A0A087Y3Z4_POEFO Loading...

FRA10A associated CGG repeat 1

AlphaFold DB , UniProt , Accession A0A087Y3Z4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 332 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.8	Very low	43	Very low	228 Å²	228	145.7 Å²	145.7	100%	1.123	84%	0.836	S	S	*	*				0	71.2	0	-67.2	172.8	-172.8	0	0	106.3
2	E	43.3	Very low	43.1	Very low	173 Å²	173	140.3 Å²	140.3	81%	0.808	84%	0.835	S	S	*	*				63	106.1	84.2	-66	178.3	164.8	0	0	111.1
3	N	46.3	Very low	43	Very low	159 Å²	159	146.5 Å²	146.5	85%	0.85	84%	0.838	S	S	*	*				-167.8	80.9	126.7	-91.6	-35.9	0	0	0	109.3	V5	N3-V5 PolarHBondContact O-N 2.81Å
4	L	45.3	Very low	42.9	Very low	172 Å²	172	146.1 Å²	146.1	90%	0.901	83%	0.832	S	S	*	*			trans	-68	114.1	157.9	-117.9	85.5	0	0	0	107.1	K6	L4-K6 PolarHBondContact O-N 3.22Å; L4-K6 VanDerWaalsContact O-N 3.09Å
5	V	51.4	Low	43	Very low	129 Å²	129	142.9 Å²	142.9	78%	0.782	82%	0.822	S	S	*	*			trans	-77.1	98.4	169.3	177.9	0	0	0	0	108	N3 I7	N3-V5 PolarHBondContact O-N 2.81Å; V5-I7 HydrophobicContact CG1-CG1 4.19Å; V5-I7 PolarHBondContact O-N 3.15Å
6	K	46.1	Very low	42.7	Very low	168 Å²	168	142.1 Å²	142.1	73%	0.73	81%	0.814	S	S	*	*			trans	-60.9	118.2	161.4	-108.1	171.4	174	171.8	0	108.7	L4	L4-K6 PolarHBondContact O-N 3.22Å; L4-K6 VanDerWaalsContact O-N 3.09Å
7	I	49	Very low	42.4	Very low	153 Å²	153	144.4 Å²	144.4	79%	0.785	81%	0.813	S	S	*	*			trans	-110.7	106.9	156.6	-60.2	177.9	0	0	0	106.1	V5	V5-I7 HydrophobicContact CG1-CG1 4.19Å; V5-I7 PolarHBondContact O-N 3.15Å
8	H	38.9	Very low	42.6	Very low	159 Å²	159	141.8 Å²	141.8	74%	0.736	81%	0.805	S	S	*	*			trans	-97.1	145.5	167.3	-84.4	142.1	0	0	0	109.3
9	G	35.9	Very low	42.6	Very low	75 Å²	75	141.2 Å²	141.2	77%	0.773	80%	0.8	S	S	*	*			trans	98.6	144.3	155.1	0	0	0	0	0	113.4
10	A	37.5	Very low	42.6	Very low	109 Å²	109	141.4 Å²	141.4	90%	0.901	80%	0.798	S	S	*	*			cis	-167.4	148.2	-6.6	0	0	0	0	0	104.6
11	G	40.1	Very low	42.6	Very low	78 Å²	78	142.1 Å²	142.1	80%	0.804	80%	0.801	S	S	*	*			trans	149.7	56.3	171.1	0	0	0	0	0	113.5	Y13	G11-Y13 PolarHBondContact O-N 3.37Å
12	G	44.5	Very low	42.6	Very low	80 Å²	80	134.1 Å²	134.1	83%	0.825	78%	0.776	S	S	*	*			trans	-64.4	116.1	155.8	0	0	0	0	0	107.8
13	Y	41.9	Very low	42.6	Very low	222 Å²	222	135.7 Å²	135.7	87%	0.871	78%	0.784	S	S	*	*			trans	-108.4	73.8	157.8	-155.3	-96.8	0	0	0	105.7	G11 S15	G11-Y13 PolarHBondContact O-N 3.37Å; Y13-S15 PolarHBondContact O-N 3.39Å
14	D	42.2	Very low	42.3	Very low	141 Å²	141	131.1 Å²	131.1	75%	0.754	77%	0.774	S	S	*	*			trans	-79.6	103.2	165.4	-169.2	14.5	0	0	0	105.5	D16	D14-D16 PolarHBondContact O-N 3.45Å
15	S	43.3	Very low	42.4	Very low	98 Å²	98	130.8 Å²	130.8	69%	0.685	77%	0.773	S	S	*	*			trans	-78.4	74.8	170.9	54.1	0	0	0	0	108	Y13 F17	Y13-S15 PolarHBondContact O-N 3.39Å; S15-F17 VanDerWaalsContact C-N 3.27Å; S15-F17 PolarHBondContact O-N 2.99Å; S15-F17 VanDerWaalsContact O-N 3.08Å
16	D	39.5	Very low	42.3	Very low	130 Å²	130	126.5 Å²	126.5	70%	0.695	75%	0.749	S	S	*	*			trans	-71.7	84.9	163.5	-173.7	21.4	0	0	0	107.7	D14	D14-D16 PolarHBondContact O-N 3.45Å
17	F	37.6	Very low	43	Very low	181 Å²	181	122.4 Å²	122.4	79%	0.794	74%	0.741	S	S	*	*			trans	-90	94.7	162.6	-153.6	-93.9	0	0	0	105.8	S15 D19	S15-F17 VanDerWaalsContact C-N 3.27Å; S15-F17 PolarHBondContact O-N 2.99Å; S15-F17 VanDerWaalsContact O-N 3.08Å; F17-D19 PolarHBondContact O-N 3.11Å
18	S	44.8	Very low	43.4	Very low	97 Å²	97	121.9 Å²	121.9	68%	0.678	74%	0.735	S	S	*	*			trans	-61.1	98.7	172.5	68.4	0	0	0	0	108.9	D20	S18-D20 PolarHBondContact O-N 3.35Å
19	D	43.2	Very low	44.4	Very low	131 Å²	131	120.5 Å²	120.5	70%	0.701	73%	0.727	S	S	*	*			trans	-80.2	104.3	160.8	-122.7	-73.4	0	0	0	106.1	F17 D21	F17-D19 PolarHBondContact O-N 3.11Å; D19-D21 PolarHBondContact O-N 3.42Å; D19-D21 VanDerWaalsContact O-N 3.12Å
20	D	42.8	Very low	45.5	Very low	144 Å²	144	119.8 Å²	119.8	77%	0.77	71%	0.714	S	S	*	*			trans	-60.2	103.3	168.6	177.7	-117	0	0	0	108	S18 G22	S18-D20 PolarHBondContact O-N 3.35Å; D20-G22 PolarHBondContact O-N 3.46Å
21	D	41.7	Very low	46.7	Very low	158 Å²	158	122.8 Å²	122.8	85%	0.845	70%	0.702	S	S	*	*			trans	-67.4	78.6	173.5	-79.4	-54.2	0	0	0	110.1	D19 E23	D19-D21 PolarHBondContact O-N 3.42Å; D19-D21 VanDerWaalsContact O-N 3.12Å; D21-E23 PolarHBondContact O-N 3.37Å
22	G	38.9	Very low	47.6	Very low	60 Å²	60	124.8 Å²	124.8	62%	0.619	69%	0.69	S	S	*	*			trans	-78.1	102.6	161.6	0	0	0	0	0	110.1	D20 G24	D20-G22 PolarHBondContact O-N 3.46Å; G22-G24 PolarHBondContact O-N 3.29Å
23	E	44.1	Very low	48.3	Very low	206 Å²	206	130 Å²	130	96%	0.963	69%	0.685	S	S	*	*			trans	-43.8	125.4	167	-72.9	176.3	128	0	0	111.7	D21	D21-E23 PolarHBondContact O-N 3.37Å
24	G	38.7	Very low	49.3	Very low	62 Å²	62	127 Å²	127	64%	0.639	68%	0.676	S	S	*	*			trans	158.8	98.9	168.4	0	0	0	0	0	114.2	G22 S26	G22-G24 PolarHBondContact O-N 3.29Å; G24-S26 PolarHBondContact O-N 3.12Å
25	D	48.3	Very low	50.3	Low	166 Å²	166	128.8 Å²	128.8	89%	0.888	67%	0.673	S	S	*	*			trans	-31.4	124.1	161.5	177.1	27.1	0	0	0	113.1
26	S	50	Low	51.1	Low	39 Å²	39	129.6 Å²	129.6	27%	0.273	67%	0.666	S	S	.	*			trans	-168.7	85.1	167.6	172.6	0	0	0	0	110.2	G24 E28 K29	G24-S26 PolarHBondContact O-N 3.12Å; S26-E28 PolarHBondContact O-N 3.04Å; S26-E28 PolarHBondContact OG-N 2.62Å; S26-K29 PolarHBondContact O-N 3.38Å; S26-K29 WeakPolarHBondContact OG-CG 3.24Å; S26-K29 PolarHBondContact OG-N 3.32Å
27	S	59.6	Low	52.2	Low	81 Å²	81	126.4 Å²	126.4	57%	0.566	66%	0.657	S	S	*	*	H	α-helix	trans	-52	-15.7	161.3	70.2	0	0	0	0	113.2	R31	S27-R31 VanDerWaalsContact O-CG 3.27Å; S27-R31 WeakPolarHBondContact O-CG 3.46Å; S27-R31 PolarHBondContact O-N 2.96Å
28	E	58.9	Low	53.4	Low	142 Å²	142	124.3 Å²	124.3	66%	0.664	65%	0.65	S	S	*	*	H	α-helix	trans	-77.2	-42.8	178.3	-60.7	-173.2	145.6	0	0	112.8	S26 A30 R31 E32	S26-E28 PolarHBondContact O-N 3.04Å; S26-E28 PolarHBondContact OG-N 2.62Å; E28-A30 VanDerWaalsContact C-N 3.29Å; E28-A30 PolarHBondContact O-N 3.24Å; E28-R31 CarbonylContact O-C 3.55Å; E28-R31 WeakPolarHBondContact O-CA 3.14Å; E28-R31 WeakPolarHBondContact O-CB 3.4Å; E28-R31 PolarHBondContact O-N 3.39Å; E28-E32 WeakPolarHBondContact O-CB 3.46Å; E28-E32 PolarHBondContact O-N 3.35Å
29	K	58.3	Low	54.3	Low	131 Å²	131	126.6 Å²	126.6	57%	0.57	65%	0.653	S	S	*	*	H	α-helix	trans	-62	-36.2	175.9	-78.4	174.3	179.8	174.9	0	112.3	S26 R31 E32 R33	S26-K29 PolarHBondContact O-N 3.38Å; S26-K29 WeakPolarHBondContact OG-CG 3.24Å; S26-K29 PolarHBondContact OG-N 3.32Å; K29-R31 VanDerWaalsContact C-N 3.35Å; K29-E32 PolarHBondContact O-N 3.45Å; K29-R33 WeakPolarHBondContact O-CG 3.17Å; K29-R33 PolarHBondContact O-N 3.15Å
30	A	59.7	Low	55.1	Low	59 Å²	59	127 Å²	127	49%	0.488	66%	0.655	S	S	.	*	H	α-helix	trans	-70.1	-31.3	174.5	0	0	0	0	0	112.7	E28 K34	E28-A30 VanDerWaalsContact C-N 3.29Å; E28-A30 PolarHBondContact O-N 3.24Å; A30-K34 WeakPolarHBondContact O-CG 3.44Å; A30-K34 PolarHBondContact O-N 3.47Å
31	R	62	Low	55.9	Low	173 Å²	173	127 Å²	127	65%	0.653	65%	0.65	S	S	*	*	H	α-helix	trans	-75.7	-35.1	174.2	-79.5	174.3	154.7	-167.2	-4.5	112.2	S27 E28 K29 K34 R35	S27-R31 VanDerWaalsContact O-CG 3.27Å; S27-R31 WeakPolarHBondContact O-CG 3.46Å; S27-R31 PolarHBondContact O-N 2.96Å; E28-R31 CarbonylContact O-C 3.55Å; E28-R31 WeakPolarHBondContact O-CA 3.14Å; E28-R31 WeakPolarHBondContact O-CB 3.4Å; E28-R31 PolarHBondContact O-N 3.39Å; K29-R31 VanDerWaalsContact C-N 3.35Å; R31-K34 PolarHBondContact O-N 3.08Å; R31-R35 PolarHBondContact O-N 3.45Å
32	E	59.3	Low	56.7	Low	119 Å²	119	126.1 Å²	126.1	56%	0.556	64%	0.639	S	S	*	*	H	α-helix	trans	-68.4	-47.3	177.5	-160.5	168.1	-149.6	0	0	110.8	E28 K29 K34 R35 E36	E28-E32 WeakPolarHBondContact O-CB 3.46Å; E28-E32 PolarHBondContact O-N 3.35Å; K29-E32 PolarHBondContact O-N 3.45Å; E32-K34 VanDerWaalsContact C-N 3.25Å; E32-K34 PolarHBondContact O-N 3.22Å; E32-R35 PolarHBondContact O-N 2.99Å; E32-R35 VanDerWaalsContact O-N 3.09Å; E32-E36 WeakPolarHBondContact O-CG 2.94Å; E32-E36 PolarHBondContact O-N 3.31Å
33	R	60.7	Low	57.8	Low	191 Å²	191	129.7 Å²	129.7	72%	0.721	65%	0.651	S	S	*	*	H	α-helix	trans	-58.9	-34.6	171.7	-69.1	-178.3	-164.6	-177.3	5	113	K29 A37	K29-R33 WeakPolarHBondContact O-CG 3.17Å; K29-R33 PolarHBondContact O-N 3.15Å; R33-A37 WeakPolarHBondContact O-CB 3.46Å; R33-A37 PolarHBondContact O-N 3.02Å; R33-A37 VanDerWaalsContact O-N 3.07Å
34	K	61.5	Low	58.3	Low	157 Å²	157	129 Å²	129	68%	0.683	65%	0.645	S	S	*	*	H	α-helix	trans	-68.8	-42.3	174.2	-84.9	-179.8	176.1	-179.8	0	112.4	A30 R31 E32 A37 E38	A30-K34 WeakPolarHBondContact O-CG 3.44Å; A30-K34 PolarHBondContact O-N 3.47Å; R31-K34 PolarHBondContact O-N 3.08Å; E32-K34 VanDerWaalsContact C-N 3.25Å; E32-K34 PolarHBondContact O-N 3.22Å; K34-A37 PolarHBondContact O-N 3.4Å; K34-E38 WeakPolarHBondContact O-CB 3.41Å; K34-E38 PolarHBondContact O-N 3.04Å
35	R	63.1	Low	59.3	Low	179 Å²	179	132 Å²	132	68%	0.675	64%	0.642	S	S	*	*	H	α-helix	trans	-67.1	-40.2	176.3	-79.3	-177.6	-173.6	-121.2	2.8	111.9	R31 E32 E38 I39	R31-R35 PolarHBondContact O-N 3.45Å; E32-R35 PolarHBondContact O-N 2.99Å; E32-R35 VanDerWaalsContact O-N 3.09Å; R35-E38 PolarHBondContact O-N 3.16Å; R35-I39 WeakPolarHBondContact O-CD1 3.45Å; R35-I39 VanDerWaalsContact O-CG1 3.28Å; R35-I39 WeakPolarHBondContact O-CG1 3.42Å; R35-I39 PolarHBondContact O-N 3.42Å
36	E	61.6	Low	59.9	Low	115 Å²	115	133.2 Å²	133.2	54%	0.537	64%	0.64	S	S	.	*	H	α-helix	trans	-65	-39.8	176	-71.9	-173.3	155.4	0	0	111.8	E32 E38 I39 L40	E32-E36 WeakPolarHBondContact O-CG 2.94Å; E32-E36 PolarHBondContact O-N 3.31Å; E36-E38 VanDerWaalsContact C-N 3.28Å; E36-E38 PolarHBondContact O-N 3.32Å; E36-I39 PolarHBondContact O-N 3.4Å; E36-L40 PolarHBondContact O-N 2.77Å; E36-L40 VanDerWaalsContact O-N 3.13Å
37	A	62.2	Low	60.2	Low	63 Å²	63	134.1 Å²	134.1	52%	0.521	66%	0.656	S	S	.	*	H	α-helix	trans	-65.7	-29.6	173.7	0	0	0	0	0	113.3	R33 K34	R33-A37 WeakPolarHBondContact O-CB 3.46Å; R33-A37 PolarHBondContact O-N 3.02Å; R33-A37 VanDerWaalsContact O-N 3.07Å; K34-A37 PolarHBondContact O-N 3.4Å
38	E	63	Low	60.1	Low	138 Å²	138	142.4 Å²	142.4	65%	0.645	67%	0.674	S	S	*	*	H	α-helix	trans	-77.4	-33.6	177.3	-166.4	171.5	-164.8	0	0	112.1	K34 R35 E36	K34-E38 WeakPolarHBondContact O-CB 3.41Å; K34-E38 PolarHBondContact O-N 3.04Å; R35-E38 PolarHBondContact O-N 3.16Å; E36-E38 VanDerWaalsContact C-N 3.28Å; E36-E38 PolarHBondContact O-N 3.32Å
39	I	63.5	Low	60	Low	145 Å²	145	143.2 Å²	143.2	74%	0.744	68%	0.678	S	S	*	*	H	α-helix	trans	-76.1	-29.2	177.1	-66.5	162.6	0	0	0	112	R35 E36 Q41	R35-I39 WeakPolarHBondContact O-CD1 3.45Å; R35-I39 VanDerWaalsContact O-CG1 3.28Å; R35-I39 WeakPolarHBondContact O-CG1 3.42Å; R35-I39 PolarHBondContact O-N 3.42Å; E36-I39 PolarHBondContact O-N 3.4Å; I39-Q41 VanDerWaalsContact C-N 3.27Å; I39-Q41 PolarHBondContact O-N 2.95Å
40	L	59.8	Low	60	Low	140 Å²	140	141.8 Å²	141.8	73%	0.733	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	-3.2	176.5	-96.5	142.5	0	0	0	114.2	E36 K42	E36-L40 PolarHBondContact O-N 2.77Å; E36-L40 VanDerWaalsContact O-N 3.13Å; L40-K42 PolarHBondContact O-N 2.94Å
41	Q	59	Low	60.3	Low	143 Å²	143	148 Å²	148	67%	0.668	70%	0.701	S	S	*	*			trans	-77.5	103.1	175.9	-115.5	176.3	18.4	0	0	110.6	I39	I39-Q41 VanDerWaalsContact C-N 3.27Å; I39-Q41 PolarHBondContact O-N 2.95Å
42	K	59.4	Low	60.5	Low	140 Å²	140	145.3 Å²	145.3	61%	0.609	70%	0.703	S	S	*	*			trans	-62.4	133.4	172.3	-71	178.6	-179.7	172	0	109.3	L40 F44 E45	L40-K42 PolarHBondContact O-N 2.94Å; K42-F44 PolarHBondContact O-N 2.85Å; K42-E45 HydrophobicContact CB-CB 4.49Å; K42-E45 HydrophobicContact CB-CG 4.11Å; K42-E45 PolarHBondContact O-N 2.83Å
43	P	60.4	Low	61	Low	135 Å²	135	143.1 Å²	143.1	88%	0.877	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65	-6.4	-172.2	21.9	-31.7	0	0	0	115
44	F	55.6	Low	61.7	Low	192 Å²	192	140.4 Å²	140.4	84%	0.842	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113	0.4	175.7	-97.5	-88.5	0	0	0	114.7	K42 K46	K42-F44 PolarHBondContact O-N 2.85Å; F44-K46 VanDerWaalsContact C-N 3.29Å; F44-K46 PolarHBondContact O-N 2.96Å
45	E	58.7	Low	62.5	Low	124 Å²	124	143.4 Å²	143.4	58%	0.579	71%	0.708	S	S	*	*			trans	-77.1	86.2	171.7	-79.9	-176.4	-178.8	0	0	109.1	K42 G47	K42-E45 HydrophobicContact CB-CB 4.49Å; K42-E45 HydrophobicContact CB-CG 4.11Å; K42-E45 PolarHBondContact O-N 2.83Å; E45-G47 PolarHBondContact O-N 2.92Å
46	K	62.7	Low	63.3	Low	191 Å²	191	137.7 Å²	137.7	83%	0.83	70%	0.695	S	S	*	*			trans	-51.1	117.8	159.8	-68.3	-178.8	-179.2	179.5	0	106.1	F44 R48	F44-K46 VanDerWaalsContact C-N 3.29Å; F44-K46 PolarHBondContact O-N 2.96Å; K46-R48 PolarHBondContact O-N 3.29Å
47	G	54.8	Low	64.3	Low	59 Å²	59	136.8 Å²	136.8	61%	0.608	69%	0.693	S	S	*	*			trans	-43.9	136.6	179.4	0	0	0	0	0	109.2	E45 Q49	E45-G47 PolarHBondContact O-N 2.92Å; G47-Q49 PolarHBondContact O-N 2.87Å
48	R	58	Low	65.1	Low	255 Å²	255	139.6 Å²	139.6	96%	0.962	70%	0.695	S	S	*	*			trans	-57.8	84.2	178.8	-69.3	-179	-178.9	-174.4	0.6	108.3	K46 S50	K46-R48 PolarHBondContact O-N 3.29Å; R48-S50 VanDerWaalsContact C-N 3.34Å; R48-S50 PolarHBondContact O-N 3.17Å
49	Q	56.4	Low	65.9	Low	159 Å²	159	135.6 Å²	135.6	74%	0.743	68%	0.683	S	S	*	*			trans	-66	105.9	165.4	-69.1	-167.6	-15.3	0	0	103.2	G47 K51	G47-Q49 PolarHBondContact O-N 2.87Å; Q49-K51 HydrophobicContact CB-CG 4.25Å; Q49-K51 WeakPolarHBondContact O-CG 3.28Å; Q49-K51 PolarHBondContact O-N 3.24Å
50	S	59.2	Low	66.9	Low	101 Å²	101	131.5 Å²	131.5	71%	0.706	67%	0.666	S	S	*	*			trans	-62	90.7	164.5	59.1	0	0	0	0	105.7	R48 V52	R48-S50 VanDerWaalsContact C-N 3.34Å; R48-S50 PolarHBondContact O-N 3.17Å; S50-V52 PolarHBondContact O-N 2.85Å
51	K	64.5	Low	68.1	Low	190 Å²	190	131.1 Å²	131.1	83%	0.826	66%	0.661	S	S	*	*			trans	-72.4	32.5	179	-64.3	-178.6	-179.2	-178.8	0	111.7	Q49	Q49-K51 HydrophobicContact CB-CG 4.25Å; Q49-K51 WeakPolarHBondContact O-CG 3.28Å; Q49-K51 PolarHBondContact O-N 3.24Å
52	V	67.9	Low	69.3	Low	116 Å²	116	126.7 Å²	126.7	70%	0.703	64%	0.644	S	S	*	*	S	Bend	trans	-115.3	125.4	178.1	-104.9	0	0	0	0	106.6	S50	S50-V52 PolarHBondContact O-N 2.85Å
53	A	69.8	Low	70.6	Confident	72 Å²	72	124.4 Å²	124.4	60%	0.595	64%	0.638	S	S	*	*			trans	-51.5	143.3	173.8	0	0	0	0	0	109.6	R55 L57	A53-R55 PolarHBondContact O-N 3.47Å; A53-L57 HydrophobicContact CB-CB 4.32Å; A53-L57 HydrophobicContact CB-CD1 4.18Å
54	H	75.8	Confident	71.9	Confident	135 Å²	135	126 Å²	126	63%	0.625	63%	0.627	S	S	*	*			trans	-56.2	141	176.6	-174.7	-102.1	0	0	0	109.5	S56 L57	H54-S56 WeakPolarHBondContact ND1-CB 2.87Å; H54-S56 PolarHBondContact ND1-N 3.1Å; H54-S56 PolarHBondContact ND1-OG 2.86Å; H54-S56 PolarHBondContact O-N 3.08Å; H54-L57 WeakPolarHBondContact O-CB 3.42Å; H54-L57 PolarHBondContact O-N 3.46Å
55	R	76.9	Confident	73.4	Confident	220 Å²	220	122.8 Å²	122.8	83%	0.83	61%	0.614	S	S	*	*	H	α-helix	trans	-54	-26.4	-174.4	-165.7	165	89	128.5	-0.3	113.5	A53 S59	A53-R55 PolarHBondContact O-N 3.47Å; R55-S59 PolarHBondContact O-N 3.15Å; R55-S59 PolarHBondContact O-OG 2.92Å
56	S	80.9	Confident	74.7	Confident	59 Å²	59	121.8 Å²	121.8	41%	0.413	61%	0.609	S	S	.	*	H	α-helix	trans	-69.7	-29.5	175.2	71.3	0	0	0	0	114.5	H54 S59 C60	H54-S56 WeakPolarHBondContact ND1-CB 2.87Å; H54-S56 PolarHBondContact ND1-N 3.1Å; H54-S56 PolarHBondContact ND1-OG 2.86Å; H54-S56 PolarHBondContact O-N 3.08Å; S56-S59 WeakPolarHBondContact CA-OG 2.9Å; S56-S59 PolarHBondContact O-OG 3.07Å; S56-C60 VanDerWaalsContact O-CB 3.26Å; S56-C60 WeakPolarHBondContact O-CB 3.36Å; S56-C60 PolarHBondContact O-N 3.44Å
57	L	81.2	Confident	75.7	Confident	96 Å²	96	114.3 Å²	114.3	50%	0.503	58%	0.583	S	S	.	*	H	α-helix	trans	-70.9	-44.5	175.7	-67.4	177	0	0	0	109.7	A53 H54 S59 C60 E61	A53-L57 HydrophobicContact CB-CB 4.32Å; A53-L57 HydrophobicContact CB-CD1 4.18Å; H54-L57 WeakPolarHBondContact O-CB 3.42Å; H54-L57 PolarHBondContact O-N 3.46Å; L57-S59 PolarHBondContact O-N 3.4Å; L57-C60 PolarHBondContact O-N 3.12Å; L57-E61 WeakPolarHBondContact O-CG 3.31Å; L57-E61 PolarHBondContact O-N 2.88Å
58	H	79.1	Confident	77.3	Confident	121 Å²	121	120.1 Å²	120.1	56%	0.56	59%	0.587	S	S	*	*	H	α-helix	trans	-60.3	-45	174.3	-179.2	-80.5	0	0	0	111.9	C60 E61 V62	H58-C60 PolarHBondContact O-N 3.12Å; H58-E61 PolarHBondContact O-N 3.39Å; H58-V62 VanDerWaalsContact O-CG2 3.28Å; H58-V62 WeakPolarHBondContact O-CG2 3.44Å; H58-V62 PolarHBondContact O-N 2.69Å
59	S	81.4	Confident	78.7	Confident	55 Å²	55	112.9 Å²	112.9	39%	0.385	57%	0.567	S	S	.	*	H	α-helix	trans	-62.9	-42	176.7	62.5	0	0	0	0	112.2	R55 S56 L57 E61 V62 D63	R55-S59 PolarHBondContact O-N 3.15Å; R55-S59 PolarHBondContact O-OG 2.92Å; S56-S59 WeakPolarHBondContact CA-OG 2.9Å; S56-S59 PolarHBondContact O-OG 3.07Å; L57-S59 PolarHBondContact O-N 3.4Å; S59-E61 VanDerWaalsContact C-N 3.35Å; S59-E61 PolarHBondContact O-N 2.77Å; S59-V62 PolarHBondContact O-N 2.73Å; S59-D63 PolarHBondContact O-N 2.83Å
60	C	83.9	Confident	80.1	Confident	59 Å²	59	112.1 Å²	112.1	40%	0.399	56%	0.558	S	S	.	*	H	α-helix	trans	-64.7	-36.6	178	-174.6	0	0	0	0	112.9	S56 L57 H58 R64	S56-C60 VanDerWaalsContact O-CB 3.26Å; S56-C60 WeakPolarHBondContact O-CB 3.36Å; S56-C60 PolarHBondContact O-N 3.44Å; L57-C60 PolarHBondContact O-N 3.12Å; H58-C60 PolarHBondContact O-N 3.12Å; C60-R64 WeakPolarHBondContact O-CB 3.33Å; C60-R64 PolarHBondContact O-N 2.83Å; C60-R64 VanDerWaalsContact O-N 3.12Å
61	E	83.9	Confident	81.3	Confident	132 Å²	132	115.8 Å²	115.8	62%	0.617	56%	0.556	S	S	*	*	H	α-helix	trans	-67.8	-43.2	174.7	-76.4	175.1	178.9	0	0	111.9	L57 H58 S59 R64 E65	L57-E61 WeakPolarHBondContact O-CG 3.31Å; L57-E61 PolarHBondContact O-N 2.88Å; H58-E61 PolarHBondContact O-N 3.39Å; S59-E61 VanDerWaalsContact C-N 3.35Å; S59-E61 PolarHBondContact O-N 2.77Å; E61-R64 WeakPolarHBondContact O-CB 3.28Å; E61-R64 PolarHBondContact O-N 3Å; E61-E65 PolarHBondContact O-N 3.46Å
62	V	85.8	Confident	82.5	Confident	50 Å²	50	109.5 Å²	109.5	30%	0.303	54%	0.539	S	S	.	.	H	α-helix	trans	-62	-45.8	175.4	172.7	0	0	0	0	111	H58 S59 R64 E65 E66	H58-V62 VanDerWaalsContact O-CG2 3.28Å; H58-V62 WeakPolarHBondContact O-CG2 3.44Å; H58-V62 PolarHBondContact O-N 2.69Å; S59-V62 PolarHBondContact O-N 2.73Å; V62-R64 VanDerWaalsContact C-N 3.26Å; V62-R64 PolarHBondContact O-N 3.02Å; V62-E65 PolarHBondContact O-N 2.78Å; V62-E65 VanDerWaalsContact O-N 3.14Å; V62-E66 HydrophobicContact CG1-CG 4.41Å; V62-E66 WeakPolarHBondContact O-CG 2.96Å; V62-E66 PolarHBondContact O-N 3.32Å
63	D	87	Confident	83.4	Confident	92 Å²	92	108.8 Å²	108.8	49%	0.492	53%	0.528	S	S	.	.	H	α-helix	trans	-59	-38.9	177	-68.6	-27.2	0	0	0	111.8	S59 A67	S59-D63 PolarHBondContact O-N 2.83Å; D63-A67 WeakPolarHBondContact O-CB 3.22Å; D63-A67 PolarHBondContact O-N 3.14Å
64	R	86	Confident	84.2	Confident	169 Å²	169	107.1 Å²	107.1	64%	0.638	51%	0.509	S	S	*	.	H	α-helix	trans	-65.1	-44	175.4	-95.6	-175.4	149	115.2	-2.2	112.4	C60 E61 V62 A67 R68	C60-R64 WeakPolarHBondContact O-CB 3.33Å; C60-R64 PolarHBondContact O-N 2.83Å; C60-R64 VanDerWaalsContact O-N 3.12Å; E61-R64 WeakPolarHBondContact O-CB 3.28Å; E61-R64 PolarHBondContact O-N 3Å; V62-R64 VanDerWaalsContact C-N 3.26Å; V62-R64 PolarHBondContact O-N 3.02Å; R64-A67 PolarHBondContact O-N 2.9Å; R64-R68 WeakPolarHBondContact O-CG 3.45Å; R64-R68 PolarHBondContact O-N 2.84Å
65	E	86.8	Confident	84.8	Confident	124 Å²	124	107.1 Å²	107.1	58%	0.579	51%	0.512	S	S	*	.	H	α-helix	trans	-67.7	-41.1	179.3	-169.4	165.1	-161	0	0	111.2	E61 V62 A67 R68 N69	E61-E65 PolarHBondContact O-N 3.46Å; V62-E65 PolarHBondContact O-N 2.78Å; V62-E65 VanDerWaalsContact O-N 3.14Å; E65-A67 VanDerWaalsContact C-N 3.34Å; E65-A67 PolarHBondContact O-N 2.85Å; E65-R68 WeakPolarHBondContact O-CB 3.34Å; E65-R68 PolarHBondContact O-N 3.3Å; E65-N69 PolarHBondContact O-N 2.86Å
66	E	86.8	Confident	85.4	Confident	102 Å²	102	101 Å²	101	48%	0.477	50%	0.503	S	S	.	.	H	α-helix	trans	-63.8	-36.9	172.4	-72.3	-173.4	177.7	0	0	112.7	V62 N69 R70	V62-E66 HydrophobicContact CG1-CG 4.41Å; V62-E66 WeakPolarHBondContact O-CG 2.96Å; V62-E66 PolarHBondContact O-N 3.32Å; E66-N69 PolarHBondContact O-N 3.42Å; E66-R70 WeakPolarHBondContact O-CB 3.35Å; E66-R70 VanDerWaalsContact O-CG 3.25Å; E66-R70 WeakPolarHBondContact O-CG 3.44Å; E66-R70 PolarHBondContact O-N 3.23Å; E66-R70 PolarHBondContact O-NE 2.91Å
67	A	84.8	Confident	85.8	Confident	34 Å²	34	99.8 Å²	99.8	28%	0.281	49%	0.491	S	S	.	.	H	α-helix	trans	-63.7	-41.3	173.4	0	0	0	0	0	111.7	D63 R64 E65 R70 R71	D63-A67 WeakPolarHBondContact O-CB 3.22Å; D63-A67 PolarHBondContact O-N 3.14Å; R64-A67 PolarHBondContact O-N 2.9Å; E65-A67 VanDerWaalsContact C-N 3.34Å; E65-A67 PolarHBondContact O-N 2.85Å; A67-R70 PolarHBondContact O-N 2.75Å; A67-R71 WeakPolarHBondContact O-CG 3.21Å; A67-R71 PolarHBondContact O-N 2.86Å
68	R	88.1	Confident	86.4	Confident	181 Å²	181	100.3 Å²	100.3	68%	0.683	50%	0.495	S	S	*	.	H	α-helix	trans	-63.7	-46.5	174.2	-74.3	178.2	178.2	171.2	-0.5	111.7	R64 E65 R70 R71 A72	R64-R68 WeakPolarHBondContact O-CG 3.45Å; R64-R68 PolarHBondContact O-N 2.84Å; E65-R68 WeakPolarHBondContact O-CB 3.34Å; E65-R68 PolarHBondContact O-N 3.3Å; R68-R70 VanDerWaalsContact C-N 3.34Å; R68-R70 PolarHBondContact O-N 2.94Å; R68-R71 PolarHBondContact O-N 3.19Å; R68-A72 WeakPolarHBondContact O-CB 3.36Å; R68-A72 PolarHBondContact O-N 3.01Å
69	N	87.1	Confident	86.9	Confident	104 Å²	104	97.4 Å²	97.4	56%	0.556	49%	0.492	S	S	*	.	H	α-helix	trans	-63.2	-40	178	-76	-10.2	0	0	0	112	E65 E66 A72 H73	E65-N69 PolarHBondContact O-N 2.86Å; E66-N69 PolarHBondContact O-N 3.42Å; N69-A72 PolarHBondContact O-N 2.73Å; N69-H73 WeakPolarHBondContact O-CB 3.31Å; N69-H73 PolarHBondContact O-N 2.82Å
70	R	85.8	Confident	87.4	Confident	143 Å²	143	101.9 Å²	101.9	54%	0.54	50%	0.504	S	S	.	.	H	α-helix	trans	-62.5	-41.4	174	-77.7	-177.4	-72.6	-179.1	-5.2	112.3	E66 A67 R68 L74	E66-R70 WeakPolarHBondContact O-CB 3.35Å; E66-R70 VanDerWaalsContact O-CG 3.25Å; E66-R70 WeakPolarHBondContact O-CG 3.44Å; E66-R70 PolarHBondContact O-N 3.23Å; E66-R70 PolarHBondContact O-NE 2.91Å; A67-R70 PolarHBondContact O-N 2.75Å; R68-R70 VanDerWaalsContact C-N 3.34Å; R68-R70 PolarHBondContact O-N 2.94Å; R70-L74 WeakPolarHBondContact O-CB 3.35Å; R70-L74 VanDerWaalsContact O-CG 3.3Å; R70-L74 WeakPolarHBondContact O-CG 3.24Å; R70-L74 PolarHBondContact O-N 3Å
71	R	84.8	Confident	87.8	Confident	178 Å²	178	104 Å²	104	67%	0.672	51%	0.508	S	S	*	.	H	α-helix	trans	-64.8	-49.5	175.6	-74.7	180	-176.2	-153.7	-0.8	111.5	A67 R68 H73 L74 I75	A67-R71 WeakPolarHBondContact O-CG 3.21Å; A67-R71 PolarHBondContact O-N 2.86Å; R68-R71 PolarHBondContact O-N 3.19Å; R71-H73 VanDerWaalsContact C-N 3.3Å; R71-H73 PolarHBondContact O-N 3.2Å; R71-L74 PolarHBondContact O-N 2.9Å; R71-I75 VanDerWaalsContact O-CG1 3.28Å; R71-I75 WeakPolarHBondContact O-CG1 3.48Å; R71-I75 PolarHBondContact O-N 3.3Å
72	A	88	Confident	88.2	Confident	58 Å²	58	102.6 Å²	102.6	48%	0.479	50%	0.498	S	S	.	.	H	α-helix	trans	-58.8	-43	177.6	0	0	0	0	0	111.7	R68 N69 I75 S76	R68-A72 WeakPolarHBondContact O-CB 3.36Å; R68-A72 PolarHBondContact O-N 3.01Å; N69-A72 PolarHBondContact O-N 2.73Å; A72-I75 PolarHBondContact O-N 3.37Å; A72-S76 WeakPolarHBondContact O-CB 3.45Å; A72-S76 PolarHBondContact O-N 3.26Å; A72-S76 PolarHBondContact O-OG 3.32Å
73	H	87.2	Confident	88.4	Confident	100 Å²	100	105.7 Å²	105.7	46%	0.463	51%	0.508	S	S	.	.	H	α-helix	trans	-63.9	-41.8	176.7	-177	-128.6	0	0	0	112.5	N69 R71 S76 M77	N69-H73 WeakPolarHBondContact O-CB 3.31Å; N69-H73 PolarHBondContact O-N 2.82Å; R71-H73 VanDerWaalsContact C-N 3.3Å; R71-H73 PolarHBondContact O-N 3.2Å; H73-S76 WeakPolarHBondContact CA-OG 3.05Å; H73-S76 PolarHBondContact O-N 3.44Å; H73-S76 PolarHBondContact O-OG 3.12Å; H73-M77 WeakPolarHBondContact CE1-CE 3.49Å; H73-M77 WeakPolarHBondContact ND1-CE 3.32Å; H73-M77 VanDerWaalsContact NE2-CE 3.26Å; H73-M77 WeakPolarHBondContact NE2-CE 3.38Å; H73-M77 WeakPolarHBondContact O-CG 3.43Å; H73-M77 PolarHBondContact O-N 2.94Å
74	L	86.9	Confident	88.7	Confident	38 Å²	38	108.3 Å²	108.3	20%	0.199	52%	0.515	C	S	.	.	H	α-helix	trans	-62.3	-46.1	173.8	-77.2	169.8	0	0	0	111.5	R70 R71 S76 M77 R82 K85 F86	R70-L74 WeakPolarHBondContact O-CB 3.35Å; R70-L74 VanDerWaalsContact O-CG 3.3Å; R70-L74 WeakPolarHBondContact O-CG 3.24Å; R70-L74 PolarHBondContact O-N 3Å; R71-L74 PolarHBondContact O-N 2.9Å; L74-S76 VanDerWaalsContact C-N 3.29Å; L74-S76 PolarHBondContact O-N 3.24Å; L74-M77 PolarHBondContact O-N 3.03Å; L74-R82 WeakPolarHBondContact O-CD 3.42Å; L74-R82 VanDerWaalsContact O-CG 3.31Å; L74-R82 WeakPolarHBondContact O-CG 3.4Å; L74-K85 HydrophobicContact CD2-CD 3.75Å; L74-F86 HydrophobicContact CD1-CE1 4.21Å; L74-F86 HydrophobicContact CD1-CZ 4.29Å; L74-F86 HydrophobicContact CD2-CE1 3.76Å; L74-F86 HydrophobicContact CD2-CZ 3.73Å
75	I	87.6	Confident	88.9	Confident	135 Å²	135	103.1 Å²	103.1	69%	0.692	50%	0.497	S	S	*	.	H	α-helix	trans	-63.9	-36.5	179.6	-66.6	164	0	0	0	111.1	R71 A72 M77	R71-I75 VanDerWaalsContact O-CG1 3.28Å; R71-I75 WeakPolarHBondContact O-CG1 3.48Å; R71-I75 PolarHBondContact O-N 3.3Å; A72-I75 PolarHBondContact O-N 3.37Å; I75-M77 VanDerWaalsContact C-N 3.26Å; I75-M77 PolarHBondContact O-N 3.04Å
76	S	89.4	Confident	89.1	Confident	90 Å²	90	101.9 Å²	101.9	63%	0.629	49%	0.49	S	S	*	.	H	α-helix	trans	-71	-16.2	177.9	67.5	0	0	0	0	114.7	A72 H73 L74	A72-S76 WeakPolarHBondContact O-CB 3.45Å; A72-S76 PolarHBondContact O-N 3.26Å; A72-S76 PolarHBondContact O-OG 3.32Å; H73-S76 WeakPolarHBondContact CA-OG 3.05Å; H73-S76 PolarHBondContact O-N 3.44Å; H73-S76 PolarHBondContact O-OG 3.12Å; L74-S76 VanDerWaalsContact C-N 3.29Å; L74-S76 PolarHBondContact O-N 3.24Å
77	M	90.4	Very high	89.2	Confident	35 Å²	35	98.1 Å²	98.1	17%	0.172	47%	0.474	C	S	.	.	S	Bend	trans	-80.6	145.7	-179.4	-80	176.9	-174.8	0	0	112.2	H73 L74 I75 E81 R82 K85	H73-M77 WeakPolarHBondContact CE1-CE 3.49Å; H73-M77 WeakPolarHBondContact ND1-CE 3.32Å; H73-M77 VanDerWaalsContact NE2-CE 3.26Å; H73-M77 WeakPolarHBondContact NE2-CE 3.38Å; H73-M77 WeakPolarHBondContact O-CG 3.43Å; H73-M77 PolarHBondContact O-N 2.94Å; L74-M77 PolarHBondContact O-N 3.03Å; I75-M77 VanDerWaalsContact C-N 3.26Å; I75-M77 PolarHBondContact O-N 3.04Å; M77-E81 HydrophobicContact CB-CB 4.16Å; M77-E81 HydrophobicContact CG-CB 4.37Å; M77-R82 HydrophobicContact CB-CG 3.57Å; M77-R82 PolarHBondContact O-NE 2.98Å; M77-K85 HydrophobicContact CE-CD 4.38Å; M77-K85 HydrophobicContact SD-CD 4.19Å
78	N	93.4	Very high	89.5	Confident	107 Å²	107	98.3 Å²	98.3	57%	0.572	48%	0.479	S	S	*	.			trans	-61.1	152.5	170.7	-168.8	-3.1	0	0	0	110.6	F80 E81 R82	N78-F80 PolarHBondContact O-N 3.04Å; N78-E81 HydrophobicContact CB-CB 4.47Å; N78-E81 HydrophobicContact CB-CG 4.18Å; N78-E81 PolarHBondContact N-OE2 3.34Å; N78-E81 PolarHBondContact O-N 3.11Å; N78-R82 PolarHBondContact O-N 3.42Å
79	A	90.4	Very high	89.6	Confident	60 Å²	60	92.4 Å²	92.4	50%	0.496	46%	0.461	S	S	.	.	H	α-helix	trans	-53.2	-40.1	-179.4	0	0	0	0	0	112.5	H83	A79-H83 WeakPolarHBondContact O-CB 3.34Å; A79-H83 PolarHBondContact O-N 2.93Å
80	F	90.9	Very high	89.7	Confident	148 Å²	148	93.3 Å²	93.3	65%	0.649	46%	0.458	S	S	*	.	H	α-helix	trans	-66.6	-39.8	176.2	-178.8	-103.1	0	0	0	113.1	N78 H83 K84	N78-F80 PolarHBondContact O-N 3.04Å; F80-H83 PolarHBondContact O-N 3.49Å; F80-K84 PolarHBondContact O-N 2.86Å
81	E	91.9	Very high	89.9	Confident	104 Å²	104	88.6 Å²	88.6	49%	0.486	44%	0.443	S	S	.	.	H	α-helix	trans	-71.1	-41.7	179.9	-66.2	174.6	162.5	0	0	111.4	M77 N78 K84 K85	M77-E81 HydrophobicContact CB-CB 4.16Å; M77-E81 HydrophobicContact CG-CB 4.37Å; N78-E81 HydrophobicContact CB-CB 4.47Å; N78-E81 HydrophobicContact CB-CG 4.18Å; N78-E81 PolarHBondContact N-OE2 3.34Å; N78-E81 PolarHBondContact O-N 3.11Å; E81-K84 PolarHBondContact O-N 2.83Å; E81-K85 PolarHBondContact O-N 2.74Å
82	R	93	Very high	90.2	Very high	103 Å²	103	86.4 Å²	86.4	39%	0.389	44%	0.444	S	S	.	.	H	α-helix	trans	-55.9	-51	170.5	-78.1	-166.3	-90.2	159.8	2	111.1	L74 M77 N78 K84 K85 F86	L74-R82 WeakPolarHBondContact O-CD 3.42Å; L74-R82 VanDerWaalsContact O-CG 3.31Å; L74-R82 WeakPolarHBondContact O-CG 3.4Å; M77-R82 HydrophobicContact CB-CG 3.57Å; M77-R82 PolarHBondContact O-NE 2.98Å; N78-R82 PolarHBondContact O-N 3.42Å; R82-K84 VanDerWaalsContact C-N 3.33Å; R82-K84 PolarHBondContact O-N 2.87Å; R82-K85 PolarHBondContact O-N 3.38Å; R82-F86 HydrophobicContact CB-CD2 4.44Å; R82-F86 HydrophobicContact CB-CE2 4.11Å; R82-F86 WeakPolarHBondContact O-CD2 3.47Å; R82-F86 WeakPolarHBondContact O-CG 3.43Å; R82-F86 PolarHBondContact O-N 3.22Å
83	H	90.5	Very high	90.3	Very high	114 Å²	114	92 Å²	92	53%	0.528	45%	0.454	S	S	.	.	H	α-helix	trans	-56.9	-46.4	177.4	172.3	-94.2	0	0	0	111.7	A79 F80 K85 F86 V87	A79-H83 WeakPolarHBondContact O-CB 3.34Å; A79-H83 PolarHBondContact O-N 2.93Å; F80-H83 PolarHBondContact O-N 3.49Å; H83-K85 VanDerWaalsContact C-N 3.34Å; H83-K85 PolarHBondContact O-N 2.63Å; H83-F86 PolarHBondContact O-N 3.29Å; H83-V87 VanDerWaalsContact O-CG2 3.31Å; H83-V87 WeakPolarHBondContact O-CG2 3.4Å; H83-V87 PolarHBondContact O-N 3.43Å
84	K	92	Very high	90.2	Very high	148 Å²	148	95.8 Å²	95.8	64%	0.643	47%	0.465	S	S	*	.	H	α-helix	trans	-60.4	-43	178	-173.5	-179.7	179.1	-176.2	0	112.2	F80 E81 R82 G88	F80-K84 PolarHBondContact O-N 2.86Å; E81-K84 PolarHBondContact O-N 2.83Å; R82-K84 VanDerWaalsContact C-N 3.33Å; R82-K84 PolarHBondContact O-N 2.87Å; K84-G88 PolarHBondContact O-N 3.05Å
85	K	91.4	Very high	89.8	Confident	60 Å²	60	97.2 Å²	97.2	26%	0.261	49%	0.489	S	S	.	.	H	α-helix	trans	-62.5	-48.3	176.6	-173.8	-170.2	170.3	-166.6	0	111	L74 M77 E81 R82 H83 V87 G88 D89	L74-K85 HydrophobicContact CD2-CD 3.75Å; M77-K85 HydrophobicContact CE-CD 4.38Å; M77-K85 HydrophobicContact SD-CD 4.19Å; E81-K85 PolarHBondContact O-N 2.74Å; R82-K85 PolarHBondContact O-N 3.38Å; H83-K85 VanDerWaalsContact C-N 3.34Å; H83-K85 PolarHBondContact O-N 2.63Å; K85-V87 PolarHBondContact O-N 2.97Å; K85-G88 PolarHBondContact O-N 3.46Å; K85-G88 VanDerWaalsContact O-N 3.15Å; K85-D89 PolarHBondContact O-N 3.48Å
86	F	90.3	Very high	89.5	Confident	98 Å²	98	91.9 Å²	91.9	43%	0.43	47%	0.468	S	S	.	.	H	α-helix	trans	-63.4	-40.1	179.7	-66.5	-43.5	0	0	0	113.2	L74 R82 H83 G88 D89 Y90	L74-F86 HydrophobicContact CD1-CE1 4.21Å; L74-F86 HydrophobicContact CD1-CZ 4.29Å; L74-F86 HydrophobicContact CD2-CE1 3.76Å; L74-F86 HydrophobicContact CD2-CZ 3.73Å; R82-F86 HydrophobicContact CB-CD2 4.44Å; R82-F86 HydrophobicContact CB-CE2 4.11Å; R82-F86 WeakPolarHBondContact O-CD2 3.47Å; R82-F86 WeakPolarHBondContact O-CG 3.43Å; R82-F86 PolarHBondContact O-N 3.22Å; H83-F86 PolarHBondContact O-N 3.29Å; F86-G88 VanDerWaalsContact C-N 3.32Å; F86-G88 PolarHBondContact O-N 2.92Å; F86-D89 PolarHBondContact O-N 2.71Å; F86-Y90 VanDerWaalsContact O-CB 3.27Å; F86-Y90 WeakPolarHBondContact O-CB 3.03Å; F86-Y90 PolarHBondContact O-N 3.35Å
87	V	89.9	Confident	89.1	Confident	23 Å²	23	94.1 Å²	94.1	14%	0.139	47%	0.468	C	S	.	.	H	α-helix	trans	-63.6	-40.6	173.9	172.4	0	0	0	0	110.9	H83 K85 Y90 I91 F101	H83-V87 VanDerWaalsContact O-CG2 3.31Å; H83-V87 WeakPolarHBondContact O-CG2 3.4Å; H83-V87 PolarHBondContact O-N 3.43Å; K85-V87 PolarHBondContact O-N 2.97Å; V87-Y90 PolarHBondContact O-N 3.03Å; V87-I91 HydrophobicContact CG1-CD1 3.98Å; V87-I91 VanDerWaalsContact O-CG1 3.3Å; V87-I91 WeakPolarHBondContact O-CG1 3.5Å; V87-I91 PolarHBondContact O-N 3.09Å; V87-F101 HydrophobicContact CG1-CD2 4.05Å; V87-F101 HydrophobicContact CG1-CE1 4.49Å; V87-F101 HydrophobicContact CG1-CE2 3.91Å; V87-F101 HydrophobicContact CG1-CG 4.39Å; V87-F101 HydrophobicContact CG1-CZ 4.13Å
88	G	90.6	Very high	88.5	Confident	37 Å²	37	99.4 Å²	99.4	38%	0.381	49%	0.494	S	S	.	.	H	α-helix	trans	-63.2	-48.2	175.3	0	0	0	0	0	112.8	K84 K85 F86 Y90 I91 L92	K84-G88 PolarHBondContact O-N 3.05Å; K85-G88 PolarHBondContact O-N 3.46Å; K85-G88 VanDerWaalsContact O-N 3.15Å; F86-G88 VanDerWaalsContact C-N 3.32Å; F86-G88 PolarHBondContact O-N 2.92Å; G88-Y90 VanDerWaalsContact C-N 3.33Å; G88-Y90 PolarHBondContact O-N 3.33Å; G88-I91 PolarHBondContact O-N 2.96Å; G88-L92 WeakPolarHBondContact O-CB 3.48Å; G88-L92 PolarHBondContact O-N 2.8Å
89	D	90.8	Very high	87.7	Confident	57 Å²	57	96.6 Å²	96.6	31%	0.305	49%	0.486	S	S	.	.	H	α-helix	trans	-61	-43.6	177	-70.3	-15.6	0	0	0	110.4	K85 F86 I91 L92 Y93	K85-D89 PolarHBondContact O-N 3.48Å; F86-D89 PolarHBondContact O-N 2.71Å; D89-I91 PolarHBondContact O-N 3.11Å; D89-L92 PolarHBondContact O-N 3.41Å; D89-Y93 HydrophobicContact CB-CD2 4.26Å; D89-Y93 HydrophobicContact CB-CE2 4.18Å; D89-Y93 WeakPolarHBondContact O-CD2 3.41Å; D89-Y93 PolarHBondContact O-N 3.01Å
90	Y	88.8	Confident	87.1	Confident	123 Å²	123	99.5 Å²	99.5	48%	0.482	49%	0.493	S	S	.	.	H	α-helix	trans	-59.1	-46	176.3	-178.4	-87.4	0	0	0	112.2	F86 V87 G88 L92 Y94 F101	F86-Y90 VanDerWaalsContact O-CB 3.27Å; F86-Y90 WeakPolarHBondContact O-CB 3.03Å; F86-Y90 PolarHBondContact O-N 3.35Å; V87-Y90 PolarHBondContact O-N 3.03Å; G88-Y90 VanDerWaalsContact C-N 3.33Å; G88-Y90 PolarHBondContact O-N 3.33Å; Y90-L92 VanDerWaalsContact C-N 3.31Å; Y90-L92 PolarHBondContact O-N 3.19Å; Y90-Y94 AromaticContact CD2-CD2 3.82Å; Y90-Y94 HydrophobicContact CD2-CD2 3.82Å; Y90-Y94 HydrophobicContact CD2-CE2 4.36Å; Y90-Y94 HydrophobicContact CE2-CD2 4.1Å; Y90-Y94 HydrophobicContact CE2-CG 4.48Å; Y90-Y94 HydrophobicContact CG-CD2 4.31Å; Y90-Y94 WeakPolarHBondContact O-CB 3.34Å; Y90-Y94 PolarHBondContact O-N 3.38Å; Y90-F101 HydrophobicContact CD1-CE2 4.3Å; Y90-F101 AromaticContact CD1-CZ 3.55Å; Y90-F101 HydrophobicContact CD1-CZ 3.55Å; Y90-F101 AromaticContact CE1-CZ 3.85Å; Y90-F101 HydrophobicContact CE1-CZ 3.85Å; Y90-F101 HydrophobicContact CG-CZ 4.36Å
91	I	90.6	Very high	86.4	Confident	45 Å²	45	97.1 Å²	97.1	23%	0.231	48%	0.482	C	S	.	.	H	α-helix	trans	-61.4	-41.5	176.2	-73.5	167.6	0	0	0	110.9	V87 G88 D89 G95 G96 M98 F101	V87-I91 HydrophobicContact CG1-CD1 3.98Å; V87-I91 VanDerWaalsContact O-CG1 3.3Å; V87-I91 WeakPolarHBondContact O-CG1 3.5Å; V87-I91 PolarHBondContact O-N 3.09Å; G88-I91 PolarHBondContact O-N 2.96Å; D89-I91 PolarHBondContact O-N 3.11Å; I91-G95 WeakPolarHBondContact O-CA 3.43Å; I91-G95 PolarHBondContact O-N 3.35Å; I91-G96 VanDerWaalsContact CG2-O 3.27Å; I91-G96 WeakPolarHBondContact CG2-O 3.48Å; I91-M98 HydrophobicContact CD1-CB 4.48Å; I91-M98 HydrophobicContact CD1-CG 3.6Å; I91-F101 HydrophobicContact CD1-CD2 4.5Å; I91-F101 HydrophobicContact CD1-CE2 3.99Å; I91-F101 HydrophobicContact CG1-CE2 3.91Å
92	L	90.1	Very high	85.9	Confident	132 Å²	132	101.8 Å²	101.8	69%	0.691	50%	0.496	S	S	*	.	H	α-helix	trans	-66.9	-45.2	-178.8	-176.1	65.9	0	0	0	112.8	G88 D89 Y90	G88-L92 WeakPolarHBondContact O-CB 3.48Å; G88-L92 PolarHBondContact O-N 2.8Å; D89-L92 PolarHBondContact O-N 3.41Å; Y90-L92 VanDerWaalsContact C-N 3.31Å; Y90-L92 PolarHBondContact O-N 3.19Å
93	Y	89.3	Confident	85.4	Confident	176 Å²	176	106.1 Å²	106.1	69%	0.69	51%	0.512	S	S	*	.	H	α-helix	trans	-82.8	-34.9	-175.5	-70.2	-66.8	0	0	0	113.5	D89	D89-Y93 HydrophobicContact CB-CD2 4.26Å; D89-Y93 HydrophobicContact CB-CE2 4.18Å; D89-Y93 WeakPolarHBondContact O-CD2 3.41Å; D89-Y93 PolarHBondContact O-N 3.01Å
94	Y	86	Confident	84.8	Confident	178 Å²	178	104.9 Å²	104.9	70%	0.698	52%	0.516	S	S	*	.	H	α-helix	trans	-112.3	-4.9	-171.4	-58.3	-79.9	0	0	0	114.1	Y90	Y90-Y94 AromaticContact CD2-CD2 3.82Å; Y90-Y94 HydrophobicContact CD2-CD2 3.82Å; Y90-Y94 HydrophobicContact CD2-CE2 4.36Å; Y90-Y94 HydrophobicContact CE2-CD2 4.1Å; Y90-Y94 HydrophobicContact CE2-CG 4.48Å; Y90-Y94 HydrophobicContact CG-CD2 4.31Å; Y90-Y94 WeakPolarHBondContact O-CB 3.34Å; Y90-Y94 PolarHBondContact O-N 3.38Å
95	G	77.9	Confident	84.2	Confident	69 Å²	69	101.1 Å²	101.1	71%	0.711	51%	0.513	S	S	*	.			trans	76.2	36.8	168.4	0	0	0	0	0	116.2	I91	I91-G95 WeakPolarHBondContact O-CA 3.43Å; I91-G95 PolarHBondContact O-N 3.35Å
96	G	81.7	Confident	83.5	Confident	23 Å²	23	103 Å²	103	24%	0.237	54%	0.539	C	S	.	.			trans	-91.7	173.8	175.2	0	0	0	0	0	114.6	I91	I91-G96 VanDerWaalsContact CG2-O 3.27Å; I91-G96 WeakPolarHBondContact CG2-O 3.48Å
97	Q	80.6	Confident	82.9	Confident	136 Å²	136	107.1 Å²	107.1	64%	0.636	56%	0.557	S	S	*	*			trans	-111	151.3	172.1	-63.2	-176	30.7	0	0	111.3	A99 D100	Q97-A99 HydrophobicContact CB-CB 4.45Å; Q97-A99 PolarHBondContact O-N 2.9Å; Q97-D100 PolarHBondContact N-OD2 2.92Å; Q97-D100 WeakPolarHBondContact O-CB 3.29Å; Q97-D100 PolarHBondContact O-N 2.8Å
98	M	77.9	Confident	82.6	Confident	147 Å²	147	109.6 Å²	109.6	72%	0.724	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.5	-21.8	173	-72	-170	73.2	0	0	113.1	I91 D100 F101	I91-M98 HydrophobicContact CD1-CB 4.48Å; I91-M98 HydrophobicContact CD1-CG 3.6Å; M98-D100 VanDerWaalsContact C-N 3.27Å; M98-D100 PolarHBondContact O-N 2.78Å; M98-F101 PolarHBondContact O-N 3.01Å
99	A	78	Confident	82.4	Confident	48 Å²	48	113.1 Å²	113.1	40%	0.397	57%	0.574	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.4	-28.3	176.5	0	0	0	0	0	112.9	Q97 F101 R102	Q97-A99 HydrophobicContact CB-CB 4.45Å; Q97-A99 PolarHBondContact O-N 2.9Å; A99-F101 VanDerWaalsContact C-N 3.26Å; A99-F101 PolarHBondContact O-N 3.41Å; A99-R102 VanDerWaalsContact O-CB 3.28Å; A99-R102 WeakPolarHBondContact O-CB 3.48Å; A99-R102 WeakPolarHBondContact O-CG 3.35Å; A99-R102 PolarHBondContact O-N 3.46Å; A99-R102 VanDerWaalsContact O-N 3.15Å
100	D	77.3	Confident	82.3	Confident	120 Å²	120	113.9 Å²	113.9	64%	0.642	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	-24.9	-178	-55.1	-34.6	0	0	0	111.8	Q97 M98 R102	Q97-D100 PolarHBondContact N-OD2 2.92Å; Q97-D100 WeakPolarHBondContact O-CB 3.29Å; Q97-D100 PolarHBondContact O-N 2.8Å; M98-D100 VanDerWaalsContact C-N 3.27Å; M98-D100 PolarHBondContact O-N 2.78Å; D100-R102 PolarHBondContact O-N 3.05Å
101	F	76.6	Confident	82.2	Confident	98 Å²	98	112.5 Å²	112.5	43%	0.43	58%	0.582	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.3	-0	174.9	-62.8	-83.1	0	0	0	113.5	V87 Y90 I91 M98 A99 R103	V87-F101 HydrophobicContact CG1-CD2 4.05Å; V87-F101 HydrophobicContact CG1-CE1 4.49Å; V87-F101 HydrophobicContact CG1-CE2 3.91Å; V87-F101 HydrophobicContact CG1-CG 4.39Å; V87-F101 HydrophobicContact CG1-CZ 4.13Å; Y90-F101 HydrophobicContact CD1-CE2 4.3Å; Y90-F101 AromaticContact CD1-CZ 3.55Å; Y90-F101 HydrophobicContact CD1-CZ 3.55Å; Y90-F101 AromaticContact CE1-CZ 3.85Å; Y90-F101 HydrophobicContact CE1-CZ 3.85Å; Y90-F101 HydrophobicContact CG-CZ 4.36Å; I91-F101 HydrophobicContact CD1-CD2 4.5Å; I91-F101 HydrophobicContact CD1-CE2 3.99Å; I91-F101 HydrophobicContact CG1-CE2 3.91Å; M98-F101 PolarHBondContact O-N 3.01Å; A99-F101 VanDerWaalsContact C-N 3.26Å; A99-F101 PolarHBondContact O-N 3.41Å; F101-R103 PolarHBondContact O-N 3.15Å; F101-R103 VanDerWaalsContact O-N 3.12Å
102	R	80.8	Confident	82.2	Confident	202 Å²	202	116.5 Å²	116.5	76%	0.762	60%	0.603	S	S	*	*			trans	-70.9	110.3	175.5	-69.9	-178.8	175.6	-176.2	0.1	109.2	A99 D100 S104	A99-R102 VanDerWaalsContact O-CB 3.28Å; A99-R102 WeakPolarHBondContact O-CB 3.48Å; A99-R102 WeakPolarHBondContact O-CG 3.35Å; A99-R102 PolarHBondContact O-N 3.46Å; A99-R102 VanDerWaalsContact O-N 3.15Å; D100-R102 PolarHBondContact O-N 3.05Å; R102-S104 PolarHBondContact O-N 3.4Å
103	R	81.8	Confident	82.2	Confident	194 Å²	194	112.9 Å²	112.9	73%	0.732	59%	0.585	S	S	*	*			trans	-55.1	134.6	171.2	178.1	179.6	164.2	173.3	-1.1	110.4	F101 A105 D108	F101-R103 PolarHBondContact O-N 3.15Å; F101-R103 VanDerWaalsContact O-N 3.12Å; R103-A105 PolarHBondContact O-N 3.42Å; R103-D108 IonicContact CZ-OD1 2.8Å; R103-D108 IonicContact CZ-OD2 3.4Å; R103-D108 IonicContact NE-OD1 3.37Å; R103-D108 IonicContact NE-OD2 3.78Å; R103-D108 IonicContact NH2-OD1 2.63Å; R103-D108 PolarHBondContact NH2-OD1 3.12Å; R103-D108 IonicContact NH2-OD2 3.73Å
104	S	79.2	Confident	82.2	Confident	88 Å²	88	104.5 Å²	104.5	62%	0.615	55%	0.552	S	S	*	*			trans	-72	107.6	172.2	59.2	0	0	0	0	110.5	R102 A106	R102-S104 PolarHBondContact O-N 3.4Å; S104-A106 PolarHBondContact O-N 3.41Å
105	A	78.8	Confident	82.4	Confident	69 Å²	69	97.6 Å²	97.6	57%	0.57	53%	0.527	S	S	*	.	G	3₁₀ helix	trans	-77.8	-1.6	177.3	0	0	0	0	0	114.1	R103 K107 D108	R103-A105 PolarHBondContact O-N 3.42Å; A105-K107 PolarHBondContact O-N 3.21Å; A105-K107 VanDerWaalsContact O-N 3.11Å; A105-D108 WeakPolarHBondContact CA-OD2 3.46Å; A105-D108 PolarHBondContact O-N 2.71Å; A105-D108 VanDerWaalsContact O-N 3.12Å
106	A	77.3	Confident	82.9	Confident	99 Å²	99	102.8 Å²	102.8	82%	0.818	53%	0.525	S	S	*	.	G	3₁₀ helix	trans	-63.9	-19.8	-172.6	0	0	0	0	0	114.6	S104	S104-A106 PolarHBondContact O-N 3.41Å
107	K	78	Confident	83.3	Confident	186 Å²	186	106.3 Å²	106.3	81%	0.809	54%	0.535	S	S	*	.	G	3₁₀ helix	trans	-110.9	4.5	179.6	-60.1	-177.7	-178.7	176.2	0	112.8	A105 K109	A105-K107 PolarHBondContact O-N 3.21Å; A105-K107 VanDerWaalsContact O-N 3.11Å; K107-K109 PolarHBondContact O-N 3.12Å
108	D	83.6	Confident	83.6	Confident	74 Å²	74	101.1 Å²	101.1	40%	0.396	51%	0.512	S	S	.	.			trans	-74.8	112.1	-178.9	-67.2	-14.4	0	0	0	108.2	R103 A105	R103-D108 IonicContact CZ-OD1 2.8Å; R103-D108 IonicContact CZ-OD2 3.4Å; R103-D108 IonicContact NE-OD1 3.37Å; R103-D108 IonicContact NE-OD2 3.78Å; R103-D108 IonicContact NH2-OD1 2.63Å; R103-D108 PolarHBondContact NH2-OD1 3.12Å; R103-D108 IonicContact NH2-OD2 3.73Å; A105-D108 WeakPolarHBondContact CA-OD2 3.46Å; A105-D108 PolarHBondContact O-N 2.71Å; A105-D108 VanDerWaalsContact O-N 3.12Å
109	K	84.9	Confident	84.1	Confident	111 Å²	111	99.7 Å²	99.7	48%	0.483	50%	0.503	S	S	.	.			trans	-86.8	129.5	172.4	-64.2	-171.5	177	-166.4	0	108.6	K107 V114 E117 E134	K107-K109 PolarHBondContact O-N 3.12Å; K109-V114 HydrophobicContact CB-CG2 4.07Å; K109-V114 HydrophobicContact CD-CG2 4.35Å; K109-E117 IonicContact NZ-OE1 3.57Å; K109-E117 IonicContact NZ-OE2 3.5Å; K109-E117 PolarHBondContact NZ-OE2 2.8Å; K109-E134 IonicContact NZ-OE1 2.96Å
110	T	89.1	Confident	84.5	Confident	74 Å²	74	99.6 Å²	99.6	45%	0.454	49%	0.492	S	S	.	.			trans	-81.8	156.5	169.2	69.8	0	0	0	0	110.1	L112 D113 V114	T110-L112 PolarHBondContact O-N 3.01Å; T110-L112 VanDerWaalsContact O-N 3.15Å; T110-D113 WeakPolarHBondContact CB-OD2 3.04Å; T110-D113 PolarHBondContact N-OD2 3.01Å; T110-D113 WeakPolarHBondContact O-CA 3.45Å; T110-D113 WeakPolarHBondContact O-CB 3.14Å; T110-D113 PolarHBondContact O-N 3.15Å; T110-D113 PolarHBondContact OG1-N 3.33Å; T110-D113 PolarHBondContact OG1-OD2 3.36Å; T110-V114 PolarHBondContact O-N 3.46Å
111	D	87.9	Confident	84.8	Confident	94 Å²	94	96.1 Å²	96.1	50%	0.503	47%	0.472	S	S	.	.	H	α-helix	trans	-52.9	-37.8	174.1	-65.2	8	0	0	0	111.5	D113 V114 L115 I137	D111-D113 VanDerWaalsContact C-N 3.33Å; D111-D113 PolarHBondContact O-N 2.89Å; D111-V114 PolarHBondContact O-N 3.17Å; D111-L115 WeakPolarHBondContact O-CD1 3.44Å; D111-L115 PolarHBondContact O-N 3.33Å; D111-I137 HydrophobicContact CB-CD1 4.22Å
112	L	88.9	Confident	85.2	Confident	129 Å²	129	94 Å²	94	68%	0.675	46%	0.464	S	S	*	.	H	α-helix	trans	-64	-35.6	176.5	-74.2	175.8	0	0	0	113	T110 R116	T110-L112 PolarHBondContact O-N 3.01Å; T110-L112 VanDerWaalsContact O-N 3.15Å; L112-R116 WeakPolarHBondContact O-CB 3.49Å; L112-R116 PolarHBondContact O-N 3.39Å
113	D	90.4	Very high	85.5	Confident	55 Å²	55	85.8 Å²	85.8	29%	0.294	43%	0.434	S	S	.	.	H	α-helix	trans	-70.9	-43.3	176.4	-60	-45.2	0	0	0	110.4	T110 D111 L115 R116 E117	T110-D113 WeakPolarHBondContact CB-OD2 3.04Å; T110-D113 PolarHBondContact N-OD2 3.01Å; T110-D113 WeakPolarHBondContact O-CA 3.45Å; T110-D113 WeakPolarHBondContact O-CB 3.14Å; T110-D113 PolarHBondContact O-N 3.15Å; T110-D113 PolarHBondContact OG1-N 3.33Å; T110-D113 PolarHBondContact OG1-OD2 3.36Å; D111-D113 VanDerWaalsContact C-N 3.33Å; D111-D113 PolarHBondContact O-N 2.89Å; D113-L115 VanDerWaalsContact C-N 3.3Å; D113-L115 PolarHBondContact O-N 2.9Å; D113-R116 PolarHBondContact O-N 3.09Å; D113-E117 WeakPolarHBondContact O-CG 3Å; D113-E117 PolarHBondContact O-N 2.96Å
114	V	89.8	Confident	85.3	Confident	1 Å²	1	81.3 Å²	81.3	1%	0.006	42%	0.417	C	S	.	.	H	α-helix	trans	-58.1	-44.1	174.5	176.5	0	0	0	0	111	K109 T110 D111 E117 N118 W133 E134 I137	K109-V114 HydrophobicContact CB-CG2 4.07Å; K109-V114 HydrophobicContact CD-CG2 4.35Å; T110-V114 PolarHBondContact O-N 3.46Å; D111-V114 PolarHBondContact O-N 3.17Å; V114-E117 PolarHBondContact O-N 3.37Å; V114-N118 WeakPolarHBondContact O-CB 3.28Å; V114-N118 PolarHBondContact O-N 2.76Å; V114-N118 PolarHBondContact O-ND2 3.22Å; V114-W133 HydrophobicContact CG1-CH2 4.23Å; V114-W133 HydrophobicContact CG1-CZ2 4.49Å; V114-W133 HydrophobicContact CG2-CH2 4.08Å; V114-W133 HydrophobicContact CG2-CZ2 4.29Å; V114-E134 HydrophobicContact CG1-CB 3.47Å; V114-E134 VanDerWaalsContact CG1-CB 3.47Å; V114-E134 HydrophobicContact CG1-CG 3.58Å; V114-I137 HydrophobicContact CG1-CG2 3.98Å
115	L	90.3	Very high	85.1	Confident	32 Å²	32	83.5 Å²	83.5	17%	0.168	42%	0.422	C	S	.	.	H	α-helix	trans	-61	-44.4	172.9	-94.7	97.5	0	0	0	111.7	D111 D113 E117 N118 H119 I137 Y141	D111-L115 WeakPolarHBondContact O-CD1 3.44Å; D111-L115 PolarHBondContact O-N 3.33Å; D113-L115 VanDerWaalsContact C-N 3.3Å; D113-L115 PolarHBondContact O-N 2.9Å; L115-E117 VanDerWaalsContact C-N 3.27Å; L115-E117 PolarHBondContact O-N 2.63Å; L115-N118 PolarHBondContact O-N 3.02Å; L115-H119 WeakPolarHBondContact O-CA 3.43Å; L115-H119 WeakPolarHBondContact O-CB 3.26Å; L115-H119 PolarHBondContact O-N 2.98Å; L115-H119 PolarHBondContact O-ND1 3.47Å; L115-I137 HydrophobicContact CD1-CD1 4.09Å; L115-I137 HydrophobicContact CD1-CG1 4.03Å; L115-Y141 HydrophobicContact CD1-CD2 3.9Å; L115-Y141 HydrophobicContact CD1-CE2 3.82Å; L115-Y141 HydrophobicContact CD2-CD1 4.24Å; L115-Y141 HydrophobicContact CD2-CD2 3.64Å; L115-Y141 HydrophobicContact CD2-CE2 4.18Å; L115-Y141 HydrophobicContact CD2-CG 3.67Å; L115-Y141 HydrophobicContact CG-CD2 4.21Å
116	R	88.8	Confident	84.6	Confident	178 Å²	178	86.2 Å²	86.2	67%	0.672	42%	0.422	S	S	*	.	H	α-helix	trans	-65.8	-31.1	-179.9	-169	-177.4	-64.3	160.9	4.7	112.3	L112 D113 H119	L112-R116 WeakPolarHBondContact O-CB 3.49Å; L112-R116 PolarHBondContact O-N 3.39Å; D113-R116 PolarHBondContact O-N 3.09Å; R116-H119 PolarHBondContact O-CE1 2.74Å; R116-H119 PolarHBondContact O-ND1 3.39Å
117	E	89	Confident	84.2	Confident	98 Å²	98	82.4 Å²	82.4	46%	0.458	39%	0.388	S	S	.	.	H	α-helix	trans	-74.7	-42.7	176.6	-71.3	173.9	-173.3	0	0	111.9	K109 D113 V114 L115	K109-E117 IonicContact NZ-OE1 3.57Å; K109-E117 IonicContact NZ-OE2 3.5Å; K109-E117 PolarHBondContact NZ-OE2 2.8Å; D113-E117 WeakPolarHBondContact O-CG 3Å; D113-E117 PolarHBondContact O-N 2.96Å; V114-E117 PolarHBondContact O-N 3.37Å; L115-E117 VanDerWaalsContact C-N 3.27Å; L115-E117 PolarHBondContact O-N 2.63Å
118	N	88.5	Confident	83.7	Confident	27 Å²	27	78 Å²	78	14%	0.144	37%	0.371	C	S	.	.	H	α-helix	trans	-106.1	0.5	-169.4	-68.5	-77.4	0	0	0	114.9	V114 L115 R120 E134 K135 A138	V114-N118 WeakPolarHBondContact O-CB 3.28Å; V114-N118 PolarHBondContact O-N 2.76Å; V114-N118 PolarHBondContact O-ND2 3.22Å; L115-N118 PolarHBondContact O-N 3.02Å; N118-R120 PolarHBondContact O-N 3.34Å; N118-E134 WeakPolarHBondContact ND2-CB 3.4Å; N118-E134 PolarHBondContact ND2-OE2 3.47Å; N118-K135 HydrophobicContact CB-CG 4.44Å; N118-A138 HydrophobicContact CB-CB 4.36Å
119	H	87.1	Confident	82.8	Confident	116 Å²	116	81.2 Å²	81.2	54%	0.537	39%	0.388	S	S	.	.			trans	-61.1	136.1	178.2	69	-66.6	0	0	0	111.1	L115 R116	L115-H119 WeakPolarHBondContact O-CA 3.43Å; L115-H119 WeakPolarHBondContact O-CB 3.26Å; L115-H119 PolarHBondContact O-N 2.98Å; L115-H119 PolarHBondContact O-ND1 3.47Å; R116-H119 PolarHBondContact O-CE1 2.74Å; R116-H119 PolarHBondContact O-ND1 3.39Å
120	R	86.9	Confident	82.3	Confident	46 Å²	46	81.4 Å²	81.4	17%	0.174	39%	0.394	C	S	.	.			trans	-120.1	144.3	172	-67.8	-176.3	175.8	-133.4	2.4	110.7	N118 D127 E203	N118-R120 PolarHBondContact O-N 3.34Å; R120-D127 IonicContact CZ-OD1 3.35Å; R120-D127 IonicContact CZ-OD2 3.48Å; R120-D127 IonicContact NH1-OD1 3.65Å; R120-D127 PolarHBondContact NH1-OD1 3.36Å; R120-D127 IonicContact NH1-OD2 3.54Å; R120-D127 PolarHBondContact NH1-OD2 3.19Å; R120-D127 IonicContact NH2-OD1 2.71Å; R120-E203 WeakPolarHBondContact CA-OE1 3.4Å; R120-E203 WeakPolarHBondContact CB-OE1 3.48Å
121	F	83.5	Confident	81.7	Confident	48 Å²	48	80.3 Å²	80.3	21%	0.211	38%	0.384	C	S	.	.	S	Bend	trans	-72.3	-38.7	178.8	-176.2	-102.2	0	0	0	111.6	Y142 W166 F199 Y201 E203 A210	F121-Y142 VanDerWaalsContact O-CE2 3.32Å; F121-Y142 WeakPolarHBondContact O-CE2 3.35Å; F121-W166 AromaticContact CD2-NE1 3.9Å; F121-W166 HydrophobicContact CE1-CZ2 4.29Å; F121-W166 AromaticContact CE2-CD1 3.89Å; F121-W166 AromaticContact CE2-CE2 3.88Å; F121-W166 HydrophobicContact CE2-CZ2 4.31Å; F121-W166 AromaticContact CE2-NE1 3.23Å; F121-W166 AromaticContact CZ-CE2 3.76Å; F121-W166 AromaticContact CZ-CZ2 3.73Å; F121-W166 HydrophobicContact CZ-CZ2 3.73Å; F121-W166 AromaticContact CZ-NE1 3.57Å; F121-F199 HydrophobicContact CD1-CD1 4.37Å; F121-F199 HydrophobicContact CD1-CE1 4.19Å; F121-F199 HydrophobicContact CD2-CE1 4.39Å; F121-F199 AromaticContact CE1-CD1 3.61Å; F121-F199 HydrophobicContact CE1-CD1 3.61Å; F121-F199 AromaticContact CE1-CE1 3.69Å; F121-F199 HydrophobicContact CE1-CE1 3.69Å; F121-F199 HydrophobicContact CE2-CD1 4.49Å; F121-F199 AromaticContact CE2-CE1 3.9Å; F121-F199 HydrophobicContact CE2-CE1 3.9Å; F121-F199 AromaticContact CZ-CD1 3.68Å; F121-F199 HydrophobicContact CZ-CD1 3.68Å; F121-F199 AromaticContact CZ-CE1 3.53Å; F121-F199 HydrophobicContact CZ-CE1 3.53Å; F121-Y201 HydrophobicContact CB-CD2 4.07Å; F121-Y201 HydrophobicContact CB-CE2 3.6Å; F121-Y201 HydrophobicContact CD1-CD1 4.01Å; F121-Y201 HydrophobicContact CD1-CD2 4.34Å; F121-Y201 AromaticContact CD1-CE1 3.59Å; F121-Y201 HydrophobicContact CD1-CE1 3.59Å; F121-Y201 AromaticContact CD1-CE2 3.95Å; F121-Y201 HydrophobicContact CD1-CE2 3.95Å; F121-Y201 HydrophobicContact CD1-CG 4.37Å; F121-Y201 AromaticContact CD1-CZ 3.56Å; F121-Y201 HydrophobicContact CE1-CD1 4.38Å; F121-Y201 HydrophobicContact CE1-CE1 4.14Å; F121-Y201 HydrophobicContact CG-CD2 4.35Å; F121-Y201 HydrophobicContact CG-CE1 4.49Å; F121-Y201 HydrophobicContact CG-CE2 4.1Å; F121-E203 PolarHBondContact N-OE1 3.1Å; F121-A210 HydrophobicContact CE1-CB 4.25Å
122	L	85.6	Confident	81.7	Confident	52 Å²	52	78.9 Å²	78.9	27%	0.272	38%	0.379	S	S	.	.	S	Bend	trans	-136.8	129.9	170.4	-69.6	176.3	0	0	0	109.3	Y142 A210	L122-Y142 WeakPolarHBondContact CD2-OH 3.45Å; L122-A210 HydrophobicContact CD1-CB 3.56Å
123	W	85.4	Confident	81.7	Confident	31 Å²	31	79.9 Å²	79.9	12%	0.117	37%	0.374	C	S	.	.			trans	-83.1	129.3	170.1	-68	75	0	0	0	108.9	D127 M131 K135 A138 K139 Y142	W123-D127 HydrophobicContact CE3-CB 4.47Å; W123-M131 HydrophobicContact CE3-SD 4.41Å; W123-M131 HydrophobicContact CZ3-CE 3.98Å; W123-M131 HydrophobicContact CZ3-SD 3.7Å; W123-K135 HydrophobicContact CH2-CB 3.82Å; W123-K135 HydrophobicContact CH2-CG 4.39Å; W123-K135 WeakPolarHBondContact CH2-O 3.28Å; W123-K135 HydrophobicContact CZ3-CB 4.18Å; W123-A138 HydrophobicContact CH2-CB 4.28Å; W123-A138 HydrophobicContact CZ2-CB 3.76Å; W123-K139 HydrophobicContact CD2-CB 4.19Å; W123-K139 HydrophobicContact CD2-CG 4.21Å; W123-K139 HydrophobicContact CE3-CB 4.22Å; W123-K139 HydrophobicContact CE3-CD 4.31Å; W123-K139 HydrophobicContact CE3-CG 4.29Å; W123-K139 HydrophobicContact CH2-CB 3.97Å; W123-K139 HydrophobicContact CZ2-CB 3.91Å; W123-K139 HydrophobicContact CZ3-CB 4.11Å; W123-Y142 HydrophobicContact CB-CE1 4.29Å; W123-Y142 AromaticContact CD1-CD1 3.3Å; W123-Y142 AromaticContact CD1-CD2 3.58Å; W123-Y142 AromaticContact CD1-CE1 3.66Å; W123-Y142 AromaticContact CD1-CE2 3.93Å; W123-Y142 AromaticContact CD1-CG 3.24Å; W123-Y142 AromaticContact CD1-CZ 3.95Å; W123-Y142 HydrophobicContact CG-CD1 4.09Å; W123-Y142 HydrophobicContact CG-CE1 4.28Å; W123-Y142 HydrophobicContact CG-CG 4.37Å; W123-Y142 AromaticContact NE1-CD1 3.93Å; W123-Y142 AromaticContact NE1-CD2 3.88Å; W123-Y142 AromaticContact NE1-CG 3.48Å
124	R	79.3	Confident	81.6	Confident	100 Å²	100	79.3 Å²	79.3	38%	0.377	37%	0.37	S	S	.	.			trans	-108.9	158.6	173.3	-68.2	-170.7	-75.5	143.5	0.7	109.5	E126 D127 R208	R124-E126 IonicContact CZ-OE2 2.76Å; R124-E126 IonicContact NH1-OE1 2.8Å; R124-E126 IonicContact NH1-OE2 2.63Å; R124-E126 PolarHBondContact NH1-OE2 3.07Å; R124-E126 IonicContact NH2-OE2 3.8Å; R124-E126 PolarHBondContact O-N 2.91Å; R124-D127 WeakPolarHBondContact O-CB 3.47Å; R124-D127 PolarHBondContact O-N 2.81Å; R124-R208 VanDerWaalsContact NH2-NH2 3.14Å
125	D	73.6	Confident	81.6	Confident	134 Å²	134	80.9 Å²	80.9	72%	0.717	38%	0.377	S	S	*	.	G	3₁₀ helix	trans	-58.5	-34.6	-179.5	-52	-23	0	0	0	111.9	D127 E128	D125-D127 PolarHBondContact O-N 3.31Å; D125-D127 VanDerWaalsContact O-N 3.16Å; D125-E128 WeakPolarHBondContact O-CB 3.09Å; D125-E128 PolarHBondContact O-N 3.45Å
126	E	69	Low	81.6	Confident	125 Å²	125	83.4 Å²	83.4	58%	0.584	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-58.3	-26.4	174.2	-65.8	165.5	-173	0	0	113.7	R124 E128	R124-E126 IonicContact CZ-OE2 2.76Å; R124-E126 IonicContact NH1-OE1 2.8Å; R124-E126 IonicContact NH1-OE2 2.63Å; R124-E126 PolarHBondContact NH1-OE2 3.07Å; R124-E126 IonicContact NH2-OE2 3.8Å; R124-E126 PolarHBondContact O-N 2.91Å; E126-E128 VanDerWaalsContact C-N 3.32Å
127	D	68.4	Low	81.7	Confident	20 Å²	20	76.2 Å²	76.2	11%	0.107	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-85.8	-7.6	-178.8	-65.2	-45.9	0	0	0	112.4	R120 W123 R124 D125 D129 M131	R120-D127 IonicContact CZ-OD1 3.35Å; R120-D127 IonicContact CZ-OD2 3.48Å; R120-D127 IonicContact NH1-OD1 3.65Å; R120-D127 PolarHBondContact NH1-OD1 3.36Å; R120-D127 IonicContact NH1-OD2 3.54Å; R120-D127 PolarHBondContact NH1-OD2 3.19Å; R120-D127 IonicContact NH2-OD1 2.71Å; W123-D127 HydrophobicContact CE3-CB 4.47Å; R124-D127 WeakPolarHBondContact O-CB 3.47Å; R124-D127 PolarHBondContact O-N 2.81Å; D125-D127 PolarHBondContact O-N 3.31Å; D125-D127 VanDerWaalsContact O-N 3.16Å; D127-D129 VanDerWaalsContact C-N 3.34Å; D127-M131 VanDerWaalsContact O-SD 3.35Å
128	E	67.8	Low	81.7	Confident	93 Å²	93	71.8 Å²	71.8	44%	0.435	34%	0.342	S	S	.	.	S	Bend	trans	-78.1	-19.5	177.4	-59.4	-165.8	155.4	0	0	112.9	D125 E126 M131 K139	D125-E128 WeakPolarHBondContact O-CB 3.09Å; D125-E128 PolarHBondContact O-N 3.45Å; E126-E128 VanDerWaalsContact C-N 3.32Å; E128-M131 WeakPolarHBondContact O-CG 3.33Å; E128-K139 VanDerWaalsContact CD-NZ 3.32Å; E128-K139 IonicContact OE1-NZ 3.92Å; E128-K139 PolarHBondContact OE1-NZ 2.97Å
129	D	65.4	Low	81.8	Confident	141 Å²	141	72.8 Å²	72.8	75%	0.754	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-25.9	-178.5	-63.8	-35.7	0	0	0	112.5	D127	D127-D129 VanDerWaalsContact C-N 3.34Å
130	D	73.8	Confident	82	Confident	116 Å²	116	73.1 Å²	73.1	62%	0.62	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.3	43.1	-177.7	-72.5	-30	0	0	0	112.7	T132 K135	D130-T132 PolarHBondContact O-N 2.95Å; D130-T132 VanDerWaalsContact O-N 3.13Å; D130-K135 VanDerWaalsContact O-CD 3.26Å; D130-K135 WeakPolarHBondContact O-CD 3.41Å; D130-K135 PolarHBondContact O-NZ 3.1Å
131	M	77.1	Confident	82.1	Confident	50 Å²	50	76 Å²	76	25%	0.246	36%	0.357	C	S	.	.			trans	-77.4	100.4	-175	-67.2	-65.9	-75	0	0	112.1	W123 D127 E128 K135 E136 K139	W123-M131 HydrophobicContact CE3-SD 4.41Å; W123-M131 HydrophobicContact CZ3-CE 3.98Å; W123-M131 HydrophobicContact CZ3-SD 3.7Å; D127-M131 VanDerWaalsContact O-SD 3.35Å; E128-M131 WeakPolarHBondContact O-CG 3.33Å; M131-K135 HydrophobicContact CE-CB 4.37Å; M131-K135 HydrophobicContact SD-CB 4.1Å; M131-E136 HydrophobicContact CB-CG 4.28Å; M131-E136 HydrophobicContact CE-CB 4.35Å; M131-E136 HydrophobicContact CE-CG 3.83Å; M131-K139 HydrophobicContact CE-CB 4Å; M131-K139 HydrophobicContact CE-CD 3.53Å; M131-K139 HydrophobicContact CE-CG 4.4Å
132	T	86.8	Confident	82.4	Confident	65 Å²	65	75.4 Å²	75.4	40%	0.399	35%	0.353	S	S	.	.			trans	-79.8	158.1	162.5	54.2	0	0	0	0	110.2	D130 E134 K135 E136	D130-T132 PolarHBondContact O-N 2.95Å; D130-T132 VanDerWaalsContact O-N 3.13Å; T132-E134 PolarHBondContact O-N 3.28Å; T132-K135 WeakPolarHBondContact O-CA 3.43Å; T132-K135 WeakPolarHBondContact O-CB 3.38Å; T132-K135 PolarHBondContact O-N 3.02Å; T132-K135 WeakPolarHBondContact OG1-CG 3.39Å; T132-E136 PolarHBondContact O-N 3.24Å
133	W	89.4	Confident	82.6	Confident	149 Å²	149	77.6 Å²	77.6	56%	0.564	37%	0.365	S	S	*	.	H	α-helix	trans	-52.2	-34.8	176.4	85	-91	0	0	0	112.5	V114 E136 I137	V114-W133 HydrophobicContact CG1-CH2 4.23Å; V114-W133 HydrophobicContact CG1-CZ2 4.49Å; V114-W133 HydrophobicContact CG2-CH2 4.08Å; V114-W133 HydrophobicContact CG2-CZ2 4.29Å; W133-E136 PolarHBondContact O-N 3.22Å; W133-I137 HydrophobicContact CZ3-CG2 4.34Å; W133-I137 PolarHBondContact O-N 3.17Å
134	E	89.1	Confident	82.8	Confident	44 Å²	44	83 Å²	83	21%	0.206	39%	0.39	C	S	.	.	H	α-helix	trans	-66.5	-36.9	177	-61.2	-173.7	167.5	0	0	113.2	K109 V114 N118 T132 I137 A138	K109-E134 IonicContact NZ-OE1 2.96Å; V114-E134 HydrophobicContact CG1-CB 3.47Å; V114-E134 VanDerWaalsContact CG1-CB 3.47Å; V114-E134 HydrophobicContact CG1-CG 3.58Å; N118-E134 WeakPolarHBondContact ND2-CB 3.4Å; N118-E134 PolarHBondContact ND2-OE2 3.47Å; T132-E134 PolarHBondContact O-N 3.28Å; E134-I137 WeakPolarHBondContact O-CG2 3.32Å; E134-A138 PolarHBondContact O-N 3.01Å
135	K	88.7	Confident	83.3	Confident	34 Å²	34	81.7 Å²	81.7	15%	0.148	39%	0.39	C	S	.	.	H	α-helix	trans	-75	-38.1	173.7	-72	178.5	-169.9	174.7	0	110.7	N118 W123 D130 M131 T132 I137 A138 K139	N118-K135 HydrophobicContact CB-CG 4.44Å; W123-K135 HydrophobicContact CH2-CB 3.82Å; W123-K135 HydrophobicContact CH2-CG 4.39Å; W123-K135 WeakPolarHBondContact CH2-O 3.28Å; W123-K135 HydrophobicContact CZ3-CB 4.18Å; D130-K135 VanDerWaalsContact O-CD 3.26Å; D130-K135 WeakPolarHBondContact O-CD 3.41Å; D130-K135 PolarHBondContact O-NZ 3.1Å; M131-K135 HydrophobicContact CE-CB 4.37Å; M131-K135 HydrophobicContact SD-CB 4.1Å; T132-K135 WeakPolarHBondContact O-CA 3.43Å; T132-K135 WeakPolarHBondContact O-CB 3.38Å; T132-K135 PolarHBondContact O-N 3.02Å; T132-K135 WeakPolarHBondContact OG1-CG 3.39Å; K135-I137 PolarHBondContact O-N 3.48Å; K135-A138 PolarHBondContact O-N 2.79Å; K135-K139 WeakPolarHBondContact O-CB 3.01Å; K135-K139 PolarHBondContact O-N 3.06Å
136	E	89.6	Confident	83.9	Confident	85 Å²	85	81.5 Å²	81.5	40%	0.397	38%	0.383	S	S	.	.	H	α-helix	trans	-60.3	-43.6	175.8	-72.5	-177.2	-170.2	0	0	112.6	M131 T132 W133 A138 K139 K140	M131-E136 HydrophobicContact CB-CG 4.28Å; M131-E136 HydrophobicContact CE-CB 4.35Å; M131-E136 HydrophobicContact CE-CG 3.83Å; T132-E136 PolarHBondContact O-N 3.24Å; W133-E136 PolarHBondContact O-N 3.22Å; E136-A138 VanDerWaalsContact C-N 3.34Å; E136-K139 PolarHBondContact O-N 3.16Å; E136-K140 VanDerWaalsContact O-CG 3.3Å; E136-K140 WeakPolarHBondContact O-CG 3.27Å; E136-K140 PolarHBondContact O-N 3.45Å
137	I	90.9	Very high	84.9	Confident	26 Å²	26	78.3 Å²	78.3	13%	0.133	37%	0.367	C	S	.	.	H	α-helix	trans	-61.6	-45.8	175.2	-171.4	170	0	0	0	110	D111 V114 L115 W133 E134 K135 K139 K140 Y141	D111-I137 HydrophobicContact CB-CD1 4.22Å; V114-I137 HydrophobicContact CG1-CG2 3.98Å; L115-I137 HydrophobicContact CD1-CD1 4.09Å; L115-I137 HydrophobicContact CD1-CG1 4.03Å; W133-I137 HydrophobicContact CZ3-CG2 4.34Å; W133-I137 PolarHBondContact O-N 3.17Å; E134-I137 WeakPolarHBondContact O-CG2 3.32Å; K135-I137 PolarHBondContact O-N 3.48Å; I137-K139 VanDerWaalsContact C-N 3.33Å; I137-K139 PolarHBondContact O-N 2.95Å; I137-K140 WeakPolarHBondContact O-CB 3.32Å; I137-K140 PolarHBondContact O-N 2.91Å; I137-Y141 HydrophobicContact CD1-CE2 4.29Å; I137-Y141 HydrophobicContact CG1-CD2 4.01Å; I137-Y141 HydrophobicContact CG1-CE2 3.81Å; I137-Y141 VanDerWaalsContact O-CD2 3.27Å; I137-Y141 WeakPolarHBondContact O-CD2 3.46Å; I137-Y141 PolarHBondContact O-N 2.88Å; I137-Y141 VanDerWaalsContact O-N 3.1Å
138	A	90.8	Very high	85.9	Confident	6 Å²	6	83 Å²	83	5%	0.05	39%	0.389	C	S	.	.	H	α-helix	trans	-60.2	-40.1	176.8	0	0	0	0	0	112.6	N118 W123 E134 K135 E136 Y141 Y142	N118-A138 HydrophobicContact CB-CB 4.36Å; W123-A138 HydrophobicContact CH2-CB 4.28Å; W123-A138 HydrophobicContact CZ2-CB 3.76Å; E134-A138 PolarHBondContact O-N 3.01Å; K135-A138 PolarHBondContact O-N 2.79Å; E136-A138 VanDerWaalsContact C-N 3.34Å; A138-Y141 PolarHBondContact O-N 3.13Å; A138-Y142 WeakPolarHBondContact O-CB 3.48Å; A138-Y142 PolarHBondContact O-N 2.93Å
139	K	90	Very high	87.1	Confident	48 Å²	48	80.8 Å²	80.8	21%	0.209	38%	0.377	C	S	.	.	H	α-helix	trans	-63.5	-46.7	175.2	-172.5	177.3	-177.6	177.5	0	111.7	W123 E128 M131 K135 E136 I137 Y141 Y142 D143	W123-K139 HydrophobicContact CD2-CB 4.19Å; W123-K139 HydrophobicContact CD2-CG 4.21Å; W123-K139 HydrophobicContact CE3-CB 4.22Å; W123-K139 HydrophobicContact CE3-CD 4.31Å; W123-K139 HydrophobicContact CE3-CG 4.29Å; W123-K139 HydrophobicContact CH2-CB 3.97Å; W123-K139 HydrophobicContact CZ2-CB 3.91Å; W123-K139 HydrophobicContact CZ3-CB 4.11Å; E128-K139 VanDerWaalsContact CD-NZ 3.32Å; E128-K139 IonicContact OE1-NZ 3.92Å; E128-K139 PolarHBondContact OE1-NZ 2.97Å; M131-K139 HydrophobicContact CE-CB 4Å; M131-K139 HydrophobicContact CE-CD 3.53Å; M131-K139 HydrophobicContact CE-CG 4.4Å; K135-K139 WeakPolarHBondContact O-CB 3.01Å; K135-K139 PolarHBondContact O-N 3.06Å; E136-K139 PolarHBondContact O-N 3.16Å; I137-K139 VanDerWaalsContact C-N 3.33Å; I137-K139 PolarHBondContact O-N 2.95Å; K139-Y141 PolarHBondContact O-N 3.36Å; K139-Y142 WeakPolarHBondContact O-CA 3.39Å; K139-Y142 WeakPolarHBondContact O-CB 3.47Å; K139-Y142 PolarHBondContact O-N 3.44Å; K139-D143 PolarHBondContact O-N 3.24Å
140	K	90.9	Very high	88.4	Confident	123 Å²	123	74.2 Å²	74.2	54%	0.535	34%	0.341	S	S	.	.	H	α-helix	trans	-56	-38.3	175.5	-73.5	170.2	-175.1	170.2	0	112.3	E136 I137 K144	E136-K140 VanDerWaalsContact O-CG 3.3Å; E136-K140 WeakPolarHBondContact O-CG 3.27Å; E136-K140 PolarHBondContact O-N 3.45Å; I137-K140 WeakPolarHBondContact O-CB 3.32Å; I137-K140 PolarHBondContact O-N 2.91Å; K140-K144 WeakPolarHBondContact O-CG 3.26Å
141	Y	88.9	Confident	89.4	Confident	105 Å²	105	68.8 Å²	68.8	41%	0.412	31%	0.312	S	S	.	.	H	α-helix	trans	-72.8	-42.1	174	-82.5	-86.7	0	0	0	112.1	L115 I137 A138 K139 D143 K144 L145	L115-Y141 HydrophobicContact CD1-CD2 3.9Å; L115-Y141 HydrophobicContact CD1-CE2 3.82Å; L115-Y141 HydrophobicContact CD2-CD1 4.24Å; L115-Y141 HydrophobicContact CD2-CD2 3.64Å; L115-Y141 HydrophobicContact CD2-CE2 4.18Å; L115-Y141 HydrophobicContact CD2-CG 3.67Å; L115-Y141 HydrophobicContact CG-CD2 4.21Å; I137-Y141 HydrophobicContact CD1-CE2 4.29Å; I137-Y141 HydrophobicContact CG1-CD2 4.01Å; I137-Y141 HydrophobicContact CG1-CE2 3.81Å; I137-Y141 VanDerWaalsContact O-CD2 3.27Å; I137-Y141 WeakPolarHBondContact O-CD2 3.46Å; I137-Y141 PolarHBondContact O-N 2.88Å; I137-Y141 VanDerWaalsContact O-N 3.1Å; A138-Y141 PolarHBondContact O-N 3.13Å; K139-Y141 PolarHBondContact O-N 3.36Å; Y141-D143 VanDerWaalsContact C-N 3.29Å; Y141-D143 PolarHBondContact O-N 2.92Å; Y141-K144 WeakPolarHBondContact O-CB 3.44Å; Y141-K144 PolarHBondContact O-N 3.02Å; Y141-L145 WeakPolarHBondContact O-CD1 3.42Å; Y141-L145 PolarHBondContact O-N 2.63Å
142	Y	89.8	Confident	90.2	Very high	36 Å²	36	66.4 Å²	66.4	14%	0.141	30%	0.301	C	S	.	.	H	α-helix	trans	-57.2	-40.6	176.1	174.3	-95.6	0	0	0	112.7	F121 L122 W123 A138 K139 K144 L145 K147	F121-Y142 VanDerWaalsContact O-CE2 3.32Å; F121-Y142 WeakPolarHBondContact O-CE2 3.35Å; L122-Y142 WeakPolarHBondContact CD2-OH 3.45Å; W123-Y142 HydrophobicContact CB-CE1 4.29Å; W123-Y142 AromaticContact CD1-CD1 3.3Å; W123-Y142 AromaticContact CD1-CD2 3.58Å; W123-Y142 AromaticContact CD1-CE1 3.66Å; W123-Y142 AromaticContact CD1-CE2 3.93Å; W123-Y142 AromaticContact CD1-CG 3.24Å; W123-Y142 AromaticContact CD1-CZ 3.95Å; W123-Y142 HydrophobicContact CG-CD1 4.09Å; W123-Y142 HydrophobicContact CG-CE1 4.28Å; W123-Y142 HydrophobicContact CG-CG 4.37Å; W123-Y142 AromaticContact NE1-CD1 3.93Å; W123-Y142 AromaticContact NE1-CD2 3.88Å; W123-Y142 AromaticContact NE1-CG 3.48Å; A138-Y142 WeakPolarHBondContact O-CB 3.48Å; A138-Y142 PolarHBondContact O-N 2.93Å; K139-Y142 WeakPolarHBondContact O-CA 3.39Å; K139-Y142 WeakPolarHBondContact O-CB 3.47Å; K139-Y142 PolarHBondContact O-N 3.44Å; Y142-K144 VanDerWaalsContact C-N 3.28Å; Y142-K144 PolarHBondContact O-N 2.86Å; Y142-L145 WeakPolarHBondContact O-CB 3.47Å; Y142-L145 PolarHBondContact O-N 2.82Å; Y142-L145 VanDerWaalsContact O-N 3.09Å; Y142-K147 HydrophobicContact CD2-CD 4.18Å; Y142-K147 HydrophobicContact CE1-CD 4.07Å; Y142-K147 HydrophobicContact CE2-CD 3.46Å; Y142-K147 VanDerWaalsContact CE2-CD 3.46Å; Y142-K147 VanDerWaalsContact CZ-CD 3.41Å; Y142-K147 VanDerWaalsContact CZ-CE 3.44Å; Y142-K147 PolarHBondContact O-NZ 3.45Å; Y142-K147 WeakPolarHBondContact OH-CD 3.43Å
143	D	89.7	Confident	90.5	Very high	98 Å²	98	65.7 Å²	65.7	52%	0.524	30%	0.295	S	S	.	.	H	α-helix	trans	-67	-30.6	179.9	-67.7	-25	0	0	0	112.5	K139 Y141 L145	K139-D143 PolarHBondContact O-N 3.24Å; Y141-D143 VanDerWaalsContact C-N 3.29Å; Y141-D143 PolarHBondContact O-N 2.92Å; D143-L145 VanDerWaalsContact C-N 3.25Å; D143-L145 PolarHBondContact O-N 3.45Å
144	K	90.1	Very high	90.6	Very high	144 Å²	144	58.7 Å²	58.7	63%	0.626	27%	0.268	S	S	*	.	H	α-helix	trans	-69.6	-19.5	173.6	-65.5	169.9	-173.3	179.3	0	113.2	K140 Y141 Y142	K140-K144 WeakPolarHBondContact O-CG 3.26Å; Y141-K144 WeakPolarHBondContact O-CB 3.44Å; Y141-K144 PolarHBondContact O-N 3.02Å; Y142-K144 VanDerWaalsContact C-N 3.28Å; Y142-K144 PolarHBondContact O-N 2.86Å
145	L	88.8	Confident	90.7	Very high	73 Å²	73	59.9 Å²	59.9	38%	0.382	28%	0.282	S	S	.	.	S	Bend	trans	-74.3	133.2	179.5	-88.4	72.8	0	0	0	111.6	Y141 Y142 D143 K147 W166	Y141-L145 WeakPolarHBondContact O-CD1 3.42Å; Y141-L145 PolarHBondContact O-N 2.63Å; Y142-L145 WeakPolarHBondContact O-CB 3.47Å; Y142-L145 PolarHBondContact O-N 2.82Å; Y142-L145 VanDerWaalsContact O-N 3.09Å; D143-L145 VanDerWaalsContact C-N 3.25Å; D143-L145 PolarHBondContact O-N 3.45Å; L145-K147 HydrophobicContact CB-CG 4.12Å; L145-K147 PolarHBondContact O-N 2.93Å; L145-K147 PolarHBondContact O-NZ 3.5Å; L145-W166 HydrophobicContact CD2-CB 4.39Å
146	F	87.9	Confident	90.7	Very high	131 Å²	131	66 Å²	66	58%	0.575	30%	0.304	S	S	*	.			trans	-79.7	103.7	169.3	-69.3	-83.1	0	0	0	111.3	V172	F146-V172 HydrophobicContact CB-CG2 4.13Å; F146-V172 HydrophobicContact CD2-CG1 4.18Å; F146-V172 HydrophobicContact CD2-CG2 4.36Å; F146-V172 HydrophobicContact CG-CG1 4.25Å; F146-V172 HydrophobicContact CG-CG2 4.48Å
147	K	89.1	Confident	90.7	Very high	57 Å²	57	64.3 Å²	64.3	25%	0.248	29%	0.294	C	S	.	.			trans	-104.1	12.6	-169.7	-62.7	171.7	-68.1	-78.1	0	114.9	Y142 L145 W166	Y142-K147 HydrophobicContact CD2-CD 4.18Å; Y142-K147 HydrophobicContact CE1-CD 4.07Å; Y142-K147 HydrophobicContact CE2-CD 3.46Å; Y142-K147 VanDerWaalsContact CE2-CD 3.46Å; Y142-K147 VanDerWaalsContact CZ-CD 3.41Å; Y142-K147 VanDerWaalsContact CZ-CE 3.44Å; Y142-K147 PolarHBondContact O-NZ 3.45Å; Y142-K147 WeakPolarHBondContact OH-CD 3.43Å; L145-K147 HydrophobicContact CB-CG 4.12Å; L145-K147 PolarHBondContact O-N 2.93Å; L145-K147 PolarHBondContact O-NZ 3.5Å; K147-W166 HydrophobicContact CB-CD2 4.44Å; K147-W166 HydrophobicContact CB-CE3 4.26Å; K147-W166 HydrophobicContact CB-CH2 4.02Å; K147-W166 HydrophobicContact CB-CZ2 4.18Å; K147-W166 HydrophobicContact CB-CZ3 4.07Å; K147-W166 HydrophobicContact CG-CD2 4.25Å; K147-W166 HydrophobicContact CG-CZ2 4.35Å; K147-W166 VanDerWaalsContact O-CH2 3.28Å; K147-W166 WeakPolarHBondContact O-CH2 3.07Å; K147-W166 WeakPolarHBondContact O-CZ3 3.27Å
148	E	89.9	Confident	90.6	Very high	119 Å²	119	69.8 Å²	69.8	56%	0.556	32%	0.317	S	S	*	.	S	Bend	trans	-70.5	-44.7	-176.4	-63.5	-173.5	158.8	0	0	113.5	K213	E148-K213 WeakPolarHBondContact O-CB 3.27Å
149	Y	92.3	Very high	90.6	Very high	47 Å²	47	74.6 Å²	74.6	18%	0.184	34%	0.338	C	S	.	.	S	Bend	trans	-128.4	136.9	-177.9	-61.1	-78.5	0	0	0	109.5	R167 Q178 K213 R215	Y149-R167 WeakPolarHBondContact O-CG 3.33Å; Y149-R167 PolarHBondContact O-NE 3.15Å; Y149-Q178 HydrophobicContact CD2-CB 4.1Å; Y149-Q178 HydrophobicContact CD2-CG 4.27Å; Y149-Q178 HydrophobicContact CE2-CB 4.24Å; Y149-Q178 HydrophobicContact CE2-CG 3.91Å; Y149-K213 HydrophobicContact CD1-CB 4.28Å; Y149-R215 HydrophobicContact CD1-CG 3.79Å; Y149-R215 HydrophobicContact CE1-CG 3.58Å
150	C	92.7	Very high	90.4	Very high	2 Å²	2	76 Å²	76	1%	0.014	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	162.2	174.8	63.4	0	0	0	0	111.7	R165 W166 K213 L214	C150-R165 WeakPolarHBondContact CB-O 3.44Å; C150-W166 HydrophobicContact CB-CE3 4.03Å; C150-W166 HydrophobicContact CB-CZ3 4.01Å; C150-K213 PolarHBondContact N-O 3.14Å; C150-K213 PolarHBondContact SG-O 3.03Å; C150-L214 WeakPolarHBondContact SG-CD1 3.35Å; C150-L214 VanDerWaalsContact SG-CG 3.58Å
151	I	94.4	Very high	90.3	Very high	2 Å²	2	75.9 Å²	75.9	1%	0.01	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	135.5	172.2	-72.8	170.6	0	0	0	108.7	F164 R165 R167 E171 K176 G182 K184	I151-F164 WeakPolarHBondContact O-CA 3.36Å; I151-R165 HydrophobicContact CB-CG 4.34Å; I151-R165 PolarHBondContact N-O 3.32Å; I151-R165 PolarHBondContact O-N 3.2Å; I151-R167 HydrophobicContact CD1-CG 3.86Å; I151-R167 HydrophobicContact CG1-CG 3.92Å; I151-E171 HydrophobicContact CD1-CB 4.31Å; I151-E171 HydrophobicContact CD1-CG 4.24Å; I151-E171 VanDerWaalsContact CD1-OE1 3.22Å; I151-E171 WeakPolarHBondContact CD1-OE1 3.11Å; I151-E171 WeakPolarHBondContact CD1-OE2 3.31Å; I151-K176 HydrophobicContact CD1-CD 4.32Å; I151-K176 HydrophobicContact CD1-CG 4.48Å; I151-G182 CarbonylContact C-O 3.56Å; I151-G182 WeakPolarHBondContact CA-O 3.03Å; I151-G182 WeakPolarHBondContact CG2-O 3.48Å; I151-K184 HydrophobicContact CG2-CB 4.34Å
152	A	94.3	Very high	90.4	Very high	1 Å²	1	73.5 Å²	73.5	1%	0.008	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	140.6	176.1	0	0	0	0	0	111.1	L154 G163 F164 G182 N183 K184 L214	A152-L154 HydrophobicContact CB-CD2 3.94Å; A152-L154 HydrophobicContact CB-CG 4.09Å; A152-G163 CarbonylContact C-O 3.44Å; A152-G163 WeakPolarHBondContact CA-O 3.3Å; A152-F164 HydrophobicContact CB-CD1 3.81Å; A152-F164 HydrophobicContact CB-CE1 3.64Å; A152-G182 PolarHBondContact N-O 3.3Å; A152-N183 CarbonylContact O-C 3.55Å; A152-N183 VanDerWaalsContact O-CA 3.28Å; A152-N183 WeakPolarHBondContact O-CA 3.46Å; A152-N183 PolarHBondContact O-OD1 2.9Å; A152-K184 PolarHBondContact O-N 3.33Å; A152-L214 HydrophobicContact CB-CD1 4.08Å; A152-L214 HydrophobicContact CB-CD2 3.6Å; A152-L214 HydrophobicContact CB-CG 4.46Å
153	D	94.3	Very high	90.5	Very high	50 Å²	50	73.5 Å²	73.5	27%	0.267	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	104.8	159	-167	-17.6	0	0	0	108.5	S155 G163	D153-S155 WeakPolarHBondContact OD1-CB 3.09Å; D153-S155 PolarHBondContact OD1-N 3.21Å; D153-S155 PolarHBondContact OD1-OG 2.93Å; D153-G163 PolarHBondContact N-O 2.92Å; D153-G163 PolarHBondContact O-N 3.41Å
154	L	91	Very high	90.6	Very high	2 Å²	2	70.6 Å²	70.6	1%	0.01	33%	0.333	C	S	.	.			trans	-95.3	15	178.8	-55.6	176.3	0	0	0	112	A152 R156 Y157 F162 N183 L216 C220 K223 L224	A152-L154 HydrophobicContact CB-CD2 3.94Å; A152-L154 HydrophobicContact CB-CG 4.09Å; L154-R156 VanDerWaalsContact C-N 3.32Å; L154-R156 PolarHBondContact O-N 2.96Å; L154-Y157 WeakPolarHBondContact O-CB 3.3Å; L154-Y157 WeakPolarHBondContact O-CD1 3.46Å; L154-Y157 PolarHBondContact O-N 3.46Å; L154-F162 HydrophobicContact CD2-CD1 3.45Å; L154-F162 VanDerWaalsContact CD2-CD1 3.45Å; L154-F162 HydrophobicContact CD2-CE1 3.73Å; L154-F162 HydrophobicContact CD2-CG 4.46Å; L154-N183 HydrophobicContact CD1-CB 4.12Å; L154-N183 HydrophobicContact CG-CB 4.49Å; L154-N183 PolarHBondContact N-OD1 3.42Å; L154-L216 HydrophobicContact CD1-CD1 4.06Å; L154-L216 HydrophobicContact CD1-CD2 4.19Å; L154-C220 HydrophobicContact CD1-CB 3.66Å; L154-K223 HydrophobicContact CD1-CB 4.33Å; L154-L224 HydrophobicContact CD2-CD1 4.02Å
155	S	90.2	Very high	90.7	Very high	69 Å²	69	68.1 Å²	68.1	48%	0.483	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-36	-173.9	-56.7	0	0	0	0	112.7	D153 H185	D153-S155 WeakPolarHBondContact OD1-CB 3.09Å; D153-S155 PolarHBondContact OD1-N 3.21Å; D153-S155 PolarHBondContact OD1-OG 2.93Å; S155-H185 PolarHBondContact OG-CD2 3.4Å; S155-H185 VanDerWaalsContact OG-CD2 3.32Å
156	R	89.7	Confident	90.8	Very high	162 Å²	162	66.6 Å²	66.6	61%	0.611	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.7	29.7	179.8	-57.5	-170.3	-166.6	-145.2	6.1	113.5	L154 K158 E159 K161	L154-R156 VanDerWaalsContact C-N 3.32Å; L154-R156 PolarHBondContact O-N 2.96Å; R156-K158 PolarHBondContact O-N 3.01Å; R156-K158 VanDerWaalsContact O-N 3.11Å; R156-E159 PolarHBondContact O-N 2.88Å; R156-K161 CarbonylContact C-O 3.53Å; R156-K161 HydrophobicContact CB-CB 4.21Å; R156-K161 PolarHBondContact O-N 3.28Å
157	Y	88.9	Confident	91.1	Very high	50 Å²	50	61.1 Å²	61.1	20%	0.196	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-58	-27.2	-178.7	73.7	-81.5	0	0	0	114.4	L154 E159 N160 K223 Y226	L154-Y157 WeakPolarHBondContact O-CB 3.3Å; L154-Y157 WeakPolarHBondContact O-CD1 3.46Å; L154-Y157 PolarHBondContact O-N 3.46Å; Y157-E159 VanDerWaalsContact C-N 3.29Å; Y157-E159 PolarHBondContact O-N 2.98Å; Y157-N160 PolarHBondContact O-N 3.25Å; Y157-N160 VanDerWaalsContact O-N 3.15Å; Y157-K223 HydrophobicContact CD1-CB 4.34Å; Y157-K223 HydrophobicContact CD1-CD 4.12Å; Y157-K223 HydrophobicContact CD1-CG 4.18Å; Y157-K223 HydrophobicContact CD2-CB 3.92Å; Y157-K223 HydrophobicContact CD2-CG 4.04Å; Y157-K223 HydrophobicContact CE1-CD 4.04Å; Y157-K223 HydrophobicContact CE1-CG 4.13Å; Y157-K223 HydrophobicContact CE2-CB 4.38Å; Y157-K223 HydrophobicContact CE2-CG 4.01Å; Y157-K223 HydrophobicContact CG-CB 3.88Å; Y157-K223 HydrophobicContact CG-CD 4.5Å; Y157-K223 HydrophobicContact CG-CG 4.11Å; Y157-Y226 AromaticContact CD2-CD1 3.94Å; Y157-Y226 HydrophobicContact CD2-CD1 3.94Å; Y157-Y226 HydrophobicContact CD2-CD2 4.02Å; Y157-Y226 AromaticContact CD2-CG 3.62Å; Y157-Y226 HydrophobicContact CD2-CG 3.62Å; Y157-Y226 HydrophobicContact CE2-CD1 4.17Å; Y157-Y226 AromaticContact CE2-CD2 3.67Å; Y157-Y226 HydrophobicContact CE2-CD2 3.67Å; Y157-Y226 HydrophobicContact CE2-CE1 4.45Å; Y157-Y226 AromaticContact CE2-CE2 3.99Å; Y157-Y226 HydrophobicContact CE2-CE2 3.99Å; Y157-Y226 AromaticContact CE2-CG 3.77Å; Y157-Y226 HydrophobicContact CE2-CG 3.77Å
158	K	89.2	Confident	91.2	Very high	141 Å²	141	61.8 Å²	61.8	61%	0.613	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-66.7	-30.6	176.3	-64.7	-178.6	-178.6	177.8	0	112.8	R156 N160 Y226	R156-K158 PolarHBondContact O-N 3.01Å; R156-K158 VanDerWaalsContact O-N 3.11Å; K158-N160 VanDerWaalsContact C-N 3.26Å; K158-Y226 HydrophobicContact CB-CE1 4.34Å; K158-Y226 HydrophobicContact CG-CE1 4.14Å
159	E	90	Very high	91.3	Very high	107 Å²	107	63.5 Å²	63.5	50%	0.5	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-87.5	5.7	175.7	-64	177.2	-151.9	0	0	112.2	R156 Y157 K161	R156-E159 PolarHBondContact O-N 2.88Å; Y157-E159 VanDerWaalsContact C-N 3.29Å; Y157-E159 PolarHBondContact O-N 2.98Å; E159-K161 HydrophobicContact CB-CD 4.21Å; E159-K161 HydrophobicContact CB-CG 4.23Å; E159-K161 PolarHBondContact O-N 3.18Å; E159-K161 IonicContact OE2-NZ 2.81Å; E159-K161 PolarHBondContact OE2-NZ 3.31Å
160	N	86	Confident	91.4	Very high	77 Å²	77	67.3 Å²	67.3	41%	0.412	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.5	28	-172.3	-159.3	40.2	0	0	0	113.6	Y157 K158 F162	Y157-N160 PolarHBondContact O-N 3.25Å; Y157-N160 VanDerWaalsContact O-N 3.15Å; K158-N160 VanDerWaalsContact C-N 3.26Å; N160-F162 WeakPolarHBondContact OD1-CE2 3.5Å
161	K	89.4	Confident	91.4	Very high	120 Å²	120	68.3 Å²	68.3	52%	0.522	33%	0.33	S	S	.	.			trans	-105.6	122.5	176.7	-67.5	175.6	-169.6	158.7	0	109.2	R156 E159	R156-K161 CarbonylContact C-O 3.53Å; R156-K161 HydrophobicContact CB-CB 4.21Å; R156-K161 PolarHBondContact O-N 3.28Å; E159-K161 HydrophobicContact CB-CD 4.21Å; E159-K161 HydrophobicContact CB-CG 4.23Å; E159-K161 PolarHBondContact O-N 3.18Å; E159-K161 IonicContact OE2-NZ 2.81Å; E159-K161 PolarHBondContact OE2-NZ 3.31Å
162	F	90.6	Very high	91.4	Very high	55 Å²	55	69.9 Å²	69.9	24%	0.241	34%	0.339	C	S	.	.			trans	-124.3	135.8	178.5	-55.9	-69.4	0	0	0	109.1	L154 N160 F164 L224	L154-F162 HydrophobicContact CD2-CD1 3.45Å; L154-F162 VanDerWaalsContact CD2-CD1 3.45Å; L154-F162 HydrophobicContact CD2-CE1 3.73Å; L154-F162 HydrophobicContact CD2-CG 4.46Å; N160-F162 WeakPolarHBondContact OD1-CE2 3.5Å; F162-F164 HydrophobicContact CB-CE2 3.87Å; F162-F164 HydrophobicContact CB-CZ 3.82Å; F162-L224 HydrophobicContact CE1-CD1 4.44Å
163	G	91.6	Very high	91.3	Very high	37 Å²	37	75.6 Å²	75.6	38%	0.381	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	135.1	170.6	0	0	0	0	0	109.5	A152 D153	A152-G163 CarbonylContact C-O 3.44Å; A152-G163 WeakPolarHBondContact CA-O 3.3Å; D153-G163 PolarHBondContact N-O 2.92Å; D153-G163 PolarHBondContact O-N 3.41Å
164	F	92.2	Very high	91.2	Very high	36 Å²	36	76.1 Å²	76.1	16%	0.158	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	146.6	173.2	-59.3	-70.7	0	0	0	109.9	I151 A152 F162 V197 F199 L214	I151-F164 WeakPolarHBondContact O-CA 3.36Å; A152-F164 HydrophobicContact CB-CD1 3.81Å; A152-F164 HydrophobicContact CB-CE1 3.64Å; F162-F164 HydrophobicContact CB-CE2 3.87Å; F162-F164 HydrophobicContact CB-CZ 3.82Å; F164-V197 HydrophobicContact CE2-CG1 4.29Å; F164-V197 HydrophobicContact CZ-CG1 3.93Å; F164-F199 HydrophobicContact CB-CD2 4.17Å; F164-F199 HydrophobicContact CB-CE2 4.13Å; F164-F199 AromaticContact CD2-CD2 3.53Å; F164-F199 HydrophobicContact CD2-CD2 3.53Å; F164-F199 HydrophobicContact CD2-CE2 4.02Å; F164-F199 HydrophobicContact CD2-CG 4.43Å; F164-F199 HydrophobicContact CE2-CD2 4.39Å; F164-F199 HydrophobicContact CG-CD2 4.27Å; F164-L214 HydrophobicContact CD1-CD1 3.49Å; F164-L214 VanDerWaalsContact CD1-CD1 3.49Å; F164-L214 HydrophobicContact CE1-CD1 3.23Å; F164-L214 HydrophobicContact CZ-CD1 4.29Å
165	R	91.6	Very high	91.2	Very high	93 Å²	93	76.3 Å²	76.3	35%	0.351	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	157.1	169.9	64.7	171	-177.2	82.4	-2.4	111.1	C150 I151 E171	C150-R165 WeakPolarHBondContact CB-O 3.44Å; I151-R165 HydrophobicContact CB-CG 4.34Å; I151-R165 PolarHBondContact N-O 3.32Å; I151-R165 PolarHBondContact O-N 3.2Å; R165-E171 IonicContact CZ-OE1 3.71Å; R165-E171 IonicContact CZ-OE2 3.35Å; R165-E171 IonicContact NH1-OE1 3.87Å; R165-E171 IonicContact NH1-OE2 2.73Å; R165-E171 PolarHBondContact NH1-OE2 3.3Å; R165-E171 IonicContact NH2-OE1 3.65Å; R165-E171 PolarHBondContact NH2-OE1 3.32Å; R165-E171 IonicContact NH2-OE2 3.98Å; R165-E171 PolarHBondContact NH2-OE2 3.46Å
166	W	92	Very high	91.3	Very high	40 Å²	40	74.8 Å²	74.8	15%	0.152	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	156.7	167.3	-63.2	124.7	0	0	0	111.3	F121 L145 K147 C150 V212	F121-W166 AromaticContact CD2-NE1 3.9Å; F121-W166 HydrophobicContact CE1-CZ2 4.29Å; F121-W166 AromaticContact CE2-CD1 3.89Å; F121-W166 AromaticContact CE2-CE2 3.88Å; F121-W166 HydrophobicContact CE2-CZ2 4.31Å; F121-W166 AromaticContact CE2-NE1 3.23Å; F121-W166 AromaticContact CZ-CE2 3.76Å; F121-W166 AromaticContact CZ-CZ2 3.73Å; F121-W166 HydrophobicContact CZ-CZ2 3.73Å; F121-W166 AromaticContact CZ-NE1 3.57Å; L145-W166 HydrophobicContact CD2-CB 4.39Å; K147-W166 HydrophobicContact CB-CD2 4.44Å; K147-W166 HydrophobicContact CB-CE3 4.26Å; K147-W166 HydrophobicContact CB-CH2 4.02Å; K147-W166 HydrophobicContact CB-CZ2 4.18Å; K147-W166 HydrophobicContact CB-CZ3 4.07Å; K147-W166 HydrophobicContact CG-CD2 4.25Å; K147-W166 HydrophobicContact CG-CZ2 4.35Å; K147-W166 VanDerWaalsContact O-CH2 3.28Å; K147-W166 WeakPolarHBondContact O-CH2 3.07Å; K147-W166 WeakPolarHBondContact O-CZ3 3.27Å; C150-W166 HydrophobicContact CB-CE3 4.03Å; C150-W166 HydrophobicContact CB-CZ3 4.01Å; W166-V212 HydrophobicContact CH2-CG1 4.13Å
167	R	92.9	Very high	91.3	Very high	16 Å²	16	67.1 Å²	67.1	6%	0.06	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-72	143.2	178.9	-67.5	-176	-70	168.3	1.9	109.9	Y149 I151 E171 V172 K176	Y149-R167 WeakPolarHBondContact O-CG 3.33Å; Y149-R167 PolarHBondContact O-NE 3.15Å; I151-R167 HydrophobicContact CD1-CG 3.86Å; I151-R167 HydrophobicContact CG1-CG 3.92Å; R167-E171 HydrophobicContact CB-CB 4.39Å; R167-V172 HydrophobicContact CB-CG2 3.69Å; R167-K176 WeakPolarHBondContact CD-O 3.26Å; R167-K176 PolarHBondContact NH1-O 3.37Å
168	T	92.8	Very high	91.3	Very high	71 Å²	71	67.3 Å²	67.3	44%	0.436	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-82	159.3	168.2	55.3	0	0	0	0	109.9	N170 E171 V172	T168-N170 VanDerWaalsContact C-N 3.31Å; T168-N170 PolarHBondContact O-N 3.35Å; T168-E171 PolarHBondContact N-OE2 2.87Å; T168-E171 VanDerWaalsContact N-OE2 3.12Å; T168-E171 WeakPolarHBondContact O-CA 3.31Å; T168-E171 WeakPolarHBondContact O-CB 3.16Å; T168-E171 PolarHBondContact O-N 2.77Å; T168-E171 WeakPolarHBondContact OG1-CG 3.3Å; T168-E171 PolarHBondContact OG1-OE2 3.01Å; T168-E171 VanDerWaalsContact OG1-OE2 3.12Å; T168-V172 PolarHBondContact O-N 3.3Å
169	E	92.1	Very high	91.5	Very high	155 Å²	155	67 Å²	67	72%	0.724	34%	0.342	S	S	*	.	H	α-helix	trans	-47.1	-51.3	177.5	-177.4	178	-168	0	0	112.7	E171 V172 V173	E169-E171 PolarHBondContact O-N 3.22Å; E169-E171 VanDerWaalsContact O-N 3.12Å; E169-V172 WeakPolarHBondContact O-CB 3.38Å; E169-V172 PolarHBondContact O-N 3.41Å; E169-V173 WeakPolarHBondContact O-CG2 3.38Å; E169-V173 PolarHBondContact O-N 2.97Å
170	N	93.8	Very high	91.6	Very high	128 Å²	128	64.1 Å²	64.1	68%	0.684	33%	0.328	S	S	*	.	H	α-helix	trans	-56	-33.5	178.3	-64.3	-13	0	0	0	113.6	T168 S174	T168-N170 VanDerWaalsContact C-N 3.31Å; T168-N170 PolarHBondContact O-N 3.35Å; N170-S174 WeakPolarHBondContact O-CB 3.12Å; N170-S174 PolarHBondContact O-N 3.48Å; N170-S174 PolarHBondContact O-OG 2.91Å
171	E	93.4	Very high	92	Very high	22 Å²	22	60.5 Å²	60.5	10%	0.103	31%	0.308	C	S	.	.	H	α-helix	trans	-81.7	-30.1	-179.7	-69	176	139.9	0	0	112.2	I151 R165 R167 T168 E169 S174 G175 K176	I151-E171 HydrophobicContact CD1-CB 4.31Å; I151-E171 HydrophobicContact CD1-CG 4.24Å; I151-E171 VanDerWaalsContact CD1-OE1 3.22Å; I151-E171 WeakPolarHBondContact CD1-OE1 3.11Å; I151-E171 WeakPolarHBondContact CD1-OE2 3.31Å; R165-E171 IonicContact CZ-OE1 3.71Å; R165-E171 IonicContact CZ-OE2 3.35Å; R165-E171 IonicContact NH1-OE1 3.87Å; R165-E171 IonicContact NH1-OE2 2.73Å; R165-E171 PolarHBondContact NH1-OE2 3.3Å; R165-E171 IonicContact NH2-OE1 3.65Å; R165-E171 PolarHBondContact NH2-OE1 3.32Å; R165-E171 IonicContact NH2-OE2 3.98Å; R165-E171 PolarHBondContact NH2-OE2 3.46Å; R167-E171 HydrophobicContact CB-CB 4.39Å; T168-E171 PolarHBondContact N-OE2 2.87Å; T168-E171 VanDerWaalsContact N-OE2 3.12Å; T168-E171 WeakPolarHBondContact O-CA 3.31Å; T168-E171 WeakPolarHBondContact O-CB 3.16Å; T168-E171 PolarHBondContact O-N 2.77Å; T168-E171 WeakPolarHBondContact OG1-CG 3.3Å; T168-E171 PolarHBondContact OG1-OE2 3.01Å; T168-E171 VanDerWaalsContact OG1-OE2 3.12Å; E169-E171 PolarHBondContact O-N 3.22Å; E169-E171 VanDerWaalsContact O-N 3.12Å; E171-S174 PolarHBondContact O-OG 2.98Å; E171-G175 PolarHBondContact O-N 3.47Å; E171-G175 VanDerWaalsContact O-N 3.11Å; E171-K176 HydrophobicContact CB-CB 4.15Å; E171-K176 HydrophobicContact CG-CD 4.24Å; E171-K176 PolarHBondContact O-N 3.32Å; E171-K176 IonicContact OE1-NZ 3.91Å
172	V	92.9	Very high	92.2	Very high	35 Å²	35	54.8 Å²	54.8	21%	0.212	28%	0.284	C	S	.	.	H	α-helix	trans	-67.2	-47.5	171.9	179.2	0	0	0	0	109.1	F146 R167 T168 E169 S174 G175	F146-V172 HydrophobicContact CB-CG2 4.13Å; F146-V172 HydrophobicContact CD2-CG1 4.18Å; F146-V172 HydrophobicContact CD2-CG2 4.36Å; F146-V172 HydrophobicContact CG-CG1 4.25Å; F146-V172 HydrophobicContact CG-CG2 4.48Å; R167-V172 HydrophobicContact CB-CG2 3.69Å; T168-V172 PolarHBondContact O-N 3.3Å; E169-V172 WeakPolarHBondContact O-CB 3.38Å; E169-V172 PolarHBondContact O-N 3.41Å; V172-S174 VanDerWaalsContact C-N 3.32Å; V172-S174 PolarHBondContact O-N 3.21Å; V172-G175 PolarHBondContact O-N 3.45Å
173	V	92.6	Very high	92.3	Very high	121 Å²	121	52.5 Å²	52.5	73%	0.733	27%	0.274	S	S	*	.	H	α-helix	trans	-61.7	-40.1	176.6	176.8	0	0	0	0	111.2	E169 G175	E169-V173 WeakPolarHBondContact O-CG2 3.38Å; E169-V173 PolarHBondContact O-N 2.97Å; V173-G175 PolarHBondContact O-N 2.91Å
174	S	92.1	Very high	92.3	Very high	62 Å²	62	55.6 Å²	55.6	43%	0.434	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-7	176.3	84.5	0	0	0	0	114.2	N170 E171 V172 K176	N170-S174 WeakPolarHBondContact O-CB 3.12Å; N170-S174 PolarHBondContact O-N 3.48Å; N170-S174 PolarHBondContact O-OG 2.91Å; E171-S174 PolarHBondContact O-OG 2.98Å; V172-S174 VanDerWaalsContact C-N 3.32Å; V172-S174 PolarHBondContact O-N 3.21Å; S174-K176 VanDerWaalsContact C-N 3.32Å; S174-K176 PolarHBondContact O-N 3.19Å
175	G	91.6	Very high	92.2	Very high	6 Å²	6	60 Å²	60	6%	0.062	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	73	17.2	-178.1	0	0	0	0	0	115.3	E171 V172 V173 Q178 F179 Q180	E171-G175 PolarHBondContact O-N 3.47Å; E171-G175 VanDerWaalsContact O-N 3.11Å; V172-G175 PolarHBondContact O-N 3.45Å; V173-G175 PolarHBondContact O-N 2.91Å; G175-Q178 PolarHBondContact O-N 3.46Å; G175-F179 PolarHBondContact O-N 2.87Å; G175-Q180 PolarHBondContact O-N 2.89Å; G175-Q180 VanDerWaalsContact O-N 3.14Å
176	K	92.4	Very high	92.2	Very high	37 Å²	37	56.6 Å²	56.6	16%	0.161	29%	0.288	C	S	.	.	B	Isolated β-bridge	trans	-67.5	135.9	179.5	-167.1	175.9	-176.5	178.2	0	110.7	I151 R167 E171 S174 Q178 K184	I151-K176 HydrophobicContact CD1-CD 4.32Å; I151-K176 HydrophobicContact CD1-CG 4.48Å; R167-K176 WeakPolarHBondContact CD-O 3.26Å; R167-K176 PolarHBondContact NH1-O 3.37Å; E171-K176 HydrophobicContact CB-CB 4.15Å; E171-K176 HydrophobicContact CG-CD 4.24Å; E171-K176 PolarHBondContact O-N 3.32Å; E171-K176 IonicContact OE1-NZ 3.91Å; S174-K176 VanDerWaalsContact C-N 3.32Å; S174-K176 PolarHBondContact O-N 3.19Å; K176-Q178 PolarHBondContact O-N 2.89Å; K176-K184 PolarHBondContact NZ-O 3.33Å; K176-K184 VanDerWaalsContact NZ-O 3.1Å
177	G	89.6	Confident	92	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.4	-6.9	-175.6	0	0	0	0	0	115.4	Q180 R215	G177-Q180 CarbonylContact C-O 3.48Å; G177-Q180 WeakPolarHBondContact CA-O 3.47Å; G177-Q180 PolarHBondContact N-O 3.08Å; G177-R215 VanDerWaalsContact O-CB 3.31Å; G177-R215 WeakPolarHBondContact O-CB 3.5Å; G177-R215 WeakPolarHBondContact O-CG 2.99Å
178	Q	89.4	Confident	92	Very high	55 Å²	55	62.1 Å²	62.1	26%	0.257	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.4	-53.3	175.5	-179	171.4	1.7	0	0	112	Y149 G175 K176 R215	Y149-Q178 HydrophobicContact CD2-CB 4.1Å; Y149-Q178 HydrophobicContact CD2-CG 4.27Å; Y149-Q178 HydrophobicContact CE2-CB 4.24Å; Y149-Q178 HydrophobicContact CE2-CG 3.91Å; G175-Q178 PolarHBondContact O-N 3.46Å; K176-Q178 PolarHBondContact O-N 2.89Å; Q178-R215 WeakPolarHBondContact O-CD 3.29Å; Q178-R215 PolarHBondContact O-NH1 3.44Å
179	F	91.7	Very high	91.9	Very high	135 Å²	135	64.4 Å²	64.4	59%	0.592	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.8	-31.9	174.3	-57.5	-62.1	0	0	0	111.4	G175 L192	G175-F179 PolarHBondContact O-N 2.87Å; F179-L192 WeakPolarHBondContact O-CD1 3.02Å
180	Q	93.3	Very high	91.8	Very high	46 Å²	46	65 Å²	65	22%	0.215	34%	0.339	C	S	.	.	B	Isolated β-bridge	trans	-105.1	156.4	173.2	-41.9	-176.1	-30.4	0	0	111.5	G175 G177 G182 E189 L192	G175-Q180 PolarHBondContact O-N 2.89Å; G175-Q180 VanDerWaalsContact O-N 3.14Å; G177-Q180 CarbonylContact C-O 3.48Å; G177-Q180 WeakPolarHBondContact CA-O 3.47Å; G177-Q180 PolarHBondContact N-O 3.08Å; Q180-G182 PolarHBondContact O-N 3.4Å; Q180-E189 HydrophobicContact CB-CG 4.36Å; Q180-E189 HydrophobicContact CG-CG 3.98Å; Q180-E189 WeakPolarHBondContact CG-OE1 3.42Å; Q180-E189 PolarHBondContact NE2-OE1 3.23Å; Q180-L192 VanDerWaalsContact C-CD2 3.44Å; Q180-L192 WeakPolarHBondContact O-CD2 3.21Å
181	C	94.8	Very high	91.4	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	33%	0.334	C	S	.	.			trans	-53.5	130.9	179.9	-173.1	0	0	0	0	111.6	N183 C186 K188 C217	C181-N183 PolarHBondContact O-N 3.1Å; C181-N183 VanDerWaalsContact O-N 3.17Å; C181-C186 HydrophobicContact CB-CB 4.12Å; C181-K188 VanDerWaalsContact CB-O 3.31Å; C181-K188 WeakPolarHBondContact CB-O 3.38Å; C181-K188 PolarHBondContact N-O 3.37Å; C181-C217 HydrophobicContact CB-CB 4.33Å; C181-C217 PolarHBondContact SG-N 3.31Å; C181-C217 VanDerWaalsContact SG-N 3.44Å; C181-C217 VanDerWaalsContact SG-SG 3.63Å
182	G	93.2	Very high	91.4	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	33%	0.334	C	S	.	.	S	Bend	trans	-75.1	6.6	179	0	0	0	0	0	114.9	I151 A152 Q180 R215	I151-G182 CarbonylContact C-O 3.56Å; I151-G182 WeakPolarHBondContact CA-O 3.03Å; I151-G182 WeakPolarHBondContact CG2-O 3.48Å; A152-G182 PolarHBondContact N-O 3.3Å; Q180-G182 PolarHBondContact O-N 3.4Å; G182-R215 WeakPolarHBondContact CA-O 3.35Å; G182-R215 PolarHBondContact N-O 3.35Å
183	N	93.4	Very high	91.3	Very high	7 Å²	7	65.5 Å²	65.5	4%	0.037	35%	0.349	C	S	.	.	B	Isolated β-bridge	trans	-81.7	131.1	172.1	179.7	20.6	0	0	0	109.9	A152 L154 C181 H185 C186 L216 C220	A152-N183 CarbonylContact O-C 3.55Å; A152-N183 VanDerWaalsContact O-CA 3.28Å; A152-N183 WeakPolarHBondContact O-CA 3.46Å; A152-N183 PolarHBondContact O-OD1 2.9Å; L154-N183 HydrophobicContact CD1-CB 4.12Å; L154-N183 HydrophobicContact CG-CB 4.49Å; L154-N183 PolarHBondContact N-OD1 3.42Å; C181-N183 PolarHBondContact O-N 3.1Å; C181-N183 VanDerWaalsContact O-N 3.17Å; N183-H185 PolarHBondContact O-N 3.2Å; N183-H185 VanDerWaalsContact O-N 3.08Å; N183-C186 HydrophobicContact CB-CB 3.84Å; N183-C186 PolarHBondContact O-N 3.19Å; N183-L216 HydrophobicContact CB-CD2 4.2Å; N183-C220 HydrophobicContact CB-CB 4.35Å; N183-C220 PolarHBondContact ND2-SG 3.36Å; N183-C220 VanDerWaalsContact ND2-SG 3.39Å
184	K	91.2	Very high	91.3	Very high	102 Å²	102	63.4 Å²	63.4	44%	0.443	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.2	-42.8	-178.1	-175.6	-178.6	175.7	-172.1	0	112.9	I151 A152 K176	I151-K184 HydrophobicContact CG2-CB 4.34Å; A152-K184 PolarHBondContact O-N 3.33Å; K176-K184 PolarHBondContact NZ-O 3.33Å; K176-K184 VanDerWaalsContact NZ-O 3.1Å
185	H	89.5	Confident	91.3	Very high	128 Å²	128	63.8 Å²	63.8	59%	0.593	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.4	20.7	-175.9	-63	-74.4	0	0	0	114.4	S155 N183	S155-H185 PolarHBondContact OG-CD2 3.4Å; S155-H185 VanDerWaalsContact OG-CD2 3.32Å; N183-H185 PolarHBondContact O-N 3.2Å; N183-H185 VanDerWaalsContact O-N 3.08Å
186	C	90.8	Very high	91.4	Very high	22 Å²	22	69.5 Å²	69.5	15%	0.149	36%	0.356	C	S	.	.			trans	-130.9	132.4	179	-167.4	0	0	0	0	111	C181 N183	C181-C186 HydrophobicContact CB-CB 4.12Å; N183-C186 HydrophobicContact CB-CB 3.84Å; N183-C186 PolarHBondContact O-N 3.19Å
187	G	89.2	Confident	91.3	Very high	60 Å²	60	69 Å²	69	62%	0.619	36%	0.356	S	S	*	.			trans	-114.5	24.8	176.4	0	0	0	0	0	113.9
188	K	91.5	Very high	91.4	Very high	112 Å²	112	74.9 Å²	74.9	49%	0.487	39%	0.388	S	S	.	.			trans	-77.3	137	178.7	-67.6	-174.3	-179.3	-171.7	0	110.8	C181 C217	C181-K188 VanDerWaalsContact CB-O 3.31Å; C181-K188 WeakPolarHBondContact CB-O 3.38Å; C181-K188 PolarHBondContact N-O 3.37Å; K188-C217 HydrophobicContact CB-CB 4.13Å; K188-C217 HydrophobicContact CD-CB 4.48Å
189	E	91.4	Very high	91.4	Very high	120 Å²	120	73.9 Å²	73.9	56%	0.561	38%	0.383	S	S	*	.			trans	-109.4	-7.8	-177.7	-51.2	-169.7	156.8	0	0	113.2	Q180 L192	Q180-E189 HydrophobicContact CB-CG 4.36Å; Q180-E189 HydrophobicContact CG-CG 3.98Å; Q180-E189 WeakPolarHBondContact CG-OE1 3.42Å; Q180-E189 PolarHBondContact NE2-OE1 3.23Å; E189-L192 WeakPolarHBondContact O-CD1 3.41Å
190	E	89.6	Confident	91.4	Very high	168 Å²	168	70.9 Å²	70.9	79%	0.785	38%	0.382	S	S	*	.	S	Bend	trans	-94.7	138.3	-174	-63	-177.9	175.3	0	0	112.9	L192	E190-L192 PolarHBondContact O-N 3.46Å
191	G	86.8	Confident	91.1	Very high	55 Å²	55	70.1 Å²	70.1	57%	0.567	38%	0.378	S	S	*	.	S	Bend	trans	65	34.9	167.7	0	0	0	0	0	115.2	K193	G191-K193 PolarHBondContact O-N 2.98Å
192	L	91.6	Very high	90.9	Very high	21 Å²	21	74.9 Å²	74.9	11%	0.11	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-67.3	125.9	-178.4	-73.4	84	0	0	0	112.2	F179 Q180 E189 E190 R215 L216	F179-L192 WeakPolarHBondContact O-CD1 3.02Å; Q180-L192 VanDerWaalsContact C-CD2 3.44Å; Q180-L192 WeakPolarHBondContact O-CD2 3.21Å; E189-L192 WeakPolarHBondContact O-CD1 3.41Å; E190-L192 PolarHBondContact O-N 3.46Å; L192-R215 HydrophobicContact CB-CB 4.33Å; L192-R215 HydrophobicContact CD2-CB 3.8Å; L192-R215 PolarHBondContact O-NH2 3.49Å; L192-L216 WeakPolarHBondContact CA-O 3.48Å
193	K	91	Very high	90.6	Very high	119 Å²	119	75.6 Å²	75.6	52%	0.517	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	137.2	171.1	-66	-179.4	-178.9	179.3	0	110	G191 W195 R215 L216	G191-K193 PolarHBondContact O-N 2.98Å; K193-W195 HydrophobicContact CB-CZ2 4.44Å; K193-W195 HydrophobicContact CD-CZ2 4.34Å; K193-W195 VanDerWaalsContact O-CD1 3.28Å; K193-R215 WeakPolarHBondContact O-CA 2.9Å; K193-L216 PolarHBondContact N-O 2.97Å; K193-L216 PolarHBondContact O-N 2.86Å
194	S	92.9	Very high	90	Very high	77 Å²	77	81.2 Å²	81.2	54%	0.538	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	134.1	172.6	-54.2	0	0	0	0	109.8	L214 R215	S194-L214 CarbonylContact C-O 3.5Å; S194-L214 WeakPolarHBondContact CA-O 3.47Å; S194-R215 PolarHBondContact OG-NE 2.92Å
195	W	92.5	Very high	89.8	Confident	70 Å²	70	79.7 Å²	79.7	27%	0.265	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	143.5	179.6	-64.1	89.7	0	0	0	108.5	K193 V197 K213 L214 S221 L224 N225	K193-W195 HydrophobicContact CB-CZ2 4.44Å; K193-W195 HydrophobicContact CD-CZ2 4.34Å; K193-W195 VanDerWaalsContact O-CD1 3.28Å; W195-V197 HydrophobicContact CB-CG2 4.29Å; W195-K213 CarbonylContact O-C 3.59Å; W195-K213 WeakPolarHBondContact O-CA 3.5Å; W195-L214 HydrophobicContact CB-CB 4.46Å; W195-L214 PolarHBondContact N-O 3.2Å; W195-L214 PolarHBondContact O-N 3.03Å; W195-S221 VanDerWaalsContact CE2-OG 3.29Å; W195-S221 WeakPolarHBondContact CZ2-OG 3.43Å; W195-S221 PolarHBondContact NE1-OG 2.77Å; W195-L224 HydrophobicContact CB-CD2 4.16Å; W195-L224 HydrophobicContact CD2-CD2 4.31Å; W195-L224 HydrophobicContact CG-CD2 4.05Å; W195-N225 WeakPolarHBondContact CH2-ND2 3.48Å; W195-N225 WeakPolarHBondContact CZ3-ND2 3.49Å
196	E	92.9	Very high	89.8	Confident	125 Å²	125	78.7 Å²	78.7	58%	0.584	45%	0.445	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.2	123.5	168.3	-66.6	-175.9	163.9	0	0	107.2	L211 V212 K213	E196-L211 HydrophobicContact CB-CD1 4.08Å; E196-L211 HydrophobicContact CB-CD2 4.05Å; E196-L211 HydrophobicContact CB-CG 4.03Å; E196-L211 HydrophobicContact CG-CD2 4.47Å; E196-V212 WeakPolarHBondContact CA-O 3.39Å; E196-K213 HydrophobicContact CG-CG 4.19Å
197	V	90.6	Very high	89.8	Confident	27 Å²	27	86.6 Å²	86.6	16%	0.164	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	135.4	-173.3	-173	0	0	0	0	108.9	F164 W195 F199 V212 L214 L224	F164-V197 HydrophobicContact CE2-CG1 4.29Å; F164-V197 HydrophobicContact CZ-CG1 3.93Å; W195-V197 HydrophobicContact CB-CG2 4.29Å; V197-F199 PolarHBondContact O-N 3.36Å; V197-V212 HydrophobicContact CB-CG2 4.41Å; V197-V212 PolarHBondContact N-O 2.88Å; V197-V212 WeakPolarHBondContact O-CG2 3.47Å; V197-V212 PolarHBondContact O-N 2.88Å; V197-L214 HydrophobicContact CG2-CD1 4.49Å; V197-L224 HydrophobicContact CG2-CD1 4.44Å; V197-L224 HydrophobicContact CG2-CD2 3.86Å
198	N	91.7	Very high	89.9	Confident	123 Å²	123	85.4 Å²	85.4	66%	0.658	45%	0.453	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.2	115.6	170.8	-78.6	3.7	0	0	0	109.4	L211	N198-L211 WeakPolarHBondContact OD1-CD1 3.43Å
199	F	90.6	Very high	89.9	Confident	35 Å²	35	85.7 Å²	85.7	15%	0.154	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	106.4	171.8	179.9	-122.1	0	0	0	109.4	F121 F164 V197 Y201 N209 A210 V212	F121-F199 HydrophobicContact CD1-CD1 4.37Å; F121-F199 HydrophobicContact CD1-CE1 4.19Å; F121-F199 HydrophobicContact CD2-CE1 4.39Å; F121-F199 AromaticContact CE1-CD1 3.61Å; F121-F199 HydrophobicContact CE1-CD1 3.61Å; F121-F199 AromaticContact CE1-CE1 3.69Å; F121-F199 HydrophobicContact CE1-CE1 3.69Å; F121-F199 HydrophobicContact CE2-CD1 4.49Å; F121-F199 AromaticContact CE2-CE1 3.9Å; F121-F199 HydrophobicContact CE2-CE1 3.9Å; F121-F199 AromaticContact CZ-CD1 3.68Å; F121-F199 HydrophobicContact CZ-CD1 3.68Å; F121-F199 AromaticContact CZ-CE1 3.53Å; F121-F199 HydrophobicContact CZ-CE1 3.53Å; F164-F199 HydrophobicContact CB-CD2 4.17Å; F164-F199 HydrophobicContact CB-CE2 4.13Å; F164-F199 AromaticContact CD2-CD2 3.53Å; F164-F199 HydrophobicContact CD2-CD2 3.53Å; F164-F199 HydrophobicContact CD2-CE2 4.02Å; F164-F199 HydrophobicContact CD2-CG 4.43Å; F164-F199 HydrophobicContact CE2-CD2 4.39Å; F164-F199 HydrophobicContact CG-CD2 4.27Å; V197-F199 PolarHBondContact O-N 3.36Å; F199-Y201 AromaticContact CD1-CD1 3.66Å; F199-Y201 HydrophobicContact CD1-CD1 3.66Å; F199-Y201 HydrophobicContact CD1-CE1 4.44Å; F199-Y201 HydrophobicContact CD1-CG 4.25Å; F199-Y201 AromaticContact CE1-CD1 3.74Å; F199-Y201 HydrophobicContact CE1-CD1 3.74Å; F199-Y201 AromaticContact CE1-CG 3.85Å; F199-Y201 HydrophobicContact CE1-CG 3.85Å; F199-N209 CarbonylContact O-C 3.53Å; F199-N209 WeakPolarHBondContact O-CA 3.37Å; F199-A210 WeakPolarHBondContact CB-O 3.25Å; F199-A210 PolarHBondContact N-O 2.9Å; F199-A210 PolarHBondContact O-N 3.5Å; F199-V212 HydrophobicContact CB-CG1 4.1Å; F199-V212 HydrophobicContact CB-CG2 4.01Å
200	A	90.1	Very high	89.8	Confident	71 Å²	71	80.6 Å²	80.6	59%	0.587	44%	0.439	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.9	125.9	170	0	0	0	0	0	109.2	R208 N209	A200-R208 CarbonylContact C-O 3.48Å; A200-R208 WeakPolarHBondContact CA-O 3.33Å; A200-N209 WeakPolarHBondContact CA-OD1 3.47Å; A200-N209 VanDerWaalsContact CB-OD1 3.24Å; A200-N209 WeakPolarHBondContact CB-OD1 3.28Å
201	Y	88.8	Confident	89.9	Confident	30 Å²	30	77.4 Å²	77.4	12%	0.118	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	161.2	178.8	65.1	-79.6	0	0	0	110.9	F121 F199 E203 R208 A210	F121-Y201 HydrophobicContact CB-CD2 4.07Å; F121-Y201 HydrophobicContact CB-CE2 3.6Å; F121-Y201 HydrophobicContact CD1-CD1 4.01Å; F121-Y201 HydrophobicContact CD1-CD2 4.34Å; F121-Y201 AromaticContact CD1-CE1 3.59Å; F121-Y201 HydrophobicContact CD1-CE1 3.59Å; F121-Y201 AromaticContact CD1-CE2 3.95Å; F121-Y201 HydrophobicContact CD1-CE2 3.95Å; F121-Y201 HydrophobicContact CD1-CG 4.37Å; F121-Y201 AromaticContact CD1-CZ 3.56Å; F121-Y201 HydrophobicContact CE1-CD1 4.38Å; F121-Y201 HydrophobicContact CE1-CE1 4.14Å; F121-Y201 HydrophobicContact CG-CD2 4.35Å; F121-Y201 HydrophobicContact CG-CE1 4.49Å; F121-Y201 HydrophobicContact CG-CE2 4.1Å; F199-Y201 AromaticContact CD1-CD1 3.66Å; F199-Y201 HydrophobicContact CD1-CD1 3.66Å; F199-Y201 HydrophobicContact CD1-CE1 4.44Å; F199-Y201 HydrophobicContact CD1-CG 4.25Å; F199-Y201 AromaticContact CE1-CD1 3.74Å; F199-Y201 HydrophobicContact CE1-CD1 3.74Å; F199-Y201 AromaticContact CE1-CG 3.85Å; F199-Y201 HydrophobicContact CE1-CG 3.85Å; Y201-E203 HydrophobicContact CD2-CB 3.98Å; Y201-E203 HydrophobicContact CE2-CB 3.79Å; Y201-R208 HydrophobicContact CD1-CB 4.29Å; Y201-R208 WeakPolarHBondContact CD1-O 3.36Å; Y201-R208 HydrophobicContact CD2-CB 4.34Å; Y201-R208 HydrophobicContact CE1-CB 3.75Å; Y201-R208 HydrophobicContact CE2-CB 3.81Å; Y201-R208 VanDerWaalsContact CZ-CB 3.48Å; Y201-R208 PolarHBondContact N-O 3.22Å; Y201-R208 PolarHBondContact O-N 3.26Å; Y201-R208 VanDerWaalsContact O-O 3.09Å; Y201-A210 HydrophobicContact CE1-CB 3.98Å
202	V	89.4	Confident	90.2	Very high	101 Å²	101	75 Å²	75	61%	0.612	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.5	123	175.5	-178.4	0	0	0	0	107.7	E206 K207	V202-E206 CarbonylContact C-O 3.57Å; V202-E206 VanDerWaalsContact CA-O 3.29Å; V202-E206 WeakPolarHBondContact CA-O 3.37Å; V202-K207 HydrophobicContact CG2-CG 4.14Å
203	E	86.5	Confident	90.3	Very high	15 Å²	15	79.4 Å²	79.4	7%	0.07	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	124.7	179.7	-178.5	171.1	-121.9	0	0	108.1	R120 F121 Y201 G205 E206 R208	R120-E203 WeakPolarHBondContact CA-OE1 3.4Å; R120-E203 WeakPolarHBondContact CB-OE1 3.48Å; F121-E203 PolarHBondContact N-OE1 3.1Å; Y201-E203 HydrophobicContact CD2-CB 3.98Å; Y201-E203 HydrophobicContact CE2-CB 3.79Å; E203-G205 PolarHBondContact O-N 3.43Å; E203-E206 PolarHBondContact N-O 3.45Å; E203-E206 PolarHBondContact O-N 2.86Å; E203-R208 VanDerWaalsContact OE2-CD 3.26Å; E203-R208 WeakPolarHBondContact OE2-CD 3.04Å; E203-R208 IonicContact OE2-CZ 3.07Å; E203-R208 IonicContact OE2-NE 3.67Å; E203-R208 IonicContact OE2-NH1 2.69Å; E203-R208 PolarHBondContact OE2-NH1 3.12Å
204	H	82.4	Confident	90.5	Very high	125 Å²	125	73.7 Å²	73.7	58%	0.579	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.2	33.5	-175.3	-57.4	-67.2	0	0	0	115
205	G	86.3	Confident	90.5	Very high	70 Å²	70	73 Å²	73	72%	0.722	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.3	-7	-179.7	0	0	0	0	0	115.2	E203	E203-G205 PolarHBondContact O-N 3.43Å
206	E	89.3	Confident	90.6	Very high	106 Å²	106	69.7 Å²	69.7	50%	0.495	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	138.4	177.3	-60.9	-177.9	159.9	0	0	111.4	V202 E203 R208	V202-E206 CarbonylContact C-O 3.57Å; V202-E206 VanDerWaalsContact CA-O 3.29Å; V202-E206 WeakPolarHBondContact CA-O 3.37Å; E203-E206 PolarHBondContact N-O 3.45Å; E203-E206 PolarHBondContact O-N 2.86Å; E206-R208 PolarHBondContact O-N 2.92Å; E206-R208 IonicContact OE2-CZ 3.86Å; E206-R208 IonicContact OE2-NE 2.71Å; E206-R208 PolarHBondContact OE2-NE 3.32Å; E206-R208 IonicContact OE2-NH2 3.71Å; E206-R208 PolarHBondContact OE2-NH2 3.29Å
207	K	91.4	Very high	90.6	Very high	188 Å²	188	63.8 Å²	63.8	82%	0.817	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.6	117.6	173.1	-69.5	177.2	-177.4	175.2	0	109.4	V202	V202-K207 HydrophobicContact CG2-CG 4.14Å
208	R	89.9	Confident	90.6	Very high	35 Å²	35	64.9 Å²	64.9	13%	0.132	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	151.9	177.3	-65.1	-175.9	179	-169.7	-2.7	110.1	R124 A200 Y201 E203 E206	R124-R208 VanDerWaalsContact NH2-NH2 3.14Å; A200-R208 CarbonylContact C-O 3.48Å; A200-R208 WeakPolarHBondContact CA-O 3.33Å; Y201-R208 HydrophobicContact CD1-CB 4.29Å; Y201-R208 WeakPolarHBondContact CD1-O 3.36Å; Y201-R208 HydrophobicContact CD2-CB 4.34Å; Y201-R208 HydrophobicContact CE1-CB 3.75Å; Y201-R208 HydrophobicContact CE2-CB 3.81Å; Y201-R208 VanDerWaalsContact CZ-CB 3.48Å; Y201-R208 PolarHBondContact N-O 3.22Å; Y201-R208 PolarHBondContact O-N 3.26Å; Y201-R208 VanDerWaalsContact O-O 3.09Å; E203-R208 VanDerWaalsContact OE2-CD 3.26Å; E203-R208 WeakPolarHBondContact OE2-CD 3.04Å; E203-R208 IonicContact OE2-CZ 3.07Å; E203-R208 IonicContact OE2-NE 3.67Å; E203-R208 IonicContact OE2-NH1 2.69Å; E203-R208 PolarHBondContact OE2-NH1 3.12Å; E206-R208 PolarHBondContact O-N 2.92Å; E206-R208 IonicContact OE2-CZ 3.86Å; E206-R208 IonicContact OE2-NE 2.71Å; E206-R208 PolarHBondContact OE2-NE 3.32Å; E206-R208 IonicContact OE2-NH2 3.71Å; E206-R208 PolarHBondContact OE2-NH2 3.29Å
209	N	91.3	Very high	90.6	Very high	119 Å²	119	64 Å²	64	64%	0.636	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.2	137	178	-65.1	-23.8	0	0	0	109.2	F199 A200	F199-N209 CarbonylContact O-C 3.53Å; F199-N209 WeakPolarHBondContact O-CA 3.37Å; A200-N209 WeakPolarHBondContact CA-OD1 3.47Å; A200-N209 VanDerWaalsContact CB-OD1 3.24Å; A200-N209 WeakPolarHBondContact CB-OD1 3.28Å
210	A	91.1	Very high	90.6	Very high	13 Å²	13	62.5 Å²	62.5	11%	0.107	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	144.2	174.7	0	0	0	0	0	110.1	F121 L122 F199 Y201	F121-A210 HydrophobicContact CE1-CB 4.25Å; L122-A210 HydrophobicContact CD1-CB 3.56Å; F199-A210 WeakPolarHBondContact CB-O 3.25Å; F199-A210 PolarHBondContact N-O 2.9Å; F199-A210 PolarHBondContact O-N 3.5Å; Y201-A210 HydrophobicContact CE1-CB 3.98Å
211	L	91.9	Very high	90.6	Very high	101 Å²	101	59.5 Å²	59.5	53%	0.529	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	118.4	172.3	-164.5	72.9	0	0	0	108.7	E196 N198	E196-L211 HydrophobicContact CB-CD1 4.08Å; E196-L211 HydrophobicContact CB-CD2 4.05Å; E196-L211 HydrophobicContact CB-CG 4.03Å; E196-L211 HydrophobicContact CG-CD2 4.47Å; N198-L211 WeakPolarHBondContact OD1-CD1 3.43Å
212	V	92.3	Very high	90.6	Very high	5 Å²	5	63.3 Å²	63.3	3%	0.03	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	144.1	-179.8	-63.3	0	0	0	0	111	W166 E196 V197 F199	W166-V212 HydrophobicContact CH2-CG1 4.13Å; E196-V212 WeakPolarHBondContact CA-O 3.39Å; V197-V212 HydrophobicContact CB-CG2 4.41Å; V197-V212 PolarHBondContact N-O 2.88Å; V197-V212 WeakPolarHBondContact O-CG2 3.47Å; V197-V212 PolarHBondContact O-N 2.88Å; F199-V212 HydrophobicContact CB-CG1 4.1Å; F199-V212 HydrophobicContact CB-CG2 4.01Å
213	K	94.4	Very high	90.6	Very high	112 Å²	112	61.8 Å²	61.8	49%	0.487	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	140.4	178.9	-61.2	174.2	179.2	176.2	0	110.9	E148 Y149 C150 W195 E196	E148-K213 WeakPolarHBondContact O-CB 3.27Å; Y149-K213 HydrophobicContact CD1-CB 4.28Å; C150-K213 PolarHBondContact N-O 3.14Å; C150-K213 PolarHBondContact SG-O 3.03Å; W195-K213 CarbonylContact O-C 3.59Å; W195-K213 WeakPolarHBondContact O-CA 3.5Å; E196-K213 HydrophobicContact CG-CG 4.19Å
214	L	93.3	Very high	90.7	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	131.3	-175.2	-118.4	139.1	0	0	0	111	C150 A152 F164 S194 W195 V197 L216	C150-L214 WeakPolarHBondContact SG-CD1 3.35Å; C150-L214 VanDerWaalsContact SG-CG 3.58Å; A152-L214 HydrophobicContact CB-CD1 4.08Å; A152-L214 HydrophobicContact CB-CD2 3.6Å; A152-L214 HydrophobicContact CB-CG 4.46Å; F164-L214 HydrophobicContact CD1-CD1 3.49Å; F164-L214 VanDerWaalsContact CD1-CD1 3.49Å; F164-L214 HydrophobicContact CE1-CD1 3.23Å; F164-L214 HydrophobicContact CZ-CD1 4.29Å; S194-L214 CarbonylContact C-O 3.5Å; S194-L214 WeakPolarHBondContact CA-O 3.47Å; W195-L214 HydrophobicContact CB-CB 4.46Å; W195-L214 PolarHBondContact N-O 3.2Å; W195-L214 PolarHBondContact O-N 3.03Å; V197-L214 HydrophobicContact CG2-CD1 4.49Å; L214-L216 HydrophobicContact CD2-CD1 4.08Å; L214-L216 HydrophobicContact CD2-CD2 3.57Å; L214-L216 HydrophobicContact CD2-CG 3.72Å
215	R	93.6	Very high	90.8	Very high	62 Å²	62	58.2 Å²	58.2	23%	0.234	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	124	169.1	-57.4	-161.1	70.6	-173.1	3.4	111	Y149 G177 Q178 G182 L192 K193 S194	Y149-R215 HydrophobicContact CD1-CG 3.79Å; Y149-R215 HydrophobicContact CE1-CG 3.58Å; G177-R215 VanDerWaalsContact O-CB 3.31Å; G177-R215 WeakPolarHBondContact O-CB 3.5Å; G177-R215 WeakPolarHBondContact O-CG 2.99Å; Q178-R215 WeakPolarHBondContact O-CD 3.29Å; Q178-R215 PolarHBondContact O-NH1 3.44Å; G182-R215 WeakPolarHBondContact CA-O 3.35Å; G182-R215 PolarHBondContact N-O 3.35Å; L192-R215 HydrophobicContact CB-CB 4.33Å; L192-R215 HydrophobicContact CD2-CB 3.8Å; L192-R215 PolarHBondContact O-NH2 3.49Å; K193-R215 WeakPolarHBondContact O-CA 2.9Å; S194-R215 PolarHBondContact OG-NE 2.92Å
216	L	93.9	Very high	90.7	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	145.3	-176.6	-65.6	176.9	0	0	0	111	L154 N183 L192 K193 L214 C220 L224	L154-L216 HydrophobicContact CD1-CD1 4.06Å; L154-L216 HydrophobicContact CD1-CD2 4.19Å; N183-L216 HydrophobicContact CB-CD2 4.2Å; L192-L216 WeakPolarHBondContact CA-O 3.48Å; K193-L216 PolarHBondContact N-O 2.97Å; K193-L216 PolarHBondContact O-N 2.86Å; L214-L216 HydrophobicContact CD2-CD1 4.08Å; L214-L216 HydrophobicContact CD2-CD2 3.57Å; L214-L216 HydrophobicContact CD2-CG 3.72Å; L216-C220 HydrophobicContact CB-CB 4.02Å; L216-C220 HydrophobicContact CD1-CB 4.4Å; L216-C220 HydrophobicContact CD2-CB 3.97Å; L216-C220 HydrophobicContact CG-CB 4.36Å; L216-L224 HydrophobicContact CD1-CB 4.16Å; L216-L224 HydrophobicContact CD1-CD2 3.97Å
217	C	93.4	Very high	89.7	Confident	1 Å²	1	61.8 Å²	61.8	1%	0.007	29%	0.289	C	S	.	.			trans	-67	163.5	168.3	70.3	0	0	0	0	110.8	C181 K188 E219 C220 S221	C181-C217 HydrophobicContact CB-CB 4.33Å; C181-C217 PolarHBondContact SG-N 3.31Å; C181-C217 VanDerWaalsContact SG-N 3.44Å; C181-C217 VanDerWaalsContact SG-SG 3.63Å; K188-C217 HydrophobicContact CB-CB 4.13Å; K188-C217 HydrophobicContact CD-CB 4.48Å; C217-E219 VanDerWaalsContact C-N 3.29Å; C217-E219 PolarHBondContact O-N 2.87Å; C217-C220 PolarHBondContact O-N 2.88Å; C217-C220 VanDerWaalsContact O-N 3.08Å; C217-S221 WeakPolarHBondContact O-CB 3.37Å; C217-S221 PolarHBondContact O-N 2.94Å
218	P	91.2	Very high	88.3	Confident	51 Å²	51	59.9 Å²	59.9	33%	0.331	28%	0.283	S	S	.	.	H	α-helix	trans	-53.8	-42.7	-178.1	-27.5	35.8	0	0	0	113.5	C220 S221 F222	P218-C220 PolarHBondContact O-N 3.4Å; P218-S221 WeakPolarHBondContact O-CB 3.26Å; P218-S221 PolarHBondContact O-N 3.39Å; P218-F222 HydrophobicContact CB-CE2 4.44Å; P218-F222 WeakPolarHBondContact O-CD2 3.43Å; P218-F222 WeakPolarHBondContact O-CG 3.28Å; P218-F222 PolarHBondContact O-N 2.93Å
219	E	90.9	Very high	86.6	Confident	105 Å²	105	64 Å²	64	49%	0.491	30%	0.302	S	S	.	.	H	α-helix	trans	-58.4	-46.7	176.4	-65.7	-59.1	144.3	0	0	112.7	C217 F222 K223	C217-E219 VanDerWaalsContact C-N 3.29Å; C217-E219 PolarHBondContact O-N 2.87Å; E219-F222 PolarHBondContact O-N 3.12Å; E219-K223 PolarHBondContact O-N 2.94Å
220	C	90.5	Very high	84.2	Confident	2 Å²	2	70.1 Å²	70.1	1%	0.014	32%	0.316	C	S	.	.	H	α-helix	trans	-74.8	-31.8	-179.2	-68.7	0	0	0	0	111.7	L154 N183 L216 C217 P218 F222 K223 L224	L154-C220 HydrophobicContact CD1-CB 3.66Å; N183-C220 HydrophobicContact CB-CB 4.35Å; N183-C220 PolarHBondContact ND2-SG 3.36Å; N183-C220 VanDerWaalsContact ND2-SG 3.39Å; L216-C220 HydrophobicContact CB-CB 4.02Å; L216-C220 HydrophobicContact CD1-CB 4.4Å; L216-C220 HydrophobicContact CD2-CB 3.97Å; L216-C220 HydrophobicContact CG-CB 4.36Å; C217-C220 PolarHBondContact O-N 2.88Å; C217-C220 VanDerWaalsContact O-N 3.08Å; P218-C220 PolarHBondContact O-N 3.4Å; C220-F222 VanDerWaalsContact C-N 3.3Å; C220-F222 PolarHBondContact O-N 3.12Å; C220-K223 WeakPolarHBondContact O-CB 3.39Å; C220-K223 PolarHBondContact O-N 3.07Å; C220-K223 VanDerWaalsContact O-N 3.15Å; C220-L224 PolarHBondContact O-N 2.89Å
221	S	90.4	Very high	81.9	Confident	8 Å²	8	79 Å²	79	6%	0.056	35%	0.352	C	S	.	.	H	α-helix	trans	-60.6	-39	170.5	167.7	0	0	0	0	111.9	W195 C217 P218 K223 L224 N225	W195-S221 VanDerWaalsContact CE2-OG 3.29Å; W195-S221 WeakPolarHBondContact CZ2-OG 3.43Å; W195-S221 PolarHBondContact NE1-OG 2.77Å; C217-S221 WeakPolarHBondContact O-CB 3.37Å; C217-S221 PolarHBondContact O-N 2.94Å; P218-S221 WeakPolarHBondContact O-CB 3.26Å; P218-S221 PolarHBondContact O-N 3.39Å; S221-K223 VanDerWaalsContact C-N 3.34Å; S221-L224 PolarHBondContact O-N 3.05Å; S221-N225 PolarHBondContact O-N 3.05Å; S221-N225 VanDerWaalsContact O-N 3.16Å
222	F	88.8	Confident	79.5	Confident	110 Å²	110	82.5 Å²	82.5	48%	0.482	37%	0.366	S	S	.	.	H	α-helix	trans	-66.1	-35.5	173.3	-69.3	-57.8	0	0	0	113.1	P218 E219 C220 N225 Y226 K229	P218-F222 HydrophobicContact CB-CE2 4.44Å; P218-F222 WeakPolarHBondContact O-CD2 3.43Å; P218-F222 WeakPolarHBondContact O-CG 3.28Å; P218-F222 PolarHBondContact O-N 2.93Å; E219-F222 PolarHBondContact O-N 3.12Å; C220-F222 VanDerWaalsContact C-N 3.3Å; C220-F222 PolarHBondContact O-N 3.12Å; F222-N225 CarbonylContact O-C 3.59Å; F222-N225 PolarHBondContact O-N 3.39Å; F222-Y226 WeakPolarHBondContact O-CA 3.42Å; F222-Y226 PolarHBondContact O-N 3.47Å; F222-Y226 VanDerWaalsContact O-N 3.12Å; F222-K229 VanDerWaalsContact CD1-NZ 3.31Å
223	K	89.8	Confident	77	Confident	70 Å²	70	88.2 Å²	88.2	30%	0.304	40%	0.401	S	S	.	.	H	α-helix	trans	-67	-40.6	175.3	-67.6	177.4	-176	-178	0	112	L154 Y157 E219 C220 S221 N225 Y226	L154-K223 HydrophobicContact CD1-CB 4.33Å; Y157-K223 HydrophobicContact CD1-CB 4.34Å; Y157-K223 HydrophobicContact CD1-CD 4.12Å; Y157-K223 HydrophobicContact CD1-CG 4.18Å; Y157-K223 HydrophobicContact CD2-CB 3.92Å; Y157-K223 HydrophobicContact CD2-CG 4.04Å; Y157-K223 HydrophobicContact CE1-CD 4.04Å; Y157-K223 HydrophobicContact CE1-CG 4.13Å; Y157-K223 HydrophobicContact CE2-CB 4.38Å; Y157-K223 HydrophobicContact CE2-CG 4.01Å; Y157-K223 HydrophobicContact CG-CB 3.88Å; Y157-K223 HydrophobicContact CG-CD 4.5Å; Y157-K223 HydrophobicContact CG-CG 4.11Å; E219-K223 PolarHBondContact O-N 2.94Å; C220-K223 WeakPolarHBondContact O-CB 3.39Å; C220-K223 PolarHBondContact O-N 3.07Å; C220-K223 VanDerWaalsContact O-N 3.15Å; S221-K223 VanDerWaalsContact C-N 3.34Å; K223-N225 VanDerWaalsContact C-N 3.31Å; K223-N225 PolarHBondContact O-N 2.73Å; K223-Y226 VanDerWaalsContact O-CB 3.24Å; K223-Y226 WeakPolarHBondContact O-CB 3.44Å; K223-Y226 PolarHBondContact O-N 2.83Å
224	L	87.7	Confident	74.7	Confident	12 Å²	12	90.9 Å²	90.9	6%	0.063	41%	0.412	C	S	.	.	H	α-helix	trans	-60.3	-42.8	175.7	-171.5	71.1	0	0	0	111.2	L154 F162 W195 V197 L216 C220 S221 Y226	L154-L224 HydrophobicContact CD2-CD1 4.02Å; F162-L224 HydrophobicContact CE1-CD1 4.44Å; W195-L224 HydrophobicContact CB-CD2 4.16Å; W195-L224 HydrophobicContact CD2-CD2 4.31Å; W195-L224 HydrophobicContact CG-CD2 4.05Å; V197-L224 HydrophobicContact CG2-CD1 4.44Å; V197-L224 HydrophobicContact CG2-CD2 3.86Å; L216-L224 HydrophobicContact CD1-CB 4.16Å; L216-L224 HydrophobicContact CD1-CD2 3.97Å; C220-L224 PolarHBondContact O-N 2.89Å; S221-L224 PolarHBondContact O-N 3.05Å; L224-Y226 VanDerWaalsContact C-N 3.35Å; L224-Y226 PolarHBondContact O-N 3.48Å
225	N	85.6	Confident	72.4	Confident	53 Å²	53	97 Å²	97	28%	0.283	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94	22	179.9	-67.9	-25.4	0	0	0	113.8	W195 S221 F222 K223 H227 H228	W195-N225 WeakPolarHBondContact CH2-ND2 3.48Å; W195-N225 WeakPolarHBondContact CZ3-ND2 3.49Å; S221-N225 PolarHBondContact O-N 3.05Å; S221-N225 VanDerWaalsContact O-N 3.16Å; F222-N225 CarbonylContact O-C 3.59Å; F222-N225 PolarHBondContact O-N 3.39Å; K223-N225 VanDerWaalsContact C-N 3.31Å; K223-N225 PolarHBondContact O-N 2.73Å; N225-H227 PolarHBondContact O-N 3.28Å; N225-H228 PolarHBondContact O-N 3.38Å
226	Y	83.5	Confident	70.2	Confident	119 Å²	119	103.1 Å²	103.1	47%	0.467	48%	0.478	S	S	.	.	S	Bend	trans	-60.8	-42.8	-171.3	-179.6	-108.3	0	0	0	113	Y157 K158 F222 K223 L224	Y157-Y226 AromaticContact CD2-CD1 3.94Å; Y157-Y226 HydrophobicContact CD2-CD1 3.94Å; Y157-Y226 HydrophobicContact CD2-CD2 4.02Å; Y157-Y226 AromaticContact CD2-CG 3.62Å; Y157-Y226 HydrophobicContact CD2-CG 3.62Å; Y157-Y226 HydrophobicContact CE2-CD1 4.17Å; Y157-Y226 AromaticContact CE2-CD2 3.67Å; Y157-Y226 HydrophobicContact CE2-CD2 3.67Å; Y157-Y226 HydrophobicContact CE2-CE1 4.45Å; Y157-Y226 AromaticContact CE2-CE2 3.99Å; Y157-Y226 HydrophobicContact CE2-CE2 3.99Å; Y157-Y226 AromaticContact CE2-CG 3.77Å; Y157-Y226 HydrophobicContact CE2-CG 3.77Å; K158-Y226 HydrophobicContact CB-CE1 4.34Å; K158-Y226 HydrophobicContact CG-CE1 4.14Å; F222-Y226 WeakPolarHBondContact O-CA 3.42Å; F222-Y226 PolarHBondContact O-N 3.47Å; F222-Y226 VanDerWaalsContact O-N 3.12Å; K223-Y226 VanDerWaalsContact O-CB 3.24Å; K223-Y226 WeakPolarHBondContact O-CB 3.44Å; K223-Y226 PolarHBondContact O-N 2.83Å; L224-Y226 VanDerWaalsContact C-N 3.35Å; L224-Y226 PolarHBondContact O-N 3.48Å
227	H	68.7	Low	68	Low	131 Å²	131	114.1 Å²	114.1	61%	0.606	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-19.6	-176.8	-163.9	-91.1	0	0	0	113.7	N225 K229	N225-H227 PolarHBondContact O-N 3.28Å; H227-K229 VanDerWaalsContact C-N 3.32Å; H227-K229 PolarHBondContact O-N 3.49Å
228	H	63.1	Low	65.7	Low	149 Å²	149	123.7 Å²	123.7	69%	0.69	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.4	11.1	-175.8	-73.4	-72.3	0	0	0	114.8	N225 R230	N225-H228 PolarHBondContact O-N 3.38Å; H228-R230 PolarHBondContact O-N 2.93Å
229	K	53.7	Low	63.5	Low	122 Å²	122	132.3 Å²	132.3	53%	0.53	59%	0.586	S	S	.	*			trans	-89.6	104.6	-179.2	-72.6	-178.9	-178.5	-176.2	0	112.3	F222 H227	F222-K229 VanDerWaalsContact CD1-NZ 3.31Å; H227-K229 VanDerWaalsContact C-N 3.32Å; H227-K229 PolarHBondContact O-N 3.49Å
230	R	41	Very low	61.2	Low	247 Å²	247	137 Å²	137	93%	0.932	61%	0.605	S	S	*	*			trans	-161.8	85.7	134	-105	168.8	-167.9	-155.3	4.2	112.4	H228	H228-R230 PolarHBondContact O-N 2.93Å
231	K	42.2	Very low	58.7	Low	199 Å²	199	144.2 Å²	144.2	87%	0.865	64%	0.642	S	S	*	*				-179.7	106.5	127.3	-98.7	170.6	-174.9	177	0	108.6	V233	K231-V233 PolarHBondContact O-N 2.81Å
232	E	41.3	Very low	56.1	Low	175 Å²	175	148 Å²	148	82%	0.818	67%	0.669	S	S	*	*			trans	-60.9	105.4	156.5	-74	179.4	173.8	0	0	107.7	K234	E232-K234 PolarHBondContact O-N 3.34Å
233	V	40.3	Very low	53.5	Low	124 Å²	124	150.7 Å²	150.7	75%	0.752	68%	0.683	S	S	*	*			trans	-74.4	92.4	158.5	-179.6	0	0	0	0	105.4	K231 V235	K231-V233 PolarHBondContact O-N 2.81Å; V233-V235 PolarHBondContact O-N 2.77Å
234	K	45.8	Very low	50.8	Low	169 Å²	169	155.3 Å²	155.3	74%	0.735	71%	0.705	S	S	*	*			trans	-53.5	110.4	159.2	-71.6	-177.8	178.5	179.6	0	106	E232 K236	E232-K234 PolarHBondContact O-N 3.34Å; K234-K236 VanDerWaalsContact C-N 3.33Å; K234-K236 PolarHBondContact O-N 3.04Å
235	V	44.4	Very low	48.2	Very low	128 Å²	128	161.3 Å²	161.3	78%	0.776	74%	0.738	S	S	*	*			trans	-57.1	104.6	167	178.9	0	0	0	0	105.2	V233 R237	V233-V235 PolarHBondContact O-N 2.77Å; V235-R237 VanDerWaalsContact C-N 3.28Å; V235-R237 PolarHBondContact O-N 3.37Å
236	K	47.8	Very low	45.6	Very low	190 Å²	190	168 Å²	168	83%	0.826	77%	0.767	S	S	*	*			trans	-61.3	100.3	169.6	-74.9	-174.3	178	-179.2	0	105.5	K234 K238	K234-K236 VanDerWaalsContact C-N 3.33Å; K234-K236 PolarHBondContact O-N 3.04Å; K236-K238 PolarHBondContact O-N 2.86Å
237	R	47.1	Very low	43.2	Very low	231 Å²	231	170.7 Å²	170.7	87%	0.872	78%	0.784	S	S	*	*			trans	-50.8	111.5	164.1	-82.4	178.9	153	177.6	-7.1	106.1	V235 R239	V235-R237 VanDerWaalsContact C-N 3.28Å; V235-R237 PolarHBondContact O-N 3.37Å; R237-R239 PolarHBondContact O-N 3.34Å
238	K	46.9	Very low	42	Very low	202 Å²	202	169.3 Å²	169.3	88%	0.878	79%	0.786	S	S	*	*			trans	-56	104.9	165	-92.6	-178.5	172.2	179.3	0	106	K236 K240	K236-K238 PolarHBondContact O-N 2.86Å; K238-K240 PolarHBondContact O-N 3.29Å; K238-K240 VanDerWaalsContact O-N 3.15Å
239	R	44.8	Very low	40.6	Very low	232 Å²	232	168.3 Å²	168.3	88%	0.875	79%	0.791	S	S	*	*			trans	-61.4	113.5	163.8	-76.6	-179	169.2	173.4	-4.7	106	R237 I241	R237-R239 PolarHBondContact O-N 3.34Å; R239-I241 PolarHBondContact O-N 2.98Å
240	K	40.9	Very low	39.8	Very low	203 Å²	203	171.9 Å²	171.9	88%	0.883	81%	0.807	S	S	*	*			trans	-66	112.1	159.4	-70.9	-178.7	176.1	-176.9	0	105.6	K238	K238-K240 PolarHBondContact O-N 3.29Å; K238-K240 VanDerWaalsContact O-N 3.15Å
241	I	38.3	Very low	39.5	Very low	154 Å²	154	170 Å²	170	79%	0.79	81%	0.805	S	S	*	*			trans	-92.8	109.4	162.6	-68.9	170.4	0	0	0	104.4	R239	R239-I241 PolarHBondContact O-N 2.98Å
242	S	36.8	Very low	39.1	Very low	88 Å²	88	169.7 Å²	169.7	62%	0.615	80%	0.804	S	S	*	*			trans	-84.1	146.6	161.5	43.5	0	0	0	0	108.9
243	E	33.9	Very low	38.8	Very low	167 Å²	167	171.1 Å²	171.1	78%	0.78	80%	0.802	S	S	*	*			trans	73.1	141.4	165	-62.5	160.9	-164.4	0	0	115.8
244	E	32.5	Very low	38.5	Very low	166 Å²	166	173.2 Å²	173.2	78%	0.776	80%	0.801	S	S	*	*			cis	-166.6	160.6	-13.3	-177.9	173	155.3	0	0	104.8
245	N	32.7	Very low	38	Very low	139 Å²	139	174.7 Å²	174.7	74%	0.743	81%	0.807	S	S	*	*			trans	-20.4	136	175	-62.1	-63.9	0	0	0	119
246	E	32	Very low	37.4	Very low	193 Å²	193	180.2 Å²	180.2	90%	0.902	81%	0.814	S	S	*	*				-173.8	124.1	114.1	-95.3	-160.6	168.7	0	0	110.9
247	E	33.7	Very low	36.9	Very low	176 Å²	176	182.5 Å²	182.5	82%	0.822	82%	0.818	S	S	*	*			trans	-87.7	153.8	156.6	-120.4	-157.2	-160.7	0	0	107.1
248	P	42.8	Very low	36.2	Very low	101 Å²	101	180.6 Å²	180.6	66%	0.656	82%	0.816	S	S	*	*				-161.4	174.7	70.6	40.4	-17.6	0	0	0	119.1
249	T	33.1	Very low	35.4	Very low	129 Å²	129	175.7 Å²	175.7	79%	0.791	81%	0.807	S	S	*	*			trans	100.6	109.5	143.8	67.5	0	0	0	0	123.1
250	K	37.3	Very low	34.7	Very low	196 Å²	196	170 Å²	170	85%	0.852	80%	0.803	S	S	*	*			trans	-38.2	136.8	154.8	-57.8	162.6	-179.1	169.9	0	117.2
251	K	35.8	Very low	34.3	Very low	208 Å²	208	164.9 Å²	164.9	90%	0.904	79%	0.792	S	S	*	*			trans	-155.3	99.9	135.9	-69.5	-169.2	-176.3	165.3	0	109.6
252	K	33	Very low	34.1	Very low	193 Å²	193	166.3 Å²	166.3	84%	0.839	80%	0.795	S	S	*	*				58.1	122.7	91.3	-84.7	-168.9	-178.1	177.1	0	117.9
253	R	35	Very low	34	Very low	205 Å²	205	166.2 Å²	166.2	77%	0.774	80%	0.795	S	S	*	*			trans	86.8	141	146.3	-66.8	169.6	101.6	-170.4	4.5	116.2
254	K	33	Very low	34.2	Very low	168 Å²	168	167 Å²	167	73%	0.73	80%	0.796	S	S	*	*			cis	-164.9	154.1	23.1	-124.3	168.1	-167.5	-177	0	111.3
255	K	35.9	Very low	34.2	Very low	199 Å²	199	167.5 Å²	167.5	87%	0.865	80%	0.795	S	S	*	*			trans	-49.3	158.9	172.2	-66.6	170.9	171	174.6	0	115.5
256	R	31.4	Very low	34.4	Very low	244 Å²	244	168 Å²	168	92%	0.921	79%	0.793	S	S	*	*				-161.6	135.2	120.1	-101.1	173.5	91.7	173.7	5.3	112.8
257	R	38.6	Very low	34.6	Very low	239 Å²	239	168.7 Å²	168.7	90%	0.902	79%	0.787	S	S	*	*			trans	-102.2	148.9	169.1	-77.2	177.4	156	-173.5	-5.9	109.5
258	K	32.1	Very low	35	Very low	191 Å²	191	166.9 Å²	166.9	83%	0.83	78%	0.778	S	S	*	*			trans	174.9	111.6	144.7	-112.7	168.6	167.3	-179.4	0	106.2
259	S	30.4	Very low	34.9	Very low	98 Å²	98	169.6 Å²	169.6	69%	0.685	78%	0.78	S	S	*	*				71.9	144.6	61.6	81.3	0	0	0	0	115.2
260	S	29.6	Very low	35	Very low	114 Å²	114	170 Å²	170	80%	0.797	77%	0.771	S	S	*	*			trans	89	137.9	174.3	79	0	0	0	0	115.3
261	S	33.3	Very low	35	Very low	95 Å²	95	167.6 Å²	167.6	66%	0.664	76%	0.762	S	S	*	*			cis	-171	154.4	-8.8	46.6	0	0	0	0	108.1
262	H	33.5	Very low	34.9	Very low	183 Å²	183	166.2 Å²	166.2	85%	0.847	76%	0.756	S	S	*	*			trans	57.3	138.7	144.4	-75.4	-24.3	0	0	0	120
263	S	34.7	Very low	34.8	Very low	87 Å²	87	160.2 Å²	160.2	61%	0.608	75%	0.75	S	S	*	*			cis	-166.4	150.3	22.2	87	0	0	0	0	110.4
264	K	37.1	Very low	34.8	Very low	184 Å²	184	161.3 Å²	161.3	80%	0.8	75%	0.754	S	S	*	*			trans	53.2	133.6	134.9	-58.7	171.4	-177.7	176	0	116.9
265	K	33.5	Very low	34.7	Very low	175 Å²	175	157.4 Å²	157.4	76%	0.761	75%	0.748	S	S	*	*			cis	-174.3	135.5	43.2	-145.6	170.9	-180	-179	0	107.8
266	H	35.8	Very low	34.4	Very low	150 Å²	150	153.9 Å²	153.9	69%	0.694	74%	0.743	S	S	*	*			trans	41.2	142.1	135.5	-69.3	-96.7	0	0	0	119.5
267	R	36.5	Very low	34.4	Very low	207 Å²	207	147.1 Å²	147.1	78%	0.781	73%	0.733	S	S	*	*			cis	-171.6	128.3	32.8	-138.6	165.5	153.4	-168.3	-7.6	105.4
268	H	42.5	Very low	33.9	Very low	139 Å²	139	140.5 Å²	140.5	64%	0.644	72%	0.724	S	S	*	*				62.8	143.5	108.4	-70.1	-32.1	0	0	0	114.4
269	K	39.9	Very low	33.8	Very low	157 Å²	157	136.5 Å²	136.5	68%	0.683	72%	0.72	S	S	*	*			cis	178.3	162.4	17.4	-117.5	177.7	165.1	171.4	0	101.6
270	K	36.6	Very low	33.8	Very low	138 Å²	138	136.6 Å²	136.6	60%	0.6	72%	0.72	S	S	*	*			cis	-168.7	137.3	11.4	-134.7	170.8	167.7	-164.9	0	102
271	Q	36.8	Very low	33.8	Very low	145 Å²	145	135.8 Å²	135.8	68%	0.678	72%	0.715	S	S	*	*				60.3	143.4	104.9	-67.1	-169.2	-12.2	0	0	114.9
272	K	34.2	Very low	33.7	Very low	179 Å²	179	140.1 Å²	140.1	78%	0.778	72%	0.724	S	S	*	*			cis	-162.2	139.4	20.1	-135.1	167.8	172.5	-173.5	0	103.5
273	G	29.9	Very low	33.7	Very low	68 Å²	68	136.8 Å²	136.8	70%	0.701	72%	0.721	S	S	*	*				69.4	136.1	81.7	0	0	0	0	0	109.9
274	R	34.4	Very low	33.6	Very low	228 Å²	228	141.5 Å²	141.5	86%	0.86	73%	0.734	S	S	*	*			cis	-172.4	127.5	16.9	-120.5	163.2	85.4	178.5	6.8	103
275	S	32.4	Very low	33.2	Very low	86 Å²	86	136.7 Å²	136.7	60%	0.601	74%	0.736	S	S	*	*				66.2	130.7	107.5	71.9	0	0	0	0	116.9
276	T	29.3	Very low	33.3	Very low	124 Å²	124	135.9 Å²	135.9	76%	0.761	74%	0.735	S	S	*	*			trans	85.6	109.7	139.1	53	0	0	0	0	121.3
277	S	30.9	Very low	33	Very low	103 Å²	103	136.1 Å²	136.1	72%	0.72	74%	0.742	S	S	*	*				77	130.9	120.6	67.6	0	0	0	0	122.8
278	S	29.3	Very low	32.8	Very low	100 Å²	100	131.2 Å²	131.2	70%	0.699	74%	0.739	S	S	*	*			trans	82.6	129.4	131.5	61.4	0	0	0	0	122
279	S	29.4	Very low	32.4	Very low	107 Å²	107	132.1 Å²	132.1	75%	0.748	75%	0.749	S	S	*	*			trans	66.3	149.8	143.4	60.1	0	0	0	0	117.4
280	S	29.1	Very low	32.3	Very low	99 Å²	99	134.8 Å²	134.8	69%	0.692	76%	0.76	S	S	*	*			cis	-176.3	164	-5.1	38.4	0	0	0	0	106.6
281	S	31.2	Very low	32.4	Very low	98 Å²	98	135.3 Å²	135.3	69%	0.685	77%	0.769	S	S	*	*			trans	66.8	116.4	148.3	58.1	0	0	0	0	123.4
282	E	31.3	Very low	32.2	Very low	186 Å²	186	134.3 Å²	134.3	87%	0.869	78%	0.779	S	S	*	*				52.9	130.3	119.2	-54.2	-172.5	157.7	0	0	123.6
283	S	32.7	Very low	32.1	Very low	112 Å²	112	135.2 Å²	135.2	78%	0.783	79%	0.786	S	S	*	*			trans	161.9	115.7	137.1	37.6	0	0	0	0	108.6
284	E	32.8	Very low	32.5	Very low	187 Å²	187	136.8 Å²	136.8	87%	0.874	79%	0.792	S	S	*	*				63.3	129.9	86.5	-69.2	-133.9	147.8	0	0	116.4
285	G	29.6	Very low	32.2	Very low	82 Å²	82	129.8 Å²	129.8	85%	0.845	79%	0.791	S	S	*	*			trans	-172.4	98.7	171.4	0	0	0	0	0	112.2
286	Q	34.8	Very low	32.2	Very low	159 Å²	159	133.1 Å²	133.1	74%	0.743	80%	0.802	S	S	*	*			trans	-82	166.8	172.9	-71.8	167.8	-3.7	0	0	112.6
287	N	29.8	Very low	32.5	Very low	155 Å²	155	135.7 Å²	135.7	83%	0.829	81%	0.805	S	S	*	*			trans	149.7	141.2	139.3	-74	-28.1	0	0	0	109.6
288	S	32.6	Very low	32.9	Very low	104 Å²	104	136 Å²	136	73%	0.727	81%	0.805	S	S	*	*			cis	-179.1	149.7	-3.2	46.7	0	0	0	0	108.4
289	D	34.1	Very low	33.1	Very low	158 Å²	158	138.6 Å²	138.6	85%	0.845	81%	0.811	S	S	*	*			trans	-70.3	163.8	179.6	-55.6	-73.4	0	0	0	116.5
290	K	38.1	Very low	33.9	Very low	212 Å²	212	138.5 Å²	138.5	92%	0.922	81%	0.81	S	S	*	*			trans	-160.7	122.3	144.4	-143.8	169.6	-176.7	176.4	0	114.8
291	D	36.8	Very low	34.2	Very low	149 Å²	149	141.2 Å²	141.2	80%	0.797	81%	0.812	S	S	*	*			trans	-78.3	162.5	174.2	-71.6	-54.8	0	0	0	115.4
292	S	33	Very low	34.7	Very low	125 Å²	125	140.8 Å²	140.8	87%	0.874	81%	0.809	S	S	*	*			trans	-171.6	124.8	135	-69.7	0	0	0	0	113.1
293	E	33.6	Very low	35.3	Very low	198 Å²	198	141.1 Å²	141.1	93%	0.925	81%	0.811	S	S	*	*			trans	-76.6	171.9	161.3	-54.7	-175.4	110.6	0	0	110.9
294	A	36.4	Very low	36	Very low	100 Å²	100	138.8 Å²	138.8	83%	0.826	80%	0.798	S	S	*	*			cis	-163.3	159.5	15.5	0	0	0	0	0	110.2
295	G	29.9	Very low	36.5	Very low	81 Å²	81	133.5 Å²	133.5	84%	0.835	78%	0.776	S	S	*	*			trans	161	98.2	161.5	0	0	0	0	0	118.5
296	N	31.3	Very low	37.3	Very low	157 Å²	157	137.6 Å²	137.6	84%	0.84	77%	0.773	S	S	*	*			trans	-4.6	127.4	166.7	-78.5	-8.1	0	0	0	125.1
297	E	36.1	Very low	38.3	Very low	177 Å²	177	140.3 Å²	140.3	83%	0.827	78%	0.776	S	S	*	*			trans	65.5	150.2	133.4	-64.6	-112.1	132.7	0	0	123.3
298	P	38.9	Very low	39.4	Very low	111 Å²	111	142.1 Å²	142.1	72%	0.721	77%	0.772	S	S	*	*			cis	-115	138.3	-32.5	35.5	-21.1	0	0	0	111.4
299	D	33.3	Very low	40.9	Very low	154 Å²	154	140 Å²	140	82%	0.824	77%	0.766	S	S	*	*			trans	-80.9	138.1	-169.2	-155.8	2	0	0	0	112.9	Q301	D299-Q301 PolarHBondContact O-N 2.77Å
300	S	47.6	Very low	42	Very low	105 Å²	105	138.9 Å²	138.9	73%	0.734	77%	0.767	S	S	*	*			trans	-70.5	108	170.9	-68.8	0	0	0	0	108.4	S302	S300-S302 PolarHBondContact O-N 2.61Å
301	Q	34.9	Very low	42.7	Very low	155 Å²	155	133.1 Å²	133.1	72%	0.724	76%	0.759	S	S	*	*			trans	-74.6	101.4	174.2	-77.2	-178.4	-24.8	0	0	110.6	D299 D305	D299-Q301 PolarHBondContact O-N 2.77Å; Q301-D305 PolarHBondContact OE1-OD2 3.2Å
302	S	40.6	Very low	43.7	Very low	90 Å²	90	131.3 Å²	131.3	63%	0.629	76%	0.755	S	S	*	*			trans	-43.4	166.2	156.5	54.6	0	0	0	0	114.3	S300 A304	S300-S302 PolarHBondContact O-N 2.61Å; S302-A304 PolarHBondContact O-N 3.5Å
303	E	44.8	Very low	44.4	Very low	192 Å²	192	130 Å²	130	90%	0.897	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.4	20.6	-170.7	-51.7	172.8	157.9	0	0	116
304	A	47.5	Very low	45.6	Very low	63 Å²	63	126.5 Å²	126.5	52%	0.521	74%	0.744	S	S	.	*	T	Hydrogen-bonded Turn	trans	-99.1	-7.6	-175.1	0	0	0	0	0	114.6	S302	S302-A304 PolarHBondContact O-N 3.5Å
305	D	43.9	Very low	46.8	Very low	77 Å²	77	130 Å²	130	41%	0.412	74%	0.743	S	S	.	*	G	3₁₀ helix	trans	-93.3	3.9	178.6	-96.2	-0.2	0	0	0	114.6	Q301 W307 R308	Q301-D305 PolarHBondContact OE1-OD2 3.2Å; D305-W307 PolarHBondContact O-N 2.96Å; D305-R308 IonicContact OD1-CZ 3.18Å; D305-R308 IonicContact OD1-NH1 2.93Å; D305-R308 PolarHBondContact OD1-NH1 2.98Å; D305-R308 IonicContact OD1-NH2 2.73Å; D305-R308 PolarHBondContact OD1-NH2 3.2Å; D305-R308 IonicContact OD2-NH2 3.78Å
306	H	45.9	Very low	48.2	Very low	167 Å²	167	134.9 Å²	134.9	77%	0.773	75%	0.745	S	S	*	*	G	3₁₀ helix	trans	-73.1	-2.3	172.9	-138.3	84.6	0	0	0	113.8
307	W	54.6	Low	49.9	Very low	217 Å²	217	132.8 Å²	132.8	82%	0.822	73%	0.728	S	S	*	*	G	3₁₀ helix	trans	-126.8	25.8	-167.4	-63.4	106.7	0	0	0	115	D305	D305-W307 PolarHBondContact O-N 2.96Å
308	R	52.8	Low	51.8	Low	193 Å²	193	126.7 Å²	126.7	73%	0.728	71%	0.705	S	S	*	*			trans	-119.1	84	169.2	-71.2	-156.9	-61.6	-69.8	-4.6	112.6	D305	D305-R308 IonicContact OD1-CZ 3.18Å; D305-R308 IonicContact OD1-NH1 2.93Å; D305-R308 PolarHBondContact OD1-NH1 2.98Å; D305-R308 IonicContact OD1-NH2 2.73Å; D305-R308 PolarHBondContact OD1-NH2 3.2Å; D305-R308 IonicContact OD2-NH2 3.78Å
309	G	64.4	Low	53.3	Low	59 Å²	59	130.2 Å²	130.2	61%	0.608	70%	0.704	S	S	*	*	S	Bend	trans	-168.7	151.9	161.8	0	0	0	0	0	109.8	A311	G309-A311 PolarHBondContact O-N 3.03Å
310	P	57.3	Low	55.1	Low	134 Å²	134	130 Å²	130	87%	0.87	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-57	128.2	171.1	-13.4	26.9	0	0	0	108
311	A	52.6	Low	56.4	Low	91 Å²	91	129.9 Å²	129.9	75%	0.752	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-51.8	129.1	-179.7	0	0	0	0	0	109.4	G309 A313	G309-A311 PolarHBondContact O-N 3.03Å; A311-A313 PolarHBondContact O-N 3.33Å
312	P	58.9	Low	58.6	Low	111 Å²	111	128 Å²	128	72%	0.721	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-55.9	133.9	167.4	24.6	-30.8	0	0	0	106.9	V314	P312-V314 VanDerWaalsContact C-N 3.29Å; P312-V314 PolarHBondContact O-N 3.48Å
313	A	47.3	Very low	60.5	Low	98 Å²	98	128.4 Å²	128.4	81%	0.81	67%	0.668	S	S	*	*			trans	-59.5	99.1	174.4	0	0	0	0	0	107.4	A311 E315	A311-A313 PolarHBondContact O-N 3.33Å; A313-E315 VanDerWaalsContact C-N 3.26Å; A313-E315 PolarHBondContact O-N 3.07Å
314	V	59.5	Low	62.3	Low	125 Å²	125	123.9 Å²	123.9	76%	0.758	65%	0.65	S	S	*	*			trans	-71.5	97.7	164.4	177.2	0	0	0	0	103.3	P312 E316	P312-V314 VanDerWaalsContact C-N 3.29Å; P312-V314 PolarHBondContact O-N 3.48Å; V314-E316 PolarHBondContact O-N 3.31Å
315	E	61.6	Low	63.9	Low	172 Å²	172	124.5 Å²	124.5	80%	0.804	64%	0.644	S	S	*	*			trans	-52.4	115.9	160.1	-74.8	179.6	156.4	0	0	105.7	A313 K317	A313-E315 VanDerWaalsContact C-N 3.26Å; A313-E315 PolarHBondContact O-N 3.07Å; E315-K317 VanDerWaalsContact C-N 3.34Å; E315-K317 PolarHBondContact O-N 3.24Å
316	E	59.6	Low	65.7	Low	185 Å²	185	127.6 Å²	127.6	86%	0.864	65%	0.651	S	S	*	*			trans	-58.6	106	170.6	-68.7	-173.8	158.9	0	0	105.5	V314 S318	V314-E316 PolarHBondContact O-N 3.31Å; E316-S318 PolarHBondContact O-N 2.85Å; E316-S318 VanDerWaalsContact O-N 3.12Å
317	K	66.9	Low	67.2	Low	113 Å²	113	124.9 Å²	124.9	49%	0.491	64%	0.637	S	S	.	*			trans	-49.3	126.5	173.1	-71.8	-178.1	172.4	-166.3	0	106.3	E315 R319 E321 E322 D325	E315-K317 VanDerWaalsContact C-N 3.34Å; E315-K317 PolarHBondContact O-N 3.24Å; K317-R319 PolarHBondContact O-N 3.38Å; K317-E321 HydrophobicContact CB-CB 4.42Å; K317-E322 HydrophobicContact CB-CG 3.97Å; K317-D325 IonicContact NZ-OD2 2.73Å; K317-D325 PolarHBondContact NZ-OD2 2.93Å
318	S	75.3	Confident	68.5	Low	48 Å²	48	120.9 Å²	120.9	34%	0.336	63%	0.627	S	S	.	*			trans	-57.9	145.4	177	63.4	0	0	0	0	107.7	E316 E320 E321 E322	E316-S318 PolarHBondContact O-N 2.85Å; E316-S318 VanDerWaalsContact O-N 3.12Å; S318-E320 PolarHBondContact O-N 3.13Å; S318-E321 PolarHBondContact N-OE2 3.09Å; S318-E321 WeakPolarHBondContact O-CA 3.43Å; S318-E321 WeakPolarHBondContact O-CB 3.42Å; S318-E321 PolarHBondContact O-N 3.25Å; S318-E321 VanDerWaalsContact OG-CD 3.23Å; S318-E321 VanDerWaalsContact OG-CG 3.29Å; S318-E321 WeakPolarHBondContact OG-CG 3.32Å; S318-E321 PolarHBondContact OG-N 3.44Å; S318-E321 PolarHBondContact OG-OE2 3.07Å; S318-E322 PolarHBondContact O-N 3.19Å; S318-E322 VanDerWaalsContact O-N 3.1Å
319	R	70.3	Confident	69.6	Low	185 Å²	185	117.7 Å²	117.7	70%	0.698	63%	0.625	S	S	*	*	H	α-helix	trans	-50.8	-26.8	177.5	175.9	172.4	175.8	-172.1	-5	112.4	K317 F323	K317-R319 PolarHBondContact O-N 3.38Å; R319-F323 HydrophobicContact CG-CD2 3.93Å; R319-F323 HydrophobicContact CG-CE2 3.48Å; R319-F323 VanDerWaalsContact CG-CE2 3.48Å; R319-F323 HydrophobicContact CG-CZ 4.36Å; R319-F323 WeakPolarHBondContact O-CD2 3.42Å; R319-F323 WeakPolarHBondContact O-CG 3.27Å; R319-F323 PolarHBondContact O-N 3.42Å
320	E	70.1	Confident	70.1	Confident	151 Å²	151	121 Å²	121	71%	0.706	63%	0.626	S	S	*	*	H	α-helix	trans	-71.1	-42.8	176.7	-58.2	176.1	-172.9	0	0	111.7	S318 F323 D324	S318-E320 PolarHBondContact O-N 3.13Å; E320-F323 PolarHBondContact O-N 3.03Å; E320-D324 PolarHBondContact O-N 2.97Å
321	E	76.8	Confident	70.3	Confident	101 Å²	101	122.2 Å²	122.2	47%	0.472	62%	0.618	S	S	.	*	H	α-helix	trans	-67.7	-34.4	174.5	-71.9	161.7	156.8	0	0	112.5	K317 S318 F323 D324 D325	K317-E321 HydrophobicContact CB-CB 4.42Å; S318-E321 PolarHBondContact N-OE2 3.09Å; S318-E321 WeakPolarHBondContact O-CA 3.43Å; S318-E321 WeakPolarHBondContact O-CB 3.42Å; S318-E321 PolarHBondContact O-N 3.25Å; S318-E321 VanDerWaalsContact OG-CD 3.23Å; S318-E321 VanDerWaalsContact OG-CG 3.29Å; S318-E321 WeakPolarHBondContact OG-CG 3.32Å; S318-E321 PolarHBondContact OG-N 3.44Å; S318-E321 PolarHBondContact OG-OE2 3.07Å; E321-F323 VanDerWaalsContact C-N 3.31Å; E321-F323 PolarHBondContact O-N 2.92Å; E321-D324 PolarHBondContact O-N 2.74Å; E321-D325 WeakPolarHBondContact O-CB 3.46Å; E321-D325 PolarHBondContact O-N 2.99Å
322	E	80.1	Confident	70.1	Confident	116 Å²	116	127.7 Å²	127.7	54%	0.542	63%	0.634	S	S	.	*	H	α-helix	trans	-66.4	-34.5	172.5	-65.3	-176.3	163.5	0	0	112.2	K317 S318 Y326	K317-E322 HydrophobicContact CB-CG 3.97Å; S318-E322 PolarHBondContact O-N 3.19Å; S318-E322 VanDerWaalsContact O-N 3.1Å; E322-Y326 WeakPolarHBondContact O-CB 3.42Å; E322-Y326 PolarHBondContact O-N 3.32Å
323	F	80.9	Confident	70.6	Confident	99 Å²	99	128.6 Å²	128.6	43%	0.434	63%	0.629	S	S	.	*	H	α-helix	trans	-71.4	-40.3	173.5	-77.3	-55.7	0	0	0	111.6	R319 E320 E321 Y326 F327	R319-F323 HydrophobicContact CG-CD2 3.93Å; R319-F323 HydrophobicContact CG-CE2 3.48Å; R319-F323 VanDerWaalsContact CG-CE2 3.48Å; R319-F323 HydrophobicContact CG-CZ 4.36Å; R319-F323 WeakPolarHBondContact O-CD2 3.42Å; R319-F323 WeakPolarHBondContact O-CG 3.27Å; R319-F323 PolarHBondContact O-N 3.42Å; E320-F323 PolarHBondContact O-N 3.03Å; E321-F323 VanDerWaalsContact C-N 3.31Å; E321-F323 PolarHBondContact O-N 2.92Å; F323-Y326 PolarHBondContact O-N 2.81Å; F323-F327 HydrophobicContact CB-CE2 4.44Å; F323-F327 WeakPolarHBondContact O-CD2 3.46Å; F323-F327 PolarHBondContact O-N 3.36Å
324	D	81.4	Confident	71.9	Confident	97 Å²	97	130.2 Å²	130.2	52%	0.519	62%	0.62	S	S	.	*	H	α-helix	trans	-67.4	-43.5	178.8	-76.5	-17.1	0	0	0	111.5	E320 E321 Y326 F327 E328	E320-D324 PolarHBondContact O-N 2.97Å; E321-D324 PolarHBondContact O-N 2.74Å; D324-Y326 VanDerWaalsContact C-N 3.28Å; D324-Y326 PolarHBondContact O-N 2.93Å; D324-F327 PolarHBondContact O-N 3.06Å; D324-F327 VanDerWaalsContact O-N 3.1Å; D324-E328 WeakPolarHBondContact O-CG 3.47Å; D324-E328 PolarHBondContact O-N 3.46Å
325	D	81.2	Confident	72.5	Confident	75 Å²	75	130.4 Å²	130.4	40%	0.401	61%	0.612	S	S	.	*	H	α-helix	trans	-57.4	-41.3	172.5	-80.3	-9.8	0	0	0	111.2	K317 E321 E328 D329	K317-D325 IonicContact NZ-OD2 2.73Å; K317-D325 PolarHBondContact NZ-OD2 2.93Å; E321-D325 WeakPolarHBondContact O-CB 3.46Å; E321-D325 PolarHBondContact O-N 2.99Å; D325-E328 PolarHBondContact O-N 3.43Å; D325-D329 PolarHBondContact O-N 2.73Å
326	Y	81.7	Confident	73.2	Confident	143 Å²	143	128 Å²	128	56%	0.561	60%	0.601	S	S	*	*	H	α-helix	trans	-67.7	-36.8	176.2	176.3	-98.9	0	0	0	112.9	E322 F323 D324 M330	E322-Y326 WeakPolarHBondContact O-CB 3.42Å; E322-Y326 PolarHBondContact O-N 3.32Å; F323-Y326 PolarHBondContact O-N 2.81Å; D324-Y326 VanDerWaalsContact C-N 3.28Å; D324-Y326 PolarHBondContact O-N 2.93Å; Y326-M330 PolarHBondContact O-N 2.99Å
327	F	78.5	Confident	74	Confident	110 Å²	110	124.4 Å²	124.4	48%	0.482	58%	0.584	S	S	.	*	H	α-helix	trans	-71	-37.1	175.7	-81	-62.8	0	0	0	111.7	F323 D324 M330 F331	F323-F327 HydrophobicContact CB-CE2 4.44Å; F323-F327 WeakPolarHBondContact O-CD2 3.46Å; F323-F327 PolarHBondContact O-N 3.36Å; D324-F327 PolarHBondContact O-N 3.06Å; D324-F327 VanDerWaalsContact O-N 3.1Å; F327-M330 PolarHBondContact O-N 3.22Å; F327-F331 HydrophobicContact CD1-CE2 4.4Å; F327-F331 WeakPolarHBondContact O-CD2 3.28Å
328	E	81	Confident	74.5	Confident	132 Å²	132	125.2 Å²	125.2	62%	0.617	59%	0.591	S	S	*	*	H	α-helix	trans	-63.9	-41.6	177.7	-73.7	-176.1	176.7	0	0	112.3	D324 D325 M330 F331	D324-E328 WeakPolarHBondContact O-CG 3.47Å; D324-E328 PolarHBondContact O-N 3.46Å; D325-E328 PolarHBondContact O-N 3.43Å; E328-M330 VanDerWaalsContact C-N 3.27Å; E328-M330 PolarHBondContact O-N 2.89Å; E328-F331 PolarHBondContact O-N 3.25Å
329	D	76.9	Confident	74.5	Confident	127 Å²	127	130.7 Å²	130.7	68%	0.679	61%	0.609	S	S	*	*	H	α-helix	trans	-69.3	-23.2	178	-159.2	39.9	0	0	0	113.1	D325	D325-D329 PolarHBondContact O-N 2.73Å
330	M	75	Confident	74.8	Confident	127 Å²	127	126.5 Å²	126.5	63%	0.626	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.4	-11.4	175	-91.9	-87.2	-80.2	0	0	114.4	Y326 F327 E328	Y326-M330 PolarHBondContact O-N 2.99Å; F327-M330 PolarHBondContact O-N 3.22Å; E328-M330 VanDerWaalsContact C-N 3.27Å; E328-M330 PolarHBondContact O-N 2.89Å
331	F	60.6	Low	75.2	Confident	160 Å²	160	124.5 Å²	124.5	70%	0.702	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.7	9.2	-177.9	-69.7	-64.7	0	0	0	114.4	F327 E328	F327-F331 HydrophobicContact CD1-CE2 4.4Å; F327-F331 WeakPolarHBondContact O-CD2 3.28Å; E328-F331 PolarHBondContact O-N 3.25Å
332	L	48.1	Very low	75	Confident	207 Å²	207	126.6 Å²	126.6	100%	1.084	60%	0.604	S	S	*	*			trans	-81.1	0	171.5	-96.4	146.4	0	0	0	113

Retrieved 332 of 332 residues in 414.7 ms (Link to these results)

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