3.74Å; I150-F255 HydrophobicContact CG2-CZ 3.77Å
151	L	94.8	Very high	91.9	Very high	29 Å²	29	32.3 Å²	32.3	15%	0.152	19%	0.188	C	C	.	.	H	α-helix	trans	-60.5	-42.3	174.9	-74.4	170.5	0	0	0	112	R147 A148 S154 A155 F252 F255 L256	R147-L151 HydrophobicContact CG-CD1 4.21Å; R147-L151 WeakPolarHBondContact O-CG 3.41Å; R147-L151 PolarHBondContact O-N 2.73Å; A148-L151 PolarHBondContact O-N 2.85Å; L151-S154 PolarHBondContact O-N 3.43Å; L151-A155 WeakPolarHBondContact O-CB 3.12Å; L151-A155 PolarHBondContact O-N 2.82Å; L151-F252 HydrophobicContact CB-CE2 4.35Å; L151-F252 HydrophobicContact CD2-CD2 3.9Å; L151-F252 HydrophobicContact CD2-CE2 4.05Å; L151-F252 HydrophobicContact CD2-CG 4.27Å; L151-F252 VanDerWaalsContact CD2-O 3.25Å; L151-F252 WeakPolarHBondContact CD2-O 3.39Å; L151-F252 WeakPolarHBondContact O-CD2 3.37Å; L151-F255 HydrophobicContact CD2-CB 3.63Å; L151-F255 HydrophobicContact CG-CB 4Å; L151-L256 HydrophobicContact CD1-CD2 4.3Å; L151-L256 HydrophobicContact CD2-CD2 4.03Å; L151-L256 HydrophobicContact CD2-CG 4.42Å
152	L	94.5	Very high	92.5	Very high	78 Å²	78	34.7 Å²	34.7	41%	0.408	21%	0.209	S	C	.	.	H	α-helix	trans	-61.4	-45.9	174.2	177.1	61.6	0	0	0	111.2	A148 A149 I150 S154 A155 L156 I186	A148-L152 WeakPolarHBondContact O-CB 3.48Å; A148-L152 PolarHBondContact O-N 3.16Å; A149-L152 PolarHBondContact O-N 2.75Å; I150-L152 VanDerWaalsContact C-N 3.33Å; I150-L152 PolarHBondContact O-N 2.76Å; L152-S154 PolarHBondContact O-N 2.97Å; L152-A155 PolarHBondContact O-N 3.42Å; L152-L156 HydrophobicContact CD1-CD1 4.39Å; L152-L156 HydrophobicContact CD1-CG 4.4Å; L152-L156 HydrophobicContact CG-CD1 4.23Å; L152-L156 WeakPolarHBondContact O-CG 3.49Å; L152-L156 PolarHBondContact O-N 3.2Å; L152-I186 HydrophobicContact CD2-CD1 4.03Å; L152-I186 HydrophobicContact CG-CD1 4.28Å
153	A	94.1	Very high	93.3	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.008	21%	0.213	C	C	.	.	H	α-helix	trans	-60.3	-46.3	176.9	0	0	0	0	0	111.7	A149 I150 A155 L156 F157 I186 A187	A149-A153 WeakPolarHBondContact O-CB 3.35Å; A149-A153 PolarHBondContact O-N 3.5Å; I150-A153 PolarHBondContact O-N 3.34Å; A153-A155 VanDerWaalsContact C-N 3.32Å; A153-A155 PolarHBondContact O-N 3.47Å; A153-L156 PolarHBondContact O-N 2.75Å; A153-F157 WeakPolarHBondContact O-CD2 3.37Å; A153-F157 PolarHBondContact O-N 3.47Å; A153-I186 HydrophobicContact CB-CB 4.06Å; A153-I186 HydrophobicContact CB-CG2 3.94Å; A153-A187 HydrophobicContact CB-CB 4.13Å
154	S	95.1	Very high	93.8	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-63.7	-36	177.3	-61.5	0	0	0	0	112.7	I150 L151 L152 T158 Q251	I150-S154 PolarHBondContact O-N 3.47Å; I150-S154 PolarHBondContact O-OG 3.05Å; L151-S154 PolarHBondContact O-N 3.43Å; L152-S154 PolarHBondContact O-N 2.97Å; S154-T158 WeakPolarHBondContact O-CB 3.47Å; S154-T158 PolarHBondContact O-N 3.13Å; S154-T158 PolarHBondContact O-OG1 3.45Å; S154-Q251 WeakPolarHBondContact OG-CG 3.49Å
155	A	95.7	Very high	94.1	Very high	42 Å²	42	27.8 Å²	27.8	35%	0.347	18%	0.175	S	C	.	.	H	α-helix	trans	-65.1	-43.6	173	0	0	0	0	0	111.6	L151 L152 A153 T158 A159 F252	L151-A155 WeakPolarHBondContact O-CB 3.12Å; L151-A155 PolarHBondContact O-N 2.82Å; L152-A155 PolarHBondContact O-N 3.42Å; A153-A155 VanDerWaalsContact C-N 3.32Å; A153-A155 PolarHBondContact O-N 3.47Å; A155-T158 PolarHBondContact O-N 3.05Å; A155-A159 WeakPolarHBondContact O-CB 3.26Å; A155-A159 PolarHBondContact O-N 3.36Å; A155-F252 HydrophobicContact CB-CD2 4.38Å; A155-F252 HydrophobicContact CB-CE2 4.15Å
156	L	96.4	Very high	94.3	Very high	38 Å²	38	31.4 Å²	31.4	20%	0.199	21%	0.205	C	C	.	.	H	α-helix	trans	-63.2	-43.6	175.1	-70.4	170.5	0	0	0	111.8	L152 A153 T158 A159 G160 V179 L182 I186	L152-L156 HydrophobicContact CD1-CD1 4.39Å; L152-L156 HydrophobicContact CD1-CG 4.4Å; L152-L156 HydrophobicContact CG-CD1 4.23Å; L152-L156 WeakPolarHBondContact O-CG 3.49Å; L152-L156 PolarHBondContact O-N 3.2Å; A153-L156 PolarHBondContact O-N 2.75Å; L156-T158 VanDerWaalsContact C-N 3.35Å; L156-T158 PolarHBondContact O-N 3.28Å; L156-A159 PolarHBondContact O-N 3.25Å; L156-G160 PolarHBondContact O-N 3.23Å; L156-V179 HydrophobicContact CB-CG1 4.49Å; L156-V179 HydrophobicContact CD2-CG1 4.15Å; L156-V179 WeakPolarHBondContact O-CG1 3.27Å; L156-L182 HydrophobicContact CD1-CB 4.09Å; L156-I186 HydrophobicContact CD1-CD1 3.88Å
157	F	95.4	Very high	94.4	Very high	4 Å²	4	30.4 Å²	30.4	2%	0.018	20%	0.202	C	C	.	.	H	α-helix	trans	-59.6	-44.7	174.6	-83.3	-63.6	0	0	0	112.2	L93 A153 S161 V180 I184 A187 A248	L93-F157 HydrophobicContact CB-CD1 4.3Å; L93-F157 HydrophobicContact CB-CD2 4.32Å; L93-F157 HydrophobicContact CB-CE1 3.97Å; L93-F157 HydrophobicContact CB-CE2 4.01Å; L93-F157 HydrophobicContact CB-CG 4.46Å; L93-F157 HydrophobicContact CB-CZ 3.81Å; L93-F157 HydrophobicContact CD1-CB 4.3Å; L93-F157 HydrophobicContact CD1-CD2 3.64Å; L93-F157 HydrophobicContact CD1-CE2 4Å; L93-F157 HydrophobicContact CD1-CG 3.95Å; A153-F157 WeakPolarHBondContact O-CD2 3.37Å; A153-F157 PolarHBondContact O-N 3.47Å; F157-S161 VanDerWaalsContact O-CB 3.25Å; F157-S161 WeakPolarHBondContact O-CB 3.39Å; F157-S161 PolarHBondContact O-N 3.35Å; F157-S161 PolarHBondContact O-OG 3.29Å; F157-V180 HydrophobicContact CD1-CG1 3.95Å; F157-V180 HydrophobicContact CE1-CG1 3.89Å; F157-I184 HydrophobicContact CE1-CD1 4.39Å; F157-I184 HydrophobicContact CE1-CG1 3.47Å; F157-I184 VanDerWaalsContact CE1-CG1 3.47Å; F157-I184 HydrophobicContact CZ-CB 4.21Å; F157-I184 HydrophobicContact CZ-CG1 3.52Å; F157-A187 HydrophobicContact CE2-CB 3.94Å; F157-A248 HydrophobicContact CB-CB 3.67Å
158	T	95.9	Very high	94.2	Very high	37 Å²	37	30 Å²	30	23%	0.227	21%	0.212	C	C	.	.	H	α-helix	trans	-65	-47.4	179.3	-54.4	0	0	0	0	110.9	S154 A155 L156 S161 A162 A248 V249	S154-T158 WeakPolarHBondContact O-CB 3.47Å; S154-T158 PolarHBondContact O-N 3.13Å; S154-T158 PolarHBondContact O-OG1 3.45Å; A155-T158 PolarHBondContact O-N 3.05Å; L156-T158 VanDerWaalsContact C-N 3.35Å; L156-T158 PolarHBondContact O-N 3.28Å; T158-S161 PolarHBondContact O-N 2.94Å; T158-A162 WeakPolarHBondContact O-CB 3.36Å; T158-A162 PolarHBondContact O-N 2.91Å; T158-A248 WeakPolarHBondContact OG1-CB 3.46Å; T158-V249 HydrophobicContact CG2-CG2 3.65Å
159	A	96.5	Very high	94.1	Very high	49 Å²	49	32.7 Å²	32.7	41%	0.405	22%	0.22	S	C	.	.	H	α-helix	trans	-63.4	-46.1	178	0	0	0	0	0	111.8	A155 L156 A162 V163	A155-A159 WeakPolarHBondContact O-CB 3.26Å; A155-A159 PolarHBondContact O-N 3.36Å; L156-A159 PolarHBondContact O-N 3.25Å; A159-A162 PolarHBondContact O-N 2.88Å; A159-V163 WeakPolarHBondContact O-CG2 3.39Å; A159-V163 PolarHBondContact O-N 2.91Å
160	G	96.1	Very high	93.9	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-61.3	-45.4	177.3	0	0	0	0	0	112.1	L156 A162 V163 L164	L156-G160 PolarHBondContact O-N 3.23Å; G160-A162 VanDerWaalsContact C-N 3.33Å; G160-A162 PolarHBondContact O-N 3.12Å; G160-V163 PolarHBondContact O-N 3.47Å; G160-L164 VanDerWaalsContact O-CG 3.27Å; G160-L164 WeakPolarHBondContact O-CG 3.47Å; G160-L164 PolarHBondContact O-N 3.17Å
161	S	95.6	Very high	93.9	Very high	1 Å²	1	40.4 Å²	40.4	1%	0.007	26%	0.255	C	S	.	.	H	α-helix	trans	-62.5	-38.8	176.4	-55.8	0	0	0	0	112.2	F157 T158 L164 A165 A244	F157-S161 VanDerWaalsContact O-CB 3.25Å; F157-S161 WeakPolarHBondContact O-CB 3.39Å; F157-S161 PolarHBondContact O-N 3.35Å; F157-S161 PolarHBondContact O-OG 3.29Å; T158-S161 PolarHBondContact O-N 2.94Å; S161-L164 PolarHBondContact O-N 3.31Å; S161-A165 WeakPolarHBondContact O-CB 3.25Å; S161-A165 PolarHBondContact O-N 3.28Å; S161-A244 WeakPolarHBondContact OG-CB 3.28Å
162	A	95.7	Very high	93.8	Very high	58 Å²	58	41.4 Å²	41.4	48%	0.479	26%	0.262	S	S	.	.	H	α-helix	trans	-65.4	-41.5	175	0	0	0	0	0	112.1	T158 A159 G160 A165 A166	T158-A162 WeakPolarHBondContact O-CB 3.36Å; T158-A162 PolarHBondContact O-N 2.91Å; A159-A162 PolarHBondContact O-N 2.88Å; G160-A162 VanDerWaalsContact C-N 3.33Å; G160-A162 PolarHBondContact O-N 3.12Å; A162-A165 PolarHBondContact O-N 2.88Å; A162-A166 WeakPolarHBondContact O-CB 3.39Å; A162-A166 PolarHBondContact O-N 3.32Å
163	V	96.1	Very high	93.8	Very high	60 Å²	60	37.7 Å²	37.7	36%	0.364	24%	0.243	S	C	.	.	H	α-helix	trans	-63.1	-44	174.2	172.6	0	0	0	0	110.8	A159 G160 A165 A166 A167	A159-V163 WeakPolarHBondContact O-CG2 3.39Å; A159-V163 PolarHBondContact O-N 2.91Å; G160-V163 PolarHBondContact O-N 3.47Å; V163-A165 PolarHBondContact O-N 2.95Å; V163-A166 CarbonylContact O-C 3.6Å; V163-A166 PolarHBondContact O-N 3.16Å; V163-A167 WeakPolarHBondContact O-CB 3.43Å; V163-A167 PolarHBondContact O-N 2.89Å
164	L	94	Very high	93.8	Very high	2 Å²	2	38.9 Å²	38.9	1%	0.01	25%	0.249	C	C	.	.	H	α-helix	trans	-62.4	-42.1	177.4	-69.3	173.2	0	0	0	112	G160 S161 A166 A167 L173 R177 V180 L241	G160-L164 VanDerWaalsContact O-CG 3.27Å; G160-L164 WeakPolarHBondContact O-CG 3.47Å; G160-L164 PolarHBondContact O-N 3.17Å; S161-L164 PolarHBondContact O-N 3.31Å; L164-A166 VanDerWaalsContact C-N 3.33Å; L164-A166 PolarHBondContact O-N 3.02Å; L164-A167 WeakPolarHBondContact O-CB 3.42Å; L164-A167 PolarHBondContact O-N 3.04Å; L164-L173 HydrophobicContact CD2-CD1 3.65Å; L164-L173 HydrophobicContact CD2-CG 4.3Å; L164-L173 WeakPolarHBondContact CD2-O 3.43Å; L164-R177 HydrophobicContact CD2-CG 4.05Å; L164-V180 HydrophobicContact CD1-CG2 3.84Å; L164-L241 HydrophobicContact CB-CB 3.92Å; L164-L241 HydrophobicContact CB-CD1 4.29Å; L164-L241 HydrophobicContact CD1-CB 4.27Å; L164-L241 HydrophobicContact CD2-CD1 4.35Å
165	A	93.8	Very high	93.9	Very high	35 Å²	35	41.1 Å²	41.1	29%	0.289	27%	0.267	S	S	.	.	H	α-helix	trans	-64.6	-36.7	176.4	0	0	0	0	0	112.5	S161 A162 V163 R238	S161-A165 WeakPolarHBondContact O-CB 3.25Å; S161-A165 PolarHBondContact O-N 3.28Å; A162-A165 PolarHBondContact O-N 2.88Å; V163-A165 PolarHBondContact O-N 2.95Å; A165-R238 PolarHBondContact O-NH1 2.93Å
166	A	93	Very high	93.9	Very high	76 Å²	76	39.1 Å²	39.1	63%	0.628	25%	0.251	S	S	*	.	H	α-helix	trans	-87.6	-4.6	-179.4	0	0	0	0	0	114.3	A162 V163 L164 S168	A162-A166 WeakPolarHBondContact O-CB 3.39Å; A162-A166 PolarHBondContact O-N 3.32Å; V163-A166 CarbonylContact O-C 3.6Å; V163-A166 PolarHBondContact O-N 3.16Å; L164-A166 VanDerWaalsContact C-N 3.33Å; L164-A166 PolarHBondContact O-N 3.02Å; A166-S168 PolarHBondContact O-N 3.28Å
167	A	92.1	Very high	93.8	Very high	2 Å²	2	37.6 Å²	37.6	2%	0.017	24%	0.242	C	C	.	.			trans	-61.8	124.6	-171.7	0	0	0	0	0	112.2	V163 L164 T172 L173 W237 R238	V163-A167 WeakPolarHBondContact O-CB 3.43Å; V163-A167 PolarHBondContact O-N 2.89Å; L164-A167 WeakPolarHBondContact O-CB 3.42Å; L164-A167 PolarHBondContact O-N 3.04Å; A167-T172 WeakPolarHBondContact CA-OG1 3.16Å; A167-L173 HydrophobicContact CB-CB 4.28Å; A167-L173 HydrophobicContact CB-CD1 4.26Å; A167-W237 HydrophobicContact CB-CH2 4.25Å; A167-W237 WeakPolarHBondContact O-CH2 3.08Å; A167-R238 PolarHBondContact O-NH1 2.99Å; A167-R238 PolarHBondContact O-NH2 2.98Å
168	S	87.6	Confident	93.8	Very high	74 Å²	74	40.9 Å²	40.9	52%	0.517	26%	0.26	S	S	.	.			trans	-102.4	-23.2	176.6	62.3	0	0	0	0	112.8	A166 T172	A166-S168 PolarHBondContact O-N 3.28Å; S168-T172 PolarHBondContact N-OG1 3.44Å
169	N	89.6	Confident	93.9	Very high	97 Å²	97	41.2 Å²	41.2	52%	0.519	26%	0.261	S	S	.	.	S	Bend	trans	-128.3	156.9	-175.3	-58.3	-39.2	0	0	0	110.5	E171 T172 L173	N169-E171 PolarHBondContact O-N 3.31Å; N169-T172 PolarHBondContact N-OG1 3.3Å; N169-T172 VanDerWaalsContact N-OG1 3.11Å; N169-T172 PolarHBondContact O-N 2.92Å; N169-T172 VanDerWaalsContact O-N 3.11Å; N169-T172 PolarHBondContact O-OG1 3.4Å; N169-L173 PolarHBondContact O-N 3.45Å; N169-L173 VanDerWaalsContact O-N 3.14Å
170	K	88.3	Confident	93.8	Very high	67 Å²	67	39 Å²	39	29%	0.291	24%	0.243	S	C	.	.	H	α-helix	trans	-56.8	-33.6	176.4	62.8	-175.1	-178.1	-179.7	0	113.9	L114 W118 L173 L174	L114-K170 HydrophobicContact CD2-CB 3.92Å; L114-K170 HydrophobicContact CD2-CD 4.31Å; W118-K170 HydrophobicContact CD2-CD 4Å; W118-K170 HydrophobicContact CE3-CD 4.31Å; W118-K170 HydrophobicContact CG-CD 4.5Å; W118-K170 HydrophobicContact CH2-CD 4.38Å; W118-K170 HydrophobicContact CZ2-CD 4.07Å; W118-K170 HydrophobicContact CZ3-CD 4.49Å; W118-K170 HydrophobicContact CZ3-CG 4.5Å; K170-L173 WeakPolarHBondContact O-CB 3.31Å; K170-L173 PolarHBondContact O-N 2.91Å; K170-L174 PolarHBondContact O-N 3.09Å
171	E	92.1	Very high	93.7	Very high	99 Å²	99	39 Å²	39	46%	0.463	24%	0.243	S	C	.	.	H	α-helix	trans	-67.8	-40.1	176.5	-51.1	-52.4	149.2	0	0	112.7	W118 N169 L173 L174 A175	W118-E171 WeakPolarHBondContact CH2-OE1 3.15Å; N169-E171 PolarHBondContact O-N 3.31Å; E171-L173 VanDerWaalsContact C-N 3.27Å; E171-L173 PolarHBondContact O-N 3.38Å; E171-L174 PolarHBondContact O-N 3.36Å; E171-A175 PolarHBondContact O-N 3.14Å
172	T	93.4	Very high	93.7	Very high	50 Å²	50	42.1 Å²	42.1	31%	0.307	26%	0.259	S	S	.	.	H	α-helix	trans	-67.4	-33.3	176.5	52.4	0	0	0	0	111.6	A167 S168 N169 A175 G176	A167-T172 WeakPolarHBondContact CA-OG1 3.16Å; S168-T172 PolarHBondContact N-OG1 3.44Å; N169-T172 PolarHBondContact N-OG1 3.3Å; N169-T172 VanDerWaalsContact N-OG1 3.11Å; N169-T172 PolarHBondContact O-N 2.92Å; N169-T172 VanDerWaalsContact O-N 3.11Å; N169-T172 PolarHBondContact O-OG1 3.4Å; T172-A175 PolarHBondContact O-N 3.32Å; T172-G176 PolarHBondContact O-N 3.42Å
173	L	93.3	Very high	93.6	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-65.4	-45.5	173.5	-171	74.6	0	0	0	110.8	L108 L112 L122 L164 A167 N169 K170 E171 A175 G176 R177 W237 L241	L108-L173 HydrophobicContact CD1-CD2 3.96Å; L108-L173 HydrophobicContact CD2-CD1 4.36Å; L108-L173 HydrophobicContact CD2-CD2 3.73Å; L108-L173 HydrophobicContact CG-CD2 4.44Å; L112-L173 HydrophobicContact CD1-CD2 4.26Å; L122-L173 HydrophobicContact CD1-CD2 3.7Å; L122-L173 HydrophobicContact CD2-CB 4.3Å; L122-L173 HydrophobicContact CD2-CD2 3.83Å; L122-L173 HydrophobicContact CD2-CG 3.93Å; L122-L173 HydrophobicContact CG-CD2 4.44Å; L164-L173 HydrophobicContact CD2-CD1 3.65Å; L164-L173 HydrophobicContact CD2-CG 4.3Å; L164-L173 WeakPolarHBondContact CD2-O 3.43Å; A167-L173 HydrophobicContact CB-CB 4.28Å; A167-L173 HydrophobicContact CB-CD1 4.26Å; N169-L173 PolarHBondContact O-N 3.45Å; N169-L173 VanDerWaalsContact O-N 3.14Å; K170-L173 WeakPolarHBondContact O-CB 3.31Å; K170-L173 PolarHBondContact O-N 2.91Å; E171-L173 VanDerWaalsContact C-N 3.27Å; E171-L173 PolarHBondContact O-N 3.38Å; L173-A175 VanDerWaalsContact C-N 3.35Å; L173-A175 PolarHBondContact O-N 3.39Å; L173-G176 PolarHBondContact O-N 2.75Å; L173-R177 WeakPolarHBondContact O-CG 3.45Å; L173-R177 PolarHBondContact O-N 3.35Å; L173-W237 HydrophobicContact CD1-CZ3 3.9Å; L173-L241 HydrophobicContact CD1-CD1 3.9Å
174	L	95	Very high	93.4	Very high	26 Å²	26	36.8 Å²	36.8	14%	0.136	22%	0.22	C	C	.	.	H	α-helix	trans	-59.6	-43.5	175	-177.5	65.1	0	0	0	112	W118 L121 L122 S125 K170 E171 G176 R177 L178	W118-L174 HydrophobicContact CZ3-CD2 4.33Å; L121-L174 HydrophobicContact CD2-CD2 4.08Å; L121-L174 HydrophobicContact CG-CD1 4.09Å; L121-L174 HydrophobicContact CG-CD2 4.45Å; L122-L174 HydrophobicContact CD2-CB 4.11Å; L122-L174 HydrophobicContact CD2-CD1 4.24Å; S125-L174 WeakPolarHBondContact OG-CD1 3.48Å; K170-L174 PolarHBondContact O-N 3.09Å; E171-L174 PolarHBondContact O-N 3.36Å; L174-G176 PolarHBondContact O-N 2.86Å; L174-R177 WeakPolarHBondContact O-CB 3.38Å; L174-R177 PolarHBondContact O-N 3.01Å; L174-L178 WeakPolarHBondContact O-CG 3.25Å; L174-L178 PolarHBondContact O-N 2.61Å
175	A	95.8	Very high	93.1	Very high	47 Å²	47	36.7 Å²	36.7	39%	0.388	22%	0.22	S	C	.	.	H	α-helix	trans	-60.9	-43.9	175.6	0	0	0	0	0	112.1	E171 T172 L173 R177 L178 V179	E171-A175 PolarHBondContact O-N 3.14Å; T172-A175 PolarHBondContact O-N 3.32Å; L173-A175 VanDerWaalsContact C-N 3.35Å; L173-A175 PolarHBondContact O-N 3.39Å; A175-R177 VanDerWaalsContact C-N 3.35Å; A175-R177 PolarHBondContact O-N 2.91Å; A175-L178 PolarHBondContact O-N 3.32Å; A175-V179 WeakPolarHBondContact O-CG2 3.44Å; A175-V179 PolarHBondContact O-N 3.29Å; A175-V179 VanDerWaalsContact O-N 3.11Å
176	G	95.4	Very high	93	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-60.2	-43.4	174.8	0	0	0	0	0	112.5	T172 L173 L174 V179 V180	T172-G176 PolarHBondContact O-N 3.42Å; L173-G176 PolarHBondContact O-N 2.75Å; L174-G176 PolarHBondContact O-N 2.86Å; G176-V179 PolarHBondContact O-N 2.74Å; G176-V180 WeakPolarHBondContact O-CG2 3.31Å; G176-V180 PolarHBondContact O-N 3.43Å
177	R	95.1	Very high	92.9	Very high	5 Å²	5	31.9 Å²	31.9	2%	0.019	18%	0.179	C	C	.	.	H	α-helix	trans	-61.4	-42.9	176.4	-76.5	-58.7	-174.5	173	4.4	112.9	D97 L122 T126 L164 L173 L174 A175 V179 V180 G181 L241	D97-R177 IonicContact OD1-NH1 2.78Å; D97-R177 PolarHBondContact OD1-NH1 3.4Å; D97-R177 IonicContact OD2-NH1 3.45Å; L122-R177 HydrophobicContact CD2-CG 4.22Å; T126-R177 WeakPolarHBondContact OG1-CB 3.47Å; T126-R177 WeakPolarHBondContact OG1-CD 3.5Å; L164-R177 HydrophobicContact CD2-CG 4.05Å; L173-R177 WeakPolarHBondContact O-CG 3.45Å; L173-R177 PolarHBondContact O-N 3.35Å; L174-R177 WeakPolarHBondContact O-CB 3.38Å; L174-R177 PolarHBondContact O-N 3.01Å; A175-R177 VanDerWaalsContact C-N 3.35Å; A175-R177 PolarHBondContact O-N 2.91Å; R177-V179 PolarHBondContact O-N 3.47Å; R177-V180 PolarHBondContact O-N 3.49Å; R177-G181 PolarHBondContact O-N 2.94Å; R177-L241 VanDerWaalsContact NH2-CD2 3.27Å
178	L	96.3	Very high	92.5	Very high	74 Å²	74	33.4 Å²	33.4	39%	0.387	19%	0.19	S	C	.	.	H	α-helix	trans	-60.3	-44.6	174.1	-74.4	170.4	0	0	0	111.8	A129 L174 A175 G181 L182	A129-L178 HydrophobicContact CB-CD2 4.04Å; A129-L178 WeakPolarHBondContact CB-O 3.42Å; L174-L178 WeakPolarHBondContact O-CG 3.25Å; L174-L178 PolarHBondContact O-N 2.61Å; A175-L178 PolarHBondContact O-N 3.32Å; L178-G181 PolarHBondContact O-N 3.42Å; L178-L182 WeakPolarHBondContact O-CG 3.47Å; L178-L182 PolarHBondContact O-N 3.09Å
179	V	96.8	Very high	92.3	Very high	43 Å²	43	33.5 Å²	33.5	26%	0.261	18%	0.183	S	C	.	.	H	α-helix	trans	-64.6	-44.8	179.2	174.6	0	0	0	0	111.5	L156 A175 G176 R177 G181 L182 G183	L156-V179 HydrophobicContact CB-CG1 4.49Å; L156-V179 HydrophobicContact CD2-CG1 4.15Å; L156-V179 WeakPolarHBondContact O-CG1 3.27Å; A175-V179 WeakPolarHBondContact O-CG2 3.44Å; A175-V179 PolarHBondContact O-N 3.29Å; A175-V179 VanDerWaalsContact O-N 3.11Å; G176-V179 PolarHBondContact O-N 2.74Å; R177-V179 PolarHBondContact O-N 3.47Å; V179-G181 VanDerWaalsContact C-N 3.32Å; V179-G181 PolarHBondContact O-N 3.03Å; V179-L182 PolarHBondContact O-N 3.26Å; V179-G183 PolarHBondContact O-N 3.45Å
180	V	95.4	Very high	92.1	Very high	4 Å²	4	28.9 Å²	28.9	2%	0.024	16%	0.158	C	C	.	.	H	α-helix	trans	-60.7	-43.7	173.8	171.6	0	0	0	0	110.6	D97 F157 L164 G176 R177 L182 G183 I184	D97-V180 HydrophobicContact CB-CG1 4.25Å; D97-V180 WeakPolarHBondContact OD1-CG1 3.28Å; F157-V180 HydrophobicContact CD1-CG1 3.95Å; F157-V180 HydrophobicContact CE1-CG1 3.89Å; L164-V180 HydrophobicContact CD1-CG2 3.84Å; G176-V180 WeakPolarHBondContact O-CG2 3.31Å; G176-V180 PolarHBondContact O-N 3.43Å; R177-V180 PolarHBondContact O-N 3.49Å; V180-L182 VanDerWaalsContact C-N 3.34Å; V180-L182 PolarHBondContact O-N 3.23Å; V180-G183 CarbonylContact O-C 3.55Å; V180-G183 WeakPolarHBondContact O-CA 3.4Å; V180-G183 PolarHBondContact O-N 2.59Å; V180-I184 HydrophobicContact CG1-CD1 3.92Å; V180-I184 HydrophobicContact CG1-CG1 4.27Å; V180-I184 WeakPolarHBondContact O-CG1 3.48Å; V180-I184 PolarHBondContact O-N 2.93Å
181	G	94.2	Very high	92.1	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-57.6	-41.9	177	0	0	0	0	0	113.4	T126 A130 R177 L178 V179 G183 I184 G185	T126-G181 VanDerWaalsContact O-CA 3.3Å; T126-G181 WeakPolarHBondContact O-CA 3.26Å; A130-G181 WeakPolarHBondContact CA-O 3.18Å; A130-G181 WeakPolarHBondContact CB-O 3.28Å; A130-G181 PolarHBondContact N-O 2.68Å; R177-G181 PolarHBondContact O-N 2.94Å; L178-G181 PolarHBondContact O-N 3.42Å; V179-G181 VanDerWaalsContact C-N 3.32Å; V179-G181 PolarHBondContact O-N 3.03Å; G181-G183 VanDerWaalsContact C-N 3.3Å; G181-G183 PolarHBondContact O-N 2.92Å; G181-I184 WeakPolarHBondContact O-CB 3.3Å; G181-I184 PolarHBondContact O-N 3.39Å; G181-G185 PolarHBondContact O-N 2.89Å
182	L	94.4	Very high	91.7	Very high	66 Å²	66	22.8 Å²	22.8	35%	0.346	13%	0.134	S	C	.	.	H	α-helix	trans	-60.5	-39.7	172.8	-66.5	175.2	0	0	0	112.1	A129 S133 L156 L178 V179 V180 I186	A129-L182 HydrophobicContact CB-CD2 4.18Å; A129-L182 HydrophobicContact CB-CG 4.25Å; S133-L182 WeakPolarHBondContact CB-O 3.45Å; S133-L182 WeakPolarHBondContact OG-CA 3.38Å; S133-L182 PolarHBondContact OG-O 3.16Å; L156-L182 HydrophobicContact CD1-CB 4.09Å; L178-L182 WeakPolarHBondContact O-CG 3.47Å; L178-L182 PolarHBondContact O-N 3.09Å; V179-L182 PolarHBondContact O-N 3.26Å; V180-L182 VanDerWaalsContact C-N 3.34Å; V180-L182 PolarHBondContact O-N 3.23Å; L182-I186 WeakPolarHBondContact O-CG1 3.3Å; L182-I186 PolarHBondContact O-N 2.67Å
183	G	93.6	Very high	91.3	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-62.7	-44.4	173.6	0	0	0	0	0	112.3	V179 V180 G181 I186 A187	V179-G183 PolarHBondContact O-N 3.45Å; V180-G183 CarbonylContact O-C 3.55Å; V180-G183 WeakPolarHBondContact O-CA 3.4Å; V180-G183 PolarHBondContact O-N 2.59Å; G181-G183 VanDerWaalsContact C-N 3.3Å; G181-G183 PolarHBondContact O-N 2.92Å; G183-I186 PolarHBondContact O-N 3.07Å; G183-A187 VanDerWaalsContact O-CB 3.28Å; G183-A187 WeakPolarHBondContact O-CB 3.38Å; G183-A187 PolarHBondContact O-N 3.04Å
184	I	91.8	Very high	91.1	Very high	5 Å²	5	22.5 Å²	22.5	3%	0.026	13%	0.132	C	C	.	.	H	α-helix	trans	-58.2	-50	178	-68.3	170.2	0	0	0	111.1	F94 D97 T126 A130 F157 V180 G181 I186 A187 S188 W552	F94-I184 HydrophobicContact CB-CG2 4.3Å; F94-I184 HydrophobicContact CD2-CD1 4.32Å; F94-I184 HydrophobicContact CD2-CG1 4.38Å; F94-I184 HydrophobicContact CD2-CG2 3.36Å; F94-I184 HydrophobicContact CE2-CG2 3.92Å; F94-I184 HydrophobicContact CG-CG2 4.01Å; D97-I184 HydrophobicContact CB-CD1 3.91Å; D97-I184 WeakPolarHBondContact OD2-CD1 3.44Å; T126-I184 HydrophobicContact CG2-CD1 3.86Å; A130-I184 HydrophobicContact CB-CB 4.11Å; A130-I184 HydrophobicContact CB-CG2 3.88Å; F157-I184 HydrophobicContact CE1-CD1 4.39Å; F157-I184 HydrophobicContact CE1-CG1 3.47Å; F157-I184 VanDerWaalsContact CE1-CG1 3.47Å; F157-I184 HydrophobicContact CZ-CB 4.21Å; F157-I184 HydrophobicContact CZ-CG1 3.52Å; V180-I184 HydrophobicContact CG1-CD1 3.92Å; V180-I184 HydrophobicContact CG1-CG1 4.27Å; V180-I184 WeakPolarHBondContact O-CG1 3.48Å; V180-I184 PolarHBondContact O-N 2.93Å; G181-I184 WeakPolarHBondContact O-CB 3.3Å; G181-I184 PolarHBondContact O-N 3.39Å; I184-I186 PolarHBondContact O-N 2.87Å; I184-A187 PolarHBondContact O-N 3.25Å; I184-S188 VanDerWaalsContact O-CB 3.22Å; I184-S188 WeakPolarHBondContact O-CB 3.41Å; I184-S188 PolarHBondContact O-N 3.11Å; I184-S188 PolarHBondContact O-OG 3.28Å; I184-W552 HydrophobicContact CG2-CH2 4.41Å
185	G	89.2	Confident	90.6	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-65.5	-43	-176.5	0	0	0	0	0	112.8	A130 S133 G181 S188 M189	A130-G185 VanDerWaalsContact O-CA 3.29Å; A130-G185 WeakPolarHBondContact O-CA 3.12Å; S133-G185 VanDerWaalsContact OG-CA 3.23Å; S133-G185 WeakPolarHBondContact OG-CA 3.5Å; G181-G185 PolarHBondContact O-N 2.89Å; G185-S188 PolarHBondContact O-N 3.25Å; G185-S188 PolarHBondContact O-OG 2.88Å; G185-M189 PolarHBondContact O-N 3.35Å
186	I	90.8	Very high	90	Very high	8 Å²	8	20.4 Å²	20.4	4%	0.041	12%	0.118	C	C	.	.	H	α-helix	trans	-61.1	-48	175	-62.1	171.4	0	0	0	110.4	L140 A149 L152 A153 L156 L182 G183 I184 M189 T190	L140-I186 HydrophobicContact CD1-CD1 4.34Å; L140-I186 HydrophobicContact CD1-CG1 4.4Å; A149-I186 HydrophobicContact CB-CG2 4.06Å; A149-I186 WeakPolarHBondContact O-CG2 3.35Å; L152-I186 HydrophobicContact CD2-CD1 4.03Å; L152-I186 HydrophobicContact CG-CD1 4.28Å; A153-I186 HydrophobicContact CB-CB 4.06Å; A153-I186 HydrophobicContact CB-CG2 3.94Å; L156-I186 HydrophobicContact CD1-CD1 3.88Å; L182-I186 WeakPolarHBondContact O-CG1 3.3Å; L182-I186 PolarHBondContact O-N 2.67Å; G183-I186 PolarHBondContact O-N 3.07Å; I184-I186 PolarHBondContact O-N 2.87Å; I186-M189 PolarHBondContact O-N 2.95Å; I186-T190 WeakPolarHBondContact O-CB 3.29Å; I186-T190 PolarHBondContact O-N 3.42Å; I186-T190 PolarHBondContact O-OG1 3.37Å
187	A	90.1	Very high	89.5	Confident	2 Å²	2	21.6 Å²	21.6	2%	0.017	12%	0.124	C	C	.	.	H	α-helix	trans	-64.3	-42.9	179.9	0	0	0	0	0	112.2	A153 F157 G183 I184 M189 T190 V191	A153-A187 HydrophobicContact CB-CB 4.13Å; F157-A187 HydrophobicContact CE2-CB 3.94Å; G183-A187 VanDerWaalsContact O-CB 3.28Å; G183-A187 WeakPolarHBondContact O-CB 3.38Å; G183-A187 PolarHBondContact O-N 3.04Å; I184-A187 PolarHBondContact O-N 3.25Å; A187-M189 VanDerWaalsContact C-N 3.26Å; A187-M189 PolarHBondContact O-N 3.49Å; A187-T190 PolarHBondContact O-N 2.93Å; A187-V191 HydrophobicContact CB-CG2 4.37Å; A187-V191 VanDerWaalsContact O-CB 3.26Å; A187-V191 WeakPolarHBondContact O-CB 3.44Å; A187-V191 VanDerWaalsContact O-CG2 3.31Å; A187-V191 WeakPolarHBondContact O-CG2 3.21Å; A187-V191 PolarHBondContact O-N 3.29Å
188	S	84.4	Confident	89	Confident	35 Å²	35	21.5 Å²	21.5	25%	0.245	12%	0.124	C	C	.	.	H	α-helix	trans	-61.4	-33.9	-178.2	74.9	0	0	0	0	113	I184 G185 P192	I184-S188 VanDerWaalsContact O-CB 3.22Å; I184-S188 WeakPolarHBondContact O-CB 3.41Å; I184-S188 PolarHBondContact O-N 3.11Å; I184-S188 PolarHBondContact O-OG 3.28Å; G185-S188 PolarHBondContact O-N 3.25Å; G185-S188 PolarHBondContact O-OG 2.88Å; S188-P192 WeakPolarHBondContact O-CD 3.19Å; S188-P192 WeakPolarHBondContact O-CG 3.03Å
189	M	82.8	Confident	88.4	Confident	76 Å²	76	18 Å²	18	37%	0.374	11%	0.106	S	C	.	.	H	α-helix	trans	-84.3	-38.5	177.5	-174.7	58.4	-179.4	0	0	111.4	G185 I186 A187 V193	G185-M189 PolarHBondContact O-N 3.35Å; I186-M189 PolarHBondContact O-N 2.95Å; A187-M189 VanDerWaalsContact C-N 3.26Å; A187-M189 PolarHBondContact O-N 3.49Å; M189-V193 WeakPolarHBondContact O-CG2 3.46Å
190	T	86.7	Confident	87.6	Confident	0 Å²	0	16.3 Å²	16.3	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-84.8	-40.2	-169.3	-49.6	0	0	0	0	113	N141 R146 A149 I150 I186 A187 V193 Y194	N141-T190 PolarHBondContact ND2-OG1 3.36Å; N141-T190 VanDerWaalsContact OD1-CG2 3.31Å; N141-T190 WeakPolarHBondContact OD1-CG2 3.23Å; N141-T190 PolarHBondContact OD1-OG1 2.85Å; N141-T190 VanDerWaalsContact OD1-OG1 3.07Å; R146-T190 HydrophobicContact CB-CG2 3.92Å; R146-T190 HydrophobicContact CG-CG2 4.12Å; A149-T190 HydrophobicContact CB-CG2 3.96Å; I150-T190 HydrophobicContact CD1-CG2 4.05Å; I150-T190 HydrophobicContact CG1-CG2 3.68Å; I186-T190 WeakPolarHBondContact O-CB 3.29Å; I186-T190 PolarHBondContact O-N 3.42Å; I186-T190 PolarHBondContact O-OG1 3.37Å; A187-T190 PolarHBondContact O-N 2.93Å; T190-V193 PolarHBondContact O-N 2.94Å; T190-Y194 VanDerWaalsContact O-CB 3.31Å; T190-Y194 WeakPolarHBondContact O-CB 3.33Å; T190-Y194 PolarHBondContact O-N 3.31Å
191	V	88.6	Confident	86.4	Confident	1 Å²	1	20.2 Å²	20.2	1%	0.006	12%	0.121	C	C	.	.	H	α-helix	trans	-62.7	-50.8	-174.5	168.3	0	0	0	0	112.3	S87 I150 A187 V193 Y194 I195 N211	S87-V191 WeakPolarHBondContact O-CG1 3.36Å; I150-V191 HydrophobicContact CD1-CG2 4.38Å; I150-V191 HydrophobicContact CG1-CG2 4.38Å; A187-V191 HydrophobicContact CB-CG2 4.37Å; A187-V191 VanDerWaalsContact O-CB 3.26Å; A187-V191 WeakPolarHBondContact O-CB 3.44Å; A187-V191 VanDerWaalsContact O-CG2 3.31Å; A187-V191 WeakPolarHBondContact O-CG2 3.21Å; A187-V191 PolarHBondContact O-N 3.29Å; V191-V193 VanDerWaalsContact C-N 3.29Å; V191-V193 PolarHBondContact O-N 3.42Å; V191-Y194 PolarHBondContact O-N 3.21Å; V191-I195 HydrophobicContact CG1-CD1 3.75Å; V191-I195 HydrophobicContact CG1-CG1 4.44Å; V191-I195 VanDerWaalsContact O-CG1 3.31Å; V191-I195 WeakPolarHBondContact O-CG1 3.43Å; V191-I195 PolarHBondContact O-N 2.91Å; V191-N211 VanDerWaalsContact CG1-OD1 3.28Å; V191-N211 WeakPolarHBondContact CG1-OD1 3.22Å
192	P	83.4	Confident	85.4	Confident	37 Å²	37	25.9 Å²	25.9	24%	0.24	15%	0.151	C	C	.	.	H	α-helix	trans	-62.5	-37.9	179	-21.3	33.5	0	0	0	112.3	S188 A196	S188-P192 WeakPolarHBondContact O-CD 3.19Å; S188-P192 WeakPolarHBondContact O-CG 3.03Å; P192-A196 VanDerWaalsContact O-CB 3.3Å; P192-A196 WeakPolarHBondContact O-CB 3.37Å; P192-A196 PolarHBondContact O-N 3.14Å
193	V	83.9	Confident	84.4	Confident	43 Å²	43	24 Å²	24	26%	0.261	14%	0.141	S	C	.	.	H	α-helix	trans	-65.2	-46.5	177.9	172.3	0	0	0	0	110.7	M189 T190 V191 A196 E197	M189-V193 WeakPolarHBondContact O-CG2 3.46Å; T190-V193 PolarHBondContact O-N 2.94Å; V191-V193 VanDerWaalsContact C-N 3.29Å; V191-V193 PolarHBondContact O-N 3.42Å; V193-A196 PolarHBondContact O-N 3.11Å; V193-E197 HydrophobicContact CG1-CG 4.31Å; V193-E197 WeakPolarHBondContact CG1-OE1 3.4Å; V193-E197 WeakPolarHBondContact O-CB 3.15Å; V193-E197 VanDerWaalsContact O-CG 3.3Å; V193-E197 WeakPolarHBondContact O-CG 3.41Å; V193-E197 PolarHBondContact O-N 3.34Å
194	Y	88.8	Confident	83.5	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-63.1	-44.3	178.3	-178.5	-105.9	0	0	0	111.7	V83 S87 R146 I150 T190 V191 A196 E197 V198 F255 P259	V83-Y194 HydrophobicContact CG1-CE1 3.58Å; S87-Y194 VanDerWaalsContact OG-CD1 3.23Å; S87-Y194 WeakPolarHBondContact OG-CD1 3.07Å; S87-Y194 VanDerWaalsContact OG-CE1 3.27Å; S87-Y194 WeakPolarHBondContact OG-CE1 3.44Å; R146-Y194 HydrophobicContact CB-CD2 3.62Å; R146-Y194 HydrophobicContact CB-CE2 4.5Å; R146-Y194 HydrophobicContact CB-CG 4.24Å; R146-Y194 HydrophobicContact CG-CD2 4.28Å; I150-Y194 HydrophobicContact CD1-CD1 4.06Å; I150-Y194 HydrophobicContact CD1-CG 4.04Å; T190-Y194 VanDerWaalsContact O-CB 3.31Å; T190-Y194 WeakPolarHBondContact O-CB 3.33Å; T190-Y194 PolarHBondContact O-N 3.31Å; V191-Y194 PolarHBondContact O-N 3.21Å; Y194-A196 VanDerWaalsContact C-N 3.31Å; Y194-A196 PolarHBondContact O-N 2.94Å; Y194-E197 PolarHBondContact O-N 2.9Å; Y194-V198 HydrophobicContact CD2-CG2 4.21Å; Y194-V198 HydrophobicContact CE1-CG2 4.19Å; Y194-V198 HydrophobicContact CE2-CG2 3.82Å; Y194-V198 WeakPolarHBondContact O-CB 3.49Å; Y194-V198 WeakPolarHBondContact O-CG2 3.49Å; Y194-V198 PolarHBondContact O-N 3.48Å; Y194-F255 HydrophobicContact CD1-CE1 4.07Å; Y194-F255 HydrophobicContact CD1-CZ 4.18Å; Y194-F255 AromaticContact CE1-CE1 3.67Å; Y194-F255 HydrophobicContact CE1-CE1 3.67Å; Y194-F255 AromaticContact CE1-CZ 3.94Å; Y194-F255 HydrophobicContact CE1-CZ 3.94Å; Y194-P259 PolarHBondContact OH-O 3.4Å
195	I	86.3	Confident	82.3	Confident	3 Å²	3	31 Å²	31	2%	0.015	18%	0.184	C	C	.	.	H	α-helix	trans	-58.6	-46.1	173.7	-67.3	168.7	0	0	0	109.9	V191 E197 V198 S199 L207 V208 N211	V191-I195 HydrophobicContact CG1-CD1 3.75Å; V191-I195 HydrophobicContact CG1-CG1 4.44Å; V191-I195 VanDerWaalsContact O-CG1 3.31Å; V191-I195 WeakPolarHBondContact O-CG1 3.43Å; V191-I195 PolarHBondContact O-N 2.91Å; I195-E197 PolarHBondContact O-N 2.9Å; I195-V198 PolarHBondContact O-N 3.24Å; I195-S199 WeakPolarHBondContact O-CB 3.36Å; I195-S199 PolarHBondContact O-N 3.45Å; I195-S199 PolarHBondContact O-OG 3.33Å; I195-L207 HydrophobicContact CG2-CB 3.92Å; I195-V208 HydrophobicContact CG2-CG2 4.07Å; I195-N211 HydrophobicContact CD1-CB 3.98Å
196	A	82.9	Confident	81.6	Confident	27 Å²	27	37.8 Å²	37.8	22%	0.223	21%	0.209	C	C	.	.	H	α-helix	trans	-64.8	-37.7	-178.8	0	0	0	0	0	113.5	P192 V193 Y194 R204 V208	P192-A196 VanDerWaalsContact O-CB 3.3Å; P192-A196 WeakPolarHBondContact O-CB 3.37Å; P192-A196 PolarHBondContact O-N 3.14Å; V193-A196 PolarHBondContact O-N 3.11Å; Y194-A196 VanDerWaalsContact C-N 3.31Å; Y194-A196 PolarHBondContact O-N 2.94Å; A196-R204 HydrophobicContact CB-CG 4.24Å; A196-R204 PolarHBondContact O-NE 3.37Å; A196-V208 HydrophobicContact CB-CG2 4.1Å
197	E	84.8	Confident	81	Confident	25 Å²	25	37.4 Å²	37.4	12%	0.117	21%	0.207	C	C	.	.	H	α-helix	trans	-74.4	-30.7	-180	-72.7	174.8	173.7	0	0	113	R146 V193 Y194 I195 S261 R263	R146-E197 IonicContact CZ-OE1 3.24Å; R146-E197 IonicContact CZ-OE2 3.14Å; R146-E197 IonicContact NE-OE1 3.86Å; R146-E197 PolarHBondContact NE-OE1 3.29Å; R146-E197 IonicContact NE-OE2 3.39Å; R146-E197 PolarHBondContact NE-OE2 2.99Å; R146-E197 IonicContact NH2-OE1 2.61Å; R146-E197 PolarHBondContact NH2-OE1 3.22Å; R146-E197 IonicContact NH2-OE2 3.39Å; V193-E197 HydrophobicContact CG1-CG 4.31Å; V193-E197 WeakPolarHBondContact CG1-OE1 3.4Å; V193-E197 WeakPolarHBondContact O-CB 3.15Å; V193-E197 VanDerWaalsContact O-CG 3.3Å; V193-E197 WeakPolarHBondContact O-CG 3.41Å; V193-E197 PolarHBondContact O-N 3.34Å; Y194-E197 PolarHBondContact O-N 2.9Å; I195-E197 PolarHBondContact O-N 2.9Å; E197-S261 WeakPolarHBondContact CB-OG 3.29Å; E197-S261 WeakPolarHBondContact OE2-CB 3.29Å; E197-S261 PolarHBondContact OE2-OG 3.48Å; E197-R263 HydrophobicContact CG-CB 4.27Å
198	V	85.1	Confident	80.3	Confident	3 Å²	3	39.5 Å²	39.5	2%	0.018	22%	0.22	C	C	.	.	H	α-helix	trans	-85	-31.5	177.2	170.6	0	0	0	0	112	V83 Y194 I195 M281 R282	V83-V198 HydrophobicContact CB-CG1 4.41Å; V83-V198 HydrophobicContact CG1-CG1 4.01Å; Y194-V198 HydrophobicContact CD2-CG2 4.21Å; Y194-V198 HydrophobicContact CE1-CG2 4.19Å; Y194-V198 HydrophobicContact CE2-CG2 3.82Å; Y194-V198 WeakPolarHBondContact O-CB 3.49Å; Y194-V198 WeakPolarHBondContact O-CG2 3.49Å; Y194-V198 PolarHBondContact O-N 3.48Å; I195-V198 PolarHBondContact O-N 3.24Å; V198-M281 HydrophobicContact CB-CE 4.32Å; V198-M281 HydrophobicContact CB-SD 4.22Å; V198-M281 HydrophobicContact CG1-CE 3.82Å; V198-M281 HydrophobicContact CG1-CG 4.37Å; V198-M281 HydrophobicContact CG1-SD 3.69Å; V198-M281 HydrophobicContact CG2-CE 3.74Å; V198-M281 HydrophobicContact CG2-SD 4.16Å; V198-R282 PolarHBondContact O-NH1 3.02Å
199	S	82.3	Confident	79.9	Confident	1 Å²	1	40 Å²	40	1%	0.007	22%	0.222	C	C	.	.	S	Bend	trans	-69	143.2	-175	-65.4	0	0	0	0	112.9	I195 L207 R282	I195-S199 WeakPolarHBondContact O-CB 3.36Å; I195-S199 PolarHBondContact O-N 3.45Å; I195-S199 PolarHBondContact O-OG 3.33Å; S199-L207 WeakPolarHBondContact OG-CB 3.39Å; S199-L207 WeakPolarHBondContact OG-CD1 3.31Å; S199-R282 PolarHBondContact O-NH2 3.46Å
200	P	79.9	Confident	79.8	Confident	6 Å²	6	38.7 Å²	38.7	4%	0.039	22%	0.215	C	C	.	.			trans	-68.4	149.2	172.2	30.8	-34.5	0	0	0	110.8	T76 N202 L203 R204 R282	T76-P200 HydrophobicContact CG2-CG 4.31Å; P200-N202 VanDerWaalsContact CB-OD1 3.25Å; P200-N202 WeakPolarHBondContact CB-OD1 3.48Å; P200-N202 WeakPolarHBondContact CG-OD1 3.44Å; P200-N202 PolarHBondContact O-N 3.46Å; P200-N202 VanDerWaalsContact O-N 3.13Å; P200-L203 HydrophobicContact CG-CB 4.08Å; P200-L203 HydrophobicContact CG-CD1 4.3Å; P200-L203 HydrophobicContact CG-CG 4.33Å; P200-L203 PolarHBondContact O-N 2.95Å; P200-R204 PolarHBondContact O-N 2.84Å; P200-R282 VanDerWaalsContact CA-NH1 3.29Å; P200-R282 VanDerWaalsContact N-NH1 3.14Å
201	P	71.6	Confident	79.7	Confident	87 Å²	87	39.1 Å²	39.1	57%	0.565	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-35.1	-174.6	-27.1	34.5	0	0	0	113.9
202	N	73.3	Confident	79.4	Confident	119 Å²	119	41.5 Å²	41.5	64%	0.636	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-25.5	-179.6	63.8	-24	0	0	0	114.5	P200	P200-N202 VanDerWaalsContact CB-OD1 3.25Å; P200-N202 WeakPolarHBondContact CB-OD1 3.48Å; P200-N202 WeakPolarHBondContact CG-OD1 3.44Å; P200-N202 PolarHBondContact O-N 3.46Å; P200-N202 VanDerWaalsContact O-N 3.13Å
203	L	72	Confident	79.5	Confident	26 Å²	26	42.3 Å²	42.3	14%	0.136	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.4	-3.5	-177.9	-60.5	-178.5	0	0	0	113.8	T76 Y81 P200 G205 R206 L207	T76-L203 HydrophobicContact CG2-CD1 3.79Å; Y81-L203 WeakPolarHBondContact OH-CD1 3.42Å; P200-L203 HydrophobicContact CG-CB 4.08Å; P200-L203 HydrophobicContact CG-CD1 4.3Å; P200-L203 HydrophobicContact CG-CG 4.33Å; P200-L203 PolarHBondContact O-N 2.95Å; L203-G205 VanDerWaalsContact C-N 3.34Å; L203-G205 PolarHBondContact O-N 3.27Å; L203-R206 PolarHBondContact O-N 2.95Å; L203-L207 HydrophobicContact CB-CD1 4.22Å; L203-L207 HydrophobicContact CB-CG 4.37Å; L203-L207 PolarHBondContact O-N 3.03Å
204	R	74.9	Confident	79.9	Confident	101 Å²	101	42.4 Å²	42.4	38%	0.381	23%	0.231	S	C	.	.	H	α-helix	trans	-50.7	-49.4	-174.7	-175.9	179.2	-69.6	153.4	3.9	112.9	A196 P200 R206 L207 V208	A196-R204 HydrophobicContact CB-CG 4.24Å; A196-R204 PolarHBondContact O-NE 3.37Å; P200-R204 PolarHBondContact O-N 2.84Å; R204-R206 VanDerWaalsContact C-N 3.35Å; R204-R206 PolarHBondContact O-N 2.99Å; R204-L207 PolarHBondContact O-N 3.2Å; R204-V208 HydrophobicContact CG-CG2 4.41Å; R204-V208 WeakPolarHBondContact O-CB 3.44Å; R204-V208 VanDerWaalsContact O-CG2 3.25Å; R204-V208 WeakPolarHBondContact O-CG2 3.46Å; R204-V208 PolarHBondContact O-N 3.34Å
205	G	67.3	Low	80	Confident	52 Å²	52	43.8 Å²	43.8	54%	0.536	24%	0.238	S	C	.	.	H	α-helix	trans	-60.3	-43.3	179.7	0	0	0	0	0	112.9	L203 T209	L203-G205 VanDerWaalsContact C-N 3.34Å; L203-G205 PolarHBondContact O-N 3.27Å; G205-T209 WeakPolarHBondContact O-CB 3.42Å; G205-T209 PolarHBondContact O-N 2.78Å; G205-T209 PolarHBondContact O-OG1 2.88Å
206	R	73.6	Confident	80.3	Confident	141 Å²	141	44.1 Å²	44.1	53%	0.532	24%	0.241	S	C	.	.	H	α-helix	trans	-65.4	-44.5	179	-170.2	174.1	72.5	-178	4.2	111.7	Y81 L203 R204 T209 I210	Y81-R206 PolarHBondContact OH-NH2 3.42Å; L203-R206 PolarHBondContact O-N 2.95Å; R204-R206 VanDerWaalsContact C-N 3.35Å; R204-R206 PolarHBondContact O-N 2.99Å; R206-T209 WeakPolarHBondContact O-CB 3.44Å; R206-T209 PolarHBondContact O-N 3.27Å; R206-I210 PolarHBondContact O-N 3.43Å
207	L	77.8	Confident	80.8	Confident	1 Å²	1	43.5 Å²	43.5	1%	0.005	24%	0.236	C	C	.	.	H	α-helix	trans	-69.4	-37	-179.7	-68.4	177.1	0	0	0	112.4	V80 Y81 A84 I195 S199 L203 R204 T209 I210	V80-L207 HydrophobicContact CG1-CD1 3.93Å; Y81-L207 HydrophobicContact CD1-CD2 4.07Å; Y81-L207 HydrophobicContact CE1-CD2 4.07Å; A84-L207 HydrophobicContact CB-CD2 4.04Å; I195-L207 HydrophobicContact CG2-CB 3.92Å; S199-L207 WeakPolarHBondContact OG-CB 3.39Å; S199-L207 WeakPolarHBondContact OG-CD1 3.31Å; L203-L207 HydrophobicContact CB-CD1 4.22Å; L203-L207 HydrophobicContact CB-CG 4.37Å; L203-L207 PolarHBondContact O-N 3.03Å; R204-L207 PolarHBondContact O-N 3.2Å; L207-T209 VanDerWaalsContact C-N 3.28Å; L207-T209 PolarHBondContact O-N 3.28Å; L207-I210 HydrophobicContact CD2-CD1 3.73Å; L207-I210 WeakPolarHBondContact O-CB 3.42Å; L207-I210 PolarHBondContact O-N 2.88Å
208	V	76.1	Confident	81.3	Confident	46 Å²	46	42.3 Å²	42.3	28%	0.279	23%	0.231	S	C	.	.	H	α-helix	trans	-64.5	-37	172.7	172.4	0	0	0	0	110.9	I195 A196 R204 I210 N211	I195-V208 HydrophobicContact CG2-CG2 4.07Å; A196-V208 HydrophobicContact CB-CG2 4.1Å; R204-V208 HydrophobicContact CG-CG2 4.41Å; R204-V208 WeakPolarHBondContact O-CB 3.44Å; R204-V208 VanDerWaalsContact O-CG2 3.25Å; R204-V208 WeakPolarHBondContact O-CG2 3.46Å; R204-V208 PolarHBondContact O-N 3.34Å; V208-I210 VanDerWaalsContact C-N 3.26Å; V208-I210 PolarHBondContact O-N 3.36Å; V208-N211 VanDerWaalsContact O-CB 3.29Å; V208-N211 WeakPolarHBondContact O-CB 3.38Å; V208-N211 PolarHBondContact O-N 3.49Å; V208-N211 VanDerWaalsContact O-N 3.08Å
209	T	76.3	Confident	81.7	Confident	46 Å²	46	42.8 Å²	42.8	28%	0.282	23%	0.233	S	C	.	.	H	α-helix	trans	-64.9	-29	177.7	-57.2	0	0	0	0	112.8	G205 R206 L207 N211 T212 L213 V381	G205-T209 WeakPolarHBondContact O-CB 3.42Å; G205-T209 PolarHBondContact O-N 2.78Å; G205-T209 PolarHBondContact O-OG1 2.88Å; R206-T209 WeakPolarHBondContact O-CB 3.44Å; R206-T209 PolarHBondContact O-N 3.27Å; L207-T209 VanDerWaalsContact C-N 3.28Å; L207-T209 PolarHBondContact O-N 3.28Å; T209-N211 PolarHBondContact O-N 2.93Å; T209-T212 WeakPolarHBondContact O-CB 3.35Å; T209-T212 PolarHBondContact O-N 3.24Å; T209-T212 VanDerWaalsContact O-N 3.14Å; T209-L213 PolarHBondContact O-N 3.48Å; T209-L213 VanDerWaalsContact O-N 3.12Å; T209-V381 HydrophobicContact CG2-CB 4.17Å; T209-V381 HydrophobicContact CG2-CG1 3.74Å; T209-V381 HydrophobicContact CG2-CG2 3.28Å
210	I	81.1	Confident	82.3	Confident	47 Å²	47	45.6 Å²	45.6	24%	0.241	25%	0.245	C	C	.	.	H	α-helix	trans	-58.4	-36.3	173.1	-65.2	173.8	0	0	0	110.8	A88 R206 L207 V208 T212 L213 F214	A88-I210 HydrophobicContact CB-CG2 4.19Å; R206-I210 PolarHBondContact O-N 3.43Å; L207-I210 HydrophobicContact CD2-CD1 3.73Å; L207-I210 WeakPolarHBondContact O-CB 3.42Å; L207-I210 PolarHBondContact O-N 2.88Å; V208-I210 VanDerWaalsContact C-N 3.26Å; V208-I210 PolarHBondContact O-N 3.36Å; I210-T212 VanDerWaalsContact C-N 3.35Å; I210-T212 PolarHBondContact O-N 2.85Å; I210-L213 WeakPolarHBondContact O-CB 3.5Å; I210-L213 PolarHBondContact O-N 3.44Å; I210-F214 HydrophobicContact CG2-CD2 3.64Å; I210-F214 HydrophobicContact CG2-CE2 3.56Å; I210-F214 VanDerWaalsContact O-CD2 3.27Å; I210-F214 WeakPolarHBondContact O-CD2 3.11Å; I210-F214 PolarHBondContact O-N 3.24Å
211	N	83.8	Confident	83.1	Confident	10 Å²	10	50.6 Å²	50.6	5%	0.053	27%	0.267	C	S	.	.	H	α-helix	trans	-61.1	-43.9	176.7	-175.7	63.3	0	0	0	111.9	G91 V191 I195 V208 T209 L213 F214 I215	G91-N211 WeakPolarHBondContact CA-OD1 3.38Å; V191-N211 VanDerWaalsContact CG1-OD1 3.28Å; V191-N211 WeakPolarHBondContact CG1-OD1 3.22Å; I195-N211 HydrophobicContact CD1-CB 3.98Å; V208-N211 VanDerWaalsContact O-CB 3.29Å; V208-N211 WeakPolarHBondContact O-CB 3.38Å; V208-N211 PolarHBondContact O-N 3.49Å; V208-N211 VanDerWaalsContact O-N 3.08Å; T209-N211 PolarHBondContact O-N 2.93Å; N211-L213 VanDerWaalsContact C-N 3.29Å; N211-L213 PolarHBondContact O-N 3.06Å; N211-F214 PolarHBondContact O-N 2.97Å; N211-F214 VanDerWaalsContact O-N 3.15Å; N211-I215 WeakPolarHBondContact O-CG1 3.41Å; N211-I215 PolarHBondContact O-N 3.44Å
212	T	82.9	Confident	84.2	Confident	50 Å²	50	46.5 Å²	46.5	31%	0.307	24%	0.24	S	C	.	.	H	α-helix	trans	-61.3	-39.1	175.7	-53.2	0	0	0	0	111.8	T209 I210 I215 T216 T377	T209-T212 WeakPolarHBondContact O-CB 3.35Å; T209-T212 PolarHBondContact O-N 3.24Å; T209-T212 VanDerWaalsContact O-N 3.14Å; I210-T212 VanDerWaalsContact C-N 3.35Å; I210-T212 PolarHBondContact O-N 2.85Å; T212-I215 PolarHBondContact O-N 2.89Å; T212-T216 PolarHBondContact O-N 3.37Å; T212-T216 VanDerWaalsContact O-N 3.17Å; T212-T216 PolarHBondContact O-OG1 3.27Å; T212-T377 HydrophobicContact CG2-CG2 4.13Å
213	L	85.9	Confident	85.2	Confident	54 Å²	54	41 Å²	41	28%	0.283	21%	0.211	S	C	.	.	H	α-helix	trans	-65.8	-37.7	175.1	-173.8	147.2	0	0	0	112	T209 I210 N211 I215 T216 G217 F374 L378	T209-L213 PolarHBondContact O-N 3.48Å; T209-L213 VanDerWaalsContact O-N 3.12Å; I210-L213 WeakPolarHBondContact O-CB 3.5Å; I210-L213 PolarHBondContact O-N 3.44Å; N211-L213 VanDerWaalsContact C-N 3.29Å; N211-L213 PolarHBondContact O-N 3.06Å; L213-I215 VanDerWaalsContact C-N 3.34Å; L213-T216 PolarHBondContact O-OG1 3.22Å; L213-G217 PolarHBondContact O-N 2.84Å; L213-F374 HydrophobicContact CD2-CE2 3.85Å; L213-F374 HydrophobicContact CD2-CZ 4.21Å; L213-F374 HydrophobicContact CG-CE2 3.83Å; L213-F374 HydrophobicContact CG-CZ 4.41Å; L213-L378 HydrophobicContact CD1-CD1 3.78Å
214	F	91.3	Very high	86.3	Confident	45 Å²	45	42.1 Å²	42.1	20%	0.197	22%	0.218	C	C	.	.	H	α-helix	trans	-67.1	-35.1	174.9	-89.4	-121.8	0	0	0	111.8	V85 A88 L89 F92 I210 N211 G218	V85-F214 HydrophobicContact CG1-CE1 4.44Å; V85-F214 HydrophobicContact CG1-CZ 4.09Å; A88-F214 VanDerWaalsContact C-CD1 3.5Å; A88-F214 HydrophobicContact CB-CB 4.07Å; A88-F214 HydrophobicContact CB-CD1 3.65Å; A88-F214 HydrophobicContact CB-CD2 3.89Å; A88-F214 HydrophobicContact CB-CE1 4.02Å; A88-F214 HydrophobicContact CB-CE2 4.22Å; A88-F214 HydrophobicContact CB-CG 3.59Å; A88-F214 HydrophobicContact CB-CZ 4.3Å; A88-F214 WeakPolarHBondContact O-CB 3.47Å; A88-F214 VanDerWaalsContact O-CD1 3.32Å; A88-F214 WeakPolarHBondContact O-CD1 3.1Å; L89-F214 HydrophobicContact CD2-CE1 4.26Å; F92-F214 WeakPolarHBondContact CA-O 3.39Å; F92-F214 HydrophobicContact CB-CB 4.25Å; F92-F214 HydrophobicContact CB-CD1 3.98Å; I210-F214 HydrophobicContact CG2-CD2 3.64Å; I210-F214 HydrophobicContact CG2-CE2 3.56Å; I210-F214 VanDerWaalsContact O-CD2 3.27Å; I210-F214 WeakPolarHBondContact O-CD2 3.11Å; I210-F214 PolarHBondContact O-N 3.24Å; N211-F214 PolarHBondContact O-N 2.97Å; N211-F214 VanDerWaalsContact O-N 3.15Å; F214-G218 PolarHBondContact O-N 3.06Å
215	I	91	Very high	87.3	Confident	30 Å²	30	38 Å²	38	15%	0.154	21%	0.205	C	C	.	.	H	α-helix	trans	-61.1	-54.3	173.7	-64.5	166.3	0	0	0	110.4	G91 F94 G95 N211 T212 L213 G217 G218 Q219	G91-I215 WeakPolarHBondContact O-CA 3.49Å; G91-I215 VanDerWaalsContact O-CG1 3.28Å; G91-I215 WeakPolarHBondContact O-CG1 3.15Å; F94-I215 HydrophobicContact CD1-CD1 3.86Å; F94-I215 HydrophobicContact CD1-CG1 3.9Å; F94-I215 HydrophobicContact CD1-CG2 3.78Å; F94-I215 HydrophobicContact CE1-CD1 4.22Å; F94-I215 HydrophobicContact CE1-CG2 3.91Å; G95-I215 WeakPolarHBondContact CA-O 3.5Å; N211-I215 WeakPolarHBondContact O-CG1 3.41Å; N211-I215 PolarHBondContact O-N 3.44Å; T212-I215 PolarHBondContact O-N 2.89Å; L213-I215 VanDerWaalsContact C-N 3.34Å; I215-G217 VanDerWaalsContact C-N 3.31Å; I215-G217 PolarHBondContact O-N 3.33Å; I215-G218 PolarHBondContact O-N 2.89Å; I215-Q219 PolarHBondContact O-N 3.4Å; I215-Q219 VanDerWaalsContact O-N 3.1Å
216	T	91.9	Very high	88.5	Confident	10 Å²	10	35.6 Å²	35.6	6%	0.061	18%	0.179	C	C	.	.	H	α-helix	trans	-70.3	-30.6	-178.6	56.3	0	0	0	0	112.4	T212 L213 Q219 F220 F374 T377	T212-T216 PolarHBondContact O-N 3.37Å; T212-T216 VanDerWaalsContact O-N 3.17Å; T212-T216 PolarHBondContact O-OG1 3.27Å; L213-T216 PolarHBondContact O-OG1 3.22Å; T216-Q219 PolarHBondContact O-N 2.97Å; T216-F220 PolarHBondContact O-N 3.21Å; T216-F220 VanDerWaalsContact O-N 3.13Å; T216-F374 WeakPolarHBondContact OG1-CD2 3.26Å; T216-T377 HydrophobicContact CG2-CG2 4.12Å
217	G	93.6	Very high	89.4	Confident	13 Å²	13	28.9 Å²	28.9	13%	0.134	15%	0.154	C	C	.	.	H	α-helix	trans	-65.6	-38.3	171	0	0	0	0	0	112.7	L213 I215 F220 F221	L213-G217 PolarHBondContact O-N 2.84Å; I215-G217 VanDerWaalsContact C-N 3.31Å; I215-G217 PolarHBondContact O-N 3.33Å; G217-F220 PolarHBondContact O-N 2.96Å; G217-F221 WeakPolarHBondContact O-CB 3.28Å; G217-F221 PolarHBondContact O-N 3.26Å
218	G	94.8	Very high	90.2	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-61.7	-43.5	173.1	0	0	0	0	0	112.3	F92 F214 I215 F220 F221 A222	F92-G218 VanDerWaalsContact CD2-CA 3.48Å; F214-G218 PolarHBondContact O-N 3.06Å; I215-G218 PolarHBondContact O-N 2.89Å; G218-F220 PolarHBondContact O-N 3.3Å; G218-F221 PolarHBondContact O-N 3.01Å; G218-A222 VanDerWaalsContact O-CB 3.27Å; G218-A222 WeakPolarHBondContact O-CB 3.32Å; G218-A222 PolarHBondContact O-N 2.88Å
219	Q	94.6	Very high	90.9	Very high	13 Å²	13	31.8 Å²	31.8	6%	0.061	17%	0.173	C	C	.	.	H	α-helix	trans	-60.3	-46.4	175.8	-69.1	172.7	-25.5	0	0	111.9	G95 T98 I215 T216 S223 M344 N373	G95-Q219 VanDerWaalsContact O-CA 3.27Å; G95-Q219 WeakPolarHBondContact O-CA 3.35Å; G95-Q219 WeakPolarHBondContact O-CG 3.32Å; G95-Q219 PolarHBondContact O-N 3.42Å; T98-Q219 HydrophobicContact CG2-CG 4.29Å; I215-Q219 PolarHBondContact O-N 3.4Å; I215-Q219 VanDerWaalsContact O-N 3.1Å; T216-Q219 PolarHBondContact O-N 2.97Å; Q219-S223 PolarHBondContact O-N 3.25Å; Q219-S223 PolarHBondContact O-OG 3.14Å; Q219-M344 HydrophobicContact CB-CE 4.19Å; Q219-M344 HydrophobicContact CG-CE 4.29Å; Q219-N373 PolarHBondContact OE1-ND2 2.99Å
220	F	95.3	Very high	91.5	Very high	61 Å²	61	29.9 Å²	29.9	27%	0.268	16%	0.161	S	C	.	.	H	α-helix	trans	-63.4	-49	177.2	169.9	-118.8	0	0	0	111.7	T216 G217 G218 A222 S223 V224 F371 F374	T216-F220 PolarHBondContact O-N 3.21Å; T216-F220 VanDerWaalsContact O-N 3.13Å; G217-F220 PolarHBondContact O-N 2.96Å; G218-F220 PolarHBondContact O-N 3.3Å; F220-A222 VanDerWaalsContact C-N 3.33Å; F220-A222 PolarHBondContact O-N 3.06Å; F220-S223 PolarHBondContact O-N 3.03Å; F220-S223 VanDerWaalsContact O-N 3.17Å; F220-V224 HydrophobicContact CD2-CG2 4.15Å; F220-V224 HydrophobicContact CE1-CG2 4.47Å; F220-V224 HydrophobicContact CE2-CG2 3.61Å; F220-V224 HydrophobicContact CZ-CG2 3.8Å; F220-V224 WeakPolarHBondContact O-CG2 3.37Å; F220-V224 PolarHBondContact O-N 2.97Å; F220-F371 HydrophobicContact CD1-CD2 4.38Å; F220-F371 HydrophobicContact CD2-CB 3.61Å; F220-F371 HydrophobicContact CD2-CD2 4.01Å; F220-F371 HydrophobicContact CD2-CG 4.3Å; F220-F371 HydrophobicContact CE1-CD2 4.06Å; F220-F371 HydrophobicContact CE2-CB 3.62Å; F220-F371 AromaticContact CE2-CD2 3.66Å; F220-F371 HydrophobicContact CE2-CD2 3.66Å; F220-F371 HydrophobicContact CE2-CG 4.01Å; F220-F371 HydrophobicContact CG-CB 4.48Å; F220-F371 HydrophobicContact CG-CD2 4.36Å; F220-F371 HydrophobicContact CZ-CB 4.49Å; F220-F371 AromaticContact CZ-CD2 3.68Å; F220-F371 HydrophobicContact CZ-CD2 3.68Å; F220-F371 HydrophobicContact CZ-CE2 4.39Å; F220-F371 HydrophobicContact CZ-CG 4.44Å; F220-F374 HydrophobicContact CB-CB 4.4Å
221	F	95.8	Very high	91.8	Very high	111 Å²	111	34 Å²	34	49%	0.487	18%	0.175	S	C	.	.	H	α-helix	trans	-61.9	-41.6	-179.6	-172.5	-93.5	0	0	0	111.9	F92 Y96 G217 G218 S223 V224 V225	F92-F221 HydrophobicContact CE2-CB 4.02Å; F92-F221 HydrophobicContact CE2-CG 4.38Å; F92-F221 HydrophobicContact CZ-CB 3.94Å; F92-F221 AromaticContact CZ-CD1 3.71Å; F92-F221 HydrophobicContact CZ-CD1 3.71Å; F92-F221 HydrophobicContact CZ-CE1 4.48Å; F92-F221 AromaticContact CZ-CG 3.94Å; F92-F221 HydrophobicContact CZ-CG 3.94Å; Y96-F221 HydrophobicContact CD2-CD1 4.17Å; Y96-F221 AromaticContact CE2-CD1 3.95Å; Y96-F221 HydrophobicContact CE2-CD1 3.95Å; Y96-F221 HydrophobicContact CE2-CE1 4.34Å; G217-F221 WeakPolarHBondContact O-CB 3.28Å; G217-F221 PolarHBondContact O-N 3.26Å; G218-F221 PolarHBondContact O-N 3.01Å; F221-S223 VanDerWaalsContact C-N 3.35Å; F221-S223 PolarHBondContact O-N 2.91Å; F221-V224 PolarHBondContact O-N 3.45Å; F221-V225 HydrophobicContact CD1-CG2 4.02Å; F221-V225 HydrophobicContact CE1-CG2 3.71Å; F221-V225 HydrophobicContact CZ-CG2 4.29Å; F221-V225 WeakPolarHBondContact O-CG2 3.32Å; F221-V225 PolarHBondContact O-N 3.18Å
222	A	95.8	Very high	91.9	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-60	-43.6	174.1	0	0	0	0	0	112.6	Y96 V100 G218 F220 V224 V225 D226	Y96-A222 HydrophobicContact CD1-CB 4.33Å; Y96-A222 HydrophobicContact CD2-CB 3.66Å; Y96-A222 HydrophobicContact CE2-CB 3.93Å; Y96-A222 HydrophobicContact CG-CB 3.88Å; Y96-A222 VanDerWaalsContact O-CB 3.23Å; Y96-A222 WeakPolarHBondContact O-CB 3.15Å; V100-A222 HydrophobicContact CB-CB 3.99Å; G218-A222 VanDerWaalsContact O-CB 3.27Å; G218-A222 WeakPolarHBondContact O-CB 3.32Å; G218-A222 PolarHBondContact O-N 2.88Å; F220-A222 VanDerWaalsContact C-N 3.33Å; F220-A222 PolarHBondContact O-N 3.06Å; A222-V224 VanDerWaalsContact C-N 3.29Å; A222-V224 PolarHBondContact O-N 3.34Å; A222-V225 CarbonylContact O-C 3.54Å; A222-V225 WeakPolarHBondContact O-CA 3.34Å; A222-V225 WeakPolarHBondContact O-CB 3.41Å; A222-V225 PolarHBondContact O-N 2.94Å; A222-V225 VanDerWaalsContact O-N 3.09Å; A222-D226 PolarHBondContact O-N 2.98Å
223	S	93.8	Very high	91.1	Very high	5 Å²	5	40.6 Å²	40.6	4%	0.035	20%	0.204	C	C	.	.	H	α-helix	trans	-62.7	-37.6	178.3	-52.8	0	0	0	0	111.8	Q219 F220 F221 D226 G227 S367 A370	Q219-S223 PolarHBondContact O-N 3.25Å; Q219-S223 PolarHBondContact O-OG 3.14Å; F220-S223 PolarHBondContact O-N 3.03Å; F220-S223 VanDerWaalsContact O-N 3.17Å; F221-S223 VanDerWaalsContact C-N 3.35Å; F221-S223 PolarHBondContact O-N 2.91Å; S223-D226 WeakPolarHBondContact O-CB 3.34Å; S223-D226 PolarHBondContact O-N 3.36Å; S223-G227 PolarHBondContact O-N 3.34Å; S223-S367 VanDerWaalsContact C-OG 3.22Å; S223-S367 WeakPolarHBondContact CB-OG 3.44Å; S223-S367 PolarHBondContact O-OG 3.45Å; S223-A370 WeakPolarHBondContact OG-CB 3.48Å
224	V	95.2	Very high	90.4	Very high	48 Å²	48	46.5 Å²	46.5	29%	0.291	23%	0.228	S	C	.	.	H	α-helix	trans	-66.2	-39.2	173.9	175.3	0	0	0	0	111.4	F220 F221 A222 D226 G227 A228	F220-V224 HydrophobicContact CD2-CG2 4.15Å; F220-V224 HydrophobicContact CE1-CG2 4.47Å; F220-V224 HydrophobicContact CE2-CG2 3.61Å; F220-V224 HydrophobicContact CZ-CG2 3.8Å; F220-V224 WeakPolarHBondContact O-CG2 3.37Å; F220-V224 PolarHBondContact O-N 2.97Å; F221-V224 PolarHBondContact O-N 3.45Å; A222-V224 VanDerWaalsContact C-N 3.29Å; A222-V224 PolarHBondContact O-N 3.34Å; V224-D226 VanDerWaalsContact C-N 3.33Å; V224-G227 PolarHBondContact O-N 3.05Å; V224-A228 WeakPolarHBondContact O-CB 3.41Å; V224-A228 PolarHBondContact O-N 3.3Å
225	V	95.2	Very high	90	Very high	15 Å²	15	47.9 Å²	47.9	9%	0.091	24%	0.237	C	C	.	.	H	α-helix	trans	-61.7	-43.2	173	173	0	0	0	0	110.3	Y96 F221 A222 G227 A228 F229 L243	Y96-V225 HydrophobicContact CE2-CG2 4.37Å; F221-V225 HydrophobicContact CD1-CG2 4.02Å; F221-V225 HydrophobicContact CE1-CG2 3.71Å; F221-V225 HydrophobicContact CZ-CG2 4.29Å; F221-V225 WeakPolarHBondContact O-CG2 3.32Å; F221-V225 PolarHBondContact O-N 3.18Å; A222-V225 CarbonylContact O-C 3.54Å; A222-V225 WeakPolarHBondContact O-CA 3.34Å; A222-V225 WeakPolarHBondContact O-CB 3.41Å; A222-V225 PolarHBondContact O-N 2.94Å; A222-V225 VanDerWaalsContact O-N 3.09Å; V225-G227 VanDerWaalsContact C-N 3.35Å; V225-G227 PolarHBondContact O-N 2.96Å; V225-A228 PolarHBondContact O-N 3.39Å; V225-F229 HydrophobicContact CG1-CD2 3.69Å; V225-F229 HydrophobicContact CG1-CE2 4.04Å; V225-F229 WeakPolarHBondContact O-CD2 3.3Å; V225-F229 PolarHBondContact O-N 2.73Å; V225-L243 HydrophobicContact CG1-CD1 3.82Å
226	D	93.9	Very high	89.8	Confident	1 Å²	1	46.5 Å²	46.5	1%	0.005	23%	0.23	C	C	.	.	H	α-helix	trans	-58.8	-46.5	174.5	-68.7	-13.1	0	0	0	111.3	V100 G103 A222 S223 V224 A228 F229 S230 M240 I363	V100-D226 WeakPolarHBondContact CA-OD2 3.26Å; V100-D226 VanDerWaalsContact CG2-OD1 3.24Å; V100-D226 WeakPolarHBondContact CG2-OD1 3.25Å; V100-D226 VanDerWaalsContact O-OD2 3.11Å; G103-D226 WeakPolarHBondContact CA-OD2 3.22Å; G103-D226 PolarHBondContact N-OD2 2.92Å; A222-D226 PolarHBondContact O-N 2.98Å; S223-D226 WeakPolarHBondContact O-CB 3.34Å; S223-D226 PolarHBondContact O-N 3.36Å; V224-D226 VanDerWaalsContact C-N 3.33Å; D226-A228 VanDerWaalsContact C-N 3.34Å; D226-A228 PolarHBondContact O-N 2.97Å; D226-F229 PolarHBondContact O-N 3.26Å; D226-S230 VanDerWaalsContact O-CB 3.23Å; D226-S230 WeakPolarHBondContact O-CB 3.46Å; D226-S230 PolarHBondContact O-N 3.14Å; D226-M240 HydrophobicContact CB-SD 4.23Å; D226-M240 WeakPolarHBondContact O-CE 3.34Å; D226-M240 WeakPolarHBondContact OD1-CB 3.28Å; D226-M240 WeakPolarHBondContact OD1-CG 3.44Å; D226-I363 HydrophobicContact CB-CG2 3.66Å
227	G	91.9	Very high	89.8	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-57.9	-45	175.3	0	0	0	0	0	112.5	S223 V224 V225 S230 Y231	S223-G227 PolarHBondContact O-N 3.34Å; V224-G227 PolarHBondContact O-N 3.05Å; V225-G227 VanDerWaalsContact C-N 3.35Å; V225-G227 PolarHBondContact O-N 2.96Å; G227-S230 PolarHBondContact O-N 2.87Å; G227-S230 PolarHBondContact O-OG 2.72Å; G227-Y231 WeakPolarHBondContact O-CE2 3.3Å
228	A	93.2	Very high	89.8	Confident	53 Å²	53	48.4 Å²	48.4	44%	0.438	23%	0.232	S	C	.	.	H	α-helix	trans	-68.4	-39.4	-179.3	0	0	0	0	0	113.4	V224 V225 D226 Y231	V224-A228 WeakPolarHBondContact O-CB 3.41Å; V224-A228 PolarHBondContact O-N 3.3Å; V225-A228 PolarHBondContact O-N 3.39Å; D226-A228 VanDerWaalsContact C-N 3.34Å; D226-A228 PolarHBondContact O-N 2.97Å; A228-Y231 WeakPolarHBondContact O-CD2 3.45Å
229	F	92.7	Very high	89.7	Confident	55 Å²	55	54.5 Å²	54.5	24%	0.241	26%	0.256	C	S	.	.	H	α-helix	trans	-89.7	-6.6	179.7	-75.1	-87.6	0	0	0	113.3	V225 D226 Y231 L232 Y239 M240 L243	V225-F229 HydrophobicContact CG1-CD2 3.69Å; V225-F229 HydrophobicContact CG1-CE2 4.04Å; V225-F229 WeakPolarHBondContact O-CD2 3.3Å; V225-F229 PolarHBondContact O-N 2.73Å; D226-F229 PolarHBondContact O-N 3.26Å; F229-Y231 PolarHBondContact O-N 3.49Å; F229-L232 HydrophobicContact CD1-CD1 3.75Å; F229-L232 HydrophobicContact CE1-CD1 4.24Å; F229-L232 PolarHBondContact O-N 3.44Å; F229-Y239 HydrophobicContact CD1-CD2 4.22Å; F229-Y239 HydrophobicContact CD1-CG 4.02Å; F229-Y239 HydrophobicContact CE1-CD1 4.45Å; F229-Y239 HydrophobicContact CE1-CD2 4.4Å; F229-Y239 AromaticContact CE1-CG 3.93Å; F229-Y239 HydrophobicContact CE1-CG 3.93Å; F229-M240 HydrophobicContact CB-CE 3.7Å; F229-M240 HydrophobicContact CB-CG 3.85Å; F229-L243 HydrophobicContact CD2-CD1 4.17Å; F229-L243 HydrophobicContact CE2-CD1 3.42Å; F229-L243 VanDerWaalsContact CE2-CD1 3.42Å; F229-L243 HydrophobicContact CZ-CD1 3.75Å
230	S	88.8	Confident	89.6	Confident	6 Å²	6	53.9 Å²	53.9	4%	0.042	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-23	175.9	71.3	0	0	0	0	113.6	D226 G227 L232 M240	D226-S230 VanDerWaalsContact O-CB 3.23Å; D226-S230 WeakPolarHBondContact O-CB 3.46Å; D226-S230 PolarHBondContact O-N 3.14Å; G227-S230 PolarHBondContact O-N 2.87Å; G227-S230 PolarHBondContact O-OG 2.72Å; S230-L232 PolarHBondContact O-N 2.77Å; S230-M240 VanDerWaalsContact N-CE 3.3Å
231	Y	87.1	Confident	89.5	Confident	134 Å²	134	51.1 Å²	51.1	53%	0.525	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-22.1	176.1	-62.9	-83.9	0	0	0	112.8	G227 A228 F229 Q233	G227-Y231 WeakPolarHBondContact O-CE2 3.3Å; A228-Y231 WeakPolarHBondContact O-CD2 3.45Å; F229-Y231 PolarHBondContact O-N 3.49Å; Y231-Q233 PolarHBondContact O-N 3.36Å
232	L	85.4	Confident	89.4	Confident	89 Å²	89	46.5 Å²	46.5	47%	0.466	23%	0.225	S	C	.	.			trans	-91.5	89.7	179.4	-71.9	161.6	0	0	0	110.8	F229 S230 K234 G236	F229-L232 HydrophobicContact CD1-CD1 3.75Å; F229-L232 HydrophobicContact CE1-CD1 4.24Å; F229-L232 PolarHBondContact O-N 3.44Å; S230-L232 PolarHBondContact O-N 2.77Å; L232-K234 PolarHBondContact O-N 3.24Å; L232-G236 VanDerWaalsContact O-CA 3.25Å; L232-G236 WeakPolarHBondContact O-CA 3.35Å; L232-G236 PolarHBondContact O-N 3.39Å
233	Q	66.6	Low	89.4	Confident	110 Å²	110	49 Å²	49	51%	0.514	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-28.3	-171.3	-77.9	-175.7	-28.2	0	0	116.3	Q111 Y231	Q111-Q233 PolarHBondContact NE2-O 3.04Å; Y231-Q233 PolarHBondContact O-N 3.36Å
234	K	71.3	Confident	89.3	Confident	178 Å²	178	49.2 Å²	49.2	77%	0.774	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-36.5	-175.5	-84.3	-173.6	175.3	-179.6	0	114	Q111 L232	Q111-K234 PolarHBondContact NE2-O 3.32Å; Q111-K234 PolarHBondContact OE1-O 3.32Å; L232-K234 PolarHBondContact O-N 3.24Å
235	D	82.6	Confident	89.3	Confident	74 Å²	74	48 Å²	48	40%	0.396	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-138.5	9.6	-174.8	-68.9	-63.3	0	0	0	114.1	W237 R238 Y239	D235-W237 VanDerWaalsContact C-N 3.31Å; D235-W237 PolarHBondContact O-N 2.99Å; D235-R238 WeakPolarHBondContact O-CB 3.39Å; D235-R238 PolarHBondContact O-N 3.12Å; D235-R238 WeakPolarHBondContact OD1-CD 3.33Å; D235-R238 IonicContact OD1-NE 3.8Å; D235-R238 PolarHBondContact OD1-NE 2.98Å; D235-Y239 HydrophobicContact CB-CE2 4.29Å; D235-Y239 VanDerWaalsContact O-CD2 3.28Å; D235-Y239 WeakPolarHBondContact O-CD2 3.43Å
236	G	87.1	Confident	89.3	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-54.9	-42.3	-177	0	0	0	0	0	113.7	L232 R238 Y239 M240	L232-G236 VanDerWaalsContact O-CA 3.25Å; L232-G236 WeakPolarHBondContact O-CA 3.35Å; L232-G236 PolarHBondContact O-N 3.39Å; G236-R238 VanDerWaalsContact C-N 3.25Å; G236-R238 PolarHBondContact O-N 3.46Å; G236-Y239 PolarHBondContact O-N 2.8Å; G236-Y239 VanDerWaalsContact O-N 3.12Å; G236-M240 WeakPolarHBondContact O-CG 3.42Å; G236-M240 PolarHBondContact O-N 2.83Å
237	W	90.8	Very high	89.3	Confident	3 Å²	3	52.8 Å²	52.8	1%	0.011	26%	0.26	C	S	.	.	H	α-helix	trans	-63	-28	179.6	68.9	-95.1	0	0	0	113.5	A104 L107 L108 A167 L173 D235 Y239 M240 L241	A104-W237 HydrophobicContact CB-CB 4.46Å; L107-W237 HydrophobicContact CB-CB 4.16Å; L107-W237 HydrophobicContact CD2-CB 4.4Å; L108-W237 HydrophobicContact CD2-CD2 3.6Å; L108-W237 HydrophobicContact CD2-CE3 3.53Å; L108-W237 HydrophobicContact CD2-CG 4.13Å; L108-W237 HydrophobicContact CD2-CH2 4.21Å; L108-W237 HydrophobicContact CD2-CZ2 4.28Å; L108-W237 HydrophobicContact CD2-CZ3 3.85Å; L108-W237 HydrophobicContact CG-CB 4.46Å; L108-W237 HydrophobicContact CG-CD2 4.3Å; L108-W237 HydrophobicContact CG-CE3 4.32Å; L108-W237 HydrophobicContact CG-CG 4.38Å; A167-W237 HydrophobicContact CB-CH2 4.25Å; A167-W237 WeakPolarHBondContact O-CH2 3.08Å; L173-W237 HydrophobicContact CD1-CZ3 3.9Å; D235-W237 VanDerWaalsContact C-N 3.31Å; D235-W237 PolarHBondContact O-N 2.99Å; W237-Y239 VanDerWaalsContact C-N 3.34Å; W237-M240 HydrophobicContact CB-SD 4.42Å; W237-M240 PolarHBondContact O-N 2.86Å; W237-L241 HydrophobicContact CE3-CD1 4.02Å; W237-L241 HydrophobicContact CZ3-CD1 4.34Å; W237-L241 WeakPolarHBondContact O-CG 3.3Å; W237-L241 PolarHBondContact O-N 3.19Å; W237-L241 VanDerWaalsContact O-N 3.09Å
238	R	93.4	Very high	89.5	Confident	60 Å²	60	52.8 Å²	52.8	23%	0.226	26%	0.26	C	S	.	.	H	α-helix	trans	-66.2	-40.3	175.9	-62.8	178.9	177.6	-75.8	-11	110.8	A165 A167 D235 G236 G242	A165-R238 PolarHBondContact O-NH1 2.93Å; A167-R238 PolarHBondContact O-NH1 2.99Å; A167-R238 PolarHBondContact O-NH2 2.98Å; D235-R238 WeakPolarHBondContact O-CB 3.39Å; D235-R238 PolarHBondContact O-N 3.12Å; D235-R238 WeakPolarHBondContact OD1-CD 3.33Å; D235-R238 IonicContact OD1-NE 3.8Å; D235-R238 PolarHBondContact OD1-NE 2.98Å; G236-R238 VanDerWaalsContact C-N 3.25Å; G236-R238 PolarHBondContact O-N 3.46Å; R238-G242 WeakPolarHBondContact O-CA 3.39Å; R238-G242 PolarHBondContact O-N 3.23Å
239	Y	92.6	Very high	89.6	Confident	129 Å²	129	52.7 Å²	52.7	51%	0.506	26%	0.255	S	S	.	.	H	α-helix	trans	-71.2	-40.2	176.3	-64.2	-74.9	0	0	0	111.5	F229 D235 G236 W237 L241 G242 L243	F229-Y239 HydrophobicContact CD1-CD2 4.22Å; F229-Y239 HydrophobicContact CD1-CG 4.02Å; F229-Y239 HydrophobicContact CE1-CD1 4.45Å; F229-Y239 HydrophobicContact CE1-CD2 4.4Å; F229-Y239 AromaticContact CE1-CG 3.93Å; F229-Y239 HydrophobicContact CE1-CG 3.93Å; D235-Y239 HydrophobicContact CB-CE2 4.29Å; D235-Y239 VanDerWaalsContact O-CD2 3.28Å; D235-Y239 WeakPolarHBondContact O-CD2 3.43Å; G236-Y239 PolarHBondContact O-N 2.8Å; G236-Y239 VanDerWaalsContact O-N 3.12Å; W237-Y239 VanDerWaalsContact C-N 3.34Å; Y239-L241 PolarHBondContact O-N 2.87Å; Y239-G242 PolarHBondContact O-N 2.87Å; Y239-L243 VanDerWaalsContact O-CB 3.32Å; Y239-L243 WeakPolarHBondContact O-CB 3.35Å; Y239-L243 WeakPolarHBondContact O-CD1 3.34Å; Y239-L243 WeakPolarHBondContact O-CG 3.25Å; Y239-L243 PolarHBondContact O-N 3.44Å
240	M	94	Very high	89.6	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-52.6	-55.9	174.2	-65.3	169.9	-171.4	0	0	110.5	Y96 V100 A104 L107 D226 F229 S230 G236 W237	Y96-M240 PolarHBondContact OH-O 3.5Å; V100-M240 VanDerWaalsContact CG2-C 3.47Å; V100-M240 HydrophobicContact CG2-CB 3.72Å; V100-M240 VanDerWaalsContact CG2-O 3.3Å; V100-M240 WeakPolarHBondContact CG2-O 3.38Å; A104-M240 HydrophobicContact CB-CB 4.48Å; A104-M240 HydrophobicContact CB-SD 4.09Å; L107-M240 HydrophobicContact CD2-CE 3.98Å; D226-M240 HydrophobicContact CB-SD 4.23Å; D226-M240 WeakPolarHBondContact O-CE 3.34Å; D226-M240 WeakPolarHBondContact OD1-CB 3.28Å; D226-M240 WeakPolarHBondContact OD1-CG 3.44Å; F229-M240 HydrophobicContact CB-CE 3.7Å; F229-M240 HydrophobicContact CB-CG 3.85Å; S230-M240 VanDerWaalsContact N-CE 3.3Å; G236-M240 WeakPolarHBondContact O-CG 3.42Å; G236-M240 PolarHBondContact O-N 2.83Å; W237-M240 HydrophobicContact CB-SD 4.42Å; W237-M240 PolarHBondContact O-N 2.86Å
241	L	93.4	Very high	89.9	Confident	2 Å²	2	54 Å²	54	1%	0.01	26%	0.262	C	S	.	.	H	α-helix	trans	-73.6	-35	-178.8	-58.5	179.7	0	0	0	113.3	V100 A104 L108 L164 L173 R177 W237 Y239	V100-L241 HydrophobicContact CB-CD2 4.41Å; V100-L241 HydrophobicContact CG1-CD2 3.65Å; V100-L241 HydrophobicContact CG2-CD2 3.9Å; A104-L241 HydrophobicContact CB-CD2 4.16Å; A104-L241 HydrophobicContact CB-CG 4.43Å; L108-L241 HydrophobicContact CD1-CD1 4.41Å; L164-L241 HydrophobicContact CB-CB 3.92Å; L164-L241 HydrophobicContact CB-CD1 4.29Å; L164-L241 HydrophobicContact CD1-CB 4.27Å; L164-L241 HydrophobicContact CD2-CD1 4.35Å; L173-L241 HydrophobicContact CD1-CD1 3.9Å; R177-L241 VanDerWaalsContact NH2-CD2 3.27Å; W237-L241 HydrophobicContact CE3-CD1 4.02Å; W237-L241 HydrophobicContact CZ3-CD1 4.34Å; W237-L241 WeakPolarHBondContact O-CG 3.3Å; W237-L241 PolarHBondContact O-N 3.19Å; W237-L241 VanDerWaalsContact O-N 3.09Å; Y239-L241 PolarHBondContact O-N 2.87Å
242	G	93.3	Very high	90.2	Very high	15 Å²	15	50.6 Å²	50.6	16%	0.155	25%	0.251	C	S	.	.	H	α-helix	trans	-73.5	-30.7	-175.6	0	0	0	0	0	114.4	R238 Y239 A244 A245	R238-G242 WeakPolarHBondContact O-CA 3.39Å; R238-G242 PolarHBondContact O-N 3.23Å; Y239-G242 PolarHBondContact O-N 2.87Å; G242-A244 PolarHBondContact O-N 3.09Å; G242-A244 VanDerWaalsContact O-N 3.16Å; G242-A245 VanDerWaalsContact O-CB 3.26Å; G242-A245 WeakPolarHBondContact O-CB 3.25Å; G242-A245 PolarHBondContact O-N 2.91Å
243	L	94.3	Very high	90.7	Very high	51 Å²	51	52 Å²	52	27%	0.267	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-17.2	-178.5	-78.2	171.3	0	0	0	113.4	Y96 V225 F229 Y239 A245 I246 P247	Y96-L243 WeakPolarHBondContact OH-CB 3.29Å; V225-L243 HydrophobicContact CG1-CD1 3.82Å; F229-L243 HydrophobicContact CD2-CD1 4.17Å; F229-L243 HydrophobicContact CE2-CD1 3.42Å; F229-L243 VanDerWaalsContact CE2-CD1 3.42Å; F229-L243 HydrophobicContact CZ-CD1 3.75Å; Y239-L243 VanDerWaalsContact O-CB 3.32Å; Y239-L243 WeakPolarHBondContact O-CB 3.35Å; Y239-L243 WeakPolarHBondContact O-CD1 3.34Å; Y239-L243 WeakPolarHBondContact O-CG 3.25Å; Y239-L243 PolarHBondContact O-N 3.44Å; L243-A245 PolarHBondContact O-N 3.5Å; L243-A245 VanDerWaalsContact O-N 3.14Å; L243-I246 HydrophobicContact CD2-CD1 3.53Å; L243-I246 HydrophobicContact CD2-CG1 4.47Å; L243-I246 PolarHBondContact O-N 3.25Å; L243-I246 VanDerWaalsContact O-N 3.09Å; L243-P247 WeakPolarHBondContact O-CD 3.49Å
244	A	93.1	Very high	91.8	Very high	11 Å²	11	47.3 Å²	47.3	9%	0.091	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-24.4	168.6	0	0	0	0	0	113.1	L93 Y96 S161 G242 I246 P247 A248	L93-A244 WeakPolarHBondContact CD2-O 3.48Å; Y96-A244 HydrophobicContact CD1-CB 3.63Å; Y96-A244 HydrophobicContact CE1-CB 3.59Å; S161-A244 WeakPolarHBondContact OG-CB 3.28Å; G242-A244 PolarHBondContact O-N 3.09Å; G242-A244 VanDerWaalsContact O-N 3.16Å; A244-I246 VanDerWaalsContact C-N 3.25Å; A244-I246 PolarHBondContact O-N 3.49Å; A244-P247 WeakPolarHBondContact O-CD 3.47Å; A244-P247 WeakPolarHBondContact O-CG 3.48Å; A244-A248 PolarHBondContact O-N 2.97Å
245	A	94.9	Very high	92.8	Very high	23 Å²	23	38.8 Å²	38.8	19%	0.19	20%	0.197	C	C	.	.	H	α-helix	trans	-61.8	-31.1	176.2	0	0	0	0	0	112.8	G242 L243 A248 V249	G242-A245 VanDerWaalsContact O-CB 3.26Å; G242-A245 WeakPolarHBondContact O-CB 3.25Å; G242-A245 PolarHBondContact O-N 2.91Å; L243-A245 PolarHBondContact O-N 3.5Å; L243-A245 VanDerWaalsContact O-N 3.14Å; A245-A248 PolarHBondContact O-N 2.75Å; A245-V249 WeakPolarHBondContact O-CB 3.15Å; A245-V249 VanDerWaalsContact O-CG2 3.22Å; A245-V249 WeakPolarHBondContact O-CG2 3.47Å; A245-V249 PolarHBondContact O-N 3.28Å
246	I	94.6	Very high	93.2	Very high	96 Å²	96	38.5 Å²	38.5	49%	0.492	20%	0.195	S	C	.	.	H	α-helix	trans	-62.7	-59.3	-177	-61.5	176.2	0	0	0	111.4	L243 A244 A248 V249 I250	L243-I246 HydrophobicContact CD2-CD1 3.53Å; L243-I246 HydrophobicContact CD2-CG1 4.47Å; L243-I246 PolarHBondContact O-N 3.25Å; L243-I246 VanDerWaalsContact O-N 3.09Å; A244-I246 VanDerWaalsContact C-N 3.25Å; A244-I246 PolarHBondContact O-N 3.49Å; I246-A248 PolarHBondContact O-N 3.2Å; I246-V249 PolarHBondContact O-N 3.45Å; I246-I250 HydrophobicContact CG2-CD1 3.98Å; I246-I250 WeakPolarHBondContact O-CG1 3.37Å; I246-I250 PolarHBondContact O-N 2.99Å
247	P	94.5	Very high	93.2	Very high	19 Å²	19	47 Å²	47	12%	0.123	23%	0.233	C	C	.	.	H	α-helix	trans	-61.2	-31.7	176.3	19.5	-29.2	0	0	0	112.7	F92 L93 L243 A244 I250 Q251	F92-P247 HydrophobicContact CD1-CB 4.14Å; F92-P247 HydrophobicContact CD1-CG 4.26Å; F92-P247 HydrophobicContact CE1-CB 4.23Å; F92-P247 HydrophobicContact CE1-CG 4.02Å; L93-P247 HydrophobicContact CD2-CB 3.97Å; L93-P247 HydrophobicContact CD2-CG 3.67Å; L243-P247 WeakPolarHBondContact O-CD 3.49Å; A244-P247 WeakPolarHBondContact O-CD 3.47Å; A244-P247 WeakPolarHBondContact O-CG 3.48Å; P247-I250 PolarHBondContact O-N 3.37Å; P247-Q251 WeakPolarHBondContact O-CB 3.32Å; P247-Q251 PolarHBondContact O-N 3.06Å
248	A	94.8	Very high	93.2	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-65.4	-43.3	176.8	0	0	0	0	0	112.7	L93 F157 T158 A244 A245 I246 Q251 F252	L93-A248 HydrophobicContact CD1-CB 3.92Å; L93-A248 HydrophobicContact CD2-CB 4.02Å; F157-A248 HydrophobicContact CB-CB 3.67Å; T158-A248 WeakPolarHBondContact OG1-CB 3.46Å; A244-A248 PolarHBondContact O-N 2.97Å; A245-A248 PolarHBondContact O-N 2.75Å; I246-A248 PolarHBondContact O-N 3.2Å; A248-Q251 PolarHBondContact O-N 2.85Å; A248-F252 WeakPolarHBondContact O-CB 3.28Å; A248-F252 PolarHBondContact O-N 3.26Å
249	V	95.5	Very high	93	Very high	52 Å²	52	45.5 Å²	45.5	32%	0.315	23%	0.231	S	C	.	.	H	α-helix	trans	-66.5	-42.3	175.9	169.8	0	0	0	0	110.9	T158 A245 I246 Q251 F252 F253	T158-V249 HydrophobicContact CG2-CG2 3.65Å; A245-V249 WeakPolarHBondContact O-CB 3.15Å; A245-V249 VanDerWaalsContact O-CG2 3.22Å; A245-V249 WeakPolarHBondContact O-CG2 3.47Å; A245-V249 PolarHBondContact O-N 3.28Å; I246-V249 PolarHBondContact O-N 3.45Å; V249-Q251 VanDerWaalsContact C-N 3.31Å; V249-Q251 PolarHBondContact O-N 2.96Å; V249-F252 PolarHBondContact O-N 3.07Å; V249-F253 HydrophobicContact CG1-CD2 3.58Å; V249-F253 HydrophobicContact CG1-CE2 3.57Å; V249-F253 VanDerWaalsContact O-CD2 3.3Å; V249-F253 WeakPolarHBondContact O-CD2 2.93Å; V249-F253 PolarHBondContact O-N 3.01Å
250	I	94.4	Very high	93	Very high	87 Å²	87	40.3 Å²	40.3	45%	0.446	21%	0.211	S	C	.	.	H	α-helix	trans	-59.2	-45.4	175.2	-67.6	168.2	0	0	0	110.4	F86 L89 I246 P247 G254	F86-I250 HydrophobicContact CE1-CG2 4.08Å; L89-I250 HydrophobicContact CD1-CG2 3.99Å; I246-I250 HydrophobicContact CG2-CD1 3.98Å; I246-I250 WeakPolarHBondContact O-CG1 3.37Å; I246-I250 PolarHBondContact O-N 2.99Å; P247-I250 PolarHBondContact O-N 3.37Å; I250-G254 PolarHBondContact O-N 2.97Å
251	Q	93.7	Very high	92.8	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-63.5	-43.6	176.5	-173	179.3	-4.1	0	0	111.5	L89 I150 S154 P247 A248 V249 G254 F255	L89-Q251 HydrophobicContact CB-CB 4.18Å; L89-Q251 HydrophobicContact CB-CG 4.26Å; L89-Q251 HydrophobicContact CD1-CB 4.22Å; I150-Q251 HydrophobicContact CG2-CG 4.38Å; I150-Q251 VanDerWaalsContact CG2-NE2 3.28Å; S154-Q251 WeakPolarHBondContact OG-CG 3.49Å; P247-Q251 WeakPolarHBondContact O-CB 3.32Å; P247-Q251 PolarHBondContact O-N 3.06Å; A248-Q251 PolarHBondContact O-N 2.85Å; V249-Q251 VanDerWaalsContact C-N 3.31Å; V249-Q251 PolarHBondContact O-N 2.96Å; Q251-G254 PolarHBondContact O-N 3.27Å; Q251-F255 HydrophobicContact CG-CD2 3.83Å; Q251-F255 HydrophobicContact CG-CE2 4.02Å; Q251-F255 WeakPolarHBondContact O-CD2 3.48Å; Q251-F255 PolarHBondContact O-N 3.24Å
252	F	94.8	Very high	92.5	Very high	64 Å²	64	40.2 Å²	40.2	28%	0.281	21%	0.211	S	C	.	.	H	α-helix	trans	-57.3	-54	178.1	-173.9	-91.8	0	0	0	111.4	L151 A155 A248 V249 G254 F255 L256	L151-F252 HydrophobicContact CB-CE2 4.35Å; L151-F252 HydrophobicContact CD2-CD2 3.9Å; L151-F252 HydrophobicContact CD2-CE2 4.05Å; L151-F252 HydrophobicContact CD2-CG 4.27Å; L151-F252 VanDerWaalsContact CD2-O 3.25Å; L151-F252 WeakPolarHBondContact CD2-O 3.39Å; L151-F252 WeakPolarHBondContact O-CD2 3.37Å; A155-F252 HydrophobicContact CB-CD2 4.38Å; A155-F252 HydrophobicContact CB-CE2 4.15Å; A248-F252 WeakPolarHBondContact O-CB 3.28Å; A248-F252 PolarHBondContact O-N 3.26Å; V249-F252 PolarHBondContact O-N 3.07Å; F252-G254 VanDerWaalsContact C-N 3.34Å; F252-G254 PolarHBondContact O-N 3.13Å; F252-F255 PolarHBondContact O-N 2.78Å; F252-L256 HydrophobicContact CD1-CD1 4.48Å; F252-L256 HydrophobicContact CE1-CD1 4.24Å; F252-L256 HydrophobicContact CE1-CD2 4.38Å; F252-L256 HydrophobicContact CE1-CG 4.46Å; F252-L256 PolarHBondContact O-N 2.95Å
253	F	94.1	Very high	92.2	Very high	117 Å²	117	43.5 Å²	43.5	51%	0.513	22%	0.218	S	C	.	.	H	α-helix	trans	-65.8	-35.6	178.5	-77.3	-70.8	0	0	0	112.5	V249 F255 L256 F257	V249-F253 HydrophobicContact CG1-CD2 3.58Å; V249-F253 HydrophobicContact CG1-CE2 3.57Å; V249-F253 VanDerWaalsContact O-CD2 3.3Å; V249-F253 WeakPolarHBondContact O-CD2 2.93Å; V249-F253 PolarHBondContact O-N 3.01Å; F253-F255 PolarHBondContact O-N 3.01Å; F253-L256 HydrophobicContact CD1-CD1 3.79Å; F253-L256 HydrophobicContact CE1-CD1 4.26Å; F253-L256 WeakPolarHBondContact O-CB 3.39Å; F253-L256 PolarHBondContact O-N 3.15Å; F253-F257 WeakPolarHBondContact O-CD2 3.5Å; F253-F257 WeakPolarHBondContact O-CE2 3.26Å
254	G	90.8	Very high	92	Very high	12 Å²	12	42.6 Å²	42.6	12%	0.124	21%	0.211	C	C	.	.	H	α-helix	trans	-59.1	-46.8	174	0	0	0	0	0	112.3	I250 Q251 F252 L256 F257 L258	I250-G254 PolarHBondContact O-N 2.97Å; Q251-G254 PolarHBondContact O-N 3.27Å; F252-G254 VanDerWaalsContact C-N 3.34Å; F252-G254 PolarHBondContact O-N 3.13Å; G254-L256 PolarHBondContact O-N 3.07Å; G254-F257 PolarHBondContact O-N 3.2Å; G254-F257 VanDerWaalsContact O-N 3.1Å; G254-L258 WeakPolarHBondContact O-CG 3.37Å; G254-L258 PolarHBondContact O-N 2.99Å
255	F	91.3	Very high	91.7	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-73.2	-10.8	179.9	-88	-94.6	0	0	0	114.5	F86 S87 R147 I150 L151 Y194 Q251 F252 F253 F257 L258	F86-F255 HydrophobicContact CB-CE2 4.45Å; S87-F255 WeakPolarHBondContact OG-CZ 3.41Å; R147-F255 HydrophobicContact CG-CD1 4.36Å; R147-F255 PolarHBondContact NE-O 2.96Å; I150-F255 HydrophobicContact CB-CD1 4.08Å; I150-F255 HydrophobicContact CB-CE1 4.08Å; I150-F255 HydrophobicContact CB-CG 4.45Å; I150-F255 HydrophobicContact CB-CZ 4.43Å; I150-F255 HydrophobicContact CD1-CD1 4.23Å; I150-F255 HydrophobicContact CD1-CE1 3.4Å; I150-F255 HydrophobicContact CD1-CZ 3.59Å; I150-F255 HydrophobicContact CG1-CE1 4.32Å; I150-F255 HydrophobicContact CG2-CD1 3.81Å; I150-F255 HydrophobicContact CG2-CD2 3.69Å; I150-F255 HydrophobicContact CG2-CE1 3.83Å; I150-F255 HydrophobicContact CG2-CE2 3.7Å; I150-F255 HydrophobicContact CG2-CG 3.74Å; I150-F255 HydrophobicContact CG2-CZ 3.77Å; L151-F255 HydrophobicContact CD2-CB 3.63Å; L151-F255 HydrophobicContact CG-CB 4Å; Y194-F255 HydrophobicContact CD1-CE1 4.07Å; Y194-F255 HydrophobicContact CD1-CZ 4.18Å; Y194-F255 AromaticContact CE1-CE1 3.67Å; Y194-F255 HydrophobicContact CE1-CE1 3.67Å; Y194-F255 AromaticContact CE1-CZ 3.94Å; Y194-F255 HydrophobicContact CE1-CZ 3.94Å; Q251-F255 HydrophobicContact CG-CD2 3.83Å; Q251-F255 HydrophobicContact CG-CE2 4.02Å; Q251-F255 WeakPolarHBondContact O-CD2 3.48Å; Q251-F255 PolarHBondContact O-N 3.24Å; F252-F255 PolarHBondContact O-N 2.78Å; F253-F255 PolarHBondContact O-N 3.01Å; F255-F257 PolarHBondContact O-N 3.27Å; F255-L258 HydrophobicContact CD1-CB 4.4Å; F255-L258 HydrophobicContact CD1-CD1 4.21Å; F255-L258 HydrophobicContact CD2-CD1 3.99Å; F255-L258 HydrophobicContact CE1-CD1 4.18Å; F255-L258 HydrophobicContact CE2-CD1 3.97Å; F255-L258 HydrophobicContact CG-CD1 4.12Å; F255-L258 HydrophobicContact CZ-CD1 4.07Å
256	L	90.9	Very high	91.5	Very high	67 Å²	67	42 Å²	42	35%	0.351	20%	0.203	S	C	.	.	H	α-helix	trans	-66.5	-28.7	167.1	-65.9	-179.4	0	0	0	112	R147 L151 F252 F253 G254	R147-L256 PolarHBondContact NH2-O 2.96Å; L151-L256 HydrophobicContact CD1-CD2 4.3Å; L151-L256 HydrophobicContact CD2-CD2 4.03Å; L151-L256 HydrophobicContact CD2-CG 4.42Å; F252-L256 HydrophobicContact CD1-CD1 4.48Å; F252-L256 HydrophobicContact CE1-CD1 4.24Å; F252-L256 HydrophobicContact CE1-CD2 4.38Å; F252-L256 HydrophobicContact CE1-CG 4.46Å; F252-L256 PolarHBondContact O-N 2.95Å; F253-L256 HydrophobicContact CD1-CD1 3.79Å; F253-L256 HydrophobicContact CE1-CD1 4.26Å; F253-L256 WeakPolarHBondContact O-CB 3.39Å; F253-L256 PolarHBondContact O-N 3.15Å; G254-L256 PolarHBondContact O-N 3.07Å
257	F	89	Confident	91	Very high	178 Å²	178	41.1 Å²	41.1	78%	0.781	20%	0.197	S	C	*	.	H	α-helix	trans	-101.1	-16	-179.4	-56.9	-73.5	0	0	0	113.8	F253 G254 F255	F253-F257 WeakPolarHBondContact O-CD2 3.5Å; F253-F257 WeakPolarHBondContact O-CE2 3.26Å; G254-F257 PolarHBondContact O-N 3.2Å; G254-F257 VanDerWaalsContact O-N 3.1Å; F255-F257 PolarHBondContact O-N 3.27Å
258	L	89.3	Confident	90.6	Very high	14 Å²	14	45.1 Å²	45.1	7%	0.073	21%	0.212	C	C	.	.	S	Bend	trans	-78.2	145.8	179.6	-67.9	171.5	0	0	0	112.3	V83 F86 R147 G254 F255	V83-L258 HydrophobicContact CB-CD2 4.26Å; V83-L258 HydrophobicContact CG1-CD2 4.36Å; V83-L258 HydrophobicContact CG2-CD2 3.58Å; F86-L258 HydrophobicContact CB-CD1 3.87Å; R147-L258 VanDerWaalsContact CD-O 3.27Å; R147-L258 WeakPolarHBondContact CD-O 3.26Å; R147-L258 PolarHBondContact NE-O 3.42Å; G254-L258 WeakPolarHBondContact O-CG 3.37Å; G254-L258 PolarHBondContact O-N 2.99Å; F255-L258 HydrophobicContact CD1-CB 4.4Å; F255-L258 HydrophobicContact CD1-CD1 4.21Å; F255-L258 HydrophobicContact CD2-CD1 3.99Å; F255-L258 HydrophobicContact CE1-CD1 4.18Å; F255-L258 HydrophobicContact CE2-CD1 3.97Å; F255-L258 HydrophobicContact CG-CD1 4.12Å; F255-L258 HydrophobicContact CZ-CD1 4.07Å
259	P	89.8	Confident	90.2	Very high	19 Å²	19	47.5 Å²	47.5	12%	0.123	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-73	169.7	178.4	31	-35.7	0	0	0	112.3	F79 Y194 I277 M281	F79-P259 HydrophobicContact CE1-CG 4.28Å; F79-P259 HydrophobicContact CZ-CG 3.98Å; Y194-P259 PolarHBondContact OH-O 3.4Å; P259-I277 HydrophobicContact CB-CD1 3.83Å; P259-I277 HydrophobicContact CB-CG1 3.94Å; P259-I277 HydrophobicContact CB-CG2 3.78Å; P259-I277 HydrophobicContact CG-CG2 4.04Å; P259-M281 HydrophobicContact CB-CE 4.46Å; P259-M281 HydrophobicContact CG-CE 3.6Å
260	E	92.1	Very high	89.9	Confident	19 Å²	19	48.7 Å²	48.7	9%	0.089	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-84.2	161.4	170.5	-175.7	55.4	-91.7	0	0	110.8	G145 R146 R147 W264 L265	G145-E260 WeakPolarHBondContact CA-OE2 3.4Å; R146-E260 WeakPolarHBondContact CA-OE1 3.46Å; R146-E260 WeakPolarHBondContact CB-OE1 3.37Å; R146-E260 VanDerWaalsContact N-CD 3.33Å; R146-E260 PolarHBondContact N-OE1 3.18Å; R146-E260 PolarHBondContact N-OE2 2.71Å; R146-E260 VanDerWaalsContact N-OE2 3.17Å; R147-E260 HydrophobicContact CB-CB 4.48Å; R147-E260 WeakPolarHBondContact CB-OE2 3.4Å; R147-E260 PolarHBondContact N-OE1 2.66Å; R147-E260 VanDerWaalsContact N-OE1 3.1Å; R147-E260 PolarHBondContact N-OE2 3.49Å; E260-W264 HydrophobicContact CG-CD2 4.23Å; E260-W264 HydrophobicContact CG-CE3 3.46Å; E260-W264 VanDerWaalsContact CG-CE3 3.46Å; E260-W264 HydrophobicContact CG-CZ3 3.89Å; E260-L265 HydrophobicContact CB-CD1 4.43Å; E260-L265 HydrophobicContact CB-CG 4.44Å; E260-L265 HydrophobicContact CG-CG 4.4Å
261	S	90.3	Very high	89.5	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-55.9	128.3	176.8	169.6	0	0	0	0	112.7	E197 R263 W264 L265	E197-S261 WeakPolarHBondContact CB-OG 3.29Å; E197-S261 WeakPolarHBondContact OE2-CB 3.29Å; E197-S261 PolarHBondContact OE2-OG 3.48Å; S261-R263 VanDerWaalsContact C-N 3.27Å; S261-R263 PolarHBondContact O-N 2.96Å; S261-R263 PolarHBondContact OG-N 3.42Å; S261-W264 PolarHBondContact O-N 2.88Å; S261-L265 WeakPolarHBondContact O-CG 3.45Å; S261-L265 PolarHBondContact O-N 2.95Å; S261-L265 VanDerWaalsContact O-N 3.1Å
262	P	88	Confident	89.1	Confident	1 Å²	1	55.5 Å²	55.5	1%	0.006	27%	0.274	C	S	.	.	H	α-helix	trans	-57.4	-39.6	174.8	-23.3	32.3	0	0	0	112.7	W264 L265 I266 I277 L278 M281	P262-W264 PolarHBondContact O-N 3.23Å; P262-L265 PolarHBondContact O-N 3.2Å; P262-I266 VanDerWaalsContact O-CG1 3.31Å; P262-I266 WeakPolarHBondContact O-CG1 3.33Å; P262-I266 PolarHBondContact O-N 3.12Å; P262-I277 HydrophobicContact CG-CG2 4.1Å; P262-L278 HydrophobicContact CB-CB 4.41Å; P262-L278 HydrophobicContact CB-CD1 4.14Å; P262-L278 HydrophobicContact CG-CD1 4.14Å; P262-M281 HydrophobicContact CG-CE 4.27Å; P262-M281 HydrophobicContact CG-SD 3.72Å
263	R	87.1	Confident	88.8	Confident	84 Å²	84	58.6 Å²	58.6	32%	0.317	29%	0.287	S	S	.	.	H	α-helix	trans	-61.3	-45	179.4	-175.5	178.1	178.1	172.7	0.7	111.4	E197 S261 I266 Q267 I294 I298 E301	E197-R263 HydrophobicContact CG-CB 4.27Å; S261-R263 VanDerWaalsContact C-N 3.27Å; S261-R263 PolarHBondContact O-N 2.96Å; S261-R263 PolarHBondContact OG-N 3.42Å; R263-I266 PolarHBondContact O-N 3.23Å; R263-Q267 PolarHBondContact O-N 3.15Å; R263-I294 HydrophobicContact CB-CG2 4.28Å; R263-I294 HydrophobicContact CG-CG2 3.99Å; R263-I298 HydrophobicContact CG-CD1 4.16Å; R263-E301 IonicContact CZ-OE1 3.25Å; R263-E301 IonicContact NH2-OE1 2.76Å; R263-E301 PolarHBondContact NH2-OE1 3.35Å; R263-E301 IonicContact NH2-OE2 3.63Å; R263-E301 PolarHBondContact NH2-OE2 2.76Å
264	W	88.3	Confident	88.5	Confident	31 Å²	31	53 Å²	53	12%	0.117	26%	0.263	C	S	.	.	H	α-helix	trans	-67.1	-38.2	178.1	-177.8	82.4	0	0	0	112.4	G142 G145 R146 E260 S261 P262 I266 Q267 K268	G142-W264 PolarHBondContact O-NE1 3.41Å; G145-W264 VanDerWaalsContact CA-CE2 3.49Å; R146-W264 VanDerWaalsContact NH1-CD1 3.25Å; E260-W264 HydrophobicContact CG-CD2 4.23Å; E260-W264 HydrophobicContact CG-CE3 3.46Å; E260-W264 VanDerWaalsContact CG-CE3 3.46Å; E260-W264 HydrophobicContact CG-CZ3 3.89Å; S261-W264 PolarHBondContact O-N 2.88Å; P262-W264 PolarHBondContact O-N 3.23Å; W264-I266 VanDerWaalsContact C-N 3.33Å; W264-I266 PolarHBondContact O-N 3.48Å; W264-Q267 WeakPolarHBondContact O-CB 3.03Å; W264-Q267 PolarHBondContact O-N 2.69Å; W264-K268 HydrophobicContact CD2-CG 4.05Å; W264-K268 HydrophobicContact CE3-CG 4.27Å; W264-K268 HydrophobicContact CH2-CG 3.97Å; W264-K268 HydrophobicContact CZ2-CD 4.22Å; W264-K268 HydrophobicContact CZ2-CG 3.7Å; W264-K268 HydrophobicContact CZ3-CG 4.23Å; W264-K268 PolarHBondContact O-N 3.41Å
265	L	88.6	Confident	88.3	Confident	7 Å²	7	57.5 Å²	57.5	4%	0.037	28%	0.276	C	S	.	.	H	α-helix	trans	-64	-37.9	176.7	-70.3	169.5	0	0	0	112.4	E260 S261 P262 K268 G269 Q270 A274 I277	E260-L265 HydrophobicContact CB-CD1 4.43Å; E260-L265 HydrophobicContact CB-CG 4.44Å; E260-L265 HydrophobicContact CG-CG 4.4Å; S261-L265 WeakPolarHBondContact O-CG 3.45Å; S261-L265 PolarHBondContact O-N 2.95Å; S261-L265 VanDerWaalsContact O-N 3.1Å; P262-L265 PolarHBondContact O-N 3.2Å; L265-K268 PolarHBondContact O-N 3.21Å; L265-G269 PolarHBondContact O-N 3.07Å; L265-Q270 HydrophobicContact CD2-CB 4.3Å; L265-Q270 PolarHBondContact O-N 3.46Å; L265-A274 HydrophobicContact CB-CB 3.82Å; L265-I277 HydrophobicContact CD1-CD1 3.39Å
266	I	88.9	Confident	88.1	Confident	14 Å²	14	65.9 Å²	65.9	7%	0.072	31%	0.307	C	S	.	.	H	α-helix	trans	-64.9	-45.4	173.5	-65.5	167.7	0	0	0	110	P262 R263 W264 K268 G269 A274 Y291 I294 K295 I298	P262-I266 VanDerWaalsContact O-CG1 3.31Å; P262-I266 WeakPolarHBondContact O-CG1 3.33Å; P262-I266 PolarHBondContact O-N 3.12Å; R263-I266 PolarHBondContact O-N 3.23Å; W264-I266 VanDerWaalsContact C-N 3.33Å; W264-I266 PolarHBondContact O-N 3.48Å; I266-K268 VanDerWaalsContact C-N 3.26Å; I266-K268 PolarHBondContact O-N 3.26Å; I266-G269 PolarHBondContact O-N 3.49Å; I266-A274 HydrophobicContact CD1-CB 4.41Å; I266-A274 HydrophobicContact CG1-CB 3.62Å; I266-Y291 HydrophobicContact CD1-CD2 3.69Å; I266-Y291 HydrophobicContact CD1-CE2 3.79Å; I266-Y291 HydrophobicContact CD1-CG 4.49Å; I266-Y291 HydrophobicContact CG1-CD2 4.13Å; I266-Y291 HydrophobicContact CG1-CE2 3.68Å; I266-I294 HydrophobicContact CD1-CB 4.04Å; I266-I294 HydrophobicContact CD1-CG2 3.69Å; I266-K295 HydrophobicContact CG2-CB 4.07Å; I266-K295 HydrophobicContact CG2-CG 4.26Å; I266-I298 HydrophobicContact CB-CD1 4.15Å; I266-I298 HydrophobicContact CG2-CD1 3.86Å
267	Q	84.3	Confident	87.9	Confident	79 Å²	79	63.8 Å²	63.8	37%	0.369	30%	0.296	S	S	.	.	H	α-helix	trans	-58.7	-36	177.1	-170.4	179.5	26.6	0	0	112.7	R263 W264 G269 I298	R263-Q267 PolarHBondContact O-N 3.15Å; W264-Q267 WeakPolarHBondContact O-CB 3.03Å; W264-Q267 PolarHBondContact O-N 2.69Å; Q267-G269 VanDerWaalsContact C-N 3.25Å; Q267-G269 PolarHBondContact O-N 2.97Å; Q267-I298 HydrophobicContact CB-CD1 4.18Å; Q267-I298 HydrophobicContact CB-CG2 4.4Å; Q267-I298 HydrophobicContact CG-CG2 4.16Å
268	K	86.8	Confident	87.7	Confident	102 Å²	102	55.3 Å²	55.3	44%	0.443	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	4.3	175.4	-66.7	-63.6	-175.6	-174.7	0	114.1	G142 W264 L265 I266 Q270	G142-K268 PolarHBondContact O-NZ 2.99Å; W264-K268 HydrophobicContact CD2-CG 4.05Å; W264-K268 HydrophobicContact CE3-CG 4.27Å; W264-K268 HydrophobicContact CH2-CG 3.97Å; W264-K268 HydrophobicContact CZ2-CD 4.22Å; W264-K268 HydrophobicContact CZ2-CG 3.7Å; W264-K268 HydrophobicContact CZ3-CG 4.23Å; W264-K268 PolarHBondContact O-N 3.41Å; L265-K268 PolarHBondContact O-N 3.21Å; I266-K268 VanDerWaalsContact C-N 3.26Å; I266-K268 PolarHBondContact O-N 3.26Å; K268-Q270 VanDerWaalsContact C-N 3.28Å; K268-Q270 PolarHBondContact O-N 3.36Å
269	G	85.7	Confident	87.4	Confident	51 Å²	51	56.9 Å²	56.9	53%	0.526	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.8	11.4	-179.2	0	0	0	0	0	115	L265 I266 Q267 T271	L265-G269 PolarHBondContact O-N 3.07Å; I266-G269 PolarHBondContact O-N 3.49Å; Q267-G269 VanDerWaalsContact C-N 3.25Å; Q267-G269 PolarHBondContact O-N 2.97Å; G269-T271 PolarHBondContact O-N 3.33Å
270	Q	88.9	Confident	87	Confident	76 Å²	76	60.7 Å²	60.7	36%	0.355	29%	0.287	S	S	.	.			trans	-84.3	61.5	179.5	-62.4	-170.5	16.3	0	0	111.8	L265 K268 Q272 K273 A274	L265-Q270 HydrophobicContact CD2-CB 4.3Å; L265-Q270 PolarHBondContact O-N 3.46Å; K268-Q270 VanDerWaalsContact C-N 3.28Å; K268-Q270 PolarHBondContact O-N 3.36Å; Q270-Q272 PolarHBondContact O-N 2.97Å; Q270-K273 PolarHBondContact O-N 3.33Å; Q270-A274 PolarHBondContact O-N 3.04Å
271	T	85.9	Confident	86.5	Confident	64 Å²	64	59.8 Å²	59.8	39%	0.393	28%	0.283	S	S	.	.	H	α-helix	trans	-58.2	-43.3	-169.6	60.8	0	0	0	0	114.3	G269 A274 R275 Y291	G269-T271 PolarHBondContact O-N 3.33Å; T271-A274 PolarHBondContact O-N 3.42Å; T271-R275 WeakPolarHBondContact O-CG 3.42Å; T271-R275 PolarHBondContact O-N 3.17Å; T271-Y291 WeakPolarHBondContact CB-OH 3.3Å; T271-Y291 WeakPolarHBondContact CG2-OH 3.47Å
272	Q	87.3	Confident	86.1	Confident	167 Å²	167	60.2 Å²	60.2	78%	0.78	29%	0.285	S	S	*	.	H	α-helix	trans	-66	-42.1	-179.8	-72.2	-170.8	-14.9	0	0	112.9	Q270 R276	Q270-Q272 PolarHBondContact O-N 2.97Å; Q272-R276 PolarHBondContact O-N 3Å; Q272-R276 VanDerWaalsContact O-N 3.16Å
273	K	87.9	Confident	85.5	Confident	128 Å²	128	61.8 Å²	61.8	56%	0.557	30%	0.301	S	S	*	.	H	α-helix	trans	-68.8	-40.7	177.5	-72	-175.1	-171.5	169.2	0	111.2	Q270 R276 I277	Q270-K273 PolarHBondContact O-N 3.33Å; K273-R276 PolarHBondContact O-N 2.97Å; K273-I277 PolarHBondContact O-N 3.31Å
274	A	86.8	Confident	84.4	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-57.9	-48.4	175.7	0	0	0	0	0	111.5	L265 I266 Q270 T271 R276 I277 L278 Y291	L265-A274 HydrophobicContact CB-CB 3.82Å; I266-A274 HydrophobicContact CD1-CB 4.41Å; I266-A274 HydrophobicContact CG1-CB 3.62Å; Q270-A274 PolarHBondContact O-N 3.04Å; T271-A274 PolarHBondContact O-N 3.42Å; A274-R276 PolarHBondContact O-N 3.43Å; A274-I277 PolarHBondContact O-N 3.17Å; A274-L278 WeakPolarHBondContact O-CB 3.5Å; A274-L278 PolarHBondContact O-N 2.85Å; A274-Y291 HydrophobicContact CB-CE2 4.25Å
275	R	86.6	Confident	83.4	Confident	107 Å²	107	67.4 Å²	67.4	40%	0.404	34%	0.337	S	S	.	.	H	α-helix	trans	-59.9	-42	177	-76	-178.1	176.1	-128	-6.5	112.7	T271 S279 D288 Y291	T271-R275 WeakPolarHBondContact O-CG 3.42Å; T271-R275 PolarHBondContact O-N 3.17Å; R275-S279 WeakPolarHBondContact O-CB 3.29Å; R275-S279 PolarHBondContact O-N 2.94Å; R275-S279 PolarHBondContact O-OG 2.97Å; R275-D288 IonicContact CZ-OD1 3.34Å; R275-D288 VanDerWaalsContact CZ-OD1 3.24Å; R275-D288 IonicContact NH1-OD1 2.73Å; R275-D288 PolarHBondContact NH1-OD1 2.96Å; R275-D288 IonicContact NH2-OD1 3.99Å; R275-D288 PolarHBondContact NH2-OD1 3.46Å; R275-Y291 HydrophobicContact CG-CD2 3.84Å; R275-Y291 HydrophobicContact CG-CE2 3.91Å; R275-Y291 HydrophobicContact CG-CG 4.44Å
276	R	86.9	Confident	82.4	Confident	175 Å²	175	72.5 Å²	72.5	66%	0.66	37%	0.369	S	S	*	.	H	α-helix	trans	-65	-42.3	178.1	-175.4	177.9	-179.5	171.3	1.7	112.8	Q272 K273 A274 S279 Q280	Q272-R276 PolarHBondContact O-N 3Å; Q272-R276 VanDerWaalsContact O-N 3.16Å; K273-R276 PolarHBondContact O-N 2.97Å; A274-R276 PolarHBondContact O-N 3.43Å; R276-S279 PolarHBondContact O-OG 3.05Å; R276-Q280 VanDerWaalsContact O-CG 3.3Å; R276-Q280 WeakPolarHBondContact O-CG 3.22Å; R276-Q280 PolarHBondContact O-N 3.35Å; R276-Q280 VanDerWaalsContact O-N 3.12Å
277	I	86.8	Confident	82.1	Confident	23 Å²	23	73.1 Å²	73.1	12%	0.118	37%	0.372	C	S	.	.	H	α-helix	trans	-72.3	-41.2	179.6	-71.2	165	0	0	0	110.2	P259 P262 L265 K273 A274 S279 Q280 M281	P259-I277 HydrophobicContact CB-CD1 3.83Å; P259-I277 HydrophobicContact CB-CG1 3.94Å; P259-I277 HydrophobicContact CB-CG2 3.78Å; P259-I277 HydrophobicContact CG-CG2 4.04Å; P262-I277 HydrophobicContact CG-CG2 4.1Å; L265-I277 HydrophobicContact CD1-CD1 3.39Å; K273-I277 PolarHBondContact O-N 3.31Å; A274-I277 PolarHBondContact O-N 3.17Å; I277-S279 VanDerWaalsContact C-N 3.31Å; I277-S279 PolarHBondContact O-N 2.94Å; I277-Q280 WeakPolarHBondContact O-CB 3.35Å; I277-Q280 PolarHBondContact O-N 3.4Å; I277-M281 HydrophobicContact CG2-CE 3.37Å; I277-M281 HydrophobicContact CG2-CG 4.48Å; I277-M281 HydrophobicContact CG2-SD 3.94Å; I277-M281 WeakPolarHBondContact O-CG 3.29Å; I277-M281 PolarHBondContact O-N 3.33Å
278	L	85.1	Confident	82	Confident	1 Å²	1	73.4 Å²	73.4	1%	0.005	38%	0.376	C	S	.	.	H	α-helix	trans	-64.5	-37	177.7	-165.9	58.9	0	0	0	111.2	P262 A274 M281 R282 I287	P262-L278 HydrophobicContact CB-CB 4.41Å; P262-L278 HydrophobicContact CB-CD1 4.14Å; P262-L278 HydrophobicContact CG-CD1 4.14Å; A274-L278 WeakPolarHBondContact O-CB 3.5Å; A274-L278 PolarHBondContact O-N 2.85Å; L278-M281 PolarHBondContact O-N 3.39Å; L278-R282 HydrophobicContact CD1-CG 4.17Å; L278-R282 HydrophobicContact CG-CG 4.44Å; L278-R282 WeakPolarHBondContact O-CB 3.31Å; L278-R282 WeakPolarHBondContact O-CG 3.25Å; L278-R282 PolarHBondContact O-N 3.18Å; L278-I287 HydrophobicContact CB-CG2 3.86Å; L278-I287 HydrophobicContact CD2-CG2 3.28Å; L278-I287 HydrophobicContact CG-CG2 3.42Å; L278-I287 VanDerWaalsContact CG-CG2 3.42Å
279	S	84.1	Confident	81.7	Confident	46 Å²	46	75.9 Å²	75.9	32%	0.322	39%	0.39	S	S	.	.	H	α-helix	trans	-66.6	-39.4	172.7	75.6	0	0	0	0	113.4	R275 R276 I277 M281 G283 I287	R275-S279 WeakPolarHBondContact O-CB 3.29Å; R275-S279 PolarHBondContact O-N 2.94Å; R275-S279 PolarHBondContact O-OG 2.97Å; R276-S279 PolarHBondContact O-OG 3.05Å; I277-S279 VanDerWaalsContact C-N 3.31Å; I277-S279 PolarHBondContact O-N 2.94Å; S279-M281 VanDerWaalsContact C-N 3.29Å; S279-M281 PolarHBondContact O-N 3.2Å; S279-G283 WeakPolarHBondContact O-CA 3.38Å; S279-G283 PolarHBondContact O-N 3.49Å; S279-I287 VanDerWaalsContact CA-CD1 3.41Å; S279-I287 VanDerWaalsContact CB-CD1 3.44Å
280	Q	81.4	Confident	81.5	Confident	99 Å²	99	75.4 Å²	75.4	46%	0.463	37%	0.373	S	S	.	.	H	α-helix	trans	-62.8	-35.4	173.3	-74.5	177	-32.4	0	0	112.6	R276 I277	R276-Q280 VanDerWaalsContact O-CG 3.3Å; R276-Q280 WeakPolarHBondContact O-CG 3.22Å; R276-Q280 PolarHBondContact O-N 3.35Å; R276-Q280 VanDerWaalsContact O-N 3.12Å; I277-Q280 WeakPolarHBondContact O-CB 3.35Å; I277-Q280 PolarHBondContact O-N 3.4Å
281	M	81.3	Confident	81.3	Confident	1 Å²	1	72.3 Å²	72.3	1%	0.005	36%	0.359	C	S	.	.	H	α-helix	trans	-81.4	-30.8	-179.4	-69.5	174.2	-179.5	0	0	113.7	P77 F79 V80 V198 P259 P262 I277 L278 S279	P77-M281 WeakPolarHBondContact CD-O 3.34Å; P77-M281 WeakPolarHBondContact CG-O 3.25Å; F79-M281 HydrophobicContact CD1-CG 4.3Å; F79-M281 HydrophobicContact CE1-CG 4.05Å; V80-M281 VanDerWaalsContact CG2-O 3.24Å; V80-M281 WeakPolarHBondContact CG2-O 3.3Å; V198-M281 HydrophobicContact CB-CE 4.32Å; V198-M281 HydrophobicContact CB-SD 4.22Å; V198-M281 HydrophobicContact CG1-CE 3.82Å; V198-M281 HydrophobicContact CG1-CG 4.37Å; V198-M281 HydrophobicContact CG1-SD 3.69Å; V198-M281 HydrophobicContact CG2-CE 3.74Å; V198-M281 HydrophobicContact CG2-SD 4.16Å; P259-M281 HydrophobicContact CB-CE 4.46Å; P259-M281 HydrophobicContact CG-CE 3.6Å; P262-M281 HydrophobicContact CG-CE 4.27Å; P262-M281 HydrophobicContact CG-SD 3.72Å; I277-M281 HydrophobicContact CG2-CE 3.37Å; I277-M281 HydrophobicContact CG2-CG 4.48Å; I277-M281 HydrophobicContact CG2-SD 3.94Å; I277-M281 WeakPolarHBondContact O-CG 3.29Å; I277-M281 PolarHBondContact O-N 3.33Å; L278-M281 PolarHBondContact O-N 3.39Å; S279-M281 VanDerWaalsContact C-N 3.29Å; S279-M281 PolarHBondContact O-N 3.2Å
282	R	81.1	Confident	81.4	Confident	9 Å²	9	72.8 Å²	72.8	3%	0.034	36%	0.359	C	S	.	.	H	α-helix	trans	-98.5	-12	-177.9	-64.2	-67	-179	-105.3	-3.4	113.9	V198 S199 P200 L278 N284 Q285 I287 E290	V198-R282 PolarHBondContact O-NH1 3.02Å; S199-R282 PolarHBondContact O-NH2 3.46Å; P200-R282 VanDerWaalsContact CA-NH1 3.29Å; P200-R282 VanDerWaalsContact N-NH1 3.14Å; L278-R282 HydrophobicContact CD1-CG 4.17Å; L278-R282 HydrophobicContact CG-CG 4.44Å; L278-R282 WeakPolarHBondContact O-CB 3.31Å; L278-R282 WeakPolarHBondContact O-CG 3.25Å; L278-R282 PolarHBondContact O-N 3.18Å; R282-N284 PolarHBondContact O-N 2.99Å; R282-Q285 HydrophobicContact CB-CB 4.34Å; R282-I287 HydrophobicContact CB-CG1 4.09Å; R282-E290 IonicContact CZ-OE1 2.64Å; R282-E290 IonicContact CZ-OE2 3.83Å; R282-E290 IonicContact NE-OE1 3.49Å; R282-E290 PolarHBondContact NE-OE1 3Å; R282-E290 IonicContact NE-OE2 2.99Å; R282-E290 PolarHBondContact NE-OE2 3.48Å; R282-E290 IonicContact NH2-OE1 3.6Å; R282-E290 PolarHBondContact NH2-OE1 2.97Å; R282-E290 IonicContact NH2-OE2 2.78Å
283	G	75.7	Confident	81.2	Confident	33 Å²	33	67.8 Å²	67.8	34%	0.34	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.7	-122.2	180	0	0	0	0	0	111.7	S279	S279-G283 WeakPolarHBondContact O-CA 3.38Å; S279-G283 PolarHBondContact O-N 3.49Å
284	N	63.7	Low	81	Confident	171 Å²	171	63.1 Å²	63.1	91%	0.914	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	2.8	-174.4	-76.6	-8.4	0	0	0	114.7	R282	R282-N284 PolarHBondContact O-N 2.99Å
285	Q	67.2	Low	81	Confident	62 Å²	62	67 Å²	67	29%	0.29	34%	0.34	S	S	.	.	S	Bend	trans	-71.8	148	179.2	-69.4	-178.9	-23.5	0	0	112	D74 R282 I287	D74-Q285 HydrophobicContact CB-CG 4.46Å; D74-Q285 VanDerWaalsContact CG-NE2 3.25Å; D74-Q285 PolarHBondContact OD2-NE2 3.13Å; R282-Q285 HydrophobicContact CB-CB 4.34Å; Q285-I287 VanDerWaalsContact O-CD1 3.26Å; Q285-I287 WeakPolarHBondContact O-CD1 3.37Å; Q285-I287 WeakPolarHBondContact O-CG1 3.35Å; Q285-I287 PolarHBondContact O-N 3.35Å; Q285-I287 VanDerWaalsContact O-N 3.09Å
286	T	68.4	Low	80.9	Confident	114 Å²	114	65.9 Å²	65.9	70%	0.699	34%	0.342	S	S	*	.			trans	-66.4	105.6	172	41.5	0	0	0	0	110.3
287	I	81.7	Confident	80.6	Confident	28 Å²	28	61.3 Å²	61.3	14%	0.144	33%	0.331	C	S	.	.			trans	-82.8	-19.6	-172.7	-64.7	125.1	0	0	0	113.2	L278 S279 R282 Q285 E289 E290 Y291	L278-I287 HydrophobicContact CB-CG2 3.86Å; L278-I287 HydrophobicContact CD2-CG2 3.28Å; L278-I287 HydrophobicContact CG-CG2 3.42Å; L278-I287 VanDerWaalsContact CG-CG2 3.42Å; S279-I287 VanDerWaalsContact CA-CD1 3.41Å; S279-I287 VanDerWaalsContact CB-CD1 3.44Å; R282-I287 HydrophobicContact CB-CG1 4.09Å; Q285-I287 VanDerWaalsContact O-CD1 3.26Å; Q285-I287 WeakPolarHBondContact O-CD1 3.37Å; Q285-I287 WeakPolarHBondContact O-CG1 3.35Å; Q285-I287 PolarHBondContact O-N 3.35Å; Q285-I287 VanDerWaalsContact O-N 3.09Å; I287-E289 VanDerWaalsContact C-N 3.34Å; I287-E289 PolarHBondContact O-N 3.35Å; I287-E290 PolarHBondContact O-N 2.86Å; I287-Y291 WeakPolarHBondContact O-CB 3.4Å; I287-Y291 PolarHBondContact O-N 2.88Å
288	D	82.6	Confident	80.3	Confident	84 Å²	84	60.6 Å²	60.6	45%	0.449	33%	0.327	S	S	.	.	H	α-helix	trans	-60.9	-40	-172.5	-69.5	-58	0	0	0	112.5	R275 Y291 D292	R275-D288 IonicContact CZ-OD1 3.34Å; R275-D288 VanDerWaalsContact CZ-OD1 3.24Å; R275-D288 IonicContact NH1-OD1 2.73Å; R275-D288 PolarHBondContact NH1-OD1 2.96Å; R275-D288 IonicContact NH2-OD1 3.99Å; R275-D288 PolarHBondContact NH2-OD1 3.46Å; D288-Y291 PolarHBondContact O-N 3.42Å; D288-D292 WeakPolarHBondContact O-CB 3.39Å; D288-D292 PolarHBondContact O-N 2.64Å
289	E	81.1	Confident	80.1	Confident	155 Å²	155	64 Å²	64	72%	0.724	34%	0.343	S	S	*	.	H	α-helix	trans	-63.3	-43.9	177.1	-65.4	-176.4	173.1	0	0	112.5	I287 S293	I287-E289 VanDerWaalsContact C-N 3.34Å; I287-E289 PolarHBondContact O-N 3.35Å; E289-S293 VanDerWaalsContact O-CB 3.29Å; E289-S293 WeakPolarHBondContact O-CB 3.32Å; E289-S293 PolarHBondContact O-N 3.47Å
290	E	80.8	Confident	79.7	Confident	40 Å²	40	67.4 Å²	67.4	19%	0.187	35%	0.354	C	S	.	.	H	α-helix	trans	-68.2	-40.5	177.6	-174.6	175.2	-168.8	0	0	110.9	R282 I287 S293 I294	R282-E290 IonicContact CZ-OE1 2.64Å; R282-E290 IonicContact CZ-OE2 3.83Å; R282-E290 IonicContact NE-OE1 3.49Å; R282-E290 PolarHBondContact NE-OE1 3Å; R282-E290 IonicContact NE-OE2 2.99Å; R282-E290 PolarHBondContact NE-OE2 3.48Å; R282-E290 IonicContact NH2-OE1 3.6Å; R282-E290 PolarHBondContact NH2-OE1 2.97Å; R282-E290 IonicContact NH2-OE2 2.78Å; I287-E290 PolarHBondContact O-N 2.86Å; E290-S293 PolarHBondContact O-N 2.97Å; E290-I294 HydrophobicContact CG-CD1 3.92Å; E290-I294 HydrophobicContact CG-CG1 4.49Å; E290-I294 VanDerWaalsContact O-CG1 3.25Å; E290-I294 WeakPolarHBondContact O-CG1 3.37Å; E290-I294 PolarHBondContact O-N 3.37Å
291	Y	85.9	Confident	79.3	Confident	12 Å²	12	66.9 Å²	66.9	5%	0.047	35%	0.351	C	S	.	.	H	α-helix	trans	-60.4	-49.5	176.7	177.1	-86.4	0	0	0	111.6	I266 T271 A274 R275 I287 D288 S293 I294 K295	I266-Y291 HydrophobicContact CD1-CD2 3.69Å; I266-Y291 HydrophobicContact CD1-CE2 3.79Å; I266-Y291 HydrophobicContact CD1-CG 4.49Å; I266-Y291 HydrophobicContact CG1-CD2 4.13Å; I266-Y291 HydrophobicContact CG1-CE2 3.68Å; T271-Y291 WeakPolarHBondContact CB-OH 3.3Å; T271-Y291 WeakPolarHBondContact CG2-OH 3.47Å; A274-Y291 HydrophobicContact CB-CE2 4.25Å; R275-Y291 HydrophobicContact CG-CD2 3.84Å; R275-Y291 HydrophobicContact CG-CE2 3.91Å; R275-Y291 HydrophobicContact CG-CG 4.44Å; I287-Y291 WeakPolarHBondContact O-CB 3.4Å; I287-Y291 PolarHBondContact O-N 2.88Å; D288-Y291 PolarHBondContact O-N 3.42Å; Y291-S293 VanDerWaalsContact C-N 3.35Å; Y291-I294 PolarHBondContact O-N 3.22Å; Y291-K295 HydrophobicContact CE1-CD 4.35Å; Y291-K295 WeakPolarHBondContact O-CB 3.38Å; Y291-K295 PolarHBondContact O-N 3.01Å
292	D	86.3	Confident	78.8	Confident	74 Å²	74	72.4 Å²	72.4	40%	0.396	38%	0.377	S	S	.	.	H	α-helix	trans	-67.3	-37.6	-179.8	-72.3	-22.4	0	0	0	111.1	D288 K295 N296	D288-D292 WeakPolarHBondContact O-CB 3.39Å; D288-D292 PolarHBondContact O-N 2.64Å; D292-K295 PolarHBondContact O-N 3.06Å; D292-N296 WeakPolarHBondContact O-CB 3.42Å; D292-N296 PolarHBondContact O-N 3.43Å; D292-N296 PolarHBondContact O-ND2 2.96Å
293	S	84.1	Confident	78.2	Confident	62 Å²	62	78.6 Å²	78.6	43%	0.434	40%	0.404	S	S	.	.	H	α-helix	trans	-60.1	-48	172.8	-178.9	0	0	0	0	112.2	E289 E290 Y291 K295 N296 N297	E289-S293 VanDerWaalsContact O-CB 3.29Å; E289-S293 WeakPolarHBondContact O-CB 3.32Å; E289-S293 PolarHBondContact O-N 3.47Å; E290-S293 PolarHBondContact O-N 2.97Å; Y291-S293 VanDerWaalsContact C-N 3.35Å; S293-K295 VanDerWaalsContact C-N 3.33Å; S293-K295 PolarHBondContact O-N 3.03Å; S293-N296 PolarHBondContact O-N 2.85Å; S293-N297 PolarHBondContact O-N 2.77Å; S293-N297 PolarHBondContact O-ND2 3.35Å
294	I	83.3	Confident	77.6	Confident	30 Å²	30	81.5 Å²	81.5	15%	0.154	41%	0.409	C	S	.	.	H	α-helix	trans	-62.6	-42.3	178.1	-67.5	165.4	0	0	0	110.7	R263 I266 E290 Y291 N297 I298	R263-I294 HydrophobicContact CB-CG2 4.28Å; R263-I294 HydrophobicContact CG-CG2 3.99Å; I266-I294 HydrophobicContact CD1-CB 4.04Å; I266-I294 HydrophobicContact CD1-CG2 3.69Å; E290-I294 HydrophobicContact CG-CD1 3.92Å; E290-I294 HydrophobicContact CG-CG1 4.49Å; E290-I294 VanDerWaalsContact O-CG1 3.25Å; E290-I294 WeakPolarHBondContact O-CG1 3.37Å; E290-I294 PolarHBondContact O-N 3.37Å; Y291-I294 PolarHBondContact O-N 3.22Å; I294-N297 PolarHBondContact O-N 2.93Å; I294-I298 HydrophobicContact CG2-CD1 3.84Å; I294-I298 VanDerWaalsContact O-CG1 3.32Å; I294-I298 WeakPolarHBondContact O-CG1 3.24Å; I294-I298 PolarHBondContact O-N 3.25Å; I294-I298 VanDerWaalsContact O-N 3.13Å
295	K	86.7	Confident	77.5	Confident	82 Å²	82	78.5 Å²	78.5	36%	0.357	40%	0.397	S	S	.	.	H	α-helix	trans	-62.7	-48.2	179	-172.8	-174.3	175.8	-151.1	0	111.7	I266 Y291 D292 S293 N297 I298 E299	I266-K295 HydrophobicContact CG2-CB 4.07Å; I266-K295 HydrophobicContact CG2-CG 4.26Å; Y291-K295 HydrophobicContact CE1-CD 4.35Å; Y291-K295 WeakPolarHBondContact O-CB 3.38Å; Y291-K295 PolarHBondContact O-N 3.01Å; D292-K295 PolarHBondContact O-N 3.06Å; S293-K295 VanDerWaalsContact C-N 3.33Å; S293-K295 PolarHBondContact O-N 3.03Å; K295-N297 VanDerWaalsContact C-N 3.34Å; K295-N297 PolarHBondContact O-N 3.43Å; K295-I298 PolarHBondContact O-N 3.26Å; K295-E299 WeakPolarHBondContact CE-OE1 3.27Å; K295-E299 IonicContact NZ-OE1 2.85Å; K295-E299 PolarHBondContact O-N 2.96Å
296	N	84.4	Confident	76.9	Confident	83 Å²	83	79 Å²	79	44%	0.444	42%	0.419	S	S	.	.	H	α-helix	trans	-60.9	-42.9	178.9	-68.1	-16.8	0	0	0	111.4	D292 S293 I298 E299 E300	D292-N296 WeakPolarHBondContact O-CB 3.42Å; D292-N296 PolarHBondContact O-N 3.43Å; D292-N296 PolarHBondContact O-ND2 2.96Å; S293-N296 PolarHBondContact O-N 2.85Å; N296-I298 VanDerWaalsContact C-N 3.32Å; N296-I298 PolarHBondContact O-N 3.41Å; N296-E299 PolarHBondContact O-N 3.4Å; N296-E300 WeakPolarHBondContact O-CG 3.27Å; N296-E300 PolarHBondContact O-N 3.31Å
297	N	80.6	Confident	76.2	Confident	78 Å²	78	78.6 Å²	78.6	42%	0.417	42%	0.42	S	S	.	.	H	α-helix	trans	-60.1	-39.3	176.4	-71.1	-34.3	0	0	0	112.5	S293 I294 K295 E301	S293-N297 PolarHBondContact O-N 2.77Å; S293-N297 PolarHBondContact O-ND2 3.35Å; I294-N297 PolarHBondContact O-N 2.93Å; K295-N297 VanDerWaalsContact C-N 3.34Å; K295-N297 PolarHBondContact O-N 3.43Å; N297-E301 WeakPolarHBondContact O-CG 3.46Å; N297-E301 PolarHBondContact O-N 3.5Å
298	I	80.8	Confident	74.8	Confident	9 Å²	9	79.4 Å²	79.4	5%	0.046	43%	0.431	C	S	.	.	H	α-helix	trans	-68.8	-43.1	177.7	-67.3	163.4	0	0	0	110.7	R263 I266 Q267 I294 K295 N296 E300 E301 E302	R263-I298 HydrophobicContact CG-CD1 4.16Å; I266-I298 HydrophobicContact CB-CD1 4.15Å; I266-I298 HydrophobicContact CG2-CD1 3.86Å; Q267-I298 HydrophobicContact CB-CD1 4.18Å; Q267-I298 HydrophobicContact CB-CG2 4.4Å; Q267-I298 HydrophobicContact CG-CG2 4.16Å; I294-I298 HydrophobicContact CG2-CD1 3.84Å; I294-I298 VanDerWaalsContact O-CG1 3.32Å; I294-I298 WeakPolarHBondContact O-CG1 3.24Å; I294-I298 PolarHBondContact O-N 3.25Å; I294-I298 VanDerWaalsContact O-N 3.13Å; K295-I298 PolarHBondContact O-N 3.26Å; N296-I298 VanDerWaalsContact C-N 3.32Å; N296-I298 PolarHBondContact O-N 3.41Å; I298-E300 VanDerWaalsContact C-N 3.27Å; I298-E300 PolarHBondContact O-N 3.41Å; I298-E301 PolarHBondContact O-N 3.2Å; I298-E302 PolarHBondContact O-N 2.89Å
299	E	81.9	Confident	74	Confident	73 Å²	73	78 Å²	78	34%	0.341	44%	0.437	S	S	.	.	H	α-helix	trans	-63.9	-33.4	177.6	-71.2	-178	-171.3	0	0	112.2	K295 N296 K303	K295-E299 WeakPolarHBondContact CE-OE1 3.27Å; K295-E299 IonicContact NZ-OE1 2.85Å; K295-E299 PolarHBondContact O-N 2.96Å; N296-E299 PolarHBondContact O-N 3.4Å; E299-K303 WeakPolarHBondContact O-CD 3.23Å; E299-K303 VanDerWaalsContact O-CG 3.23Å; E299-K303 WeakPolarHBondContact O-CG 3.33Å; E299-K303 PolarHBondContact O-N 3.1Å
300	E	75.6	Confident	73.8	Confident	116 Å²	116	74.7 Å²	74.7	54%	0.542	43%	0.429	S	S	.	.	H	α-helix	trans	-69	-46.3	171.8	-73.8	178.2	-178.3	0	0	111.8	N296 I298 E302 K303 E304	N296-E300 WeakPolarHBondContact O-CG 3.27Å; N296-E300 PolarHBondContact O-N 3.31Å; I298-E300 VanDerWaalsContact C-N 3.27Å; I298-E300 PolarHBondContact O-N 3.41Å; E300-E302 VanDerWaalsContact C-N 3.31Å; E300-E302 PolarHBondContact O-N 3.34Å; E300-K303 PolarHBondContact O-N 2.99Å; E300-K303 VanDerWaalsContact O-N 3.17Å; E300-E304 PolarHBondContact O-N 3.15Å
301	E	71.3	Confident	73.7	Confident	89 Å²	89	74.8 Å²	74.8	42%	0.416	43%	0.432	S	S	.	.	H	α-helix	trans	-56.8	-42.2	175.7	-78.2	176.7	171.7	0	0	111.7	R263 N297 I298 E304 V305	R263-E301 IonicContact CZ-OE1 3.25Å; R263-E301 IonicContact NH2-OE1 2.76Å; R263-E301 PolarHBondContact NH2-OE1 3.35Å; R263-E301 IonicContact NH2-OE2 3.63Å; R263-E301 PolarHBondContact NH2-OE2 2.76Å; N297-E301 WeakPolarHBondContact O-CG 3.46Å; N297-E301 PolarHBondContact O-N 3.5Å; I298-E301 PolarHBondContact O-N 3.2Å; E301-E304 PolarHBondContact O-N 2.8Å; E301-V305 WeakPolarHBondContact O-CG2 3.42Å; E301-V305 PolarHBondContact O-N 3.48Å
302	E	71.9	Confident	73.6	Confident	116 Å²	116	77.6 Å²	77.6	54%	0.542	45%	0.447	S	S	.	.	H	α-helix	trans	-67.5	-37	177.9	-74.5	-177.4	172.7	0	0	112.9	I298 E300 G306	I298-E302 PolarHBondContact O-N 2.89Å; E300-E302 VanDerWaalsContact C-N 3.31Å; E300-E302 PolarHBondContact O-N 3.34Å; E302-G306 PolarHBondContact O-N 3.3Å
303	K	68.9	Low	73.4	Confident	140 Å²	140	77.3 Å²	77.3	61%	0.609	45%	0.45	S	S	*	.	H	α-helix	trans	-68	-36.9	176	-74.4	167.3	-171.4	163.9	0	112	E299 E300 S307	E299-K303 WeakPolarHBondContact O-CD 3.23Å; E299-K303 VanDerWaalsContact O-CG 3.23Å; E299-K303 WeakPolarHBondContact O-CG 3.33Å; E299-K303 PolarHBondContact O-N 3.1Å; E300-K303 PolarHBondContact O-N 2.99Å; E300-K303 VanDerWaalsContact O-N 3.17Å; K303-S307 WeakPolarHBondContact O-CB 3.49Å; K303-S307 PolarHBondContact O-N 2.84Å
304	E	62.7	Low	73.5	Confident	93 Å²	93	79.8 Å²	79.8	44%	0.435	45%	0.45	S	S	.	.	H	α-helix	trans	-68.6	-41.5	179	-73.4	-165.4	154.4	0	0	112.6	E300 E301 G306 S307 W538	E300-E304 PolarHBondContact O-N 3.15Å; E301-E304 PolarHBondContact O-N 2.8Å; E304-G306 VanDerWaalsContact C-N 3.26Å; E304-G306 PolarHBondContact O-N 2.89Å; E304-S307 PolarHBondContact O-N 3.35Å; E304-W538 WeakPolarHBondContact OE2-CB 3.47Å
305	V	61.7	Low	73.6	Confident	109 Å²	109	78.4 Å²	78.4	66%	0.661	44%	0.443	S	S	*	.	H	α-helix	trans	-63.2	-32.7	178	174.8	0	0	0	0	111.8	E301	E301-V305 WeakPolarHBondContact O-CG2 3.42Å; E301-V305 PolarHBondContact O-N 3.48Å
306	G	55	Low	73.7	Confident	73 Å²	73	78.7 Å²	78.7	75%	0.753	45%	0.447	S	S	*	.	H	α-helix	trans	-78.6	-17.7	179.4	0	0	0	0	0	115.6	E302 E304	E302-G306 PolarHBondContact O-N 3.3Å; E304-G306 VanDerWaalsContact C-N 3.26Å; E304-G306 PolarHBondContact O-N 2.89Å
307	S	53.2	Low	73.8	Confident	105 Å²	105	79.3 Å²	79.3	73%	0.734	46%	0.458	S	S	*	.	H	α-helix	trans	-105	-26	-165.5	-176.1	0	0	0	0	114.7	K303 E304	K303-S307 WeakPolarHBondContact O-CB 3.49Å; K303-S307 PolarHBondContact O-N 2.84Å; E304-S307 PolarHBondContact O-N 3.35Å
308	A	52.8	Low	74.1	Confident	44 Å²	44	80.2 Å²	80.2	36%	0.364	46%	0.456	S	S	.	.	S	Bend	trans	-140.9	48.6	-162.9	0	0	0	0	0	116
309	G	65.1	Low	74.4	Confident	55 Å²	55	82.2 Å²	82.2	57%	0.567	47%	0.47	S	S	*	.	S	Bend	trans	54.5	-165.3	171.5	0	0	0	0	0	115	V311	G309-V311 PolarHBondContact O-N 3.12Å
310	P	76.6	Confident	74.7	Confident	86 Å²	86	79.2 Å²	79.2	56%	0.558	46%	0.457	S	S	*	.			trans	-66.2	123.2	174.9	-17.7	30.7	0	0	0	110.5	I312 C313 R314	P310-I312 HydrophobicContact CB-CG2 4.16Å; P310-I312 PolarHBondContact O-N 3.3Å; P310-C313 HydrophobicContact CB-CB 4.49Å; P310-C313 WeakPolarHBondContact O-CB 3.33Å; P310-C313 PolarHBondContact O-N 3.44Å; P310-R314 PolarHBondContact O-N 3.19Å
311	V	79.7	Confident	75.2	Confident	41 Å²	41	73.7 Å²	73.7	25%	0.248	43%	0.431	C	S	.	.	H	α-helix	trans	-51.1	-34.8	177.8	177.8	0	0	0	0	111.7	G309 C313 R314 M315 W538 T542	G309-V311 PolarHBondContact O-N 3.12Å; V311-C313 PolarHBondContact O-N 3.14Å; V311-R314 WeakPolarHBondContact O-CB 3.39Å; V311-R314 PolarHBondContact O-N 3.42Å; V311-M315 HydrophobicContact CG1-CG 4.34Å; V311-M315 HydrophobicContact CG1-SD 4.44Å; V311-M315 WeakPolarHBondContact O-CG 3.44Å; V311-M315 PolarHBondContact O-N 3.4Å; V311-W538 HydrophobicContact CG1-CE3 4.03Å; V311-W538 HydrophobicContact CG1-CZ3 4.06Å; V311-T542 HydrophobicContact CG1-CG2 4.47Å
312	I	82.3	Confident	76.1	Confident	72 Å²	72	74.7 Å²	74.7	37%	0.369	43%	0.431	S	S	.	.	H	α-helix	trans	-64.8	-36.9	178.8	-156.9	148.1	0	0	0	113.1	P310 M315 L316 T542	P310-I312 HydrophobicContact CB-CG2 4.16Å; P310-I312 PolarHBondContact O-N 3.3Å; I312-M315 PolarHBondContact O-N 3.08Å; I312-L316 VanDerWaalsContact O-CG 3.31Å; I312-L316 WeakPolarHBondContact O-CG 3.04Å; I312-L316 PolarHBondContact O-N 2.9Å; I312-T542 HydrophobicContact CB-CG2 3.94Å; I312-T542 HydrophobicContact CD1-CG2 4.04Å; I312-T542 HydrophobicContact CG1-CG2 4.17Å
313	C	83.9	Confident	77	Confident	67 Å²	67	71.3 Å²	71.3	45%	0.453	41%	0.413	S	S	.	.	H	α-helix	trans	-65.9	-43.5	175.6	-66.4	0	0	0	0	110.1	P310 V311 M315 L316 S317	P310-C313 HydrophobicContact CB-CB 4.49Å; P310-C313 WeakPolarHBondContact O-CB 3.33Å; P310-C313 PolarHBondContact O-N 3.44Å; V311-C313 PolarHBondContact O-N 3.14Å; C313-M315 VanDerWaalsContact C-N 3.34Å; C313-M315 PolarHBondContact O-N 3.25Å; C313-L316 PolarHBondContact O-N 3.35Å; C313-S317 PolarHBondContact O-N 3.34Å; C313-S317 PolarHBondContact O-OG 3.27Å; C313-S317 VanDerWaalsContact O-OG 3.14Å
314	R	85.3	Confident	78	Confident	115 Å²	115	64.7 Å²	64.7	43%	0.434	39%	0.385	S	S	.	.	H	α-helix	trans	-60.7	-42.5	174.9	-172.2	179.7	176.7	-173.2	-3	111.7	P310 V311 L316 S317 Y318 W538	P310-R314 PolarHBondContact O-N 3.19Å; V311-R314 WeakPolarHBondContact O-CB 3.39Å; V311-R314 PolarHBondContact O-N 3.42Å; R314-L316 VanDerWaalsContact C-N 3.33Å; R314-L316 PolarHBondContact O-N 3.37Å; R314-S317 PolarHBondContact O-N 2.93Å; R314-Y318 WeakPolarHBondContact O-CB 3.08Å; R314-Y318 PolarHBondContact O-N 3.32Å; R314-W538 HydrophobicContact CB-CH2 4.49Å; R314-W538 HydrophobicContact CB-CZ3 4.17Å; R314-W538 HydrophobicContact CG-CH2 3.89Å; R314-W538 HydrophobicContact CG-CZ3 3.86Å
315	M	86.2	Confident	79.4	Confident	1 Å²	1	61 Å²	61	1%	0.005	37%	0.368	C	S	.	.	H	α-helix	trans	-61.6	-39.2	176.5	-74.7	-175.4	76.8	0	0	112.8	V311 I312 C313 T321 R322 L325 Y535 W538 A539 T542	V311-M315 HydrophobicContact CG1-CG 4.34Å; V311-M315 HydrophobicContact CG1-SD 4.44Å; V311-M315 WeakPolarHBondContact O-CG 3.44Å; V311-M315 PolarHBondContact O-N 3.4Å; I312-M315 PolarHBondContact O-N 3.08Å; C313-M315 VanDerWaalsContact C-N 3.34Å; C313-M315 PolarHBondContact O-N 3.25Å; M315-T321 WeakPolarHBondContact CA-OG1 3.16Å; M315-T321 PolarHBondContact O-OG1 3.06Å; M315-R322 PolarHBondContact O-N 3.32Å; M315-L325 HydrophobicContact CE-CD1 4.29Å; M315-Y535 HydrophobicContact CE-CD1 3.81Å; M315-Y535 HydrophobicContact CE-CE1 3.93Å; M315-W538 HydrophobicContact CG-CH2 3.99Å; M315-W538 HydrophobicContact CG-CZ3 3.77Å; M315-A539 HydrophobicContact CE-CB 3.85Å; M315-A539 HydrophobicContact CG-CB 3.8Å; M315-A539 HydrophobicContact SD-CB 3.75Å; M315-T542 HydrophobicContact SD-CG2 3.88Å
316	L	87.8	Confident	80.9	Confident	87 Å²	87	59.9 Å²	59.9	46%	0.455	36%	0.357	S	S	.	.	H	α-helix	trans	-75.2	-31.5	179.4	-69.6	173.2	0	0	0	112.8	I312 C313 R314 R322 L325	I312-L316 VanDerWaalsContact O-CG 3.31Å; I312-L316 WeakPolarHBondContact O-CG 3.04Å; I312-L316 PolarHBondContact O-N 2.9Å; C313-L316 PolarHBondContact O-N 3.35Å; R314-L316 VanDerWaalsContact C-N 3.33Å; R314-L316 PolarHBondContact O-N 3.37Å; L316-R322 WeakPolarHBondContact O-CD 3.29Å; L316-L325 HydrophobicContact CD2-CD2 3.95Å
317	S	87.6	Confident	82.7	Confident	96 Å²	96	56.4 Å²	56.4	67%	0.671	32%	0.322	S	S	*	.	H	α-helix	trans	-75.8	-37.5	176.3	-64.1	0	0	0	0	112.6	C313 R314 P319	C313-S317 PolarHBondContact O-N 3.34Å; C313-S317 PolarHBondContact O-OG 3.27Å; C313-S317 VanDerWaalsContact O-OG 3.14Å; R314-S317 PolarHBondContact O-N 2.93Å; S317-P319 WeakPolarHBondContact O-CD 3.18Å
318	Y	86	Confident	84.5	Confident	97 Å²	97	51.4 Å²	51.4	38%	0.38	29%	0.287	S	S	.	.	S	Bend	trans	-82.8	119.3	-177.8	-173.9	-121.2	0	0	0	111.6	R314 P320 T321 R322 W538	R314-Y318 WeakPolarHBondContact O-CB 3.08Å; R314-Y318 PolarHBondContact O-N 3.32Å; Y318-P320 HydrophobicContact CD1-CB 4.37Å; Y318-P320 HydrophobicContact CD1-CG 4.29Å; Y318-P320 HydrophobicContact CE1-CB 3.87Å; Y318-P320 HydrophobicContact CE1-CG 3.67Å; Y318-P320 HydrophobicContact CE2-CG 4.28Å; Y318-T321 WeakPolarHBondContact CB-OG1 3.14Å; Y318-T321 HydrophobicContact CD1-CG2 3.9Å; Y318-T321 WeakPolarHBondContact CD1-OG1 3.37Å; Y318-T321 HydrophobicContact CE1-CG2 4.49Å; Y318-T321 PolarHBondContact O-N 3.27Å; Y318-T321 PolarHBondContact O-OG1 3.37Å; Y318-R322 WeakPolarHBondContact O-CB 3.24Å; Y318-R322 PolarHBondContact O-N 3.07Å; Y318-W538 HydrophobicContact CD1-CZ2 4.32Å
319	P	86.9	Confident	86.5	Confident	52 Å²	52	50 Å²	50	34%	0.338	27%	0.274	S	S	.	.	H	α-helix	trans	-60.8	-43.2	-169.5	-22.3	31.2	0	0	0	116	S317 R322 R323	S317-P319 WeakPolarHBondContact O-CD 3.18Å; P319-R322 PolarHBondContact O-N 2.89Å; P319-R323 WeakPolarHBondContact O-CB 3.46Å; P319-R323 VanDerWaalsContact O-CG 3.29Å; P319-R323 WeakPolarHBondContact O-CG 3.28Å; P319-R323 PolarHBondContact O-N 3.2Å
320	P	87.3	Confident	87.9	Confident	9 Å²	9	47.7 Å²	47.7	6%	0.058	25%	0.25	C	S	.	.	H	α-helix	trans	-62	-45.2	178.2	-25.7	36.5	0	0	0	112.8	Y318 R322 R323 A324 E605 F608 D609	Y318-P320 HydrophobicContact CD1-CB 4.37Å; Y318-P320 HydrophobicContact CD1-CG 4.29Å; Y318-P320 HydrophobicContact CE1-CB 3.87Å; Y318-P320 HydrophobicContact CE1-CG 3.67Å; Y318-P320 HydrophobicContact CE2-CG 4.28Å; P320-R322 PolarHBondContact O-N 3.21Å; P320-R323 WeakPolarHBondContact O-CB 3.47Å; P320-R323 PolarHBondContact O-N 2.89Å; P320-A324 PolarHBondContact O-N 3.33Å; P320-E605 HydrophobicContact CB-CG 4.47Å; P320-F608 HydrophobicContact CB-CB 3.97Å; P320-F608 WeakPolarHBondContact O-CB 3.49Å; P320-D609 VanDerWaalsContact CG-OD1 3.29Å; P320-D609 WeakPolarHBondContact CG-OD1 3.43Å
321	T	87.1	Confident	88.7	Confident	1 Å²	1	43.6 Å²	43.6	1%	0.006	22%	0.224	C	C	.	.	H	α-helix	trans	-68.3	-34.6	177	47	0	0	0	0	113.1	M315 Y318 R323 A324 L325 P536 W538 A539	M315-T321 WeakPolarHBondContact CA-OG1 3.16Å; M315-T321 PolarHBondContact O-OG1 3.06Å; Y318-T321 WeakPolarHBondContact CB-OG1 3.14Å; Y318-T321 HydrophobicContact CD1-CG2 3.9Å; Y318-T321 WeakPolarHBondContact CD1-OG1 3.37Å; Y318-T321 HydrophobicContact CE1-CG2 4.49Å; Y318-T321 PolarHBondContact O-N 3.27Å; Y318-T321 PolarHBondContact O-OG1 3.37Å; T321-R323 VanDerWaalsContact C-N 3.3Å; T321-R323 PolarHBondContact O-N 3.5Å; T321-A324 PolarHBondContact O-N 3.24Å; T321-L325 WeakPolarHBondContact O-CB 3.22Å; T321-L325 PolarHBondContact O-N 3.17Å; T321-P536 HydrophobicContact CG2-CG 3.58Å; T321-W538 HydrophobicContact CG2-CH2 3.82Å; T321-W538 HydrophobicContact CG2-CZ2 3.52Å; T321-A539 HydrophobicContact CG2-CB 4.31Å
322	R	90.2	Very high	89.4	Confident	110 Å²	110	41.7 Å²	41.7	42%	0.415	21%	0.212	S	C	.	.	H	α-helix	trans	-62.5	-40.6	173.4	-176.8	177.3	65.2	-157.9	4.8	111	M315 L316 Y318 P319 P320 L325 I326	M315-R322 PolarHBondContact O-N 3.32Å; L316-R322 WeakPolarHBondContact O-CD 3.29Å; Y318-R322 WeakPolarHBondContact O-CB 3.24Å; Y318-R322 PolarHBondContact O-N 3.07Å; P319-R322 PolarHBondContact O-N 2.89Å; P320-R322 PolarHBondContact O-N 3.21Å; R322-L325 PolarHBondContact O-N 3.42Å; R322-I326 HydrophobicContact CG-CD1 4.24Å; R322-I326 VanDerWaalsContact O-CG1 3.3Å; R322-I326 WeakPolarHBondContact O-CG1 3.35Å; R322-I326 PolarHBondContact O-N 2.94Å
323	R	90.8	Very high	90.1	Very high	45 Å²	45	40.6 Å²	40.6	17%	0.17	21%	0.206	C	C	.	.	H	α-helix	trans	-65	-47.6	176.1	-75.8	169.7	-179.1	163.2	0.8	111.5	P319 P320 T321 L325 I326 V327 F608 D609 N610 L612	P319-R323 WeakPolarHBondContact O-CB 3.46Å; P319-R323 VanDerWaalsContact O-CG 3.29Å; P319-R323 WeakPolarHBondContact O-CG 3.28Å; P319-R323 PolarHBondContact O-N 3.2Å; P320-R323 WeakPolarHBondContact O-CB 3.47Å; P320-R323 PolarHBondContact O-N 2.89Å; T321-R323 VanDerWaalsContact C-N 3.3Å; T321-R323 PolarHBondContact O-N 3.5Å; R323-L325 VanDerWaalsContact C-N 3.25Å; R323-L325 PolarHBondContact O-N 2.74Å; R323-I326 PolarHBondContact O-N 3.06Å; R323-V327 WeakPolarHBondContact O-CG2 3.44Å; R323-V327 PolarHBondContact O-N 3.14Å; R323-F608 HydrophobicContact CB-CB 4.3Å; R323-F608 HydrophobicContact CB-CD1 3.98Å; R323-F608 WeakPolarHBondContact CD-O 3.18Å; R323-F608 PolarHBondContact NH1-O 3.06Å; R323-D609 PolarHBondContact NH1-O 3.28Å; R323-N610 VanDerWaalsContact CZ-O 3.25Å; R323-N610 PolarHBondContact NH1-O 3.13Å; R323-L612 HydrophobicContact CB-CD1 3.44Å; R323-L612 VanDerWaalsContact CB-CD1 3.44Å; R323-L612 HydrophobicContact CB-CG 3.82Å; R323-L612 HydrophobicContact CG-CD1 3.67Å; R323-L612 HydrophobicContact CG-CG 3.84Å
324	A	90.1	Very high	90.7	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.008	19%	0.187	C	C	.	.	H	α-helix	trans	-58	-39.9	173.4	0	0	0	0	0	111.6	P320 T321 V327 G328 I534 Y535 F608	P320-A324 PolarHBondContact O-N 3.33Å; T321-A324 PolarHBondContact O-N 3.24Å; A324-V327 PolarHBondContact O-N 2.99Å; A324-G328 PolarHBondContact O-N 3.13Å; A324-I534 VanDerWaalsContact O-CD1 3.28Å; A324-I534 WeakPolarHBondContact O-CD1 3.05Å; A324-Y535 HydrophobicContact CB-CD1 3.99Å; A324-Y535 HydrophobicContact CB-CE1 4Å; A324-F608 HydrophobicContact CB-CD1 4.29Å; A324-F608 HydrophobicContact CB-CD2 4.05Å; A324-F608 HydrophobicContact CB-CE1 4.21Å; A324-F608 HydrophobicContact CB-CE2 3.97Å; A324-F608 HydrophobicContact CB-CG 4.21Å; A324-F608 HydrophobicContact CB-CZ 4.05Å
325	L	91.4	Very high	91.1	Very high	14 Å²	14	33.1 Å²	33.1	7%	0.073	17%	0.169	C	C	.	.	H	α-helix	trans	-63	-46.2	176.2	-171.1	65.4	0	0	0	111.7	M315 L316 T321 R322 R323 V327 G328 C329 Y535 C546	M315-L325 HydrophobicContact CE-CD1 4.29Å; L316-L325 HydrophobicContact CD2-CD2 3.95Å; T321-L325 WeakPolarHBondContact O-CB 3.22Å; T321-L325 PolarHBondContact O-N 3.17Å; R322-L325 PolarHBondContact O-N 3.42Å; R323-L325 VanDerWaalsContact C-N 3.25Å; R323-L325 PolarHBondContact O-N 2.74Å; L325-V327 VanDerWaalsContact C-N 3.31Å; L325-V327 PolarHBondContact O-N 3.38Å; L325-G328 PolarHBondContact O-N 2.86Å; L325-C329 WeakPolarHBondContact O-CB 3.46Å; L325-C329 PolarHBondContact O-N 3.3Å; L325-C329 PolarHBondContact O-SG 3.25Å; L325-Y535 HydrophobicContact CB-CE1 4.33Å; L325-Y535 HydrophobicContact CD1-CE1 4.27Å; L325-C546 HydrophobicContact CD1-CB 3.92Å
326	I	93.1	Very high	91.5	Very high	87 Å²	87	33.3 Å²	33.3	45%	0.446	17%	0.17	S	C	.	.	H	α-helix	trans	-58.1	-44	176.2	-69.2	163.1	0	0	0	111.1	R322 R323 G330 F588	R322-I326 HydrophobicContact CG-CD1 4.24Å; R322-I326 VanDerWaalsContact O-CG1 3.3Å; R322-I326 WeakPolarHBondContact O-CG1 3.35Å; R322-I326 PolarHBondContact O-N 2.94Å; R323-I326 PolarHBondContact O-N 3.06Å; I326-G330 WeakPolarHBondContact O-CA 2.96Å; I326-G330 PolarHBondContact O-N 2.98Å; I326-F588 HydrophobicContact CG2-CE2 4.36Å
327	V	92.8	Very high	91.9	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-64.2	-49.8	177.8	175.4	0	0	0	0	111.2	R323 A324 L325 G330 L331 C592 L593 F608 L612	R323-V327 WeakPolarHBondContact O-CG2 3.44Å; R323-V327 PolarHBondContact O-N 3.14Å; A324-V327 PolarHBondContact O-N 2.99Å; L325-V327 VanDerWaalsContact C-N 3.31Å; L325-V327 PolarHBondContact O-N 3.38Å; V327-G330 PolarHBondContact O-N 3.33Å; V327-L331 HydrophobicContact CG1-CD1 4.29Å; V327-L331 WeakPolarHBondContact O-CG 3.26Å; V327-L331 PolarHBondContact O-N 3.2Å; V327-C592 HydrophobicContact CG2-CB 4.34Å; V327-C592 WeakPolarHBondContact CG2-O 3.26Å; V327-L593 HydrophobicContact CG1-CD1 3.86Å; V327-F608 HydrophobicContact CB-CE1 4.47Å; V327-F608 HydrophobicContact CG2-CE1 4.08Å; V327-L612 HydrophobicContact CG2-CD1 3.84Å; V327-L612 HydrophobicContact CG2-CD2 4.08Å
328	G	91.5	Very high	92.2	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-61.3	-46.2	-179.2	0	0	0	0	0	114	A324 L325 Q332 N531 S547	A324-G328 PolarHBondContact O-N 3.13Å; L325-G328 PolarHBondContact O-N 2.86Å; G328-Q332 WeakPolarHBondContact O-CG 3.45Å; G328-Q332 PolarHBondContact O-N 3.25Å; G328-N531 WeakPolarHBondContact CA-OD1 3.09Å; G328-N531 PolarHBondContact O-ND2 2.86Å; G328-S547 VanDerWaalsContact C-OG 3.26Å
329	C	94.3	Very high	92.5	Very high	15 Å²	15	20.9 Å²	20.9	10%	0.101	10%	0.103	C	C	.	.	H	α-helix	trans	-66.3	-42.7	175.7	-67.8	0	0	0	0	111.8	L325 Q332 M333 S547 I550	L325-C329 WeakPolarHBondContact O-CB 3.46Å; L325-C329 PolarHBondContact O-N 3.3Å; L325-C329 PolarHBondContact O-SG 3.25Å; C329-Q332 PolarHBondContact O-N 3.08Å; C329-M333 WeakPolarHBondContact O-CB 3.29Å; C329-M333 PolarHBondContact O-N 2.86Å; C329-S547 PolarHBondContact N-OG 3.43Å; C329-I550 HydrophobicContact CB-CD1 3.4Å; C329-I550 VanDerWaalsContact CB-CD1 3.4Å; C329-I550 WeakPolarHBondContact SG-CD1 3.02Å
330	G	95.4	Very high	92.7	Very high	6 Å²	6	19 Å²	19	6%	0.062	9%	0.09	C	C	.	.	H	α-helix	trans	-62.9	-42.3	177.9	0	0	0	0	0	112.5	I326 V327 Q332 M333 F334	I326-G330 WeakPolarHBondContact O-CA 2.96Å; I326-G330 PolarHBondContact O-N 2.98Å; V327-G330 PolarHBondContact O-N 3.33Å; G330-Q332 VanDerWaalsContact C-N 3.34Å; G330-Q332 PolarHBondContact O-N 3.45Å; G330-M333 PolarHBondContact O-N 2.93Å; G330-F334 WeakPolarHBondContact O-CD2 3.25Å; G330-F334 PolarHBondContact O-N 3.2Å
331	L	93.9	Very high	92.7	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-58.9	-44.4	175	-75.4	176.3	0	0	0	112.1	V327 Q335 T393 P527 V530 I589 L593	V327-L331 HydrophobicContact CG1-CD1 4.29Å; V327-L331 WeakPolarHBondContact O-CG 3.26Å; V327-L331 PolarHBondContact O-N 3.2Å; L331-Q335 WeakPolarHBondContact O-CB 3.39Å; L331-Q335 PolarHBondContact O-N 2.64Å; L331-T393 HydrophobicContact CD2-CG2 4.38Å; L331-P527 HydrophobicContact CB-CB 4.17Å; L331-V530 HydrophobicContact CD1-CB 3.95Å; L331-V530 HydrophobicContact CD1-CG1 3.66Å; L331-V530 HydrophobicContact CD1-CG2 4.5Å; L331-I589 HydrophobicContact CD2-CD1 4.11Å; L331-I589 HydrophobicContact CD2-CG1 3.93Å; L331-L593 HydrophobicContact CD1-CD1 3.98Å; L331-L593 HydrophobicContact CD2-CD2 4.35Å
332	Q	94.4	Very high	92.8	Very high	1 Å²	1	19.4 Å²	19.4	1%	0.005	9%	0.091	C	C	.	.	H	α-helix	trans	-68.4	-38.6	178.9	-67.8	-70.6	18.5	0	0	112.4	G328 C329 G330 Q335 Q336 P527 N531 S547 N551	G328-Q332 WeakPolarHBondContact O-CG 3.45Å; G328-Q332 PolarHBondContact O-N 3.25Å; C329-Q332 PolarHBondContact O-N 3.08Å; G330-Q332 VanDerWaalsContact C-N 3.34Å; G330-Q332 PolarHBondContact O-N 3.45Å; Q332-Q335 WeakPolarHBondContact O-CB 3.39Å; Q332-Q336 PolarHBondContact O-N 3.46Å; Q332-P527 HydrophobicContact CG-CB 4.49Å; Q332-N531 WeakPolarHBondContact CG-ND2 3Å; Q332-S547 WeakPolarHBondContact CB-O 3.42Å; Q332-S547 WeakPolarHBondContact CG-O 3.38Å; Q332-N551 HydrophobicContact CB-CB 3.98Å; Q332-N551 HydrophobicContact CG-CB 4.35Å; Q332-N551 PolarHBondContact OE1-ND2 3.12Å
333	M	96	Very high	92.9	Very high	49 Å²	49	14.2 Å²	14.2	24%	0.241	7%	0.072	C	C	.	.	H	α-helix	trans	-61.8	-51.7	174.6	179.8	-177.4	75.7	0	0	111.5	C329 G330 Q335 Q336 L337 I550 F554	C329-M333 WeakPolarHBondContact O-CB 3.29Å; C329-M333 PolarHBondContact O-N 2.86Å; G330-M333 PolarHBondContact O-N 2.93Å; M333-Q335 VanDerWaalsContact C-N 3.3Å; M333-Q335 PolarHBondContact O-N 2.77Å; M333-Q336 PolarHBondContact O-N 2.97Å; M333-Q336 VanDerWaalsContact O-N 3.15Å; M333-L337 HydrophobicContact CG-CD1 3.73Å; M333-L337 HydrophobicContact CG-CG 4.28Å; M333-L337 WeakPolarHBondContact O-CG 3.46Å; M333-L337 PolarHBondContact O-N 2.78Å; M333-L337 HydrophobicContact SD-CD1 4.35Å; M333-I550 HydrophobicContact CB-CG2 3.96Å; M333-F554 HydrophobicContact CB-CD2 4.21Å; M333-F554 HydrophobicContact CB-CE2 4.22Å; M333-F554 HydrophobicContact CG-CD1 3.93Å; M333-F554 HydrophobicContact CG-CD2 3.83Å; M333-F554 HydrophobicContact CG-CE1 3.7Å; M333-F554 HydrophobicContact CG-CE2 3.6Å; M333-F554 HydrophobicContact CG-CG 3.98Å; M333-F554 HydrophobicContact CG-CZ 3.53Å; M333-F554 HydrophobicContact SD-CE1 4.03Å; M333-F554 HydrophobicContact SD-CE2 3.86Å; M333-F554 HydrophobicContact SD-CZ 3.49Å; M333-F554 WeakPolarHBondContact SD-CZ 3.38Å
334	F	96.1	Very high	93	Very high	15 Å²	15	12.4 Å²	12.4	7%	0.066	7%	0.065	C	C	.	.	H	α-helix	trans	-69.4	-26.7	-179.1	-73.1	-62.2	0	0	0	113.3	G330 Q336 L337 S338 V584 G585 F588	G330-F334 WeakPolarHBondContact O-CD2 3.25Å; G330-F334 PolarHBondContact O-N 3.2Å; F334-Q336 VanDerWaalsContact C-N 3.32Å; F334-Q336 PolarHBondContact O-N 2.73Å; F334-L337 HydrophobicContact CD1-CD1 4.41Å; F334-S338 WeakPolarHBondContact O-CB 3.31Å; F334-S338 PolarHBondContact O-N 3.44Å; F334-S338 VanDerWaalsContact O-N 3.1Å; F334-V584 HydrophobicContact CE1-CB 4.21Å; F334-V584 HydrophobicContact CE1-CG1 3.92Å; F334-V584 HydrophobicContact CZ-CG1 3.88Å; F334-G585 VanDerWaalsContact CD1-CA 3.4Å; F334-F588 HydrophobicContact CD2-CB 4.22Å; F334-F588 AromaticContact CD2-CD1 3.82Å; F334-F588 HydrophobicContact CD2-CD1 3.82Å; F334-F588 HydrophobicContact CD2-CE1 4.44Å; F334-F588 HydrophobicContact CD2-CG 4.1Å; F334-F588 HydrophobicContact CE2-CB 3.61Å; F334-F588 AromaticContact CE2-CD1 3.78Å; F334-F588 HydrophobicContact CE2-CD1 3.78Å; F334-F588 HydrophobicContact CE2-CD2 4.14Å; F334-F588 HydrophobicContact CE2-CE1 4.48Å; F334-F588 AromaticContact CE2-CG 3.57Å; F334-F588 HydrophobicContact CE2-CG 3.57Å; F334-F588 HydrophobicContact CZ-CB 4.23Å
335	Q	94.7	Very high	93	Very high	9 Å²	9	12.7 Å²	12.7	4%	0.042	7%	0.066	C	C	.	.	H	α-helix	trans	-56.8	-48.4	168.5	-173.3	-173.7	58.2	0	0	110.9	L331 Q332 M333 S338 F519 M523 G524 P527 N551	L331-Q335 WeakPolarHBondContact O-CB 3.39Å; L331-Q335 PolarHBondContact O-N 2.64Å; Q332-Q335 WeakPolarHBondContact O-CB 3.39Å; M333-Q335 VanDerWaalsContact C-N 3.3Å; M333-Q335 PolarHBondContact O-N 2.77Å; Q335-S338 PolarHBondContact O-OG 3.26Å; Q335-F519 HydrophobicContact CG-CE2 4.39Å; Q335-F519 HydrophobicContact CG-CZ 3.87Å; Q335-M523 HydrophobicContact CB-CE 4.03Å; Q335-M523 PolarHBondContact NE2-O 3.22Å; Q335-G524 PolarHBondContact NE2-O 3.43Å; Q335-P527 HydrophobicContact CB-CG 4.06Å; Q335-P527 HydrophobicContact CG-CG 4.21Å; Q335-N551 PolarHBondContact OE1-ND2 3.49Å
336	Q	95	Very high	93	Very high	6 Å²	6	12 Å²	12	3%	0.028	6%	0.063	C	C	.	.	H	α-helix	trans	-75.7	-41.9	-177.9	-64.3	-61	-18.5	0	0	113.1	Q332 M333 F334 S338 G339 N341 N551 F554 N555	Q332-Q336 PolarHBondContact O-N 3.46Å; M333-Q336 PolarHBondContact O-N 2.97Å; M333-Q336 VanDerWaalsContact O-N 3.15Å; F334-Q336 VanDerWaalsContact C-N 3.32Å; F334-Q336 PolarHBondContact O-N 2.73Å; Q336-S338 PolarHBondContact O-N 3.17Å; Q336-G339 PolarHBondContact O-N 2.93Å; Q336-N341 PolarHBondContact NE2-ND2 2.77Å; Q336-N341 VanDerWaalsContact NE2-ND2 3.17Å; Q336-N341 PolarHBondContact OE1-ND2 2.73Å; Q336-N551 WeakPolarHBondContact CG-O 3.45Å; Q336-N551 VanDerWaalsContact NE2-CG 3.31Å; Q336-N551 PolarHBondContact NE2-ND2 3.1Å; Q336-N551 PolarHBondContact NE2-OD1 2.79Å; Q336-F554 HydrophobicContact CB-CB 3.71Å; Q336-F554 HydrophobicContact CG-CB 4.22Å; Q336-N555 HydrophobicContact CG-CB 4.25Å
337	L	94.6	Very high	93	Very high	18 Å²	18	8 Å²	8	9%	0.094	4%	0.042	C	C	.	.	H	α-helix	trans	-64.6	-21.1	177.7	-70.1	177.3	0	0	0	113.4	M333 F334 G339 F554 V558 Y578 F581	M333-L337 HydrophobicContact CG-CD1 3.73Å; M333-L337 HydrophobicContact CG-CG 4.28Å; M333-L337 WeakPolarHBondContact O-CG 3.46Å; M333-L337 PolarHBondContact O-N 2.78Å; M333-L337 HydrophobicContact SD-CD1 4.35Å; F334-L337 HydrophobicContact CD1-CD1 4.41Å; L337-G339 PolarHBondContact O-N 3.19Å; L337-F554 HydrophobicContact CD1-CD1 4.3Å; L337-F554 HydrophobicContact CD1-CE1 4.18Å; L337-F554 HydrophobicContact CD2-CD1 3.72Å; L337-F554 HydrophobicContact CD2-CE1 4.08Å; L337-F554 HydrophobicContact CG-CD1 3.9Å; L337-F554 HydrophobicContact CG-CE1 4.26Å; L337-V558 HydrophobicContact CD2-CG2 3.99Å; L337-Y578 WeakPolarHBondContact O-CD1 3.34Å; L337-F581 HydrophobicContact CB-CB 3.97Å; L337-F581 HydrophobicContact CB-CD2 4.3Å; L337-F581 HydrophobicContact CB-CG 4.31Å; L337-F581 HydrophobicContact CD2-CD2 4.23Å; L337-F581 HydrophobicContact CD2-CE2 4.39Å
338	S	94.1	Very high	93.1	Very high	0 Å²	0	8 Å²	8	0%	0	4%	0.042	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-4.9	170.9	76.9	0	0	0	0	113.8	F334 Q335 Q336 Y515 F519	F334-S338 WeakPolarHBondContact O-CB 3.31Å; F334-S338 PolarHBondContact O-N 3.44Å; F334-S338 VanDerWaalsContact O-N 3.1Å; Q335-S338 PolarHBondContact O-OG 3.26Å; Q336-S338 PolarHBondContact O-N 3.17Å; S338-Y515 WeakPolarHBondContact O-CE2 3.49Å; S338-Y515 PolarHBondContact O-OH 3.47Å; S338-F519 WeakPolarHBondContact OG-CE2 3.22Å
339	G	92.4	Very high	93	Very high	0 Å²	0	8.1 Å²	8.1	0%	0	4%	0.043	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.9	16.4	168.5	0	0	0	0	0	115.7	Q336 L337 N341 T342 I343	Q336-G339 PolarHBondContact O-N 2.93Å; L337-G339 PolarHBondContact O-N 3.19Å; G339-N341 PolarHBondContact O-N 2.84Å; G339-T342 WeakPolarHBondContact O-CB 3.38Å; G339-T342 PolarHBondContact O-N 3.39Å; G339-I343 WeakPolarHBondContact O-CG1 3.4Å; G339-I343 PolarHBondContact O-N 3.31Å
340	I	91.4	Very high	93	Very high	13 Å²	13	7.4 Å²	7.4	7%	0.067	4%	0.038	C	C	.	.	H	α-helix	trans	-57.7	-48.5	-175.9	179.7	62.6	0	0	0	112.1	T342 I343 M344 Y515 L516 F519	I340-T342 VanDerWaalsContact C-N 3.35Å; I340-T342 PolarHBondContact O-N 3.39Å; I340-I343 PolarHBondContact O-N 3.45Å; I340-M344 HydrophobicContact CD1-CG 4.04Å; I340-M344 HydrophobicContact CD1-SD 4.38Å; I340-M344 HydrophobicContact CG1-CG 4.3Å; I340-M344 VanDerWaalsContact O-CG 3.29Å; I340-M344 WeakPolarHBondContact O-CG 3.42Å; I340-M344 PolarHBondContact O-N 2.96Å; I340-Y515 VanDerWaalsContact CA-OH 3.25Å; I340-Y515 WeakPolarHBondContact CA-OH 3.38Å; I340-Y515 HydrophobicContact CD1-CE1 3.77Å; I340-Y515 PolarHBondContact N-OH 3.28Å; I340-L516 HydrophobicContact CD1-CD2 3.67Å; I340-F519 HydrophobicContact CB-CD1 4.31Å; I340-F519 HydrophobicContact CB-CD2 4.4Å; I340-F519 HydrophobicContact CB-CE1 3.74Å; I340-F519 HydrophobicContact CB-CE2 3.83Å; I340-F519 HydrophobicContact CB-CZ 3.47Å; I340-F519 VanDerWaalsContact CB-CZ 3.47Å; I340-F519 HydrophobicContact CD1-CD1 3.53Å; I340-F519 HydrophobicContact CD1-CE1 3.64Å; I340-F519 HydrophobicContact CD1-CG 4.11Å; I340-F519 HydrophobicContact CD1-CZ 4.27Å; I340-F519 HydrophobicContact CG1-CD1 3.85Å; I340-F519 HydrophobicContact CG1-CE1 3.38Å; I340-F519 HydrophobicContact CG1-CE2 4.4Å; I340-F519 HydrophobicContact CG1-CZ 3.7Å; I340-F519 HydrophobicContact CG2-CE1 4.12Å; I340-F519 HydrophobicContact CG2-CE2 4.13Å; I340-F519 HydrophobicContact CG2-CZ 3.55Å
341	N	87.7	Confident	92.8	Very high	18 Å²	18	7.1 Å²	7.1	10%	0.096	4%	0.036	C	C	.	.	H	α-helix	trans	-67.8	-38	-177.1	-81.3	-37.6	0	0	0	111.5	Q336 G339 I343 M344 Y345 N555	Q336-N341 PolarHBondContact NE2-ND2 2.77Å; Q336-N341 VanDerWaalsContact NE2-ND2 3.17Å; Q336-N341 PolarHBondContact OE1-ND2 2.73Å; G339-N341 PolarHBondContact O-N 2.84Å; N341-I343 PolarHBondContact O-N 3.24Å; N341-M344 PolarHBondContact O-N 3.39Å; N341-Y345 HydrophobicContact CB-CD2 4.1Å; N341-Y345 HydrophobicContact CB-CE2 3.71Å; N341-Y345 WeakPolarHBondContact O-CB 3.28Å; N341-Y345 WeakPolarHBondContact O-CD2 2.93Å; N341-Y345 VanDerWaalsContact O-CG 3.25Å; N341-Y345 PolarHBondContact O-N 3.39Å; N341-N555 WeakPolarHBondContact CB-OD1 3.22Å; N341-N555 PolarHBondContact ND2-ND2 3.27Å; N341-N555 PolarHBondContact ND2-OD1 3.13Å
342	T	89.6	Confident	92.6	Very high	0 Å²	0	7.9 Å²	7.9	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-56.6	-49.5	169.6	-67.7	0	0	0	0	112.1	G339 I340 M344 Y345 Y346 V558 F562 Y578	G339-T342 WeakPolarHBondContact O-CB 3.38Å; G339-T342 PolarHBondContact O-N 3.39Å; I340-T342 VanDerWaalsContact C-N 3.35Å; I340-T342 PolarHBondContact O-N 3.39Å; T342-M344 VanDerWaalsContact C-N 3.26Å; T342-M344 PolarHBondContact O-N 2.67Å; T342-Y345 PolarHBondContact O-N 3.14Å; T342-Y346 HydrophobicContact CG2-CD2 4.04Å; T342-Y346 WeakPolarHBondContact O-CB 3.43Å; T342-Y346 WeakPolarHBondContact O-CD2 3.46Å; T342-Y346 PolarHBondContact O-N 2.61Å; T342-V558 VanDerWaalsContact OG1-CG1 3.26Å; T342-V558 WeakPolarHBondContact OG1-CG1 3.49Å; T342-F562 HydrophobicContact CG2-CB 3.76Å; T342-F562 HydrophobicContact CG2-CD1 3.44Å; T342-F562 VanDerWaalsContact CG2-CD1 3.44Å; T342-F562 HydrophobicContact CG2-CD2 3.26Å; T342-F562 HydrophobicContact CG2-CE1 3.74Å; T342-F562 HydrophobicContact CG2-CE2 3.56Å; T342-F562 HydrophobicContact CG2-CG 3.16Å; T342-F562 HydrophobicContact CG2-CZ 3.78Å; T342-Y578 HydrophobicContact CG2-CE2 4.32Å
343	I	92.4	Very high	92.3	Very high	2 Å²	2	8.3 Å²	8.3	1%	0.01	4%	0.041	C	C	.	.	H	α-helix	trans	-62.4	-36.7	179.3	-77.5	166.4	0	0	0	111.2	G339 I340 N341 S347 I350 L404 L512 Y515	G339-I343 WeakPolarHBondContact O-CG1 3.4Å; G339-I343 PolarHBondContact O-N 3.31Å; I340-I343 PolarHBondContact O-N 3.45Å; N341-I343 PolarHBondContact O-N 3.24Å; I343-S347 WeakPolarHBondContact O-CA 3.46Å; I343-S347 WeakPolarHBondContact O-CB 3.49Å; I343-S347 PolarHBondContact O-N 3.5Å; I343-S347 VanDerWaalsContact O-N 3.07Å; I343-S347 PolarHBondContact O-OG 2.92Å; I343-I350 HydrophobicContact CG1-CD1 4.41Å; I343-L404 HydrophobicContact CD1-CD2 4.14Å; I343-L512 HydrophobicContact CD1-CD2 4.5Å; I343-L512 HydrophobicContact CG1-CD2 4.15Å; I343-L512 HydrophobicContact CG2-CD2 3.78Å; I343-Y515 HydrophobicContact CB-CE1 4.4Å; I343-Y515 HydrophobicContact CD1-CD1 3.62Å; I343-Y515 HydrophobicContact CD1-CD2 3.73Å; I343-Y515 HydrophobicContact CD1-CE1 3.44Å; I343-Y515 VanDerWaalsContact CD1-CE1 3.44Å; I343-Y515 HydrophobicContact CD1-CE2 3.52Å; I343-Y515 HydrophobicContact CD1-CG 3.78Å; I343-Y515 VanDerWaalsContact CD1-CZ 3.4Å; I343-Y515 HydrophobicContact CG2-CD1 4.23Å; I343-Y515 HydrophobicContact CG2-CE1 4.31Å
344	M	90.9	Very high	92	Very high	7 Å²	7	6.1 Å²	6.1	3%	0.034	3%	0.031	C	C	.	.	H	α-helix	trans	-71.9	-50.3	177.5	-66.9	-52.3	-57.6	0	0	112	T98 S102 Q219 I340 N341 T342 Y346 A370 L516	T98-M344 HydrophobicContact CG2-CB 4.01Å; S102-M344 WeakPolarHBondContact CB-O 3.44Å; S102-M344 PolarHBondContact OG-O 2.9Å; Q219-M344 HydrophobicContact CB-CE 4.19Å; Q219-M344 HydrophobicContact CG-CE 4.29Å; I340-M344 HydrophobicContact CD1-CG 4.04Å; I340-M344 HydrophobicContact CD1-SD 4.38Å; I340-M344 HydrophobicContact CG1-CG 4.3Å; I340-M344 VanDerWaalsContact O-CG 3.29Å; I340-M344 WeakPolarHBondContact O-CG 3.42Å; I340-M344 PolarHBondContact O-N 2.96Å; N341-M344 PolarHBondContact O-N 3.39Å; T342-M344 VanDerWaalsContact C-N 3.26Å; T342-M344 PolarHBondContact O-N 2.67Å; M344-Y346 PolarHBondContact O-N 3.41Å; M344-A370 HydrophobicContact CE-CB 4.49Å; M344-L516 HydrophobicContact SD-CD2 4.08Å
345	Y	91.2	Very high	91.5	Very high	6 Å²	6	5.7 Å²	5.7	2%	0.024	3%	0.03	C	C	.	.	H	α-helix	trans	-69.9	-32	-177.4	-63.8	-49.2	0	0	0	113.6	T98 V101 S102 V123 V127 N341 T342	T98-Y345 HydrophobicContact CG2-CD1 3.99Å; T98-Y345 HydrophobicContact CG2-CE1 3.59Å; V101-Y345 HydrophobicContact CB-CD1 4.36Å; V101-Y345 HydrophobicContact CG1-CD1 4.37Å; S102-Y345 VanDerWaalsContact CA-O 3.24Å; S102-Y345 WeakPolarHBondContact CA-O 3.22Å; V123-Y345 HydrophobicContact CG1-CD1 4.01Å; V123-Y345 HydrophobicContact CG1-CD2 3.23Å; V123-Y345 HydrophobicContact CG1-CE1 4.36Å; V123-Y345 HydrophobicContact CG1-CE2 3.65Å; V123-Y345 HydrophobicContact CG1-CG 3.45Å; V123-Y345 VanDerWaalsContact CG1-CG 3.45Å; V127-Y345 HydrophobicContact CG2-CE2 4.06Å; V127-Y345 VanDerWaalsContact CG2-OH 3.24Å; V127-Y345 WeakPolarHBondContact CG2-OH 3.37Å; N341-Y345 HydrophobicContact CB-CD2 4.1Å; N341-Y345 HydrophobicContact CB-CE2 3.71Å; N341-Y345 WeakPolarHBondContact O-CB 3.28Å; N341-Y345 WeakPolarHBondContact O-CD2 2.93Å; N341-Y345 VanDerWaalsContact O-CG 3.25Å; N341-Y345 PolarHBondContact O-N 3.39Å; T342-Y345 PolarHBondContact O-N 3.14Å
346	Y	91.9	Very high	91.1	Very high	0 Å²	0	5.8 Å²	5.8	0%	0	3%	0.031	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.8	17.8	-176.3	-59.1	-73.6	0	0	0	112.5	E120 V123 T342 M344 A348 T349 I350 S559 F562 L563	E120-Y346 WeakPolarHBondContact CA-OH 3.39Å; V123-Y346 HydrophobicContact CG2-CE1 4.17Å; T342-Y346 HydrophobicContact CG2-CD2 4.04Å; T342-Y346 WeakPolarHBondContact O-CB 3.43Å; T342-Y346 WeakPolarHBondContact O-CD2 3.46Å; T342-Y346 PolarHBondContact O-N 2.61Å; M344-Y346 PolarHBondContact O-N 3.41Å; Y346-A348 PolarHBondContact O-N 3.37Å; Y346-T349 CarbonylContact O-C 3.02Å; Y346-T349 WeakPolarHBondContact O-CB 3.42Å; Y346-T349 PolarHBondContact O-N 2.93Å; Y346-T349 VanDerWaalsContact O-N 3.12Å; Y346-I350 WeakPolarHBondContact O-CB 3.5Å; Y346-I350 WeakPolarHBondContact O-CG1 3.16Å; Y346-I350 PolarHBondContact O-N 3.44Å; Y346-S559 PolarHBondContact OH-O 3.32Å; Y346-F562 AromaticContact CD2-CD1 3.49Å; Y346-F562 HydrophobicContact CD2-CD1 3.49Å; Y346-F562 VanDerWaalsContact CD2-CD1 3.49Å; Y346-F562 AromaticContact CD2-CE1 3.99Å; Y346-F562 HydrophobicContact CD2-CE1 3.99Å; Y346-F562 HydrophobicContact CD2-CG 4.37Å; Y346-F562 HydrophobicContact CE2-CB 4.38Å; Y346-F562 AromaticContact CE2-CD1 3.88Å; Y346-F562 HydrophobicContact CE2-CD1 3.88Å; Y346-F562 AromaticContact CG-CD1 3.89Å; Y346-F562 HydrophobicContact CG-CD1 3.89Å; Y346-F562 AromaticContact CG-CE1 4Å; Y346-F562 HydrophobicContact CG-CE1 4Å; Y346-L563 HydrophobicContact CD1-CD2 4.43Å; Y346-L563 HydrophobicContact CE1-CD1 3.99Å; Y346-L563 HydrophobicContact CE1-CD2 4.5Å; Y346-L563 HydrophobicContact CE1-CG 4.23Å
347	S	93.4	Very high	90.5	Very high	2 Å²	2	10 Å²	10	1%	0.014	5%	0.051	C	C	.	.	H	α-helix	trans	-54.4	-50.3	-175.9	-151.6	0	0	0	0	112.6	S102 I343 I350 L351 T369	S102-S347 WeakPolarHBondContact OG-CB 3.43Å; S102-S347 PolarHBondContact OG-N 3.35Å; I343-S347 WeakPolarHBondContact O-CA 3.46Å; I343-S347 WeakPolarHBondContact O-CB 3.49Å; I343-S347 PolarHBondContact O-N 3.5Å; I343-S347 VanDerWaalsContact O-N 3.07Å; I343-S347 PolarHBondContact O-OG 2.92Å; S347-I350 PolarHBondContact O-N 3.02Å; S347-L351 WeakPolarHBondContact O-CG 3.28Å; S347-L351 PolarHBondContact O-N 3.45Å; S347-T369 PolarHBondContact OG-OG1 3.05Å
348	A	92.9	Very high	90	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-66.2	-39	178.4	0	0	0	0	0	111.7	S102 L106 Y346 L351 Q352 I363 A366	S102-A348 WeakPolarHBondContact O-CB 3.4Å; S102-A348 PolarHBondContact OG-N 2.96Å; L106-A348 HydrophobicContact CD1-CB 3.74Å; L106-A348 HydrophobicContact CG-CB 4.21Å; Y346-A348 PolarHBondContact O-N 3.37Å; A348-L351 PolarHBondContact O-N 2.96Å; A348-Q352 PolarHBondContact O-N 3.46Å; A348-I363 HydrophobicContact CB-CG1 4.43Å; A348-A366 HydrophobicContact CB-CB 3.91Å
349	T	91.3	Very high	89.6	Confident	4 Å²	4	14.7 Å²	14.7	3%	0.025	8%	0.076	C	C	.	.	H	α-helix	trans	-62.9	-41.5	174.6	-50.4	0	0	0	0	112.2	Y346 L351 Q352 M353	Y346-T349 CarbonylContact O-C 3.02Å; Y346-T349 WeakPolarHBondContact O-CB 3.42Å; Y346-T349 PolarHBondContact O-N 2.93Å; Y346-T349 VanDerWaalsContact O-N 3.12Å; T349-L351 VanDerWaalsContact C-N 3.32Å; T349-L351 PolarHBondContact O-N 2.69Å; T349-Q352 WeakPolarHBondContact O-CB 3.17Å; T349-Q352 PolarHBondContact O-N 3.39Å; T349-M353 HydrophobicContact CG2-CE 4.28Å; T349-M353 WeakPolarHBondContact O-CB 3.48Å; T349-M353 VanDerWaalsContact O-CG 3.29Å; T349-M353 WeakPolarHBondContact O-CG 3.36Å; T349-M353 PolarHBondContact O-N 2.9Å
350	I	92.7	Very high	89.4	Confident	0 Å²	0	18.8 Å²	18.8	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-64.1	-40	176.8	-68	162.5	0	0	0	110.6	I343 Y346 S347 M353 S354 F411 L512 F562 F575	I343-I350 HydrophobicContact CG1-CD1 4.41Å; Y346-I350 WeakPolarHBondContact O-CB 3.5Å; Y346-I350 WeakPolarHBondContact O-CG1 3.16Å; Y346-I350 PolarHBondContact O-N 3.44Å; S347-I350 PolarHBondContact O-N 3.02Å; I350-M353 HydrophobicContact CB-CE 4.21Å; I350-M353 HydrophobicContact CG1-CE 3.72Å; I350-M353 PolarHBondContact O-N 3.06Å; I350-S354 PolarHBondContact O-N 3.32Å; I350-F411 HydrophobicContact CG2-CE2 4.17Å; I350-F411 HydrophobicContact CG2-CZ 3.97Å; I350-L512 HydrophobicContact CG2-CD1 4.08Å; I350-L512 HydrophobicContact CG2-CD2 4.4Å; I350-F562 HydrophobicContact CD1-CE1 4.32Å; I350-F562 HydrophobicContact CD1-CZ 3.98Å; I350-F562 HydrophobicContact CG1-CE1 4.16Å; I350-F562 HydrophobicContact CG1-CZ 3.9Å; I350-F575 HydrophobicContact CD1-CE1 4.44Å; I350-F575 HydrophobicContact CD1-CZ 3.97Å; I350-F575 HydrophobicContact CG1-CZ 4.11Å; I350-F575 HydrophobicContact CG2-CE2 4.35Å; I350-F575 HydrophobicContact CG2-CZ 3.89Å
351	L	92.6	Very high	89.4	Confident	0 Å²	0	22.5 Å²	22.5	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-67.1	-37.7	174.5	-71.2	164.3	0	0	0	111.9	S347 A348 T349 S354 V356 A362 L365 A366 L509 L512	S347-L351 WeakPolarHBondContact O-CG 3.28Å; S347-L351 PolarHBondContact O-N 3.45Å; A348-L351 PolarHBondContact O-N 2.96Å; T349-L351 VanDerWaalsContact C-N 3.32Å; T349-L351 PolarHBondContact O-N 2.69Å; L351-S354 PolarHBondContact O-N 3.43Å; L351-S354 PolarHBondContact O-OG 3.31Å; L351-V356 VanDerWaalsContact O-CB 3.3Å; L351-V356 WeakPolarHBondContact O-CB 3.43Å; L351-V356 VanDerWaalsContact O-CG2 3.26Å; L351-V356 WeakPolarHBondContact O-CG2 3.2Å; L351-V356 PolarHBondContact O-N 2.94Å; L351-A362 HydrophobicContact CB-CB 4.31Å; L351-L365 HydrophobicContact CD1-CB 3.6Å; L351-A366 HydrophobicContact CD1-CB 4.21Å; L351-L509 HydrophobicContact CD2-CB 3.91Å; L351-L509 HydrophobicContact CD2-CD1 4.04Å; L351-L512 HydrophobicContact CD1-CD1 4.47Å; L351-L512 HydrophobicContact CD2-CD1 3.97Å; L351-L512 HydrophobicContact CG-CD1 3.91Å
352	Q	89.9	Confident	89.6	Confident	16 Å²	16	21.7 Å²	21.7	8%	0.075	11%	0.107	C	C	.	.	H	α-helix	trans	-63.4	-48.8	172	-167.5	-173.8	52.3	0	0	110.5	L106 A348 T349 S354 G355 D359 F499	L106-Q352 HydrophobicContact CD2-CB 4.31Å; A348-Q352 PolarHBondContact O-N 3.46Å; T349-Q352 WeakPolarHBondContact O-CB 3.17Å; T349-Q352 PolarHBondContact O-N 3.39Å; Q352-S354 PolarHBondContact O-N 3.32Å; Q352-S354 VanDerWaalsContact O-N 3.08Å; Q352-G355 PolarHBondContact O-N 3.33Å; Q352-D359 PolarHBondContact NE2-OD1 2.87Å; Q352-F499 HydrophobicContact CG-CD1 4.27Å; Q352-F499 WeakPolarHBondContact O-CB 3.39Å
353	M	87.6	Confident	89.7	Confident	10 Å²	10	21.7 Å²	21.7	5%	0.049	11%	0.107	C	C	.	.	H	α-helix	trans	-57.5	-25.8	177.1	-71.8	-173.9	-63.3	0	0	113.1	T349 I350 G355 F411 N498 F562 Y571	T349-M353 HydrophobicContact CG2-CE 4.28Å; T349-M353 WeakPolarHBondContact O-CB 3.48Å; T349-M353 VanDerWaalsContact O-CG 3.29Å; T349-M353 WeakPolarHBondContact O-CG 3.36Å; T349-M353 PolarHBondContact O-N 2.9Å; I350-M353 HydrophobicContact CB-CE 4.21Å; I350-M353 HydrophobicContact CG1-CE 3.72Å; I350-M353 PolarHBondContact O-N 3.06Å; M353-G355 PolarHBondContact O-N 2.98Å; M353-F411 HydrophobicContact CB-CE1 4.27Å; M353-N498 WeakPolarHBondContact CA-O 3.49Å; M353-F562 HydrophobicContact CE-CE1 4.18Å; M353-F562 HydrophobicContact CE-CZ 4.15Å; M353-Y571 HydrophobicContact CB-CD2 4.3Å; M353-Y571 HydrophobicContact CB-CE2 4.09Å; M353-Y571 HydrophobicContact CG-CE1 4.35Å; M353-Y571 HydrophobicContact CG-CE2 4.29Å; M353-Y571 HydrophobicContact SD-CD1 3.9Å; M353-Y571 HydrophobicContact SD-CE1 3.55Å; M353-Y571 VanDerWaalsContact SD-CE1 3.55Å; M353-Y571 HydrophobicContact SD-CE2 4.46Å
354	S	88.7	Confident	89.8	Confident	3 Å²	3	26.5 Å²	26.5	2%	0.021	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-5.2	176.9	84.5	0	0	0	0	114.2	I350 L351 Q352 T502 S505	I350-S354 PolarHBondContact O-N 3.32Å; L351-S354 PolarHBondContact O-N 3.43Å; L351-S354 PolarHBondContact O-OG 3.31Å; Q352-S354 PolarHBondContact O-N 3.32Å; Q352-S354 VanDerWaalsContact O-N 3.08Å; S354-T502 WeakPolarHBondContact O-CG2 3.18Å; S354-S505 WeakPolarHBondContact O-CA 3.02Å; S354-S505 VanDerWaalsContact O-CB 3.32Å; S354-S505 WeakPolarHBondContact O-CB 3.39Å; S354-S505 PolarHBondContact O-OG 3.3Å; S354-S505 PolarHBondContact OG-O 3.12Å
355	G	85.8	Confident	90	Very high	5 Å²	5	28 Å²	28	5%	0.052	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	107	12.1	178.4	0	0	0	0	0	115.1	Q352 M353 E357 C500 S505	Q352-G355 PolarHBondContact O-N 3.33Å; M353-G355 PolarHBondContact O-N 2.98Å; G355-E357 PolarHBondContact O-N 2.97Å; G355-C500 WeakPolarHBondContact CA-O 3.42Å; G355-S505 WeakPolarHBondContact CA-OG 3.1Å; G355-S505 PolarHBondContact O-OG 3.22Å
356	V	87.9	Confident	90.1	Very high	12 Å²	12	27.9 Å²	27.9	7%	0.073	13%	0.133	C	C	.	.			trans	-70.8	109.8	171.7	175.6	0	0	0	0	109.4	L351 L361 A362 L365	L351-V356 VanDerWaalsContact O-CB 3.3Å; L351-V356 WeakPolarHBondContact O-CB 3.43Å; L351-V356 VanDerWaalsContact O-CG2 3.26Å; L351-V356 WeakPolarHBondContact O-CG2 3.2Å; L351-V356 PolarHBondContact O-N 2.94Å; V356-L361 HydrophobicContact CG1-CB 4.05Å; V356-L361 HydrophobicContact CG1-CD2 3.48Å; V356-L361 VanDerWaalsContact CG1-CD2 3.48Å; V356-L361 HydrophobicContact CG1-CG 4.32Å; V356-L361 HydrophobicContact CG2-CD2 4.49Å; V356-A362 HydrophobicContact CB-CB 4.48Å; V356-A362 HydrophobicContact CG1-CB 3.97Å; V356-L365 HydrophobicContact CG2-CD1 4.28Å
357	E	81	Confident	90.2	Very high	94 Å²	94	28.1 Å²	28.1	44%	0.439	14%	0.135	S	C	.	.			trans	-70.9	-35.9	-172.7	-52.1	-175.3	169.9	0	0	113.6	G355 M456 F499	G355-E357 PolarHBondContact O-N 2.97Å; E357-M456 WeakPolarHBondContact OE1-CE 3.23Å; E357-F499 HydrophobicContact CB-CE2 4.19Å; E357-F499 HydrophobicContact CB-CZ 4.24Å; E357-F499 HydrophobicContact CG-CE2 3.86Å; E357-F499 HydrophobicContact CG-CZ 4.38Å
358	D	85.1	Confident	90.3	Very high	83 Å²	83	31 Å²	31	44%	0.444	15%	0.153	S	C	.	.			trans	-92.2	115.9	-177.8	-175.4	0.6	0	0	0	111.1	R360 L361 A362	D358-R360 PolarHBondContact O-N 3.34Å; D358-R360 VanDerWaalsContact O-N 3.14Å; D358-R360 WeakPolarHBondContact OD1-CB 3.41Å; D358-R360 PolarHBondContact OD1-N 2.88Å; D358-L361 HydrophobicContact CB-CB 3.95Å; D358-L361 WeakPolarHBondContact O-CB 3.48Å; D358-L361 PolarHBondContact O-N 2.89Å; D358-A362 PolarHBondContact O-N 2.91Å
359	D	85	Confident	90.3	Very high	33 Å²	33	31.1 Å²	31.1	18%	0.176	15%	0.153	C	C	.	.	H	α-helix	trans	-47.6	-41.4	172.7	-63.8	-23.4	0	0	0	111.6	R110 Q352 A362 I363	R110-D359 IonicContact CZ-OD2 2.74Å; R110-D359 IonicContact NH1-OD2 2.76Å; R110-D359 PolarHBondContact NH1-OD2 3.36Å; Q352-D359 PolarHBondContact NE2-OD1 2.87Å; D359-A362 PolarHBondContact O-N 3.12Å; D359-I363 VanDerWaalsContact O-CG1 3.24Å; D359-I363 WeakPolarHBondContact O-CG1 3.33Å; D359-I363 PolarHBondContact O-N 3.39Å
360	R	89.2	Confident	90.4	Very high	87 Å²	87	31 Å²	31	33%	0.328	15%	0.152	S	C	.	.	H	α-helix	trans	-68.1	-42.4	-177.1	-60.2	171	-179.8	167.7	1.8	110.9	D358 A362 I363 W364	D358-R360 PolarHBondContact O-N 3.34Å; D358-R360 VanDerWaalsContact O-N 3.14Å; D358-R360 WeakPolarHBondContact OD1-CB 3.41Å; D358-R360 PolarHBondContact OD1-N 2.88Å; R360-A362 VanDerWaalsContact C-N 3.32Å; R360-I363 PolarHBondContact O-N 3.34Å; R360-W364 VanDerWaalsContact O-CD1 3.26Å; R360-W364 PolarHBondContact O-N 3.32Å
361	L	90.8	Very high	90.6	Very high	91 Å²	91	35.2 Å²	35.2	48%	0.476	17%	0.171	S	C	.	.	H	α-helix	trans	-62.2	-44.1	175.8	-166.5	106.7	0	0	0	109.9	V356 D358 I363 W364 L365	V356-L361 HydrophobicContact CG1-CB 4.05Å; V356-L361 HydrophobicContact CG1-CD2 3.48Å; V356-L361 VanDerWaalsContact CG1-CD2 3.48Å; V356-L361 HydrophobicContact CG1-CG 4.32Å; V356-L361 HydrophobicContact CG2-CD2 4.49Å; D358-L361 HydrophobicContact CB-CB 3.95Å; D358-L361 WeakPolarHBondContact O-CB 3.48Å; D358-L361 PolarHBondContact O-N 2.89Å; L361-I363 VanDerWaalsContact C-N 3.35Å; L361-I363 PolarHBondContact O-N 3.04Å; L361-W364 PolarHBondContact O-N 3.26Å; L361-L365 HydrophobicContact CD2-CD1 3.74Å; L361-L365 HydrophobicContact CD2-CG 4.41Å; L361-L365 HydrophobicContact CG-CD1 4.19Å; L361-L365 HydrophobicContact CG-CG 4.34Å; L361-L365 WeakPolarHBondContact O-CB 3.47Å; L361-L365 VanDerWaalsContact O-CG 3.22Å; L361-L365 WeakPolarHBondContact O-CG 3.44Å; L361-L365 PolarHBondContact O-N 3.06Å
362	A	90.9	Very high	90.7	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-59.1	-42.9	177.2	0	0	0	0	0	112.4	L106 L351 V356 D358 D359 R360 L365 A366	L106-A362 HydrophobicContact CD1-CB 4.13Å; L351-A362 HydrophobicContact CB-CB 4.31Å; V356-A362 HydrophobicContact CB-CB 4.48Å; V356-A362 HydrophobicContact CG1-CB 3.97Å; D358-A362 PolarHBondContact O-N 2.91Å; D359-A362 PolarHBondContact O-N 3.12Å; R360-A362 VanDerWaalsContact C-N 3.32Å; A362-L365 PolarHBondContact O-N 3.48Å; A362-A366 WeakPolarHBondContact O-CB 3.47Å; A362-A366 PolarHBondContact O-N 3.46Å
363	I	92.8	Very high	90.8	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.005	17%	0.174	C	C	.	.	H	α-helix	trans	-65.6	-43.6	177	-64.4	166.1	0	0	0	111.6	L106 L107 D226 A348 D359 R360 L361 A366 S367	L106-I363 HydrophobicContact CD1-CG1 4.03Å; L107-I363 HydrophobicContact CD1-CD1 3.69Å; D226-I363 HydrophobicContact CB-CG2 3.66Å; A348-I363 HydrophobicContact CB-CG1 4.43Å; D359-I363 VanDerWaalsContact O-CG1 3.24Å; D359-I363 WeakPolarHBondContact O-CG1 3.33Å; D359-I363 PolarHBondContact O-N 3.39Å; R360-I363 PolarHBondContact O-N 3.34Å; L361-I363 VanDerWaalsContact C-N 3.35Å; L361-I363 PolarHBondContact O-N 3.04Å; I363-A366 WeakPolarHBondContact O-CB 3.21Å; I363-A366 PolarHBondContact O-N 3.42Å; I363-S367 PolarHBondContact O-N 2.94Å; I363-S367 PolarHBondContact O-OG 3.02Å
364	W	94.8	Very high	91.1	Very high	102 Å²	102	37.3 Å²	37.3	39%	0.386	18%	0.181	S	C	.	.	H	α-helix	trans	-66.8	-37.7	176.5	-84.2	108.9	0	0	0	112.5	R360 L361 A366 S367 V368	R360-W364 VanDerWaalsContact O-CD1 3.26Å; R360-W364 PolarHBondContact O-N 3.32Å; L361-W364 PolarHBondContact O-N 3.26Å; W364-A366 VanDerWaalsContact C-N 3.34Å; W364-S367 VanDerWaalsContact O-CB 3.24Å; W364-S367 WeakPolarHBondContact O-CB 3.27Å; W364-S367 PolarHBondContact O-N 3.34Å; W364-S367 VanDerWaalsContact O-N 3.1Å; W364-V368 PolarHBondContact O-N 3.25Å
365	L	94.1	Very high	91.3	Very high	38 Å²	38	40.4 Å²	40.4	20%	0.199	20%	0.197	C	C	.	.	H	α-helix	trans	-65.4	-37.1	173.4	-73	-177.9	0	0	0	111.8	L351 V356 L361 A362 S367 V368 T369 L509	L351-L365 HydrophobicContact CD1-CB 3.6Å; V356-L365 HydrophobicContact CG2-CD1 4.28Å; L361-L365 HydrophobicContact CD2-CD1 3.74Å; L361-L365 HydrophobicContact CD2-CG 4.41Å; L361-L365 HydrophobicContact CG-CD1 4.19Å; L361-L365 HydrophobicContact CG-CG 4.34Å; L361-L365 WeakPolarHBondContact O-CB 3.47Å; L361-L365 VanDerWaalsContact O-CG 3.22Å; L361-L365 WeakPolarHBondContact O-CG 3.44Å; L361-L365 PolarHBondContact O-N 3.06Å; A362-L365 PolarHBondContact O-N 3.48Å; L365-S367 PolarHBondContact O-N 3.31Å; L365-V368 WeakPolarHBondContact O-CB 3.47Å; L365-V368 PolarHBondContact O-N 2.77Å; L365-V368 VanDerWaalsContact O-N 3.11Å; L365-T369 PolarHBondContact O-N 3.39Å; L365-L509 HydrophobicContact CB-CD1 4.21Å; L365-L509 HydrophobicContact CD1-CD2 4.32Å; L365-L509 HydrophobicContact CD2-CD1 4.28Å; L365-L509 HydrophobicContact CD2-CD2 3.64Å; L365-L509 HydrophobicContact CG-CD2 4.48Å
366	A	93.4	Very high	91.7	Very high	4 Å²	4	43.5 Å²	43.5	3%	0.033	21%	0.209	C	C	.	.	H	α-helix	trans	-64	-29.3	170.3	0	0	0	0	0	112.5	A348 L351 A362 I363 W364 V368 T369 A370	A348-A366 HydrophobicContact CB-CB 3.91Å; L351-A366 HydrophobicContact CD1-CB 4.21Å; A362-A366 WeakPolarHBondContact O-CB 3.47Å; A362-A366 PolarHBondContact O-N 3.46Å; I363-A366 WeakPolarHBondContact O-CB 3.21Å; I363-A366 PolarHBondContact O-N 3.42Å; W364-A366 VanDerWaalsContact C-N 3.34Å; A366-V368 VanDerWaalsContact C-N 3.29Å; A366-V368 PolarHBondContact O-N 2.72Å; A366-T369 WeakPolarHBondContact CA-OG1 3.35Å; A366-T369 PolarHBondContact O-N 3.33Å; A366-T369 PolarHBondContact O-OG1 3.18Å; A366-A370 PolarHBondContact O-N 2.62Å
367	S	94.4	Very high	91.8	Very high	6 Å²	6	43.4 Å²	43.4	4%	0.042	21%	0.208	C	C	.	.	H	α-helix	trans	-66.1	-33.6	172.1	-56.6	0	0	0	0	112.3	S223 I363 W364 L365 A370 F371	S223-S367 VanDerWaalsContact C-OG 3.22Å; S223-S367 WeakPolarHBondContact CB-OG 3.44Å; S223-S367 PolarHBondContact O-OG 3.45Å; I363-S367 PolarHBondContact O-N 2.94Å; I363-S367 PolarHBondContact O-OG 3.02Å; W364-S367 VanDerWaalsContact O-CB 3.24Å; W364-S367 WeakPolarHBondContact O-CB 3.27Å; W364-S367 PolarHBondContact O-N 3.34Å; W364-S367 VanDerWaalsContact O-N 3.1Å; L365-S367 PolarHBondContact O-N 3.31Å; S367-A370 PolarHBondContact O-N 2.88Å; S367-F371 WeakPolarHBondContact O-CB 3.49Å; S367-F371 PolarHBondContact O-N 3.2Å
368	V	95.1	Very high	92.1	Very high	63 Å²	63	43.3 Å²	43.3	38%	0.382	21%	0.21	S	C	.	.	H	α-helix	trans	-67.3	-39.1	174.9	178.7	0	0	0	0	111.2	W364 L365 A366 F371 T372 I513	W364-V368 PolarHBondContact O-N 3.25Å; L365-V368 WeakPolarHBondContact O-CB 3.47Å; L365-V368 PolarHBondContact O-N 2.77Å; L365-V368 VanDerWaalsContact O-N 3.11Å; A366-V368 VanDerWaalsContact C-N 3.29Å; A366-V368 PolarHBondContact O-N 2.72Å; V368-F371 PolarHBondContact O-N 3.42Å; V368-T372 PolarHBondContact O-N 2.9Å; V368-T372 PolarHBondContact O-OG1 3.38Å; V368-I513 HydrophobicContact CG1-CD1 4.14Å
369	T	93.1	Very high	92.3	Very high	1 Å²	1	41.3 Å²	41.3	1%	0.006	21%	0.206	C	C	.	.	H	α-helix	trans	-65.4	-46.9	175.9	64.2	0	0	0	0	110.3	S347 L365 A366 F371 T372 N373 L509 L512 I513 L516	S347-T369 PolarHBondContact OG-OG1 3.05Å; L365-T369 PolarHBondContact O-N 3.39Å; A366-T369 WeakPolarHBondContact CA-OG1 3.35Å; A366-T369 PolarHBondContact O-N 3.33Å; A366-T369 PolarHBondContact O-OG1 3.18Å; T369-F371 PolarHBondContact O-N 2.89Å; T369-T372 WeakPolarHBondContact O-CB 3.06Å; T369-T372 PolarHBondContact O-N 3.45Å; T369-T372 VanDerWaalsContact O-N 3.14Å; T369-N373 PolarHBondContact O-N 2.94Å; T369-L509 HydrophobicContact CG2-CD1 4.17Å; T369-L512 HydrophobicContact CG2-CB 3.92Å; T369-L512 HydrophobicContact CG2-CD1 4.4Å; T369-I513 HydrophobicContact CG2-CG1 4.41Å; T369-L516 WeakPolarHBondContact O-CD1 3.46Å
370	A	94.4	Very high	92.3	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.008	20%	0.197	C	C	.	.	H	α-helix	trans	-60.7	-40.4	175.8	0	0	0	0	0	113.2	S223 M344 A366 S367 T372 N373 F374	S223-A370 WeakPolarHBondContact OG-CB 3.48Å; M344-A370 HydrophobicContact CE-CB 4.49Å; A366-A370 PolarHBondContact O-N 2.62Å; S367-A370 PolarHBondContact O-N 2.88Å; A370-T372 VanDerWaalsContact C-N 3.34Å; A370-T372 PolarHBondContact O-N 3.3Å; A370-N373 WeakPolarHBondContact O-CB 3.35Å; A370-N373 PolarHBondContact O-N 2.85Å; A370-F374 PolarHBondContact O-N 3.5Å; A370-F374 VanDerWaalsContact O-N 3.08Å
371	F	95.3	Very high	91.9	Very high	90 Å²	90	38.5 Å²	38.5	40%	0.395	20%	0.199	S	C	.	.	H	α-helix	trans	-60.9	-42.7	174	-179.5	-110.8	0	0	0	112.2	F220 S367 V368 T369 N373 F374 I375	F220-F371 HydrophobicContact CD1-CD2 4.38Å; F220-F371 HydrophobicContact CD2-CB 3.61Å; F220-F371 HydrophobicContact CD2-CD2 4.01Å; F220-F371 HydrophobicContact CD2-CG 4.3Å; F220-F371 HydrophobicContact CE1-CD2 4.06Å; F220-F371 HydrophobicContact CE2-CB 3.62Å; F220-F371 AromaticContact CE2-CD2 3.66Å; F220-F371 HydrophobicContact CE2-CD2 3.66Å; F220-F371 HydrophobicContact CE2-CG 4.01Å; F220-F371 HydrophobicContact CG-CB 4.48Å; F220-F371 HydrophobicContact CG-CD2 4.36Å; F220-F371 HydrophobicContact CZ-CB 4.49Å; F220-F371 AromaticContact CZ-CD2 3.68Å; F220-F371 HydrophobicContact CZ-CD2 3.68Å; F220-F371 HydrophobicContact CZ-CE2 4.39Å; F220-F371 HydrophobicContact CZ-CG 4.44Å; S367-F371 WeakPolarHBondContact O-CB 3.49Å; S367-F371 PolarHBondContact O-N 3.2Å; V368-F371 PolarHBondContact O-N 3.42Å; T369-F371 PolarHBondContact O-N 2.89Å; F371-N373 VanDerWaalsContact C-N 3.33Å; F371-N373 PolarHBondContact O-N 3.41Å; F371-F374 WeakPolarHBondContact O-CB 3.41Å; F371-F374 PolarHBondContact O-N 3.22Å; F371-I375 HydrophobicContact CD1-CG1 4.36Å; F371-I375 HydrophobicContact CD2-CG1 4.32Å; F371-I375 HydrophobicContact CE1-CG1 3.87Å; F371-I375 HydrophobicContact CE2-CD1 3.97Å; F371-I375 HydrophobicContact CE2-CG1 3.82Å; F371-I375 HydrophobicContact CZ-CD1 3.86Å; F371-I375 HydrophobicContact CZ-CG1 3.58Å; F371-I375 PolarHBondContact O-N 3.48Å
372	T	94.8	Very high	91.5	Very high	15 Å²	15	41.6 Å²	41.6	9%	0.092	21%	0.205	C	C	.	.	H	α-helix	trans	-59	-46.4	176	-57.5	0	0	0	0	110.4	V368 T369 A370 F374 I375 F376 I513 L516 V517	V368-T372 PolarHBondContact O-N 2.9Å; V368-T372 PolarHBondContact O-OG1 3.38Å; T369-T372 WeakPolarHBondContact O-CB 3.06Å; T369-T372 PolarHBondContact O-N 3.45Å; T369-T372 VanDerWaalsContact O-N 3.14Å; A370-T372 VanDerWaalsContact C-N 3.34Å; A370-T372 PolarHBondContact O-N 3.3Å; T372-F374 VanDerWaalsContact C-N 3.32Å; T372-F374 PolarHBondContact O-N 3.29Å; T372-I375 PolarHBondContact O-N 3.03Å; T372-F376 HydrophobicContact CG2-CD2 3.69Å; T372-F376 HydrophobicContact CG2-CE2 3.98Å; T372-F376 WeakPolarHBondContact O-CD2 3.35Å; T372-F376 PolarHBondContact O-N 2.86Å; T372-I513 HydrophobicContact CG2-CG2 4.2Å; T372-L516 HydrophobicContact CG2-CB 4.21Å; T372-V517 HydrophobicContact CG2-CG2 3.72Å
373	N	93.1	Very high	91.3	Very high	9 Å²	9	44.1 Å²	44.1	5%	0.048	22%	0.218	C	C	.	.	H	α-helix	trans	-56.9	-45	176.4	-171.5	39.2	0	0	0	112	Q219 T369 A370 F371 T377 L516 A520	Q219-N373 PolarHBondContact OE1-ND2 2.99Å; T369-N373 PolarHBondContact O-N 2.94Å; A370-N373 WeakPolarHBondContact O-CB 3.35Å; A370-N373 PolarHBondContact O-N 2.85Å; F371-N373 VanDerWaalsContact C-N 3.33Å; F371-N373 PolarHBondContact O-N 3.41Å; N373-T377 VanDerWaalsContact O-CB 3.28Å; N373-T377 WeakPolarHBondContact O-CB 3.36Å; N373-T377 PolarHBondContact O-N 3.09Å; N373-T377 PolarHBondContact O-OG1 3.06Å; N373-L516 HydrophobicContact CB-CD1 4.31Å; N373-L516 HydrophobicContact CB-CD2 4.27Å; N373-A520 VanDerWaalsContact OD1-CB 3.29Å; N373-A520 WeakPolarHBondContact OD1-CB 3.35Å
374	F	93.2	Very high	90.7	Very high	45 Å²	45	45 Å²	45	20%	0.197	22%	0.223	C	C	.	.	H	α-helix	trans	-60.5	-50.7	178.8	177.1	-112.3	0	0	0	112.8	L213 T216 F220 A370 F371 T372 T377 L378	L213-F374 HydrophobicContact CD2-CE2 3.85Å; L213-F374 HydrophobicContact CD2-CZ 4.21Å; L213-F374 HydrophobicContact CG-CE2 3.83Å; L213-F374 HydrophobicContact CG-CZ 4.41Å; T216-F374 WeakPolarHBondContact OG1-CD2 3.26Å; F220-F374 HydrophobicContact CB-CB 4.4Å; A370-F374 PolarHBondContact O-N 3.5Å; A370-F374 VanDerWaalsContact O-N 3.08Å; F371-F374 WeakPolarHBondContact O-CB 3.41Å; F371-F374 PolarHBondContact O-N 3.22Å; T372-F374 VanDerWaalsContact C-N 3.32Å; T372-F374 PolarHBondContact O-N 3.29Å; F374-T377 PolarHBondContact O-N 3.06Å; F374-L378 PolarHBondContact O-N 3.36Å
375	I	94.1	Very high	90	Very high	69 Å²	69	47.4 Å²	47.4	35%	0.354	24%	0.239	S	C	.	.	H	α-helix	trans	-65.4	-44.2	-178.3	-65.3	-61.9	0	0	0	111.8	F371 T372 T377 L378 A379	F371-I375 HydrophobicContact CD1-CG1 4.36Å; F371-I375 HydrophobicContact CD2-CG1 4.32Å; F371-I375 HydrophobicContact CE1-CG1 3.87Å; F371-I375 HydrophobicContact CE2-CD1 3.97Å; F371-I375 HydrophobicContact CE2-CG1 3.82Å; F371-I375 HydrophobicContact CZ-CD1 3.86Å; F371-I375 HydrophobicContact CZ-CG1 3.58Å; F371-I375 PolarHBondContact O-N 3.48Å; T372-I375 PolarHBondContact O-N 3.03Å; I375-T377 VanDerWaalsContact C-N 3.32Å; I375-T377 PolarHBondContact O-N 3.28Å; I375-L378 WeakPolarHBondContact O-CB 3.28Å; I375-L378 PolarHBondContact O-N 2.9Å; I375-A379 PolarHBondContact O-N 3.42Å; I375-A379 VanDerWaalsContact O-N 3.09Å
376	F	93.3	Very high	89.5	Confident	70 Å²	70	51.7 Å²	51.7	31%	0.307	26%	0.256	S	S	.	.	H	α-helix	trans	-75.2	-22.5	-179	-79.8	-85.4	0	0	0	113.1	T372 A379 G380 V517 A520	T372-F376 HydrophobicContact CG2-CD2 3.69Å; T372-F376 HydrophobicContact CG2-CE2 3.98Å; T372-F376 WeakPolarHBondContact O-CD2 3.35Å; T372-F376 PolarHBondContact O-N 2.86Å; F376-A379 PolarHBondContact O-N 2.79Å; F376-G380 PolarHBondContact O-N 2.96Å; F376-V517 HydrophobicContact CD1-CG1 4.13Å; F376-V517 HydrophobicContact CD2-CB 4.48Å; F376-V517 HydrophobicContact CD2-CG2 3.98Å; F376-V517 HydrophobicContact CE1-CB 4.4Å; F376-V517 HydrophobicContact CE1-CG1 3.71Å; F376-V517 HydrophobicContact CE1-CG2 4.37Å; F376-V517 HydrophobicContact CE2-CB 4.36Å; F376-V517 HydrophobicContact CE2-CG1 4.41Å; F376-V517 HydrophobicContact CE2-CG2 3.58Å; F376-V517 HydrophobicContact CZ-CB 4.3Å; F376-V517 HydrophobicContact CZ-CG1 3.87Å; F376-V517 HydrophobicContact CZ-CG2 3.79Å; F376-A520 HydrophobicContact CB-CB 3.79Å
377	T	89.6	Confident	89.3	Confident	9 Å²	9	54.3 Å²	54.3	6%	0.055	27%	0.271	C	S	.	.	H	α-helix	trans	-64	-43.2	167.3	-61.4	0	0	0	0	110.9	T212 T216 N373 F374 I375 A379 G380 V381	T212-T377 HydrophobicContact CG2-CG2 4.13Å; T216-T377 HydrophobicContact CG2-CG2 4.12Å; N373-T377 VanDerWaalsContact O-CB 3.28Å; N373-T377 WeakPolarHBondContact O-CB 3.36Å; N373-T377 PolarHBondContact O-N 3.09Å; N373-T377 PolarHBondContact O-OG1 3.06Å; F374-T377 PolarHBondContact O-N 3.06Å; I375-T377 VanDerWaalsContact C-N 3.32Å; I375-T377 PolarHBondContact O-N 3.28Å; T377-A379 VanDerWaalsContact C-N 3.33Å; T377-A379 PolarHBondContact O-N 3.38Å; T377-G380 WeakPolarHBondContact O-CA 3.24Å; T377-G380 PolarHBondContact O-N 2.79Å; T377-G380 VanDerWaalsContact O-N 3.13Å; T377-V381 PolarHBondContact O-N 3.17Å
378	L	88.1	Confident	88.8	Confident	92 Å²	92	54 Å²	54	48%	0.482	27%	0.269	S	S	.	.	H	α-helix	trans	-61.8	-41.7	174.9	-177.5	66.6	0	0	0	111.5	L213 F374 I375 G380 V381	L213-L378 HydrophobicContact CD1-CD1 3.78Å; F374-L378 PolarHBondContact O-N 3.36Å; I375-L378 WeakPolarHBondContact O-CB 3.28Å; I375-L378 PolarHBondContact O-N 2.9Å; L378-G380 VanDerWaalsContact C-N 3.29Å; L378-G380 PolarHBondContact O-N 3.41Å; L378-V381 PolarHBondContact O-N 3.13Å
379	A	88.4	Confident	88.4	Confident	42 Å²	42	53.2 Å²	53.2	35%	0.347	26%	0.259	S	S	.	.	H	α-helix	trans	-61.5	-38.5	173.7	0	0	0	0	0	111.9	I375 F376 T377 V381 W382 L383	I375-A379 PolarHBondContact O-N 3.42Å; I375-A379 VanDerWaalsContact O-N 3.09Å; F376-A379 PolarHBondContact O-N 2.79Å; T377-A379 VanDerWaalsContact C-N 3.33Å; T377-A379 PolarHBondContact O-N 3.38Å; A379-V381 PolarHBondContact O-N 3.3Å; A379-W382 PolarHBondContact O-N 3.18Å; A379-L383 WeakPolarHBondContact O-CB 3.45Å; A379-L383 PolarHBondContact O-N 3.27Å
380	G	85.5	Confident	88.2	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-54.4	-48.4	175.7	0	0	0	0	0	113	F376 T377 L378 W382 L383 V384 P521	F376-G380 PolarHBondContact O-N 2.96Å; T377-G380 WeakPolarHBondContact O-CA 3.24Å; T377-G380 PolarHBondContact O-N 2.79Å; T377-G380 VanDerWaalsContact O-N 3.13Å; L378-G380 VanDerWaalsContact C-N 3.29Å; L378-G380 PolarHBondContact O-N 3.41Å; G380-W382 PolarHBondContact O-N 3.22Å; G380-L383 PolarHBondContact O-N 3.09Å; G380-V384 WeakPolarHBondContact O-CG2 3.41Å; G380-V384 PolarHBondContact O-N 3.42Å; G380-P521 VanDerWaalsContact CA-CA 3.5Å; G380-P521 WeakPolarHBondContact CA-O 3.25Å
381	V	81.1	Confident	88.1	Confident	61 Å²	61	64.5 Å²	64.5	37%	0.37	31%	0.305	S	S	.	.	H	α-helix	trans	-53	-44.5	179.4	178.5	0	0	0	0	111.8	T209 T377 L378 A379	T209-V381 HydrophobicContact CG2-CB 4.17Å; T209-V381 HydrophobicContact CG2-CG1 3.74Å; T209-V381 HydrophobicContact CG2-CG2 3.28Å; T377-V381 PolarHBondContact O-N 3.17Å; L378-V381 PolarHBondContact O-N 3.13Å; A379-V381 PolarHBondContact O-N 3.3Å
382	W	82.4	Confident	88	Confident	155 Å²	155	60.8 Å²	60.8	59%	0.587	29%	0.29	S	S	*	.	H	α-helix	trans	-71.6	-36.6	177.2	178	85.7	0	0	0	112.9	A379 G380 K386	A379-W382 PolarHBondContact O-N 3.18Å; G380-W382 PolarHBondContact O-N 3.22Å; W382-K386 HydrophobicContact CH2-CD 3.83Å; W382-K386 HydrophobicContact CZ2-CD 3.74Å; W382-K386 HydrophobicContact CZ3-CD 4.24Å
383	L	85.9	Confident	87.9	Confident	54 Å²	54	60 Å²	60	28%	0.283	29%	0.285	S	S	.	.	H	α-helix	trans	-73.8	-31.1	-174.7	-152.2	65.7	0	0	0	112.7	A379 G380 E385 K386 V387 L392	A379-L383 WeakPolarHBondContact O-CB 3.45Å; A379-L383 PolarHBondContact O-N 3.27Å; G380-L383 PolarHBondContact O-N 3.09Å; L383-E385 VanDerWaalsContact C-N 3.34Å; L383-E385 PolarHBondContact O-N 2.67Å; L383-K386 PolarHBondContact O-N 3.07Å; L383-V387 HydrophobicContact CD1-CG2 3.95Å; L383-V387 HydrophobicContact CG-CG2 3.81Å; L383-V387 PolarHBondContact O-N 2.91Å; L383-L392 HydrophobicContact CB-CD2 4.46Å; L383-L392 HydrophobicContact CD2-CD1 3.6Å; L383-L392 HydrophobicContact CG-CD1 4.14Å
384	V	80.8	Confident	88	Confident	18 Å²	18	63.4 Å²	63.4	11%	0.109	30%	0.299	C	S	.	.	H	α-helix	trans	-56.5	-45.3	179.1	168.4	0	0	0	0	112.2	G380 G388 L392 M526	G380-V384 WeakPolarHBondContact O-CG2 3.41Å; G380-V384 PolarHBondContact O-N 3.42Å; V384-G388 PolarHBondContact O-N 3.11Å; V384-L392 HydrophobicContact CB-CD2 4.23Å; V384-L392 HydrophobicContact CG2-CD2 3.43Å; V384-L392 VanDerWaalsContact CG2-CD2 3.43Å; V384-M526 HydrophobicContact CB-CE 4.2Å; V384-M526 HydrophobicContact CG1-CE 3.94Å; V384-M526 HydrophobicContact CG1-SD 4.36Å; V384-M526 HydrophobicContact CG2-CE 3.12Å; V384-M526 HydrophobicContact CG2-SD 3.85Å
385	E	79.5	Confident	88.1	Confident	153 Å²	153	63 Å²	63	72%	0.715	31%	0.308	S	S	*	.	H	α-helix	trans	-69.8	-36.7	-179.1	-64.6	-169.6	162	0	0	111.6	L383 K597	L383-E385 VanDerWaalsContact C-N 3.34Å; L383-E385 PolarHBondContact O-N 2.67Å; E385-K597 WeakPolarHBondContact O-CE 3.46Å; E385-K597 PolarHBondContact O-NZ 3.15Å
386	K	84.6	Confident	88.2	Confident	129 Å²	129	60 Å²	60	56%	0.561	29%	0.293	S	S	*	.	H	α-helix	trans	-76	-52.5	-179	-73.9	-163.2	174	-169.9	0	113.3	W382 L383 K597	W382-K386 HydrophobicContact CH2-CD 3.83Å; W382-K386 HydrophobicContact CZ2-CD 3.74Å; W382-K386 HydrophobicContact CZ3-CD 4.24Å; L383-K386 PolarHBondContact O-N 3.07Å; K386-K597 PolarHBondContact O-NZ 2.71Å
387	V	87.7	Confident	88.3	Confident	58 Å²	58	56.6 Å²	56.6	35%	0.352	28%	0.278	S	S	.	.	H	α-helix	trans	-84.1	-31.1	-168.3	177.7	0	0	0	0	112.6	L383 K391 L392	L383-V387 HydrophobicContact CD1-CG2 3.95Å; L383-V387 HydrophobicContact CG-CG2 3.81Å; L383-V387 PolarHBondContact O-N 2.91Å; V387-K391 HydrophobicContact CG1-CB 3.79Å; V387-L392 HydrophobicContact CG1-CB 4.23Å
388	G	84.4	Confident	88.7	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	29%	0.288	C	S	.	.			trans	94	161.6	-169.7	0	0	0	0	0	112.6	V384 L392	V384-G388 PolarHBondContact O-N 3.11Å; G388-L392 WeakPolarHBondContact O-CB 3.41Å; G388-L392 PolarHBondContact O-N 2.89Å
389	R	86.5	Confident	89.1	Confident	47 Å²	47	53.8 Å²	53.8	18%	0.177	27%	0.27	C	S	.	.	H	α-helix	trans	-76.5	-46	-167.4	-72.1	73	164.1	157	1.6	110.7	T393 M526 V530 E533 E595	R389-T393 WeakPolarHBondContact O-CB 3.36Å; R389-T393 PolarHBondContact O-N 3.37Å; R389-T393 PolarHBondContact O-OG1 3.03Å; R389-M526 HydrophobicContact CB-SD 4.35Å; R389-M526 HydrophobicContact CG-SD 4.15Å; R389-V530 HydrophobicContact CB-CG2 4.16Å; R389-V530 HydrophobicContact CG-CG2 4.37Å; R389-E533 IonicContact CZ-OE1 3.73Å; R389-E533 IonicContact NE-OE1 2.9Å; R389-E533 PolarHBondContact NE-OE1 2.91Å; R389-E533 IonicContact NE-OE2 3.58Å; R389-E533 PolarHBondContact NE-OE2 3.16Å; R389-E533 IonicContact NH2-OE1 2.88Å; R389-E533 PolarHBondContact NH2-OE1 3.5Å; R389-E595 PolarHBondContact N-OE1 3.3Å
390	R	90.1	Very high	89.5	Confident	89 Å²	89	51.8 Å²	51.8	34%	0.336	25%	0.253	S	S	.	.	H	α-helix	trans	-65.2	-51.8	-176.2	-176.9	-174.5	-178.2	-174.6	2.8	111.1	L392 T393 F394 Y590 L593 E595	R390-L392 VanDerWaalsContact C-N 3.34Å; R390-L392 PolarHBondContact O-N 2.82Å; R390-T393 PolarHBondContact O-N 3.24Å; R390-F394 WeakPolarHBondContact O-CB 3.29Å; R390-F394 PolarHBondContact O-N 3.46Å; R390-Y590 PolarHBondContact NH2-O 3.33Å; R390-L593 HydrophobicContact CB-CD2 4.39Å; R390-L593 HydrophobicContact CB-CG 4.47Å; R390-L593 WeakPolarHBondContact CD-O 3.26Å; R390-L593 HydrophobicContact CG-CD2 4.3Å; R390-L593 HydrophobicContact CG-CG 4.27Å; R390-L593 WeakPolarHBondContact CG-O 3.11Å; R390-L593 PolarHBondContact NE-O 2.87Å; R390-E595 HydrophobicContact CB-CB 4.24Å; R390-E595 WeakPolarHBondContact CB-OE2 3.31Å; R390-E595 PolarHBondContact N-OE2 2.89Å
391	K	91.8	Very high	90.1	Very high	149 Å²	149	52.4 Å²	52.4	65%	0.648	26%	0.257	S	S	*	.	H	α-helix	trans	-61.7	-41.4	-178.4	-68	-179.3	-177	177.7	0	112	V387 G395	V387-K391 HydrophobicContact CG1-CB 3.79Å; K391-G395 PolarHBondContact O-N 3.06Å
392	L	92.3	Very high	90.8	Very high	12 Å²	12	53.4 Å²	53.4	6%	0.063	26%	0.263	C	S	.	.	H	α-helix	trans	-67.7	-45.3	178.5	-179.1	59.5	0	0	0	112.2	L383 V384 V387 G388 R390 G395 S396 M526	L383-L392 HydrophobicContact CB-CD2 4.46Å; L383-L392 HydrophobicContact CD2-CD1 3.6Å; L383-L392 HydrophobicContact CG-CD1 4.14Å; V384-L392 HydrophobicContact CB-CD2 4.23Å; V384-L392 HydrophobicContact CG2-CD2 3.43Å; V384-L392 VanDerWaalsContact CG2-CD2 3.43Å; V387-L392 HydrophobicContact CG1-CB 4.23Å; G388-L392 WeakPolarHBondContact O-CB 3.41Å; G388-L392 PolarHBondContact O-N 2.89Å; R390-L392 VanDerWaalsContact C-N 3.34Å; R390-L392 PolarHBondContact O-N 2.82Å; L392-G395 PolarHBondContact O-N 3.09Å; L392-S396 WeakPolarHBondContact O-CB 3.41Å; L392-S396 PolarHBondContact O-N 3.3Å; L392-M526 HydrophobicContact CD2-CG 4.49Å; L392-M526 HydrophobicContact CD2-SD 4.31Å
393	T	93.1	Very high	91.5	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-63.6	-43.8	178.7	-47.5	0	0	0	0	111	L331 R389 R390 S396 L397 M523 M526 I589 L593	L331-T393 HydrophobicContact CD2-CG2 4.38Å; R389-T393 WeakPolarHBondContact O-CB 3.36Å; R389-T393 PolarHBondContact O-N 3.37Å; R389-T393 PolarHBondContact O-OG1 3.03Å; R390-T393 PolarHBondContact O-N 3.24Å; T393-S396 PolarHBondContact O-N 2.89Å; T393-L397 PolarHBondContact O-N 2.87Å; T393-M523 HydrophobicContact CG2-SD 3.5Å; T393-M523 VanDerWaalsContact CG2-SD 3.5Å; T393-M526 HydrophobicContact CG2-CB 4.16Å; T393-M526 WeakPolarHBondContact OG1-CB 3.47Å; T393-M526 WeakPolarHBondContact OG1-CG 3.33Å; T393-I589 HydrophobicContact CG2-CD1 3.8Å; T393-L593 HydrophobicContact CG2-CD2 4.44Å
394	F	95	Very high	92	Very high	79 Å²	79	43.5 Å²	43.5	35%	0.346	22%	0.222	S	C	.	.	H	α-helix	trans	-62.9	-49.9	177	-178.2	-96.7	0	0	0	112.2	R390 S396 L397 A398 L586 I589 Y590	R390-F394 WeakPolarHBondContact O-CB 3.29Å; R390-F394 PolarHBondContact O-N 3.46Å; F394-S396 VanDerWaalsContact C-N 3.31Å; F394-S396 PolarHBondContact O-N 3.48Å; F394-L397 PolarHBondContact O-N 3.46Å; F394-A398 WeakPolarHBondContact O-CB 3.26Å; F394-A398 PolarHBondContact O-N 3.48Å; F394-L586 HydrophobicContact CD2-CD2 3.9Å; F394-L586 HydrophobicContact CE2-CD2 3.85Å; F394-L586 HydrophobicContact CZ-CD2 4.43Å; F394-L586 WeakPolarHBondContact O-CD2 3.41Å; F394-I589 HydrophobicContact CB-CG2 3.99Å; F394-I589 HydrophobicContact CD2-CG2 4.13Å; F394-Y590 HydrophobicContact CE2-CD2 4.23Å; F394-Y590 HydrophobicContact CZ-CD2 4.48Å
395	G	95.1	Very high	92.8	Very high	37 Å²	37	45.7 Å²	45.7	38%	0.381	23%	0.233	S	C	.	.	H	α-helix	trans	-62.4	-38.6	178.6	0	0	0	0	0	112.8	K391 L392 A398 G399	K391-G395 PolarHBondContact O-N 3.06Å; L392-G395 PolarHBondContact O-N 3.09Å; G395-A398 PolarHBondContact O-N 3.21Å; G395-G399 PolarHBondContact O-N 2.9Å
396	S	96.1	Very high	93.5	Very high	5 Å²	5	41.5 Å²	41.5	4%	0.035	22%	0.215	C	C	.	.	H	α-helix	trans	-62.7	-50.4	175.7	172.5	0	0	0	0	112.1	L392 T393 F394 A398 G399 T400 F518 F519 G522 M523	L392-S396 WeakPolarHBondContact O-CB 3.41Å; L392-S396 PolarHBondContact O-N 3.3Å; T393-S396 PolarHBondContact O-N 2.89Å; F394-S396 VanDerWaalsContact C-N 3.31Å; F394-S396 PolarHBondContact O-N 3.48Å; S396-A398 VanDerWaalsContact C-N 3.26Å; S396-A398 PolarHBondContact O-N 3.11Å; S396-G399 PolarHBondContact O-N 3.29Å; S396-T400 WeakPolarHBondContact O-CB 3.15Å; S396-T400 PolarHBondContact O-N 3.19Å; S396-T400 PolarHBondContact O-OG1 3.13Å; S396-F518 WeakPolarHBondContact CA-O 3.49Å; S396-F518 VanDerWaalsContact CB-O 3.24Å; S396-F518 WeakPolarHBondContact CB-O 3.25Å; S396-F518 PolarHBondContact OG-O 2.92Å; S396-F519 PolarHBondContact OG-O 3.13Å; S396-G522 WeakPolarHBondContact OG-CA 3.22Å; S396-M523 PolarHBondContact OG-N 2.99Å
397	L	96.4	Very high	94	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-65.6	-31.9	178.1	-169.5	63.1	0	0	0	111.5	T393 F394 T400 T401 M523 A582 L586 I589	T393-L397 PolarHBondContact O-N 2.87Å; F394-L397 PolarHBondContact O-N 3.46Å; L397-T400 WeakPolarHBondContact O-CB 3.42Å; L397-T400 PolarHBondContact O-N 3.04Å; L397-T401 PolarHBondContact O-N 3.38Å; L397-T401 PolarHBondContact O-OG1 2.98Å; L397-M523 HydrophobicContact CB-CG 3.85Å; L397-M523 HydrophobicContact CB-SD 4.15Å; L397-M523 HydrophobicContact CD1-CE 4.07Å; L397-M523 HydrophobicContact CD1-CG 4.07Å; L397-M523 HydrophobicContact CD1-SD 4.37Å; L397-A582 HydrophobicContact CD1-CB 3.99Å; L397-A582 WeakPolarHBondContact CD2-O 3.25Å; L397-L586 HydrophobicContact CB-CD2 3.77Å; L397-L586 HydrophobicContact CB-CG 4.24Å; L397-L586 HydrophobicContact CD2-CD2 4.11Å; L397-L586 HydrophobicContact CD2-CG 3.92Å; L397-L586 HydrophobicContact CG-CD2 3.97Å; L397-L586 HydrophobicContact CG-CG 3.86Å; L397-I589 HydrophobicContact CB-CD1 4.39Å; L397-I589 HydrophobicContact CD2-CD1 3.58Å
398	A	97.1	Very high	94.4	Very high	31 Å²	31	32.6 Å²	32.6	26%	0.256	17%	0.171	S	C	.	.	H	α-helix	trans	-67.1	-48.3	178.9	0	0	0	0	0	111.2	F394 G395 S396 T400 T401 V402 L586	F394-A398 WeakPolarHBondContact O-CB 3.26Å; F394-A398 PolarHBondContact O-N 3.48Å; G395-A398 PolarHBondContact O-N 3.21Å; S396-A398 VanDerWaalsContact C-N 3.26Å; S396-A398 PolarHBondContact O-N 3.11Å; A398-T400 VanDerWaalsContact C-N 3.29Å; A398-T400 PolarHBondContact O-N 2.76Å; A398-T401 PolarHBondContact O-N 3.4Å; A398-V402 WeakPolarHBondContact O-CG2 3.33Å; A398-V402 PolarHBondContact O-N 2.74Å; A398-V402 VanDerWaalsContact O-N 3.11Å; A398-L586 HydrophobicContact CB-CD1 4.23Å; A398-L586 HydrophobicContact CB-CD2 3.91Å
399	G	96.9	Very high	94.9	Very high	10 Å²	10	36.7 Å²	36.7	10%	0.103	19%	0.193	C	C	.	.	H	α-helix	trans	-62.6	-37.5	173.4	0	0	0	0	0	112.5	G395 S396 V402 A403	G395-G399 PolarHBondContact O-N 2.9Å; S396-G399 PolarHBondContact O-N 3.29Å; G399-V402 PolarHBondContact O-N 3.38Å; G399-A403 WeakPolarHBondContact O-CB 3.08Å; G399-A403 PolarHBondContact O-N 3.28Å
400	T	96.7	Very high	95.2	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-62	-46	175.8	-56.4	0	0	0	0	111.3	S396 L397 A398 V402 A403 L404 Y515 F519	S396-T400 WeakPolarHBondContact O-CB 3.15Å; S396-T400 PolarHBondContact O-N 3.19Å; S396-T400 PolarHBondContact O-OG1 3.13Å; L397-T400 WeakPolarHBondContact O-CB 3.42Å; L397-T400 PolarHBondContact O-N 3.04Å; A398-T400 VanDerWaalsContact C-N 3.29Å; A398-T400 PolarHBondContact O-N 2.76Å; T400-V402 PolarHBondContact O-N 2.91Å; T400-A403 PolarHBondContact O-N 3.2Å; T400-L404 HydrophobicContact CG2-CD1 4.44Å; T400-L404 WeakPolarHBondContact O-CG 3.29Å; T400-L404 PolarHBondContact O-N 3.39Å; T400-Y515 HydrophobicContact CG2-CD2 3.55Å; T400-Y515 HydrophobicContact CG2-CE2 3.17Å; T400-Y515 HydrophobicContact CG2-CG 4.48Å; T400-F519 HydrophobicContact CG2-CD2 4.18Å
401	T	97.6	Very high	95.3	Very high	13 Å²	13	30.8 Å²	30.8	8%	0.08	17%	0.172	C	C	.	.	H	α-helix	trans	-59.6	-45.1	175.9	-59.9	0	0	0	0	111.5	L397 A398 A403 L404 I405 A582 A583	L397-T401 PolarHBondContact O-N 3.38Å; L397-T401 PolarHBondContact O-OG1 2.98Å; A398-T401 PolarHBondContact O-N 3.4Å; T401-A403 PolarHBondContact O-N 3.5Å; T401-L404 PolarHBondContact O-N 2.93Å; T401-I405 HydrophobicContact CG2-CD1 4.2Å; T401-I405 WeakPolarHBondContact O-CG1 3.26Å; T401-I405 PolarHBondContact O-N 3.21Å; T401-A582 WeakPolarHBondContact OG1-CB 3.36Å; T401-A583 HydrophobicContact CG2-CB 4.2Å
402	V	97.3	Very high	95.3	Very high	82 Å²	82	25.2 Å²	25.2	50%	0.497	15%	0.15	S	C	.	.	H	α-helix	trans	-63	-42.9	177	174	0	0	0	0	111.1	A398 G399 T400 I405 I406	A398-V402 WeakPolarHBondContact O-CG2 3.33Å; A398-V402 PolarHBondContact O-N 2.74Å; A398-V402 VanDerWaalsContact O-N 3.11Å; G399-V402 PolarHBondContact O-N 3.38Å; T400-V402 PolarHBondContact O-N 2.91Å; V402-I405 PolarHBondContact O-N 3.32Å; V402-I406 HydrophobicContact CG1-CD1 4Å; V402-I406 WeakPolarHBondContact O-CG1 3.35Å; V402-I406 PolarHBondContact O-N 3.5Å
403	A	96.9	Very high	95.3	Very high	1 Å²	1	28.2 Å²	28.2	1%	0.008	17%	0.166	C	C	.	.	H	α-helix	trans	-64.4	-39.7	177.9	0	0	0	0	0	112.8	G399 T400 T401 I405 I406 L407 L514 Y515	G399-A403 WeakPolarHBondContact O-CB 3.08Å; G399-A403 PolarHBondContact O-N 3.28Å; T400-A403 PolarHBondContact O-N 3.2Å; T401-A403 PolarHBondContact O-N 3.5Å; A403-I405 VanDerWaalsContact C-N 3.33Å; A403-I405 PolarHBondContact O-N 2.92Å; A403-I406 PolarHBondContact O-N 3.15Å; A403-L407 WeakPolarHBondContact O-CB 3.33Å; A403-L407 PolarHBondContact O-N 2.99Å; A403-L514 HydrophobicContact CB-CB 3.92Å; A403-Y515 VanDerWaalsContact CB-CA 3.48Å
404	L	96.5	Very high	95.1	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-62.7	-38.9	173.5	-73.3	173.7	0	0	0	112	I343 T400 T401 L407 A408 Y515 F575 A579 A582	I343-L404 HydrophobicContact CD1-CD2 4.14Å; T400-L404 HydrophobicContact CG2-CD1 4.44Å; T400-L404 WeakPolarHBondContact O-CG 3.29Å; T400-L404 PolarHBondContact O-N 3.39Å; T401-L404 PolarHBondContact O-N 2.93Å; L404-L407 PolarHBondContact O-N 3.1Å; L404-A408 WeakPolarHBondContact O-CB 3.33Å; L404-A408 PolarHBondContact O-N 3.09Å; L404-Y515 HydrophobicContact CD1-CD2 4.46Å; L404-Y515 HydrophobicContact CD1-CE2 4.04Å; L404-Y515 HydrophobicContact CD2-CD2 3.59Å; L404-Y515 HydrophobicContact CD2-CE2 3.59Å; L404-Y515 HydrophobicContact CG-CD2 3.7Å; L404-Y515 HydrophobicContact CG-CE2 3.74Å; L404-F575 HydrophobicContact CD2-CD1 4.28Å; L404-A579 HydrophobicContact CB-CB 3.82Å; L404-A579 HydrophobicContact CD1-CB 4.49Å; L404-A582 HydrophobicContact CD1-CB 4.24Å
405	I	96.8	Very high	94.7	Very high	65 Å²	65	25.9 Å²	25.9	33%	0.333	16%	0.16	S	C	.	.	H	α-helix	trans	-64.5	-44.1	174.6	-68	165.6	0	0	0	110.6	T401 V402 A403 L407 A408 L409 F576 A579	T401-I405 HydrophobicContact CG2-CD1 4.2Å; T401-I405 WeakPolarHBondContact O-CG1 3.26Å; T401-I405 PolarHBondContact O-N 3.21Å; V402-I405 PolarHBondContact O-N 3.32Å; A403-I405 VanDerWaalsContact C-N 3.33Å; A403-I405 PolarHBondContact O-N 2.92Å; I405-L407 VanDerWaalsContact C-N 3.32Å; I405-L407 PolarHBondContact O-N 2.93Å; I405-A408 PolarHBondContact O-N 3.06Å; I405-L409 HydrophobicContact CG2-CD1 3.9Å; I405-L409 HydrophobicContact CG2-CG 4.29Å; I405-L409 WeakPolarHBondContact O-CB 3.2Å; I405-L409 VanDerWaalsContact O-CG 3.27Å; I405-L409 WeakPolarHBondContact O-CG 3.15Å; I405-L409 PolarHBondContact O-N 2.06Å; I405-F576 HydrophobicContact CG2-CE1 4.37Å; I405-A579 HydrophobicContact CG1-CB 3.89Å
406	I	95.4	Very high	94.4	Very high	65 Å²	65	31 Å²	31	33%	0.333	17%	0.174	S	C	.	.	H	α-helix	trans	-60.5	-44.4	176.4	-68.7	167.1	0	0	0	110.6	V402 A403 L409 G410 L514	V402-I406 HydrophobicContact CG1-CD1 4Å; V402-I406 WeakPolarHBondContact O-CG1 3.35Å; V402-I406 PolarHBondContact O-N 3.5Å; A403-I406 PolarHBondContact O-N 3.15Å; I406-L409 PolarHBondContact O-N 2.68Å; I406-G410 PolarHBondContact O-N 3.41Å; I406-L514 HydrophobicContact CD1-CD1 4.01Å
407	L	94.6	Very high	94	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-60.2	-47.7	176.2	-177.5	58	0	0	0	111.4	A403 L404 I405 L409 G410 F411 A508 L512 F575	A403-L407 WeakPolarHBondContact O-CB 3.33Å; A403-L407 PolarHBondContact O-N 2.99Å; L404-L407 PolarHBondContact O-N 3.1Å; I405-L407 VanDerWaalsContact C-N 3.32Å; I405-L407 PolarHBondContact O-N 2.93Å; L407-L409 PolarHBondContact O-N 2.83Å; L407-G410 PolarHBondContact O-N 2.63Å; L407-F411 HydrophobicContact CD1-CD2 4.23Å; L407-F411 HydrophobicContact CD1-CE2 3.79Å; L407-F411 HydrophobicContact CG-CD2 4.38Å; L407-F411 HydrophobicContact CG-CE2 4.18Å; L407-F411 WeakPolarHBondContact O-CD2 3.37Å; L407-F411 PolarHBondContact O-N 3.47Å; L407-F411 VanDerWaalsContact O-N 3.17Å; L407-A508 HydrophobicContact CD1-CB 3.89Å; L407-A508 WeakPolarHBondContact CD1-O 3.5Å; L407-L512 HydrophobicContact CD1-CG 4.4Å; L407-L512 HydrophobicContact CD2-CD2 3.91Å; L407-L512 HydrophobicContact CD2-CG 4.41Å; L407-F575 HydrophobicContact CD2-CD1 3.6Å; L407-F575 HydrophobicContact CD2-CD2 4.35Å; L407-F575 HydrophobicContact CD2-CE1 3.5Å; L407-F575 HydrophobicContact CD2-CE2 4.29Å; L407-F575 HydrophobicContact CD2-CG 4.06Å; L407-F575 HydrophobicContact CD2-CZ 3.87Å; L407-F575 HydrophobicContact CG-CD1 4.22Å; L407-F575 HydrophobicContact CG-CD2 4.21Å; L407-F575 HydrophobicContact CG-CE1 4.36Å; L407-F575 HydrophobicContact CG-CE2 4.37Å; L407-F575 HydrophobicContact CG-CG 4.15Å; L407-F575 HydrophobicContact CG-CZ 4.44Å
408	A	95.3	Very high	93.6	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-60.4	-44.8	177	0	0	0	0	0	112.1	L404 I405 G410 F411 V412 Y572 F575 F576	L404-A408 WeakPolarHBondContact O-CB 3.33Å; L404-A408 PolarHBondContact O-N 3.09Å; I405-A408 PolarHBondContact O-N 3.06Å; A408-G410 VanDerWaalsContact C-N 3.3Å; A408-G410 PolarHBondContact O-N 3.3Å; A408-F411 PolarHBondContact O-N 2.69Å; A408-V412 WeakPolarHBondContact O-CG2 3.5Å; A408-V412 PolarHBondContact O-N 3.12Å; A408-Y572 WeakPolarHBondContact O-CB 3.44Å; A408-F575 HydrophobicContact CB-CB 3.78Å; A408-F576 HydrophobicContact CB-CD1 3.91Å; A408-F576 HydrophobicContact CB-CD2 3.79Å; A408-F576 HydrophobicContact CB-CE1 3.89Å; A408-F576 HydrophobicContact CB-CE2 3.77Å; A408-F576 HydrophobicContact CB-CG 3.85Å; A408-F576 HydrophobicContact CB-CZ 3.82Å
409	L	94.6	Very high	93.1	Very high	86 Å²	86	34.2 Å²	34.2	45%	0.45	19%	0.192	S	C	.	.	H	α-helix	trans	-62.6	-35.9	176	-71.8	172.7	0	0	0	112.2	I405 I406 L407 F411 V412 L413 F576	I405-L409 HydrophobicContact CG2-CD1 3.9Å; I405-L409 HydrophobicContact CG2-CG 4.29Å; I405-L409 WeakPolarHBondContact O-CB 3.2Å; I405-L409 VanDerWaalsContact O-CG 3.27Å; I405-L409 WeakPolarHBondContact O-CG 3.15Å; I405-L409 PolarHBondContact O-N 2.06Å; I406-L409 PolarHBondContact O-N 2.68Å; L407-L409 PolarHBondContact O-N 2.83Å; L409-F411 VanDerWaalsContact C-N 3.35Å; L409-V412 WeakPolarHBondContact O-CB 3.42Å; L409-V412 PolarHBondContact O-N 3.2Å; L409-L413 WeakPolarHBondContact O-CG 3.18Å; L409-L413 PolarHBondContact O-N 2.59Å; L409-F576 HydrophobicContact CD2-CZ 4.05Å; L409-F576 HydrophobicContact CG-CZ 4.32Å
410	G	92.8	Very high	92.6	Very high	4 Å²	4	41.6 Å²	41.6	4%	0.041	22%	0.216	C	C	.	.	H	α-helix	trans	-59	-44.6	172.4	0	0	0	0	0	112.4	I406 L407 A408 L413 S414 T507	I406-G410 PolarHBondContact O-N 3.41Å; L407-G410 PolarHBondContact O-N 2.63Å; A408-G410 VanDerWaalsContact C-N 3.3Å; A408-G410 PolarHBondContact O-N 3.3Å; G410-L413 PolarHBondContact O-N 2.87Å; G410-S414 PolarHBondContact O-N 3.01Å; G410-T507 VanDerWaalsContact CA-OG1 3.27Å; G410-T507 WeakPolarHBondContact CA-OG1 3.35Å
411	F	92.3	Very high	92.1	Very high	7 Å²	7	42.9 Å²	42.9	3%	0.031	22%	0.223	C	C	.	.	H	α-helix	trans	-66.8	-34.5	173.8	-79.7	-74.3	0	0	0	113	I350 M353 L407 A408 L409 S414 A415 A508 Y571 F575	I350-F411 HydrophobicContact CG2-CE2 4.17Å; I350-F411 HydrophobicContact CG2-CZ 3.97Å; M353-F411 HydrophobicContact CB-CE1 4.27Å; L407-F411 HydrophobicContact CD1-CD2 4.23Å; L407-F411 HydrophobicContact CD1-CE2 3.79Å; L407-F411 HydrophobicContact CG-CD2 4.38Å; L407-F411 HydrophobicContact CG-CE2 4.18Å; L407-F411 WeakPolarHBondContact O-CD2 3.37Å; L407-F411 PolarHBondContact O-N 3.47Å; L407-F411 VanDerWaalsContact O-N 3.17Å; A408-F411 PolarHBondContact O-N 2.69Å; L409-F411 VanDerWaalsContact C-N 3.35Å; F411-S414 PolarHBondContact O-N 3.41Å; F411-A415 WeakPolarHBondContact O-CB 3.39Å; F411-A415 PolarHBondContact O-N 2.7Å; F411-A508 HydrophobicContact CE2-CB 4.25Å; F411-A508 HydrophobicContact CZ-CB 4.29Å; F411-Y571 HydrophobicContact CD1-CD2 4.2Å; F411-Y571 HydrophobicContact CD1-CG 4.41Å; F411-Y571 HydrophobicContact CE1-CD2 4.26Å; F411-Y571 HydrophobicContact CE1-CG 4.49Å; F411-F575 AromaticContact CD2-CD2 3.72Å; F411-F575 HydrophobicContact CD2-CD2 3.72Å; F411-F575 AromaticContact CD2-CE2 3.78Å; F411-F575 HydrophobicContact CD2-CE2 3.78Å; F411-F575 AromaticContact CE2-CD2 3.8Å; F411-F575 HydrophobicContact CE2-CD2 3.8Å; F411-F575 AromaticContact CE2-CE2 3.35Å; F411-F575 HydrophobicContact CE2-CE2 3.35Å; F411-F575 HydrophobicContact CE2-CZ 4.25Å; F411-F575 HydrophobicContact CZ-CE2 4.08Å
412	V	93.1	Very high	91.5	Very high	33 Å²	33	46.6 Å²	46.6	20%	0.2	25%	0.246	C	C	.	.	H	α-helix	trans	-62.7	-46.9	172.6	173.5	0	0	0	0	111.1	A408 L409 S414 A415 Q416 Y572 F576	A408-V412 WeakPolarHBondContact O-CG2 3.5Å; A408-V412 PolarHBondContact O-N 3.12Å; L409-V412 WeakPolarHBondContact O-CB 3.42Å; L409-V412 PolarHBondContact O-N 3.2Å; V412-S414 VanDerWaalsContact C-N 3.3Å; V412-S414 PolarHBondContact O-N 2.99Å; V412-A415 PolarHBondContact O-N 2.9Å; V412-Q416 HydrophobicContact CG1-CG 4.44Å; V412-Q416 WeakPolarHBondContact O-CG 3.33Å; V412-Q416 PolarHBondContact O-N 3.29Å; V412-Y572 HydrophobicContact CG2-CD1 4.22Å; V412-Y572 HydrophobicContact CG2-CD2 3.88Å; V412-Y572 HydrophobicContact CG2-CG 3.65Å; V412-F576 HydrophobicContact CG2-CE2 4.02Å
413	L	91.3	Very high	90.7	Very high	74 Å²	74	47 Å²	47	39%	0.387	24%	0.241	S	C	.	.	H	α-helix	trans	-61	-42	177.5	-70.5	172.6	0	0	0	111.1	L409 G410 Q416 V417	L409-L413 WeakPolarHBondContact O-CG 3.18Å; L409-L413 PolarHBondContact O-N 2.59Å; G410-L413 PolarHBondContact O-N 2.87Å; L413-Q416 PolarHBondContact O-N 2.9Å; L413-V417 WeakPolarHBondContact O-CG2 3.14Å; L413-V417 PolarHBondContact O-N 3.36Å; L413-V417 VanDerWaalsContact O-N 3.16Å
414	S	89.1	Confident	89.8	Confident	14 Å²	14	53.3 Å²	53.3	10%	0.098	27%	0.27	C	S	.	.	H	α-helix	trans	-61	-43.8	175	-168.9	0	0	0	0	112.3	G410 F411 V412 V417 S418 T502	G410-S414 PolarHBondContact O-N 3.01Å; F411-S414 PolarHBondContact O-N 3.41Å; V412-S414 VanDerWaalsContact C-N 3.3Å; V412-S414 PolarHBondContact O-N 2.99Å; S414-V417 PolarHBondContact O-N 3.14Å; S414-S418 PolarHBondContact O-N 3.29Å; S414-S418 VanDerWaalsContact O-N 3.13Å; S414-T502 VanDerWaalsContact OG-CG2 3.24Å; S414-T502 WeakPolarHBondContact OG-CG2 3.22Å; S414-T502 PolarHBondContact OG-OG1 2.89Å
415	A	87.9	Confident	88.6	Confident	16 Å²	16	54.3 Å²	54.3	13%	0.132	28%	0.277	C	S	.	.	H	α-helix	trans	-64.9	-40.1	178	0	0	0	0	0	112.5	F411 V412 V417 S418 Y572	F411-A415 WeakPolarHBondContact O-CB 3.39Å; F411-A415 PolarHBondContact O-N 2.7Å; V412-A415 PolarHBondContact O-N 2.9Å; A415-V417 VanDerWaalsContact C-N 3.35Å; A415-V417 PolarHBondContact O-N 3.32Å; A415-S418 VanDerWaalsContact O-CB 3.26Å; A415-S418 WeakPolarHBondContact O-CB 3.13Å; A415-S418 PolarHBondContact O-N 3.18Å; A415-S418 PolarHBondContact O-OG 3.03Å; A415-Y572 HydrophobicContact CB-CD1 4.29Å; A415-Y572 HydrophobicContact CB-CE1 3.99Å
416	Q	88.5	Confident	87.3	Confident	145 Å²	145	59 Å²	59	68%	0.678	30%	0.301	S	S	*	.	H	α-helix	trans	-67.4	-33.4	179.3	-74.3	-179.2	-7.5	0	0	113.4	V412 L413 S418	V412-Q416 HydrophobicContact CG1-CG 4.44Å; V412-Q416 WeakPolarHBondContact O-CG 3.33Å; V412-Q416 PolarHBondContact O-N 3.29Å; L413-Q416 PolarHBondContact O-N 2.9Å; Q416-S418 VanDerWaalsContact C-N 3.31Å
417	V	87.5	Confident	86	Confident	73 Å²	73	58.4 Å²	58.4	44%	0.442	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	6	180	-176.2	0	0	0	0	111.4	L413 S414 A415 Y504	L413-V417 WeakPolarHBondContact O-CG2 3.14Å; L413-V417 PolarHBondContact O-N 3.36Å; L413-V417 VanDerWaalsContact O-N 3.16Å; S414-V417 PolarHBondContact O-N 3.14Å; A415-V417 VanDerWaalsContact C-N 3.35Å; A415-V417 PolarHBondContact O-N 3.32Å; V417-Y504 HydrophobicContact CB-CD2 4.37Å; V417-Y504 HydrophobicContact CB-CE2 4.12Å; V417-Y504 HydrophobicContact CG1-CE2 4.12Å; V417-Y504 HydrophobicContact CG2-CD2 4.37Å; V417-Y504 HydrophobicContact CG2-CE2 3.79Å
418	S	86.6	Confident	85	Confident	12 Å²	12	60.8 Å²	60.8	8%	0.084	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-59.5	137.3	179.9	67.2	0	0	0	0	111.7	S414 A415 Q416	S414-S418 PolarHBondContact O-N 3.29Å; S414-S418 VanDerWaalsContact O-N 3.13Å; A415-S418 VanDerWaalsContact O-CB 3.26Å; A415-S418 WeakPolarHBondContact O-CB 3.13Å; A415-S418 PolarHBondContact O-N 3.18Å; A415-S418 PolarHBondContact O-OG 3.03Å; Q416-S418 VanDerWaalsContact C-N 3.31Å
419	P	86.8	Confident	83.3	Confident	19 Å²	19	67.1 Å²	67.1	12%	0.123	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-65.6	140.8	-177.2	25.9	-34	0	0	0	111.1	C441 F452 V461 P501	P419-C441 HydrophobicContact CG-CB 3.83Å; P419-C441 PolarHBondContact O-N 3.5Å; P419-F452 HydrophobicContact CB-CZ 4.17Å; P419-F452 HydrophobicContact CG-CE1 3.87Å; P419-F452 HydrophobicContact CG-CZ 3.69Å; P419-V461 HydrophobicContact CB-CB 3.82Å; P419-V461 HydrophobicContact CB-CG1 3.96Å; P419-V461 HydrophobicContact CB-CG2 4.06Å; P419-V461 HydrophobicContact CG-CB 4.45Å; P419-V461 HydrophobicContact CG-CG1 4.44Å; P419-V461 HydrophobicContact CG-CG2 4.22Å; P419-P501 HydrophobicContact CG-CG 4.14Å
420	R	87.1	Confident	81.9	Confident	165 Å²	165	67.2 Å²	67.2	62%	0.623	38%	0.382	S	S	*	.	B	Isolated β-bridge	trans	-72.4	149.2	171.8	-69.9	-176.6	178.4	-169.6	-0.1	110.3	Y440 S464	R420-Y440 HydrophobicContact CG-CD1 3.89Å; R420-Y440 HydrophobicContact CG-CE1 3.49Å; R420-Y440 VanDerWaalsContact CG-CE1 3.49Å; R420-Y440 PolarHBondContact NE-OH 2.92Å; R420-Y440 PolarHBondContact NH2-OH 3.39Å; R420-S464 PolarHBondContact O-OG 2.84Å
421	I	87.2	Confident	80.7	Confident	26 Å²	26	71.6 Å²	71.6	13%	0.133	40%	0.401	C	S	.	.	P	Polyproline II helix	trans	-80.3	116	171.2	-67.5	160.7	0	0	0	107.9	Y438 S439 C444 F452 S464 C466	I421-Y438 WeakPolarHBondContact CD1-O 3.48Å; I421-S439 PolarHBondContact N-O 3.46Å; I421-C444 HydrophobicContact CD1-CB 4.43Å; I421-F452 HydrophobicContact CG1-CE2 3.96Å; I421-S464 WeakPolarHBondContact CA-OG 3.5Å; I421-C466 HydrophobicContact CD1-CB 3.54Å; I421-C466 HydrophobicContact CG1-CB 4.41Å
422	T	84.9	Confident	79.4	Confident	92 Å²	92	77 Å²	77	56%	0.564	43%	0.431	S	S	*	.			trans	-102.1	-21.1	-176.8	56.1	0	0	0	0	113.4	D463 S464	T422-D463 VanDerWaalsContact OG1-CA 3.31Å; T422-D463 WeakPolarHBondContact OG1-CA 3.12Å; T422-D463 PolarHBondContact OG1-N 2.93Å; T422-S464 PolarHBondContact N-O 3.4Å; T422-S464 PolarHBondContact N-OG 2.89Å; T422-S464 VanDerWaalsContact N-OG 3.11Å; T422-S464 PolarHBondContact OG1-N 3.4Å; T422-S464 VanDerWaalsContact OG1-N 3.07Å; T422-S464 PolarHBondContact OG1-OG 3.1Å
423	F	80.5	Confident	78.2	Confident	91 Å²	91	77.7 Å²	77.7	40%	0.399	44%	0.44	S	S	.	.			trans	-125	114.1	-176.3	-172.4	-92	0	0	0	110.6	P425 S464 S465	F423-P425 HydrophobicContact CD1-CB 4.34Å; F423-P425 HydrophobicContact CE1-CB 3.94Å; F423-P425 WeakPolarHBondContact O-CD 3.19Å; F423-S464 WeakPolarHBondContact CA-O 3.36Å; F423-S464 PolarHBondContact N-O 3.26Å; F423-S464 VanDerWaalsContact O-O 3.13Å; F423-S465 VanDerWaalsContact CD1-OG 3.32Å; F423-S465 WeakPolarHBondContact CD1-OG 3.37Å; F423-S465 WeakPolarHBondContact O-CA 3.16Å; F423-S465 WeakPolarHBondContact O-CB 3.44Å; F423-S465 PolarHBondContact O-OG 2.8Å
424	Q	76.7	Confident	77.7	Confident	132 Å²	132	78.1 Å²	78.1	62%	0.617	45%	0.445	S	S	*	.			trans	-96	107.1	172.4	-72.5	179.1	-16.7	0	0	109.2
425	P	71.6	Confident	77.4	Confident	22 Å²	22	77.6 Å²	77.6	14%	0.143	44%	0.442	C	S	.	.	P	Polyproline II helix	trans	-71.9	145.7	179.3	30.3	-33	0	0	0	110.4	F423 T427 V467 W479	F423-P425 HydrophobicContact CD1-CB 4.34Å; F423-P425 HydrophobicContact CE1-CB 3.94Å; F423-P425 WeakPolarHBondContact O-CD 3.19Å; P425-T427 PolarHBondContact O-N 3.48Å; P425-V467 HydrophobicContact CG-CG1 3.5Å; P425-V467 VanDerWaalsContact CG-CG1 3.5Å; P425-W479 HydrophobicContact CB-CH2 4.39Å; P425-W479 HydrophobicContact CB-CZ3 3.84Å; P425-W479 HydrophobicContact CG-CH2 3.95Å; P425-W479 HydrophobicContact CG-CZ3 3.82Å
426	I	68.8	Low	77.1	Confident	163 Å²	163	78.1 Å²	78.1	84%	0.836	44%	0.443	S	S	*	.	P	Polyproline II helix	trans	-64.7	118.7	178.2	-57.5	168.7	0	0	0	108.1
427	T	69	Low	77	Confident	52 Å²	52	75.7 Å²	75.7	32%	0.319	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-66.6	129.1	179.7	44.3	0	0	0	0	110.5	P425 S429 A433 T436 W479	P425-T427 PolarHBondContact O-N 3.48Å; T427-S429 PolarHBondContact O-N 3.46Å; T427-A433 HydrophobicContact CG2-CB 3.98Å; T427-T436 HydrophobicContact CG2-CG2 3.83Å; T427-W479 HydrophobicContact CG2-CH2 3.81Å; T427-W479 HydrophobicContact CG2-CZ2 4.03Å
428	P	73.2	Confident	76.9	Confident	50 Å²	50	75.2 Å²	75.2	33%	0.325	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-59	138.9	172.2	-20.3	30.5	0	0	0	110.4	G430 Q431 W479	P428-G430 PolarHBondContact O-N 3Å; P428-G430 VanDerWaalsContact O-N 3.15Å; P428-Q431 HydrophobicContact CB-CG 4.35Å; P428-Q431 PolarHBondContact O-N 3.14Å; P428-W479 HydrophobicContact CG-CD2 3.93Å; P428-W479 HydrophobicContact CG-CE3 4.01Å; P428-W479 HydrophobicContact CG-CG 4.17Å
429	S	61.2	Low	77	Confident	133 Å²	133	77.9 Å²	77.9	93%	0.93	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	119.3	-179	-50.3	0	0	0	0	111.1	T427	T427-S429 PolarHBondContact O-N 3.46Å
430	G	63.5	Low	77.1	Confident	88 Å²	88	81.1 Å²	81.1	91%	0.907	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.9	6.1	178.6	0	0	0	0	0	116.2	P428	P428-G430 PolarHBondContact O-N 3Å; P428-G430 VanDerWaalsContact O-N 3.15Å
431	Q	68.3	Low	77.1	Confident	96 Å²	96	73.2 Å²	73.2	45%	0.449	43%	0.432	S	S	.	.	S	Bend	trans	-106.8	153.9	175.6	-64.9	-159.7	3.4	0	0	113.5	P428 A433 W479	P428-Q431 HydrophobicContact CB-CG 4.35Å; P428-Q431 PolarHBondContact O-N 3.14Å; Q431-A433 PolarHBondContact O-N 3.39Å; Q431-W479 VanDerWaalsContact OE1-NE1 3.08Å
432	N	64.9	Low	77.1	Confident	122 Å²	122	73.3 Å²	73.3	65%	0.652	43%	0.433	S	S	*	.			trans	-61	120	-178.1	-73	-7.9	0	0	0	111.3
433	A	68.3	Low	77.2	Confident	47 Å²	47	73.1 Å²	73.1	39%	0.388	43%	0.425	S	S	.	.			trans	-91.4	3.7	-179.5	0	0	0	0	0	113.8	T427 Q431 C435 T436	T427-A433 HydrophobicContact CG2-CB 3.98Å; Q431-A433 PolarHBondContact O-N 3.39Å; A433-C435 PolarHBondContact O-N 3.28Å; A433-T436 PolarHBondContact O-N 3.39Å; A433-T436 VanDerWaalsContact O-N 3.07Å; A433-T436 PolarHBondContact O-OG1 3.21Å
434	T	80.8	Confident	77.5	Confident	82 Å²	82	68.8 Å²	68.8	50%	0.503	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-55.5	-47.5	-173.6	-2.5	0	0	0	0	112.1	T436 S437	T434-T436 VanDerWaalsContact C-N 3.26Å; T434-T436 PolarHBondContact O-N 3.24Å; T434-S437 WeakPolarHBondContact O-CB 3.31Å; T434-S437 PolarHBondContact O-N 3.08Å; T434-S437 VanDerWaalsContact O-N 3.1Å
435	C	83.3	Confident	78	Confident	4 Å²	4	62.7 Å²	62.7	3%	0.027	38%	0.378	C	S	.	.	G	3₁₀ helix	trans	-59.9	-33.7	178.8	-58	0	0	0	0	113.4	A433 S437 Y438 C450 C466 P468	A433-C435 PolarHBondContact O-N 3.28Å; C435-S437 PolarHBondContact O-N 3.04Å; C435-Y438 WeakPolarHBondContact O-CD2 3.23Å; C435-Y438 PolarHBondContact O-N 3.37Å; C435-C450 WeakPolarHBondContact CA-SG 3.47Å; C435-C450 HydrophobicContact CB-CB 3.85Å; C435-C450 WeakPolarHBondContact CB-SG 3.5Å; C435-C450 VanDerWaalsContact SG-CA 3.5Å; C435-C450 WeakPolarHBondContact SG-CB 3.42Å; C435-C450 CovalentContact SG-SG 2.03Å; C435-C450 PolarHBondContact SG-SG 3.36Å; C435-C466 VanDerWaalsContact O-CB 3.28Å; C435-C466 WeakPolarHBondContact O-CB 3.22Å; C435-C466 PolarHBondContact O-SG 2.83Å; C435-P468 HydrophobicContact CB-CG 4.28Å
436	T	81.7	Confident	78.5	Confident	26 Å²	26	63.5 Å²	63.5	16%	0.16	38%	0.381	C	S	.	.	G	3₁₀ helix	trans	-74.7	-9.5	-178.4	59.4	0	0	0	0	113.7	T427 A433 T434 W479	T427-T436 HydrophobicContact CG2-CG2 3.83Å; A433-T436 PolarHBondContact O-N 3.39Å; A433-T436 VanDerWaalsContact O-N 3.07Å; A433-T436 PolarHBondContact O-OG1 3.21Å; T434-T436 VanDerWaalsContact C-N 3.26Å; T434-T436 PolarHBondContact O-N 3.24Å; T436-W479 HydrophobicContact CG2-CH2 4.15Å; T436-W479 HydrophobicContact CG2-CZ2 4.46Å
437	S	84.8	Confident	79.2	Confident	94 Å²	94	57.1 Å²	57.1	66%	0.657	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-80	-18.5	178.7	-170.3	0	0	0	0	113.6	T434 C435	T434-S437 WeakPolarHBondContact O-CB 3.31Å; T434-S437 PolarHBondContact O-N 3.08Å; T434-S437 VanDerWaalsContact O-N 3.1Å; C435-S437 PolarHBondContact O-N 3.04Å
438	Y	86.6	Confident	79.7	Confident	63 Å²	63	57.1 Å²	57.1	25%	0.247	35%	0.35	C	S	.	.			trans	-74.9	146	-177	-63.7	-64.9	0	0	0	111.9	I421 C435 E443 C444 D447	I421-Y438 WeakPolarHBondContact CD1-O 3.48Å; C435-Y438 WeakPolarHBondContact O-CD2 3.23Å; C435-Y438 PolarHBondContact O-N 3.37Å; Y438-E443 HydrophobicContact CD1-CB 3.74Å; Y438-E443 HydrophobicContact CE1-CB 4.38Å; Y438-E443 HydrophobicContact CG-CB 4.34Å; Y438-C444 HydrophobicContact CD2-CB 4.4Å; Y438-D447 HydrophobicContact CE2-CB 4.13Å; Y438-D447 PolarHBondContact OH-OD2 3.32Å
439	S	87.4	Confident	80.2	Confident	69 Å²	69	59.1 Å²	59.1	48%	0.483	36%	0.357	S	S	.	.	S	Bend	trans	-103.2	-22.5	-178.3	-65.4	0	0	0	0	113.5	I421	I421-S439 PolarHBondContact N-O 3.46Å
440	Y	89	Confident	81.5	Confident	86 Å²	86	52.8 Å²	52.8	34%	0.337	31%	0.313	S	S	.	.	B	Isolated β-bridge	trans	-125.9	149.2	-178.3	-68.2	-91.1	0	0	0	111.3	R420 N442 E443 C444	R420-Y440 HydrophobicContact CG-CD1 3.89Å; R420-Y440 HydrophobicContact CG-CE1 3.49Å; R420-Y440 VanDerWaalsContact CG-CE1 3.49Å; R420-Y440 PolarHBondContact NE-OH 2.92Å; R420-Y440 PolarHBondContact NH2-OH 3.39Å; Y440-N442 VanDerWaalsContact C-N 3.27Å; Y440-N442 PolarHBondContact O-N 3.09Å; Y440-E443 PolarHBondContact O-N 3.47Å; Y440-C444 PolarHBondContact O-N 3.44Å
441	C	88.1	Confident	82.7	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-56.8	-41.6	175.2	178.7	0	0	0	0	111.9	P419 E443 C444 M445 F452 C500	P419-C441 HydrophobicContact CG-CB 3.83Å; P419-C441 PolarHBondContact O-N 3.5Å; C441-E443 VanDerWaalsContact C-N 3.32Å; C441-E443 PolarHBondContact O-N 3.23Å; C441-C444 WeakPolarHBondContact O-CB 3.46Å; C441-C444 PolarHBondContact O-N 2.97Å; C441-C444 VanDerWaalsContact O-N 3.14Å; C441-M445 WeakPolarHBondContact O-CG 3.24Å; C441-M445 PolarHBondContact O-N 3.34Å; C441-F452 HydrophobicContact CB-CD1 4.5Å; C441-F452 HydrophobicContact CB-CD2 3.87Å; C441-F452 HydrophobicContact CB-CE1 4.32Å; C441-F452 HydrophobicContact CB-CE2 3.65Å; C441-F452 HydrophobicContact CB-CG 4.29Å; C441-F452 HydrophobicContact CB-CZ 3.89Å; C441-C500 HydrophobicContact CB-CB 4.05Å; C441-C500 WeakPolarHBondContact CB-SG 3.24Å; C441-C500 PolarHBondContact O-SG 3.41Å; C441-C500 VanDerWaalsContact O-SG 3.41Å; C441-C500 VanDerWaalsContact SG-CA 3.58Å; C441-C500 WeakPolarHBondContact SG-CB 3.36Å; C441-C500 CovalentContact SG-SG 2.04Å; C441-C500 PolarHBondContact SG-SG 3.48Å
442	N	87.3	Confident	83.7	Confident	28 Å²	28	44 Å²	44	15%	0.15	25%	0.249	C	C	.	.	H	α-helix	trans	-60.1	-40.7	-177.5	-176	73.3	0	0	0	112.6	Y440 L446	Y440-N442 VanDerWaalsContact C-N 3.27Å; Y440-N442 PolarHBondContact O-N 3.09Å; N442-L446 WeakPolarHBondContact O-CG 3.49Å
443	E	86.8	Confident	84.9	Confident	87 Å²	87	38.3 Å²	38.3	41%	0.407	22%	0.218	S	C	.	.	H	α-helix	trans	-70.2	-39.3	176.7	-62.1	178.5	153.9	0	0	111.5	Y438 Y440 C441 M445 L446	Y438-E443 HydrophobicContact CD1-CB 3.74Å; Y438-E443 HydrophobicContact CE1-CB 4.38Å; Y438-E443 HydrophobicContact CG-CB 4.34Å; Y440-E443 PolarHBondContact O-N 3.47Å; C441-E443 VanDerWaalsContact C-N 3.32Å; C441-E443 PolarHBondContact O-N 3.23Å; E443-M445 VanDerWaalsContact C-N 3.32Å; E443-M445 PolarHBondContact O-N 2.74Å; E443-L446 PolarHBondContact O-N 3.38Å
444	C	87.6	Confident	85.9	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-60.7	-38.6	175.5	177	0	0	0	0	112.5	I421 Y438 Y440 C441 L446 D447 C450 C466	I421-C444 HydrophobicContact CD1-CB 4.43Å; Y438-C444 HydrophobicContact CD2-CB 4.4Å; Y440-C444 PolarHBondContact O-N 3.44Å; C441-C444 WeakPolarHBondContact O-CB 3.46Å; C441-C444 PolarHBondContact O-N 2.97Å; C441-C444 VanDerWaalsContact O-N 3.14Å; C444-L446 VanDerWaalsContact C-N 3.31Å; C444-L446 PolarHBondContact O-N 2.92Å; C444-D447 PolarHBondContact O-N 3Å; C444-C450 WeakPolarHBondContact O-CB 3.41Å; C444-C466 HydrophobicContact CB-CB 3.78Å; C444-C466 WeakPolarHBondContact CB-SG 3.28Å; C444-C466 WeakPolarHBondContact SG-CB 3.36Å; C444-C466 CovalentContact SG-SG 2.02Å; C444-C466 PolarHBondContact SG-SG 3.23Å
445	M	86.4	Confident	86.3	Confident	5 Å²	5	35.5 Å²	35.5	3%	0.025	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-10.6	-178.4	-65.9	-57.6	88.8	0	0	114.6	C441 E443 F452 C500 Y571	C441-M445 WeakPolarHBondContact O-CG 3.24Å; C441-M445 PolarHBondContact O-N 3.34Å; E443-M445 VanDerWaalsContact C-N 3.32Å; E443-M445 PolarHBondContact O-N 2.74Å; M445-F452 HydrophobicContact CE-CB 3.59Å; M445-F452 HydrophobicContact SD-CB 4.2Å; M445-C500 WeakPolarHBondContact CG-SG 3.44Å; M445-Y571 PolarHBondContact O-OH 2.79Å
446	L	82.6	Confident	86.3	Confident	38 Å²	38	38 Å²	38	20%	0.199	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-22.7	172.9	-68.3	169.9	0	0	0	111.9	N442 E443 C444 T570 Y571	N442-L446 WeakPolarHBondContact O-CG 3.49Å; E443-L446 PolarHBondContact O-N 3.38Å; C444-L446 VanDerWaalsContact C-N 3.31Å; C444-L446 PolarHBondContact O-N 2.92Å; L446-T570 HydrophobicContact CD1-CG2 3.94Å; L446-Y571 HydrophobicContact CD2-CE1 4.34Å
447	D	83.6	Confident	86.3	Confident	29 Å²	29	41 Å²	41	16%	0.155	22%	0.218	C	C	.	.	S	Bend	trans	-84.6	116.7	173.8	-170	-29.1	0	0	0	109.4	Y438 C444 D449 C450	Y438-D447 HydrophobicContact CE2-CB 4.13Å; Y438-D447 PolarHBondContact OH-OD2 3.32Å; C444-D447 PolarHBondContact O-N 3Å; D447-D449 PolarHBondContact O-N 3.04Å; D447-D449 PolarHBondContact OD1-N 3.03Å; D447-C450 HydrophobicContact CB-CB 4.08Å; D447-C450 PolarHBondContact O-N 3Å; D447-C450 VanDerWaalsContact O-N 3.12Å
448	P	78.2	Confident	86	Confident	53 Å²	53	46 Å²	46	34%	0.344	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-20.9	-175.5	27.6	-35.9	0	0	0	113.6	C450 Y497	P448-C450 VanDerWaalsContact C-N 3.33Å; P448-Y497 PolarHBondContact O-OH 3.12Å
449	D	84.5	Confident	85.6	Confident	91 Å²	91	48.2 Å²	48.2	49%	0.487	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-4.2	178.8	-75.5	-40.3	0	0	0	112.7	D447 P468 V469	D447-D449 PolarHBondContact O-N 3.04Å; D447-D449 PolarHBondContact OD1-N 3.03Å; D449-P468 CarbonylContact O-C 3.58Å; D449-P468 VanDerWaalsContact O-CA 3.3Å; D449-P468 WeakPolarHBondContact O-CA 3.47Å; D449-V469 PolarHBondContact O-N 2.89Å
450	C	88.1	Confident	85.2	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	151.6	-174.8	-58	0	0	0	0	113.4	C435 C444 D447 P448 V469	C435-C450 WeakPolarHBondContact CA-SG 3.47Å; C435-C450 HydrophobicContact CB-CB 3.85Å; C435-C450 WeakPolarHBondContact CB-SG 3.5Å; C435-C450 VanDerWaalsContact SG-CA 3.5Å; C435-C450 WeakPolarHBondContact SG-CB 3.42Å; C435-C450 CovalentContact SG-SG 2.03Å; C435-C450 PolarHBondContact SG-SG 3.36Å; C444-C450 WeakPolarHBondContact O-CB 3.41Å; D447-C450 HydrophobicContact CB-CB 4.08Å; D447-C450 PolarHBondContact O-N 3Å; D447-C450 VanDerWaalsContact O-N 3.12Å; P448-C450 VanDerWaalsContact C-N 3.33Å; C450-V469 WeakPolarHBondContact O-CG2 3.48Å
451	G	87.9	Confident	84.9	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	161.3	179.1	0	0	0	0	0	112.1	C466 V467 W495	G451-C466 WeakPolarHBondContact O-CA 3.11Å; G451-V467 PolarHBondContact N-O 3.12Å; G451-V467 PolarHBondContact O-N 3.48Å; G451-W495 VanDerWaalsContact CA-CH2 3.44Å
452	F	89.8	Confident	84.7	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	113.8	-170.6	-170.9	-108.6	0	0	0	110.3	P419 I421 C441 M445 Y454 V461 A496 P501	P419-F452 HydrophobicContact CB-CZ 4.17Å; P419-F452 HydrophobicContact CG-CE1 3.87Å; P419-F452 HydrophobicContact CG-CZ 3.69Å; I421-F452 HydrophobicContact CG1-CE2 3.96Å; C441-F452 HydrophobicContact CB-CD1 4.5Å; C441-F452 HydrophobicContact CB-CD2 3.87Å; C441-F452 HydrophobicContact CB-CE1 4.32Å; C441-F452 HydrophobicContact CB-CE2 3.65Å; C441-F452 HydrophobicContact CB-CG 4.29Å; C441-F452 HydrophobicContact CB-CZ 3.89Å; M445-F452 HydrophobicContact CE-CB 3.59Å; M445-F452 HydrophobicContact SD-CB 4.2Å; F452-Y454 AromaticContact CD1-CD1 3.35Å; F452-Y454 HydrophobicContact CD1-CD1 3.35Å; F452-Y454 HydrophobicContact CD1-CE1 4.03Å; F452-Y454 AromaticContact CD1-CG 3.95Å; F452-Y454 HydrophobicContact CD1-CG 3.95Å; F452-Y454 AromaticContact CE1-CD1 3.56Å; F452-Y454 HydrophobicContact CE1-CD1 3.56Å; F452-Y454 HydrophobicContact CE1-CE1 4.37Å; F452-Y454 AromaticContact CE1-CG 3.65Å; F452-Y454 HydrophobicContact CE1-CG 3.65Å; F452-Y454 HydrophobicContact CG-CD1 4.46Å; F452-V461 HydrophobicContact CE1-CG1 4.21Å; F452-V461 HydrophobicContact CZ-CG1 4.23Å; F452-A496 HydrophobicContact CB-CB 4.35Å; F452-A496 PolarHBondContact N-O 3.21Å; F452-A496 PolarHBondContact O-N 2.88Å; F452-P501 HydrophobicContact CE1-CG 4.4Å
453	C	90	Very high	84.6	Confident	2 Å²	2	51.8 Å²	51.8	1%	0.014	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	122.7	179.8	-175.4	0	0	0	0	109.1	S464 S465 V467 C482 F494 W495	C453-S464 CarbonylContact O-C 3.58Å; C453-S464 WeakPolarHBondContact O-CA 3.34Å; C453-S465 PolarHBondContact N-O 3.02Å; C453-S465 PolarHBondContact O-N 2.95Å; C453-V467 HydrophobicContact CB-CG2 4.36Å; C453-C482 VanDerWaalsContact CA-SG 3.56Å; C453-C482 HydrophobicContact CB-CB 3.77Å; C453-C482 WeakPolarHBondContact CB-SG 3.2Å; C453-C482 WeakPolarHBondContact SG-CB 3.45Å; C453-C482 CovalentContact SG-SG 2.03Å; C453-C482 PolarHBondContact SG-SG 2.85Å; C453-F494 WeakPolarHBondContact CA-O 3.45Å; C453-W495 HydrophobicContact CB-CE3 3.95Å; C453-W495 HydrophobicContact CB-CZ3 4.06Å
454	Y	89.8	Confident	84.7	Confident	3 Å²	3	47.6 Å²	47.6	1%	0.012	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	161.2	-172.2	70.1	-82	0	0	0	113.7	F452 M456 V461 F494 A496 P501	F452-Y454 AromaticContact CD1-CD1 3.35Å; F452-Y454 HydrophobicContact CD1-CD1 3.35Å; F452-Y454 HydrophobicContact CD1-CE1 4.03Å; F452-Y454 AromaticContact CD1-CG 3.95Å; F452-Y454 HydrophobicContact CD1-CG 3.95Å; F452-Y454 AromaticContact CE1-CD1 3.56Å; F452-Y454 HydrophobicContact CE1-CD1 3.56Å; F452-Y454 HydrophobicContact CE1-CE1 4.37Å; F452-Y454 AromaticContact CE1-CG 3.65Å; F452-Y454 HydrophobicContact CE1-CG 3.65Å; F452-Y454 HydrophobicContact CG-CD1 4.46Å; Y454-M456 HydrophobicContact CD2-CG 4.09Å; Y454-M456 HydrophobicContact CE2-CE 3.58Å; Y454-M456 HydrophobicContact CE2-CG 3.64Å; Y454-M456 HydrophobicContact CE2-SD 4.41Å; Y454-V461 HydrophobicContact CD2-CB 4.48Å; Y454-V461 HydrophobicContact CD2-CG1 3.83Å; Y454-V461 HydrophobicContact CD2-CG2 4.01Å; Y454-V461 HydrophobicContact CE2-CG2 4.3Å; Y454-V461 HydrophobicContact CG-CG1 4.04Å; Y454-F494 HydrophobicContact CD1-CB 4.2Å; Y454-F494 HydrophobicContact CD2-CB 4.4Å; Y454-F494 HydrophobicContact CE1-CB 3.69Å; Y454-F494 HydrophobicContact CE2-CB 3.9Å; Y454-F494 HydrophobicContact CE2-CD2 4.28Å; Y454-F494 HydrophobicContact CE2-CG 4.34Å; Y454-F494 PolarHBondContact N-O 3.21Å; Y454-F494 PolarHBondContact O-N 3.04Å; Y454-A496 HydrophobicContact CE1-CB 3.96Å; Y454-P501 HydrophobicContact CE1-CG 4.28Å; Y454-P501 HydrophobicContact CE2-CB 4.45Å; Y454-P501 HydrophobicContact CE2-CG 4.06Å
455	K	88.5	Confident	84.8	Confident	68 Å²	68	47.8 Å²	47.8	30%	0.296	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	142.6	173.8	-176.4	158.8	-174.4	146.3	0	109.7	I462 E491	K455-I462 HydrophobicContact CB-CG1 4.16Å; K455-I462 HydrophobicContact CG-CD1 4.37Å; K455-I462 HydrophobicContact CG-CG1 4.25Å; K455-I462 PolarHBondContact N-O 3.25Å; K455-I462 WeakPolarHBondContact O-CG1 3.29Å; K455-I462 PolarHBondContact O-N 3.25Å; K455-E491 PolarHBondContact NZ-O 3.15Å
456	M	82.7	Confident	85	Confident	57 Å²	57	47.7 Å²	47.7	28%	0.281	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	134.1	174.9	-72.1	-150.1	173.3	0	0	110.8	E357 Y454 F494 P501	E357-M456 WeakPolarHBondContact OE1-CE 3.23Å; Y454-M456 HydrophobicContact CD2-CG 4.09Å; Y454-M456 HydrophobicContact CE2-CE 3.58Å; Y454-M456 HydrophobicContact CE2-CG 3.64Å; Y454-M456 HydrophobicContact CE2-SD 4.41Å; M456-F494 HydrophobicContact CB-CE2 4.17Å; M456-F494 HydrophobicContact CG-CD2 4.14Å; M456-F494 HydrophobicContact CG-CE2 4.17Å; M456-P501 HydrophobicContact CE-CB 3.97Å
457	N	82.3	Confident	85.3	Confident	89 Å²	89	46 Å²	46	48%	0.476	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	102.7	162.6	-171.9	-5.6	0	0	0	108.2	S459 T460 I462	N457-S459 PolarHBondContact O-N 2.97Å; N457-T460 PolarHBondContact N-O 3.13Å; N457-T460 PolarHBondContact O-N 2.97Å; N457-T460 PolarHBondContact O-OG1 2.9Å; N457-I462 HydrophobicContact CB-CD1 3.74Å; N457-I462 HydrophobicContact CB-CG1 4.01Å; N457-I462 HydrophobicContact CB-CG2 4.26Å
458	K	79.8	Confident	85.5	Confident	198 Å²	198	45.6 Å²	45.6	86%	0.861	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.8	-91	-168.6	-56.6	176.5	-179	177.8	0	112
459	S	76.5	Confident	86	Confident	109 Å²	109	43.8 Å²	43.8	76%	0.762	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-127.8	2.1	-178.3	56.5	0	0	0	0	113.5	N457	N457-S459 PolarHBondContact O-N 2.97Å
460	T	79.8	Confident	85.9	Confident	86 Å²	86	41.5 Å²	41.5	53%	0.528	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	133	176.4	58.7	0	0	0	0	110.5	N457 I462	N457-T460 PolarHBondContact N-O 3.13Å; N457-T460 PolarHBondContact O-N 2.97Å; N457-T460 PolarHBondContact O-OG1 2.9Å; T460-I462 PolarHBondContact O-N 3.21Å
461	V	83.1	Confident	85.4	Confident	36 Å²	36	49.9 Å²	49.9	22%	0.218	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	124.5	174.7	178.1	0	0	0	0	109.3	P419 F452 Y454 P501	P419-V461 HydrophobicContact CB-CB 3.82Å; P419-V461 HydrophobicContact CB-CG1 3.96Å; P419-V461 HydrophobicContact CB-CG2 4.06Å; P419-V461 HydrophobicContact CG-CB 4.45Å; P419-V461 HydrophobicContact CG-CG1 4.44Å; P419-V461 HydrophobicContact CG-CG2 4.22Å; F452-V461 HydrophobicContact CE1-CG1 4.21Å; F452-V461 HydrophobicContact CZ-CG1 4.23Å; Y454-V461 HydrophobicContact CD2-CB 4.48Å; Y454-V461 HydrophobicContact CD2-CG1 3.83Å; Y454-V461 HydrophobicContact CD2-CG2 4.01Å; Y454-V461 HydrophobicContact CE2-CG2 4.3Å; Y454-V461 HydrophobicContact CG-CG1 4.04Å; V461-P501 HydrophobicContact CG2-CB 4.5Å; V461-P501 HydrophobicContact CG2-CG 3.78Å
462	I	84.3	Confident	84.7	Confident	56 Å²	56	54 Å²	54	29%	0.287	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	157.6	174.7	58.9	160.7	0	0	0	109.7	K455 N457 T460 S464	K455-I462 HydrophobicContact CB-CG1 4.16Å; K455-I462 HydrophobicContact CG-CD1 4.37Å; K455-I462 HydrophobicContact CG-CG1 4.25Å; K455-I462 PolarHBondContact N-O 3.25Å; K455-I462 WeakPolarHBondContact O-CG1 3.29Å; K455-I462 PolarHBondContact O-N 3.25Å; N457-I462 HydrophobicContact CB-CD1 3.74Å; N457-I462 HydrophobicContact CB-CG1 4.01Å; N457-I462 HydrophobicContact CB-CG2 4.26Å; T460-I462 PolarHBondContact O-N 3.21Å; I462-S464 PolarHBondContact O-N 3.43Å
463	D	84.1	Confident	83.9	Confident	80 Å²	80	55.4 Å²	55.4	43%	0.428	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	44.1	59.7	178.6	-57.4	-23.5	0	0	0	113.6	T422 R481	T422-D463 VanDerWaalsContact OG1-CA 3.31Å; T422-D463 WeakPolarHBondContact OG1-CA 3.12Å; T422-D463 PolarHBondContact OG1-N 2.93Å; D463-R481 PolarHBondContact O-NH1 2.87Å; D463-R481 VanDerWaalsContact O-NH1 3.15Å; D463-R481 PolarHBondContact O-NH2 3.22Å
464	S	89.3	Confident	83.2	Confident	0 Å²	0	56 Å²	56	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	144.9	-178	49.6	0	0	0	0	112.3	R420 I421 T422 F423 C453 I462	R420-S464 PolarHBondContact O-OG 2.84Å; I421-S464 WeakPolarHBondContact CA-OG 3.5Å; T422-S464 PolarHBondContact N-O 3.4Å; T422-S464 PolarHBondContact N-OG 2.89Å; T422-S464 VanDerWaalsContact N-OG 3.11Å; T422-S464 PolarHBondContact OG1-N 3.4Å; T422-S464 VanDerWaalsContact OG1-N 3.07Å; T422-S464 PolarHBondContact OG1-OG 3.1Å; F423-S464 WeakPolarHBondContact CA-O 3.36Å; F423-S464 PolarHBondContact N-O 3.26Å; F423-S464 VanDerWaalsContact O-O 3.13Å; C453-S464 CarbonylContact O-C 3.58Å; C453-S464 WeakPolarHBondContact O-CA 3.34Å; I462-S464 PolarHBondContact O-N 3.43Å
465	S	89.7	Confident	82.6	Confident	3 Å²	3	58.1 Å²	58.1	2%	0.021	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	139.9	-179.3	-55.2	0	0	0	0	111	F423 C453 R481	F423-S465 VanDerWaalsContact CD1-OG 3.32Å; F423-S465 WeakPolarHBondContact CD1-OG 3.37Å; F423-S465 WeakPolarHBondContact O-CA 3.16Å; F423-S465 WeakPolarHBondContact O-CB 3.44Å; F423-S465 PolarHBondContact O-OG 2.8Å; C453-S465 PolarHBondContact N-O 3.02Å; C453-S465 PolarHBondContact O-N 2.95Å; S465-R481 PolarHBondContact OG-NH2 2.77Å
466	C	90.3	Very high	82.4	Confident	3 Å²	3	57 Å²	57	2%	0.02	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	120.3	164.9	-175.6	0	0	0	0	109	I421 C435 C444 G451	I421-C466 HydrophobicContact CD1-CB 3.54Å; I421-C466 HydrophobicContact CG1-CB 4.41Å; C435-C466 VanDerWaalsContact O-CB 3.28Å; C435-C466 WeakPolarHBondContact O-CB 3.22Å; C435-C466 PolarHBondContact O-SG 2.83Å; C444-C466 HydrophobicContact CB-CB 3.78Å; C444-C466 WeakPolarHBondContact CB-SG 3.28Å; C444-C466 WeakPolarHBondContact SG-CB 3.36Å; C444-C466 CovalentContact SG-SG 2.02Å; C444-C466 PolarHBondContact SG-SG 3.23Å; G451-C466 WeakPolarHBondContact O-CA 3.11Å
467	V	89.9	Confident	82.5	Confident	4 Å²	4	54.2 Å²	54.2	2%	0.024	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	154	-177.8	-68.5	0	0	0	0	110.8	P425 G451 C453 A477 W479 W495	P425-V467 HydrophobicContact CG-CG1 3.5Å; P425-V467 VanDerWaalsContact CG-CG1 3.5Å; G451-V467 PolarHBondContact N-O 3.12Å; G451-V467 PolarHBondContact O-N 3.48Å; C453-V467 HydrophobicContact CB-CG2 4.36Å; V467-A477 HydrophobicContact CG2-CB 3.55Å; V467-W479 HydrophobicContact CG1-CH2 4.34Å; V467-W479 HydrophobicContact CG1-CZ3 4.47Å; V467-W495 HydrophobicContact CG2-CH2 3.97Å; V467-W495 HydrophobicContact CG2-CZ3 3.58Å
468	P	88.2	Confident	82.7	Confident	20 Å²	20	51.8 Å²	51.8	13%	0.13	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	143.5	177.8	-22.7	33.6	0	0	0	112.6	C435 D449 A477 A478 W479	C435-P468 HydrophobicContact CB-CG 4.28Å; D449-P468 CarbonylContact O-C 3.58Å; D449-P468 VanDerWaalsContact O-CA 3.3Å; D449-P468 WeakPolarHBondContact O-CA 3.47Å; P468-A477 WeakPolarHBondContact O-CA 3.48Å; P468-A478 HydrophobicContact CB-CB 4.24Å; P468-A478 PolarHBondContact O-N 3.13Å; P468-W479 HydrophobicContact CG-CZ2 4.32Å
469	V	86.8	Confident	82.9	Confident	15 Å²	15	43.2 Å²	43.2	9%	0.091	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	145	176.2	-174.7	0	0	0	0	110.2	D449 C450 K471 T474 W495 Y497	D449-V469 PolarHBondContact O-N 2.89Å; C450-V469 WeakPolarHBondContact O-CG2 3.48Å; V469-K471 PolarHBondContact O-N 3.31Å; V469-T474 HydrophobicContact CG1-CG2 4.21Å; V469-W495 HydrophobicContact CB-CZ2 4.33Å; V469-W495 HydrophobicContact CG1-CZ2 4.24Å; V469-W495 HydrophobicContact CG2-CH2 4.33Å; V469-W495 HydrophobicContact CG2-CZ2 3.9Å; V469-Y497 HydrophobicContact CG1-CE2 4.45Å; V469-Y497 HydrophobicContact CG2-CD2 3.76Å; V469-Y497 HydrophobicContact CG2-CE2 3.79Å
470	N	83.3	Confident	83.1	Confident	43 Å²	43	39.6 Å²	39.6	23%	0.23	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	121.7	171.7	-176.4	-6.1	0	0	0	110.2	A472 S473 E476	N470-A472 PolarHBondContact O-N 3.34Å; N470-A472 VanDerWaalsContact O-N 3.14Å; N470-A472 PolarHBondContact OD1-N 2.74Å; N470-S473 WeakPolarHBondContact CB-O 3.48Å; N470-S473 CarbonylContact O-C 3.55Å; N470-S473 VanDerWaalsContact O-C 3.26Å; N470-S473 PolarHBondContact O-N 3.06Å; N470-S473 VanDerWaalsContact O-N 3.11Å; N470-E476 HydrophobicContact CB-CG 3.81Å; N470-E476 PolarHBondContact N-O 3.48Å; N470-E476 PolarHBondContact ND2-OE1 2.98Å
471	K	77.6	Confident	83.3	Confident	175 Å²	175	39.1 Å²	39.1	76%	0.761	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-22.8	179.4	-65.7	-169.4	175.5	-169.5	0	113.8	V469	V469-K471 PolarHBondContact O-N 3.31Å
472	A	72.9	Confident	83.5	Confident	86 Å²	86	37.4 Å²	37.4	71%	0.711	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-24.5	177.6	0	0	0	0	0	113.4	N470	N470-A472 PolarHBondContact O-N 3.34Å; N470-A472 VanDerWaalsContact O-N 3.14Å; N470-A472 PolarHBondContact OD1-N 2.74Å
473	S	72.8	Confident	83.5	Confident	30 Å²	30	39.9 Å²	39.9	21%	0.21	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	115.3	-176.1	177.1	0	0	0	0	110.3	N470 N475	N470-S473 WeakPolarHBondContact CB-O 3.48Å; N470-S473 CarbonylContact O-C 3.55Å; N470-S473 VanDerWaalsContact O-C 3.26Å; N470-S473 PolarHBondContact O-N 3.06Å; N470-S473 VanDerWaalsContact O-N 3.11Å; S473-N475 PolarHBondContact O-N 3.07Å; S473-N475 VanDerWaalsContact O-N 3.07Å
474	T	75.9	Confident	83.4	Confident	15 Å²	15	39.8 Å²	39.8	9%	0.092	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	-0.4	179.7	59	0	0	0	0	114.1	V469 E476 W495 Y497	V469-T474 HydrophobicContact CG1-CG2 4.21Å; T474-E476 VanDerWaalsContact C-N 3.33Å; T474-W495 PolarHBondContact O-NE1 3.43Å; T474-Y497 HydrophobicContact CG2-CD1 4.34Å; T474-Y497 HydrophobicContact CG2-CE1 3.76Å
475	N	77.4	Confident	82.8	Confident	48 Å²	48	43.1 Å²	43.1	26%	0.257	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	-4.2	-178.6	-64.5	-19.2	0	0	0	113.9	R110 S473	R110-N475 WeakPolarHBondContact CD-ND2 3.47Å; R110-N475 WeakPolarHBondContact CD-OD1 3.33Å; R110-N475 WeakPolarHBondContact CG-OD1 3.43Å; S473-N475 PolarHBondContact O-N 3.07Å; S473-N475 VanDerWaalsContact O-N 3.07Å
476	E	83.9	Confident	82.1	Confident	43 Å²	43	47.9 Å²	47.9	20%	0.201	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	155.3	-175.9	60.8	-168.7	-170.4	0	0	110.3	N470 T474 C482 F488	N470-E476 HydrophobicContact CB-CG 3.81Å; N470-E476 PolarHBondContact N-O 3.48Å; N470-E476 PolarHBondContact ND2-OE1 2.98Å; T474-E476 VanDerWaalsContact C-N 3.33Å; E476-C482 WeakPolarHBondContact CA-O 3.49Å; E476-C482 WeakPolarHBondContact CB-O 3.29Å; E476-F488 HydrophobicContact CB-CE1 4.44Å
477	A	85.6	Confident	81.5	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	150.9	171.1	0	0	0	0	0	109.9	V467 P468 W479 C482 E483 W495	V467-A477 HydrophobicContact CG2-CB 3.55Å; P468-A477 WeakPolarHBondContact O-CA 3.48Å; A477-W479 WeakPolarHBondContact CB-O 3.49Å; A477-W479 PolarHBondContact O-N 3.32Å; A477-C482 HydrophobicContact CB-CB 3.9Å; A477-C482 PolarHBondContact N-O 3.48Å; A477-E483 WeakPolarHBondContact O-CA 3.21Å; A477-W495 HydrophobicContact CB-CE3 4.34Å; A477-W495 HydrophobicContact CB-CH2 3.68Å; A477-W495 HydrophobicContact CB-CZ2 4.42Å; A477-W495 HydrophobicContact CB-CZ3 3.65Å
478	A	85.1	Confident	81	Confident	38 Å²	38	53.8 Å²	53.8	31%	0.314	29%	0.293	S	S	.	.	S	Bend	trans	-62.5	-26.5	171.6	0	0	0	0	0	112.3	P468	P468-A478 HydrophobicContact CB-CB 4.24Å; P468-A478 PolarHBondContact O-N 3.13Å
479	W	83.9	Confident	80.5	Confident	17 Å²	17	58.7 Å²	58.7	6%	0.064	31%	0.312	C	S	.	.	S	Bend	trans	-162.9	162.1	178.2	53.9	-87.7	0	0	0	110.6	P425 T427 P428 Q431 T436 V467 P468 A477	P425-W479 HydrophobicContact CB-CH2 4.39Å; P425-W479 HydrophobicContact CB-CZ3 3.84Å; P425-W479 HydrophobicContact CG-CH2 3.95Å; P425-W479 HydrophobicContact CG-CZ3 3.82Å; T427-W479 HydrophobicContact CG2-CH2 3.81Å; T427-W479 HydrophobicContact CG2-CZ2 4.03Å; P428-W479 HydrophobicContact CG-CD2 3.93Å; P428-W479 HydrophobicContact CG-CE3 4.01Å; P428-W479 HydrophobicContact CG-CG 4.17Å; Q431-W479 VanDerWaalsContact OE1-NE1 3.08Å; T436-W479 HydrophobicContact CG2-CH2 4.15Å; T436-W479 HydrophobicContact CG2-CZ2 4.46Å; V467-W479 HydrophobicContact CG1-CH2 4.34Å; V467-W479 HydrophobicContact CG1-CZ3 4.47Å; P468-W479 HydrophobicContact CG-CZ2 4.32Å; A477-W479 WeakPolarHBondContact CB-O 3.49Å; A477-W479 PolarHBondContact O-N 3.32Å
480	G	82	Confident	80.1	Confident	33 Å²	33	63.4 Å²	63.4	34%	0.34	34%	0.341	S	S	.	.	S	Bend	trans	97.8	-154.7	173.3	0	0	0	0	0	113.4	C482 E483	G480-C482 PolarHBondContact O-N 3.41Å; G480-E483 VanDerWaalsContact O-CB 3.28Å; G480-E483 WeakPolarHBondContact O-CB 3.09Å; G480-E483 PolarHBondContact O-N 3.27Å
481	R	84.5	Confident	79.9	Confident	76 Å²	76	65.7 Å²	65.7	29%	0.287	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-26.5	-170.7	-67.9	-176.3	-67.2	157.4	4.4	113.8	D463 S465 F488 I493	D463-R481 PolarHBondContact O-NH1 2.87Å; D463-R481 VanDerWaalsContact O-NH1 3.15Å; D463-R481 PolarHBondContact O-NH2 3.22Å; S465-R481 PolarHBondContact OG-NH2 2.77Å; R481-F488 WeakPolarHBondContact O-CB 3.14Å; R481-I493 HydrophobicContact CB-CD1 4.42Å
482	C	85.9	Confident	80.2	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102	21.2	178.9	-71.4	0	0	0	0	113.4	C453 E476 A477 G480 F488 I493 W495	C453-C482 VanDerWaalsContact CA-SG 3.56Å; C453-C482 HydrophobicContact CB-CB 3.77Å; C453-C482 WeakPolarHBondContact CB-SG 3.2Å; C453-C482 WeakPolarHBondContact SG-CB 3.45Å; C453-C482 CovalentContact SG-SG 2.03Å; C453-C482 PolarHBondContact SG-SG 2.85Å; E476-C482 WeakPolarHBondContact CA-O 3.49Å; E476-C482 WeakPolarHBondContact CB-O 3.29Å; A477-C482 HydrophobicContact CB-CB 3.9Å; A477-C482 PolarHBondContact N-O 3.48Å; G480-C482 PolarHBondContact O-N 3.41Å; C482-F488 HydrophobicContact CB-CD1 4.13Å; C482-F488 HydrophobicContact CB-CE1 4.31Å; C482-F488 WeakPolarHBondContact O-CE1 3.34Å; C482-I493 VanDerWaalsContact SG-CG2 3.58Å; C482-W495 HydrophobicContact CB-CD2 4.23Å; C482-W495 HydrophobicContact CB-CE3 3.51Å; C482-W495 HydrophobicContact CB-CZ3 4.05Å
483	E	84.5	Confident	80.8	Confident	108 Å²	108	58.8 Å²	58.8	51%	0.505	31%	0.309	S	S	.	.	S	Bend	trans	-72.4	-30	-178.6	-175.6	-179	167.6	0	0	113.7	A477 G480	A477-E483 WeakPolarHBondContact O-CA 3.21Å; G480-E483 VanDerWaalsContact O-CB 3.28Å; G480-E483 WeakPolarHBondContact O-CB 3.09Å; G480-E483 PolarHBondContact O-N 3.27Å
484	N	82.3	Confident	81.5	Confident	79 Å²	79	61.4 Å²	61.4	42%	0.422	32%	0.317	S	S	.	.			trans	-126	110.6	-176.1	-176.8	-24.2	0	0	0	111.2	T486 K487 F488	N484-T486 VanDerWaalsContact C-N 3.26Å; N484-T486 PolarHBondContact O-N 2.9Å; N484-T486 PolarHBondContact OD1-N 2.82Å; N484-T486 VanDerWaalsContact OD1-N 3.12Å; N484-T486 PolarHBondContact OD1-OG1 2.87Å; N484-K487 HydrophobicContact CB-CB 3.95Å; N484-K487 WeakPolarHBondContact O-CB 3.5Å; N484-K487 PolarHBondContact O-N 3.01Å; N484-F488 WeakPolarHBondContact O-CD1 3.47Å; N484-F488 PolarHBondContact O-N 3.38Å
485	E	76.8	Confident	82	Confident	70 Å²	70	62.2 Å²	62.2	33%	0.327	32%	0.318	S	S	.	.	H	α-helix	trans	-51.7	-41.2	-177.2	-167.1	-179.5	178.1	0	0	113.8	K487 F488 K489	E485-K487 VanDerWaalsContact C-N 3.31Å; E485-K487 PolarHBondContact O-N 3.48Å; E485-F488 HydrophobicContact CB-CE1 4.05Å; E485-F488 HydrophobicContact CB-CZ 4.07Å; E485-F488 HydrophobicContact CG-CE1 4.41Å; E485-F488 HydrophobicContact CG-CE2 4.41Å; E485-F488 HydrophobicContact CG-CZ 3.92Å; E485-K489 HydrophobicContact CG-CD 4.13Å; E485-K489 WeakPolarHBondContact O-CB 3.49Å; E485-K489 VanDerWaalsContact O-CG 3.24Å; E485-K489 WeakPolarHBondContact O-CG 3.44Å; E485-K489 PolarHBondContact O-N 3.33Å; E485-K489 VanDerWaalsContact OE1-CE 3.31Å; E485-K489 WeakPolarHBondContact OE1-CE 3.16Å; E485-K489 IonicContact OE1-NZ 2.9Å; E485-K489 PolarHBondContact OE1-NZ 2.86Å
486	T	75.2	Confident	82.3	Confident	103 Å²	103	59.9 Å²	59.9	63%	0.632	31%	0.306	S	S	*	.	H	α-helix	trans	-68.7	-34.7	179.7	60.2	0	0	0	0	112.1	N484 T490	N484-T486 VanDerWaalsContact C-N 3.26Å; N484-T486 PolarHBondContact O-N 2.9Å; N484-T486 PolarHBondContact OD1-N 2.82Å; N484-T486 VanDerWaalsContact OD1-N 3.12Å; N484-T486 PolarHBondContact OD1-OG1 2.87Å; T486-T490 PolarHBondContact O-OG1 2.77Å; T486-T490 VanDerWaalsContact O-OG1 3.12Å
487	K	77.6	Confident	82.2	Confident	122 Å²	122	59.2 Å²	59.2	53%	0.53	30%	0.302	S	S	.	.	H	α-helix	trans	-79.6	-44.8	-175.4	-169.6	-178	177.4	-173.7	0	112	N484 E485 T490 E491	N484-K487 HydrophobicContact CB-CB 3.95Å; N484-K487 WeakPolarHBondContact O-CB 3.5Å; N484-K487 PolarHBondContact O-N 3.01Å; E485-K487 VanDerWaalsContact C-N 3.31Å; E485-K487 PolarHBondContact O-N 3.48Å; K487-T490 PolarHBondContact O-N 2.67Å; K487-T490 PolarHBondContact O-OG1 3.31Å; K487-E491 PolarHBondContact O-N 3Å
488	F	78.1	Confident	81.9	Confident	9 Å²	9	60.3 Å²	60.3	4%	0.039	31%	0.308	C	S	.	.	H	α-helix	trans	-73.3	-30.9	-177.6	70.1	-118.7	0	0	0	112.2	E476 R481 C482 N484 E485 T490 E491 D492 I493 W495	E476-F488 HydrophobicContact CB-CE1 4.44Å; R481-F488 WeakPolarHBondContact O-CB 3.14Å; C482-F488 HydrophobicContact CB-CD1 4.13Å; C482-F488 HydrophobicContact CB-CE1 4.31Å; C482-F488 WeakPolarHBondContact O-CE1 3.34Å; N484-F488 WeakPolarHBondContact O-CD1 3.47Å; N484-F488 PolarHBondContact O-N 3.38Å; E485-F488 HydrophobicContact CB-CE1 4.05Å; E485-F488 HydrophobicContact CB-CZ 4.07Å; E485-F488 HydrophobicContact CG-CE1 4.41Å; E485-F488 HydrophobicContact CG-CE2 4.41Å; E485-F488 HydrophobicContact CG-CZ 3.92Å; F488-T490 VanDerWaalsContact C-N 3.33Å; F488-T490 PolarHBondContact O-N 2.93Å; F488-E491 PolarHBondContact O-N 3.49Å; F488-D492 PolarHBondContact O-N 3.21Å; F488-I493 HydrophobicContact CB-CB 3.99Å; F488-I493 HydrophobicContact CB-CG2 4.19Å; F488-I493 WeakPolarHBondContact CD2-O 3.3Å; F488-I493 PolarHBondContact O-N 2.03Å; F488-W495 HydrophobicContact CE2-CB 4.14Å; F488-W495 HydrophobicContact CZ-CB 3.91Å
489	K	78.3	Confident	81.9	Confident	123 Å²	123	59.2 Å²	59.2	54%	0.535	30%	0.296	S	S	.	.	H	α-helix	trans	-65.2	-33.9	172.2	-74.5	-177.7	-177.1	177.5	0	112.9	E485 E491	E485-K489 HydrophobicContact CG-CD 4.13Å; E485-K489 WeakPolarHBondContact O-CB 3.49Å; E485-K489 VanDerWaalsContact O-CG 3.24Å; E485-K489 WeakPolarHBondContact O-CG 3.44Å; E485-K489 PolarHBondContact O-N 3.33Å; E485-K489 VanDerWaalsContact OE1-CE 3.31Å; E485-K489 WeakPolarHBondContact OE1-CE 3.16Å; E485-K489 IonicContact OE1-NZ 2.9Å; E485-K489 PolarHBondContact OE1-NZ 2.86Å; K489-E491 VanDerWaalsContact C-N 3.29Å
490	T	77.9	Confident	82	Confident	113 Å²	113	59 Å²	59	69%	0.693	30%	0.297	S	S	*	.	H	α-helix	trans	-73.9	-18.4	175.3	43.7	0	0	0	0	113.9	T486 K487 F488	T486-T490 PolarHBondContact O-OG1 2.77Å; T486-T490 VanDerWaalsContact O-OG1 3.12Å; K487-T490 PolarHBondContact O-N 2.67Å; K487-T490 PolarHBondContact O-OG1 3.31Å; F488-T490 VanDerWaalsContact C-N 3.33Å; F488-T490 PolarHBondContact O-N 2.93Å
491	E	80.3	Confident	82.1	Confident	91 Å²	91	58 Å²	58	43%	0.425	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.7	10.6	-178.5	-67.8	-179	-167.3	0	0	113.2	K455 K487 F488 K489 I493	K455-E491 PolarHBondContact NZ-O 3.15Å; K487-E491 PolarHBondContact O-N 3Å; F488-E491 PolarHBondContact O-N 3.49Å; K489-E491 VanDerWaalsContact C-N 3.29Å; E491-I493 VanDerWaalsContact C-N 3.27Å; E491-I493 HydrophobicContact CB-CD1 3.91Å; E491-I493 HydrophobicContact CB-CG1 4.1Å; E491-I493 PolarHBondContact O-N 3.12Å
492	D	83	Confident	82.3	Confident	107 Å²	107	55.3 Å²	55.3	57%	0.572	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.1	38	-173.2	-60.5	-46.3	0	0	0	113.3	F488	F488-D492 PolarHBondContact O-N 3.21Å
493	I	86.3	Confident	82.2	Confident	10 Å²	10	59.7 Å²	59.7	5%	0.051	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	139.8	175.8	-59.3	171.7	0	0	0	108.2	R481 C482 F488 E491	R481-I493 HydrophobicContact CB-CD1 4.42Å; C482-I493 VanDerWaalsContact SG-CG2 3.58Å; F488-I493 HydrophobicContact CB-CB 3.99Å; F488-I493 HydrophobicContact CB-CG2 4.19Å; F488-I493 WeakPolarHBondContact CD2-O 3.3Å; F488-I493 PolarHBondContact O-N 2.03Å; E491-I493 VanDerWaalsContact C-N 3.27Å; E491-I493 HydrophobicContact CB-CD1 3.91Å; E491-I493 HydrophobicContact CB-CG1 4.1Å; E491-I493 PolarHBondContact O-N 3.12Å
494	F	86.6	Confident	82.3	Confident	84 Å²	84	58.6 Å²	58.6	37%	0.368	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	146.2	-177.7	-61.5	-87.3	0	0	0	110.9	C453 Y454 M456	C453-F494 WeakPolarHBondContact CA-O 3.45Å; Y454-F494 HydrophobicContact CD1-CB 4.2Å; Y454-F494 HydrophobicContact CD2-CB 4.4Å; Y454-F494 HydrophobicContact CE1-CB 3.69Å; Y454-F494 HydrophobicContact CE2-CB 3.9Å; Y454-F494 HydrophobicContact CE2-CD2 4.28Å; Y454-F494 HydrophobicContact CE2-CG 4.34Å; Y454-F494 PolarHBondContact N-O 3.21Å; Y454-F494 PolarHBondContact O-N 3.04Å; M456-F494 HydrophobicContact CB-CE2 4.17Å; M456-F494 HydrophobicContact CG-CD2 4.14Å; M456-F494 HydrophobicContact CG-CE2 4.17Å
495	W	86.8	Confident	82.6	Confident	32 Å²	32	55.7 Å²	55.7	12%	0.121	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	126.2	174.8	176.9	-107.8	0	0	0	109.2	G451 C453 V467 V469 T474 A477 C482 F488	G451-W495 VanDerWaalsContact CA-CH2 3.44Å; C453-W495 HydrophobicContact CB-CE3 3.95Å; C453-W495 HydrophobicContact CB-CZ3 4.06Å; V467-W495 HydrophobicContact CG2-CH2 3.97Å; V467-W495 HydrophobicContact CG2-CZ3 3.58Å; V469-W495 HydrophobicContact CB-CZ2 4.33Å; V469-W495 HydrophobicContact CG1-CZ2 4.24Å; V469-W495 HydrophobicContact CG2-CH2 4.33Å; V469-W495 HydrophobicContact CG2-CZ2 3.9Å; T474-W495 PolarHBondContact O-NE1 3.43Å; A477-W495 HydrophobicContact CB-CE3 4.34Å; A477-W495 HydrophobicContact CB-CH2 3.68Å; A477-W495 HydrophobicContact CB-CZ2 4.42Å; A477-W495 HydrophobicContact CB-CZ3 3.65Å; C482-W495 HydrophobicContact CB-CD2 4.23Å; C482-W495 HydrophobicContact CB-CE3 3.51Å; C482-W495 HydrophobicContact CB-CZ3 4.05Å; F488-W495 HydrophobicContact CE2-CB 4.14Å; F488-W495 HydrophobicContact CZ-CB 3.91Å
496	A	83.8	Confident	83.2	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	137.7	174.8	0	0	0	0	0	110.5	F452 Y454 F499	F452-A496 HydrophobicContact CB-CB 4.35Å; F452-A496 PolarHBondContact N-O 3.21Å; F452-A496 PolarHBondContact O-N 2.88Å; Y454-A496 HydrophobicContact CE1-CB 3.96Å; A496-F499 HydrophobicContact CB-CD1 4.23Å; A496-F499 HydrophobicContact CB-CD2 4.03Å; A496-F499 HydrophobicContact CB-CE1 3.8Å; A496-F499 HydrophobicContact CB-CE2 3.56Å; A496-F499 HydrophobicContact CB-CG 4.33Å; A496-F499 HydrophobicContact CB-CZ 3.45Å; A496-F499 VanDerWaalsContact CB-CZ 3.45Å; A496-F499 WeakPolarHBondContact CB-O 3.35Å
497	Y	82.2	Confident	84	Confident	29 Å²	29	55.5 Å²	55.5	11%	0.114	27%	0.269	C	S	.	.	S	Bend	trans	-135.1	124	179.4	178	-119.2	0	0	0	109.3	K109 P448 V469 T474 F499	K109-Y497 HydrophobicContact CD-CE1 4.44Å; K109-Y497 VanDerWaalsContact CE-CE1 3.45Å; P448-Y497 PolarHBondContact O-OH 3.12Å; V469-Y497 HydrophobicContact CG1-CE2 4.45Å; V469-Y497 HydrophobicContact CG2-CD2 3.76Å; V469-Y497 HydrophobicContact CG2-CE2 3.79Å; T474-Y497 HydrophobicContact CG2-CD1 4.34Å; T474-Y497 HydrophobicContact CG2-CE1 3.76Å; Y497-F499 WeakPolarHBondContact O-CD1 3.13Å; Y497-F499 PolarHBondContact O-N 3.41Å
498	N	78.8	Confident	84.6	Confident	22 Å²	22	49.8 Å²	49.8	12%	0.118	24%	0.244	C	C	.	.	S	Bend	trans	59.1	20.3	-172.3	-69.4	27.5	0	0	0	115.7	K109 M353	K109-N498 PolarHBondContact NZ-ND2 3.45Å; M353-N498 WeakPolarHBondContact CA-O 3.49Å
499	F	85.1	Confident	85.3	Confident	16 Å²	16	50.9 Å²	50.9	7%	0.07	25%	0.25	C	S	.	.			trans	-150.8	155.3	171.5	75.3	-92.7	0	0	0	111.4	Q352 E357 A496 Y497	Q352-F499 HydrophobicContact CG-CD1 4.27Å; Q352-F499 WeakPolarHBondContact O-CB 3.39Å; E357-F499 HydrophobicContact CB-CE2 4.19Å; E357-F499 HydrophobicContact CB-CZ 4.24Å; E357-F499 HydrophobicContact CG-CE2 3.86Å; E357-F499 HydrophobicContact CG-CZ 4.38Å; A496-F499 HydrophobicContact CB-CD1 4.23Å; A496-F499 HydrophobicContact CB-CD2 4.03Å; A496-F499 HydrophobicContact CB-CE1 3.8Å; A496-F499 HydrophobicContact CB-CE2 3.56Å; A496-F499 HydrophobicContact CB-CG 4.33Å; A496-F499 HydrophobicContact CB-CZ 3.45Å; A496-F499 VanDerWaalsContact CB-CZ 3.45Å; A496-F499 WeakPolarHBondContact CB-O 3.35Å; Y497-F499 WeakPolarHBondContact O-CD1 3.13Å; Y497-F499 PolarHBondContact O-N 3.41Å
500	C	86.1	Confident	86.1	Confident	12 Å²	12	48.6 Å²	48.6	8%	0.081	24%	0.243	C	C	.	.			trans	-116.7	137.9	171.3	-69	0	0	0	0	109.8	G355 C441 M445 T502	G355-C500 WeakPolarHBondContact CA-O 3.42Å; C441-C500 HydrophobicContact CB-CB 4.05Å; C441-C500 WeakPolarHBondContact CB-SG 3.24Å; C441-C500 PolarHBondContact O-SG 3.41Å; C441-C500 VanDerWaalsContact O-SG 3.41Å; C441-C500 VanDerWaalsContact SG-CA 3.58Å; C441-C500 WeakPolarHBondContact SG-CB 3.36Å; C441-C500 CovalentContact SG-SG 2.04Å; C441-C500 PolarHBondContact SG-SG 3.48Å; M445-C500 WeakPolarHBondContact CG-SG 3.44Å; C500-T502 PolarHBondContact O-N 3.15Å
501	P	84.8	Confident	86.9	Confident	12 Å²	12	43.2 Å²	43.2	8%	0.078	21%	0.21	C	C	.	.			trans	-63.6	128.7	176.9	27.1	-34.2	0	0	0	109.7	P419 F452 Y454 M456 V461	P419-P501 HydrophobicContact CG-CG 4.14Å; F452-P501 HydrophobicContact CE1-CG 4.4Å; Y454-P501 HydrophobicContact CE1-CG 4.28Å; Y454-P501 HydrophobicContact CE2-CB 4.45Å; Y454-P501 HydrophobicContact CE2-CG 4.06Å; M456-P501 HydrophobicContact CE-CB 3.97Å; V461-P501 HydrophobicContact CG2-CB 4.5Å; V461-P501 HydrophobicContact CG2-CG 3.78Å
502	T	87.2	Confident	87.6	Confident	19 Å²	19	38.9 Å²	38.9	12%	0.117	19%	0.19	C	C	.	.			trans	-154.9	140.7	-173	-179.5	0	0	0	0	110.7	S354 S414 C500 Y504 S505	S354-T502 WeakPolarHBondContact O-CG2 3.18Å; S414-T502 VanDerWaalsContact OG-CG2 3.24Å; S414-T502 WeakPolarHBondContact OG-CG2 3.22Å; S414-T502 PolarHBondContact OG-OG1 2.89Å; C500-T502 PolarHBondContact O-N 3.15Å; T502-Y504 PolarHBondContact O-N 3.42Å; T502-Y504 PolarHBondContact OG1-N 3.29Å; T502-S505 WeakPolarHBondContact CG2-OG 3.4Å; T502-S505 PolarHBondContact O-OG 2.91Å
503	P	84.5	Confident	88.3	Confident	92 Å²	92	35.9 Å²	35.9	60%	0.597	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-6.2	174.8	30.8	-34	0	0	0	112.9	W506	P503-W506 VanDerWaalsContact O-CD1 3.27Å
504	Y	87.4	Confident	88.8	Confident	86 Å²	86	37.6 Å²	37.6	34%	0.337	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.2	8.5	-173.1	-62.2	-75.9	0	0	0	114.7	V417 T502 W506 T507	V417-Y504 HydrophobicContact CB-CD2 4.37Å; V417-Y504 HydrophobicContact CB-CE2 4.12Å; V417-Y504 HydrophobicContact CG1-CE2 4.12Å; V417-Y504 HydrophobicContact CG2-CD2 4.37Å; V417-Y504 HydrophobicContact CG2-CE2 3.79Å; T502-Y504 PolarHBondContact O-N 3.42Å; T502-Y504 PolarHBondContact OG1-N 3.29Å; Y504-W506 PolarHBondContact O-N 3.27Å; Y504-W506 VanDerWaalsContact O-N 3.09Å; Y504-T507 WeakPolarHBondContact O-CB 2.98Å; Y504-T507 WeakPolarHBondContact O-CG2 3.35Å; Y504-T507 PolarHBondContact O-N 2.95Å; Y504-T507 PolarHBondContact O-OG1 3.27Å
505	S	87	Confident	89.3	Confident	17 Å²	17	33.6 Å²	33.6	12%	0.119	17%	0.165	C	C	.	.	H	α-helix	trans	-57.6	-28.4	-178.3	-50.9	0	0	0	0	113.8	S354 G355 T502 T507 A508	S354-S505 WeakPolarHBondContact O-CA 3.02Å; S354-S505 VanDerWaalsContact O-CB 3.32Å; S354-S505 WeakPolarHBondContact O-CB 3.39Å; S354-S505 PolarHBondContact O-OG 3.3Å; S354-S505 PolarHBondContact OG-O 3.12Å; G355-S505 WeakPolarHBondContact CA-OG 3.1Å; G355-S505 PolarHBondContact O-OG 3.22Å; T502-S505 WeakPolarHBondContact CG2-OG 3.4Å; T502-S505 PolarHBondContact O-OG 2.91Å; S505-T507 PolarHBondContact O-N 3.44Å; S505-A508 PolarHBondContact O-N 3.45Å
506	W	89.9	Confident	89.7	Confident	154 Å²	154	32.1 Å²	32.1	58%	0.583	16%	0.16	S	C	*	.	H	α-helix	trans	-62	-25.4	176	69	-91.8	0	0	0	113.5	P503 Y504 A508 L509 L510	P503-W506 VanDerWaalsContact O-CD1 3.27Å; Y504-W506 PolarHBondContact O-N 3.27Å; Y504-W506 VanDerWaalsContact O-N 3.09Å; W506-A508 VanDerWaalsContact C-N 3.3Å; W506-A508 PolarHBondContact O-N 2.87Å; W506-L509 PolarHBondContact O-N 2.88Å; W506-L510 HydrophobicContact CZ3-CD2 3.88Å; W506-L510 PolarHBondContact O-N 3.24Å
507	T	91.5	Very high	90.3	Very high	16 Å²	16	33.6 Å²	33.6	10%	0.098	17%	0.169	C	C	.	.	H	α-helix	trans	-65.8	-35.2	178.9	62.8	0	0	0	0	111.6	G410 Y504 S505 L510 G511	G410-T507 VanDerWaalsContact CA-OG1 3.27Å; G410-T507 WeakPolarHBondContact CA-OG1 3.35Å; Y504-T507 WeakPolarHBondContact O-CB 2.98Å; Y504-T507 WeakPolarHBondContact O-CG2 3.35Å; Y504-T507 PolarHBondContact O-N 2.95Å; Y504-T507 PolarHBondContact O-OG1 3.27Å; S505-T507 PolarHBondContact O-N 3.44Å; T507-L510 PolarHBondContact O-N 3.46Å; T507-G511 PolarHBondContact O-N 3.34Å
508	A	90.9	Very high	91	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.008	18%	0.18	C	C	.	.	H	α-helix	trans	-68.2	-42.4	176.4	0	0	0	0	0	111.6	L407 F411 S505 W506 L510 G511 L512	L407-A508 HydrophobicContact CD1-CB 3.89Å; L407-A508 WeakPolarHBondContact CD1-O 3.5Å; F411-A508 HydrophobicContact CE2-CB 4.25Å; F411-A508 HydrophobicContact CZ-CB 4.29Å; S505-A508 PolarHBondContact O-N 3.45Å; W506-A508 VanDerWaalsContact C-N 3.3Å; W506-A508 PolarHBondContact O-N 2.87Å; A508-L510 PolarHBondContact O-N 3.37Å; A508-G511 PolarHBondContact O-N 3.5Å; A508-L512 VanDerWaalsContact O-CG 3.32Å; A508-L512 WeakPolarHBondContact O-CG 3.39Å; A508-L512 PolarHBondContact O-N 3.01Å
509	L	93.4	Very high	91.8	Very high	33 Å²	33	35.3 Å²	35.3	17%	0.173	18%	0.176	C	C	.	.	H	α-helix	trans	-59.7	-47	173.9	178.3	65.3	0	0	0	111.5	L351 L365 T369 W506 G511 L512 I513	L351-L509 HydrophobicContact CD2-CB 3.91Å; L351-L509 HydrophobicContact CD2-CD1 4.04Å; L365-L509 HydrophobicContact CB-CD1 4.21Å; L365-L509 HydrophobicContact CD1-CD2 4.32Å; L365-L509 HydrophobicContact CD2-CD1 4.28Å; L365-L509 HydrophobicContact CD2-CD2 3.64Å; L365-L509 HydrophobicContact CG-CD2 4.48Å; T369-L509 HydrophobicContact CG2-CD1 4.17Å; W506-L509 PolarHBondContact O-N 2.88Å; L509-G511 VanDerWaalsContact C-N 3.33Å; L509-G511 PolarHBondContact O-N 2.98Å; L509-L512 PolarHBondContact O-N 3.11Å; L509-I513 HydrophobicContact CD1-CD1 3.99Å; L509-I513 HydrophobicContact CD1-CG1 4.32Å; L509-I513 HydrophobicContact CG-CD1 3.92Å; L509-I513 WeakPolarHBondContact O-CG1 3.42Å; L509-I513 PolarHBondContact O-N 2.9Å
510	L	94.8	Very high	92.1	Very high	74 Å²	74	34.6 Å²	34.6	39%	0.387	17%	0.173	S	C	.	.	H	α-helix	trans	-59.4	-45.1	176.7	178	63.8	0	0	0	111.4	W506 T507 A508 I513 L514	W506-L510 HydrophobicContact CZ3-CD2 3.88Å; W506-L510 PolarHBondContact O-N 3.24Å; T507-L510 PolarHBondContact O-N 3.46Å; A508-L510 PolarHBondContact O-N 3.37Å; L510-I513 PolarHBondContact O-N 3.47Å; L510-L514 HydrophobicContact CD1-CD1 4.08Å; L510-L514 HydrophobicContact CD1-CG 4.13Å; L510-L514 HydrophobicContact CG-CD1 3.98Å; L510-L514 HydrophobicContact CG-CG 4.42Å; L510-L514 WeakPolarHBondContact O-CB 3.32Å; L510-L514 WeakPolarHBondContact O-CG 3.34Å; L510-L514 PolarHBondContact O-N 3.21Å
511	G	95.2	Very high	92.4	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-59.5	-44.9	176.7	0	0	0	0	0	112.7	T507 A508 L509 L514 Y515	T507-G511 PolarHBondContact O-N 3.34Å; A508-G511 PolarHBondContact O-N 3.5Å; L509-G511 VanDerWaalsContact C-N 3.33Å; L509-G511 PolarHBondContact O-N 2.98Å; G511-L514 PolarHBondContact O-N 3.31Å; G511-Y515 VanDerWaalsContact O-CB 3.25Å; G511-Y515 WeakPolarHBondContact O-CB 3.08Å; G511-Y515 PolarHBondContact O-N 3.36Å
512	L	95.3	Very high	92.7	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-64.8	-42.1	176.9	-70.9	174.7	0	0	0	112.6	I343 I350 L351 T369 L407 A508 L509 Y515 L516	I343-L512 HydrophobicContact CD1-CD2 4.5Å; I343-L512 HydrophobicContact CG1-CD2 4.15Å; I343-L512 HydrophobicContact CG2-CD2 3.78Å; I350-L512 HydrophobicContact CG2-CD1 4.08Å; I350-L512 HydrophobicContact CG2-CD2 4.4Å; L351-L512 HydrophobicContact CD1-CD1 4.47Å; L351-L512 HydrophobicContact CD2-CD1 3.97Å; L351-L512 HydrophobicContact CG-CD1 3.91Å; T369-L512 HydrophobicContact CG2-CB 3.92Å; T369-L512 HydrophobicContact CG2-CD1 4.4Å; L407-L512 HydrophobicContact CD1-CG 4.4Å; L407-L512 HydrophobicContact CD2-CD2 3.91Å; L407-L512 HydrophobicContact CD2-CG 4.41Å; A508-L512 VanDerWaalsContact O-CG 3.32Å; A508-L512 WeakPolarHBondContact O-CG 3.39Å; A508-L512 PolarHBondContact O-N 3.01Å; L509-L512 PolarHBondContact O-N 3.11Å; L512-Y515 WeakPolarHBondContact O-CB 3.48Å; L512-Y515 PolarHBondContact O-N 3.21Å; L512-L516 WeakPolarHBondContact O-CG 3.32Å; L512-L516 PolarHBondContact O-N 3.44Å; L512-L516 VanDerWaalsContact O-N 3.09Å
513	I	96.3	Very high	92.9	Very high	44 Å²	44	33.1 Å²	33.1	23%	0.226	16%	0.163	C	C	.	.	H	α-helix	trans	-63.6	-50.7	176.2	-69.9	171	0	0	0	109.9	V368 T369 T372 L509 L510 Y515 L516 V517	V368-I513 HydrophobicContact CG1-CD1 4.14Å; T369-I513 HydrophobicContact CG2-CG1 4.41Å; T372-I513 HydrophobicContact CG2-CG2 4.2Å; L509-I513 HydrophobicContact CD1-CD1 3.99Å; L509-I513 HydrophobicContact CD1-CG1 4.32Å; L509-I513 HydrophobicContact CG-CD1 3.92Å; L509-I513 WeakPolarHBondContact O-CG1 3.42Å; L509-I513 PolarHBondContact O-N 2.9Å; L510-I513 PolarHBondContact O-N 3.47Å; I513-Y515 VanDerWaalsContact C-N 3.26Å; I513-Y515 PolarHBondContact O-N 2.84Å; I513-L516 PolarHBondContact O-N 3.06Å; I513-L516 VanDerWaalsContact O-N 3.16Å; I513-V517 HydrophobicContact CG2-CG2 4.17Å; I513-V517 WeakPolarHBondContact O-CG2 3.31Å; I513-V517 PolarHBondContact O-N 2.86Å
514	L	96.8	Very high	93	Very high	47 Å²	47	29.7 Å²	29.7	25%	0.246	14%	0.144	C	C	.	.	H	α-helix	trans	-58.9	-40.5	178	-73.4	174.9	0	0	0	111.6	A403 I406 L510 G511 L516 V517 F518	A403-L514 HydrophobicContact CB-CB 3.92Å; I406-L514 HydrophobicContact CD1-CD1 4.01Å; L510-L514 HydrophobicContact CD1-CD1 4.08Å; L510-L514 HydrophobicContact CD1-CG 4.13Å; L510-L514 HydrophobicContact CG-CD1 3.98Å; L510-L514 HydrophobicContact CG-CG 4.42Å; L510-L514 WeakPolarHBondContact O-CB 3.32Å; L510-L514 WeakPolarHBondContact O-CG 3.34Å; L510-L514 PolarHBondContact O-N 3.21Å; G511-L514 PolarHBondContact O-N 3.31Å; L514-L516 PolarHBondContact O-N 3.48Å; L514-V517 PolarHBondContact O-N 3.46Å; L514-F518 HydrophobicContact CD2-CE2 4.46Å; L514-F518 WeakPolarHBondContact O-CD2 3.48Å; L514-F518 PolarHBondContact O-N 2.86Å; L514-F518 VanDerWaalsContact O-N 3.14Å
515	Y	97.4	Very high	92.9	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-56	-50.7	175.7	175.9	-85.2	0	0	0	110.9	S338 I340 I343 T400 A403 L404 G511 L512 I513 F518 F519	S338-Y515 WeakPolarHBondContact O-CE2 3.49Å; S338-Y515 PolarHBondContact O-OH 3.47Å; I340-Y515 VanDerWaalsContact CA-OH 3.25Å; I340-Y515 WeakPolarHBondContact CA-OH 3.38Å; I340-Y515 HydrophobicContact CD1-CE1 3.77Å; I340-Y515 PolarHBondContact N-OH 3.28Å; I343-Y515 HydrophobicContact CB-CE1 4.4Å; I343-Y515 HydrophobicContact CD1-CD1 3.62Å; I343-Y515 HydrophobicContact CD1-CD2 3.73Å; I343-Y515 HydrophobicContact CD1-CE1 3.44Å; I343-Y515 VanDerWaalsContact CD1-CE1 3.44Å; I343-Y515 HydrophobicContact CD1-CE2 3.52Å; I343-Y515 HydrophobicContact CD1-CG 3.78Å; I343-Y515 VanDerWaalsContact CD1-CZ 3.4Å; I343-Y515 HydrophobicContact CG2-CD1 4.23Å; I343-Y515 HydrophobicContact CG2-CE1 4.31Å; T400-Y515 HydrophobicContact CG2-CD2 3.55Å; T400-Y515 HydrophobicContact CG2-CE2 3.17Å; T400-Y515 HydrophobicContact CG2-CG 4.48Å; A403-Y515 VanDerWaalsContact CB-CA 3.48Å; L404-Y515 HydrophobicContact CD1-CD2 4.46Å; L404-Y515 HydrophobicContact CD1-CE2 4.04Å; L404-Y515 HydrophobicContact CD2-CD2 3.59Å; L404-Y515 HydrophobicContact CD2-CE2 3.59Å; L404-Y515 HydrophobicContact CG-CD2 3.7Å; L404-Y515 HydrophobicContact CG-CE2 3.74Å; G511-Y515 VanDerWaalsContact O-CB 3.25Å; G511-Y515 WeakPolarHBondContact O-CB 3.08Å; G511-Y515 PolarHBondContact O-N 3.36Å; L512-Y515 WeakPolarHBondContact O-CB 3.48Å; L512-Y515 PolarHBondContact O-N 3.21Å; I513-Y515 VanDerWaalsContact C-N 3.26Å; I513-Y515 PolarHBondContact O-N 2.84Å; Y515-F518 PolarHBondContact O-N 3.37Å; Y515-F519 HydrophobicContact CD1-CB 4.37Å; Y515-F519 HydrophobicContact CE1-CB 4.08Å; Y515-F519 HydrophobicContact CE1-CD2 4.35Å; Y515-F519 HydrophobicContact CE1-CG 4.17Å; Y515-F519 WeakPolarHBondContact O-CB 3.23Å; Y515-F519 PolarHBondContact O-N 2.83Å
516	L	95.8	Very high	92.9	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-71.7	-34.2	-178	-66.5	173.1	0	0	0	113	I340 M344 T369 T372 N373 L512 I513 L514 F518 F519 A520	I340-L516 HydrophobicContact CD1-CD2 3.67Å; M344-L516 HydrophobicContact SD-CD2 4.08Å; T369-L516 WeakPolarHBondContact O-CD1 3.46Å; T372-L516 HydrophobicContact CG2-CB 4.21Å; N373-L516 HydrophobicContact CB-CD1 4.31Å; N373-L516 HydrophobicContact CB-CD2 4.27Å; L512-L516 WeakPolarHBondContact O-CG 3.32Å; L512-L516 PolarHBondContact O-N 3.44Å; L512-L516 VanDerWaalsContact O-N 3.09Å; I513-L516 PolarHBondContact O-N 3.06Å; I513-L516 VanDerWaalsContact O-N 3.16Å; L514-L516 PolarHBondContact O-N 3.48Å; L516-F518 VanDerWaalsContact C-N 3.27Å; L516-F518 PolarHBondContact O-N 3.42Å; L516-F519 PolarHBondContact O-N 3.22Å; L516-A520 WeakPolarHBondContact O-CB 3.24Å; L516-A520 PolarHBondContact O-N 3.46Å
517	V	96.2	Very high	92.9	Very high	31 Å²	31	18.5 Å²	18.5	19%	0.188	10%	0.102	C	C	.	.	H	α-helix	trans	-55.4	-44.2	172.6	166.8	0	0	0	0	110.9	T372 F376 I513 L514 P521	T372-V517 HydrophobicContact CG2-CG2 3.72Å; F376-V517 HydrophobicContact CD1-CG1 4.13Å; F376-V517 HydrophobicContact CD2-CB 4.48Å; F376-V517 HydrophobicContact CD2-CG2 3.98Å; F376-V517 HydrophobicContact CE1-CB 4.4Å; F376-V517 HydrophobicContact CE1-CG1 3.71Å; F376-V517 HydrophobicContact CE1-CG2 4.37Å; F376-V517 HydrophobicContact CE2-CB 4.36Å; F376-V517 HydrophobicContact CE2-CG1 4.41Å; F376-V517 HydrophobicContact CE2-CG2 3.58Å; F376-V517 HydrophobicContact CZ-CB 4.3Å; F376-V517 HydrophobicContact CZ-CG1 3.87Å; F376-V517 HydrophobicContact CZ-CG2 3.79Å; I513-V517 HydrophobicContact CG2-CG2 4.17Å; I513-V517 WeakPolarHBondContact O-CG2 3.31Å; I513-V517 PolarHBondContact O-N 2.86Å; L514-V517 PolarHBondContact O-N 3.46Å; V517-P521 WeakPolarHBondContact O-CD 3.45Å; V517-P521 WeakPolarHBondContact O-CG 3.44Å
518	F	96.3	Very high	92.6	Very high	82 Å²	82	23 Å²	23	36%	0.36	12%	0.117	S	C	.	.	H	α-helix	trans	-84.8	-36.1	-179.1	-71.8	-64.4	0	0	0	113.2	S396 L514 Y515 L516	S396-F518 WeakPolarHBondContact CA-O 3.49Å; S396-F518 VanDerWaalsContact CB-O 3.24Å; S396-F518 WeakPolarHBondContact CB-O 3.25Å; S396-F518 PolarHBondContact OG-O 2.92Å; L514-F518 HydrophobicContact CD2-CE2 4.46Å; L514-F518 WeakPolarHBondContact O-CD2 3.48Å; L514-F518 PolarHBondContact O-N 2.86Å; L514-F518 VanDerWaalsContact O-N 3.14Å; Y515-F518 PolarHBondContact O-N 3.37Å; L516-F518 VanDerWaalsContact C-N 3.27Å; L516-F518 PolarHBondContact O-N 3.42Å
519	F	95.4	Very high	92.2	Very high	6 Å²	6	25 Å²	25	3%	0.026	13%	0.129	C	C	.	.	H	α-helix	trans	-72.4	-49.4	-177	-176.8	-84.1	0	0	0	112.5	Q335 S338 I340 S396 T400 Y515 L516 G522 M523 G524	Q335-F519 HydrophobicContact CG-CE2 4.39Å; Q335-F519 HydrophobicContact CG-CZ 3.87Å; S338-F519 WeakPolarHBondContact OG-CE2 3.22Å; I340-F519 HydrophobicContact CB-CD1 4.31Å; I340-F519 HydrophobicContact CB-CD2 4.4Å; I340-F519 HydrophobicContact CB-CE1 3.74Å; I340-F519 HydrophobicContact CB-CE2 3.83Å; I340-F519 HydrophobicContact CB-CZ 3.47Å; I340-F519 VanDerWaalsContact CB-CZ 3.47Å; I340-F519 HydrophobicContact CD1-CD1 3.53Å; I340-F519 HydrophobicContact CD1-CE1 3.64Å; I340-F519 HydrophobicContact CD1-CG 4.11Å; I340-F519 HydrophobicContact CD1-CZ 4.27Å; I340-F519 HydrophobicContact CG1-CD1 3.85Å; I340-F519 HydrophobicContact CG1-CE1 3.38Å; I340-F519 HydrophobicContact CG1-CE2 4.4Å; I340-F519 HydrophobicContact CG1-CZ 3.7Å; I340-F519 HydrophobicContact CG2-CE1 4.12Å; I340-F519 HydrophobicContact CG2-CE2 4.13Å; I340-F519 HydrophobicContact CG2-CZ 3.55Å; S396-F519 PolarHBondContact OG-O 3.13Å; T400-F519 HydrophobicContact CG2-CD2 4.18Å; Y515-F519 HydrophobicContact CD1-CB 4.37Å; Y515-F519 HydrophobicContact CE1-CB 4.08Å; Y515-F519 HydrophobicContact CE1-CD2 4.35Å; Y515-F519 HydrophobicContact CE1-CG 4.17Å; Y515-F519 WeakPolarHBondContact O-CB 3.23Å; Y515-F519 PolarHBondContact O-N 2.83Å; L516-F519 PolarHBondContact O-N 3.22Å; F519-G522 PolarHBondContact O-N 3.3Å; F519-M523 HydrophobicContact CD2-CB 3.66Å; F519-M523 HydrophobicContact CE2-CB 3.52Å; F519-M523 HydrophobicContact CG-CB 4.27Å; F519-M523 HydrophobicContact CZ-CB 4.01Å; F519-M523 PolarHBondContact O-N 2.94Å; F519-M523 VanDerWaalsContact O-N 3.13Å; F519-G524 PolarHBondContact O-N 3.05Å
520	A	92.3	Very high	91.8	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-43.9	-170.6	0	0	0	0	0	115.1	N373 F376 L516 G522 P525	N373-A520 VanDerWaalsContact OD1-CB 3.29Å; N373-A520 WeakPolarHBondContact OD1-CB 3.35Å; F376-A520 HydrophobicContact CB-CB 3.79Å; L516-A520 WeakPolarHBondContact O-CB 3.24Å; L516-A520 PolarHBondContact O-N 3.46Å; A520-G522 PolarHBondContact O-N 3.12Å; A520-P525 WeakPolarHBondContact O-CD 3.33Å
521	P	91.5	Very high	91.4	Very high	13 Å²	13	20 Å²	20	8%	0.084	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-21.8	-175.1	28.6	-33.5	0	0	0	114	G380 V517	G380-P521 VanDerWaalsContact CA-CA 3.5Å; G380-P521 WeakPolarHBondContact CA-O 3.25Å; V517-P521 WeakPolarHBondContact O-CD 3.45Å; V517-P521 WeakPolarHBondContact O-CG 3.44Å
522	G	90.9	Very high	90.7	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119	-79.7	-175.5	0	0	0	0	0	112.6	S396 F519 A520 G524 P525 M526	S396-G522 WeakPolarHBondContact OG-CA 3.22Å; F519-G522 PolarHBondContact O-N 3.3Å; A520-G522 PolarHBondContact O-N 3.12Å; G522-G524 PolarHBondContact O-N 2.85Å; G522-P525 VanDerWaalsContact O-CD 3.26Å; G522-P525 WeakPolarHBondContact O-CD 3.36Å; G522-M526 WeakPolarHBondContact O-CB 3.37Å; G522-M526 WeakPolarHBondContact O-CG 3.05Å; G522-M526 PolarHBondContact O-N 3.45Å
523	M	92.1	Very high	90.1	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-21.4	-176.1	-79.3	-61.3	-70.7	0	0	113.9	Q335 T393 S396 L397 F519 P527 I589	Q335-M523 HydrophobicContact CB-CE 4.03Å; Q335-M523 PolarHBondContact NE2-O 3.22Å; T393-M523 HydrophobicContact CG2-SD 3.5Å; T393-M523 VanDerWaalsContact CG2-SD 3.5Å; S396-M523 PolarHBondContact OG-N 2.99Å; L397-M523 HydrophobicContact CB-CG 3.85Å; L397-M523 HydrophobicContact CB-SD 4.15Å; L397-M523 HydrophobicContact CD1-CE 4.07Å; L397-M523 HydrophobicContact CD1-CG 4.07Å; L397-M523 HydrophobicContact CD1-SD 4.37Å; F519-M523 HydrophobicContact CD2-CB 3.66Å; F519-M523 HydrophobicContact CE2-CB 3.52Å; F519-M523 HydrophobicContact CG-CB 4.27Å; F519-M523 HydrophobicContact CZ-CB 4.01Å; F519-M523 PolarHBondContact O-N 2.94Å; F519-M523 VanDerWaalsContact O-N 3.13Å; M523-P527 WeakPolarHBondContact O-CD 3.38Å; M523-P527 WeakPolarHBondContact O-CG 3.3Å; M523-I589 HydrophobicContact SD-CD1 4.09Å
524	G	87.4	Confident	89.6	Confident	19 Å²	19	22.2 Å²	22.2	20%	0.196	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-71.1	169.2	0	0	0	0	0	113.3	Q335 F519 G522	Q335-G524 PolarHBondContact NE2-O 3.43Å; F519-G524 PolarHBondContact O-N 3.05Å; G522-G524 PolarHBondContact O-N 2.85Å
525	P	84.1	Confident	88.9	Confident	21 Å²	21	20 Å²	20	14%	0.136	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-28.6	-175.4	28.4	-35.3	0	0	0	114.9	A520 G522 W528 T529	A520-P525 WeakPolarHBondContact O-CD 3.33Å; G522-P525 VanDerWaalsContact O-CD 3.26Å; G522-P525 WeakPolarHBondContact O-CD 3.36Å; P525-W528 PolarHBondContact O-N 3.26Å; P525-T529 PolarHBondContact O-N 3.11Å; P525-T529 VanDerWaalsContact O-N 3.09Å; P525-T529 PolarHBondContact O-OG1 3.18Å
526	M	87.6	Confident	88.1	Confident	2 Å²	2	20.8 Å²	20.8	1%	0.01	11%	0.112	C	C	.	.	H	α-helix	trans	-64.8	-41.7	-167.5	-67.2	-61.6	92.9	0	0	115.5	V384 R389 L392 T393 G522 W528 T529 V530	V384-M526 HydrophobicContact CB-CE 4.2Å; V384-M526 HydrophobicContact CG1-CE 3.94Å; V384-M526 HydrophobicContact CG1-SD 4.36Å; V384-M526 HydrophobicContact CG2-CE 3.12Å; V384-M526 HydrophobicContact CG2-SD 3.85Å; R389-M526 HydrophobicContact CB-SD 4.35Å; R389-M526 HydrophobicContact CG-SD 4.15Å; L392-M526 HydrophobicContact CD2-CG 4.49Å; L392-M526 HydrophobicContact CD2-SD 4.31Å; T393-M526 HydrophobicContact CG2-CB 4.16Å; T393-M526 WeakPolarHBondContact OG1-CB 3.47Å; T393-M526 WeakPolarHBondContact OG1-CG 3.33Å; G522-M526 WeakPolarHBondContact O-CB 3.37Å; G522-M526 WeakPolarHBondContact O-CG 3.05Å; G522-M526 PolarHBondContact O-N 3.45Å; M526-W528 PolarHBondContact O-N 2.98Å; M526-T529 PolarHBondContact O-N 3.24Å; M526-V530 WeakPolarHBondContact O-CB 3.34Å; M526-V530 VanDerWaalsContact O-CG2 3.29Å; M526-V530 WeakPolarHBondContact O-CG2 3.2Å; M526-V530 PolarHBondContact O-N 3.23Å
527	P	89.9	Confident	87	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-56	-35.1	175.7	-29.3	38.6	0	0	0	112.9	L331 Q332 Q335 M523 N531	L331-P527 HydrophobicContact CB-CB 4.17Å; Q332-P527 HydrophobicContact CG-CB 4.49Å; Q335-P527 HydrophobicContact CB-CG 4.06Å; Q335-P527 HydrophobicContact CG-CG 4.21Å; M523-P527 WeakPolarHBondContact O-CD 3.38Å; M523-P527 WeakPolarHBondContact O-CG 3.3Å; P527-N531 VanDerWaalsContact O-CB 3.26Å; P527-N531 WeakPolarHBondContact O-CB 3.44Å; P527-N531 PolarHBondContact O-N 2.03Å; P527-N531 PolarHBondContact O-ND2 2.82Å
528	W	84.7	Confident	86.1	Confident	110 Å²	110	27.2 Å²	27.2	42%	0.417	14%	0.141	S	C	.	.	H	α-helix	trans	-75.1	-46.9	177.3	-63.4	97.9	0	0	0	112.1	P525 M526 S532 S548	P525-W528 PolarHBondContact O-N 3.26Å; M526-W528 PolarHBondContact O-N 2.98Å; W528-S532 PolarHBondContact O-N 3.08Å; W528-S548 WeakPolarHBondContact CZ3-OG 3.47Å
529	T	82.2	Confident	85.2	Confident	43 Å²	43	23.3 Å²	23.3	26%	0.264	12%	0.124	S	C	.	.	H	α-helix	trans	-62.5	-49	179.2	-56.6	0	0	0	0	111.5	P525 M526 N531 S532 E533	P525-T529 PolarHBondContact O-N 3.11Å; P525-T529 VanDerWaalsContact O-N 3.09Å; P525-T529 PolarHBondContact O-OG1 3.18Å; M526-T529 PolarHBondContact O-N 3.24Å; T529-N531 PolarHBondContact O-N 2.9Å; T529-S532 PolarHBondContact O-N 3.34Å; T529-S532 VanDerWaalsContact O-N 3.12Å; T529-S532 PolarHBondContact O-OG 3.41Å; T529-E533 PolarHBondContact O-N 2.92Å
530	V	86.5	Confident	84.4	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-62.7	-43.9	-179.1	174	0	0	0	0	110.8	L331 R389 M526 S532 E533 I534 L593	L331-V530 HydrophobicContact CD1-CB 3.95Å; L331-V530 HydrophobicContact CD1-CG1 3.66Å; L331-V530 HydrophobicContact CD1-CG2 4.5Å; R389-V530 HydrophobicContact CB-CG2 4.16Å; R389-V530 HydrophobicContact CG-CG2 4.37Å; M526-V530 WeakPolarHBondContact O-CB 3.34Å; M526-V530 VanDerWaalsContact O-CG2 3.29Å; M526-V530 WeakPolarHBondContact O-CG2 3.2Å; M526-V530 PolarHBondContact O-N 3.23Å; V530-S532 PolarHBondContact O-N 3.05Å; V530-E533 PolarHBondContact O-N 3.4Å; V530-I534 HydrophobicContact CG1-CD1 4.43Å; V530-I534 HydrophobicContact CG1-CG2 3.55Å; V530-I534 WeakPolarHBondContact O-CG1 3.48Å; V530-I534 WeakPolarHBondContact O-CG2 3.35Å; V530-I534 PolarHBondContact O-N 3.45Å; V530-L593 HydrophobicContact CG1-CD1 3.92Å
531	N	85.3	Confident	83.4	Confident	2 Å²	2	29.6 Å²	29.6	1%	0.011	16%	0.161	C	C	.	.	H	α-helix	trans	-57.1	-36.1	176.1	-91.6	-58.8	0	0	0	112.3	G328 Q332 P527 T529 E533 Y535 N544 S547	G328-N531 WeakPolarHBondContact CA-OD1 3.09Å; G328-N531 PolarHBondContact O-ND2 2.86Å; Q332-N531 WeakPolarHBondContact CG-ND2 3Å; P527-N531 VanDerWaalsContact O-CB 3.26Å; P527-N531 WeakPolarHBondContact O-CB 3.44Å; P527-N531 PolarHBondContact O-N 2.03Å; P527-N531 PolarHBondContact O-ND2 2.82Å; T529-N531 PolarHBondContact O-N 2.9Å; N531-E533 VanDerWaalsContact C-N 3.28Å; N531-E533 PolarHBondContact O-N 2.87Å; N531-Y535 HydrophobicContact CB-CE2 4.41Å; N531-Y535 WeakPolarHBondContact O-CD2 3.48Å; N531-Y535 VanDerWaalsContact O-CE2 3.29Å; N531-Y535 WeakPolarHBondContact O-CE2 3.32Å; N531-Y535 PolarHBondContact OD1-OH 3.29Å; N531-Y535 VanDerWaalsContact OD1-OH 3.12Å; N531-N544 WeakPolarHBondContact CB-OD1 3.16Å; N531-N544 PolarHBondContact O-OD1 2.98Å; N531-S547 VanDerWaalsContact OD1-CB 3.29Å; N531-S547 WeakPolarHBondContact OD1-CB 3.4Å; N531-S547 PolarHBondContact OD1-OG 3.36Å
532	S	80.1	Confident	82.9	Confident	54 Å²	54	30.6 Å²	30.6	38%	0.378	17%	0.167	S	C	.	.	H	α-helix	trans	-71.4	-20.9	176.6	76.7	0	0	0	0	114.6	W528 T529 V530 R540 N544	W528-S532 PolarHBondContact O-N 3.08Å; T529-S532 PolarHBondContact O-N 3.34Å; T529-S532 VanDerWaalsContact O-N 3.12Å; T529-S532 PolarHBondContact O-OG 3.41Å; V530-S532 PolarHBondContact O-N 3.05Å; S532-R540 PolarHBondContact O-NE 2.83Å; S532-N544 PolarHBondContact N-OD1 3.5Å
533	E	83.4	Confident	82.5	Confident	35 Å²	35	30.6 Å²	30.6	16%	0.164	17%	0.167	C	C	.	.	H	α-helix	trans	-97.1	-36.2	-176	-67.9	177.8	174.1	0	0	112.8	R389 T529 V530 N531 Y535 T596 I604	R389-E533 IonicContact CZ-OE1 3.73Å; R389-E533 IonicContact NE-OE1 2.9Å; R389-E533 PolarHBondContact NE-OE1 2.91Å; R389-E533 IonicContact NE-OE2 3.58Å; R389-E533 PolarHBondContact NE-OE2 3.16Å; R389-E533 IonicContact NH2-OE1 2.88Å; R389-E533 PolarHBondContact NH2-OE1 3.5Å; T529-E533 PolarHBondContact O-N 2.92Å; V530-E533 PolarHBondContact O-N 3.4Å; N531-E533 VanDerWaalsContact C-N 3.28Å; N531-E533 PolarHBondContact O-N 2.87Å; E533-Y535 PolarHBondContact O-N 3.34Å; E533-T596 WeakPolarHBondContact OE2-CB 3.35Å; E533-T596 PolarHBondContact OE2-OG1 3.09Å; E533-I604 HydrophobicContact CB-CD1 4.49Å; E533-I604 WeakPolarHBondContact O-CD1 3.49Å
534	I	85.9	Confident	82	Confident	1 Å²	1	32.6 Å²	32.6	1%	0.005	18%	0.178	C	C	.	.	H	α-helix	trans	-76.8	-15.9	-166.4	62	178.9	0	0	0	116.3	A324 V530 T596 F608	A324-I534 VanDerWaalsContact O-CD1 3.28Å; A324-I534 WeakPolarHBondContact O-CD1 3.05Å; V530-I534 HydrophobicContact CG1-CD1 4.43Å; V530-I534 HydrophobicContact CG1-CG2 3.55Å; V530-I534 WeakPolarHBondContact O-CG1 3.48Å; V530-I534 WeakPolarHBondContact O-CG2 3.35Å; V530-I534 PolarHBondContact O-N 3.45Å; I534-T596 HydrophobicContact CG2-CG2 4.01Å; I534-F608 HydrophobicContact CB-CE2 4.01Å; I534-F608 HydrophobicContact CB-CZ 4.04Å; I534-F608 HydrophobicContact CG2-CE2 4.28Å; I534-F608 HydrophobicContact CG2-CZ 4.05Å
535	Y	83.1	Confident	81.7	Confident	2 Å²	2	34 Å²	34	1%	0.008	19%	0.187	C	C	.	.	S	Bend	trans	-97.5	140.9	-175.4	-59.8	-64.4	0	0	0	112.6	M315 A324 L325 N531 E533 R540 G543 S547	M315-Y535 HydrophobicContact CE-CD1 3.81Å; M315-Y535 HydrophobicContact CE-CE1 3.93Å; A324-Y535 HydrophobicContact CB-CD1 3.99Å; A324-Y535 HydrophobicContact CB-CE1 4Å; L325-Y535 HydrophobicContact CB-CE1 4.33Å; L325-Y535 HydrophobicContact CD1-CE1 4.27Å; N531-Y535 HydrophobicContact CB-CE2 4.41Å; N531-Y535 WeakPolarHBondContact O-CD2 3.48Å; N531-Y535 VanDerWaalsContact O-CE2 3.29Å; N531-Y535 WeakPolarHBondContact O-CE2 3.32Å; N531-Y535 PolarHBondContact OD1-OH 3.29Å; N531-Y535 VanDerWaalsContact OD1-OH 3.12Å; E533-Y535 PolarHBondContact O-N 3.34Å; Y535-R540 PolarHBondContact O-NE 3.37Å; Y535-R540 PolarHBondContact O-NH2 3.34Å; Y535-R540 VanDerWaalsContact O-NH2 3.07Å; Y535-G543 VanDerWaalsContact CE2-C 3.45Å; Y535-S547 PolarHBondContact OH-OG 3.41Å
536	P	79.7	Confident	81.8	Confident	15 Å²	15	34.8 Å²	34.8	10%	0.097	19%	0.193	C	C	.	.			trans	-64.2	156.8	170.4	28.9	-33.7	0	0	0	110.5	T321 W538 A539 R540	T321-P536 HydrophobicContact CG2-CG 3.58Å; P536-W538 VanDerWaalsContact C-N 3.34Å; P536-W538 HydrophobicContact CG-CZ2 4.17Å; P536-W538 PolarHBondContact O-N 3.43Å; P536-A539 HydrophobicContact CG-CB 3.81Å; P536-A539 PolarHBondContact O-N 2.86Å; P536-R540 WeakPolarHBondContact O-CB 3.46Å; P536-R540 PolarHBondContact O-N 3.37Å
537	L	73.3	Confident	81.8	Confident	123 Å²	123	34.7 Å²	34.7	64%	0.644	19%	0.192	S	C	*	.	G	3₁₀ helix	trans	-52.9	-47.9	-170.3	-72.3	167.8	0	0	0	113	A539 R540	L537-A539 PolarHBondContact O-N 2.89Å; L537-R540 PolarHBondContact O-N 3.48Å
538	W	75.9	Confident	81.6	Confident	44 Å²	44	35.9 Å²	35.9	17%	0.167	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-62.6	-24.1	179.5	66.6	-96.4	0	0	0	114	E304 V311 R314 M315 Y318 T321 P536	E304-W538 WeakPolarHBondContact OE2-CB 3.47Å; V311-W538 HydrophobicContact CG1-CE3 4.03Å; V311-W538 HydrophobicContact CG1-CZ3 4.06Å; R314-W538 HydrophobicContact CB-CH2 4.49Å; R314-W538 HydrophobicContact CB-CZ3 4.17Å; R314-W538 HydrophobicContact CG-CH2 3.89Å; R314-W538 HydrophobicContact CG-CZ3 3.86Å; M315-W538 HydrophobicContact CG-CH2 3.99Å; M315-W538 HydrophobicContact CG-CZ3 3.77Å; Y318-W538 HydrophobicContact CD1-CZ2 4.32Å; T321-W538 HydrophobicContact CG2-CH2 3.82Å; T321-W538 HydrophobicContact CG2-CZ2 3.52Å; P536-W538 VanDerWaalsContact C-N 3.34Å; P536-W538 HydrophobicContact CG-CZ2 4.17Å; P536-W538 PolarHBondContact O-N 3.43Å
539	A	77.4	Confident	81.6	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-105.7	-12.9	-175.2	0	0	0	0	0	113.7	M315 T321 P536 L537 S541 T542 G543	M315-A539 HydrophobicContact CE-CB 3.85Å; M315-A539 HydrophobicContact CG-CB 3.8Å; M315-A539 HydrophobicContact SD-CB 3.75Å; T321-A539 HydrophobicContact CG2-CB 4.31Å; P536-A539 HydrophobicContact CG-CB 3.81Å; P536-A539 PolarHBondContact O-N 2.86Å; L537-A539 PolarHBondContact O-N 2.89Å; A539-S541 PolarHBondContact O-N 3.14Å; A539-T542 PolarHBondContact O-N 3.39Å; A539-G543 PolarHBondContact O-N 2.57Å
540	R	78.6	Confident	82.1	Confident	51 Å²	51	31.3 Å²	31.3	19%	0.192	19%	0.186	C	C	.	.	H	α-helix	trans	-63	-44.6	-164.2	-176.6	175.8	-62	161.8	4.7	114.4	S532 Y535 P536 L537 N544	S532-R540 PolarHBondContact O-NE 2.83Å; Y535-R540 PolarHBondContact O-NE 3.37Å; Y535-R540 PolarHBondContact O-NH2 3.34Å; Y535-R540 VanDerWaalsContact O-NH2 3.07Å; P536-R540 WeakPolarHBondContact O-CB 3.46Å; P536-R540 PolarHBondContact O-N 3.37Å; L537-R540 PolarHBondContact O-N 3.48Å; R540-N544 WeakPolarHBondContact O-CB 3.38Å; R540-N544 PolarHBondContact O-N 3.48Å; R540-N544 PolarHBondContact O-ND2 2.83Å
541	S	72.1	Confident	82.2	Confident	87 Å²	87	31.6 Å²	31.6	61%	0.608	19%	0.187	S	C	*	.	H	α-helix	trans	-62.1	-44.9	179.2	56.7	0	0	0	0	111.4	A539 A545	A539-S541 PolarHBondContact O-N 3.14Å; S541-A545 WeakPolarHBondContact O-CB 3.24Å; S541-A545 PolarHBondContact O-N 2.9Å
542	T	80.5	Confident	82.4	Confident	34 Å²	34	32.4 Å²	32.4	21%	0.209	19%	0.19	C	C	.	.	H	α-helix	trans	-69.1	-42.9	-179.7	-59.1	0	0	0	0	111.6	V311 I312 M315 A539 A545 C546	V311-T542 HydrophobicContact CG1-CG2 4.47Å; I312-T542 HydrophobicContact CB-CG2 3.94Å; I312-T542 HydrophobicContact CD1-CG2 4.04Å; I312-T542 HydrophobicContact CG1-CG2 4.17Å; M315-T542 HydrophobicContact SD-CG2 3.88Å; A539-T542 PolarHBondContact O-N 3.39Å; T542-A545 PolarHBondContact O-N 3.25Å; T542-C546 WeakPolarHBondContact O-CB 3.25Å; T542-C546 PolarHBondContact O-N 3.33Å
543	G	83.7	Confident	82.9	Confident	0 Å²	0	35 Å²	35	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-60.3	-49.9	175.8	0	0	0	0	0	112.5	Y535 A539 A545 C546 S547	Y535-G543 VanDerWaalsContact CE2-C 3.45Å; A539-G543 PolarHBondContact O-N 2.57Å; G543-A545 VanDerWaalsContact C-N 3.32Å; G543-A545 PolarHBondContact O-N 3.46Å; G543-C546 PolarHBondContact O-N 2.91Å; G543-S547 PolarHBondContact O-N 3.38Å; G543-S547 PolarHBondContact O-OG 2.91Å
544	N	81.4	Confident	83.4	Confident	42 Å²	42	35.7 Å²	35.7	23%	0.225	20%	0.201	C	C	.	.	H	α-helix	trans	-58.5	-41.9	175.5	-79.8	-35.4	0	0	0	112.5	N531 S532 R540 S548	N531-N544 WeakPolarHBondContact CB-OD1 3.16Å; N531-N544 PolarHBondContact O-OD1 2.98Å; S532-N544 PolarHBondContact N-OD1 3.5Å; R540-N544 WeakPolarHBondContact O-CB 3.38Å; R540-N544 PolarHBondContact O-N 3.48Å; R540-N544 PolarHBondContact O-ND2 2.83Å; N544-S548 VanDerWaalsContact O-CB 3.28Å; N544-S548 WeakPolarHBondContact O-CB 3.44Å; N544-S548 PolarHBondContact O-N 3Å; N544-S548 PolarHBondContact O-OG 3.49Å
545	A	80.3	Confident	83.6	Confident	48 Å²	48	35.7 Å²	35.7	40%	0.397	20%	0.201	S	C	.	.	H	α-helix	trans	-64.1	-43.2	178	0	0	0	0	0	112	S541 T542 G543 S548 G549	S541-A545 WeakPolarHBondContact O-CB 3.24Å; S541-A545 PolarHBondContact O-N 2.9Å; T542-A545 PolarHBondContact O-N 3.25Å; G543-A545 VanDerWaalsContact C-N 3.32Å; G543-A545 PolarHBondContact O-N 3.46Å; A545-S548 PolarHBondContact O-N 2.67Å; A545-G549 PolarHBondContact O-N 3.45Å
546	C	85.4	Confident	84	Confident	38 Å²	38	37.1 Å²	37.1	26%	0.257	21%	0.21	S	C	.	.	H	α-helix	trans	-64.7	-48.4	178.2	-172.9	0	0	0	0	111.9	L325 T542 G543 S548 G549 I550	L325-C546 HydrophobicContact CD1-CB 3.92Å; T542-C546 WeakPolarHBondContact O-CB 3.25Å; T542-C546 PolarHBondContact O-N 3.33Å; G543-C546 PolarHBondContact O-N 2.91Å; C546-S548 VanDerWaalsContact C-N 3.31Å; C546-S548 PolarHBondContact O-N 3.37Å; C546-G549 PolarHBondContact O-N 2.96Å; C546-G549 VanDerWaalsContact O-N 3.17Å; C546-I550 PolarHBondContact O-N 3.43Å
547	S	89.1	Confident	84.7	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-59.8	-41.5	176.3	-62.6	0	0	0	0	111.9	G328 C329 Q332 N531 Y535 G543 I550 N551	G328-S547 VanDerWaalsContact C-OG 3.26Å; C329-S547 PolarHBondContact N-OG 3.43Å; Q332-S547 WeakPolarHBondContact CB-O 3.42Å; Q332-S547 WeakPolarHBondContact CG-O 3.38Å; N531-S547 VanDerWaalsContact OD1-CB 3.29Å; N531-S547 WeakPolarHBondContact OD1-CB 3.4Å; N531-S547 PolarHBondContact OD1-OG 3.36Å; Y535-S547 PolarHBondContact OH-OG 3.41Å; G543-S547 PolarHBondContact O-N 3.38Å; G543-S547 PolarHBondContact O-OG 2.91Å; S547-I550 PolarHBondContact O-N 3.19Å; S547-N551 PolarHBondContact O-N 3.23Å
548	S	84.1	Confident	85.6	Confident	25 Å²	25	34.9 Å²	34.9	18%	0.175	20%	0.198	C	C	.	.	H	α-helix	trans	-65.9	-39.4	175.5	-56	0	0	0	0	112.2	W528 N544 A545 C546 I550 N551 W552	W528-S548 WeakPolarHBondContact CZ3-OG 3.47Å; N544-S548 VanDerWaalsContact O-CB 3.28Å; N544-S548 WeakPolarHBondContact O-CB 3.44Å; N544-S548 PolarHBondContact O-N 3Å; N544-S548 PolarHBondContact O-OG 3.49Å; A545-S548 PolarHBondContact O-N 2.67Å; C546-S548 VanDerWaalsContact C-N 3.31Å; C546-S548 PolarHBondContact O-N 3.37Å; S548-I550 VanDerWaalsContact C-N 3.31Å; S548-I550 PolarHBondContact O-N 3.07Å; S548-N551 VanDerWaalsContact O-CB 3.26Å; S548-N551 WeakPolarHBondContact O-CB 3.41Å; S548-N551 PolarHBondContact O-N 2.02Å; S548-W552 PolarHBondContact O-N 3.26Å
549	G	86	Confident	86.2	Confident	14 Å²	14	32.8 Å²	32.8	14%	0.144	19%	0.19	C	C	.	.	H	α-helix	trans	-58.8	-43.1	174.3	0	0	0	0	0	112	A545 C546 W552 I553	A545-G549 PolarHBondContact O-N 3.45Å; C546-G549 PolarHBondContact O-N 2.96Å; C546-G549 VanDerWaalsContact O-N 3.17Å; G549-W552 PolarHBondContact O-N 3.43Å; G549-I553 VanDerWaalsContact O-CG1 3.26Å; G549-I553 WeakPolarHBondContact O-CG1 3.35Å; G549-I553 PolarHBondContact O-N 2.99Å
550	I	91.3	Very high	86.9	Confident	43 Å²	43	36 Å²	36	22%	0.221	21%	0.207	C	C	.	.	H	α-helix	trans	-64.3	-40.9	174.8	-73	172.1	0	0	0	111.4	C329 M333 C546 S547 S548 W552 I553 F554	C329-I550 HydrophobicContact CB-CD1 3.4Å; C329-I550 VanDerWaalsContact CB-CD1 3.4Å; C329-I550 WeakPolarHBondContact SG-CD1 3.02Å; M333-I550 HydrophobicContact CB-CG2 3.96Å; C546-I550 PolarHBondContact O-N 3.43Å; S547-I550 PolarHBondContact O-N 3.19Å; S548-I550 VanDerWaalsContact C-N 3.31Å; S548-I550 PolarHBondContact O-N 3.07Å; I550-W552 VanDerWaalsContact C-N 3.34Å; I550-W552 PolarHBondContact O-N 2.92Å; I550-I553 PolarHBondContact O-N 3.36Å; I550-F554 HydrophobicContact CG2-CD2 3.75Å; I550-F554 HydrophobicContact CG2-CE2 3.97Å; I550-F554 WeakPolarHBondContact O-CD2 3.15Å; I550-F554 PolarHBondContact O-N 3.37Å
551	N	90.6	Very high	87.6	Confident	6 Å²	6	36 Å²	36	3%	0.032	21%	0.213	C	C	.	.	H	α-helix	trans	-52.9	-53.3	172.9	-170.7	-86.7	0	0	0	110.9	Q332 Q335 Q336 S547 S548 I553 F554 N555	Q332-N551 HydrophobicContact CB-CB 3.98Å; Q332-N551 HydrophobicContact CG-CB 4.35Å; Q332-N551 PolarHBondContact OE1-ND2 3.12Å; Q335-N551 PolarHBondContact OE1-ND2 3.49Å; Q336-N551 WeakPolarHBondContact CG-O 3.45Å; Q336-N551 VanDerWaalsContact NE2-CG 3.31Å; Q336-N551 PolarHBondContact NE2-ND2 3.1Å; Q336-N551 PolarHBondContact NE2-OD1 2.79Å; S547-N551 PolarHBondContact O-N 3.23Å; S548-N551 VanDerWaalsContact O-CB 3.26Å; S548-N551 WeakPolarHBondContact O-CB 3.41Å; S548-N551 PolarHBondContact O-N 2.02Å; N551-I553 PolarHBondContact O-N 3.37Å; N551-F554 PolarHBondContact O-N 3.42Å; N551-N555 VanDerWaalsContact O-CB 3.26Å; N551-N555 WeakPolarHBondContact O-CB 3.44Å; N551-N555 PolarHBondContact O-N 2.92Å
552	W	87.9	Confident	88.6	Confident	18 Å²	18	32 Å²	32	7%	0.068	18%	0.184	C	C	.	.	H	α-helix	trans	-66.4	-38.4	-177.8	-69.6	114.7	0	0	0	113.4	F94 V127 A130 A131 I184 S548 G549 I550 N555 V556	F94-W552 HydrophobicContact CE2-CH2 4.29Å; F94-W552 HydrophobicContact CZ-CH2 4.24Å; V127-W552 HydrophobicContact CG1-CE3 3.69Å; V127-W552 HydrophobicContact CG1-CZ3 3.99Å; A130-W552 HydrophobicContact CB-CE3 4.42Å; A130-W552 HydrophobicContact CB-CH2 4.18Å; A130-W552 HydrophobicContact CB-CZ3 4.01Å; A131-W552 HydrophobicContact CB-CB 3.59Å; A131-W552 HydrophobicContact CB-CG 4.13Å; I184-W552 HydrophobicContact CG2-CH2 4.41Å; S548-W552 PolarHBondContact O-N 3.26Å; G549-W552 PolarHBondContact O-N 3.43Å; I550-W552 VanDerWaalsContact C-N 3.34Å; I550-W552 PolarHBondContact O-N 2.92Å; W552-N555 WeakPolarHBondContact O-CB 3.13Å; W552-N555 PolarHBondContact O-N 3.46Å; W552-V556 WeakPolarHBondContact O-CG2 3.45Å; W552-V556 PolarHBondContact O-N 3.33Å
553	I	90.6	Very high	89	Confident	110 Å²	110	30.9 Å²	30.9	56%	0.564	18%	0.177	S	C	*	.	H	α-helix	trans	-61.1	-49.4	176.9	-71.2	164.7	0	0	0	110.8	G549 I550 N551 N555 V556 L557	G549-I553 VanDerWaalsContact O-CG1 3.26Å; G549-I553 WeakPolarHBondContact O-CG1 3.35Å; G549-I553 PolarHBondContact O-N 2.99Å; I550-I553 PolarHBondContact O-N 3.36Å; N551-I553 PolarHBondContact O-N 3.37Å; I553-N555 VanDerWaalsContact C-N 3.31Å; I553-N555 PolarHBondContact O-N 3.4Å; I553-V556 PolarHBondContact O-N 2.98Å; I553-L557 WeakPolarHBondContact O-CB 3.01Å; I553-L557 PolarHBondContact O-N 3.13Å
554	F	93.6	Very high	89.3	Confident	48 Å²	48	33.6 Å²	33.6	21%	0.211	19%	0.189	C	C	.	.	H	α-helix	trans	-70.6	-30	179.3	-82.4	-87.7	0	0	0	112.2	M333 Q336 L337 I550 N551 L557 V558	M333-F554 HydrophobicContact CB-CD2 4.21Å; M333-F554 HydrophobicContact CB-CE2 4.22Å; M333-F554 HydrophobicContact CG-CD1 3.93Å; M333-F554 HydrophobicContact CG-CD2 3.83Å; M333-F554 HydrophobicContact CG-CE1 3.7Å; M333-F554 HydrophobicContact CG-CE2 3.6Å; M333-F554 HydrophobicContact CG-CG 3.98Å; M333-F554 HydrophobicContact CG-CZ 3.53Å; M333-F554 HydrophobicContact SD-CE1 4.03Å; M333-F554 HydrophobicContact SD-CE2 3.86Å; M333-F554 HydrophobicContact SD-CZ 3.49Å; M333-F554 WeakPolarHBondContact SD-CZ 3.38Å; Q336-F554 HydrophobicContact CB-CB 3.71Å; Q336-F554 HydrophobicContact CG-CB 4.22Å; L337-F554 HydrophobicContact CD1-CD1 4.3Å; L337-F554 HydrophobicContact CD1-CE1 4.18Å; L337-F554 HydrophobicContact CD2-CD1 3.72Å; L337-F554 HydrophobicContact CD2-CE1 4.08Å; L337-F554 HydrophobicContact CG-CD1 3.9Å; L337-F554 HydrophobicContact CG-CE1 4.26Å; I550-F554 HydrophobicContact CG2-CD2 3.75Å; I550-F554 HydrophobicContact CG2-CE2 3.97Å; I550-F554 WeakPolarHBondContact O-CD2 3.15Å; I550-F554 PolarHBondContact O-N 3.37Å; N551-F554 PolarHBondContact O-N 3.42Å; F554-L557 HydrophobicContact CD1-CD2 4.02Å; F554-L557 HydrophobicContact CE1-CD2 4.14Å; F554-L557 PolarHBondContact O-N 3.45Å; F554-V558 WeakPolarHBondContact O-CB 3.28Å; F554-V558 VanDerWaalsContact O-CG2 3.25Å; F554-V558 WeakPolarHBondContact O-CG2 3.45Å; F554-V558 PolarHBondContact O-N 2.99Å
555	N	91.4	Very high	89.8	Confident	2 Å²	2	32.9 Å²	32.9	1%	0.011	19%	0.187	C	C	.	.	H	α-helix	trans	-61.2	-47.6	171.5	-171.2	-4.6	0	0	0	111.3	V127 Q336 N341 N551 W552 I553 S559	V127-N555 HydrophobicContact CG1-CB 3.78Å; V127-N555 WeakPolarHBondContact CG1-ND2 3.35Å; Q336-N555 HydrophobicContact CG-CB 4.25Å; N341-N555 WeakPolarHBondContact CB-OD1 3.22Å; N341-N555 PolarHBondContact ND2-ND2 3.27Å; N341-N555 PolarHBondContact ND2-OD1 3.13Å; N551-N555 VanDerWaalsContact O-CB 3.26Å; N551-N555 WeakPolarHBondContact O-CB 3.44Å; N551-N555 PolarHBondContact O-N 2.92Å; W552-N555 WeakPolarHBondContact O-CB 3.13Å; W552-N555 PolarHBondContact O-N 3.46Å; I553-N555 VanDerWaalsContact C-N 3.31Å; I553-N555 PolarHBondContact O-N 3.4Å; N555-S559 WeakPolarHBondContact O-CB 3.48Å; N555-S559 PolarHBondContact O-N 2.96Å; N555-S559 PolarHBondContact O-OG 3.34Å; N555-S559 PolarHBondContact OD1-OG 3.1Å
556	V	91.8	Very high	90.2	Very high	32 Å²	32	30.7 Å²	30.7	19%	0.194	17%	0.168	C	C	.	.	H	α-helix	trans	-60.1	-47.8	174.6	171.5	0	0	0	0	110.8	V127 W552 I553 V558 S559 L560	V127-V556 HydrophobicContact CB-CG2 4.06Å; V127-V556 HydrophobicContact CG1-CG2 3.68Å; W552-V556 WeakPolarHBondContact O-CG2 3.45Å; W552-V556 PolarHBondContact O-N 3.33Å; I553-V556 PolarHBondContact O-N 2.98Å; V556-V558 PolarHBondContact O-N 2.89Å; V556-S559 PolarHBondContact O-N 2.7Å; V556-L560 HydrophobicContact CG1-CD1 3.68Å; V556-L560 HydrophobicContact CG1-CG 4.32Å; V556-L560 VanDerWaalsContact O-CB 3.29Å; V556-L560 WeakPolarHBondContact O-CB 3.35Å; V556-L560 WeakPolarHBondContact O-CG 3.21Å; V556-L560 PolarHBondContact O-N 3.33Å
557	L	93.2	Very high	90.2	Very high	85 Å²	85	31.3 Å²	31.3	45%	0.445	17%	0.168	S	C	.	.	H	α-helix	trans	-57.2	-51.2	-179.1	179.3	66.3	0	0	0	111.8	I553 F554 L560 T561	I553-L557 WeakPolarHBondContact O-CB 3.01Å; I553-L557 PolarHBondContact O-N 3.13Å; F554-L557 HydrophobicContact CD1-CD2 4.02Å; F554-L557 HydrophobicContact CE1-CD2 4.14Å; F554-L557 PolarHBondContact O-N 3.45Å; L557-L560 PolarHBondContact O-N 2.96Å; L557-T561 HydrophobicContact CD1-CG2 4.42Å; L557-T561 WeakPolarHBondContact O-CB 3.38Å; L557-T561 VanDerWaalsContact O-CG2 3.31Å; L557-T561 WeakPolarHBondContact O-CG2 3.21Å; L557-T561 PolarHBondContact O-N 2.97Å; L557-T561 PolarHBondContact O-OG1 3.34Å
558	V	93	Very high	90.2	Very high	5 Å²	5	40.5 Å²	40.5	3%	0.03	20%	0.203	C	C	.	.	H	α-helix	trans	-69.5	-38.2	-177	175.6	0	0	0	0	110.8	L337 T342 F554 V556 L560 T561 F562 Y578	L337-V558 HydrophobicContact CD2-CG2 3.99Å; T342-V558 VanDerWaalsContact OG1-CG1 3.26Å; T342-V558 WeakPolarHBondContact OG1-CG1 3.49Å; F554-V558 WeakPolarHBondContact O-CB 3.28Å; F554-V558 VanDerWaalsContact O-CG2 3.25Å; F554-V558 WeakPolarHBondContact O-CG2 3.45Å; F554-V558 PolarHBondContact O-N 2.99Å; V556-V558 PolarHBondContact O-N 2.89Å; V558-L560 PolarHBondContact O-N 2.89Å; V558-T561 PolarHBondContact O-N 3.22Å; V558-T561 PolarHBondContact O-OG1 3.34Å; V558-F562 PolarHBondContact O-N 2.86Å; V558-Y578 HydrophobicContact CG1-CE1 3.97Å
559	S	88.8	Confident	90.4	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-69.3	-31.1	178	-58.2	0	0	0	0	113.5	Y346 N555 V556	Y346-S559 PolarHBondContact OH-O 3.32Å; N555-S559 WeakPolarHBondContact O-CB 3.48Å; N555-S559 PolarHBondContact O-N 2.96Å; N555-S559 PolarHBondContact O-OG 3.34Å; N555-S559 PolarHBondContact OD1-OG 3.1Å; V556-S559 PolarHBondContact O-N 2.7Å
560	L	91.7	Very high	90.6	Very high	68 Å²	68	43.7 Å²	43.7	36%	0.356	22%	0.215	S	C	.	.	H	α-helix	trans	-78.2	-17.3	177.1	-89	174.6	0	0	0	114.6	S124 V556 L557 V558	S124-L560 WeakPolarHBondContact OG-CD2 3.08Å; S124-L560 WeakPolarHBondContact OG-CG 3.33Å; V556-L560 HydrophobicContact CG1-CD1 3.68Å; V556-L560 HydrophobicContact CG1-CG 4.32Å; V556-L560 VanDerWaalsContact O-CB 3.29Å; V556-L560 WeakPolarHBondContact O-CB 3.35Å; V556-L560 WeakPolarHBondContact O-CG 3.21Å; V556-L560 PolarHBondContact O-N 3.33Å; L557-L560 PolarHBondContact O-N 2.96Å; V558-L560 PolarHBondContact O-N 2.89Å
561	T	93.1	Very high	90.6	Very high	52 Å²	52	42.6 Å²	42.6	32%	0.319	21%	0.209	S	C	.	.	H	α-helix	trans	-117.1	-9.9	-167.9	53	0	0	0	0	113.1	E120 L557 V558 T565	E120-T561 VanDerWaalsContact OE1-C 3.32Å; L557-T561 HydrophobicContact CD1-CG2 4.42Å; L557-T561 WeakPolarHBondContact O-CB 3.38Å; L557-T561 VanDerWaalsContact O-CG2 3.31Å; L557-T561 WeakPolarHBondContact O-CG2 3.21Å; L557-T561 PolarHBondContact O-N 2.97Å; L557-T561 PolarHBondContact O-OG1 3.34Å; V558-T561 PolarHBondContact O-N 3.22Å; V558-T561 PolarHBondContact O-OG1 3.34Å; T561-T565 WeakPolarHBondContact O-CB 3.34Å; T561-T565 PolarHBondContact O-N 2.88Å; T561-T565 PolarHBondContact O-OG1 2.7Å
562	F	92.4	Very high	90.6	Very high	1 Å²	1	46 Å²	46	0%	0.004	22%	0.221	C	C	.	.	H	α-helix	trans	-61.5	-52.6	-170.3	170.5	-117.7	0	0	0	114.2	E120 T342 Y346 I350 M353 V558 T565 A566 F575 Y578	E120-F562 PolarHBondContact OE1-N 2.96Å; T342-F562 HydrophobicContact CG2-CB 3.76Å; T342-F562 HydrophobicContact CG2-CD1 3.44Å; T342-F562 VanDerWaalsContact CG2-CD1 3.44Å; T342-F562 HydrophobicContact CG2-CD2 3.26Å; T342-F562 HydrophobicContact CG2-CE1 3.74Å; T342-F562 HydrophobicContact CG2-CE2 3.56Å; T342-F562 HydrophobicContact CG2-CG 3.16Å; T342-F562 HydrophobicContact CG2-CZ 3.78Å; Y346-F562 AromaticContact CD2-CD1 3.49Å; Y346-F562 HydrophobicContact CD2-CD1 3.49Å; Y346-F562 VanDerWaalsContact CD2-CD1 3.49Å; Y346-F562 AromaticContact CD2-CE1 3.99Å; Y346-F562 HydrophobicContact CD2-CE1 3.99Å; Y346-F562 HydrophobicContact CD2-CG 4.37Å; Y346-F562 HydrophobicContact CE2-CB 4.38Å; Y346-F562 AromaticContact CE2-CD1 3.88Å; Y346-F562 HydrophobicContact CE2-CD1 3.88Å; Y346-F562 AromaticContact CG-CD1 3.89Å; Y346-F562 HydrophobicContact CG-CD1 3.89Å; Y346-F562 AromaticContact CG-CE1 4Å; Y346-F562 HydrophobicContact CG-CE1 4Å; I350-F562 HydrophobicContact CD1-CE1 4.32Å; I350-F562 HydrophobicContact CD1-CZ 3.98Å; I350-F562 HydrophobicContact CG1-CE1 4.16Å; I350-F562 HydrophobicContact CG1-CZ 3.9Å; M353-F562 HydrophobicContact CE-CE1 4.18Å; M353-F562 HydrophobicContact CE-CZ 4.15Å; V558-F562 PolarHBondContact O-N 2.86Å; F562-T565 PolarHBondContact O-N 3.24Å; F562-A566 WeakPolarHBondContact O-CB 3.26Å; F562-A566 PolarHBondContact O-N 3.36Å; F562-F575 HydrophobicContact CE2-CE1 4.47Å; F562-F575 HydrophobicContact CE2-CZ 4.27Å; F562-F575 HydrophobicContact CZ-CZ 4.17Å; F562-Y578 AromaticContact CD2-CE2 3.74Å; F562-Y578 HydrophobicContact CD2-CE2 3.74Å; F562-Y578 WeakPolarHBondContact CD2-OH 3.43Å; F562-Y578 HydrophobicContact CE2-CE2 4.05Å
563	L	89.2	Confident	90.9	Very high	12 Å²	12	45.9 Å²	45.9	6%	0.063	23%	0.226	C	C	.	.	H	α-helix	trans	-67.6	-43	-176.3	-64.4	179	0	0	0	110.4	A116 Q119 E120 Y346 T565 A566 E567	A116-L563 HydrophobicContact CB-CB 3.96Å; A116-L563 HydrophobicContact CB-CD1 4.23Å; Q119-L563 HydrophobicContact CB-CD1 3.74Å; Q119-L563 HydrophobicContact CG-CD1 4.46Å; E120-L563 HydrophobicContact CG-CB 4.09Å; E120-L563 HydrophobicContact CG-CD1 4.13Å; E120-L563 HydrophobicContact CG-CG 4.15Å; E120-L563 WeakPolarHBondContact OE1-CA 3.41Å; E120-L563 WeakPolarHBondContact OE1-CB 3.44Å; E120-L563 PolarHBondContact OE1-N 3.37Å; Y346-L563 HydrophobicContact CD1-CD2 4.43Å; Y346-L563 HydrophobicContact CE1-CD1 3.99Å; Y346-L563 HydrophobicContact CE1-CD2 4.5Å; Y346-L563 HydrophobicContact CE1-CG 4.23Å; L563-T565 VanDerWaalsContact C-N 3.33Å; L563-T565 PolarHBondContact O-N 3.21Å; L563-A566 CarbonylContact O-C 3.57Å; L563-A566 WeakPolarHBondContact O-CA 3.37Å; L563-A566 WeakPolarHBondContact O-CB 3.41Å; L563-A566 PolarHBondContact O-N 3.32Å; L563-A566 VanDerWaalsContact O-N 3.15Å; L563-E567 WeakPolarHBondContact O-CG 3.5Å; L563-E567 PolarHBondContact O-N 2.98Å
564	H	91.1	Very high	91.1	Very high	57 Å²	57	40.6 Å²	40.6	26%	0.264	20%	0.199	S	C	.	.	H	α-helix	trans	-63.1	-39.4	173.6	-73.8	91.4	0	0	0	112.1	E120 A566 E567 Y568	E120-H564 VanDerWaalsContact CD-ND1 3.33Å; E120-H564 PolarHBondContact OE1-N 2.89Å; E120-H564 IonicContact OE1-ND1 3.66Å; E120-H564 PolarHBondContact OE1-ND1 2.83Å; E120-H564 IonicContact OE2-CE1 3.51Å; E120-H564 PolarHBondContact OE2-CE1 2.96Å; E120-H564 IonicContact OE2-CG 2.59Å; E120-H564 IonicContact OE2-ND1 3.4Å; E120-H564 PolarHBondContact OE2-ND1 3.22Å; H564-A566 VanDerWaalsContact C-N 3.27Å; H564-A566 PolarHBondContact O-N 3.46Å; H564-E567 PolarHBondContact O-N 3.42Å; H564-Y568 HydrophobicContact CB-CD2 4.31Å; H564-Y568 HydrophobicContact CB-CE2 4.37Å; H564-Y568 WeakPolarHBondContact O-CB 3.36Å; H564-Y568 WeakPolarHBondContact O-CD2 3.41Å; H564-Y568 PolarHBondContact O-N 2.8Å
565	T	91.2	Very high	91.1	Very high	27 Å²	27	38.4 Å²	38.4	17%	0.166	19%	0.19	C	C	.	.	H	α-helix	trans	-62	-39.9	175.5	-59.5	0	0	0	0	110.7	T561 F562 L563 L569 A574 L577	T561-T565 WeakPolarHBondContact O-CB 3.34Å; T561-T565 PolarHBondContact O-N 2.88Å; T561-T565 PolarHBondContact O-OG1 2.7Å; F562-T565 PolarHBondContact O-N 3.24Å; L563-T565 VanDerWaalsContact C-N 3.33Å; L563-T565 PolarHBondContact O-N 3.21Å; T565-L569 HydrophobicContact CG2-CD1 3.78Å; T565-L569 HydrophobicContact CG2-CG 4.39Å; T565-L569 VanDerWaalsContact O-CB 3.32Å; T565-L569 WeakPolarHBondContact O-CB 3.39Å; T565-L569 PolarHBondContact O-N 3.19Å; T565-A574 HydrophobicContact CG2-CB 4.04Å; T565-L577 HydrophobicContact CG2-CD2 3.89Å
566	A	87.9	Confident	91.4	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.008	21%	0.206	C	C	.	.	H	α-helix	trans	-65.6	-35.8	174.8	0	0	0	0	0	113	F562 L563 H564 T570 Y571 A574	F562-A566 WeakPolarHBondContact O-CB 3.26Å; F562-A566 PolarHBondContact O-N 3.36Å; L563-A566 CarbonylContact O-C 3.57Å; L563-A566 WeakPolarHBondContact O-CA 3.37Å; L563-A566 WeakPolarHBondContact O-CB 3.41Å; L563-A566 PolarHBondContact O-N 3.32Å; L563-A566 VanDerWaalsContact O-N 3.15Å; H564-A566 VanDerWaalsContact C-N 3.27Å; H564-A566 PolarHBondContact O-N 3.46Å; A566-T570 CarbonylContact O-C 3.56Å; A566-T570 WeakPolarHBondContact O-CA 3.26Å; A566-T570 PolarHBondContact O-N 3.2Å; A566-T570 VanDerWaalsContact O-N 3.12Å; A566-Y571 HydrophobicContact CB-CD1 3.89Å; A566-Y571 HydrophobicContact CB-CE1 4.33Å; A566-Y571 PolarHBondContact O-N 3.46Å; A566-A574 HydrophobicContact CB-CB 4.3Å
567	E	86.8	Confident	91.6	Very high	52 Å²	52	43.7 Å²	43.7	24%	0.243	21%	0.213	C	C	.	.	H	α-helix	trans	-71.3	-45.6	174.6	-71.5	169.9	-178.8	0	0	111.7	A116 L563 H564	A116-E567 VanDerWaalsContact CB-OE1 3.26Å; A116-E567 WeakPolarHBondContact CB-OE1 3.35Å; L563-E567 WeakPolarHBondContact O-CG 3.5Å; L563-E567 PolarHBondContact O-N 2.98Å; H564-E567 PolarHBondContact O-N 3.42Å
568	Y	88.1	Confident	91.7	Very high	192 Å²	192	40 Å²	40	75%	0.753	19%	0.193	S	C	*	.	H	α-helix	trans	-76.6	-42.4	-177	-77.3	-65.3	0	0	0	114.3	H564	H564-Y568 HydrophobicContact CB-CD2 4.31Å; H564-Y568 HydrophobicContact CB-CE2 4.37Å; H564-Y568 WeakPolarHBondContact O-CB 3.36Å; H564-Y568 WeakPolarHBondContact O-CD2 3.41Å; H564-Y568 PolarHBondContact O-N 2.8Å
569	L	89.5	Confident	91.9	Very high	87 Å²	87	40 Å²	40	46%	0.455	19%	0.193	S	C	.	.	H	α-helix	trans	-96.8	-3	-177.7	-65.2	179.3	0	0	0	113.2	T565 G573 L577	T565-L569 HydrophobicContact CG2-CD1 3.78Å; T565-L569 HydrophobicContact CG2-CG 4.39Å; T565-L569 VanDerWaalsContact O-CB 3.32Å; T565-L569 WeakPolarHBondContact O-CB 3.39Å; T565-L569 PolarHBondContact O-N 3.19Å; L569-G573 WeakPolarHBondContact O-CA 3.22Å; L569-L577 HydrophobicContact CD1-CD2 4.09Å
570	T	90.4	Very high	92.3	Very high	19 Å²	19	41.7 Å²	41.7	12%	0.117	21%	0.211	C	C	.	.			trans	71.2	161.6	-163.4	77.9	0	0	0	0	114	L446 A566 Y572 G573 A574	L446-T570 HydrophobicContact CD1-CG2 3.94Å; A566-T570 CarbonylContact O-C 3.56Å; A566-T570 WeakPolarHBondContact O-CA 3.26Å; A566-T570 PolarHBondContact O-N 3.2Å; A566-T570 VanDerWaalsContact O-N 3.12Å; T570-Y572 HydrophobicContact CG2-CE1 4.19Å; T570-Y572 PolarHBondContact O-N 3.33Å; T570-Y572 WeakPolarHBondContact OG1-CD1 3.4Å; T570-Y572 WeakPolarHBondContact OG1-CD2 3.32Å; T570-Y572 WeakPolarHBondContact OG1-CE1 3.41Å; T570-Y572 WeakPolarHBondContact OG1-CE2 3.06Å; T570-G573 PolarHBondContact O-N 3.45Å; T570-G573 VanDerWaalsContact O-N 3.13Å; T570-G573 PolarHBondContact OG1-N 2.94Å; T570-A574 PolarHBondContact O-N 3.31Å
571	Y	89.4	Confident	92.6	Very high	20 Å²	20	41.9 Å²	41.9	8%	0.078	21%	0.209	C	C	.	.	H	α-helix	trans	-55.9	-46.6	179.4	-54.8	-29.1	0	0	0	112.8	M353 F411 M445 L446 A566 F575	M353-Y571 HydrophobicContact CB-CD2 4.3Å; M353-Y571 HydrophobicContact CB-CE2 4.09Å; M353-Y571 HydrophobicContact CG-CE1 4.35Å; M353-Y571 HydrophobicContact CG-CE2 4.29Å; M353-Y571 HydrophobicContact SD-CD1 3.9Å; M353-Y571 HydrophobicContact SD-CE1 3.55Å; M353-Y571 VanDerWaalsContact SD-CE1 3.55Å; M353-Y571 HydrophobicContact SD-CE2 4.46Å; F411-Y571 HydrophobicContact CD1-CD2 4.2Å; F411-Y571 HydrophobicContact CD1-CG 4.41Å; F411-Y571 HydrophobicContact CE1-CD2 4.26Å; F411-Y571 HydrophobicContact CE1-CG 4.49Å; M445-Y571 PolarHBondContact O-OH 2.79Å; L446-Y571 HydrophobicContact CD2-CE1 4.34Å; A566-Y571 HydrophobicContact CB-CD1 3.89Å; A566-Y571 HydrophobicContact CB-CE1 4.33Å; A566-Y571 PolarHBondContact O-N 3.46Å; Y571-F575 WeakPolarHBondContact O-CD2 3.43Å; Y571-F575 PolarHBondContact O-N 2.96Å
572	Y	92.3	Very high	92.7	Very high	77 Å²	77	39.4 Å²	39.4	30%	0.302	19%	0.194	S	C	.	.	H	α-helix	trans	-68.8	-36	177.5	53.9	-96.5	0	0	0	112.3	A408 V412 A415 T570 F575 F576	A408-Y572 WeakPolarHBondContact O-CB 3.44Å; V412-Y572 HydrophobicContact CG2-CD1 4.22Å; V412-Y572 HydrophobicContact CG2-CD2 3.88Å; V412-Y572 HydrophobicContact CG2-CG 3.65Å; A415-Y572 HydrophobicContact CB-CD1 4.29Å; A415-Y572 HydrophobicContact CB-CE1 3.99Å; T570-Y572 HydrophobicContact CG2-CE1 4.19Å; T570-Y572 PolarHBondContact O-N 3.33Å; T570-Y572 WeakPolarHBondContact OG1-CD1 3.4Å; T570-Y572 WeakPolarHBondContact OG1-CD2 3.32Å; T570-Y572 WeakPolarHBondContact OG1-CE1 3.41Å; T570-Y572 WeakPolarHBondContact OG1-CE2 3.06Å; Y572-F575 PolarHBondContact O-N 3.5Å; Y572-F576 VanDerWaalsContact O-CD2 3.22Å; Y572-F576 WeakPolarHBondContact O-CD2 3.32Å; Y572-F576 PolarHBondContact O-N 2.75Å
573	G	93.9	Very high	92.9	Very high	16 Å²	16	41.2 Å²	41.2	17%	0.165	21%	0.209	C	C	.	.	H	α-helix	trans	-63.7	-39.8	177.8	0	0	0	0	0	112.5	L569 T570 F576 L577	L569-G573 WeakPolarHBondContact O-CA 3.22Å; T570-G573 PolarHBondContact O-N 3.45Å; T570-G573 VanDerWaalsContact O-N 3.13Å; T570-G573 PolarHBondContact OG1-N 2.94Å; G573-F576 PolarHBondContact O-N 3.25Å; G573-L577 PolarHBondContact O-N 3.33Å
574	A	93.6	Very high	93.3	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-61.2	-44.8	174.8	0	0	0	0	0	112.4	T565 A566 T570 L577 Y578	T565-A574 HydrophobicContact CG2-CB 4.04Å; A566-A574 HydrophobicContact CB-CB 4.3Å; T570-A574 PolarHBondContact O-N 3.31Å; A574-L577 WeakPolarHBondContact O-CB 3.32Å; A574-L577 PolarHBondContact O-N 3.4Å; A574-Y578 PolarHBondContact O-N 3.37Å; A574-Y578 VanDerWaalsContact O-N 3.13Å
575	F	95.1	Very high	93.5	Very high	2 Å²	2	41.8 Å²	41.8	1%	0.009	22%	0.217	C	C	.	.	H	α-helix	trans	-70.9	-33.1	177.8	-70	-65.1	0	0	0	113.2	I350 L404 L407 A408 F411 F562 Y571 Y572 L577 Y578 A579	I350-F575 HydrophobicContact CD1-CE1 4.44Å; I350-F575 HydrophobicContact CD1-CZ 3.97Å; I350-F575 HydrophobicContact CG1-CZ 4.11Å; I350-F575 HydrophobicContact CG2-CE2 4.35Å; I350-F575 HydrophobicContact CG2-CZ 3.89Å; L404-F575 HydrophobicContact CD2-CD1 4.28Å; L407-F575 HydrophobicContact CD2-CD1 3.6Å; L407-F575 HydrophobicContact CD2-CD2 4.35Å; L407-F575 HydrophobicContact CD2-CE1 3.5Å; L407-F575 HydrophobicContact CD2-CE2 4.29Å; L407-F575 HydrophobicContact CD2-CG 4.06Å; L407-F575 HydrophobicContact CD2-CZ 3.87Å; L407-F575 HydrophobicContact CG-CD1 4.22Å; L407-F575 HydrophobicContact CG-CD2 4.21Å; L407-F575 HydrophobicContact CG-CE1 4.36Å; L407-F575 HydrophobicContact CG-CE2 4.37Å; L407-F575 HydrophobicContact CG-CG 4.15Å; L407-F575 HydrophobicContact CG-CZ 4.44Å; A408-F575 HydrophobicContact CB-CB 3.78Å; F411-F575 AromaticContact CD2-CD2 3.72Å; F411-F575 HydrophobicContact CD2-CD2 3.72Å; F411-F575 AromaticContact CD2-CE2 3.78Å; F411-F575 HydrophobicContact CD2-CE2 3.78Å; F411-F575 AromaticContact CE2-CD2 3.8Å; F411-F575 HydrophobicContact CE2-CD2 3.8Å; F411-F575 AromaticContact CE2-CE2 3.35Å; F411-F575 HydrophobicContact CE2-CE2 3.35Å; F411-F575 HydrophobicContact CE2-CZ 4.25Å; F411-F575 HydrophobicContact CZ-CE2 4.08Å; F562-F575 HydrophobicContact CE2-CE1 4.47Å; F562-F575 HydrophobicContact CE2-CZ 4.27Å; F562-F575 HydrophobicContact CZ-CZ 4.17Å; Y571-F575 WeakPolarHBondContact O-CD2 3.43Å; Y571-F575 PolarHBondContact O-N 2.96Å; Y572-F575 PolarHBondContact O-N 3.5Å; F575-L577 VanDerWaalsContact C-N 3.33Å; F575-Y578 HydrophobicContact CD1-CD2 4.39Å; F575-Y578 PolarHBondContact O-N 3.24Å; F575-A579 WeakPolarHBondContact O-CB 3.34Å; F575-A579 PolarHBondContact O-N 3.45Å
576	F	96.9	Very high	93.7	Very high	81 Å²	81	41.8 Å²	41.8	36%	0.355	22%	0.216	S	C	.	.	H	α-helix	trans	-64.2	-36.8	170	-82.8	-56.6	0	0	0	112.5	I405 A408 L409 V412 Y572 G573 A579 G580	I405-F576 HydrophobicContact CG2-CE1 4.37Å; A408-F576 HydrophobicContact CB-CD1 3.91Å; A408-F576 HydrophobicContact CB-CD2 3.79Å; A408-F576 HydrophobicContact CB-CE1 3.89Å; A408-F576 HydrophobicContact CB-CE2 3.77Å; A408-F576 HydrophobicContact CB-CG 3.85Å; A408-F576 HydrophobicContact CB-CZ 3.82Å; L409-F576 HydrophobicContact CD2-CZ 4.05Å; L409-F576 HydrophobicContact CG-CZ 4.32Å; V412-F576 HydrophobicContact CG2-CE2 4.02Å; Y572-F576 VanDerWaalsContact O-CD2 3.22Å; Y572-F576 WeakPolarHBondContact O-CD2 3.32Å; Y572-F576 PolarHBondContact O-N 2.75Å; G573-F576 PolarHBondContact O-N 3.25Å; F576-A579 PolarHBondContact O-N 3.34Å; F576-G580 PolarHBondContact O-N 3.28Å
577	L	96.3	Very high	94	Very high	64 Å²	64	47.9 Å²	47.9	34%	0.335	25%	0.247	S	C	.	.	H	α-helix	trans	-61.2	-48.6	174.3	-179.2	69.3	0	0	0	111.2	T565 L569 G573 A574 F575 A579 G580 F581	T565-L577 HydrophobicContact CG2-CD2 3.89Å; L569-L577 HydrophobicContact CD1-CD2 4.09Å; G573-L577 PolarHBondContact O-N 3.33Å; A574-L577 WeakPolarHBondContact O-CB 3.32Å; A574-L577 PolarHBondContact O-N 3.4Å; F575-L577 VanDerWaalsContact C-N 3.33Å; L577-A579 VanDerWaalsContact C-N 3.34Å; L577-A579 PolarHBondContact O-N 2.9Å; L577-G580 WeakPolarHBondContact O-CA 3.05Å; L577-G580 PolarHBondContact O-N 2.92Å; L577-G580 VanDerWaalsContact O-N 3.11Å; L577-F581 HydrophobicContact CD1-CE1 4.44Å; L577-F581 HydrophobicContact CD1-CE2 4.06Å; L577-F581 HydrophobicContact CD1-CZ 3.87Å; L577-F581 HydrophobicContact CD2-CE2 4.09Å; L577-F581 HydrophobicContact CD2-CZ 4.44Å; L577-F581 HydrophobicContact CG-CD2 4.34Å; L577-F581 HydrophobicContact CG-CE2 3.73Å; L577-F581 HydrophobicContact CG-CZ 4.06Å; L577-F581 PolarHBondContact O-N 2.04Å
578	Y	95.6	Very high	94.3	Very high	6 Å²	6	47 Å²	47	2%	0.024	24%	0.243	C	C	.	.	H	α-helix	trans	-63.4	-37.6	175.8	-66.2	-40.2	0	0	0	112.6	L337 T342 V558 F562 A574 F575 G580 F581 A582	L337-Y578 WeakPolarHBondContact O-CD1 3.34Å; T342-Y578 HydrophobicContact CG2-CE2 4.32Å; V558-Y578 HydrophobicContact CG1-CE1 3.97Å; F562-Y578 AromaticContact CD2-CE2 3.74Å; F562-Y578 HydrophobicContact CD2-CE2 3.74Å; F562-Y578 WeakPolarHBondContact CD2-OH 3.43Å; F562-Y578 HydrophobicContact CE2-CE2 4.05Å; A574-Y578 PolarHBondContact O-N 3.37Å; A574-Y578 VanDerWaalsContact O-N 3.13Å; F575-Y578 HydrophobicContact CD1-CD2 4.39Å; F575-Y578 PolarHBondContact O-N 3.24Å; Y578-G580 VanDerWaalsContact C-N 3.29Å; Y578-G580 PolarHBondContact O-N 3.49Å; Y578-F581 HydrophobicContact CD1-CD2 4.19Å; Y578-F581 PolarHBondContact O-N 3.44Å; Y578-A582 WeakPolarHBondContact O-CB 3.05Å; Y578-A582 PolarHBondContact O-N 3Å
579	A	96.9	Very high	94.5	Very high	5 Å²	5	38 Å²	38	4%	0.041	21%	0.208	C	C	.	.	H	α-helix	trans	-61.4	-39	172.4	0	0	0	0	0	111.7	L404 I405 F575 F576 L577 A582 A583	L404-A579 HydrophobicContact CB-CB 3.82Å; L404-A579 HydrophobicContact CD1-CB 4.49Å; I405-A579 HydrophobicContact CG1-CB 3.89Å; F575-A579 WeakPolarHBondContact O-CB 3.34Å; F575-A579 PolarHBondContact O-N 3.45Å; F576-A579 PolarHBondContact O-N 3.34Å; L577-A579 VanDerWaalsContact C-N 3.34Å; L577-A579 PolarHBondContact O-N 2.9Å; A579-A582 PolarHBondContact O-N 3.17Å; A579-A583 WeakPolarHBondContact O-CB 3.38Å; A579-A583 PolarHBondContact O-N 2.81Å
580	G	97.3	Very high	94.6	Very high	36 Å²	36	40.2 Å²	40.2	37%	0.371	21%	0.211	S	C	.	.	H	α-helix	trans	-61	-47.5	173.5	0	0	0	0	0	112.4	F576 L577 Y578 A582 A583 V584	F576-G580 PolarHBondContact O-N 3.28Å; L577-G580 WeakPolarHBondContact O-CA 3.05Å; L577-G580 PolarHBondContact O-N 2.92Å; L577-G580 VanDerWaalsContact O-N 3.11Å; Y578-G580 VanDerWaalsContact C-N 3.29Å; Y578-G580 PolarHBondContact O-N 3.49Å; G580-A582 VanDerWaalsContact C-N 3.34Å; G580-A582 PolarHBondContact O-N 3.48Å; G580-A583 PolarHBondContact O-N 2.76Å; G580-V584 WeakPolarHBondContact O-CG2 3.37Å; G580-V584 PolarHBondContact O-N 2.89Å
581	F	96.7	Very high	94.5	Very high	72 Å²	72	40.2 Å²	40.2	32%	0.316	22%	0.215	S	C	.	.	H	α-helix	trans	-62.7	-40.3	175.1	-66	-38.8	0	0	0	112.6	L337 L577 Y578 A583 V584 G585	L337-F581 HydrophobicContact CB-CB 3.97Å; L337-F581 HydrophobicContact CB-CD2 4.3Å; L337-F581 HydrophobicContact CB-CG 4.31Å; L337-F581 HydrophobicContact CD2-CD2 4.23Å; L337-F581 HydrophobicContact CD2-CE2 4.39Å; L577-F581 HydrophobicContact CD1-CE1 4.44Å; L577-F581 HydrophobicContact CD1-CE2 4.06Å; L577-F581 HydrophobicContact CD1-CZ 3.87Å; L577-F581 HydrophobicContact CD2-CE2 4.09Å; L577-F581 HydrophobicContact CD2-CZ 4.44Å; L577-F581 HydrophobicContact CG-CD2 4.34Å; L577-F581 HydrophobicContact CG-CE2 3.73Å; L577-F581 HydrophobicContact CG-CZ 4.06Å; L577-F581 PolarHBondContact O-N 2.04Å; Y578-F581 HydrophobicContact CD1-CD2 4.19Å; Y578-F581 PolarHBondContact O-N 3.44Å; F581-A583 VanDerWaalsContact C-N 3.34Å; F581-A583 PolarHBondContact O-N 3.41Å; F581-V584 PolarHBondContact O-N 3.17Å; F581-G585 PolarHBondContact O-N 2.94Å
582	A	96.4	Very high	94.4	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-64.1	-38.1	175	0	0	0	0	0	111.9	L397 T401 L404 Y578 A579 G580 G585 L586	L397-A582 HydrophobicContact CD1-CB 3.99Å; L397-A582 WeakPolarHBondContact CD2-O 3.25Å; T401-A582 WeakPolarHBondContact OG1-CB 3.36Å; L404-A582 HydrophobicContact CD1-CB 4.24Å; Y578-A582 WeakPolarHBondContact O-CB 3.05Å; Y578-A582 PolarHBondContact O-N 3Å; A579-A582 PolarHBondContact O-N 3.17Å; G580-A582 VanDerWaalsContact C-N 3.34Å; G580-A582 PolarHBondContact O-N 3.48Å; A582-G585 CarbonylContact O-C 3.51Å; A582-G585 PolarHBondContact O-N 3.27Å; A582-L586 PolarHBondContact O-N 3.2Å
583	A	96.8	Very high	94.3	Very high	40 Å²	40	36.1 Å²	36.1	33%	0.331	20%	0.2	S	C	.	.	H	α-helix	trans	-65.5	-40.3	174.3	0	0	0	0	0	112.8	T401 A579 G580 F581 G585 L586 L587	T401-A583 HydrophobicContact CG2-CB 4.2Å; A579-A583 WeakPolarHBondContact O-CB 3.38Å; A579-A583 PolarHBondContact O-N 2.81Å; G580-A583 PolarHBondContact O-N 2.76Å; F581-A583 VanDerWaalsContact C-N 3.34Å; F581-A583 PolarHBondContact O-N 3.41Å; A583-G585 VanDerWaalsContact C-N 3.31Å; A583-L586 WeakPolarHBondContact O-CB 3.15Å; A583-L586 PolarHBondContact O-N 3.46Å; A583-L587 PolarHBondContact O-N 3.4Å
584	V	96.6	Very high	93.9	Very high	80 Å²	80	36.5 Å²	36.5	49%	0.485	20%	0.199	S	C	.	.	H	α-helix	trans	-63.4	-41.4	171.7	175.5	0	0	0	0	110.6	F334 G580 F581 L586 L587 F588	F334-V584 HydrophobicContact CE1-CB 4.21Å; F334-V584 HydrophobicContact CE1-CG1 3.92Å; F334-V584 HydrophobicContact CZ-CG1 3.88Å; G580-V584 WeakPolarHBondContact O-CG2 3.37Å; G580-V584 PolarHBondContact O-N 2.89Å; F581-V584 PolarHBondContact O-N 3.17Å; V584-L586 VanDerWaalsContact C-N 3.27Å; V584-L586 PolarHBondContact O-N 2.9Å; V584-L587 PolarHBondContact O-N 3.38Å; V584-F588 PolarHBondContact O-N 3.38Å
585	G	95.5	Very high	93.5	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-59.6	-35.3	173.6	0	0	0	0	0	113.1	F334 F581 A582 A583 F588 I589	F334-G585 VanDerWaalsContact CD1-CA 3.4Å; F581-G585 PolarHBondContact O-N 2.94Å; A582-G585 CarbonylContact O-C 3.51Å; A582-G585 PolarHBondContact O-N 3.27Å; A583-G585 VanDerWaalsContact C-N 3.31Å; G585-F588 WeakPolarHBondContact O-CB 3.38Å; G585-F588 PolarHBondContact O-N 3.49Å; G585-I589 VanDerWaalsContact O-CG1 3.32Å; G585-I589 WeakPolarHBondContact O-CG1 3.39Å; G585-I589 PolarHBondContact O-N 2.96Å
586	L	95.1	Very high	92.8	Very high	27 Å²	27	39.1 Å²	39.1	14%	0.141	21%	0.212	C	C	.	.	H	α-helix	trans	-63.6	-44.5	174.7	-79.7	167.9	0	0	0	112.5	F394 L397 A398 A582 A583 V584 F588 I589 Y590	F394-L586 HydrophobicContact CD2-CD2 3.9Å; F394-L586 HydrophobicContact CE2-CD2 3.85Å; F394-L586 HydrophobicContact CZ-CD2 4.43Å; F394-L586 WeakPolarHBondContact O-CD2 3.41Å; L397-L586 HydrophobicContact CB-CD2 3.77Å; L397-L586 HydrophobicContact CB-CG 4.24Å; L397-L586 HydrophobicContact CD2-CD2 4.11Å; L397-L586 HydrophobicContact CD2-CG 3.92Å; L397-L586 HydrophobicContact CG-CD2 3.97Å; L397-L586 HydrophobicContact CG-CG 3.86Å; A398-L586 HydrophobicContact CB-CD1 4.23Å; A398-L586 HydrophobicContact CB-CD2 3.91Å; A582-L586 PolarHBondContact O-N 3.2Å; A583-L586 WeakPolarHBondContact O-CB 3.15Å; A583-L586 PolarHBondContact O-N 3.46Å; V584-L586 VanDerWaalsContact C-N 3.27Å; V584-L586 PolarHBondContact O-N 2.9Å; L586-F588 VanDerWaalsContact C-N 3.28Å; L586-F588 PolarHBondContact O-N 3.5Å; L586-I589 PolarHBondContact O-N 3.24Å; L586-Y590 VanDerWaalsContact O-CB 3.26Å; L586-Y590 WeakPolarHBondContact O-CB 3.45Å; L586-Y590 PolarHBondContact O-N 3.33Å
587	L	94.3	Very high	91.8	Very high	129 Å²	129	39.4 Å²	39.4	68%	0.675	21%	0.213	S	C	*	.	H	α-helix	trans	-62.4	-40.7	176	-63	176.3	0	0	0	110.8	A583 V584 Y590 G591	A583-L587 PolarHBondContact O-N 3.4Å; V584-L587 PolarHBondContact O-N 3.38Å; L587-Y590 PolarHBondContact O-N 3.14Å; L587-G591 PolarHBondContact O-N 3.33Å
588	F	94.5	Very high	90.4	Very high	34 Å²	34	40 Å²	40	15%	0.149	24%	0.235	C	C	.	.	H	α-helix	trans	-62	-48.9	175.5	177.8	-97.8	0	0	0	112.3	I326 F334 V584 G585 L586 Y590 G591 C592	I326-F588 HydrophobicContact CG2-CE2 4.36Å; F334-F588 HydrophobicContact CD2-CB 4.22Å; F334-F588 AromaticContact CD2-CD1 3.82Å; F334-F588 HydrophobicContact CD2-CD1 3.82Å; F334-F588 HydrophobicContact CD2-CE1 4.44Å; F334-F588 HydrophobicContact CD2-CG 4.1Å; F334-F588 HydrophobicContact CE2-CB 3.61Å; F334-F588 AromaticContact CE2-CD1 3.78Å; F334-F588 HydrophobicContact CE2-CD1 3.78Å; F334-F588 HydrophobicContact CE2-CD2 4.14Å; F334-F588 HydrophobicContact CE2-CE1 4.48Å; F334-F588 AromaticContact CE2-CG 3.57Å; F334-F588 HydrophobicContact CE2-CG 3.57Å; F334-F588 HydrophobicContact CZ-CB 4.23Å; V584-F588 PolarHBondContact O-N 3.38Å; G585-F588 WeakPolarHBondContact O-CB 3.38Å; G585-F588 PolarHBondContact O-N 3.49Å; L586-F588 VanDerWaalsContact C-N 3.28Å; L586-F588 PolarHBondContact O-N 3.5Å; F588-Y590 VanDerWaalsContact C-N 3.34Å; F588-Y590 PolarHBondContact O-N 3.19Å; F588-G591 PolarHBondContact O-N 3.35Å; F588-C592 HydrophobicContact CD2-CB 4.29Å; F588-C592 HydrophobicContact CE2-CB 4.14Å; F588-C592 HydrophobicContact CZ-CB 4.4Å; F588-C592 WeakPolarHBondContact O-CA 3.27Å; F588-C592 VanDerWaalsContact O-CB 3.25Å; F588-C592 WeakPolarHBondContact O-CB 3.46Å; F588-C592 PolarHBondContact O-N 2.96Å; F588-C592 PolarHBondContact O-SG 2.88Å
589	I	92.3	Very high	89.4	Confident	2 Å²	2	45 Å²	45	1%	0.01	26%	0.257	C	S	.	.	H	α-helix	trans	-64.1	-41.9	178.6	-70.2	175.6	0	0	0	110.7	L331 T393 F394 L397 M523 G585 L586 G591 L593	L331-I589 HydrophobicContact CD2-CD1 4.11Å; L331-I589 HydrophobicContact CD2-CG1 3.93Å; T393-I589 HydrophobicContact CG2-CD1 3.8Å; F394-I589 HydrophobicContact CB-CG2 3.99Å; F394-I589 HydrophobicContact CD2-CG2 4.13Å; L397-I589 HydrophobicContact CB-CD1 4.39Å; L397-I589 HydrophobicContact CD2-CD1 3.58Å; M523-I589 HydrophobicContact SD-CD1 4.09Å; G585-I589 VanDerWaalsContact O-CG1 3.32Å; G585-I589 WeakPolarHBondContact O-CG1 3.39Å; G585-I589 PolarHBondContact O-N 2.96Å; L586-I589 PolarHBondContact O-N 3.24Å; I589-G591 PolarHBondContact O-N 2.91Å; I589-L593 HydrophobicContact CG2-CB 4.11Å; I589-L593 HydrophobicContact CG2-CD2 3.81Å; I589-L593 VanDerWaalsContact O-CB 3.31Å; I589-L593 WeakPolarHBondContact O-CB 3.42Å; I589-L593 PolarHBondContact O-N 3.21Å
590	Y	91	Very high	88.3	Confident	135 Å²	135	51.3 Å²	51.3	53%	0.529	28%	0.283	S	S	.	.	H	α-helix	trans	-58.6	-48.4	178.6	179	-102.9	0	0	0	111.9	R390 F394 L586 L587 F588	R390-Y590 PolarHBondContact NH2-O 3.33Å; F394-Y590 HydrophobicContact CE2-CD2 4.23Å; F394-Y590 HydrophobicContact CZ-CD2 4.48Å; L586-Y590 VanDerWaalsContact O-CB 3.26Å; L586-Y590 WeakPolarHBondContact O-CB 3.45Å; L586-Y590 PolarHBondContact O-N 3.33Å; L587-Y590 PolarHBondContact O-N 3.14Å; F588-Y590 VanDerWaalsContact C-N 3.34Å; F588-Y590 PolarHBondContact O-N 3.19Å
591	G	87.4	Confident	86.6	Confident	19 Å²	19	53 Å²	53	20%	0.196	28%	0.283	C	S	.	.	H	α-helix	trans	-82.2	-35.4	-176.2	0	0	0	0	0	114.9	L587 F588 I589 C613	L587-G591 PolarHBondContact O-N 3.33Å; F588-G591 PolarHBondContact O-N 3.35Å; I589-G591 PolarHBondContact O-N 2.91Å; G591-C613 WeakPolarHBondContact O-CA 3.26Å; G591-C613 PolarHBondContact O-N 3.4Å
592	C	87.9	Confident	85.2	Confident	8 Å²	8	56.1 Å²	56.1	5%	0.054	30%	0.299	C	S	.	.	H	α-helix	trans	-116.7	-13.9	-161.7	-41	0	0	0	0	114.1	V327 F588 P594 C613	V327-C592 HydrophobicContact CG2-CB 4.34Å; V327-C592 WeakPolarHBondContact CG2-O 3.26Å; F588-C592 HydrophobicContact CD2-CB 4.29Å; F588-C592 HydrophobicContact CE2-CB 4.14Å; F588-C592 HydrophobicContact CZ-CB 4.4Å; F588-C592 WeakPolarHBondContact O-CA 3.27Å; F588-C592 VanDerWaalsContact O-CB 3.25Å; F588-C592 WeakPolarHBondContact O-CB 3.46Å; F588-C592 PolarHBondContact O-N 2.96Å; F588-C592 PolarHBondContact O-SG 2.88Å; C592-P594 VanDerWaalsContact O-CD 3.23Å; C592-P594 WeakPolarHBondContact O-CD 3.33Å; C592-C613 WeakPolarHBondContact CB-SG 3.49Å; C592-C613 HydrophobicContact CB-CB 4.5Å; C592-C613 PolarHBondContact SG-SG 3.16Å; C592-C613 WeakPolarHBondContact SG-CB 3.39Å; C592-C613 CovalentContact SG-SG 2.06Å
593	L	89.3	Confident	83.9	Confident	3 Å²	3	60 Å²	60	2%	0.016	32%	0.317	C	S	.	.			trans	-90.7	110.9	177.1	-177.3	62.1	0	0	0	111.2	V327 L331 R390 T393 V530 I589	V327-L593 HydrophobicContact CG1-CD1 3.86Å; L331-L593 HydrophobicContact CD1-CD1 3.98Å; L331-L593 HydrophobicContact CD2-CD2 4.35Å; R390-L593 HydrophobicContact CB-CD2 4.39Å; R390-L593 HydrophobicContact CB-CG 4.47Å; R390-L593 WeakPolarHBondContact CD-O 3.26Å; R390-L593 HydrophobicContact CG-CD2 4.3Å; R390-L593 HydrophobicContact CG-CG 4.27Å; R390-L593 WeakPolarHBondContact CG-O 3.11Å; R390-L593 PolarHBondContact NE-O 2.87Å; T393-L593 HydrophobicContact CG2-CD2 4.44Å; V530-L593 HydrophobicContact CG1-CD1 3.92Å; I589-L593 HydrophobicContact CG2-CB 4.11Å; I589-L593 HydrophobicContact CG2-CD2 3.81Å; I589-L593 VanDerWaalsContact O-CB 3.31Å; I589-L593 WeakPolarHBondContact O-CB 3.42Å; I589-L593 PolarHBondContact O-N 3.21Å
594	P	86.4	Confident	82.7	Confident	23 Å²	23	58.2 Å²	58.2	15%	0.149	30%	0.302	C	S	.	.			trans	-75	161.7	171.2	31.4	-35.2	0	0	0	112	C592 L607 F608	C592-P594 VanDerWaalsContact O-CD 3.23Å; C592-P594 WeakPolarHBondContact O-CD 3.33Å; P594-L607 HydrophobicContact CB-CB 4.4Å; P594-L607 HydrophobicContact CB-CD1 4.34Å; P594-L607 HydrophobicContact CG-CB 4.48Å; P594-F608 HydrophobicContact CG-CE1 4.07Å; P594-F608 HydrophobicContact CG-CE2 4.48Å; P594-F608 HydrophobicContact CG-CZ 3.8Å
595	E	85.3	Confident	81.5	Confident	53 Å²	53	57.3 Å²	57.3	25%	0.248	29%	0.292	C	S	.	.			trans	-79.8	122.5	171.1	-177.8	61.4	-104.4	0	0	110	R389 R390 K597	R389-E595 PolarHBondContact N-OE1 3.3Å; R390-E595 HydrophobicContact CB-CB 4.24Å; R390-E595 WeakPolarHBondContact CB-OE2 3.31Å; R390-E595 PolarHBondContact N-OE2 2.89Å; E595-K597 PolarHBondContact OE1-N 3.11Å; E595-K597 VanDerWaalsContact OE1-N 3.13Å; E595-K597 WeakPolarHBondContact OE1-CB 3.44Å; E595-K597 HydrophobicContact CG-CB 4.16Å
596	T	81.3	Confident	80.5	Confident	5 Å²	5	60.4 Å²	60.4	3%	0.031	31%	0.314	C	S	.	.			trans	-98	-10.6	-179.7	62.1	0	0	0	0	113	E533 I534 G598 K599	E533-T596 WeakPolarHBondContact OE2-CB 3.35Å; E533-T596 PolarHBondContact OE2-OG1 3.09Å; I534-T596 HydrophobicContact CG2-CG2 4.01Å; T596-G598 PolarHBondContact O-N 3.31Å; T596-K599 PolarHBondContact O-N 3.06Å
597	K	75.6	Confident	79.6	Confident	87 Å²	87	61.8 Å²	61.8	38%	0.378	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	122.3	-176.7	175.5	169.4	165.5	171.3	0	111.9	E385 K386 E595 K599	E385-K597 WeakPolarHBondContact O-CE 3.46Å; E385-K597 PolarHBondContact O-NZ 3.15Å; K386-K597 PolarHBondContact O-NZ 2.71Å; E595-K597 PolarHBondContact OE1-N 3.11Å; E595-K597 VanDerWaalsContact OE1-N 3.13Å; E595-K597 WeakPolarHBondContact OE1-CB 3.44Å; E595-K597 HydrophobicContact CG-CB 4.16Å; K597-K599 VanDerWaalsContact C-N 3.28Å; K597-K599 PolarHBondContact O-N 2.9Å
598	G	65.9	Low	79.1	Confident	77 Å²	77	55.7 Å²	55.7	79%	0.794	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.1	7.2	170.8	0	0	0	0	0	115.2	T596	T596-G598 PolarHBondContact O-N 3.31Å
599	K	74.4	Confident	78.2	Confident	110 Å²	110	58.2 Å²	58.2	48%	0.478	31%	0.305	S	S	.	.			trans	-88	141.3	175	-64.1	-64	-175.4	177.1	0	110.8	T596 K597 I604	T596-K599 PolarHBondContact O-N 3.06Å; K597-K599 VanDerWaalsContact C-N 3.28Å; K597-K599 PolarHBondContact O-N 2.9Å; K599-I604 HydrophobicContact CB-CG1 4.19Å
600	K	73.4	Confident	77.3	Confident	138 Å²	138	64.2 Å²	64.2	60%	0.6	34%	0.337	S	S	*	.			trans	-73.5	153.9	171.7	-66	-177.8	178.9	173.3	0	110.2	E602 E603 I604	K600-E602 WeakPolarHBondContact CB-OE2 3.24Å; K600-E602 PolarHBondContact O-N 2.83Å; K600-E603 HydrophobicContact CB-CG 4.22Å; K600-E603 PolarHBondContact O-N 3.32Å; K600-E603 PolarHBondContact N-OE2 3.02Å; K600-E603 WeakPolarHBondContact O-CB 3.27Å; K600-I604 WeakPolarHBondContact O-CG1 3.37Å; K600-I604 PolarHBondContact O-N 3.3Å
601	L	63	Low	76.5	Confident	70 Å²	70	67.5 Å²	67.5	37%	0.366	35%	0.348	S	S	.	.	H	α-helix	trans	-59.3	-31.7	-176.6	-71.3	172.3	0	0	0	112.6	E603 I604	L601-E603 VanDerWaalsContact C-N 3.34Å; L601-I604 HydrophobicContact CD2-CD1 4.03Å; L601-I604 PolarHBondContact O-N 3.33Å
602	E	66.1	Low	75.5	Confident	139 Å²	139	68.5 Å²	68.5	65%	0.65	35%	0.349	S	S	*	.	H	α-helix	trans	-73.4	-27.7	178	-55.3	78.4	-170	0	0	112.1	K600	K600-E602 WeakPolarHBondContact CB-OE2 3.24Å; K600-E602 PolarHBondContact O-N 2.83Å
603	E	70.2	Confident	74.4	Confident	80 Å²	80	71.3 Å²	71.3	37%	0.374	37%	0.367	S	S	.	.	H	α-helix	trans	-82.5	-19.9	177.9	-63.7	169.7	-173.9	0	0	112	K600 L601 E605 S606	K600-E603 HydrophobicContact CB-CG 4.22Å; K600-E603 PolarHBondContact O-N 3.32Å; K600-E603 PolarHBondContact N-OE2 3.02Å; K600-E603 WeakPolarHBondContact O-CB 3.27Å; L601-E603 VanDerWaalsContact C-N 3.34Å; E603-E605 PolarHBondContact O-N 2.66Å; E603-E605 VanDerWaalsContact C-N 3.32Å; E603-S606 PolarHBondContact O-N 3.09Å; E603-S606 PolarHBondContact O-OG 3.19Å
604	I	72.3	Confident	72.9	Confident	4 Å²	4	75.7 Å²	75.7	2%	0.021	40%	0.395	C	S	.	.	H	α-helix	trans	-66.9	-34.1	-179.5	-70.2	174.8	0	0	0	111.4	E533 K599 K600 L601 S606 L607 F608	E533-I604 HydrophobicContact CB-CD1 4.49Å; E533-I604 WeakPolarHBondContact O-CD1 3.49Å; K599-I604 HydrophobicContact CB-CG1 4.19Å; K600-I604 WeakPolarHBondContact O-CG1 3.37Å; K600-I604 PolarHBondContact O-N 3.3Å; L601-I604 HydrophobicContact CD2-CD1 4.03Å; L601-I604 PolarHBondContact O-N 3.33Å; I604-S606 PolarHBondContact O-N 3.38Å; I604-L607 HydrophobicContact CG1-CD1 4.46Å; I604-L607 VanDerWaalsContact O-CB 3.28Å; I604-L607 WeakPolarHBondContact O-CB 3.43Å; I604-L607 PolarHBondContact O-N 3.42Å; I604-F608 WeakPolarHBondContact O-CD2 3.39Å; I604-F608 HydrophobicContact CG2-CD2 4.46Å; I604-F608 HydrophobicContact CG2-CE2 4.03Å
605	E	70.6	Confident	70.9	Confident	60 Å²	60	79.6 Å²	79.6	28%	0.28	42%	0.421	S	S	.	.	H	α-helix	trans	-61.5	-37.6	178.6	-156.5	164.7	-150	0	0	110.8	P320 E603 L607 F608 D609	P320-E605 HydrophobicContact CB-CG 4.47Å; E603-E605 PolarHBondContact O-N 2.66Å; E603-E605 VanDerWaalsContact C-N 3.32Å; E605-L607 PolarHBondContact O-N 3.07Å; E605-F608 PolarHBondContact O-N 2.64Å; E605-D609 PolarHBondContact O-N 2.97Å
606	S	74	Confident	68.7	Low	65 Å²	65	80 Å²	80	46%	0.455	44%	0.44	S	S	.	.	H	α-helix	trans	-64	-25.4	176	79	0	0	0	0	114	E603 I604 F608 D609	E603-S606 PolarHBondContact O-N 3.09Å; E603-S606 PolarHBondContact O-OG 3.19Å; I604-S606 PolarHBondContact O-N 3.38Å; S606-F608 PolarHBondContact O-N 3.11Å; S606-D609 WeakPolarHBondContact CA-OD2 3.39Å; S606-D609 PolarHBondContact O-N 2.85Å
607	L	77.4	Confident	66.5	Low	56 Å²	56	85.8 Å²	85.8	29%	0.293	48%	0.475	S	S	.	.	H	α-helix	trans	-66	-23.1	175	-62.3	172.2	0	0	0	112	P594 I604 E605	P594-L607 HydrophobicContact CB-CB 4.4Å; P594-L607 HydrophobicContact CB-CD1 4.34Å; P594-L607 HydrophobicContact CG-CB 4.48Å; I604-L607 HydrophobicContact CG1-CD1 4.46Å; I604-L607 VanDerWaalsContact O-CB 3.28Å; I604-L607 WeakPolarHBondContact O-CB 3.43Å; I604-L607 PolarHBondContact O-N 3.42Å; E605-L607 PolarHBondContact O-N 3.07Å
608	F	81.9	Confident	64.7	Low	2 Å²	2	86.7 Å²	86.7	1%	0.009	49%	0.493	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.7	2.8	-178.1	-63.6	-75.6	0	0	0	113.5	P320 R323 A324 V327 I534 P594 I604 E605 S606 N610 L612	P320-F608 HydrophobicContact CB-CB 3.97Å; P320-F608 WeakPolarHBondContact O-CB 3.49Å; R323-F608 HydrophobicContact CB-CB 4.3Å; R323-F608 HydrophobicContact CB-CD1 3.98Å; R323-F608 WeakPolarHBondContact CD-O 3.18Å; R323-F608 PolarHBondContact NH1-O 3.06Å; A324-F608 HydrophobicContact CB-CD1 4.29Å; A324-F608 HydrophobicContact CB-CD2 4.05Å; A324-F608 HydrophobicContact CB-CE1 4.21Å; A324-F608 HydrophobicContact CB-CE2 3.97Å; A324-F608 HydrophobicContact CB-CG 4.21Å; A324-F608 HydrophobicContact CB-CZ 4.05Å; V327-F608 HydrophobicContact CB-CE1 4.47Å; V327-F608 HydrophobicContact CG2-CE1 4.08Å; I534-F608 HydrophobicContact CB-CE2 4.01Å; I534-F608 HydrophobicContact CB-CZ 4.04Å; I534-F608 HydrophobicContact CG2-CE2 4.28Å; I534-F608 HydrophobicContact CG2-CZ 4.05Å; P594-F608 HydrophobicContact CG-CE1 4.07Å; P594-F608 HydrophobicContact CG-CE2 4.48Å; P594-F608 HydrophobicContact CG-CZ 3.8Å; I604-F608 WeakPolarHBondContact O-CD2 3.39Å; I604-F608 HydrophobicContact CG2-CD2 4.46Å; I604-F608 HydrophobicContact CG2-CE2 4.03Å; E605-F608 PolarHBondContact O-N 2.64Å; S606-F608 PolarHBondContact O-N 3.11Å; F608-N610 VanDerWaalsContact C-N 3.33Å; F608-L612 HydrophobicContact CD1-CD2 4Å; F608-L612 HydrophobicContact CE1-CD2 4.16Å
609	D	76.9	Confident	63.4	Low	87 Å²	87	89.8 Å²	89.8	47%	0.465	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-31.7	175.9	-78.1	-21.6	0	0	0	112.4	P320 R323 E605 S606	P320-D609 VanDerWaalsContact CG-OD1 3.29Å; P320-D609 WeakPolarHBondContact CG-OD1 3.43Å; R323-D609 PolarHBondContact NH1-O 3.28Å; E605-D609 PolarHBondContact O-N 2.97Å; S606-D609 WeakPolarHBondContact CA-OD2 3.39Å; S606-D609 PolarHBondContact O-N 2.85Å
610	N	74	Confident	61.5	Low	128 Å²	128	89.6 Å²	89.6	68%	0.684	50%	0.503	S	S	*	.	S	Bend	trans	-87.8	158.3	176.2	-69.7	-30.7	0	0	0	112.6	R323 F608 L612	R323-N610 VanDerWaalsContact CZ-O 3.25Å; R323-N610 PolarHBondContact NH1-O 3.13Å; F608-N610 VanDerWaalsContact C-N 3.33Å; N610-L612 PolarHBondContact O-N 3.43Å
611	R	72.3	Confident	59.9	Low	204 Å²	204	89 Å²	89	77%	0.77	51%	0.507	S	S	*	.	P	Polyproline II helix	trans	-60.6	127.4	179.4	-76.8	-175.5	175.7	-172	-0.7	110.2	T614	R611-T614 HydrophobicContact CB-CG2 4.45Å
612	L	68.1	Low	58.9	Low	40 Å²	40	94.6 Å²	94.6	21%	0.209	53%	0.531	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	153.6	171.3	-72.8	177.1	0	0	0	111.3	R323 V327 F608 N610 T614	R323-L612 HydrophobicContact CB-CD1 3.44Å; R323-L612 VanDerWaalsContact CB-CD1 3.44Å; R323-L612 HydrophobicContact CB-CG 3.82Å; R323-L612 HydrophobicContact CG-CD1 3.67Å; R323-L612 HydrophobicContact CG-CG 3.84Å; V327-L612 HydrophobicContact CG2-CD1 3.84Å; V327-L612 HydrophobicContact CG2-CD2 4.08Å; F608-L612 HydrophobicContact CD1-CD2 4Å; F608-L612 HydrophobicContact CE1-CD2 4.16Å; N610-L612 PolarHBondContact O-N 3.43Å; L612-T614 PolarHBondContact O-N 3.44Å
613	C	64.4	Low	57.3	Low	66 Å²	66	91 Å²	91	45%	0.446	53%	0.531	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.2	32.2	169.2	-31.8	0	0	0	0	114.5	G591 C592 C615	G591-C613 WeakPolarHBondContact O-CA 3.26Å; G591-C613 PolarHBondContact O-N 3.4Å; C592-C613 WeakPolarHBondContact CB-SG 3.49Å; C592-C613 HydrophobicContact CB-CB 4.5Å; C592-C613 PolarHBondContact SG-SG 3.16Å; C592-C613 WeakPolarHBondContact SG-CB 3.39Å; C592-C613 CovalentContact SG-SG 2.06Å; C613-C615 PolarHBondContact O-N 2.98Å; C613-C615 VanDerWaalsContact O-N 3.13Å
614	T	57	Low	55.5	Low	96 Å²	96	96.7 Å²	96.7	59%	0.589	55%	0.549	S	S	*	.			trans	-76.3	93.5	166.6	46.1	0	0	0	0	109.8	R611 L612 G616	R611-T614 HydrophobicContact CB-CG2 4.45Å; L612-T614 PolarHBondContact O-N 3.44Å; T614-G616 VanDerWaalsContact C-N 3.31Å; T614-G616 PolarHBondContact O-N 3.39Å
615	C	45.2	Very low	53.6	Low	105 Å²	105	107.4 Å²	107.4	71%	0.709	59%	0.591	S	S	*	*			trans	-67.9	90.8	164.9	-77.4	0	0	0	0	108.8	C613	C613-C615 PolarHBondContact O-N 2.98Å; C613-C615 VanDerWaalsContact O-N 3.13Å
616	G	38.6	Very low	52.1	Low	62 Å²	62	110.4 Å²	110.4	64%	0.639	61%	0.608	S	S	*	*			trans	136.7	76	173.3	0	0	0	0	0	114	T614	T614-G616 VanDerWaalsContact C-N 3.31Å; T614-G616 PolarHBondContact O-N 3.39Å
617	T	34.7	Very low	49.9	Very low	125 Å²	125	115 Å²	115	77%	0.767	62%	0.622	S	S	*	*				-168.8	110.3	126.7	24	0	0	0	0	105.6
618	S	37.7	Very low	47.9	Very low	107 Å²	107	122.1 Å²	122.1	75%	0.748	65%	0.646	S	S	*	*			trans	-53.6	144.6	163.7	-169.2	0	0	0	0	108.5	S620	S618-S620 PolarHBondContact O-N 3.37Å
619	D	39.7	Very low	45.5	Very low	141 Å²	141	128.1 Å²	128.1	75%	0.754	68%	0.677	S	S	*	*	S	Bend	trans	-34.3	98.2	171.5	-67.5	-51.6	0	0	0	113.1
620	S	34.9	Very low	43.3	Very low	106 Å²	106	134.9 Å²	134.9	74%	0.741	70%	0.696	S	S	*	*			trans	-126.2	18	163.6	69.8	0	0	0	0	111.9	S618	S618-S620 PolarHBondContact O-N 3.37Å
621	D	40.1	Very low	41.4	Very low	125 Å²	125	134.7 Å²	134.7	67%	0.668	70%	0.699	S	S	*	*			trans	-120.9	27.3	175.9	-121.1	1.6	0	0	0	111.8	G623	D621-G623 PolarHBondContact O-N 3.41Å
622	E	40.5	Very low	39.5	Very low	188 Å²	188	134 Å²	134	88%	0.879	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	27.4	174.2	-140	179	-160.4	0	0	113.1
623	G	32.7	Very low	37.7	Very low	63 Å²	63	135.5 Å²	135.5	65%	0.649	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-142.6	3.6	-169.3	0	0	0	0	0	117.2	D621	D621-G623 PolarHBondContact O-N 3.41Å
624	R	33.8	Very low	36	Very low	201 Å²	201	136.9 Å²	136.9	76%	0.758	74%	0.738	S	S	*	*			trans	-100.6	80.4	171.1	-86.1	-179.7	173.6	164.3	-1.1	111.3	I626	R624-I626 VanDerWaalsContact C-N 3.35Å; R624-I626 PolarHBondContact O-N 2.98Å
625	Y	32.2	Very low	35.1	Very low	228 Å²	228	140.2 Å²	140.2	89%	0.894	75%	0.752	S	S	*	*			trans	-62.1	101.4	151.2	-83.4	-91.7	0	0	0	107.5	E627	Y625-E627 VanDerWaalsContact C-N 3.27Å; Y625-E627 VanDerWaalsContact O-N 3.09Å; Y625-E627 PolarHBondContact O-N 2.73Å
626	I	39.3	Very low	34.4	Very low	123 Å²	123	144.7 Å²	144.7	63%	0.631	76%	0.755	S	S	*	*			trans	-77.1	91.3	163.2	-60.3	178.1	0	0	0	105.7	R624 Y628	R624-I626 VanDerWaalsContact C-N 3.35Å; R624-I626 PolarHBondContact O-N 2.98Å; I626-Y628 HydrophobicContact CG2-CD2 4.23Å; I626-Y628 HydrophobicContact CG2-CE2 3.99Å; I626-Y628 PolarHBondContact O-N 3.48Å; I626-Y628 VanDerWaalsContact O-N 3.12Å
627	E	26.6	Very low	34.1	Very low	162 Å²	162	150.7 Å²	150.7	76%	0.757	77%	0.767	S	S	*	*			trans	-69.3	102.9	168.9	-166.6	173.2	-158.8	0	0	107.6	Y625 I629	Y625-E627 VanDerWaalsContact C-N 3.27Å; Y625-E627 VanDerWaalsContact O-N 3.09Å; Y625-E627 PolarHBondContact O-N 2.73Å; E627-I629 HydrophobicContact CG-CG1 4.39Å; E627-I629 PolarHBondContact O-N 2.96Å
628	Y	35.6	Very low	33.8	Very low	205 Å²	205	153 Å²	153	80%	0.804	77%	0.773	S	S	*	*			trans	-68.1	90.8	166.3	-76.1	-86.6	0	0	0	108	I626 R630	I626-Y628 HydrophobicContact CG2-CD2 4.23Å; I626-Y628 HydrophobicContact CG2-CE2 3.99Å; I626-Y628 PolarHBondContact O-N 3.48Å; I626-Y628 VanDerWaalsContact O-N 3.12Å; Y628-R630 PolarHBondContact O-N 2.92Å
629	I	32.4	Very low	33.5	Very low	129 Å²	129	153 Å²	153	66%	0.662	77%	0.773	S	S	*	*			trans	-64.1	105.9	165.4	-61	175	0	0	0	106.4	E627 V631	E627-I629 HydrophobicContact CG-CG1 4.39Å; E627-I629 PolarHBondContact O-N 2.96Å; I629-V631 PolarHBondContact O-N 3.22Å; I629-V631 HydrophobicContact CG2-CG2 4.19Å; I629-V631 VanDerWaalsContact C-N 3.25Å
630	R	30.6	Very low	33.3	Very low	229 Å²	229	153.2 Å²	153.2	86%	0.864	77%	0.774	S	S	*	*			trans	-67.5	89.2	167.9	-165.6	-177.1	-147.9	174.8	7	107.4	Y628 K632	Y628-R630 PolarHBondContact O-N 2.92Å; R630-K632 VanDerWaalsContact C-N 3.35Å; R630-K632 PolarHBondContact O-N 2.96Å
631	V	32.3	Very low	33.2	Very low	123 Å²	123	155.1 Å²	155.1	75%	0.745	78%	0.777	S	S	*	*			trans	-63.9	100.5	169	-176.9	0	0	0	0	106.6	I629 G633	I629-V631 PolarHBondContact O-N 3.22Å; I629-V631 HydrophobicContact CG2-CG2 4.19Å; I629-V631 VanDerWaalsContact C-N 3.25Å; V631-G633 PolarHBondContact O-N 2.89Å
632	K	33.2	Very low	32.7	Very low	189 Å²	189	156.4 Å²	156.4	82%	0.822	78%	0.783	S	S	*	*			trans	-61	109.5	161.8	-88.3	-176.9	174.4	178.6	0	105.7	R630 S634	R630-K632 VanDerWaalsContact C-N 3.35Å; R630-K632 PolarHBondContact O-N 2.96Å; K632-S634 PolarHBondContact O-N 3.06Å
633	G	29.5	Very low	32.4	Very low	73 Å²	73	152 Å²	152	75%	0.753	78%	0.779	S	S	*	*			trans	-55.3	102.3	169.5	0	0	0	0	0	109.2	V631	V631-G633 PolarHBondContact O-N 2.89Å
634	S	30.4	Very low	32.4	Very low	95 Å²	95	153.8 Å²	153.8	66%	0.664	78%	0.781	S	S	*	*			trans	-84.6	110.8	160.9	-167.3	0	0	0	0	105.6	K632 Y636	K632-S634 PolarHBondContact O-N 3.06Å; S634-Y636 VanDerWaalsContact C-N 3.33Å; S634-Y636 PolarHBondContact O-N 3.22Å
635	N	36.9	Very low	32.4	Very low	166 Å²	166	151.3 Å²	151.3	89%	0.888	78%	0.784	S	S	*	*			trans	-63.1	97	167.7	-81.7	-23.7	0	0	0	108
636	Y	30.7	Very low	32.6	Very low	198 Å²	198	146.4 Å²	146.4	78%	0.776	78%	0.777	S	S	*	*			trans	-112.2	113.7	158.4	-103.8	-92.7	0	0	0	108	S634 L638	S634-Y636 VanDerWaalsContact C-N 3.33Å; S634-Y636 PolarHBondContact O-N 3.22Å; Y636-L638 PolarHBondContact O-N 3.28Å
637	H	32.3	Very low	32.5	Very low	189 Å²	189	153.2 Å²	153.2	88%	0.875	81%	0.806	S	S	*	*			trans	-52.8	116.4	164.1	-103.6	-91.5	0	0	0	108.7	S639	H637-S639 PolarHBondContact O-N 3.47Å
638	L	28.6	Very low	32.8	Very low	172 Å²	172	152.8 Å²	152.8	90%	0.901	81%	0.809	S	S	*	*			trans	-73.1	113.1	157.2	-95.5	98	0	0	0	107.2	Y636	Y636-L638 PolarHBondContact O-N 3.28Å
639	S	30.2	Very low	32.6	Very low	108 Å²	108	150.1 Å²	150.1	76%	0.755	81%	0.809	S	S	*	*			trans	-76.6	133.1	158.4	-169.9	0	0	0	0	107.5	H637 N641	H637-S639 PolarHBondContact O-N 3.47Å; S639-N641 PolarHBondContact O-N 3.19Å
640	D	36.8	Very low	32.6	Very low	145 Å²	145	151.2 Å²	151.2	78%	0.775	82%	0.817	S	S	*	*			trans	-48.7	123.9	164	-70.9	-46.5	0	0	0	110.1
641	N	33.3	Very low	32.8	Very low	147 Å²	147	146.6 Å²	146.6	79%	0.786	81%	0.814	S	S	*	*			trans	171	153.2	130.7	-88.9	-20.5	0	0	0	111.7	S639	S639-N641 PolarHBondContact O-N 3.19Å
642	D	29.8	Very low	32.8	Very low	151 Å²	151	148.1 Å²	148.1	81%	0.807	82%	0.819	S	S	*	*			trans	92.4	81.4	165.7	-56.7	-19.3	0	0	0	117
643	A	33.4	Very low	32.8	Very low	96 Å²	96	145.4 Å²	145.4	79%	0.793	82%	0.818	S	S	*	*			trans	-47.1	131.8	135.2	0	0	0	0	0	111.5
644	S	33.4	Very low	33	Very low	100 Å²	100	150.6 Å²	150.6	70%	0.699	82%	0.823	S	S	*	*				167.6	125.5	128.9	40.4	0	0	0	0	111.2
645	D	33	Very low	33.2	Very low	150 Å²	150	154.8 Å²	154.8	80%	0.802	84%	0.835	S	S	*	*			trans	72.5	133.9	133.9	-55.2	-22.1	0	0	0	123.4
646	V	37	Very low	32.9	Very low	125 Å²	125	153.9 Å²	153.9	76%	0.758	83%	0.831	S	S	*	*			trans	103	101.9	142.8	-156.8	0	0	0	0	118.5
647	E	36.1	Very low	33.1	Very low	266 Å²	266	149.9 Å²	149.9	100%	1.243	84%	0.836	S	S	*	*			trans	58.7	0	146.7	-64.3	-176.1	151.8	0	0	121.9

Retrieved 647 of 647 residues in 130.4 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).