A0A2K5KQ78_CERAT Loading...

Kelch repeat and BTB domain containing 6

As part of the CUL3(KBTBD6/7) E3 ubiquitin ligase complex functions as a substrate adapter for the RAC1 guanine exchange factor (GEF) TIAM1, mediating its 'Lys-48' ubiquitination and proteasomal degradation. By controlling this ubiquitination, regulates RAC1 signal transduction and downstream biological processes including the organization of the cytoskeleton, cell migration and cell proliferation. Ubiquitination of TIAM1 requires the membrane-associated protein GABARAP which may restrict locally the activity of the complex.

AlphaFold DB , UniProt , Accession A0A2K5KQ78, Species CERAT (Cercocebus atys, Sooty mangabey), Gene KBTBD6, Length 674 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	35.4	Very low	37.1	Very low	239 Å²	239	177.4 Å²	177.4	100%	1.177	89%	0.887	S	S	*	*				0	118.6	0	-72	-174.4	166.1	0	0	106.5
2	Q	34.9	Very low	36.8	Very low	179 Å²	179	184 Å²	184	84%	0.836	89%	0.894	S	S	*	*			cis	-149.2	123.1	10	-87.7	163.7	-32.7	0	0	104.8
3	S	34.6	Very low	36.6	Very low	116 Å²	116	182.5 Å²	182.5	81%	0.811	89%	0.891	S	S	*	*				64	123.9	87.6	67.3	0	0	0	0	116.7
4	R	40.8	Very low	36.3	Very low	233 Å²	233	176.1 Å²	176.1	88%	0.879	88%	0.883	S	S	*	*			trans	-49.4	161.9	170.7	-68.5	171	161.2	173.6	-6.9	114.6
5	E	35.6	Very low	36.1	Very low	202 Å²	202	171.9 Å²	171.9	94%	0.944	88%	0.876	S	S	*	*				-165.6	146.9	126.3	-110.2	172.2	-169.4	0	0	114.2
6	D	34.3	Very low	37.2	Very low	152 Å²	152	167.8 Å²	167.8	81%	0.813	87%	0.865	S	S	*	*			trans	-93.6	149.6	-173	-85.5	-55.2	0	0	0	113.8
7	A	36.4	Very low	37.2	Very low	91 Å²	91	172.9 Å²	172.9	75%	0.752	87%	0.871	S	S	*	*			trans	42.2	154.4	141.9	0	0	0	0	0	122.6
8	P	46.3	Very low	37.2	Very low	132 Å²	132	167.8 Å²	167.8	86%	0.857	87%	0.869	S	S	*	*				-148.6	164.5	84.4	34.2	-13.5	0	0	0	117
9	R	39.1	Very low	37.4	Very low	250 Å²	250	162.9 Å²	162.9	94%	0.943	86%	0.864	S	S	*	*			trans	-84.1	153.5	174.7	-75.1	176.3	168.6	170.4	-2.8	112.7
10	S	32.2	Very low	37.9	Very low	124 Å²	124	165.9 Å²	165.9	87%	0.867	87%	0.869	S	S	*	*			trans	-135.5	134.3	158.7	173.6	0	0	0	0	111.6
11	R	38.2	Very low	38.4	Very low	233 Å²	233	169 Å²	169	88%	0.879	87%	0.869	S	S	*	*			trans	-85.4	147.5	179.7	-85.6	173.3	162.3	170.1	-4.9	111.4
12	R	34	Very low	38.9	Very low	257 Å²	257	163.6 Å²	163.6	97%	0.97	85%	0.852	S	S	*	*			trans	-150.1	149.1	140.1	-98.4	-175.3	-162.9	-152.7	3.2	112.3
13	L	33.9	Very low	39.5	Very low	164 Å²	164	164.3 Å²	164.3	86%	0.859	85%	0.852	S	S	*	*			trans	-94.6	154.8	-164.9	-89.9	131.4	0	0	0	114.7
14	A	32.9	Very low	40.3	Very low	93 Å²	93	168.2 Å²	168.2	77%	0.769	86%	0.855	S	S	*	*			trans	59.8	146.4	142.9	0	0	0	0	0	120.1
15	S	32.8	Very low	40.9	Very low	113 Å²	113	163.9 Å²	163.9	79%	0.79	85%	0.847	S	S	*	*			cis	-171.3	-166.8	-9.7	64.6	0	0	0	0	107
16	P	53.6	Low	42	Very low	107 Å²	107	162.7 Å²	162.7	70%	0.695	84%	0.841	S	S	*	*				-105.6	161.6	-121.3	40.1	-24.6	0	0	0	115.6
17	R	37.4	Very low	43.3	Very low	255 Å²	255	164.1 Å²	164.1	96%	0.962	84%	0.84	S	S	*	*			trans	177.2	136.3	139.9	-100.9	162.7	-171.3	-157.3	3.5	111.9
18	G	36.8	Very low	44.4	Very low	81 Å²	81	163.8 Å²	163.8	84%	0.835	83%	0.83	S	S	*	*			trans	105.2	111.6	140.4	0	0	0	0	0	117.3
19	G	41.4	Very low	45.3	Very low	75 Å²	75	162 Å²	162	77%	0.773	82%	0.817	S	S	*	*			trans	97.6	89.7	144.5	0	0	0	0	0	116.3	R21	G19-R21 PolarHBondContact O-N 2.97Å; G19-R21 VanDerWaalsContact O-N 3.08Å
20	K	46.6	Very low	46.5	Very low	222 Å²	222	155 Å²	155	97%	0.965	80%	0.802	S	S	*	*			trans	-58.6	107.8	157.6	-74.2	179.5	175.7	178	0	109.1
21	R	48.6	Very low	48.1	Very low	231 Å²	231	153.1 Å²	153.1	87%	0.872	79%	0.789	S	S	*	*			trans	-99.9	133.3	153.2	-78.3	-175.8	176.9	-179.4	-0.3	108	G19 K23	G19-R21 PolarHBondContact O-N 2.97Å; G19-R21 VanDerWaalsContact O-N 3.08Å; R21-K23 PolarHBondContact O-N 3.29Å
22	P	45.8	Very low	49.5	Very low	125 Å²	125	145.5 Å²	145.5	81%	0.812	78%	0.776	S	S	*	*			trans	-63.7	124.3	178.9	25.8	-31	0	0	0	108.8	K24	P22-K24 PolarHBondContact O-N 3.26Å
23	K	48	Very low	51.1	Low	195 Å²	195	140.5 Å²	140.5	85%	0.848	76%	0.761	S	S	*	*			trans	-55.7	111.7	170.1	-70.9	179.9	176.8	-179.4	0	107.2	R21 I25	R21-K23 PolarHBondContact O-N 3.29Å; K23-I25 VanDerWaalsContact C-N 3.26Å; K23-I25 PolarHBondContact O-N 3.15Å
24	K	52.4	Low	53	Low	198 Å²	198	139.9 Å²	139.9	86%	0.861	75%	0.752	S	S	*	*			trans	-61.8	100.3	157.6	-85.6	-174.9	176.5	-179	0	105.5	P22 H26	P22-K24 PolarHBondContact O-N 3.26Å; K24-H26 PolarHBondContact O-N 3.14Å
25	I	51.7	Low	54.9	Low	142 Å²	142	142.1 Å²	142.1	73%	0.728	76%	0.756	S	S	*	*			trans	-65.4	95	167.9	-60.1	168.5	0	0	0	104.5	K23 K27	K23-I25 VanDerWaalsContact C-N 3.26Å; K23-I25 PolarHBondContact O-N 3.15Å; I25-K27 PolarHBondContact O-N 3.33Å; I25-K27 VanDerWaalsContact O-N 3.09Å
26	H	60	Low	56.9	Low	176 Å²	176	139.9 Å²	139.9	82%	0.815	75%	0.751	S	S	*	*			trans	-61.2	111.8	153.3	-93.3	-15	0	0	0	104.7	K24 P28	K24-H26 PolarHBondContact O-N 3.14Å; H26-P28 WeakPolarHBondContact O-CD 3.34Å; H26-P28 VanDerWaalsContact O-N 3.07Å
27	K	61.3	Low	58.1	Low	183 Å²	183	141.1 Å²	141.1	80%	0.796	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-48.8	121.3	168.9	-74.1	-176.6	176.7	-178.1	0	105.6	I25 T29	I25-K27 PolarHBondContact O-N 3.33Å; I25-K27 VanDerWaalsContact O-N 3.09Å; K27-T29 PolarHBondContact O-N 3.15Å
28	P	58.6	Low	60.3	Low	83 Å²	83	136.7 Å²	136.7	54%	0.539	75%	0.749	S	S	.	*	P	Polyproline II helix	trans	-58	117.8	175.9	24	-30.6	0	0	0	105.8	H26 V30 F33	H26-P28 WeakPolarHBondContact O-CD 3.34Å; H26-P28 VanDerWaalsContact O-N 3.07Å; P28-V30 PolarHBondContact O-N 2.92Å; P28-F33 HydrophobicContact CB-CE2 3.82Å; P28-F33 HydrophobicContact CB-CZ 4.09Å; P28-F33 HydrophobicContact CG-CE2 3.96Å; P28-F33 HydrophobicContact CG-CZ 4.05Å
29	T	67.1	Low	62.6	Low	94 Å²	94	141.9 Å²	141.9	58%	0.577	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-60.4	142.3	171.7	37.2	0	0	0	0	107.1	K27 S31 A32	K27-T29 PolarHBondContact O-N 3.15Å; T29-S31 WeakPolarHBondContact CB-OG 3.28Å; T29-S31 PolarHBondContact O-N 2.98Å; T29-S31 PolarHBondContact OG1-OG 3.11Å; T29-A32 WeakPolarHBondContact O-CB 3.42Å; T29-A32 PolarHBondContact O-N 3.16Å
30	V	63.7	Low	64.9	Low	105 Å²	105	145.2 Å²	145.2	64%	0.636	75%	0.751	S	S	*	*	G	3₁₀ helix	trans	-47.9	-32.8	-179.7	176.4	0	0	0	0	110.9	P28 A32 F33 F34	P28-V30 PolarHBondContact O-N 2.92Å; V30-A32 VanDerWaalsContact C-N 3.26Å; V30-A32 PolarHBondContact O-N 3.17Å; V30-F33 PolarHBondContact O-N 3.29Å; V30-F34 HydrophobicContact CG1-CD2 4.34Å; V30-F34 HydrophobicContact CG1-CE2 3.49Å; V30-F34 VanDerWaalsContact CG1-CE2 3.49Å; V30-F34 HydrophobicContact CG1-CZ 4.31Å; V30-F34 WeakPolarHBondContact O-CD2 3.47Å; V30-F34 VanDerWaalsContact O-CE2 3.26Å; V30-F34 WeakPolarHBondContact O-CE2 3.38Å
31	S	66.1	Low	67	Low	83 Å²	83	143.4 Å²	143.4	58%	0.58	74%	0.743	S	S	*	*	G	3₁₀ helix	trans	-57.1	-23.1	173.7	56.6	0	0	0	0	116.7	T29 F33	T29-S31 WeakPolarHBondContact CB-OG 3.28Å; T29-S31 PolarHBondContact O-N 2.98Å; T29-S31 PolarHBondContact OG1-OG 3.11Å; S31-F33 PolarHBondContact O-N 3.02Å
32	A	67.1	Low	69.2	Low	74 Å²	74	137.3 Å²	137.3	61%	0.612	73%	0.728	S	S	*	*	G	3₁₀ helix	trans	-75.3	-10.1	179.6	0	0	0	0	0	113.4	T29 V30	T29-A32 WeakPolarHBondContact O-CB 3.42Å; T29-A32 PolarHBondContact O-N 3.16Å; V30-A32 VanDerWaalsContact C-N 3.26Å; V30-A32 PolarHBondContact O-N 3.17Å
33	F	67.9	Low	71.5	Confident	152 Å²	152	137 Å²	137	67%	0.667	72%	0.724	S	S	*	*	G	3₁₀ helix	trans	-103.4	-6.7	-179.2	-63.5	-78.3	0	0	0	114	P28 V30 S31	P28-F33 HydrophobicContact CB-CE2 3.82Å; P28-F33 HydrophobicContact CB-CZ 4.09Å; P28-F33 HydrophobicContact CG-CE2 3.96Å; P28-F33 HydrophobicContact CG-CZ 4.05Å; V30-F33 PolarHBondContact O-N 3.29Å; S31-F33 PolarHBondContact O-N 3.02Å
34	F	72.8	Confident	73.7	Confident	151 Å²	151	130.4 Å²	130.4	66%	0.662	71%	0.706	S	S	*	*			trans	-105.9	133.1	-179.2	-62.7	-84	0	0	0	110.5	V30	V30-F34 HydrophobicContact CG1-CD2 4.34Å; V30-F34 HydrophobicContact CG1-CE2 3.49Å; V30-F34 VanDerWaalsContact CG1-CE2 3.49Å; V30-F34 HydrophobicContact CG1-CZ 4.31Å; V30-F34 WeakPolarHBondContact O-CD2 3.47Å; V30-F34 VanDerWaalsContact O-CE2 3.26Å; V30-F34 WeakPolarHBondContact O-CE2 3.38Å
35	T	74.4	Confident	75.7	Confident	140 Å²	140	126.4 Å²	126.4	86%	0.859	69%	0.69	S	S	*	*			trans	-102.7	126.5	178.4	50.9	0	0	0	0	110.8
36	G	73.4	Confident	77.7	Confident	66 Å²	66	123.6 Å²	123.6	68%	0.68	68%	0.683	S	S	*	*	S	Bend	trans	73.3	161.2	169.4	0	0	0	0	0	115
37	P	78.7	Confident	79.2	Confident	133 Å²	133	118.4 Å²	118.4	86%	0.864	67%	0.671	S	S	*	*			trans	-70.3	134.5	170	29.1	-31.7	0	0	0	110.5
38	E	84.8	Confident	80.8	Confident	162 Å²	162	112.3 Å²	112.3	76%	0.757	66%	0.655	S	S	*	*			trans	-90.5	122.2	168.8	-174.1	176.5	-173.3	0	0	108.9	L40	E38-L40 HydrophobicContact CG-CD2 3.99Å; E38-L40 HydrophobicContact CG-CG 4.33Å
39	E	85.3	Confident	82.6	Confident	189 Å²	189	112.6 Å²	112.6	88%	0.883	65%	0.651	S	S	*	*			trans	-89.9	109.8	174	-71.9	-173.3	177.1	0	0	110
40	L	89.5	Confident	83.9	Confident	146 Å²	146	110.9 Å²	110.9	76%	0.764	64%	0.638	S	S	*	*			trans	-98.4	133.2	175.4	-61.1	176.2	0	0	0	110.2	E38	E38-L40 HydrophobicContact CG-CD2 3.99Å; E38-L40 HydrophobicContact CG-CG 4.33Å
41	K	91.1	Very high	85.4	Confident	184 Å²	184	108.7 Å²	108.7	80%	0.8	63%	0.631	S	S	*	*			trans	-116.7	114.1	178.6	-174.7	177.9	-179.7	178.7	0	110.9	T43	K41-T43 PolarHBondContact O-N 3.45Å
42	D	93.6	Very high	86.8	Confident	103 Å²	103	110 Å²	110	55%	0.551	63%	0.628	S	S	*	*			trans	-79.1	108.9	168.2	179.2	3	0	0	0	109.7	A44 H45	D42-A44 VanDerWaalsContact C-N 3.32Å; D42-A44 WeakPolarHBondContact OD1-CB 3.33Å; D42-A44 PolarHBondContact OD1-N 2.68Å; D42-H45 HydrophobicContact CB-CB 4.06Å; D42-H45 PolarHBondContact OD1-N 3.18Å
43	T	94	Very high	88.2	Confident	117 Å²	117	108.3 Å²	108.3	72%	0.718	61%	0.609	S	S	*	*	S	Bend	trans	-75.7	-18.2	-179.9	54.2	0	0	0	0	113.4	K41	K41-T43 PolarHBondContact O-N 3.45Å
44	A	94.2	Very high	89.5	Confident	58 Å²	58	102.7 Å²	102.7	48%	0.479	58%	0.584	S	S	.	*	S	Bend	trans	-88.3	-17.6	179	0	0	0	0	0	112.7	D42 S46 A47 A48	D42-A44 VanDerWaalsContact C-N 3.32Å; D42-A44 WeakPolarHBondContact OD1-CB 3.33Å; D42-A44 PolarHBondContact OD1-N 2.68Å; A44-S46 PolarHBondContact O-N 3.27Å; A44-A47 PolarHBondContact O-N 3.33Å; A44-A48 WeakPolarHBondContact O-CB 3.3Å; A44-A48 PolarHBondContact O-N 2.97Å
45	H	95.4	Very high	90.6	Very high	113 Å²	113	98.4 Å²	98.4	52%	0.523	57%	0.573	S	S	.	*	H	α-helix	trans	-52.7	-47.9	-174.4	-175.3	67.5	0	0	0	113.6	D42 A48 L49	D42-H45 HydrophobicContact CB-CB 4.06Å; D42-H45 PolarHBondContact OD1-N 3.18Å; H45-A48 PolarHBondContact O-N 3.38Å; H45-L49 VanDerWaalsContact O-CB 3.26Å; H45-L49 WeakPolarHBondContact O-CB 3.26Å; H45-L49 PolarHBondContact O-N 2.92Å
46	S	92	Very high	91.6	Very high	83 Å²	83	94.9 Å²	94.9	58%	0.58	55%	0.545	S	S	*	.	H	α-helix	trans	-65.8	-41.5	-176.9	54.5	0	0	0	0	113	A44 L50	A44-S46 PolarHBondContact O-N 3.27Å; S46-L50 WeakPolarHBondContact O-CB 3.4Å; S46-L50 PolarHBondContact O-N 3.06Å
47	A	92.8	Very high	92.6	Very high	67 Å²	67	93.1 Å²	93.1	55%	0.554	52%	0.518	S	S	*	.	H	α-helix	trans	-68.1	-42.4	177.8	0	0	0	0	0	111.4	A44 L50 A51	A44-A47 PolarHBondContact O-N 3.33Å; A47-L50 PolarHBondContact O-N 3.44Å; A47-A51 WeakPolarHBondContact O-CB 3.4Å; A47-A51 PolarHBondContact O-N 3.21Å
48	A	94.7	Very high	93.3	Very high	56 Å²	56	91.3 Å²	91.3	46%	0.463	50%	0.502	S	S	.	.	H	α-helix	trans	-64.8	-43.6	176.6	0	0	0	0	0	111.9	A44 H45 A51 Q52	A44-A48 WeakPolarHBondContact O-CB 3.3Å; A44-A48 PolarHBondContact O-N 2.97Å; H45-A48 PolarHBondContact O-N 3.38Å; A48-A51 PolarHBondContact O-N 3.43Å; A48-Q52 WeakPolarHBondContact O-CG 3.48Å; A48-Q52 PolarHBondContact O-N 3.33Å
49	L	95.1	Very high	93.8	Very high	89 Å²	89	86.2 Å²	86.2	47%	0.466	49%	0.487	S	S	.	.	H	α-helix	trans	-59.3	-49	176	176.5	63.5	0	0	0	111.4	H45 A51 Q52 L53	H45-L49 VanDerWaalsContact O-CB 3.26Å; H45-L49 WeakPolarHBondContact O-CB 3.26Å; H45-L49 PolarHBondContact O-N 2.92Å; L49-A51 VanDerWaalsContact C-N 3.33Å; L49-A51 PolarHBondContact O-N 3.05Å; L49-Q52 PolarHBondContact O-N 2.84Å; L49-L53 HydrophobicContact CG-CD1 4.25Å; L49-L53 WeakPolarHBondContact O-CG 3.47Å; L49-L53 PolarHBondContact O-N 3.12Å
50	L	94.8	Very high	94.2	Very high	57 Å²	57	86.1 Å²	86.1	30%	0.298	48%	0.479	S	S	.	.	H	α-helix	trans	-63.9	-39.3	-179.5	-172.9	62.3	0	0	0	111.8	S46 A47 Q52 L53 K54 Y130	S46-L50 WeakPolarHBondContact O-CB 3.4Å; S46-L50 PolarHBondContact O-N 3.06Å; A47-L50 PolarHBondContact O-N 3.44Å; L50-Q52 VanDerWaalsContact C-N 3.32Å; L50-Q52 PolarHBondContact O-N 3.17Å; L50-L53 PolarHBondContact O-N 3.19Å; L50-K54 PolarHBondContact O-N 3.38Å; L50-Y130 VanDerWaalsContact CD1-O 3.32Å; L50-Y130 WeakPolarHBondContact CD1-O 3.31Å; L50-Y130 WeakPolarHBondContact CG-O 3.16Å
51	A	94.9	Very high	94.4	Very high	59 Å²	59	84.1 Å²	84.1	49%	0.488	47%	0.465	S	S	.	.	H	α-helix	trans	-61.3	-38.7	173.9	0	0	0	0	0	112.6	A47 A48 L49 K54 S55	A47-A51 WeakPolarHBondContact O-CB 3.4Å; A47-A51 PolarHBondContact O-N 3.21Å; A48-A51 PolarHBondContact O-N 3.43Å; L49-A51 VanDerWaalsContact C-N 3.33Å; L49-A51 PolarHBondContact O-N 3.05Å; A51-K54 PolarHBondContact O-N 3.47Å; A51-S55 PolarHBondContact O-N 2.99Å
52	Q	96.2	Very high	94.5	Very high	111 Å²	111	81.7 Å²	81.7	52%	0.519	46%	0.461	S	S	.	.	H	α-helix	trans	-68.1	-41.2	174.3	-68.2	-59.1	-41.5	0	0	112.1	A48 L49 L50 K54 S55 F56	A48-Q52 WeakPolarHBondContact O-CG 3.48Å; A48-Q52 PolarHBondContact O-N 3.33Å; L49-Q52 PolarHBondContact O-N 2.84Å; L50-Q52 VanDerWaalsContact C-N 3.32Å; L50-Q52 PolarHBondContact O-N 3.17Å; Q52-K54 VanDerWaalsContact C-N 3.31Å; Q52-K54 PolarHBondContact O-N 3.17Å; Q52-S55 WeakPolarHBondContact O-CB 3.45Å; Q52-S55 PolarHBondContact O-N 2.84Å; Q52-S55 VanDerWaalsContact O-N 3.13Å; Q52-F56 WeakPolarHBondContact O-CG 3.15Å; Q52-F56 PolarHBondContact O-N 3.3Å
53	L	95.6	Very high	94.5	Very high	39 Å²	39	78.7 Å²	78.7	20%	0.204	45%	0.447	C	S	.	.	H	α-helix	trans	-60.8	-40.6	174.7	-68.9	170	0	0	0	111.8	L49 L50 F56 Y57 V88 Y130	L49-L53 HydrophobicContact CG-CD1 4.25Å; L49-L53 WeakPolarHBondContact O-CG 3.47Å; L49-L53 PolarHBondContact O-N 3.12Å; L50-L53 PolarHBondContact O-N 3.19Å; L53-F56 HydrophobicContact CD2-CD2 4.49Å; L53-F56 PolarHBondContact O-N 3.15Å; L53-Y57 PolarHBondContact O-N 2.75Å; L53-V88 HydrophobicContact CB-CG2 4.45Å; L53-V88 HydrophobicContact CD1-CG2 4.05Å; L53-V88 HydrophobicContact CD2-CG2 4.27Å; L53-Y130 HydrophobicContact CB-CD1 4.28Å
54	K	95.4	Very high	94.4	Very high	34 Å²	34	76.7 Å²	76.7	15%	0.148	43%	0.432	C	S	.	.	H	α-helix	trans	-61.4	-42.6	172.6	-178.5	59.5	165.6	73.8	0	111.9	L50 A51 Q52 F56 Y57 D58 D127 Y130 T131	L50-K54 PolarHBondContact O-N 3.38Å; A51-K54 PolarHBondContact O-N 3.47Å; Q52-K54 VanDerWaalsContact C-N 3.31Å; Q52-K54 PolarHBondContact O-N 3.17Å; K54-F56 VanDerWaalsContact C-N 3.3Å; K54-F56 PolarHBondContact O-N 2.85Å; K54-Y57 HydrophobicContact CD-CD1 4.18Å; K54-Y57 WeakPolarHBondContact O-CB 3.32Å; K54-Y57 PolarHBondContact O-N 3.09Å; K54-D58 IonicContact NZ-OD1 3.57Å; K54-D58 PolarHBondContact NZ-OD1 3.07Å; K54-D58 IonicContact NZ-OD2 2.67Å; K54-D58 PolarHBondContact NZ-OD2 2.88Å; K54-D58 PolarHBondContact O-N 3.29Å; K54-D127 WeakPolarHBondContact CE-OD1 3.5Å; K54-D127 IonicContact NZ-OD1 3.29Å; K54-D127 PolarHBondContact NZ-OD1 3.38Å; K54-Y130 HydrophobicContact CD-CG 4.34Å; K54-T131 HydrophobicContact CD-CG2 3.93Å; K54-T131 HydrophobicContact CG-CG2 4.16Å
55	S	96.5	Very high	94.4	Very high	61 Å²	61	74 Å²	74	43%	0.427	41%	0.41	S	S	.	.	H	α-helix	trans	-61	-37.8	176.2	-174.3	0	0	0	0	112.5	A51 Q52 A59	A51-S55 PolarHBondContact O-N 2.99Å; Q52-S55 WeakPolarHBondContact O-CB 3.45Å; Q52-S55 PolarHBondContact O-N 2.84Å; Q52-S55 VanDerWaalsContact O-N 3.13Å; S55-A59 WeakPolarHBondContact O-CB 3.14Å; S55-A59 PolarHBondContact O-N 3.33Å; S55-A59 VanDerWaalsContact O-N 3.08Å
56	F	95.5	Very high	94.4	Very high	65 Å²	65	70.7 Å²	70.7	29%	0.285	40%	0.397	S	S	.	.	H	α-helix	trans	-67.4	-41.4	175	-63.6	-30.7	0	0	0	111.9	Q52 L53 K54 A59 R60 Q61 L62	Q52-F56 WeakPolarHBondContact O-CG 3.15Å; Q52-F56 PolarHBondContact O-N 3.3Å; L53-F56 HydrophobicContact CD2-CD2 4.49Å; L53-F56 PolarHBondContact O-N 3.15Å; K54-F56 VanDerWaalsContact C-N 3.3Å; K54-F56 PolarHBondContact O-N 2.85Å; F56-A59 CarbonylContact O-C 3.5Å; F56-A59 PolarHBondContact O-N 3.21Å; F56-R60 PolarHBondContact O-N 3.31Å; F56-Q61 HydrophobicContact CB-CB 4.38Å; F56-Q61 PolarHBondContact O-N 3.25Å; F56-L62 HydrophobicContact CD2-CD1 4.27Å; F56-L62 HydrophobicContact CE2-CD1 4.36Å
57	Y	94.5	Very high	94.4	Very high	29 Å²	29	66.7 Å²	66.7	11%	0.114	37%	0.37	C	S	.	.	H	α-helix	trans	-59.2	-48.4	174.1	172.3	-102.2	0	0	0	112	L53 K54 A59 R60 P83 V126 Y130	L53-Y57 PolarHBondContact O-N 2.75Å; K54-Y57 HydrophobicContact CD-CD1 4.18Å; K54-Y57 WeakPolarHBondContact O-CB 3.32Å; K54-Y57 PolarHBondContact O-N 3.09Å; Y57-A59 VanDerWaalsContact C-N 3.3Å; Y57-A59 PolarHBondContact O-N 3.27Å; Y57-R60 WeakPolarHBondContact O-CA 3.25Å; Y57-R60 PolarHBondContact O-N 3.1Å; Y57-P83 WeakPolarHBondContact CD2-O 3.14Å; Y57-P83 VanDerWaalsContact CE2-O 3.28Å; Y57-P83 WeakPolarHBondContact CE2-O 3.41Å; Y57-V126 HydrophobicContact CE1-CG1 4.33Å; Y57-V126 HydrophobicContact CE2-CG1 3.79Å; Y57-V126 WeakPolarHBondContact OH-CG1 3.28Å; Y57-Y130 HydrophobicContact CD2-CD2 4.46Å; Y57-Y130 HydrophobicContact CD2-CE1 4.48Å; Y57-Y130 AromaticContact CD2-CE2 3.83Å; Y57-Y130 HydrophobicContact CD2-CE2 3.83Å; Y57-Y130 AromaticContact CD2-CZ 3.82Å; Y57-Y130 HydrophobicContact CE2-CE2 4.32Å; Y57-Y130 HydrophobicContact CG-CD1 4.47Å; Y57-Y130 HydrophobicContact CG-CD2 4.29Å; Y57-Y130 HydrophobicContact CG-CE1 4.21Å; Y57-Y130 HydrophobicContact CG-CE2 4.03Å; Y57-Y130 AromaticContact CG-CZ 3.97Å
58	D	94.1	Very high	94.4	Very high	96 Å²	96	65 Å²	65	51%	0.513	35%	0.35	S	S	.	.	H	α-helix	trans	-63.3	-36.8	179.8	-69.8	-24.4	0	0	0	112.5	K54 R60	K54-D58 IonicContact NZ-OD1 3.57Å; K54-D58 PolarHBondContact NZ-OD1 3.07Å; K54-D58 IonicContact NZ-OD2 2.67Å; K54-D58 PolarHBondContact NZ-OD2 2.88Å; K54-D58 PolarHBondContact O-N 3.29Å; D58-R60 VanDerWaalsContact C-N 3.26Å; D58-R60 PolarHBondContact O-N 2.93Å
59	A	95.1	Very high	94.3	Very high	55 Å²	55	62.4 Å²	62.4	46%	0.455	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-2.5	174.9	0	0	0	0	0	113.8	S55 F56 Y57 Q61	S55-A59 WeakPolarHBondContact O-CB 3.14Å; S55-A59 PolarHBondContact O-N 3.33Å; S55-A59 VanDerWaalsContact O-N 3.08Å; F56-A59 CarbonylContact O-C 3.5Å; F56-A59 PolarHBondContact O-N 3.21Å; Y57-A59 VanDerWaalsContact C-N 3.3Å; Y57-A59 PolarHBondContact O-N 3.27Å; A59-Q61 HydrophobicContact CB-CG 3.92Å; A59-Q61 PolarHBondContact O-N 2.99Å
60	R	94.2	Very high	93.9	Very high	187 Å²	187	59.1 Å²	59.1	71%	0.706	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.2	38.2	-174	-54.4	-179.1	-179.5	-173.1	-1	113.3	F56 Y57 D58 P83	F56-R60 PolarHBondContact O-N 3.31Å; Y57-R60 WeakPolarHBondContact O-CA 3.25Å; Y57-R60 PolarHBondContact O-N 3.1Å; D58-R60 VanDerWaalsContact C-N 3.26Å; D58-R60 PolarHBondContact O-N 2.93Å; R60-P83 HydrophobicContact CG-CG 4.13Å
61	Q	93	Very high	93	Very high	103 Å²	103	59.4 Å²	59.4	48%	0.481	32%	0.316	S	S	.	.			trans	-97.5	142.2	178.7	-67.3	-176.5	-11.5	0	0	110.9	F56 A59 C63	F56-Q61 HydrophobicContact CB-CB 4.38Å; F56-Q61 PolarHBondContact O-N 3.25Å; A59-Q61 HydrophobicContact CB-CG 3.92Å; A59-Q61 PolarHBondContact O-N 2.99Å; Q61-C63 PolarHBondContact O-N 3.04Å; Q61-C63 VanDerWaalsContact O-N 3.08Å
62	L	92.8	Very high	91.6	Very high	134 Å²	134	62 Å²	62	70%	0.702	33%	0.328	S	S	*	.	S	Bend	trans	59.6	16.9	176.5	-52.5	173.8	0	0	0	114.7	F56 D64 N85	F56-L62 HydrophobicContact CD2-CD1 4.27Å; F56-L62 HydrophobicContact CE2-CD1 4.36Å; L62-D64 PolarHBondContact O-N 3.34Å; L62-N85 PolarHBondContact O-ND2 3.23Å
63	C	92.8	Very high	90.2	Very high	40 Å²	40	61 Å²	61	27%	0.27	35%	0.348	S	S	.	.			trans	-67.8	128.6	174.3	-56.2	0	0	0	0	110.3	Q61 P83 C84	Q61-C63 PolarHBondContact O-N 3.04Å; Q61-C63 VanDerWaalsContact O-N 3.08Å; C63-P83 HydrophobicContact CB-CB 4.04Å; C63-C84 CarbonylContact C-O 3.52Å; C63-C84 VanDerWaalsContact CA-O 3.3Å; C63-C84 WeakPolarHBondContact CA-O 3.41Å; C63-C84 WeakPolarHBondContact CB-O 3.31Å
64	D	93.8	Very high	88.8	Confident	75 Å²	75	61 Å²	61	40%	0.401	35%	0.351	S	S	.	.			trans	-121.3	3.6	-173.4	63	-14.4	0	0	0	112.9	L62 C84 N85 R86	L62-D64 PolarHBondContact O-N 3.34Å; D64-C84 PolarHBondContact N-O 3.25Å; D64-C84 VanDerWaalsContact N-O 3.08Å; D64-N85 VanDerWaalsContact OD1-CA 3.24Å; D64-N85 WeakPolarHBondContact OD1-CA 3.37Å; D64-R86 PolarHBondContact O-NE 3.1Å; D64-R86 WeakPolarHBondContact OD1-CG 3.3Å; D64-R86 PolarHBondContact OD1-N 3.01Å
65	V	93.9	Very high	87.2	Confident	2 Å²	2	61.1 Å²	61.1	1%	0.012	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	145.3	170.7	65.5	0	0	0	0	110.3	I67 C84 R86 F100 V112	V65-I67 HydrophobicContact CG2-CD1 3.86Å; V65-C84 HydrophobicContact CG1-CB 4.13Å; V65-C84 PolarHBondContact N-O 2.85Å; V65-C84 PolarHBondContact O-N 3.26Å; V65-R86 HydrophobicContact CB-CG 3.68Å; V65-R86 HydrophobicContact CG1-CG 3.58Å; V65-F100 HydrophobicContact CG1-CZ 4.24Å; V65-F100 HydrophobicContact CG2-CE1 4.31Å; V65-F100 HydrophobicContact CG2-CZ 4.15Å; V65-V112 HydrophobicContact CG2-CG2 4.29Å
66	T	94.2	Very high	85.5	Confident	42 Å²	42	64.9 Å²	64.9	26%	0.258	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	124.8	168.2	-56.4	0	0	0	0	109.1	L81 F82 T110 S111 V112	T66-L81 HydrophobicContact CG2-CB 4.03Å; T66-L81 HydrophobicContact CG2-CD2 4.14Å; T66-F82 WeakPolarHBondContact CA-O 3.46Å; T66-T110 PolarHBondContact N-O 3.03Å; T66-S111 CarbonylContact O-C 3.42Å; T66-S111 VanDerWaalsContact O-CA 3.25Å; T66-S111 WeakPolarHBondContact O-CA 3.37Å; T66-V112 PolarHBondContact O-N 3.34Å
67	I	93.1	Very high	84.1	Confident	0 Å²	0	65 Å²	65	0%	0	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	120.4	173.7	-50.5	-59.2	0	0	0	108.3	V65 V69 F82 L89 F96 F100 V112 M114 F122	V65-I67 HydrophobicContact CG2-CD1 3.86Å; I67-V69 HydrophobicContact CG2-CG2 4.3Å; I67-F82 HydrophobicContact CB-CB 4.38Å; I67-F82 PolarHBondContact N-O 3.16Å; I67-F82 PolarHBondContact O-N 3.29Å; I67-L89 HydrophobicContact CG1-CD1 4.41Å; I67-F96 HydrophobicContact CD1-CE1 4.05Å; I67-F100 HydrophobicContact CD1-CZ 4.4Å; I67-V112 CarbonylContact C-O 3.54Å; I67-V112 WeakPolarHBondContact CA-O 3.38Å; I67-V112 HydrophobicContact CD1-CB 3.9Å; I67-V112 HydrophobicContact CD1-CG2 4.46Å; I67-M114 HydrophobicContact CG2-CE 3.83Å; I67-M114 HydrophobicContact CG2-CG 3.92Å; I67-M114 HydrophobicContact CG2-SD 4.11Å; I67-F122 HydrophobicContact CB-CE1 3.98Å; I67-F122 HydrophobicContact CB-CZ 4.01Å; I67-F122 HydrophobicContact CG1-CZ 4.17Å; I67-F122 HydrophobicContact CG2-CE1 3.86Å; I67-F122 HydrophobicContact CG2-CZ 3.69Å
68	E	92.7	Very high	83.2	Confident	32 Å²	32	67.6 Å²	67.6	15%	0.15	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	115.5	172.3	-178.5	177.3	-176	0	0	108.9	V70 G79 L81 V112 T113 M114	E68-V70 HydrophobicContact CG-CG2 4.16Å; E68-G79 PolarHBondContact OE1-N 3.06Å; E68-L81 HydrophobicContact CB-CD2 3.63Å; E68-L81 HydrophobicContact CG-CD2 3.71Å; E68-V112 PolarHBondContact N-O 3.28Å; E68-T113 HydrophobicContact CB-CG2 4.13Å; E68-T113 HydrophobicContact CG-CG2 4.5Å; E68-T113 CarbonylContact O-C 3.58Å; E68-T113 WeakPolarHBondContact O-CA 3.2Å; E68-M114 PolarHBondContact O-N 3.4Å
69	V	92.4	Very high	82.5	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	113.5	175.6	-177.7	0	0	0	0	108.9	I67 G79 R80 F82 M114 V117 A119 F122	I67-V69 HydrophobicContact CG2-CG2 4.3Å; V69-G79 CarbonylContact O-C 3.54Å; V69-G79 WeakPolarHBondContact O-CA 3.35Å; V69-R80 PolarHBondContact N-O 3.33Å; V69-R80 PolarHBondContact O-N 3.2Å; V69-F82 HydrophobicContact CB-CD2 4.48Å; V69-F82 HydrophobicContact CB-CE2 4.01Å; V69-F82 HydrophobicContact CG2-CD2 3.85Å; V69-F82 HydrophobicContact CG2-CE2 3.7Å; V69-M114 HydrophobicContact CG2-CE 3.93Å; V69-V117 WeakPolarHBondContact CG1-O 3.38Å; V69-A119 HydrophobicContact CB-CB 4.36Å; V69-A119 HydrophobicContact CG1-CB 4.13Å; V69-F122 HydrophobicContact CG2-CB 4.01Å; V69-F122 HydrophobicContact CG2-CD1 3.43Å; V69-F122 VanDerWaalsContact CG2-CD1 3.43Å; V69-F122 HydrophobicContact CG2-CD2 4.41Å; V69-F122 HydrophobicContact CG2-CE1 3.95Å; V69-F122 HydrophobicContact CG2-CG 3.67Å
70	V	86.7	Confident	82.3	Confident	21 Å²	21	66.2 Å²	66.2	13%	0.127	40%	0.404	C	S	.	.	P	Polyproline II helix	trans	-93.1	119.4	-176.9	-177.4	0	0	0	0	109.3	E68 M114	E68-V70 HydrophobicContact CG-CG2 4.16Å; V70-M114 PolarHBondContact N-O 3.09Å
71	T	74.7	Confident	82.3	Confident	62 Å²	62	62.3 Å²	62.3	38%	0.38	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-70.2	135.6	173.3	28.9	0	0	0	0	110.4	G73 S74	T71-G73 PolarHBondContact O-N 2.74Å; T71-S74 WeakPolarHBondContact O-CB 3.42Å; T71-S74 PolarHBondContact O-N 3.13Å; T71-S74 VanDerWaalsContact O-N 3.13Å; T71-S74 PolarHBondContact O-OG 3.32Å; T71-S74 PolarHBondContact OG1-OG 2.91Å
72	P	67.4	Low	82.4	Confident	114 Å²	114	57.6 Å²	57.6	74%	0.74	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	130.4	176.5	-24	32.4	0	0	0	111.4	S74	P72-S74 VanDerWaalsContact C-N 3.35Å
73	G	66	Low	82.5	Confident	91 Å²	91	52.6 Å²	52.6	94%	0.938	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.8	-2	179.7	0	0	0	0	0	115.6	T71	T71-G73 PolarHBondContact O-N 2.74Å
74	S	65.2	Low	82.6	Confident	37 Å²	37	50.7 Å²	50.7	26%	0.259	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-85.8	146.5	171.5	76.7	0	0	0	0	110.8	T71 P72 T78	T71-S74 WeakPolarHBondContact O-CB 3.42Å; T71-S74 PolarHBondContact O-N 3.13Å; T71-S74 VanDerWaalsContact O-N 3.13Å; T71-S74 PolarHBondContact O-OG 3.32Å; T71-S74 PolarHBondContact OG1-OG 2.91Å; P72-S74 VanDerWaalsContact C-N 3.35Å; S74-T78 WeakPolarHBondContact CB-OG1 3.42Å; S74-T78 PolarHBondContact OG-OG1 3.21Å
75	G	61.8	Low	82.6	Confident	37 Å²	37	47.5 Å²	47.5	38%	0.381	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-67.2	167.8	-177.6	0	0	0	0	0	112.8	G77 T78	G75-G77 PolarHBondContact O-N 2.85Å; G75-T78 PolarHBondContact N-OG1 3.16Å; G75-T78 PolarHBondContact O-N 2.82Å; G75-T78 PolarHBondContact O-OG1 2.87Å
76	P	61.1	Low	82.6	Confident	141 Å²	141	49.1 Å²	49.1	92%	0.916	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	127.9	174.4	22.3	-30.3	0	0	0	110.8
77	G	66.3	Low	82.6	Confident	66 Å²	66	52 Å²	52	68%	0.68	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.5	10.6	177.6	0	0	0	0	0	116.4	G75	G75-G77 PolarHBondContact O-N 2.85Å
78	T	75.2	Confident	82.7	Confident	85 Å²	85	52.5 Å²	52.5	52%	0.521	34%	0.342	S	S	.	.			trans	-100	14	173.9	54.6	0	0	0	0	113.9	S74 G75	S74-T78 WeakPolarHBondContact CB-OG1 3.42Å; S74-T78 PolarHBondContact OG-OG1 3.21Å; G75-T78 PolarHBondContact N-OG1 3.16Å; G75-T78 PolarHBondContact O-N 2.82Å; G75-T78 PolarHBondContact O-OG1 2.87Å
79	G	80.8	Confident	82.8	Confident	15 Å²	15	51 Å²	51	16%	0.155	34%	0.336	C	S	.	.	P	Polyproline II helix	trans	-69.9	155	178.9	0	0	0	0	0	113.2	E68 V69	E68-G79 PolarHBondContact OE1-N 3.06Å; V69-G79 CarbonylContact O-C 3.54Å; V69-G79 WeakPolarHBondContact O-CA 3.35Å
80	R	91.2	Very high	82.9	Confident	106 Å²	106	51.8 Å²	51.8	40%	0.4	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	129.8	173.4	-172.7	173.9	176.8	-161.1	-1.5	109.3	V69 F82 A119 E123	V69-R80 PolarHBondContact N-O 3.33Å; V69-R80 PolarHBondContact O-N 3.2Å; R80-F82 HydrophobicContact CB-CE2 3.86Å; R80-F82 HydrophobicContact CB-CZ 4.31Å; R80-F82 HydrophobicContact CG-CD2 4.5Å; R80-F82 HydrophobicContact CG-CE2 3.71Å; R80-F82 HydrophobicContact CG-CZ 3.77Å; R80-F82 WeakPolarHBondContact O-CD2 3.46Å; R80-F82 WeakPolarHBondContact O-CE2 3.46Å; R80-A119 HydrophobicContact CB-CB 3.96Å; R80-E123 IonicContact CZ-OE1 3.08Å; R80-E123 IonicContact CZ-OE2 3.93Å; R80-E123 IonicContact NH1-OE1 3.68Å; R80-E123 IonicContact NH1-OE2 3.97Å; R80-E123 PolarHBondContact NH1-OE2 3.31Å; R80-E123 IonicContact NH2-OE1 3.12Å; R80-E123 PolarHBondContact NH2-OE1 2.91Å; R80-E123 IonicContact NH2-OE2 3.73Å; R80-E123 PolarHBondContact NH2-OE2 3.3Å
81	L	93	Very high	83.3	Confident	105 Å²	105	55 Å²	55	55%	0.55	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	133	-175.6	-58.5	176.8	0	0	0	112	T66 E68	T66-L81 HydrophobicContact CG2-CB 4.03Å; T66-L81 HydrophobicContact CG2-CD2 4.14Å; E68-L81 HydrophobicContact CB-CD2 3.63Å; E68-L81 HydrophobicContact CG-CD2 3.71Å
82	F	94.6	Very high	84.3	Confident	5 Å²	5	53.9 Å²	53.9	2%	0.022	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	99	-179.9	-63.2	-90.7	0	0	0	110.3	T66 I67 V69 R80 C84 A119 F122 E123	T66-F82 WeakPolarHBondContact CA-O 3.46Å; I67-F82 HydrophobicContact CB-CB 4.38Å; I67-F82 PolarHBondContact N-O 3.16Å; I67-F82 PolarHBondContact O-N 3.29Å; V69-F82 HydrophobicContact CB-CD2 4.48Å; V69-F82 HydrophobicContact CB-CE2 4.01Å; V69-F82 HydrophobicContact CG2-CD2 3.85Å; V69-F82 HydrophobicContact CG2-CE2 3.7Å; R80-F82 HydrophobicContact CB-CE2 3.86Å; R80-F82 HydrophobicContact CB-CZ 4.31Å; R80-F82 HydrophobicContact CG-CD2 4.5Å; R80-F82 HydrophobicContact CG-CE2 3.71Å; R80-F82 HydrophobicContact CG-CZ 3.77Å; R80-F82 WeakPolarHBondContact O-CD2 3.46Å; R80-F82 WeakPolarHBondContact O-CE2 3.46Å; F82-C84 PolarHBondContact O-N 2.73Å; F82-C84 PolarHBondContact O-SG 3.09Å; F82-A119 HydrophobicContact CE2-CB 4.41Å; F82-A119 HydrophobicContact CZ-CB 4.35Å; F82-A119 WeakPolarHBondContact CZ-O 3.4Å; F82-F122 HydrophobicContact CB-CD1 4.44Å; F82-F122 HydrophobicContact CB-CE1 3.91Å; F82-F122 HydrophobicContact CD1-CD1 4.12Å; F82-F122 HydrophobicContact CD1-CE1 4.35Å; F82-F122 AromaticContact CD2-CD1 3.6Å; F82-F122 HydrophobicContact CD2-CD1 3.6Å; F82-F122 AromaticContact CD2-CE1 3.81Å; F82-F122 HydrophobicContact CD2-CE1 3.81Å; F82-F122 HydrophobicContact CE1-CD1 4.24Å; F82-F122 AromaticContact CE2-CD1 3.73Å; F82-F122 HydrophobicContact CE2-CD1 3.73Å; F82-F122 HydrophobicContact CE2-CE1 4.41Å; F82-F122 AromaticContact CG-CD1 3.79Å; F82-F122 HydrophobicContact CG-CD1 3.79Å; F82-F122 AromaticContact CG-CE1 3.76Å; F82-F122 HydrophobicContact CG-CE1 3.76Å; F82-F122 HydrophobicContact CZ-CD1 4.04Å; F82-E123 HydrophobicContact CE1-CB 3.82Å; F82-E123 HydrophobicContact CE1-CG 4.27Å; F82-E123 HydrophobicContact CZ-CB 4.28Å
83	P	95.3	Very high	85.7	Confident	28 Å²	28	48.6 Å²	48.6	18%	0.182	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	117.8	174.2	29.4	-31.5	0	0	0	110.2	Y57 R60 C63	Y57-P83 WeakPolarHBondContact CD2-O 3.14Å; Y57-P83 VanDerWaalsContact CE2-O 3.28Å; Y57-P83 WeakPolarHBondContact CE2-O 3.41Å; R60-P83 HydrophobicContact CG-CG 4.13Å; C63-P83 HydrophobicContact CB-CB 4.04Å
84	C	95.4	Very high	87.1	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	171.6	-171.4	-61.5	0	0	0	0	111.8	C63 D64 V65 F82 L89	C63-C84 CarbonylContact C-O 3.52Å; C63-C84 VanDerWaalsContact CA-O 3.3Å; C63-C84 WeakPolarHBondContact CA-O 3.41Å; C63-C84 WeakPolarHBondContact CB-O 3.31Å; D64-C84 PolarHBondContact N-O 3.25Å; D64-C84 VanDerWaalsContact N-O 3.08Å; V65-C84 HydrophobicContact CG1-CB 4.13Å; V65-C84 PolarHBondContact N-O 2.85Å; V65-C84 PolarHBondContact O-N 3.26Å; F82-C84 PolarHBondContact O-N 2.73Å; F82-C84 PolarHBondContact O-SG 3.09Å; C84-L89 HydrophobicContact CB-CD1 3.57Å; C84-L89 HydrophobicContact CB-CG 4.14Å
85	N	94.8	Very high	88.5	Confident	9 Å²	9	48.2 Å²	48.2	5%	0.048	31%	0.305	C	S	.	.			trans	-102.2	121	170.5	-46.7	97.9	0	0	0	109.7	L62 D64 N87 V88 L89 Y130	L62-N85 PolarHBondContact O-ND2 3.23Å; D64-N85 VanDerWaalsContact OD1-CA 3.24Å; D64-N85 WeakPolarHBondContact OD1-CA 3.37Å; N85-N87 VanDerWaalsContact C-N 3.25Å; N85-N87 WeakPolarHBondContact CB-OD1 3.5Å; N85-N87 PolarHBondContact O-N 2.97Å; N85-V88 HydrophobicContact CB-CB 4.41Å; N85-V88 HydrophobicContact CB-CG2 4.07Å; N85-V88 PolarHBondContact O-N 2.75Å; N85-L89 PolarHBondContact O-N 3.33Å; N85-L89 VanDerWaalsContact O-N 3.11Å; N85-Y130 WeakPolarHBondContact CB-OH 3.27Å; N85-Y130 PolarHBondContact N-OH 2.76Å; N85-Y130 WeakPolarHBondContact OD1-CE1 3.1Å; N85-Y130 PolarHBondContact OD1-OH 3.13Å
86	R	93.1	Very high	90	Very high	36 Å²	36	46.6 Å²	46.6	14%	0.136	29%	0.288	C	S	.	.	H	α-helix	trans	-55.5	-41.4	-179.9	-70.4	174.4	-176.9	-96.7	6.2	112.3	D64 V65 L89 A90 F100 S107 Q109	D64-R86 PolarHBondContact O-NE 3.1Å; D64-R86 WeakPolarHBondContact OD1-CG 3.3Å; D64-R86 PolarHBondContact OD1-N 3.01Å; V65-R86 HydrophobicContact CB-CG 3.68Å; V65-R86 HydrophobicContact CG1-CG 3.58Å; R86-L89 PolarHBondContact O-N 3.47Å; R86-A90 WeakPolarHBondContact O-CB 3.38Å; R86-A90 PolarHBondContact O-N 3.13Å; R86-F100 HydrophobicContact CB-CD2 3.85Å; R86-F100 HydrophobicContact CB-CE2 4.08Å; R86-F100 HydrophobicContact CB-CG 4.41Å; R86-F100 HydrophobicContact CG-CD2 4.03Å; R86-F100 HydrophobicContact CG-CE2 4Å; R86-F100 HydrophobicContact CG-CG 4.34Å; R86-F100 HydrophobicContact CG-CZ 4.26Å; R86-S107 PolarHBondContact NH1-O 3.12Å; R86-Q109 VanDerWaalsContact NH2-C 3.28Å; R86-Q109 PolarHBondContact NH2-O 3.2Å
87	N	93.4	Very high	91.6	Very high	101 Å²	101	45.6 Å²	45.6	54%	0.54	27%	0.269	S	S	.	.	H	α-helix	trans	-63.1	-41.5	-178.1	64.6	-22.1	0	0	0	112.1	N85 A91	N85-N87 VanDerWaalsContact C-N 3.25Å; N85-N87 WeakPolarHBondContact CB-OD1 3.5Å; N85-N87 PolarHBondContact O-N 2.97Å; N87-A91 WeakPolarHBondContact O-CB 2.95Å; N87-A91 PolarHBondContact O-N 3.36Å
88	V	95.7	Very high	92.8	Very high	11 Å²	11	46 Å²	46	7%	0.067	26%	0.262	C	S	.	.	H	α-helix	trans	-68.9	-49	178	-178.4	0	0	0	0	110	L53 N85 A90 A91 A92 Y130	L53-V88 HydrophobicContact CB-CG2 4.45Å; L53-V88 HydrophobicContact CD1-CG2 4.05Å; L53-V88 HydrophobicContact CD2-CG2 4.27Å; N85-V88 HydrophobicContact CB-CB 4.41Å; N85-V88 HydrophobicContact CB-CG2 4.07Å; N85-V88 PolarHBondContact O-N 2.75Å; V88-A90 PolarHBondContact O-N 3.21Å; V88-A91 PolarHBondContact O-N 3.47Å; V88-A92 WeakPolarHBondContact O-CB 3.26Å; V88-A92 PolarHBondContact O-N 3.34Å; V88-Y130 HydrophobicContact CB-CD1 4.47Å; V88-Y130 HydrophobicContact CB-CE1 3.91Å; V88-Y130 HydrophobicContact CB-CE2 4.41Å; V88-Y130 HydrophobicContact CG1-CD1 3.79Å; V88-Y130 HydrophobicContact CG1-CD2 4.09Å; V88-Y130 HydrophobicContact CG1-CE1 3.72Å; V88-Y130 HydrophobicContact CG1-CE2 4.01Å; V88-Y130 HydrophobicContact CG1-CG 3.99Å; V88-Y130 HydrophobicContact CG2-CD1 4.41Å; V88-Y130 HydrophobicContact CG2-CE1 3.79Å
89	L	95.1	Very high	93.6	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.005	24%	0.244	C	C	.	.	H	α-helix	trans	-60.8	-43.8	177.8	-67.7	-175.1	0	0	0	112	I67 C84 N85 R86 A91 A92 C93 F96 F100 C129	I67-L89 HydrophobicContact CG1-CD1 4.41Å; C84-L89 HydrophobicContact CB-CD1 3.57Å; C84-L89 HydrophobicContact CB-CG 4.14Å; N85-L89 PolarHBondContact O-N 3.33Å; N85-L89 VanDerWaalsContact O-N 3.11Å; R86-L89 PolarHBondContact O-N 3.47Å; L89-A91 VanDerWaalsContact C-N 3.33Å; L89-A91 PolarHBondContact O-N 3.41Å; L89-A92 PolarHBondContact O-N 3.22Å; L89-C93 WeakPolarHBondContact O-CA 3.2Å; L89-C93 VanDerWaalsContact O-CB 3.26Å; L89-C93 WeakPolarHBondContact O-CB 3.36Å; L89-C93 PolarHBondContact O-N 3.38Å; L89-F96 HydrophobicContact CB-CB 4.03Å; L89-F96 HydrophobicContact CB-CD2 4.06Å; L89-F96 HydrophobicContact CB-CG 4.14Å; L89-F96 HydrophobicContact CD1-CD2 4.29Å; L89-F96 HydrophobicContact CD1-CE2 4.42Å; L89-F96 HydrophobicContact CD1-CG 4.48Å; L89-F96 HydrophobicContact CD2-CD2 4.48Å; L89-F100 HydrophobicContact CB-CE2 4.2Å; L89-F100 HydrophobicContact CD1-CE2 4.46Å; L89-C129 HydrophobicContact CD2-CB 4.11Å
90	A	94.8	Very high	94.1	Very high	16 Å²	16	43.9 Å²	43.9	13%	0.132	24%	0.242	C	C	.	.	H	α-helix	trans	-68.1	-30.3	176.9	0	0	0	0	0	113.3	R86 V88 K97 F100	R86-A90 WeakPolarHBondContact O-CB 3.38Å; R86-A90 PolarHBondContact O-N 3.13Å; V88-A90 PolarHBondContact O-N 3.21Å; A90-K97 HydrophobicContact CB-CB 4.34Å; A90-K97 VanDerWaalsContact O-CB 3.28Å; A90-K97 WeakPolarHBondContact O-CB 3.46Å; A90-F100 HydrophobicContact CB-CD2 4.26Å
91	A	95.4	Very high	94	Very high	90 Å²	90	43.8 Å²	43.8	74%	0.744	25%	0.253	S	S	*	.	H	α-helix	trans	-73.3	-38.3	176.1	0	0	0	0	0	111.9	N87 V88 L89	N87-A91 WeakPolarHBondContact O-CB 2.95Å; N87-A91 PolarHBondContact O-N 3.36Å; V88-A91 PolarHBondContact O-N 3.47Å; L89-A91 VanDerWaalsContact C-N 3.33Å; L89-A91 PolarHBondContact O-N 3.41Å
92	A	95.5	Very high	93.4	Very high	38 Å²	38	41 Å²	41	31%	0.314	25%	0.25	S	S	.	.	H	α-helix	trans	-92.6	-30.2	-174.5	0	0	0	0	0	114.3	V88 L89 C129 L153	V88-A92 WeakPolarHBondContact O-CB 3.26Å; V88-A92 PolarHBondContact O-N 3.34Å; L89-A92 PolarHBondContact O-N 3.22Å; A92-C129 HydrophobicContact CB-CB 3.75Å; A92-L153 WeakPolarHBondContact O-CD2 3.13Å
93	C	96.3	Very high	92.4	Very high	2 Å²	2	43.9 Å²	43.9	1%	0.014	28%	0.281	C	S	.	.			trans	-121.8	115.9	-171.6	175.9	0	0	0	0	111.7	L89 Y95 F96 K97 L151 L153	L89-C93 WeakPolarHBondContact O-CA 3.2Å; L89-C93 VanDerWaalsContact O-CB 3.26Å; L89-C93 WeakPolarHBondContact O-CB 3.36Å; L89-C93 PolarHBondContact O-N 3.38Å; C93-Y95 VanDerWaalsContact C-N 3.29Å; C93-Y95 PolarHBondContact O-N 3.15Å; C93-F96 HydrophobicContact CB-CB 4.35Å; C93-F96 HydrophobicContact CB-CD2 3.78Å; C93-F96 PolarHBondContact O-N 2.92Å; C93-F96 WeakPolarHBondContact SG-CD2 3.29Å; C93-K97 PolarHBondContact O-N 3.48Å; C93-L151 PolarHBondContact SG-O 3.28Å; C93-L153 HydrophobicContact CB-CD2 3.96Å
94	P	95.6	Very high	91.5	Very high	52 Å²	52	48.8 Å²	48.8	34%	0.338	30%	0.303	S	S	.	.	H	α-helix	trans	-60.5	-33.3	-179	-25.5	35.2	0	0	0	114.6	K97 S98 Q152	P94-K97 WeakPolarHBondContact O-CB 3.43Å; P94-K97 PolarHBondContact O-N 2.9Å; P94-S98 PolarHBondContact O-N 3.23Å; P94-S98 PolarHBondContact O-OG 3.22Å; P94-Q152 HydrophobicContact CB-CB 4.13Å; P94-Q152 WeakPolarHBondContact CD-O 3.42Å; P94-Q152 HydrophobicContact CG-CB 4.31Å
95	Y	94.2	Very high	90.4	Very high	69 Å²	69	57.6 Å²	57.6	27%	0.271	34%	0.338	S	S	.	.	H	α-helix	trans	-60.9	-53	175.4	177.4	-93.2	0	0	0	111.2	C93 K97 S98 M99 M114 L151	C93-Y95 VanDerWaalsContact C-N 3.29Å; C93-Y95 PolarHBondContact O-N 3.15Å; Y95-K97 VanDerWaalsContact C-N 3.32Å; Y95-K97 PolarHBondContact O-N 2.89Å; Y95-S98 PolarHBondContact O-N 2.99Å; Y95-M99 HydrophobicContact CD1-CE 4.32Å; Y95-M99 HydrophobicContact CE1-CE 3.37Å; Y95-M99 PolarHBondContact O-N 3.08Å; Y95-M99 WeakPolarHBondContact OH-CE 3.25Å; Y95-M114 HydrophobicContact CE1-SD 4.41Å; Y95-L151 HydrophobicContact CD1-CD2 3.57Å; Y95-L151 HydrophobicContact CE1-CD2 4.09Å; Y95-L151 HydrophobicContact CG-CD2 3.95Å
96	F	93.7	Very high	89.5	Confident	2 Å²	2	60.8 Å²	60.8	1%	0.009	35%	0.352	C	S	.	.	H	α-helix	trans	-67.6	-32.2	177.8	-71.2	-57.5	0	0	0	112.9	I67 L89 C93 M99 F100 M114 F122 L151	I67-F96 HydrophobicContact CD1-CE1 4.05Å; L89-F96 HydrophobicContact CB-CB 4.03Å; L89-F96 HydrophobicContact CB-CD2 4.06Å; L89-F96 HydrophobicContact CB-CG 4.14Å; L89-F96 HydrophobicContact CD1-CD2 4.29Å; L89-F96 HydrophobicContact CD1-CE2 4.42Å; L89-F96 HydrophobicContact CD1-CG 4.48Å; L89-F96 HydrophobicContact CD2-CD2 4.48Å; C93-F96 HydrophobicContact CB-CB 4.35Å; C93-F96 HydrophobicContact CB-CD2 3.78Å; C93-F96 PolarHBondContact O-N 2.92Å; C93-F96 WeakPolarHBondContact SG-CD2 3.29Å; F96-M99 HydrophobicContact CD1-SD 4.13Å; F96-M99 HydrophobicContact CE1-SD 4.43Å; F96-M99 PolarHBondContact O-N 3.16Å; F96-F100 HydrophobicContact CB-CD2 4.14Å; F96-F100 HydrophobicContact CB-CE2 3.83Å; F96-F100 HydrophobicContact CB-CZ 4.47Å; F96-F100 AromaticContact CD1-CE2 4Å; F96-F100 HydrophobicContact CD1-CE2 4Å; F96-F100 AromaticContact CD1-CZ 3.81Å; F96-F100 HydrophobicContact CD1-CZ 3.81Å; F96-F100 HydrophobicContact CG-CE2 4.18Å; F96-F100 HydrophobicContact CG-CZ 4.45Å; F96-F100 WeakPolarHBondContact O-CB 3.36Å; F96-F100 VanDerWaalsContact O-CD2 3.29Å; F96-F100 WeakPolarHBondContact O-CD2 3.41Å; F96-F100 VanDerWaalsContact O-CG 3.31Å; F96-F100 WeakPolarHBondContact O-CG 3.34Å; F96-F100 PolarHBondContact O-N 3.1Å; F96-M114 HydrophobicContact CE1-SD 4.06Å; F96-M114 HydrophobicContact CZ-CE 4.29Å; F96-M114 HydrophobicContact CZ-SD 3.75Å; F96-F122 AromaticContact CE2-CE2 3.95Å; F96-F122 HydrophobicContact CE2-CE2 3.95Å; F96-F122 HydrophobicContact CE2-CZ 4.27Å; F96-F122 AromaticContact CZ-CE2 3.76Å; F96-F122 HydrophobicContact CZ-CE2 3.76Å; F96-F122 AromaticContact CZ-CZ 3.93Å; F96-F122 HydrophobicContact CZ-CZ 3.93Å; F96-L151 HydrophobicContact CE2-CD1 4.47Å; F96-L151 HydrophobicContact CE2-CD2 4.08Å; F96-L151 HydrophobicContact CZ-CD2 4.2Å
97	K	93.6	Very high	88.8	Confident	120 Å²	120	59.8 Å²	59.8	52%	0.522	35%	0.351	S	S	.	.	H	α-helix	trans	-55.4	-54.4	170.7	-170.3	177.2	176	178	0	110.4	A90 C93 P94 Y95 M99 F100 T101	A90-K97 HydrophobicContact CB-CB 4.34Å; A90-K97 VanDerWaalsContact O-CB 3.28Å; A90-K97 WeakPolarHBondContact O-CB 3.46Å; C93-K97 PolarHBondContact O-N 3.48Å; P94-K97 WeakPolarHBondContact O-CB 3.43Å; P94-K97 PolarHBondContact O-N 2.9Å; Y95-K97 VanDerWaalsContact C-N 3.32Å; Y95-K97 PolarHBondContact O-N 2.89Å; K97-M99 VanDerWaalsContact C-N 3.31Å; K97-M99 PolarHBondContact O-N 2.93Å; K97-F100 PolarHBondContact O-N 2.85Å; K97-T101 WeakPolarHBondContact O-CB 3.23Å; K97-T101 WeakPolarHBondContact O-CG2 3.39Å; K97-T101 PolarHBondContact O-N 2.86Å; K97-T101 PolarHBondContact O-OG1 3.1Å
98	S	92.9	Very high	88.2	Confident	75 Å²	75	62.6 Å²	62.6	52%	0.524	36%	0.361	S	S	.	.	H	α-helix	trans	-61.3	-41.2	-178.8	-55.5	0	0	0	0	111.5	P94 Y95 G102	P94-S98 PolarHBondContact O-N 3.23Å; P94-S98 PolarHBondContact O-OG 3.22Å; Y95-S98 PolarHBondContact O-N 2.99Å; S98-G102 VanDerWaalsContact O-CA 3.22Å; S98-G102 WeakPolarHBondContact O-CA 3.46Å; S98-G102 PolarHBondContact O-N 3.02Å
99	M	90.6	Very high	87.7	Confident	30 Å²	30	64.5 Å²	64.5	15%	0.148	37%	0.369	C	S	.	.	H	α-helix	trans	-63.4	-48.4	177	-177.3	-175.1	-75.4	0	0	112.7	Y95 F96 K97 E106 V112	Y95-M99 HydrophobicContact CD1-CE 4.32Å; Y95-M99 HydrophobicContact CE1-CE 3.37Å; Y95-M99 PolarHBondContact O-N 3.08Å; Y95-M99 WeakPolarHBondContact OH-CE 3.25Å; F96-M99 HydrophobicContact CD1-SD 4.13Å; F96-M99 HydrophobicContact CE1-SD 4.43Å; F96-M99 PolarHBondContact O-N 3.16Å; K97-M99 VanDerWaalsContact C-N 3.31Å; K97-M99 PolarHBondContact O-N 2.93Å; M99-E106 HydrophobicContact CG-CB 4.01Å; M99-V112 HydrophobicContact CE-CG1 4.06Å; M99-V112 HydrophobicContact SD-CG1 3.81Å; M99-V112 HydrophobicContact SD-CG2 4.32Å
100	F	91.1	Very high	87.3	Confident	26 Å²	26	69.7 Å²	69.7	11%	0.114	40%	0.401	C	S	.	.	H	α-helix	trans	-83	-23.2	-173.6	-59.5	-30.8	0	0	0	113.6	V65 I67 R86 L89 A90 F96 K97	V65-F100 HydrophobicContact CG1-CZ 4.24Å; V65-F100 HydrophobicContact CG2-CE1 4.31Å; V65-F100 HydrophobicContact CG2-CZ 4.15Å; I67-F100 HydrophobicContact CD1-CZ 4.4Å; R86-F100 HydrophobicContact CB-CD2 3.85Å; R86-F100 HydrophobicContact CB-CE2 4.08Å; R86-F100 HydrophobicContact CB-CG 4.41Å; R86-F100 HydrophobicContact CG-CD2 4.03Å; R86-F100 HydrophobicContact CG-CE2 4Å; R86-F100 HydrophobicContact CG-CG 4.34Å; R86-F100 HydrophobicContact CG-CZ 4.26Å; L89-F100 HydrophobicContact CB-CE2 4.2Å; L89-F100 HydrophobicContact CD1-CE2 4.46Å; A90-F100 HydrophobicContact CB-CD2 4.26Å; F96-F100 HydrophobicContact CB-CD2 4.14Å; F96-F100 HydrophobicContact CB-CE2 3.83Å; F96-F100 HydrophobicContact CB-CZ 4.47Å; F96-F100 AromaticContact CD1-CE2 4Å; F96-F100 HydrophobicContact CD1-CE2 4Å; F96-F100 AromaticContact CD1-CZ 3.81Å; F96-F100 HydrophobicContact CD1-CZ 3.81Å; F96-F100 HydrophobicContact CG-CE2 4.18Å; F96-F100 HydrophobicContact CG-CZ 4.45Å; F96-F100 WeakPolarHBondContact O-CB 3.36Å; F96-F100 VanDerWaalsContact O-CD2 3.29Å; F96-F100 WeakPolarHBondContact O-CD2 3.41Å; F96-F100 VanDerWaalsContact O-CG 3.31Å; F96-F100 WeakPolarHBondContact O-CG 3.34Å; F96-F100 PolarHBondContact O-N 3.1Å; K97-F100 PolarHBondContact O-N 2.85Å
101	T	89.4	Confident	87	Confident	103 Å²	103	71.5 Å²	71.5	63%	0.632	41%	0.412	S	S	*	.	H	α-helix	trans	-103.5	-5.9	177.1	71.1	0	0	0	0	113.8	K97 G103	K97-T101 WeakPolarHBondContact O-CB 3.23Å; K97-T101 WeakPolarHBondContact O-CG2 3.39Å; K97-T101 PolarHBondContact O-N 2.86Å; K97-T101 PolarHBondContact O-OG1 3.1Å; T101-G103 VanDerWaalsContact C-N 3.32Å; T101-G103 PolarHBondContact O-N 3.25Å
102	G	80.5	Confident	86.8	Confident	48 Å²	48	67.5 Å²	67.5	50%	0.495	38%	0.378	S	S	.	.	S	Bend	trans	-77.6	-7.1	-172.6	0	0	0	0	0	116	S98 M104	S98-G102 VanDerWaalsContact O-CA 3.22Å; S98-G102 WeakPolarHBondContact O-CA 3.46Å; S98-G102 PolarHBondContact O-N 3.02Å; G102-M104 PolarHBondContact O-N 3.12Å
103	G	74.5	Confident	86.5	Confident	65 Å²	65	69 Å²	69	67%	0.67	38%	0.384	S	S	*	.			trans	73.3	6.4	177.8	0	0	0	0	0	115.7	T101	T101-G103 VanDerWaalsContact C-N 3.32Å; T101-G103 PolarHBondContact O-N 3.25Å
104	M	76.1	Confident	86.1	Confident	131 Å²	131	69.1 Å²	69.1	65%	0.645	39%	0.385	S	S	*	.	S	Bend	trans	-77.1	170.4	174.8	-61.2	-67.8	-80.8	0	0	111.4	G102 E106 S107	G102-M104 PolarHBondContact O-N 3.12Å; M104-E106 VanDerWaalsContact CB-OE2 3.29Å; M104-E106 WeakPolarHBondContact CB-OE2 3.33Å; M104-E106 PolarHBondContact O-N 2.85Å; M104-S107 VanDerWaalsContact O-CB 3.27Å; M104-S107 WeakPolarHBondContact O-CB 3.42Å; M104-S107 PolarHBondContact O-N 3.38Å; M104-S107 PolarHBondContact O-OG 3.35Å
105	Y	73.1	Confident	85.4	Confident	185 Å²	185	71.4 Å²	71.4	73%	0.725	39%	0.391	S	S	*	.	G	3₁₀ helix	trans	-55.6	-37.3	-175.7	-177.3	-118	0	0	0	112.6	S107 Q108 Q109	Y105-S107 PolarHBondContact O-N 2.98Å; Y105-Q108 PolarHBondContact O-N 2.9Å; Y105-Q109 HydrophobicContact CD1-CG 4.27Å; Y105-Q109 HydrophobicContact CE1-CG 4.16Å
106	E	75.2	Confident	84.8	Confident	76 Å²	76	74.6 Å²	74.6	36%	0.355	41%	0.412	S	S	.	.	G	3₁₀ helix	trans	-61.2	-26.7	177.6	-61.3	77.3	-171.4	0	0	112.8	M99 M104 Q108 Q109	M99-E106 HydrophobicContact CG-CB 4.01Å; M104-E106 VanDerWaalsContact CB-OE2 3.29Å; M104-E106 WeakPolarHBondContact CB-OE2 3.33Å; M104-E106 PolarHBondContact O-N 2.85Å; E106-Q108 PolarHBondContact O-N 3.4Å; E106-Q109 PolarHBondContact O-N 3.42Å
107	S	79.1	Confident	84.6	Confident	14 Å²	14	74.7 Å²	74.7	10%	0.098	41%	0.413	C	S	.	.	G	3₁₀ helix	trans	-63.4	-25.4	178.7	69.8	0	0	0	0	112.8	R86 M104 Y105	R86-S107 PolarHBondContact NH1-O 3.12Å; M104-S107 VanDerWaalsContact O-CB 3.27Å; M104-S107 WeakPolarHBondContact O-CB 3.42Å; M104-S107 PolarHBondContact O-N 3.38Å; M104-S107 PolarHBondContact O-OG 3.35Å; Y105-S107 PolarHBondContact O-N 2.98Å
108	Q	79.8	Confident	84.3	Confident	161 Å²	161	70.5 Å²	70.5	75%	0.752	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	-104.5	-5.4	-179.6	-57.9	-61.4	-30	0	0	113.4	Y105 E106	Y105-Q108 PolarHBondContact O-N 2.9Å; E106-Q108 PolarHBondContact O-N 3.4Å
109	Q	85.3	Confident	84.3	Confident	50 Å²	50	67.5 Å²	67.5	23%	0.234	38%	0.376	C	S	.	.			trans	-78.8	124.7	-175.4	-75.8	179.6	-8.2	0	0	112.7	R86 Y105 E106 S111 V112	R86-Q109 VanDerWaalsContact NH2-C 3.28Å; R86-Q109 PolarHBondContact NH2-O 3.2Å; Y105-Q109 HydrophobicContact CD1-CG 4.27Å; Y105-Q109 HydrophobicContact CE1-CG 4.16Å; E106-Q109 PolarHBondContact O-N 3.42Å; Q109-S111 PolarHBondContact O-N 3.31Å; Q109-S111 PolarHBondContact OE1-O 2.93Å; Q109-V112 HydrophobicContact CB-CG2 4.39Å
110	T	86.5	Confident	84.3	Confident	111 Å²	111	71.7 Å²	71.7	68%	0.681	40%	0.395	S	S	*	.	S	Bend	trans	-69.4	-16.7	176.4	54.8	0	0	0	0	114	T66	T66-T110 PolarHBondContact N-O 3.03Å
111	S	89.5	Confident	84.5	Confident	54 Å²	54	70.5 Å²	70.5	38%	0.378	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	128.8	176.8	-166.2	0	0	0	0	110	T66 Q109	T66-S111 CarbonylContact O-C 3.42Å; T66-S111 VanDerWaalsContact O-CA 3.25Å; T66-S111 WeakPolarHBondContact O-CA 3.37Å; Q109-S111 PolarHBondContact O-N 3.31Å; Q109-S111 PolarHBondContact OE1-O 2.93Å
112	V	90.2	Very high	84.8	Confident	5 Å²	5	65.7 Å²	65.7	3%	0.03	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	129.4	-180	178.6	0	0	0	0	109.2	V65 T66 I67 E68 M99 Q109	V65-V112 HydrophobicContact CG2-CG2 4.29Å; T66-V112 PolarHBondContact O-N 3.34Å; I67-V112 CarbonylContact C-O 3.54Å; I67-V112 WeakPolarHBondContact CA-O 3.38Å; I67-V112 HydrophobicContact CD1-CB 3.9Å; I67-V112 HydrophobicContact CD1-CG2 4.46Å; E68-V112 PolarHBondContact N-O 3.28Å; M99-V112 HydrophobicContact CE-CG1 4.06Å; M99-V112 HydrophobicContact SD-CG1 3.81Å; M99-V112 HydrophobicContact SD-CG2 4.32Å; Q109-V112 HydrophobicContact CB-CG2 4.39Å
113	T	89.3	Confident	85.4	Confident	71 Å²	71	67.2 Å²	67.2	44%	0.436	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	132.3	178.5	51.6	0	0	0	0	111.1	E68	E68-T113 HydrophobicContact CB-CG2 4.13Å; E68-T113 HydrophobicContact CG-CG2 4.5Å; E68-T113 CarbonylContact O-C 3.58Å; E68-T113 WeakPolarHBondContact O-CA 3.2Å
114	M	87.9	Confident	86.4	Confident	4 Å²	4	65.7 Å²	65.7	2%	0.02	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	130.1	172.7	-62.6	-160	-46.4	0	0	110.7	I67 E68 V69 V70 Y95 F96 V117 F122 L151	I67-M114 HydrophobicContact CG2-CE 3.83Å; I67-M114 HydrophobicContact CG2-CG 3.92Å; I67-M114 HydrophobicContact CG2-SD 4.11Å; E68-M114 PolarHBondContact O-N 3.4Å; V69-M114 HydrophobicContact CG2-CE 3.93Å; V70-M114 PolarHBondContact N-O 3.09Å; Y95-M114 HydrophobicContact CE1-SD 4.41Å; F96-M114 HydrophobicContact CE1-SD 4.06Å; F96-M114 HydrophobicContact CZ-CE 4.29Å; F96-M114 HydrophobicContact CZ-SD 3.75Å; M114-V117 HydrophobicContact CE-CB 4.48Å; M114-V117 HydrophobicContact CE-CG2 4.44Å; M114-F122 HydrophobicContact CE-CD1 4.48Å; M114-F122 HydrophobicContact CE-CD2 3.3Å; M114-F122 HydrophobicContact CE-CE1 4.32Å; M114-F122 HydrophobicContact CE-CE2 3.14Å; M114-F122 HydrophobicContact CE-CG 3.99Å; M114-F122 HydrophobicContact CE-CZ 3.69Å; M114-F122 HydrophobicContact SD-CE2 4.31Å; M114-L151 HydrophobicContact SD-CD2 4.34Å
115	H	80.4	Confident	87.4	Confident	100 Å²	100	59.5 Å²	59.5	46%	0.463	30%	0.302	S	S	.	.			trans	-112.8	143.7	172.5	-50.1	-70.9	0	0	0	105.5
116	D	82.5	Confident	88.5	Confident	136 Å²	136	50.8 Å²	50.8	73%	0.727	27%	0.268	S	S	*	.	S	Bend	trans	87.1	11.5	-179.9	-41.9	-40.8	0	0	0	117.5	M150	D116-M150 HydrophobicContact CB-SD 4.33Å
117	V	88.9	Confident	89.4	Confident	4 Å²	4	49.9 Å²	49.9	2%	0.024	27%	0.265	C	S	.	.	S	Bend	trans	-124.3	135.1	166.4	-175.1	0	0	0	0	109.2	V69 M114 F122 A147 M150	V69-V117 WeakPolarHBondContact CG1-O 3.38Å; M114-V117 HydrophobicContact CE-CB 4.48Å; M114-V117 HydrophobicContact CE-CG2 4.44Å; V117-F122 HydrophobicContact CG1-CB 3.9Å; V117-F122 HydrophobicContact CG1-CD2 4.41Å; V117-A147 HydrophobicContact CG1-CB 3.69Å; V117-M150 HydrophobicContact CG2-CE 4.15Å; V117-M150 HydrophobicContact CG2-SD 3.41Å; V117-M150 WeakPolarHBondContact CG2-SD 3.32Å
118	D	88.2	Confident	90.3	Very high	32 Å²	32	51.1 Å²	51.1	17%	0.171	27%	0.268	C	S	.	.			trans	-76.7	143.2	172.6	72	-77.1	0	0	0	111.2	E120 S121 F122 R143	D118-E120 PolarHBondContact O-N 2.86Å; D118-S121 PolarHBondContact O-N 2.92Å; D118-S121 WeakPolarHBondContact OD1-CB 3.13Å; D118-S121 PolarHBondContact OD1-OG 3.27Å; D118-S121 WeakPolarHBondContact OD2-CB 3.48Å; D118-S121 PolarHBondContact OD2-N 3.32Å; D118-S121 PolarHBondContact OD2-OG 3.18Å; D118-F122 PolarHBondContact O-N 2.98Å; D118-R143 WeakPolarHBondContact OD1-CB 3.38Å; D118-R143 IonicContact OD2-CZ 3.96Å; D118-R143 IonicContact OD2-NH1 3.68Å; D118-R143 PolarHBondContact OD2-NH1 3.11Å
119	A	91.4	Very high	91.1	Very high	12 Å²	12	44 Å²	44	10%	0.099	24%	0.236	C	C	.	.	H	α-helix	trans	-65.8	-26.5	-172.4	0	0	0	0	0	113.7	V69 R80 F82 E123	V69-A119 HydrophobicContact CB-CB 4.36Å; V69-A119 HydrophobicContact CG1-CB 4.13Å; R80-A119 HydrophobicContact CB-CB 3.96Å; F82-A119 HydrophobicContact CE2-CB 4.41Å; F82-A119 HydrophobicContact CZ-CB 4.35Å; F82-A119 WeakPolarHBondContact CZ-O 3.4Å; A119-E123 WeakPolarHBondContact O-CB 3.39Å; A119-E123 PolarHBondContact O-N 3.42Å; A119-E123 VanDerWaalsContact O-N 3.1Å
120	E	92.2	Very high	91.6	Very high	117 Å²	117	41.7 Å²	41.7	55%	0.547	23%	0.225	S	C	.	.	H	α-helix	trans	-71.8	-48.4	176.4	-63.2	177.7	171.7	0	0	111.2	D118 F122 E123 V124 R143	D118-E120 PolarHBondContact O-N 2.86Å; E120-F122 VanDerWaalsContact C-N 3.31Å; E120-F122 PolarHBondContact O-N 3.16Å; E120-E123 WeakPolarHBondContact O-CB 3.37Å; E120-E123 PolarHBondContact O-N 3.09Å; E120-V124 WeakPolarHBondContact O-CG2 3.22Å; E120-V124 PolarHBondContact O-N 3.03Å; E120-V124 VanDerWaalsContact O-N 3.16Å; E120-R143 IonicContact OE2-CZ 3.35Å; E120-R143 IonicContact OE2-NH1 2.75Å; E120-R143 PolarHBondContact OE2-NH1 2.89Å; E120-R143 IonicContact OE2-NH2 3.3Å; E120-R143 PolarHBondContact OE2-NH2 2.81Å; E120-R143 VanDerWaalsContact OE2-NH2 3.12Å
121	S	94.4	Very high	92	Very high	2 Å²	2	38.3 Å²	38.3	1%	0.014	20%	0.204	C	C	.	.	H	α-helix	trans	-63.4	-39.4	175.3	-59	0	0	0	0	111.2	D118 E123 V124 L125 R143 L144	D118-S121 PolarHBondContact O-N 2.92Å; D118-S121 WeakPolarHBondContact OD1-CB 3.13Å; D118-S121 PolarHBondContact OD1-OG 3.27Å; D118-S121 WeakPolarHBondContact OD2-CB 3.48Å; D118-S121 PolarHBondContact OD2-N 3.32Å; D118-S121 PolarHBondContact OD2-OG 3.18Å; S121-E123 VanDerWaalsContact C-N 3.34Å; S121-E123 PolarHBondContact O-N 3.49Å; S121-V124 PolarHBondContact O-N 3.48Å; S121-L125 VanDerWaalsContact O-CG 3.32Å; S121-L125 WeakPolarHBondContact O-CG 3.45Å; S121-L125 PolarHBondContact O-N 3.35Å; S121-R143 WeakPolarHBondContact OG-CB 3.45Å; S121-L144 PolarHBondContact OG-N 2.95Å
122	F	94.9	Very high	92.2	Very high	1 Å²	1	38.1 Å²	38.1	0%	0.004	21%	0.211	C	C	.	.	H	α-helix	trans	-60.9	-43.3	176.1	-171.3	-109.7	0	0	0	112.2	I67 V69 F82 F96 M114 V117 D118 E120 V124 L125 V126 L151	I67-F122 HydrophobicContact CB-CE1 3.98Å; I67-F122 HydrophobicContact CB-CZ 4.01Å; I67-F122 HydrophobicContact CG1-CZ 4.17Å; I67-F122 HydrophobicContact CG2-CE1 3.86Å; I67-F122 HydrophobicContact CG2-CZ 3.69Å; V69-F122 HydrophobicContact CG2-CB 4.01Å; V69-F122 HydrophobicContact CG2-CD1 3.43Å; V69-F122 VanDerWaalsContact CG2-CD1 3.43Å; V69-F122 HydrophobicContact CG2-CD2 4.41Å; V69-F122 HydrophobicContact CG2-CE1 3.95Å; V69-F122 HydrophobicContact CG2-CG 3.67Å; F82-F122 HydrophobicContact CB-CD1 4.44Å; F82-F122 HydrophobicContact CB-CE1 3.91Å; F82-F122 HydrophobicContact CD1-CD1 4.12Å; F82-F122 HydrophobicContact CD1-CE1 4.35Å; F82-F122 AromaticContact CD2-CD1 3.6Å; F82-F122 HydrophobicContact CD2-CD1 3.6Å; F82-F122 AromaticContact CD2-CE1 3.81Å; F82-F122 HydrophobicContact CD2-CE1 3.81Å; F82-F122 HydrophobicContact CE1-CD1 4.24Å; F82-F122 AromaticContact CE2-CD1 3.73Å; F82-F122 HydrophobicContact CE2-CD1 3.73Å; F82-F122 HydrophobicContact CE2-CE1 4.41Å; F82-F122 AromaticContact CG-CD1 3.79Å; F82-F122 HydrophobicContact CG-CD1 3.79Å; F82-F122 AromaticContact CG-CE1 3.76Å; F82-F122 HydrophobicContact CG-CE1 3.76Å; F82-F122 HydrophobicContact CZ-CD1 4.04Å; F96-F122 AromaticContact CE2-CE2 3.95Å; F96-F122 HydrophobicContact CE2-CE2 3.95Å; F96-F122 HydrophobicContact CE2-CZ 4.27Å; F96-F122 AromaticContact CZ-CE2 3.76Å; F96-F122 HydrophobicContact CZ-CE2 3.76Å; F96-F122 AromaticContact CZ-CZ 3.93Å; F96-F122 HydrophobicContact CZ-CZ 3.93Å; M114-F122 HydrophobicContact CE-CD1 4.48Å; M114-F122 HydrophobicContact CE-CD2 3.3Å; M114-F122 HydrophobicContact CE-CE1 4.32Å; M114-F122 HydrophobicContact CE-CE2 3.14Å; M114-F122 HydrophobicContact CE-CG 3.99Å; M114-F122 HydrophobicContact CE-CZ 3.69Å; M114-F122 HydrophobicContact SD-CE2 4.31Å; V117-F122 HydrophobicContact CG1-CB 3.9Å; V117-F122 HydrophobicContact CG1-CD2 4.41Å; D118-F122 PolarHBondContact O-N 2.98Å; E120-F122 VanDerWaalsContact C-N 3.31Å; E120-F122 PolarHBondContact O-N 3.16Å; F122-V124 VanDerWaalsContact C-N 3.31Å; F122-V124 PolarHBondContact O-N 3.11Å; F122-L125 PolarHBondContact O-N 3.41Å; F122-V126 HydrophobicContact CD1-CG2 3.81Å; F122-V126 HydrophobicContact CD2-CG2 4.33Å; F122-V126 HydrophobicContact CE1-CG2 3.38Å; F122-V126 HydrophobicContact CE2-CG2 3.91Å; F122-V126 HydrophobicContact CG-CG2 4.29Å; F122-V126 HydrophobicContact CZ-CG2 3.43Å; F122-V126 VanDerWaalsContact CZ-CG2 3.43Å; F122-V126 WeakPolarHBondContact O-CG2 3.46Å; F122-V126 PolarHBondContact O-N 3.18Å; F122-L151 HydrophobicContact CD2-CD1 4.08Å; F122-L151 HydrophobicContact CE2-CD1 4.12Å
123	E	94.5	Very high	92.4	Very high	81 Å²	81	47.2 Å²	47.2	38%	0.379	25%	0.245	S	C	.	.	H	α-helix	trans	-57.4	-44.9	175.4	-177.3	169.6	-147.1	0	0	111.9	R80 F82 A119 E120 S121 L125 V126 D127	R80-E123 IonicContact CZ-OE1 3.08Å; R80-E123 IonicContact CZ-OE2 3.93Å; R80-E123 IonicContact NH1-OE1 3.68Å; R80-E123 IonicContact NH1-OE2 3.97Å; R80-E123 PolarHBondContact NH1-OE2 3.31Å; R80-E123 IonicContact NH2-OE1 3.12Å; R80-E123 PolarHBondContact NH2-OE1 2.91Å; R80-E123 IonicContact NH2-OE2 3.73Å; R80-E123 PolarHBondContact NH2-OE2 3.3Å; F82-E123 HydrophobicContact CE1-CB 3.82Å; F82-E123 HydrophobicContact CE1-CG 4.27Å; F82-E123 HydrophobicContact CZ-CB 4.28Å; A119-E123 WeakPolarHBondContact O-CB 3.39Å; A119-E123 PolarHBondContact O-N 3.42Å; A119-E123 VanDerWaalsContact O-N 3.1Å; E120-E123 WeakPolarHBondContact O-CB 3.37Å; E120-E123 PolarHBondContact O-N 3.09Å; S121-E123 VanDerWaalsContact C-N 3.34Å; S121-E123 PolarHBondContact O-N 3.49Å; E123-L125 PolarHBondContact O-N 3.26Å; E123-V126 PolarHBondContact O-N 3.13Å; E123-D127 WeakPolarHBondContact O-CB 3.39Å; E123-D127 PolarHBondContact O-N 3.23Å
124	V	95.7	Very high	92.6	Very high	32 Å²	32	45.7 Å²	45.7	19%	0.194	24%	0.235	C	C	.	.	H	α-helix	trans	-63.4	-40.5	176.8	175.1	0	0	0	0	111.6	E120 S121 F122 D127 Y128 V134 L144	E120-V124 WeakPolarHBondContact O-CG2 3.22Å; E120-V124 PolarHBondContact O-N 3.03Å; E120-V124 VanDerWaalsContact O-N 3.16Å; S121-V124 PolarHBondContact O-N 3.48Å; F122-V124 VanDerWaalsContact C-N 3.31Å; F122-V124 PolarHBondContact O-N 3.11Å; V124-D127 PolarHBondContact O-N 3.27Å; V124-Y128 WeakPolarHBondContact O-CB 3.44Å; V124-Y128 PolarHBondContact O-N 2.82Å; V124-V134 HydrophobicContact CG1-CG2 3.93Å; V124-L144 HydrophobicContact CB-CD1 4.24Å; V124-L144 HydrophobicContact CG1-CD1 4.06Å; V124-L144 HydrophobicContact CG1-CD2 4.17Å
125	L	96.6	Very high	92.9	Very high	2 Å²	2	49.4 Å²	49.4	1%	0.01	26%	0.261	C	S	.	.	H	α-helix	trans	-72.1	-34.5	179.1	-66.9	178.1	0	0	0	112.7	S121 F122 E123 Y128 C129 L144 A147 L151 L153 V156	S121-L125 VanDerWaalsContact O-CG 3.32Å; S121-L125 WeakPolarHBondContact O-CG 3.45Å; S121-L125 PolarHBondContact O-N 3.35Å; F122-L125 PolarHBondContact O-N 3.41Å; E123-L125 PolarHBondContact O-N 3.26Å; L125-Y128 WeakPolarHBondContact O-CB 3.49Å; L125-Y128 PolarHBondContact O-N 3.39Å; L125-C129 PolarHBondContact O-N 2.93Å; L125-C129 PolarHBondContact O-SG 3.08Å; L125-L144 HydrophobicContact CD1-CD1 4.16Å; L125-L144 HydrophobicContact CD2-CD1 3.54Å; L125-L144 HydrophobicContact CD2-CG 4.47Å; L125-L144 HydrophobicContact CG-CD1 3.6Å; L125-A147 HydrophobicContact CD1-CB 3.59Å; L125-L151 HydrophobicContact CD1-CD1 3.79Å; L125-L153 HydrophobicContact CB-CD1 4.16Å; L125-L153 HydrophobicContact CD1-CD1 4.34Å; L125-L153 HydrophobicContact CD2-CD1 3.85Å; L125-L153 HydrophobicContact CG-CD1 4.33Å; L125-V156 HydrophobicContact CD2-CB 4.34Å; L125-V156 HydrophobicContact CD2-CG1 3.82Å; L125-V156 HydrophobicContact CD2-CG2 4.3Å
126	V	95.4	Very high	93.5	Very high	1 Å²	1	46.7 Å²	46.7	1%	0.006	25%	0.25	C	S	.	.	H	α-helix	trans	-66.7	-46.9	171.6	174	0	0	0	0	109.7	Y57 F122 E123 Y128 C129 Y130	Y57-V126 HydrophobicContact CE1-CG1 4.33Å; Y57-V126 HydrophobicContact CE2-CG1 3.79Å; Y57-V126 WeakPolarHBondContact OH-CG1 3.28Å; F122-V126 HydrophobicContact CD1-CG2 3.81Å; F122-V126 HydrophobicContact CD2-CG2 4.33Å; F122-V126 HydrophobicContact CE1-CG2 3.38Å; F122-V126 HydrophobicContact CE2-CG2 3.91Å; F122-V126 HydrophobicContact CG-CG2 4.29Å; F122-V126 HydrophobicContact CZ-CG2 3.43Å; F122-V126 VanDerWaalsContact CZ-CG2 3.43Å; F122-V126 WeakPolarHBondContact O-CG2 3.46Å; F122-V126 PolarHBondContact O-N 3.18Å; E123-V126 PolarHBondContact O-N 3.13Å; V126-Y128 PolarHBondContact O-N 2.58Å; V126-C129 WeakPolarHBondContact O-CB 3.3Å; V126-C129 PolarHBondContact O-N 3.43Å; V126-Y130 HydrophobicContact CG1-CD2 4.16Å; V126-Y130 HydrophobicContact CG1-CE2 4.05Å; V126-Y130 WeakPolarHBondContact O-CD2 3.29Å; V126-Y130 PolarHBondContact O-N 3.08Å
127	D	95.4	Very high	93.9	Very high	57 Å²	57	42.7 Å²	42.7	31%	0.305	23%	0.233	S	C	.	.	H	α-helix	trans	-56.5	-42.7	175	-169.8	77.8	0	0	0	111.2	K54 E123 V124 C129 Y130 T131	K54-D127 WeakPolarHBondContact CE-OD1 3.5Å; K54-D127 IonicContact NZ-OD1 3.29Å; K54-D127 PolarHBondContact NZ-OD1 3.38Å; E123-D127 WeakPolarHBondContact O-CB 3.39Å; E123-D127 PolarHBondContact O-N 3.23Å; V124-D127 PolarHBondContact O-N 3.27Å; D127-C129 VanDerWaalsContact C-N 3.33Å; D127-C129 PolarHBondContact O-N 3.38Å; D127-Y130 CarbonylContact O-C 3.56Å; D127-Y130 PolarHBondContact O-N 3.18Å; D127-T131 WeakPolarHBondContact O-CB 3.44Å; D127-T131 WeakPolarHBondContact O-CG2 3.43Å; D127-T131 PolarHBondContact O-N 2.83Å; D127-T131 PolarHBondContact O-OG1 3.47Å; D127-T131 PolarHBondContact OD2-OG1 3.14Å
128	Y	96.8	Very high	93.9	Very high	41 Å²	41	49.2 Å²	49.2	16%	0.161	26%	0.263	C	S	.	.	H	α-helix	trans	-56.6	-41.4	172.6	169.8	-98.8	0	0	0	113.1	V124 L125 V126 Y130 T131 G132 R133 V134 L153 Y155 V156	V124-Y128 WeakPolarHBondContact O-CB 3.44Å; V124-Y128 PolarHBondContact O-N 2.82Å; L125-Y128 WeakPolarHBondContact O-CB 3.49Å; L125-Y128 PolarHBondContact O-N 3.39Å; V126-Y128 PolarHBondContact O-N 2.58Å; Y128-Y130 PolarHBondContact O-N 2.8Å; Y128-T131 PolarHBondContact O-N 3.3Å; Y128-G132 WeakPolarHBondContact O-CA 3.36Å; Y128-G132 PolarHBondContact O-N 3.41Å; Y128-R133 WeakPolarHBondContact CA-O 3.49Å; Y128-R133 WeakPolarHBondContact CB-O 3.32Å; Y128-V134 HydrophobicContact CD2-CB 4.22Å; Y128-L153 HydrophobicContact CD1-CD1 4.37Å; Y128-L153 HydrophobicContact CE1-CD2 4.26Å; Y128-Y155 HydrophobicContact CE2-CD1 4.16Å; Y128-V156 HydrophobicContact CD1-CG2 3.87Å; Y128-V156 HydrophobicContact CD2-CG2 4.04Å; Y128-V156 HydrophobicContact CE1-CG2 3.75Å; Y128-V156 HydrophobicContact CE2-CG2 3.93Å; Y128-V156 HydrophobicContact CG-CG2 4.01Å
129	C	96.4	Very high	94	Very high	11 Å²	11	51.4 Å²	51.4	7%	0.074	29%	0.286	C	S	.	.	H	α-helix	trans	-61	-29.7	177.4	-67.5	0	0	0	0	112.7	L89 A92 L125 V126 D127	L89-C129 HydrophobicContact CD2-CB 4.11Å; A92-C129 HydrophobicContact CB-CB 3.75Å; L125-C129 PolarHBondContact O-N 2.93Å; L125-C129 PolarHBondContact O-SG 3.08Å; V126-C129 WeakPolarHBondContact O-CB 3.3Å; V126-C129 PolarHBondContact O-N 3.43Å; D127-C129 VanDerWaalsContact C-N 3.33Å; D127-C129 PolarHBondContact O-N 3.38Å
130	Y	95.8	Very high	94.1	Very high	1 Å²	1	52.1 Å²	52.1	0%	0.004	29%	0.288	C	S	.	.	H	α-helix	trans	-99.6	-13.8	180	-73.8	-96.2	0	0	0	114.5	L50 L53 K54 Y57 N85 V88 V126 D127 Y128	L50-Y130 VanDerWaalsContact CD1-O 3.32Å; L50-Y130 WeakPolarHBondContact CD1-O 3.31Å; L50-Y130 WeakPolarHBondContact CG-O 3.16Å; L53-Y130 HydrophobicContact CB-CD1 4.28Å; K54-Y130 HydrophobicContact CD-CG 4.34Å; Y57-Y130 HydrophobicContact CD2-CD2 4.46Å; Y57-Y130 HydrophobicContact CD2-CE1 4.48Å; Y57-Y130 AromaticContact CD2-CE2 3.83Å; Y57-Y130 HydrophobicContact CD2-CE2 3.83Å; Y57-Y130 AromaticContact CD2-CZ 3.82Å; Y57-Y130 HydrophobicContact CE2-CE2 4.32Å; Y57-Y130 HydrophobicContact CG-CD1 4.47Å; Y57-Y130 HydrophobicContact CG-CD2 4.29Å; Y57-Y130 HydrophobicContact CG-CE1 4.21Å; Y57-Y130 HydrophobicContact CG-CE2 4.03Å; Y57-Y130 AromaticContact CG-CZ 3.97Å; N85-Y130 WeakPolarHBondContact CB-OH 3.27Å; N85-Y130 PolarHBondContact N-OH 2.76Å; N85-Y130 WeakPolarHBondContact OD1-CE1 3.1Å; N85-Y130 PolarHBondContact OD1-OH 3.13Å; V88-Y130 HydrophobicContact CB-CD1 4.47Å; V88-Y130 HydrophobicContact CB-CE1 3.91Å; V88-Y130 HydrophobicContact CB-CE2 4.41Å; V88-Y130 HydrophobicContact CG1-CD1 3.79Å; V88-Y130 HydrophobicContact CG1-CD2 4.09Å; V88-Y130 HydrophobicContact CG1-CE1 3.72Å; V88-Y130 HydrophobicContact CG1-CE2 4.01Å; V88-Y130 HydrophobicContact CG1-CG 3.99Å; V88-Y130 HydrophobicContact CG2-CD1 4.41Å; V88-Y130 HydrophobicContact CG2-CE1 3.79Å; V126-Y130 HydrophobicContact CG1-CD2 4.16Å; V126-Y130 HydrophobicContact CG1-CE2 4.05Å; V126-Y130 WeakPolarHBondContact O-CD2 3.29Å; V126-Y130 PolarHBondContact O-N 3.08Å; D127-Y130 CarbonylContact O-C 3.56Å; D127-Y130 PolarHBondContact O-N 3.18Å; Y128-Y130 PolarHBondContact O-N 2.8Å
131	T	94.9	Very high	94.3	Very high	40 Å²	40	46.7 Å²	46.7	25%	0.245	26%	0.263	C	S	.	.	H	α-helix	trans	-121.3	-21.5	-175.9	68.8	0	0	0	0	113.8	K54 D127 Y128 R133	K54-T131 HydrophobicContact CD-CG2 3.93Å; K54-T131 HydrophobicContact CG-CG2 4.16Å; D127-T131 WeakPolarHBondContact O-CB 3.44Å; D127-T131 WeakPolarHBondContact O-CG2 3.43Å; D127-T131 PolarHBondContact O-N 2.83Å; D127-T131 PolarHBondContact O-OG1 3.47Å; D127-T131 PolarHBondContact OD2-OG1 3.14Å; Y128-T131 PolarHBondContact O-N 3.3Å; T131-R133 PolarHBondContact O-N 3.33Å; T131-R133 PolarHBondContact OG1-N 3.47Å; T131-R133 VanDerWaalsContact OG1-N 3.13Å
132	G	93.9	Very high	94.3	Very high	50 Å²	50	51.5 Å²	51.5	52%	0.515	29%	0.285	S	S	.	.	S	Bend	trans	68.5	12.6	-169.4	0	0	0	0	0	113.9	Y128	Y128-G132 WeakPolarHBondContact O-CA 3.36Å; Y128-G132 PolarHBondContact O-N 3.41Å
133	R	93.9	Very high	94.2	Very high	197 Å²	197	55.9 Å²	55.9	74%	0.743	30%	0.302	S	S	*	.			trans	-116.6	146.1	-177.1	-59.9	-178.2	-174.6	-152.4	0.4	110.6	Y128 T131	Y128-R133 WeakPolarHBondContact CA-O 3.49Å; Y128-R133 WeakPolarHBondContact CB-O 3.32Å; T131-R133 PolarHBondContact O-N 3.33Å; T131-R133 PolarHBondContact OG1-N 3.47Å; T131-R133 VanDerWaalsContact OG1-N 3.13Å
134	V	95.2	Very high	94.3	Very high	39 Å²	39	52.1 Å²	52.1	24%	0.236	28%	0.284	C	S	.	.			trans	-138.7	133.6	177.7	63.6	0	0	0	0	110.2	V124 Y128 L136 L144 V156	V124-V134 HydrophobicContact CG1-CG2 3.93Å; Y128-V134 HydrophobicContact CD2-CB 4.22Å; V134-L136 HydrophobicContact CG2-CD2 3.98Å; V134-L144 HydrophobicContact CG2-CD2 3.85Å; V134-V156 HydrophobicContact CG2-CG1 4.07Å
135	S	92.4	Very high	94.4	Very high	81 Å²	81	50.6 Å²	50.6	57%	0.566	28%	0.275	S	S	*	.			trans	-103.4	114.6	177.8	55.4	0	0	0	0	110.9	N140	S135-N140 PolarHBondContact O-ND2 3.18Å
136	L	93.8	Very high	94.3	Very high	44 Å²	44	52.1 Å²	52.1	23%	0.23	29%	0.287	C	S	.	.			trans	-100.7	137.3	-179.3	-56.3	-178.4	0	0	0	111.4	V134 L144 A159 C160 F163	V134-L136 HydrophobicContact CG2-CD2 3.98Å; L136-L144 HydrophobicContact CD2-CD2 3.44Å; L136-L144 VanDerWaalsContact CD2-CD2 3.44Å; L136-A159 HydrophobicContact CD1-CB 4.2Å; L136-C160 WeakPolarHBondContact CD2-SG 3.38Å; L136-F163 HydrophobicContact CB-CD2 3.93Å; L136-F163 HydrophobicContact CB-CE2 4.17Å; L136-F163 HydrophobicContact CB-CG 4.34Å; L136-F163 HydrophobicContact CD1-CB 3.92Å; L136-F163 HydrophobicContact CD1-CD2 4.28Å; L136-F163 HydrophobicContact CD1-CG 4.32Å
137	S	92	Very high	94.3	Very high	51 Å²	51	52.1 Å²	52.1	36%	0.357	29%	0.288	S	S	.	.			trans	-140.2	163.8	173.9	76	0	0	0	0	110.6	A139 N140 V141	S137-A139 PolarHBondContact O-N 3.2Å; S137-A139 PolarHBondContact OG-N 3.26Å; S137-N140 PolarHBondContact N-OD1 2.6Å; S137-N140 PolarHBondContact O-N 3.26Å; S137-N140 PolarHBondContact O-OD1 2.95Å; S137-N140 PolarHBondContact OG-N 3.2Å; S137-N140 PolarHBondContact OG-OD1 3.43Å; S137-V141 WeakPolarHBondContact O-CB 3.25Å; S137-V141 PolarHBondContact O-N 3.27Å
138	E	88.8	Confident	94.3	Very high	141 Å²	141	49.4 Å²	49.4	66%	0.659	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-28.8	176.9	-66.2	174.6	-176.5	0	0	112.1	F163 R167	E138-F163 HydrophobicContact CG-CE1 4.22Å; E138-F163 HydrophobicContact CG-CZ 4.32Å; E138-R167 IonicContact OE1-NH1 3.47Å
139	A	90.1	Very high	94.3	Very high	79 Å²	79	50.5 Å²	50.5	65%	0.653	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-19.1	-178.7	0	0	0	0	0	114.5	S137 R143	S137-A139 PolarHBondContact O-N 3.2Å; S137-A139 PolarHBondContact OG-N 3.26Å; A139-R143 PolarHBondContact O-NH2 2.79Å
140	N	93.5	Very high	94.1	Very high	26 Å²	26	52.9 Å²	52.9	14%	0.139	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.4	-19.7	-177	77.3	1.5	0	0	0	114.1	S135 S137 E142 R143 L144	S135-N140 PolarHBondContact O-ND2 3.18Å; S137-N140 PolarHBondContact N-OD1 2.6Å; S137-N140 PolarHBondContact O-N 3.26Å; S137-N140 PolarHBondContact O-OD1 2.95Å; S137-N140 PolarHBondContact OG-N 3.2Å; S137-N140 PolarHBondContact OG-OD1 3.43Å; N140-E142 VanDerWaalsContact C-N 3.33Å; N140-E142 PolarHBondContact O-N 3.24Å; N140-R143 PolarHBondContact O-N 2.91Å; N140-L144 WeakPolarHBondContact O-CB 3.33Å; N140-L144 PolarHBondContact O-N 3.31Å
141	V	95.4	Very high	94.1	Very high	3 Å²	3	53 Å²	53	2%	0.018	29%	0.293	C	S	.	.	H	α-helix	trans	-58.4	-39.8	-166.8	62.5	0	0	0	0	113.7	S137 Y145 C160 F163 L164	S137-V141 WeakPolarHBondContact O-CB 3.25Å; S137-V141 PolarHBondContact O-N 3.27Å; V141-Y145 WeakPolarHBondContact O-CB 3.44Å; V141-Y145 PolarHBondContact O-N 3.23Å; V141-C160 HydrophobicContact CG2-CB 3.89Å; V141-F163 HydrophobicContact CB-CD1 4.19Å; V141-F163 HydrophobicContact CB-CE1 4.45Å; V141-F163 HydrophobicContact CG1-CD1 4.36Å; V141-F163 HydrophobicContact CG1-CE1 4.41Å; V141-F163 HydrophobicContact CG2-CB 4.42Å; V141-F163 HydrophobicContact CG2-CD1 3.9Å; V141-F163 HydrophobicContact CG2-CG 4.47Å; V141-L164 HydrophobicContact CG1-CD2 3.74Å; V141-L164 HydrophobicContact CG2-CD1 4.5Å; V141-L164 HydrophobicContact CG2-CD2 4.11Å; V141-L164 HydrophobicContact CG2-CG 3.97Å
142	E	94.5	Very high	94.1	Very high	104 Å²	104	56.3 Å²	56.3	49%	0.486	31%	0.306	S	S	.	.	H	α-helix	trans	-69.3	-50	-178.4	-64.2	-177.1	175.5	0	0	112	N140 Y145 A146 F179	N140-E142 VanDerWaalsContact C-N 3.33Å; N140-E142 PolarHBondContact O-N 3.24Å; E142-Y145 WeakPolarHBondContact O-CB 3.41Å; E142-Y145 PolarHBondContact O-N 2.85Å; E142-A146 PolarHBondContact O-N 2.94Å; E142-F179 HydrophobicContact CB-CE2 3.96Å; E142-F179 HydrophobicContact CG-CD2 4.43Å; E142-F179 HydrophobicContact CG-CE2 4.16Å
143	R	94.1	Very high	94.3	Very high	93 Å²	93	54.3 Å²	54.3	35%	0.351	28%	0.283	S	S	.	.	H	α-helix	trans	-62.9	-43	177.6	-73	-173.6	-72.2	135.5	-11.3	111.7	D118 E120 S121 A139 N140 A146 A147	D118-R143 WeakPolarHBondContact OD1-CB 3.38Å; D118-R143 IonicContact OD2-CZ 3.96Å; D118-R143 IonicContact OD2-NH1 3.68Å; D118-R143 PolarHBondContact OD2-NH1 3.11Å; E120-R143 IonicContact OE2-CZ 3.35Å; E120-R143 IonicContact OE2-NH1 2.75Å; E120-R143 PolarHBondContact OE2-NH1 2.89Å; E120-R143 IonicContact OE2-NH2 3.3Å; E120-R143 PolarHBondContact OE2-NH2 2.81Å; E120-R143 VanDerWaalsContact OE2-NH2 3.12Å; S121-R143 WeakPolarHBondContact OG-CB 3.45Å; A139-R143 PolarHBondContact O-NH2 2.79Å; N140-R143 PolarHBondContact O-N 2.91Å; R143-A146 PolarHBondContact O-N 2.82Å; R143-A147 WeakPolarHBondContact O-CB 3.47Å; R143-A147 PolarHBondContact O-N 2.63Å
144	L	96.1	Very high	94.3	Very high	1 Å²	1	49.8 Å²	49.8	1%	0.005	27%	0.271	C	S	.	.	H	α-helix	trans	-66.9	-38.6	178.2	-174.2	63.3	0	0	0	111.8	S121 V124 L125 V134 L136 N140 S148 V156	S121-L144 PolarHBondContact OG-N 2.95Å; V124-L144 HydrophobicContact CB-CD1 4.24Å; V124-L144 HydrophobicContact CG1-CD1 4.06Å; V124-L144 HydrophobicContact CG1-CD2 4.17Å; L125-L144 HydrophobicContact CD1-CD1 4.16Å; L125-L144 HydrophobicContact CD2-CD1 3.54Å; L125-L144 HydrophobicContact CD2-CG 4.47Å; L125-L144 HydrophobicContact CG-CD1 3.6Å; V134-L144 HydrophobicContact CG2-CD2 3.85Å; L136-L144 HydrophobicContact CD2-CD2 3.44Å; L136-L144 VanDerWaalsContact CD2-CD2 3.44Å; N140-L144 WeakPolarHBondContact O-CB 3.33Å; N140-L144 PolarHBondContact O-N 3.31Å; L144-S148 VanDerWaalsContact O-CB 3.25Å; L144-S148 WeakPolarHBondContact O-CB 3.04Å; L144-S148 PolarHBondContact O-N 3.08Å; L144-S148 PolarHBondContact O-OG 3.18Å; L144-V156 HydrophobicContact CD2-CG1 4.46Å; L144-V156 HydrophobicContact CG-CG1 4.29Å
145	Y	96.9	Very high	94.4	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-58.9	-52.2	172.3	-177.9	-74.5	0	0	0	110.4	V141 E142 A147 S148 D149 R157 C160 A161 F179 F183 H185	V141-Y145 WeakPolarHBondContact O-CB 3.44Å; V141-Y145 PolarHBondContact O-N 3.23Å; E142-Y145 WeakPolarHBondContact O-CB 3.41Å; E142-Y145 PolarHBondContact O-N 2.85Å; Y145-A147 VanDerWaalsContact C-N 3.34Å; Y145-A147 PolarHBondContact O-N 3.02Å; Y145-S148 WeakPolarHBondContact CA-OG 3.38Å; Y145-S148 PolarHBondContact O-N 3.31Å; Y145-S148 VanDerWaalsContact O-N 3.12Å; Y145-S148 PolarHBondContact O-OG 2.93Å; Y145-D149 HydrophobicContact CE1-CB 4.38Å; Y145-D149 PolarHBondContact O-N 2.89Å; Y145-R157 HydrophobicContact CD2-CG 4.24Å; Y145-R157 WeakPolarHBondContact CD2-O 2.98Å; Y145-R157 HydrophobicContact CE1-CG 4.18Å; Y145-R157 HydrophobicContact CE2-CG 3.61Å; Y145-R157 VanDerWaalsContact CE2-O 3.27Å; Y145-R157 WeakPolarHBondContact CE2-O 3.44Å; Y145-R157 PolarHBondContact OH-NH1 3.14Å; Y145-C160 HydrophobicContact CD2-CB 3.62Å; Y145-C160 HydrophobicContact CG-CB 4.25Å; Y145-A161 HydrophobicContact CE2-CB 4.01Å; Y145-F179 AromaticContact CD1-CE1 3.68Å; Y145-F179 HydrophobicContact CD1-CE1 3.68Å; Y145-F179 AromaticContact CD1-CZ 3.47Å; Y145-F179 HydrophobicContact CD1-CZ 3.47Å; Y145-F179 VanDerWaalsContact CD1-CZ 3.47Å; Y145-F179 HydrophobicContact CD2-CE1 4.16Å; Y145-F179 HydrophobicContact CD2-CZ 4.44Å; Y145-F179 HydrophobicContact CE1-CE1 4.05Å; Y145-F179 HydrophobicContact CE1-CZ 4.22Å; Y145-F179 HydrophobicContact CE2-CE1 4.49Å; Y145-F179 AromaticContact CG-CE1 3.77Å; Y145-F179 HydrophobicContact CG-CE1 3.77Å; Y145-F179 AromaticContact CG-CZ 3.64Å; Y145-F179 HydrophobicContact CG-CZ 3.64Å; Y145-F183 HydrophobicContact CD1-CD1 4.11Å; Y145-F183 HydrophobicContact CD1-CD2 4.11Å; Y145-F183 HydrophobicContact CD1-CE1 4.31Å; Y145-F183 HydrophobicContact CD1-CE2 4.34Å; Y145-F183 HydrophobicContact CD1-CG 4.02Å; Y145-F183 HydrophobicContact CD1-CZ 4.44Å; Y145-F183 HydrophobicContact CE1-CB 3.66Å; Y145-F183 AromaticContact CE1-CD1 3.74Å; Y145-F183 HydrophobicContact CE1-CD1 3.74Å; Y145-F183 AromaticContact CE1-CD2 3.96Å; Y145-F183 HydrophobicContact CE1-CD2 3.96Å; Y145-F183 HydrophobicContact CE1-CE1 4.39Å; Y145-F183 AromaticContact CE1-CG 3.5Å; Y145-F183 HydrophobicContact CE1-CG 3.5Å; Y145-F183 VanDerWaalsContact CE1-CG 3.5Å; Y145-H185 WeakPolarHBondContact OH-CB 3.46Å; Y145-H185 PolarHBondContact OH-CD2 2.75Å
146	A	95	Very high	94.6	Very high	34 Å²	34	51.6 Å²	51.6	28%	0.281	26%	0.262	S	S	.	.	H	α-helix	trans	-57.5	-45.9	-179.9	0	0	0	0	0	112.1	E142 R143 S148 D149 M150 F183	E142-A146 PolarHBondContact O-N 2.94Å; R143-A146 PolarHBondContact O-N 2.82Å; A146-S148 PolarHBondContact O-N 3.16Å; A146-D149 PolarHBondContact O-N 3.12Å; A146-M150 PolarHBondContact O-N 2.81Å; A146-F183 HydrophobicContact CB-CE1 3.9Å; A146-F183 HydrophobicContact CB-CZ 3.57Å
147	A	95.3	Very high	94.7	Very high	2 Å²	2	51.1 Å²	51.1	2%	0.017	26%	0.257	C	S	.	.	H	α-helix	trans	-62.9	-41.2	175.9	0	0	0	0	0	112.4	V117 L125 R143 Y145 L151	V117-A147 HydrophobicContact CG1-CB 3.69Å; L125-A147 HydrophobicContact CD1-CB 3.59Å; R143-A147 WeakPolarHBondContact O-CB 3.47Å; R143-A147 PolarHBondContact O-N 2.63Å; Y145-A147 VanDerWaalsContact C-N 3.34Å; Y145-A147 PolarHBondContact O-N 3.02Å; A147-L151 WeakPolarHBondContact O-CB 3.46Å; A147-L151 WeakPolarHBondContact O-CG 3.5Å; A147-L151 PolarHBondContact O-N 3.38Å
148	S	96.4	Very high	94.9	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-68.4	-34.4	178.5	71.2	0	0	0	0	112.9	L144 Y145 A146 Q152 L153 R157	L144-S148 VanDerWaalsContact O-CB 3.25Å; L144-S148 WeakPolarHBondContact O-CB 3.04Å; L144-S148 PolarHBondContact O-N 3.08Å; L144-S148 PolarHBondContact O-OG 3.18Å; Y145-S148 WeakPolarHBondContact CA-OG 3.38Å; Y145-S148 PolarHBondContact O-N 3.31Å; Y145-S148 VanDerWaalsContact O-N 3.12Å; Y145-S148 PolarHBondContact O-OG 2.93Å; A146-S148 PolarHBondContact O-N 3.16Å; S148-Q152 PolarHBondContact O-N 3.29Å; S148-L153 PolarHBondContact O-N 3.44Å; S148-R157 WeakPolarHBondContact OG-CA 3.43Å; S148-R157 PolarHBondContact OG-N 3.34Å
149	D	95.3	Very high	95.3	Very high	63 Å²	63	45.7 Å²	45.7	34%	0.337	23%	0.23	S	C	.	.	H	α-helix	trans	-67.1	-48.7	175.1	-172.3	69.5	0	0	0	110.5	Y145 A146 L151 Q152 R157 F183	Y145-D149 HydrophobicContact CE1-CB 4.38Å; Y145-D149 PolarHBondContact O-N 2.89Å; A146-D149 PolarHBondContact O-N 3.12Å; D149-L151 PolarHBondContact O-N 3.01Å; D149-Q152 PolarHBondContact O-N 3.22Å; D149-Q152 VanDerWaalsContact O-N 3.07Å; D149-R157 HydrophobicContact CB-CG 4.44Å; D149-R157 WeakPolarHBondContact OD1-CD 2.83Å; D149-F183 HydrophobicContact CB-CD1 4.43Å
150	M	93.7	Very high	95.6	Very high	62 Å²	62	42 Å²	42	31%	0.305	20%	0.199	S	C	.	.	H	α-helix	trans	-58.2	-46	175.1	179.5	-177.3	171.3	0	0	112.4	D116 V117 A146 Q152	D116-M150 HydrophobicContact CB-SD 4.33Å; V117-M150 HydrophobicContact CG2-CE 4.15Å; V117-M150 HydrophobicContact CG2-SD 3.41Å; V117-M150 WeakPolarHBondContact CG2-SD 3.32Å; A146-M150 PolarHBondContact O-N 2.81Å; M150-Q152 PolarHBondContact O-N 3.32Å
151	L	94.5	Very high	95.7	Very high	2 Å²	2	40.8 Å²	40.8	1%	0.01	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	1.4	179.4	-65.5	-179.6	0	0	0	113.5	C93 Y95 F96 M114 F122 L125 A147 D149 L153	C93-L151 PolarHBondContact SG-O 3.28Å; Y95-L151 HydrophobicContact CD1-CD2 3.57Å; Y95-L151 HydrophobicContact CE1-CD2 4.09Å; Y95-L151 HydrophobicContact CG-CD2 3.95Å; F96-L151 HydrophobicContact CE2-CD1 4.47Å; F96-L151 HydrophobicContact CE2-CD2 4.08Å; F96-L151 HydrophobicContact CZ-CD2 4.2Å; M114-L151 HydrophobicContact SD-CD2 4.34Å; F122-L151 HydrophobicContact CD2-CD1 4.08Å; F122-L151 HydrophobicContact CE2-CD1 4.12Å; L125-L151 HydrophobicContact CD1-CD1 3.79Å; A147-L151 WeakPolarHBondContact O-CB 3.46Å; A147-L151 WeakPolarHBondContact O-CG 3.5Å; A147-L151 PolarHBondContact O-N 3.38Å; D149-L151 PolarHBondContact O-N 3.01Å; L151-L153 VanDerWaalsContact C-N 3.27Å; L151-L153 HydrophobicContact CB-CD1 4.33Å; L151-L153 HydrophobicContact CB-CG 4.29Å; L151-L153 PolarHBondContact O-N 3.49Å
152	Q	95.7	Very high	95.7	Very high	110 Å²	110	43 Å²	43	51%	0.514	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.2	35.2	178.2	-54.7	176.3	10.3	0	0	113.6	P94 S148 D149 M150 E154	P94-Q152 HydrophobicContact CB-CB 4.13Å; P94-Q152 WeakPolarHBondContact CD-O 3.42Å; P94-Q152 HydrophobicContact CG-CB 4.31Å; S148-Q152 PolarHBondContact O-N 3.29Å; D149-Q152 PolarHBondContact O-N 3.22Å; D149-Q152 VanDerWaalsContact O-N 3.07Å; M150-Q152 PolarHBondContact O-N 3.32Å; Q152-E154 PolarHBondContact O-N 2.86Å
153	L	96.8	Very high	95.7	Very high	8 Å²	8	38.9 Å²	38.9	4%	0.042	19%	0.189	C	C	.	.			trans	-89.2	77.4	176	-68.3	175.6	0	0	0	110.5	A92 C93 L125 Y128 S148 L151 Y155 V156 R157	A92-L153 WeakPolarHBondContact O-CD2 3.13Å; C93-L153 HydrophobicContact CB-CD2 3.96Å; L125-L153 HydrophobicContact CB-CD1 4.16Å; L125-L153 HydrophobicContact CD1-CD1 4.34Å; L125-L153 HydrophobicContact CD2-CD1 3.85Å; L125-L153 HydrophobicContact CG-CD1 4.33Å; Y128-L153 HydrophobicContact CD1-CD1 4.37Å; Y128-L153 HydrophobicContact CE1-CD2 4.26Å; S148-L153 PolarHBondContact O-N 3.44Å; L151-L153 VanDerWaalsContact C-N 3.27Å; L151-L153 HydrophobicContact CB-CD1 4.33Å; L151-L153 HydrophobicContact CB-CG 4.29Å; L151-L153 PolarHBondContact O-N 3.49Å; L153-Y155 VanDerWaalsContact C-N 3.33Å; L153-Y155 PolarHBondContact O-N 2.81Å; L153-V156 HydrophobicContact CB-CB 4.4Å; L153-V156 HydrophobicContact CB-CG2 4.43Å; L153-V156 PolarHBondContact O-N 3.14Å; L153-V156 VanDerWaalsContact O-N 3.09Å; L153-R157 PolarHBondContact O-N 2.99Å
154	E	95.6	Very high	95.7	Very high	102 Å²	102	35.1 Å²	35.1	48%	0.477	18%	0.176	S	C	.	.	H	α-helix	trans	-53.9	-42.4	-171	-176	62.3	-170.5	0	0	114.5	Q152 V156 R157 E158	Q152-E154 PolarHBondContact O-N 2.86Å; E154-V156 PolarHBondContact O-N 3.34Å; E154-R157 WeakPolarHBondContact O-CB 3.33Å; E154-R157 PolarHBondContact O-N 3.27Å; E154-R157 IonicContact OE1-CZ 2.68Å; E154-R157 IonicContact OE1-NE 3.99Å; E154-R157 IonicContact OE1-NH2 3.13Å; E154-R157 PolarHBondContact OE1-NH2 3.07Å; E154-R157 IonicContact OE2-CZ 3.21Å; E154-R157 VanDerWaalsContact OE2-CZ 3.27Å; E154-R157 IonicContact OE2-NE 3.78Å; E154-R157 PolarHBondContact OE2-NE 3.41Å; E154-R157 IonicContact OE2-NH2 3.44Å; E154-R157 PolarHBondContact OE2-NH2 2.68Å; E154-E158 WeakPolarHBondContact O-CG 3.42Å; E154-E158 PolarHBondContact O-N 3.34Å
155	Y	96.3	Very high	95.5	Very high	158 Å²	158	35.9 Å²	35.9	62%	0.62	18%	0.183	S	C	*	.	H	α-helix	trans	-62.4	-43.9	179.3	179	-92.8	0	0	0	112.1	Y128 L153 A159	Y128-Y155 HydrophobicContact CE2-CD1 4.16Å; L153-Y155 VanDerWaalsContact C-N 3.33Å; L153-Y155 PolarHBondContact O-N 2.81Å; Y155-A159 VanDerWaalsContact O-CB 3.27Å; Y155-A159 WeakPolarHBondContact O-CB 3.33Å; Y155-A159 PolarHBondContact O-N 3.37Å
156	V	96.9	Very high	95	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-68.7	-41.3	179.9	-178.6	0	0	0	0	110.1	L125 Y128 V134 L144 L153 E154 E158 A159 C160	L125-V156 HydrophobicContact CD2-CB 4.34Å; L125-V156 HydrophobicContact CD2-CG1 3.82Å; L125-V156 HydrophobicContact CD2-CG2 4.3Å; Y128-V156 HydrophobicContact CD1-CG2 3.87Å; Y128-V156 HydrophobicContact CD2-CG2 4.04Å; Y128-V156 HydrophobicContact CE1-CG2 3.75Å; Y128-V156 HydrophobicContact CE2-CG2 3.93Å; Y128-V156 HydrophobicContact CG-CG2 4.01Å; V134-V156 HydrophobicContact CG2-CG1 4.07Å; L144-V156 HydrophobicContact CD2-CG1 4.46Å; L144-V156 HydrophobicContact CG-CG1 4.29Å; L153-V156 HydrophobicContact CB-CB 4.4Å; L153-V156 HydrophobicContact CB-CG2 4.43Å; L153-V156 PolarHBondContact O-N 3.14Å; L153-V156 VanDerWaalsContact O-N 3.09Å; E154-V156 PolarHBondContact O-N 3.34Å; V156-E158 PolarHBondContact O-N 2.97Å; V156-A159 PolarHBondContact O-N 2.89Å; V156-C160 WeakPolarHBondContact O-CB 3.37Å; V156-C160 PolarHBondContact O-N 3.22Å; V156-C160 PolarHBondContact O-SG 3.47Å; V156-C160 VanDerWaalsContact O-SG 3.38Å
157	R	96.5	Very high	94.7	Very high	34 Å²	34	49.4 Å²	49.4	13%	0.128	23%	0.226	C	C	.	.	H	α-helix	trans	-56.1	-51.1	175.3	-168.7	-175.7	71.3	80.5	12.8	111.9	Y145 S148 D149 L153 E154 C160 A161 H185	Y145-R157 HydrophobicContact CD2-CG 4.24Å; Y145-R157 WeakPolarHBondContact CD2-O 2.98Å; Y145-R157 HydrophobicContact CE1-CG 4.18Å; Y145-R157 HydrophobicContact CE2-CG 3.61Å; Y145-R157 VanDerWaalsContact CE2-O 3.27Å; Y145-R157 WeakPolarHBondContact CE2-O 3.44Å; Y145-R157 PolarHBondContact OH-NH1 3.14Å; S148-R157 WeakPolarHBondContact OG-CA 3.43Å; S148-R157 PolarHBondContact OG-N 3.34Å; D149-R157 HydrophobicContact CB-CG 4.44Å; D149-R157 WeakPolarHBondContact OD1-CD 2.83Å; L153-R157 PolarHBondContact O-N 2.99Å; E154-R157 WeakPolarHBondContact O-CB 3.33Å; E154-R157 PolarHBondContact O-N 3.27Å; E154-R157 IonicContact OE1-CZ 2.68Å; E154-R157 IonicContact OE1-NE 3.99Å; E154-R157 IonicContact OE1-NH2 3.13Å; E154-R157 PolarHBondContact OE1-NH2 3.07Å; E154-R157 IonicContact OE2-CZ 3.21Å; E154-R157 VanDerWaalsContact OE2-CZ 3.27Å; E154-R157 IonicContact OE2-NE 3.78Å; E154-R157 PolarHBondContact OE2-NE 3.41Å; E154-R157 IonicContact OE2-NH2 3.44Å; E154-R157 PolarHBondContact OE2-NH2 2.68Å; R157-C160 PolarHBondContact O-N 3.19Å; R157-A161 PolarHBondContact O-N 3.12Å; R157-H185 PolarHBondContact NH1-CD2 3.12Å; R157-H185 VanDerWaalsContact NH1-CD2 3.31Å
158	E	96.5	Very high	94.4	Very high	56 Å²	56	50.7 Å²	50.7	26%	0.262	23%	0.233	S	C	.	.	H	α-helix	trans	-67.7	-33.9	177.6	-72.9	-65.2	148	0	0	112.7	E154 V156 A161 S162 H185	E154-E158 WeakPolarHBondContact O-CG 3.42Å; E154-E158 PolarHBondContact O-N 3.34Å; V156-E158 PolarHBondContact O-N 2.97Å; E158-A161 PolarHBondContact O-N 3.19Å; E158-S162 VanDerWaalsContact O-CB 3.26Å; E158-S162 WeakPolarHBondContact O-CB 3.49Å; E158-S162 PolarHBondContact O-N 3.21Å; E158-S162 PolarHBondContact O-OG 3.22Å; E158-H185 IonicContact OE1-CD2 2.75Å; E158-H185 IonicContact OE1-NE2 2.6Å; E158-H185 PolarHBondContact OE1-NE2 3.39Å; E158-H185 IonicContact OE2-NE2 2.86Å
159	A	95.8	Very high	94	Very high	23 Å²	23	52.5 Å²	52.5	19%	0.19	24%	0.242	C	C	.	.	H	α-helix	trans	-65.5	-42.6	174.6	0	0	0	0	0	111.6	L136 Y155 V156 S162 F163	L136-A159 HydrophobicContact CD1-CB 4.2Å; Y155-A159 VanDerWaalsContact O-CB 3.27Å; Y155-A159 WeakPolarHBondContact O-CB 3.33Å; Y155-A159 PolarHBondContact O-N 3.37Å; V156-A159 PolarHBondContact O-N 2.89Å; A159-S162 PolarHBondContact O-N 3.46Å; A159-F163 WeakPolarHBondContact O-CB 3.16Å; A159-F163 PolarHBondContact O-N 3Å
160	C	97.1	Very high	93.6	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-63	-47.4	173.5	-72.9	0	0	0	0	111.4	L136 V141 Y145 V156 R157 S162 F163 L164	L136-C160 WeakPolarHBondContact CD2-SG 3.38Å; V141-C160 HydrophobicContact CG2-CB 3.89Å; Y145-C160 HydrophobicContact CD2-CB 3.62Å; Y145-C160 HydrophobicContact CG-CB 4.25Å; V156-C160 WeakPolarHBondContact O-CB 3.37Å; V156-C160 PolarHBondContact O-N 3.22Å; V156-C160 PolarHBondContact O-SG 3.47Å; V156-C160 VanDerWaalsContact O-SG 3.38Å; R157-C160 PolarHBondContact O-N 3.19Å; C160-S162 VanDerWaalsContact C-N 3.31Å; C160-S162 PolarHBondContact O-N 2.94Å; C160-F163 WeakPolarHBondContact O-CB 3.43Å; C160-F163 PolarHBondContact O-N 2.78Å; C160-F163 VanDerWaalsContact O-N 3.09Å; C160-L164 PolarHBondContact O-N 2.85Å
161	A	96.3	Very high	93.2	Very high	2 Å²	2	51.2 Å²	51.2	2%	0.017	24%	0.239	C	C	.	.	H	α-helix	trans	-58.8	-42.9	174.9	0	0	0	0	0	112.2	Y145 R157 E158 F163 L164 A165 H185 L188	Y145-A161 HydrophobicContact CE2-CB 4.01Å; R157-A161 PolarHBondContact O-N 3.12Å; E158-A161 PolarHBondContact O-N 3.19Å; A161-F163 VanDerWaalsContact C-N 3.29Å; A161-F163 PolarHBondContact O-N 2.7Å; A161-L164 PolarHBondContact O-N 2.74Å; A161-A165 WeakPolarHBondContact O-CB 3.43Å; A161-A165 PolarHBondContact O-N 2.88Å; A161-H185 VanDerWaalsContact CB-NE2 3.33Å; A161-H185 WeakPolarHBondContact CB-NE2 3.17Å; A161-L188 HydrophobicContact CB-CD2 4.33Å
162	S	93.9	Very high	93	Very high	49 Å²	49	53.2 Å²	53.2	34%	0.343	25%	0.25	S	C	.	.	H	α-helix	trans	-67.5	-29	176.8	-61.2	0	0	0	0	112.6	E158 A159 C160 R166	E158-S162 VanDerWaalsContact O-CB 3.26Å; E158-S162 WeakPolarHBondContact O-CB 3.49Å; E158-S162 PolarHBondContact O-N 3.21Å; E158-S162 PolarHBondContact O-OG 3.22Å; A159-S162 PolarHBondContact O-N 3.46Å; C160-S162 VanDerWaalsContact C-N 3.31Å; C160-S162 PolarHBondContact O-N 2.94Å; S162-R166 WeakPolarHBondContact O-CB 3.41Å; S162-R166 VanDerWaalsContact O-CG 3.26Å; S162-R166 WeakPolarHBondContact O-CG 3.45Å; S162-R166 PolarHBondContact O-N 2.95Å; S162-R166 PolarHBondContact O-NE 3.17Å
163	F	94.1	Very high	92.8	Very high	18 Å²	18	48 Å²	48	8%	0.079	23%	0.225	C	C	.	.	H	α-helix	trans	-68.4	-46	171.8	-176.6	-85.1	0	0	0	111.2	L136 E138 V141 A159 C160 A161 R166 R167	L136-F163 HydrophobicContact CB-CD2 3.93Å; L136-F163 HydrophobicContact CB-CE2 4.17Å; L136-F163 HydrophobicContact CB-CG 4.34Å; L136-F163 HydrophobicContact CD1-CB 3.92Å; L136-F163 HydrophobicContact CD1-CD2 4.28Å; L136-F163 HydrophobicContact CD1-CG 4.32Å; E138-F163 HydrophobicContact CG-CE1 4.22Å; E138-F163 HydrophobicContact CG-CZ 4.32Å; V141-F163 HydrophobicContact CB-CD1 4.19Å; V141-F163 HydrophobicContact CB-CE1 4.45Å; V141-F163 HydrophobicContact CG1-CD1 4.36Å; V141-F163 HydrophobicContact CG1-CE1 4.41Å; V141-F163 HydrophobicContact CG2-CB 4.42Å; V141-F163 HydrophobicContact CG2-CD1 3.9Å; V141-F163 HydrophobicContact CG2-CG 4.47Å; A159-F163 WeakPolarHBondContact O-CB 3.16Å; A159-F163 PolarHBondContact O-N 3Å; C160-F163 WeakPolarHBondContact O-CB 3.43Å; C160-F163 PolarHBondContact O-N 2.78Å; C160-F163 VanDerWaalsContact O-N 3.09Å; A161-F163 VanDerWaalsContact C-N 3.29Å; A161-F163 PolarHBondContact O-N 2.7Å; F163-R166 PolarHBondContact O-N 3.4Å; F163-R167 PolarHBondContact O-N 3.44Å
164	L	94.6	Very high	92.6	Very high	13 Å²	13	47.8 Å²	47.8	7%	0.068	23%	0.225	C	C	.	.	H	α-helix	trans	-62	-47.8	176.1	-67.7	173.4	0	0	0	111.8	V141 C160 A161 R166 R167 L168 F179 L188	V141-L164 HydrophobicContact CG1-CD2 3.74Å; V141-L164 HydrophobicContact CG2-CD1 4.5Å; V141-L164 HydrophobicContact CG2-CD2 4.11Å; V141-L164 HydrophobicContact CG2-CG 3.97Å; C160-L164 PolarHBondContact O-N 2.85Å; A161-L164 PolarHBondContact O-N 2.74Å; L164-R166 VanDerWaalsContact C-N 3.3Å; L164-R166 PolarHBondContact O-N 3.04Å; L164-R167 CarbonylContact O-C 3.54Å; L164-R167 PolarHBondContact O-N 3.32Å; L164-L168 PolarHBondContact O-N 3.44Å; L164-F179 HydrophobicContact CD1-CD1 3.95Å; L164-F179 HydrophobicContact CD1-CE1 3.82Å; L164-L188 HydrophobicContact CB-CD1 4.14Å; L164-L188 HydrophobicContact CB-CD2 4.34Å; L164-L188 HydrophobicContact CD1-CD2 3.99Å
165	A	91.7	Very high	92.5	Very high	18 Å²	18	44 Å²	44	15%	0.149	21%	0.211	C	C	.	.	H	α-helix	trans	-59.6	-38.3	179.9	0	0	0	0	0	113	A161 R167 L168 L188 Q191	A161-A165 WeakPolarHBondContact O-CB 3.43Å; A161-A165 PolarHBondContact O-N 2.88Å; A165-R167 PolarHBondContact O-N 2.97Å; A165-L168 WeakPolarHBondContact O-CD1 3.09Å; A165-L188 HydrophobicContact CB-CD1 3.83Å; A165-Q191 VanDerWaalsContact CB-OE1 3.31Å
166	R	88.1	Confident	92.4	Very high	187 Å²	187	37 Å²	37	71%	0.706	18%	0.184	S	C	*	.	H	α-helix	trans	-71.1	-17.8	178.3	-76.4	-178.5	-63.7	151.9	-2.4	113.8	S162 F163 L164	S162-R166 WeakPolarHBondContact O-CB 3.41Å; S162-R166 VanDerWaalsContact O-CG 3.26Å; S162-R166 WeakPolarHBondContact O-CG 3.45Å; S162-R166 PolarHBondContact O-N 2.95Å; S162-R166 PolarHBondContact O-NE 3.17Å; F163-R166 PolarHBondContact O-N 3.4Å; L164-R166 VanDerWaalsContact C-N 3.3Å; L164-R166 PolarHBondContact O-N 3.04Å
167	R	88.3	Confident	92.3	Very high	130 Å²	130	37 Å²	37	49%	0.491	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.4	23.2	-178.9	-62.7	-174.1	-174.9	-85.5	-5.3	112.3	E138 F163 L164 A165 D169 N172	E138-R167 IonicContact OE1-NH1 3.47Å; F163-R167 PolarHBondContact O-N 3.44Å; L164-R167 CarbonylContact O-C 3.54Å; L164-R167 PolarHBondContact O-N 3.32Å; A165-R167 PolarHBondContact O-N 2.97Å; R167-D169 PolarHBondContact O-N 3.12Å; R167-N172 PolarHBondContact O-ND2 3.28Å
168	L	89.3	Confident	92.2	Very high	30 Å²	30	38.2 Å²	38.2	16%	0.157	19%	0.19	C	C	.	.			trans	-60.9	125.6	170.6	-81.5	165.3	0	0	0	109.9	L164 A165 C173 I176 Q191 A192 Y195	L164-L168 PolarHBondContact O-N 3.44Å; A165-L168 WeakPolarHBondContact O-CD1 3.09Å; L168-C173 HydrophobicContact CD2-CB 4.33Å; L168-I176 HydrophobicContact CD2-CB 4.07Å; L168-I176 HydrophobicContact CD2-CD1 3.74Å; L168-I176 HydrophobicContact CD2-CG2 3.93Å; L168-I176 HydrophobicContact CG-CD1 4.36Å; L168-Q191 HydrophobicContact CD1-CB 4.24Å; L168-A192 HydrophobicContact CD2-CB 4.28Å; L168-Y195 HydrophobicContact CB-CD2 4.12Å; L168-Y195 HydrophobicContact CB-CE2 4.38Å; L168-Y195 HydrophobicContact CB-CG 4.28Å
169	D	87.3	Confident	92.1	Very high	37 Å²	37	36.7 Å²	36.7	20%	0.198	18%	0.183	C	C	.	.			trans	-138.1	166.9	177.3	-161.7	-2.9	0	0	0	109	R167 T171 N172 C173 Y195 K460	R167-D169 PolarHBondContact O-N 3.12Å; D169-T171 PolarHBondContact O-N 3.04Å; D169-T171 VanDerWaalsContact O-N 3.12Å; D169-N172 PolarHBondContact N-OD1 3.39Å; D169-N172 PolarHBondContact O-N 3.05Å; D169-N172 PolarHBondContact O-OD1 2.93Å; D169-N172 VanDerWaalsContact O-OD1 3.06Å; D169-C173 WeakPolarHBondContact O-CB 3.48Å; D169-C173 PolarHBondContact O-N 2.9Å; D169-C173 VanDerWaalsContact O-N 3.07Å; D169-Y195 WeakPolarHBondContact CA-OH 3.42Å; D169-K460 IonicContact OD1-NZ 3.5Å; D169-K460 PolarHBondContact OD1-NZ 2.85Å; D169-K460 IonicContact OD2-NZ 2.71Å; D169-K460 PolarHBondContact OD2-NZ 2.6Å
170	L	85.8	Confident	92.2	Very high	36 Å²	36	35.6 Å²	35.6	19%	0.188	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-26.3	177.4	-61.9	168.7	0	0	0	112.3	Y195 N199 L203 M206	L170-Y195 HydrophobicContact CD2-CE1 4.19Å; L170-Y195 PolarHBondContact N-OH 3.21Å; L170-N199 HydrophobicContact CD2-CB 3.43Å; L170-N199 VanDerWaalsContact CD2-CB 3.43Å; L170-L203 HydrophobicContact CD2-CD2 4.37Å; L170-L203 HydrophobicContact CD2-CG 4.47Å; L170-M206 HydrophobicContact CB-CE 4.19Å; L170-M206 HydrophobicContact CD1-CE 3.92Å; L170-M206 HydrophobicContact CG-CE 4.48Å
171	T	86.8	Confident	92	Very high	63 Å²	63	37.6 Å²	37.6	39%	0.387	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-29.4	-179.2	50.8	0	0	0	0	114.3	D169	D169-T171 PolarHBondContact O-N 3.04Å; D169-T171 VanDerWaalsContact O-N 3.12Å
172	N	89.9	Confident	91.9	Very high	44 Å²	44	41.4 Å²	41.4	24%	0.235	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.2	-7	-167.2	66.8	17.1	0	0	0	113.4	R167 D169 T174 A175 I176	R167-N172 PolarHBondContact O-ND2 3.28Å; D169-N172 PolarHBondContact N-OD1 3.39Å; D169-N172 PolarHBondContact O-N 3.05Å; D169-N172 PolarHBondContact O-OD1 2.93Å; D169-N172 VanDerWaalsContact O-OD1 3.06Å; N172-T174 VanDerWaalsContact C-N 3.25Å; N172-T174 PolarHBondContact O-N 2.59Å; N172-A175 PolarHBondContact O-N 3.22Å; N172-I176 HydrophobicContact CB-CD1 4.15Å; N172-I176 WeakPolarHBondContact O-CG1 3.34Å; N172-I176 PolarHBondContact O-N 3.34Å
173	C	92.4	Very high	91.9	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-58.7	-34.3	-175.8	62.3	0	0	0	0	113.6	L168 D169 L177 Y195 I196	L168-C173 HydrophobicContact CD2-CB 4.33Å; D169-C173 WeakPolarHBondContact O-CB 3.48Å; D169-C173 PolarHBondContact O-N 2.9Å; D169-C173 VanDerWaalsContact O-N 3.07Å; C173-L177 WeakPolarHBondContact O-CB 3.22Å; C173-L177 PolarHBondContact O-N 2.88Å; C173-Y195 HydrophobicContact CB-CD1 3.64Å; C173-Y195 HydrophobicContact CB-CE1 4.02Å; C173-I196 HydrophobicContact CB-CD1 4.49Å; C173-I196 HydrophobicContact CB-CG1 3.97Å
174	T	92.4	Very high	91.9	Very high	4 Å²	4	43.4 Å²	43.4	3%	0.025	23%	0.231	C	C	.	.	H	α-helix	trans	-70.6	-46.7	176.1	47	0	0	0	0	112.4	N172 L177 K178 E212 L214 L217	N172-T174 VanDerWaalsContact C-N 3.25Å; N172-T174 PolarHBondContact O-N 2.59Å; T174-L177 PolarHBondContact O-N 3.39Å; T174-K178 WeakPolarHBondContact O-CG 3.32Å; T174-K178 PolarHBondContact O-N 2.98Å; T174-E212 PolarHBondContact OG1-OE2 3.29Å; T174-L214 HydrophobicContact CG2-CD2 4.18Å; T174-L217 HydrophobicContact CG2-CD2 4.46Å
175	A	92.1	Very high	92	Very high	23 Å²	23	43.2 Å²	43.2	19%	0.19	23%	0.23	C	C	.	.	H	α-helix	trans	-57	-49.6	172.3	0	0	0	0	0	111.2	N172 L177 K178 F179 E212	N172-A175 PolarHBondContact O-N 3.22Å; A175-L177 VanDerWaalsContact C-N 3.3Å; A175-L177 PolarHBondContact O-N 3.38Å; A175-K178 WeakPolarHBondContact O-CB 3.46Å; A175-K178 PolarHBondContact O-N 2.85Å; A175-K178 VanDerWaalsContact O-N 3.14Å; A175-F179 VanDerWaalsContact O-CB 3.32Å; A175-F179 WeakPolarHBondContact O-CB 3.46Å; A175-F179 PolarHBondContact O-N 2.84Å; A175-E212 WeakPolarHBondContact CA-OE2 3.42Å; A175-E212 WeakPolarHBondContact CB-OE2 3.35Å; A175-E212 PolarHBondContact N-OE2 3.31Å
176	I	94.4	Very high	92.1	Very high	9 Å²	9	51.9 Å²	51.9	5%	0.046	26%	0.258	C	S	.	.	H	α-helix	trans	-64.6	-36.2	-178.3	-66.8	170.3	0	0	0	110.9	L168 N172 F179 A180 L188 A192	L168-I176 HydrophobicContact CD2-CB 4.07Å; L168-I176 HydrophobicContact CD2-CD1 3.74Å; L168-I176 HydrophobicContact CD2-CG2 3.93Å; L168-I176 HydrophobicContact CG-CD1 4.36Å; N172-I176 HydrophobicContact CB-CD1 4.15Å; N172-I176 WeakPolarHBondContact O-CG1 3.34Å; N172-I176 PolarHBondContact O-N 3.34Å; I176-F179 PolarHBondContact O-N 3.43Å; I176-A180 VanDerWaalsContact O-CB 3.27Å; I176-A180 WeakPolarHBondContact O-CB 3.41Å; I176-A180 PolarHBondContact O-N 3.42Å; I176-L188 HydrophobicContact CG2-CD1 3.82Å; I176-L188 HydrophobicContact CG2-CD2 4.16Å; I176-L188 HydrophobicContact CG2-CG 3.98Å; I176-A192 HydrophobicContact CG2-CB 4.36Å
177	L	95.6	Very high	92.5	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-62.1	-48.6	172.3	177.1	58.7	0	0	0	111.5	C173 T174 A175 F179 A180 D181 R189 A192 Q193 I196 L217 V225	C173-L177 WeakPolarHBondContact O-CB 3.22Å; C173-L177 PolarHBondContact O-N 2.88Å; T174-L177 PolarHBondContact O-N 3.39Å; A175-L177 VanDerWaalsContact C-N 3.3Å; A175-L177 PolarHBondContact O-N 3.38Å; L177-F179 VanDerWaalsContact C-N 3.32Å; L177-F179 PolarHBondContact O-N 3.47Å; L177-A180 PolarHBondContact O-N 3.37Å; L177-D181 PolarHBondContact O-N 3.07Å; L177-R189 HydrophobicContact CD1-CG 3.79Å; L177-A192 HydrophobicContact CB-CB 4.02Å; L177-A192 HydrophobicContact CD1-CB 4.34Å; L177-Q193 HydrophobicContact CD1-CG 3.72Å; L177-Q193 HydrophobicContact CD2-CG 4.43Å; L177-I196 HydrophobicContact CB-CD1 4.22Å; L177-I196 HydrophobicContact CD2-CD1 3.66Å; L177-L217 HydrophobicContact CD2-CD2 4.13Å; L177-V225 HydrophobicContact CD2-CG2 4.05Å
178	K	94.4	Very high	92.9	Very high	60 Å²	60	42.6 Å²	42.6	26%	0.261	23%	0.227	S	C	.	.	H	α-helix	trans	-59.1	-45	177.3	-71.3	171.1	176.9	-177.8	0	111.8	T174 A175 D181 A182 D216 L217	T174-K178 WeakPolarHBondContact O-CG 3.32Å; T174-K178 PolarHBondContact O-N 2.98Å; A175-K178 WeakPolarHBondContact O-CB 3.46Å; A175-K178 PolarHBondContact O-N 2.85Å; A175-K178 VanDerWaalsContact O-N 3.14Å; K178-D181 PolarHBondContact O-N 3.45Å; K178-A182 WeakPolarHBondContact O-CB 3.48Å; K178-A182 PolarHBondContact O-N 3.29Å; K178-D216 WeakPolarHBondContact CE-O 3.34Å; K178-D216 PolarHBondContact NZ-O 3.36Å; K178-L217 HydrophobicContact CG-CD2 4.24Å
179	F	94.8	Very high	93.2	Very high	25 Å²	25	45 Å²	45	11%	0.11	23%	0.234	C	C	.	.	H	α-helix	trans	-59.4	-49.9	176.5	-176.5	-88.5	0	0	0	111.1	E142 Y145 L164 A175 I176 L177 D181 A182 F183 L188	E142-F179 HydrophobicContact CB-CE2 3.96Å; E142-F179 HydrophobicContact CG-CD2 4.43Å; E142-F179 HydrophobicContact CG-CE2 4.16Å; Y145-F179 AromaticContact CD1-CE1 3.68Å; Y145-F179 HydrophobicContact CD1-CE1 3.68Å; Y145-F179 AromaticContact CD1-CZ 3.47Å; Y145-F179 HydrophobicContact CD1-CZ 3.47Å; Y145-F179 VanDerWaalsContact CD1-CZ 3.47Å; Y145-F179 HydrophobicContact CD2-CE1 4.16Å; Y145-F179 HydrophobicContact CD2-CZ 4.44Å; Y145-F179 HydrophobicContact CE1-CE1 4.05Å; Y145-F179 HydrophobicContact CE1-CZ 4.22Å; Y145-F179 HydrophobicContact CE2-CE1 4.49Å; Y145-F179 AromaticContact CG-CE1 3.77Å; Y145-F179 HydrophobicContact CG-CE1 3.77Å; Y145-F179 AromaticContact CG-CZ 3.64Å; Y145-F179 HydrophobicContact CG-CZ 3.64Å; L164-F179 HydrophobicContact CD1-CD1 3.95Å; L164-F179 HydrophobicContact CD1-CE1 3.82Å; A175-F179 VanDerWaalsContact O-CB 3.32Å; A175-F179 WeakPolarHBondContact O-CB 3.46Å; A175-F179 PolarHBondContact O-N 2.84Å; I176-F179 PolarHBondContact O-N 3.43Å; L177-F179 VanDerWaalsContact C-N 3.32Å; L177-F179 PolarHBondContact O-N 3.47Å; F179-D181 VanDerWaalsContact C-N 3.3Å; F179-D181 PolarHBondContact O-N 2.94Å; F179-A182 PolarHBondContact O-N 2.83Å; F179-F183 HydrophobicContact CD1-CD2 4.18Å; F179-F183 HydrophobicContact CD2-CD2 4.17Å; F179-F183 AromaticContact CD2-CE2 3.88Å; F179-F183 HydrophobicContact CD2-CE2 3.88Å; F179-F183 AromaticContact CE1-CD2 3.84Å; F179-F183 HydrophobicContact CE1-CD2 3.84Å; F179-F183 HydrophobicContact CE1-CE2 4.17Å; F179-F183 AromaticContact CE2-CD2 3.85Å; F179-F183 HydrophobicContact CE2-CD2 3.85Å; F179-F183 AromaticContact CE2-CE2 3.35Å; F179-F183 HydrophobicContact CE2-CE2 3.35Å; F179-F183 HydrophobicContact CE2-CZ 4.31Å; F179-F183 HydrophobicContact CG-CD2 4.31Å; F179-F183 HydrophobicContact CG-CE2 4.48Å; F179-F183 AromaticContact CZ-CD2 3.65Å; F179-F183 HydrophobicContact CZ-CD2 3.65Å; F179-F183 AromaticContact CZ-CE2 3.5Å; F179-F183 HydrophobicContact CZ-CE2 3.5Å; F179-F183 VanDerWaalsContact CZ-CE2 3.5Å; F179-F183 HydrophobicContact CZ-CZ 4.38Å; F179-F183 WeakPolarHBondContact O-CD2 3.46Å; F179-F183 PolarHBondContact O-N 3.18Å; F179-F183 VanDerWaalsContact O-N 3.16Å; F179-L188 HydrophobicContact CD1-CD2 4.33Å
180	A	96.3	Very high	93.5	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-62.2	-36.5	-179.8	0	0	0	0	0	112.8	I176 L177 G184 H185 L188 R189	I176-A180 VanDerWaalsContact O-CB 3.27Å; I176-A180 WeakPolarHBondContact O-CB 3.41Å; I176-A180 PolarHBondContact O-N 3.42Å; L177-A180 PolarHBondContact O-N 3.37Å; A180-G184 CarbonylContact O-C 3.51Å; A180-G184 PolarHBondContact O-N 2.94Å; A180-G184 VanDerWaalsContact O-N 3.08Å; A180-H185 PolarHBondContact O-N 3.05Å; A180-L188 HydrophobicContact CB-CB 4.05Å; A180-L188 HydrophobicContact CB-CD2 3.99Å; A180-L188 HydrophobicContact CB-CG 3.87Å; A180-R189 HydrophobicContact CB-CB 3.87Å
181	D	94.6	Very high	93.9	Very high	42 Å²	42	48.2 Å²	48.2	23%	0.225	25%	0.254	C	S	.	.	H	α-helix	trans	-70.1	-41.4	173.6	-87.8	-39.8	0	0	0	112.7	L177 K178 F179 F183 G184 R189 Q221	L177-D181 PolarHBondContact O-N 3.07Å; K178-D181 PolarHBondContact O-N 3.45Å; F179-D181 VanDerWaalsContact C-N 3.3Å; F179-D181 PolarHBondContact O-N 2.94Å; D181-F183 PolarHBondContact O-N 3.4Å; D181-G184 PolarHBondContact O-N 3.24Å; D181-R189 WeakPolarHBondContact OD1-CD 3.17Å; D181-R189 IonicContact OD1-CZ 2.85Å; D181-R189 IonicContact OD1-NE 3.45Å; D181-R189 IonicContact OD1-NH1 3.65Å; D181-R189 PolarHBondContact OD1-NH1 3.1Å; D181-Q221 WeakPolarHBondContact OD2-CG 3.5Å; D181-Q221 PolarHBondContact OD2-NE2 3.27Å; D181-Q221 VanDerWaalsContact OD2-NE2 3.12Å
182	A	93.6	Very high	94.3	Very high	82 Å²	82	45.2 Å²	45.2	68%	0.678	24%	0.236	S	C	*	.	H	α-helix	trans	-58.3	-38.2	179.1	0	0	0	0	0	112.2	K178 F179	K178-A182 WeakPolarHBondContact O-CB 3.48Å; K178-A182 PolarHBondContact O-N 3.29Å; F179-A182 PolarHBondContact O-N 2.83Å
183	F	94.3	Very high	94.6	Very high	65 Å²	65	44.6 Å²	44.6	29%	0.285	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.7	4.3	176	-68.9	-81.2	0	0	0	114	Y145 A146 D149 F179 D181 H185	Y145-F183 HydrophobicContact CD1-CD1 4.11Å; Y145-F183 HydrophobicContact CD1-CD2 4.11Å; Y145-F183 HydrophobicContact CD1-CE1 4.31Å; Y145-F183 HydrophobicContact CD1-CE2 4.34Å; Y145-F183 HydrophobicContact CD1-CG 4.02Å; Y145-F183 HydrophobicContact CD1-CZ 4.44Å; Y145-F183 HydrophobicContact CE1-CB 3.66Å; Y145-F183 AromaticContact CE1-CD1 3.74Å; Y145-F183 HydrophobicContact CE1-CD1 3.74Å; Y145-F183 AromaticContact CE1-CD2 3.96Å; Y145-F183 HydrophobicContact CE1-CD2 3.96Å; Y145-F183 HydrophobicContact CE1-CE1 4.39Å; Y145-F183 AromaticContact CE1-CG 3.5Å; Y145-F183 HydrophobicContact CE1-CG 3.5Å; Y145-F183 VanDerWaalsContact CE1-CG 3.5Å; A146-F183 HydrophobicContact CB-CE1 3.9Å; A146-F183 HydrophobicContact CB-CZ 3.57Å; D149-F183 HydrophobicContact CB-CD1 4.43Å; F179-F183 HydrophobicContact CD1-CD2 4.18Å; F179-F183 HydrophobicContact CD2-CD2 4.17Å; F179-F183 AromaticContact CD2-CE2 3.88Å; F179-F183 HydrophobicContact CD2-CE2 3.88Å; F179-F183 AromaticContact CE1-CD2 3.84Å; F179-F183 HydrophobicContact CE1-CD2 3.84Å; F179-F183 HydrophobicContact CE1-CE2 4.17Å; F179-F183 AromaticContact CE2-CD2 3.85Å; F179-F183 HydrophobicContact CE2-CD2 3.85Å; F179-F183 AromaticContact CE2-CE2 3.35Å; F179-F183 HydrophobicContact CE2-CE2 3.35Å; F179-F183 HydrophobicContact CE2-CZ 4.31Å; F179-F183 HydrophobicContact CG-CD2 4.31Å; F179-F183 HydrophobicContact CG-CE2 4.48Å; F179-F183 AromaticContact CZ-CD2 3.65Å; F179-F183 HydrophobicContact CZ-CD2 3.65Å; F179-F183 AromaticContact CZ-CE2 3.5Å; F179-F183 HydrophobicContact CZ-CE2 3.5Å; F179-F183 VanDerWaalsContact CZ-CE2 3.5Å; F179-F183 HydrophobicContact CZ-CZ 4.38Å; F179-F183 WeakPolarHBondContact O-CD2 3.46Å; F179-F183 PolarHBondContact O-N 3.18Å; F179-F183 VanDerWaalsContact O-N 3.16Å; D181-F183 PolarHBondContact O-N 3.4Å; F183-H185 PolarHBondContact O-N 3.46Å; F183-H185 VanDerWaalsContact O-N 3.11Å
184	G	94.1	Very high	94.5	Very high	44 Å²	44	46.9 Å²	46.9	45%	0.454	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.6	19.6	-179.5	0	0	0	0	0	114.9	A180 D181 R186	A180-G184 CarbonylContact O-C 3.51Å; A180-G184 PolarHBondContact O-N 2.94Å; A180-G184 VanDerWaalsContact O-N 3.08Å; D181-G184 PolarHBondContact O-N 3.24Å; G184-R186 PolarHBondContact O-N 2.95Å
185	H	95.4	Very high	94.5	Very high	8 Å²	8	49 Å²	49	4%	0.037	26%	0.255	C	S	.	.			trans	-78.6	90.6	-175.9	-172.8	-64.8	0	0	0	111.6	Y145 R157 E158 A161 A180 F183 K187 L188 R189	Y145-H185 WeakPolarHBondContact OH-CB 3.46Å; Y145-H185 PolarHBondContact OH-CD2 2.75Å; R157-H185 PolarHBondContact NH1-CD2 3.12Å; R157-H185 VanDerWaalsContact NH1-CD2 3.31Å; E158-H185 IonicContact OE1-CD2 2.75Å; E158-H185 IonicContact OE1-NE2 2.6Å; E158-H185 PolarHBondContact OE1-NE2 3.39Å; E158-H185 IonicContact OE2-NE2 2.86Å; A161-H185 VanDerWaalsContact CB-NE2 3.33Å; A161-H185 WeakPolarHBondContact CB-NE2 3.17Å; A180-H185 PolarHBondContact O-N 3.05Å; F183-H185 PolarHBondContact O-N 3.46Å; F183-H185 VanDerWaalsContact O-N 3.11Å; H185-K187 PolarHBondContact O-N 3.38Å; H185-L188 PolarHBondContact CE1-N 2.86Å; H185-L188 VanDerWaalsContact CE1-N 3.32Å; H185-L188 WeakPolarHBondContact ND1-CB 3.49Å; H185-L188 PolarHBondContact ND1-N 3.12Å; H185-L188 PolarHBondContact O-N 2.89Å; H185-R189 WeakPolarHBondContact O-CB 3.16Å; H185-R189 PolarHBondContact O-N 3.49Å
186	R	95.2	Very high	94.5	Very high	200 Å²	200	47.9 Å²	47.9	76%	0.755	25%	0.246	S	C	*	.	H	α-helix	trans	-56	-40.7	-171.6	-60.5	-176.4	-178.9	-173.5	0.1	115	G184 S190	G184-R186 PolarHBondContact O-N 2.95Å; R186-S190 PolarHBondContact O-N 3.31Å
187	K	95.3	Very high	94.4	Very high	123 Å²	123	47.4 Å²	47.4	54%	0.535	24%	0.244	S	C	.	.	H	α-helix	trans	-68.8	-53.6	-176	179.5	-178.4	177.5	-173	0	111.7	H185 R189 S190 Q191	H185-K187 PolarHBondContact O-N 3.38Å; K187-R189 VanDerWaalsContact C-N 3.27Å; K187-R189 PolarHBondContact O-N 2.68Å; K187-S190 PolarHBondContact O-N 3.02Å; K187-S190 VanDerWaalsContact O-N 3.17Å; K187-Q191 WeakPolarHBondContact O-CG 3.44Å; K187-Q191 PolarHBondContact O-N 3.11Å
188	L	96.1	Very high	94	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-55.3	-42.3	173.2	-176.1	61.6	0	0	0	111.8	A161 L164 A165 I176 F179 A180 H185 Q191 A192	A161-L188 HydrophobicContact CB-CD2 4.33Å; L164-L188 HydrophobicContact CB-CD1 4.14Å; L164-L188 HydrophobicContact CB-CD2 4.34Å; L164-L188 HydrophobicContact CD1-CD2 3.99Å; A165-L188 HydrophobicContact CB-CD1 3.83Å; I176-L188 HydrophobicContact CG2-CD1 3.82Å; I176-L188 HydrophobicContact CG2-CD2 4.16Å; I176-L188 HydrophobicContact CG2-CG 3.98Å; F179-L188 HydrophobicContact CD1-CD2 4.33Å; A180-L188 HydrophobicContact CB-CB 4.05Å; A180-L188 HydrophobicContact CB-CD2 3.99Å; A180-L188 HydrophobicContact CB-CG 3.87Å; H185-L188 PolarHBondContact CE1-N 2.86Å; H185-L188 VanDerWaalsContact CE1-N 3.32Å; H185-L188 WeakPolarHBondContact ND1-CB 3.49Å; H185-L188 PolarHBondContact ND1-N 3.12Å; H185-L188 PolarHBondContact O-N 2.89Å; L188-Q191 PolarHBondContact O-N 2.89Å; L188-A192 WeakPolarHBondContact O-CB 3.27Å; L188-A192 PolarHBondContact O-N 2.8Å
189	R	96.1	Very high	93.7	Very high	80 Å²	80	48.5 Å²	48.5	30%	0.302	25%	0.25	S	S	.	.	H	α-helix	trans	-58.5	-50.2	174.8	176.8	174.1	73.9	-176.9	0.7	112.4	L177 A180 D181 H185 K187 Q191 A192 Q193	L177-R189 HydrophobicContact CD1-CG 3.79Å; A180-R189 HydrophobicContact CB-CB 3.87Å; D181-R189 WeakPolarHBondContact OD1-CD 3.17Å; D181-R189 IonicContact OD1-CZ 2.85Å; D181-R189 IonicContact OD1-NE 3.45Å; D181-R189 IonicContact OD1-NH1 3.65Å; D181-R189 PolarHBondContact OD1-NH1 3.1Å; H185-R189 WeakPolarHBondContact O-CB 3.16Å; H185-R189 PolarHBondContact O-N 3.49Å; K187-R189 VanDerWaalsContact C-N 3.27Å; K187-R189 PolarHBondContact O-N 2.68Å; R189-Q191 VanDerWaalsContact C-N 3.26Å; R189-Q191 PolarHBondContact O-N 3.16Å; R189-A192 PolarHBondContact O-N 3.38Å; R189-Q193 HydrophobicContact CG-CG 4.39Å; R189-Q193 WeakPolarHBondContact O-CB 3.42Å; R189-Q193 WeakPolarHBondContact O-CG 3.45Å; R189-Q193 PolarHBondContact O-N 2.86Å
190	S	94.8	Very high	93.4	Very high	65 Å²	65	47.4 Å²	47.4	46%	0.455	25%	0.245	S	C	.	.	H	α-helix	trans	-59.5	-40.5	177.8	-174.2	0	0	0	0	111.3	R186 K187 Q193 S194	R186-S190 PolarHBondContact O-N 3.31Å; K187-S190 PolarHBondContact O-N 3.02Å; K187-S190 VanDerWaalsContact O-N 3.17Å; S190-Q193 PolarHBondContact O-N 3.04Å; S190-S194 WeakPolarHBondContact O-CB 3.33Å; S190-S194 PolarHBondContact O-N 3.34Å; S190-S194 PolarHBondContact O-OG 2.88Å
191	Q	93.3	Very high	92.9	Very high	76 Å²	76	50.7 Å²	50.7	36%	0.355	26%	0.26	S	S	.	.	H	α-helix	trans	-64.4	-44.6	177.5	-70	173.5	-52	0	0	111.8	A165 L168 K187 L188 R189 S194 Y195	A165-Q191 VanDerWaalsContact CB-OE1 3.31Å; L168-Q191 HydrophobicContact CD1-CB 4.24Å; K187-Q191 WeakPolarHBondContact O-CG 3.44Å; K187-Q191 PolarHBondContact O-N 3.11Å; L188-Q191 PolarHBondContact O-N 2.89Å; R189-Q191 VanDerWaalsContact C-N 3.26Å; R189-Q191 PolarHBondContact O-N 3.16Å; Q191-S194 PolarHBondContact O-N 3.12Å; Q191-Y195 WeakPolarHBondContact O-CB 3.27Å; Q191-Y195 PolarHBondContact O-N 2.83Å
192	A	95.6	Very high	92.4	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-64.1	-42.7	176	0	0	0	0	0	111.9	L168 I176 L177 L188 R189 Y195 I196	L168-A192 HydrophobicContact CD2-CB 4.28Å; I176-A192 HydrophobicContact CG2-CB 4.36Å; L177-A192 HydrophobicContact CB-CB 4.02Å; L177-A192 HydrophobicContact CD1-CB 4.34Å; L188-A192 WeakPolarHBondContact O-CB 3.27Å; L188-A192 PolarHBondContact O-N 2.8Å; R189-A192 PolarHBondContact O-N 3.38Å; A192-Y195 PolarHBondContact O-N 3.01Å; A192-I196 VanDerWaalsContact O-CG1 3.31Å; A192-I196 WeakPolarHBondContact O-CG1 3.35Å; A192-I196 PolarHBondContact O-N 3.24Å
193	Q	95.1	Very high	92.1	Very high	30 Å²	30	48.6 Å²	48.6	14%	0.14	24%	0.235	C	C	.	.	H	α-helix	trans	-62.5	-46.2	175.6	-75.2	176.6	-28.2	0	0	112.3	L177 R189 S190 Y195 I196 A197 L228	L177-Q193 HydrophobicContact CD1-CG 3.72Å; L177-Q193 HydrophobicContact CD2-CG 4.43Å; R189-Q193 HydrophobicContact CG-CG 4.39Å; R189-Q193 WeakPolarHBondContact O-CB 3.42Å; R189-Q193 WeakPolarHBondContact O-CG 3.45Å; R189-Q193 PolarHBondContact O-N 2.86Å; S190-Q193 PolarHBondContact O-N 3.04Å; Q193-Y195 VanDerWaalsContact C-N 3.3Å; Q193-Y195 PolarHBondContact O-N 3.49Å; Q193-I196 PolarHBondContact O-N 3.04Å; Q193-A197 WeakPolarHBondContact O-CB 3.45Å; Q193-A197 PolarHBondContact O-N 3.21Å; Q193-L228 HydrophobicContact CB-CD1 4.31Å
194	S	91.5	Very high	91.7	Very high	48 Å²	48	45.5 Å²	45.5	34%	0.336	22%	0.221	S	C	.	.	H	α-helix	trans	-62.2	-38.4	176.1	-64.2	0	0	0	0	111.9	S190 Q191 A197 Q198	S190-S194 WeakPolarHBondContact O-CB 3.33Å; S190-S194 PolarHBondContact O-N 3.34Å; S190-S194 PolarHBondContact O-OG 2.88Å; Q191-S194 PolarHBondContact O-N 3.12Å; S194-A197 PolarHBondContact O-N 3.26Å; S194-Q198 VanDerWaalsContact O-CG 3.27Å; S194-Q198 WeakPolarHBondContact O-CG 3.36Å; S194-Q198 PolarHBondContact O-N 3.31Å; S194-Q198 PolarHBondContact O-NE2 2.92Å
195	Y	91.5	Very high	91.1	Very high	48 Å²	48	50 Å²	50	19%	0.188	23%	0.23	C	C	.	.	H	α-helix	trans	-64.8	-45.5	175.6	-173.9	-87.2	0	0	0	111.9	L168 D169 L170 C173 Q191 A192 Q193 A197 Q198 N199	L168-Y195 HydrophobicContact CB-CD2 4.12Å; L168-Y195 HydrophobicContact CB-CE2 4.38Å; L168-Y195 HydrophobicContact CB-CG 4.28Å; D169-Y195 WeakPolarHBondContact CA-OH 3.42Å; L170-Y195 HydrophobicContact CD2-CE1 4.19Å; L170-Y195 PolarHBondContact N-OH 3.21Å; C173-Y195 HydrophobicContact CB-CD1 3.64Å; C173-Y195 HydrophobicContact CB-CE1 4.02Å; Q191-Y195 WeakPolarHBondContact O-CB 3.27Å; Q191-Y195 PolarHBondContact O-N 2.83Å; A192-Y195 PolarHBondContact O-N 3.01Å; Q193-Y195 VanDerWaalsContact C-N 3.3Å; Q193-Y195 PolarHBondContact O-N 3.49Å; Y195-A197 VanDerWaalsContact C-N 3.31Å; Y195-A197 PolarHBondContact O-N 3.39Å; Y195-Q198 PolarHBondContact O-N 3.31Å; Y195-N199 PolarHBondContact O-N 3.27Å; Y195-N199 VanDerWaalsContact O-N 3.14Å; Y195-N199 PolarHBondContact O-ND2 3.38Å
196	I	92.8	Very high	90	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-60.9	-42.6	174.9	-70.3	163.6	0	0	0	110.5	C173 L177 A192 Q193 Q198 N199 F200 L203 L214 V225	C173-I196 HydrophobicContact CB-CD1 4.49Å; C173-I196 HydrophobicContact CB-CG1 3.97Å; L177-I196 HydrophobicContact CB-CD1 4.22Å; L177-I196 HydrophobicContact CD2-CD1 3.66Å; A192-I196 VanDerWaalsContact O-CG1 3.31Å; A192-I196 WeakPolarHBondContact O-CG1 3.35Å; A192-I196 PolarHBondContact O-N 3.24Å; Q193-I196 PolarHBondContact O-N 3.04Å; I196-Q198 PolarHBondContact O-N 2.88Å; I196-N199 CarbonylContact O-C 3.51Å; I196-N199 PolarHBondContact O-N 3.36Å; I196-F200 HydrophobicContact CG2-CD2 4.25Å; I196-F200 VanDerWaalsContact O-CA 3.28Å; I196-F200 WeakPolarHBondContact O-CA 3.37Å; I196-F200 WeakPolarHBondContact O-CB 3.31Å; I196-F200 PolarHBondContact O-N 3.47Å; I196-L203 HydrophobicContact CB-CD1 4.25Å; I196-L203 HydrophobicContact CG1-CD1 4.19Å; I196-L203 HydrophobicContact CG2-CD1 3.97Å; I196-L214 HydrophobicContact CG2-CD2 4.05Å; I196-V225 HydrophobicContact CG2-CG1 3.7Å; I196-V225 HydrophobicContact CG2-CG2 4.43Å
197	A	92	Very high	88.3	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-62.7	-40.7	179.8	0	0	0	0	0	112.7	Q193 S194 Y195 N199 L228 L231 D232	Q193-A197 WeakPolarHBondContact O-CB 3.45Å; Q193-A197 PolarHBondContact O-N 3.21Å; S194-A197 PolarHBondContact O-N 3.26Å; Y195-A197 VanDerWaalsContact C-N 3.31Å; Y195-A197 PolarHBondContact O-N 3.39Å; A197-N199 VanDerWaalsContact C-N 3.34Å; A197-L228 HydrophobicContact CB-CD1 3.97Å; A197-L231 HydrophobicContact CB-CD2 3.84Å; A197-D232 PolarHBondContact O-N 3.44Å
198	Q	87	Confident	86.4	Confident	58 Å²	58	44.1 Å²	44.1	27%	0.271	24%	0.237	S	C	.	.	H	α-helix	trans	-69.6	-30.3	177.9	-72.3	166.5	38.8	0	0	112.9	S194 Y195 I196	S194-Q198 VanDerWaalsContact O-CG 3.27Å; S194-Q198 WeakPolarHBondContact O-CG 3.36Å; S194-Q198 PolarHBondContact O-N 3.31Å; S194-Q198 PolarHBondContact O-NE2 2.92Å; Y195-Q198 PolarHBondContact O-N 3.31Å; I196-Q198 PolarHBondContact O-N 2.88Å
199	N	87.5	Confident	84.4	Confident	25 Å²	25	51 Å²	51	13%	0.134	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.2	18	-176.8	-62	-82.1	0	0	0	112.8	L170 Y195 I196 A197 K201 Q202 L203	L170-N199 HydrophobicContact CD2-CB 3.43Å; L170-N199 VanDerWaalsContact CD2-CB 3.43Å; Y195-N199 PolarHBondContact O-N 3.27Å; Y195-N199 VanDerWaalsContact O-N 3.14Å; Y195-N199 PolarHBondContact O-ND2 3.38Å; I196-N199 CarbonylContact O-C 3.51Å; I196-N199 PolarHBondContact O-N 3.36Å; A197-N199 VanDerWaalsContact C-N 3.34Å; N199-K201 VanDerWaalsContact C-N 3.31Å; N199-K201 PolarHBondContact O-N 2.86Å; N199-Q202 PolarHBondContact O-N 3.43Å; N199-L203 HydrophobicContact CB-CD1 4.45Å; N199-L203 WeakPolarHBondContact O-CG 3.35Å; N199-L203 PolarHBondContact O-N 3.06Å
200	F	90.3	Very high	82.5	Confident	1 Å²	1	53.3 Å²	53.3	0%	0.004	28%	0.281	C	S	.	.	H	α-helix	trans	-60.8	-39.6	-168.5	-166.9	-91.6	0	0	0	112.4	I196 Q202 L203 S204 L214 V225 L226 L231 V233 T238 V239 V242	I196-F200 HydrophobicContact CG2-CD2 4.25Å; I196-F200 VanDerWaalsContact O-CA 3.28Å; I196-F200 WeakPolarHBondContact O-CA 3.37Å; I196-F200 WeakPolarHBondContact O-CB 3.31Å; I196-F200 PolarHBondContact O-N 3.47Å; F200-Q202 VanDerWaalsContact C-N 3.34Å; F200-Q202 PolarHBondContact O-N 3.31Å; F200-L203 PolarHBondContact O-N 2.81Å; F200-S204 PolarHBondContact O-N 3.12Å; F200-L214 HydrophobicContact CD2-CD1 4.45Å; F200-L214 HydrophobicContact CE2-CD1 4.07Å; F200-V225 HydrophobicContact CD2-CG1 4.15Å; F200-V225 HydrophobicContact CE2-CG1 3.85Å; F200-L226 HydrophobicContact CE2-CD2 4.13Å; F200-L226 HydrophobicContact CZ-CD2 3.69Å; F200-L231 HydrophobicContact CB-CD2 4.32Å; F200-L231 HydrophobicContact CD2-CD2 3.74Å; F200-L231 HydrophobicContact CE2-CD2 4.24Å; F200-L231 HydrophobicContact CG-CD2 4.05Å; F200-V233 HydrophobicContact CB-CG1 4.29Å; F200-V233 HydrophobicContact CD1-CG1 3.38Å; F200-V233 HydrophobicContact CE1-CG1 4.08Å; F200-V233 HydrophobicContact CG-CG1 4.19Å; F200-T238 HydrophobicContact CD1-CG2 4.25Å; F200-T238 HydrophobicContact CE1-CG2 4.25Å; F200-V239 HydrophobicContact CE1-CG2 4.44Å; F200-V242 HydrophobicContact CE1-CB 4.32Å; F200-V242 HydrophobicContact CE1-CG2 3.81Å; F200-V242 HydrophobicContact CZ-CB 3.95Å; F200-V242 HydrophobicContact CZ-CG1 3.93Å; F200-V242 HydrophobicContact CZ-CG2 3.81Å
201	K	85.2	Confident	80.6	Confident	69 Å²	69	59.4 Å²	59.4	30%	0.3	30%	0.303	S	S	.	.	H	α-helix	trans	-59	-41.1	174.8	179.7	173.5	173	169.3	0	112.6	N199 S204 H205 E234	N199-K201 VanDerWaalsContact C-N 3.31Å; N199-K201 PolarHBondContact O-N 2.86Å; K201-S204 PolarHBondContact O-OG 2.9Å; K201-H205 PolarHBondContact O-CD2 3.14Å; K201-E234 IonicContact NZ-OE1 3.45Å; K201-E234 PolarHBondContact NZ-OE1 2.6Å; K201-E234 IonicContact NZ-OE2 2.81Å; K201-E234 PolarHBondContact NZ-OE2 2.86Å
202	Q	84.5	Confident	79.2	Confident	62 Å²	62	59.8 Å²	59.8	29%	0.29	30%	0.304	S	S	.	.	H	α-helix	trans	-72.2	-40.4	179.1	-61.6	-176.5	3.1	0	0	111.1	N199 F200 S204 H205 M206 D392	N199-Q202 PolarHBondContact O-N 3.43Å; F200-Q202 VanDerWaalsContact C-N 3.34Å; F200-Q202 PolarHBondContact O-N 3.31Å; Q202-S204 VanDerWaalsContact C-N 3.33Å; Q202-S204 PolarHBondContact O-N 3.35Å; Q202-H205 PolarHBondContact O-N 3.36Å; Q202-M206 HydrophobicContact CB-CE 4.1Å; Q202-M206 WeakPolarHBondContact O-CG 3.42Å; Q202-M206 PolarHBondContact O-N 3.46Å; Q202-D392 PolarHBondContact NE2-OD1 3.4Å
203	L	87.4	Confident	78.5	Confident	18 Å²	18	61 Å²	61	9%	0.094	31%	0.312	C	S	.	.	H	α-helix	trans	-66.4	-32.5	179.5	-68	170.6	0	0	0	112.8	L170 I196 N199 F200 H205 M206 L214	L170-L203 HydrophobicContact CD2-CD2 4.37Å; L170-L203 HydrophobicContact CD2-CG 4.47Å; I196-L203 HydrophobicContact CB-CD1 4.25Å; I196-L203 HydrophobicContact CG1-CD1 4.19Å; I196-L203 HydrophobicContact CG2-CD1 3.97Å; N199-L203 HydrophobicContact CB-CD1 4.45Å; N199-L203 WeakPolarHBondContact O-CG 3.35Å; N199-L203 PolarHBondContact O-N 3.06Å; F200-L203 PolarHBondContact O-N 2.81Å; L203-H205 VanDerWaalsContact C-N 3.32Å; L203-H205 PolarHBondContact O-N 2.85Å; L203-M206 PolarHBondContact O-N 3.07Å; L203-L214 HydrophobicContact CB-CD1 3.91Å; L203-L214 HydrophobicContact CB-CG 4.35Å
204	S	85.8	Confident	78	Confident	0 Å²	0	60 Å²	60	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-66.1	-32.1	178.2	69	0	0	0	0	113.1	F200 K201 Q202 T238 V242	F200-S204 PolarHBondContact O-N 3.12Å; K201-S204 PolarHBondContact O-OG 2.9Å; Q202-S204 VanDerWaalsContact C-N 3.33Å; Q202-S204 PolarHBondContact O-N 3.35Å; S204-T238 WeakPolarHBondContact OG-CG2 3.38Å; S204-V242 VanDerWaalsContact CB-CG2 3.4Å
205	H	80.9	Confident	77.8	Confident	139 Å²	139	58.6 Å²	58.6	64%	0.644	30%	0.299	S	S	*	.	H	α-helix	trans	-86.8	-14.4	-180	-64.7	-58.5	0	0	0	113.8	K201 Q202 L203 G207	K201-H205 PolarHBondContact O-CD2 3.14Å; Q202-H205 PolarHBondContact O-N 3.36Å; L203-H205 VanDerWaalsContact C-N 3.32Å; L203-H205 PolarHBondContact O-N 2.85Å; H205-G207 VanDerWaalsContact C-N 3.33Å; H205-G207 PolarHBondContact O-N 3.39Å
206	M	72.2	Confident	77.6	Confident	54 Å²	54	59.4 Å²	59.4	27%	0.266	31%	0.306	S	S	.	.			trans	-81.3	-2.9	-176	-79.4	-167.7	-141.5	0	0	115.3	L170 Q202 L203 S208 I209	L170-M206 HydrophobicContact CB-CE 4.19Å; L170-M206 HydrophobicContact CD1-CE 3.92Å; L170-M206 HydrophobicContact CG-CE 4.48Å; Q202-M206 HydrophobicContact CB-CE 4.1Å; Q202-M206 WeakPolarHBondContact O-CG 3.42Å; Q202-M206 PolarHBondContact O-N 3.46Å; L203-M206 PolarHBondContact O-N 3.07Å; M206-S208 PolarHBondContact O-N 3.46Å; M206-I209 PolarHBondContact O-N 2.94Å
207	G	59.3	Low	77.5	Confident	39 Å²	39	59.5 Å²	59.5	40%	0.402	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-5.4	-167.4	0	0	0	0	0	118.2	H205	H205-G207 VanDerWaalsContact C-N 3.33Å; H205-G207 PolarHBondContact O-N 3.39Å
208	S	55.1	Low	77.6	Confident	115 Å²	115	63.2 Å²	63.2	80%	0.804	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.2	-7.3	-177.5	-170.7	0	0	0	0	115.3	M206	M206-S208 PolarHBondContact O-N 3.46Å
209	I	53.7	Low	77.9	Confident	144 Å²	144	62.5 Å²	62.5	74%	0.738	33%	0.327	S	S	*	.	S	Bend	trans	-113.6	-7.7	-163.7	-57.1	173.5	0	0	0	113.2	M206	M206-I209 PolarHBondContact O-N 2.94Å
210	R	58	Low	78.2	Confident	128 Å²	128	64.8 Å²	64.8	48%	0.483	35%	0.35	S	S	.	.			trans	-140.9	160.2	-168.2	-69.6	-172.4	169.6	161	-3.2	115.6
211	E	53.3	Low	78.4	Confident	194 Å²	194	65.4 Å²	65.4	91%	0.907	35%	0.353	S	S	*	.	S	Bend	trans	-70.8	-26.3	178.3	-68.8	178.6	169.6	0	0	113.8
212	E	65.5	Low	78.9	Confident	84 Å²	84	62.2 Å²	62.2	39%	0.393	34%	0.339	S	S	.	.			trans	-125.9	125.8	176.7	-66.6	-163.6	-171.1	0	0	112.3	T174 A175 D216	T174-E212 PolarHBondContact OG1-OE2 3.29Å; A175-E212 WeakPolarHBondContact CA-OE2 3.42Å; A175-E212 WeakPolarHBondContact CB-OE2 3.35Å; A175-E212 PolarHBondContact N-OE2 3.31Å; E212-D216 WeakPolarHBondContact CA-OD2 3.48Å
213	T	79.9	Confident	79.4	Confident	25 Å²	25	59.9 Å²	59.9	15%	0.153	33%	0.328	C	S	.	.			trans	-137.7	171.2	-175.5	65.6	0	0	0	0	110.6	A215 D216	T213-A215 PolarHBondContact O-N 3.38Å; T213-A215 VanDerWaalsContact O-N 3.11Å; T213-A215 VanDerWaalsContact OG1-CB 3.29Å; T213-A215 WeakPolarHBondContact OG1-CB 3.28Å; T213-A215 PolarHBondContact OG1-N 3.15Å; T213-D216 PolarHBondContact N-OD2 2.86Å; T213-D216 PolarHBondContact O-N 2.68Å; T213-D216 PolarHBondContact OG1-OD2 2.75Å; T213-D216 VanDerWaalsContact OG1-OD2 3.09Å
214	L	85.7	Confident	79.7	Confident	9 Å²	9	60.9 Å²	60.9	5%	0.047	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-57.7	-22.5	169.3	-67.7	173.7	0	0	0	112.2	T174 I196 F200 L203 D216 L217 V242	T174-L214 HydrophobicContact CG2-CD2 4.18Å; I196-L214 HydrophobicContact CG2-CD2 4.05Å; F200-L214 HydrophobicContact CD2-CD1 4.45Å; F200-L214 HydrophobicContact CE2-CD1 4.07Å; L203-L214 HydrophobicContact CB-CD1 3.91Å; L203-L214 HydrophobicContact CB-CG 4.35Å; L214-D216 PolarHBondContact O-N 2.9Å; L214-L217 HydrophobicContact CD2-CD1 3.89Å; L214-L217 PolarHBondContact O-N 3.47Å; L214-V242 HydrophobicContact CB-CG1 4.26Å; L214-V242 HydrophobicContact CD1-CG1 3.88Å; L214-V242 HydrophobicContact CD1-CG2 4.35Å
215	A	85.7	Confident	80.1	Confident	19 Å²	19	60.9 Å²	60.9	16%	0.157	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-67.7	-19.3	176.1	0	0	0	0	0	113	T213 L217 A249 R254	T213-A215 PolarHBondContact O-N 3.38Å; T213-A215 VanDerWaalsContact O-N 3.11Å; T213-A215 VanDerWaalsContact OG1-CB 3.29Å; T213-A215 WeakPolarHBondContact OG1-CB 3.28Å; T213-A215 PolarHBondContact OG1-N 3.15Å; A215-L217 VanDerWaalsContact C-N 3.35Å; A215-A249 HydrophobicContact CB-CB 3.97Å; A215-R254 VanDerWaalsContact O-CZ 3.25Å; A215-R254 PolarHBondContact O-NH1 2.82Å; A215-R254 PolarHBondContact O-NH2 3.02Å
216	D	87.4	Confident	80.8	Confident	64 Å²	64	54.2 Å²	54.2	34%	0.342	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-88.9	-4.2	-178.2	-55.4	-57.1	0	0	0	113.2	K178 E212 T213 L214	K178-D216 WeakPolarHBondContact CE-O 3.34Å; K178-D216 PolarHBondContact NZ-O 3.36Å; E212-D216 WeakPolarHBondContact CA-OD2 3.48Å; T213-D216 PolarHBondContact N-OD2 2.86Å; T213-D216 PolarHBondContact O-N 2.68Å; T213-D216 PolarHBondContact OG1-OD2 2.75Å; T213-D216 VanDerWaalsContact OG1-OD2 3.09Å; L214-D216 PolarHBondContact O-N 2.9Å
217	L	91.9	Very high	81.8	Confident	2 Å²	2	58.7 Å²	58.7	1%	0.01	32%	0.322	C	S	.	.	S	Bend	trans	-67.7	147.9	175.9	-63.9	178.9	0	0	0	111.1	T174 L177 K178 L214 A215 Q221 L222 W246	T174-L217 HydrophobicContact CG2-CD2 4.46Å; L177-L217 HydrophobicContact CD2-CD2 4.13Å; K178-L217 HydrophobicContact CG-CD2 4.24Å; L214-L217 HydrophobicContact CD2-CD1 3.89Å; L214-L217 PolarHBondContact O-N 3.47Å; A215-L217 VanDerWaalsContact C-N 3.35Å; L217-Q221 HydrophobicContact CB-CB 4.05Å; L217-Q221 HydrophobicContact CD2-CB 4.28Å; L217-L222 HydrophobicContact CB-CB 4.41Å; L217-L222 HydrophobicContact CD1-CD1 4.45Å; L217-W246 PolarHBondContact O-NE1 3.21Å
218	T	92.9	Very high	83.4	Confident	78 Å²	78	58.9 Å²	58.9	48%	0.479	31%	0.313	S	S	.	.			trans	-67.6	162	167.8	64.4	0	0	0	0	110.6	A220 Q221 L222	T218-A220 VanDerWaalsContact C-N 3.29Å; T218-A220 PolarHBondContact O-N 3.12Å; T218-Q221 PolarHBondContact O-N 3.39Å; T218-Q221 WeakPolarHBondContact OG1-CB 3.22Å; T218-Q221 WeakPolarHBondContact OG1-CG 3.49Å; T218-Q221 PolarHBondContact OG1-N 3.03Å; T218-Q221 PolarHBondContact OG1-OE1 2.92Å; T218-L222 PolarHBondContact O-N 2.67Å
219	L	93.9	Very high	85.1	Confident	43 Å²	43	57.5 Å²	57.5	23%	0.225	30%	0.297	C	S	.	.	H	α-helix	trans	-53.5	-47.2	176.9	176.8	64	0	0	0	111.7	Q221 L222 L223 W246 S257 V261	L219-Q221 VanDerWaalsContact C-N 3.35Å; L219-Q221 PolarHBondContact O-N 2.98Å; L219-L222 PolarHBondContact O-N 3.27Å; L219-L223 HydrophobicContact CD1-CD1 3.93Å; L219-L223 HydrophobicContact CD1-CD2 4.4Å; L219-L223 HydrophobicContact CD1-CG 3.97Å; L219-L223 HydrophobicContact CG-CD1 3.91Å; L219-L223 HydrophobicContact CG-CG 4.32Å; L219-L223 WeakPolarHBondContact O-CB 3.32Å; L219-L223 VanDerWaalsContact O-CG 3.22Å; L219-L223 WeakPolarHBondContact O-CG 3.35Å; L219-L223 PolarHBondContact O-N 2.88Å; L219-W246 HydrophobicContact CB-CH2 4Å; L219-W246 HydrophobicContact CB-CZ2 4.16Å; L219-W246 HydrophobicContact CD1-CH2 3.77Å; L219-W246 HydrophobicContact CD1-CZ2 4.49Å; L219-W246 HydrophobicContact CD1-CZ3 4.15Å; L219-W246 HydrophobicContact CG-CH2 4.46Å; L219-S257 WeakPolarHBondContact CD2-OG 3.37Å; L219-V261 HydrophobicContact CD1-CG2 3.69Å
220	A	93.8	Very high	86.8	Confident	73 Å²	73	52.9 Å²	52.9	60%	0.603	28%	0.278	S	S	*	.	H	α-helix	trans	-61.6	-42.4	-179	0	0	0	0	0	112.3	T218 A224	T218-A220 VanDerWaalsContact C-N 3.29Å; T218-A220 PolarHBondContact O-N 3.12Å; A220-A224 WeakPolarHBondContact O-CB 3.35Å; A220-A224 PolarHBondContact O-N 3.09Å
221	Q	94.9	Very high	88.5	Confident	15 Å²	15	46.8 Å²	46.8	7%	0.07	26%	0.255	C	S	.	.	H	α-helix	trans	-65.1	-46	176.9	-79.9	160.4	-18.4	0	0	112.2	D181 L217 T218 L219 A224 V225	D181-Q221 WeakPolarHBondContact OD2-CG 3.5Å; D181-Q221 PolarHBondContact OD2-NE2 3.27Å; D181-Q221 VanDerWaalsContact OD2-NE2 3.12Å; L217-Q221 HydrophobicContact CB-CB 4.05Å; L217-Q221 HydrophobicContact CD2-CB 4.28Å; T218-Q221 PolarHBondContact O-N 3.39Å; T218-Q221 WeakPolarHBondContact OG1-CB 3.22Å; T218-Q221 WeakPolarHBondContact OG1-CG 3.49Å; T218-Q221 PolarHBondContact OG1-N 3.03Å; T218-Q221 PolarHBondContact OG1-OE1 2.92Å; L219-Q221 VanDerWaalsContact C-N 3.35Å; L219-Q221 PolarHBondContact O-N 2.98Å; Q221-A224 WeakPolarHBondContact O-CB 3.31Å; Q221-A224 PolarHBondContact O-N 2.69Å; Q221-V225 WeakPolarHBondContact O-CG2 3.28Å; Q221-V225 PolarHBondContact O-N 2.87Å; Q221-V225 VanDerWaalsContact O-N 3.12Å
222	L	95	Very high	90.2	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-61.7	-48.1	178.4	-176.1	75.9	0	0	0	110.9	L217 T218 L219 A224 V225 L226 W246 V261	L217-L222 HydrophobicContact CB-CB 4.41Å; L217-L222 HydrophobicContact CD1-CD1 4.45Å; T218-L222 PolarHBondContact O-N 2.67Å; L219-L222 PolarHBondContact O-N 3.27Å; L222-A224 VanDerWaalsContact C-N 3.26Å; L222-A224 PolarHBondContact O-N 3.37Å; L222-V225 PolarHBondContact O-N 2.76Å; L222-V225 VanDerWaalsContact O-N 3.09Å; L222-L226 HydrophobicContact CD1-CD1 4.16Å; L222-L226 HydrophobicContact CD1-CG 4.18Å; L222-L226 HydrophobicContact CD2-CD1 3.98Å; L222-L226 HydrophobicContact CG-CD1 3.73Å; L222-L226 HydrophobicContact CG-CG 4.04Å; L222-L226 WeakPolarHBondContact O-CG 3.45Å; L222-L226 PolarHBondContact O-N 2.66Å; L222-W246 HydrophobicContact CD1-CG 4.42Å; L222-W246 HydrophobicContact CD2-CB 3.86Å; L222-W246 HydrophobicContact CD2-CD2 3.43Å; L222-W246 VanDerWaalsContact CD2-CD2 3.43Å; L222-W246 HydrophobicContact CD2-CE3 3.81Å; L222-W246 HydrophobicContact CD2-CG 3.43Å; L222-W246 VanDerWaalsContact CD2-CG 3.43Å; L222-W246 HydrophobicContact CG-CG 4.45Å; L222-V261 HydrophobicContact CD2-CG1 4.1Å; L222-V261 HydrophobicContact CD2-CG2 4.37Å
223	L	94.8	Very high	91.3	Very high	14 Å²	14	34.4 Å²	34.4	7%	0.073	20%	0.198	C	C	.	.	H	α-helix	trans	-59.2	-39.8	177.7	-68.2	175.8	0	0	0	111.4	L219 V225 R227 E260 V261 C264	L219-L223 HydrophobicContact CD1-CD1 3.93Å; L219-L223 HydrophobicContact CD1-CD2 4.4Å; L219-L223 HydrophobicContact CD1-CG 3.97Å; L219-L223 HydrophobicContact CG-CD1 3.91Å; L219-L223 HydrophobicContact CG-CG 4.32Å; L219-L223 WeakPolarHBondContact O-CB 3.32Å; L219-L223 VanDerWaalsContact O-CG 3.22Å; L219-L223 WeakPolarHBondContact O-CG 3.35Å; L219-L223 PolarHBondContact O-N 2.88Å; L223-V225 VanDerWaalsContact C-N 3.29Å; L223-V225 PolarHBondContact O-N 2.9Å; L223-R227 WeakPolarHBondContact O-CB 3.45Å; L223-R227 WeakPolarHBondContact O-CD 3.3Å; L223-R227 WeakPolarHBondContact O-CG 3.24Å; L223-R227 PolarHBondContact O-N 2.73Å; L223-R227 VanDerWaalsContact O-N 3.12Å; L223-E260 WeakPolarHBondContact CD2-O 3.44Å; L223-V261 HydrophobicContact CD2-CG2 4.31Å; L223-C264 WeakPolarHBondContact CD2-SG 3.29Å
224	A	93.9	Very high	91.5	Very high	38 Å²	38	38.1 Å²	38.1	31%	0.314	21%	0.213	S	C	.	.	H	α-helix	trans	-62.1	-36.1	177	0	0	0	0	0	112.4	A220 Q221 L222 L228	A220-A224 WeakPolarHBondContact O-CB 3.35Å; A220-A224 PolarHBondContact O-N 3.09Å; Q221-A224 WeakPolarHBondContact O-CB 3.31Å; Q221-A224 PolarHBondContact O-N 2.69Å; L222-A224 VanDerWaalsContact C-N 3.26Å; L222-A224 PolarHBondContact O-N 3.37Å; A224-L228 WeakPolarHBondContact O-CG 3.13Å
225	V	95	Very high	91.7	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-75.6	-51	175.9	174.8	0	0	0	0	111.5	L177 I196 F200 Q221 L222 L223 R227 L228 L231	L177-V225 HydrophobicContact CD2-CG2 4.05Å; I196-V225 HydrophobicContact CG2-CG1 3.7Å; I196-V225 HydrophobicContact CG2-CG2 4.43Å; F200-V225 HydrophobicContact CD2-CG1 4.15Å; F200-V225 HydrophobicContact CE2-CG1 3.85Å; Q221-V225 WeakPolarHBondContact O-CG2 3.28Å; Q221-V225 PolarHBondContact O-N 2.87Å; Q221-V225 VanDerWaalsContact O-N 3.12Å; L222-V225 PolarHBondContact O-N 2.76Å; L222-V225 VanDerWaalsContact O-N 3.09Å; L223-V225 VanDerWaalsContact C-N 3.29Å; L223-V225 PolarHBondContact O-N 2.9Å; V225-R227 PolarHBondContact O-N 3.48Å; V225-R227 VanDerWaalsContact O-N 3.14Å; V225-L228 WeakPolarHBondContact O-CB 3.4Å; V225-L228 WeakPolarHBondContact O-CG 3.44Å; V225-L228 PolarHBondContact O-N 2.85Å; V225-L231 HydrophobicContact CG1-CD2 4.27Å
226	L	94.4	Very high	92	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-64.6	-20.6	-175.7	-63.9	-179.2	0	0	0	113.2	F200 L222 V239 V242 A243 V261 C264 R337	F200-L226 HydrophobicContact CE2-CD2 4.13Å; F200-L226 HydrophobicContact CZ-CD2 3.69Å; L222-L226 HydrophobicContact CD1-CD1 4.16Å; L222-L226 HydrophobicContact CD1-CG 4.18Å; L222-L226 HydrophobicContact CD2-CD1 3.98Å; L222-L226 HydrophobicContact CG-CD1 3.73Å; L222-L226 HydrophobicContact CG-CG 4.04Å; L222-L226 WeakPolarHBondContact O-CG 3.45Å; L222-L226 PolarHBondContact O-N 2.66Å; L226-V239 HydrophobicContact CD2-CG1 3.9Å; L226-V242 HydrophobicContact CD2-CG1 4.36Å; L226-A243 HydrophobicContact CD1-CB 4.3Å; L226-V261 HydrophobicContact CD1-CG1 3.87Å; L226-C264 HydrophobicContact CB-CB 3.81Å; L226-R337 VanDerWaalsContact O-CZ 3.26Å; L226-R337 PolarHBondContact O-NH1 3.49Å; L226-R337 PolarHBondContact O-NH2 3.08Å
227	R	93.3	Very high	92.1	Very high	148 Å²	148	38 Å²	38	56%	0.558	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-12.2	176.4	-72.6	173.9	-172.7	177.8	3.2	114.2	L223 V225 D229 C264	L223-R227 WeakPolarHBondContact O-CB 3.45Å; L223-R227 WeakPolarHBondContact O-CD 3.3Å; L223-R227 WeakPolarHBondContact O-CG 3.24Å; L223-R227 PolarHBondContact O-N 2.73Å; L223-R227 VanDerWaalsContact O-N 3.12Å; V225-R227 PolarHBondContact O-N 3.48Å; V225-R227 VanDerWaalsContact O-N 3.14Å; R227-D229 PolarHBondContact O-N 2.89Å; R227-C264 HydrophobicContact CG-CB 4.31Å
228	L	92.7	Very high	92.1	Very high	42 Å²	42	39.1 Å²	39.1	22%	0.22	22%	0.216	C	C	.	.			trans	-65.6	127.4	-175.4	-65.5	172.3	0	0	0	112.2	Q193 A197 A224 V225 S230 L231 R337	Q193-L228 HydrophobicContact CB-CD1 4.31Å; A197-L228 HydrophobicContact CB-CD1 3.97Å; A224-L228 WeakPolarHBondContact O-CG 3.13Å; V225-L228 WeakPolarHBondContact O-CB 3.4Å; V225-L228 WeakPolarHBondContact O-CG 3.44Å; V225-L228 PolarHBondContact O-N 2.85Å; L228-S230 PolarHBondContact O-N 2.8Å; L228-L231 HydrophobicContact CB-CD2 4.22Å; L228-L231 HydrophobicContact CB-CG 4.11Å; L228-L231 WeakPolarHBondContact O-CG 3.42Å; L228-R337 PolarHBondContact O-NH1 2.97Å
229	D	91.1	Very high	92.1	Very high	86 Å²	86	35.4 Å²	35.4	46%	0.46	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-29.1	170.5	-66.8	-48.4	0	0	0	112.1	R227 L231 R266 P335 R337 L338	R227-D229 PolarHBondContact O-N 2.89Å; D229-L231 PolarHBondContact O-N 3.42Å; D229-L231 VanDerWaalsContact O-N 3.15Å; D229-R266 IonicContact OD1-CZ 2.76Å; D229-R266 IonicContact OD1-NH1 3.75Å; D229-R266 PolarHBondContact OD1-NH1 3.22Å; D229-R266 IonicContact OD1-NH2 3.82Å; D229-R266 PolarHBondContact OD1-NH2 3.08Å; D229-P335 WeakPolarHBondContact OD1-CG 3.26Å; D229-R337 WeakPolarHBondContact O-CA 3.48Å; D229-L338 PolarHBondContact O-N 3Å
230	S	90.6	Very high	92	Very high	48 Å²	48	33.3 Å²	33.3	34%	0.336	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	10.4	-176.4	67.3	0	0	0	0	114.8	L228 D232	L228-S230 PolarHBondContact O-N 2.8Å; S230-D232 PolarHBondContact O-N 2.86Å
231	L	92.1	Very high	91.9	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.168	C	C	.	.			trans	-65	125	176.7	-65.7	177.5	0	0	0	109.8	A197 F200 V225 L228 D229 V233 V239 L338 G339	A197-L231 HydrophobicContact CB-CD2 3.84Å; F200-L231 HydrophobicContact CB-CD2 4.32Å; F200-L231 HydrophobicContact CD2-CD2 3.74Å; F200-L231 HydrophobicContact CE2-CD2 4.24Å; F200-L231 HydrophobicContact CG-CD2 4.05Å; V225-L231 HydrophobicContact CG1-CD2 4.27Å; L228-L231 HydrophobicContact CB-CD2 4.22Å; L228-L231 HydrophobicContact CB-CG 4.11Å; L228-L231 WeakPolarHBondContact O-CG 3.42Å; D229-L231 PolarHBondContact O-N 3.42Å; D229-L231 VanDerWaalsContact O-N 3.15Å; L231-V233 HydrophobicContact CB-CG1 4.47Å; L231-V233 HydrophobicContact CB-CG2 4.27Å; L231-V233 PolarHBondContact O-N 2.8Å; L231-V233 VanDerWaalsContact O-N 3.12Å; L231-V239 HydrophobicContact CD1-CG2 4.21Å; L231-L338 PolarHBondContact O-N 3.11Å; L231-G339 PolarHBondContact O-N 3.21Å; L231-G339 VanDerWaalsContact O-N 3.09Å
232	D	89.3	Confident	91.7	Very high	18 Å²	18	32.3 Å²	32.3	10%	0.096	17%	0.165	C	C	.	.			trans	-83.3	82.8	171.5	-173.8	34.2	0	0	0	110.1	A197 S230 G339 R617 Y619	A197-D232 PolarHBondContact O-N 3.44Å; S230-D232 PolarHBondContact O-N 2.86Å; D232-G339 WeakPolarHBondContact OD1-CA 3.49Å; D232-R617 IonicContact OD1-CZ 2.8Å; D232-R617 IonicContact OD1-NH1 2.61Å; D232-R617 PolarHBondContact OD1-NH1 2.93Å; D232-R617 IonicContact OD1-NH2 2.76Å; D232-R617 PolarHBondContact OD1-NH2 3.44Å; D232-R617 IonicContact OD2-CZ 3.32Å; D232-R617 IonicContact OD2-NH1 2.89Å; D232-R617 PolarHBondContact OD2-NH1 3.3Å; D232-R617 VanDerWaalsContact OD2-NH1 3.08Å; D232-R617 IonicContact OD2-NH2 2.62Å; D232-Y619 WeakPolarHBondContact OD1-CE1 3.32Å; D232-Y619 PolarHBondContact OD1-OH 3.27Å; D232-Y619 PolarHBondContact OD2-OH 3.44Å
233	V	89.3	Confident	91.6	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.165	C	C	.	.			trans	-128.1	139.2	175.5	-67.3	0	0	0	0	110.5	F200 L231 T238 V239 R337 G339 M340	F200-V233 HydrophobicContact CB-CG1 4.29Å; F200-V233 HydrophobicContact CD1-CG1 3.38Å; F200-V233 HydrophobicContact CE1-CG1 4.08Å; F200-V233 HydrophobicContact CG-CG1 4.19Å; L231-V233 HydrophobicContact CB-CG1 4.47Å; L231-V233 HydrophobicContact CB-CG2 4.27Å; L231-V233 PolarHBondContact O-N 2.8Å; L231-V233 VanDerWaalsContact O-N 3.12Å; V233-T238 HydrophobicContact CG1-CG2 4.09Å; V233-V239 HydrophobicContact CG1-CG2 4.31Å; V233-V239 HydrophobicContact CG2-CG2 3.96Å; V233-R337 HydrophobicContact CG2-CB 3.68Å; V233-R337 HydrophobicContact CG2-CG 3.75Å; V233-G339 CarbonylContact O-C 3.55Å; V233-G339 VanDerWaalsContact O-CA 3.22Å; V233-G339 WeakPolarHBondContact O-CA 3.49Å; V233-M340 WeakPolarHBondContact O-CG 3.26Å; V233-M340 PolarHBondContact O-N 3.48Å
234	E	85.1	Confident	91.4	Very high	103 Å²	103	31.7 Å²	31.7	48%	0.481	16%	0.162	S	C	.	.	S	Bend	trans	-77.1	-29.3	178.6	-69.6	164.6	-177.6	0	0	112.2	K201	K201-E234 IonicContact NZ-OE1 3.45Å; K201-E234 PolarHBondContact NZ-OE1 2.6Å; K201-E234 IonicContact NZ-OE2 2.81Å; K201-E234 PolarHBondContact NZ-OE2 2.86Å
235	S	89	Confident	91.2	Very high	21 Å²	21	32.7 Å²	32.7	15%	0.147	16%	0.16	C	C	.	.			trans	-145.7	149.2	177.7	170.1	0	0	0	0	111.1	Q237 T238	S235-Q237 PolarHBondContact O-N 3.47Å; S235-Q237 WeakPolarHBondContact OG-CB 3.46Å; S235-Q237 PolarHBondContact OG-N 2.98Å; S235-Q237 VanDerWaalsContact OG-N 3.08Å; S235-T238 PolarHBondContact O-N 2.96Å; S235-T238 VanDerWaalsContact O-N 3.08Å
236	E	90.9	Very high	91.1	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-61.8	-16.6	170.8	-78.9	-73	153.6	0	0	112.9	T238 V239 C240 R266 H269 F270 R337 M340	E236-T238 PolarHBondContact O-N 3.42Å; E236-V239 PolarHBondContact O-N 3.46Å; E236-V239 VanDerWaalsContact O-N 3.13Å; E236-C240 WeakPolarHBondContact O-CB 3.34Å; E236-C240 PolarHBondContact O-N 3.35Å; E236-R266 HydrophobicContact CG-CB 3.9Å; E236-R266 WeakPolarHBondContact OE1-CD 3.36Å; E236-R266 PolarHBondContact OE2-N 3.45Å; E236-H269 HydrophobicContact CG-CB 3.94Å; E236-F270 HydrophobicContact CB-CD2 4.01Å; E236-F270 HydrophobicContact CB-CE2 3.56Å; E236-F270 HydrophobicContact CB-CZ 4.04Å; E236-R337 WeakPolarHBondContact OE1-CG 3.28Å; E236-R337 IonicContact OE1-CZ 2.75Å; E236-R337 IonicContact OE1-NE 3.73Å; E236-R337 PolarHBondContact OE1-NE 3.28Å; E236-R337 IonicContact OE1-NH2 2.89Å; E236-R337 PolarHBondContact OE1-NH2 3.25Å; E236-R337 IonicContact OE2-NH2 3.84Å; E236-M340 HydrophobicContact CG-SD 4.29Å
237	Q	90.8	Very high	90.9	Very high	68 Å²	68	33 Å²	33	32%	0.318	16%	0.161	S	C	.	.	H	α-helix	trans	-50.4	-41.7	167.8	-170.2	-167.9	17.1	0	0	111.4	S235 C240 H241 F270 Y277	S235-Q237 PolarHBondContact O-N 3.47Å; S235-Q237 WeakPolarHBondContact OG-CB 3.46Å; S235-Q237 PolarHBondContact OG-N 2.98Å; S235-Q237 VanDerWaalsContact OG-N 3.08Å; Q237-C240 PolarHBondContact O-N 3.2Å; Q237-H241 WeakPolarHBondContact O-CB 3.5Å; Q237-H241 PolarHBondContact O-N 3.16Å; Q237-F270 HydrophobicContact CB-CE1 4.26Å; Q237-Y277 HydrophobicContact CG-CD1 3.65Å; Q237-Y277 HydrophobicContact CG-CD2 3.89Å; Q237-Y277 HydrophobicContact CG-CE1 3.7Å; Q237-Y277 HydrophobicContact CG-CE2 3.93Å; Q237-Y277 HydrophobicContact CG-CG 3.73Å; Q237-Y277 VanDerWaalsContact NE2-CG 3.35Å
238	T	91.4	Very high	90.7	Very high	25 Å²	25	29.9 Å²	29.9	15%	0.153	15%	0.153	C	C	.	.	H	α-helix	trans	-66.7	-41.8	-179.3	-56.1	0	0	0	0	111.5	F200 S204 V233 S235 E236 H241 V242	F200-T238 HydrophobicContact CD1-CG2 4.25Å; F200-T238 HydrophobicContact CE1-CG2 4.25Å; S204-T238 WeakPolarHBondContact OG-CG2 3.38Å; V233-T238 HydrophobicContact CG1-CG2 4.09Å; S235-T238 PolarHBondContact O-N 2.96Å; S235-T238 VanDerWaalsContact O-N 3.08Å; E236-T238 PolarHBondContact O-N 3.42Å; T238-H241 WeakPolarHBondContact O-CB 3.41Å; T238-H241 PolarHBondContact O-N 3.33Å; T238-V242 WeakPolarHBondContact O-CG2 3.43Å; T238-V242 PolarHBondContact O-N 2.99Å; T238-V242 VanDerWaalsContact O-N 3.09Å
239	V	93.1	Very high	90.6	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-64.1	-45.2	177.6	-176.2	0	0	0	0	110	F200 L226 L231 V233 E236 H241 V242 A243 V265	F200-V239 HydrophobicContact CE1-CG2 4.44Å; L226-V239 HydrophobicContact CD2-CG1 3.9Å; L231-V239 HydrophobicContact CD1-CG2 4.21Å; V233-V239 HydrophobicContact CG1-CG2 4.31Å; V233-V239 HydrophobicContact CG2-CG2 3.96Å; E236-V239 PolarHBondContact O-N 3.46Å; E236-V239 VanDerWaalsContact O-N 3.13Å; V239-H241 VanDerWaalsContact C-N 3.34Å; V239-H241 PolarHBondContact O-N 2.81Å; V239-V242 PolarHBondContact O-N 3.46Å; V239-A243 PolarHBondContact O-N 3.03Å; V239-V265 HydrophobicContact CG1-CG2 4.44Å
240	C	91.8	Very high	90.4	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-63.4	-39.4	175.9	-174.3	0	0	0	0	112.2	E236 Q237 A243 V244 V265 F270 Y277 L281	E236-C240 WeakPolarHBondContact O-CB 3.34Å; E236-C240 PolarHBondContact O-N 3.35Å; Q237-C240 PolarHBondContact O-N 3.2Å; C240-A243 WeakPolarHBondContact O-CB 3.45Å; C240-A243 PolarHBondContact O-N 3.44Å; C240-V244 VanDerWaalsContact O-CG2 3.23Å; C240-V244 WeakPolarHBondContact O-CG2 3.49Å; C240-V244 PolarHBondContact O-N 2.92Å; C240-V265 HydrophobicContact CB-CG1 4.06Å; C240-V265 HydrophobicContact CB-CG2 4.14Å; C240-F270 HydrophobicContact CB-CZ 3.91Å; C240-Y277 HydrophobicContact CB-CE1 4.32Å; C240-L281 VanDerWaalsContact SG-CD2 3.57Å
241	H	90.8	Very high	90.2	Very high	65 Å²	65	28.7 Å²	28.7	30%	0.301	16%	0.159	S	C	.	.	H	α-helix	trans	-60.7	-47.7	177.7	-178.9	72.5	0	0	0	111.3	Q237 T238 V239 A243 V244 Q245 Y277	Q237-H241 WeakPolarHBondContact O-CB 3.5Å; Q237-H241 PolarHBondContact O-N 3.16Å; T238-H241 WeakPolarHBondContact O-CB 3.41Å; T238-H241 PolarHBondContact O-N 3.33Å; V239-H241 VanDerWaalsContact C-N 3.34Å; V239-H241 PolarHBondContact O-N 2.81Å; H241-A243 PolarHBondContact O-N 3.49Å; H241-V244 PolarHBondContact O-N 3.09Å; H241-Q245 PolarHBondContact NE2-NE2 3.03Å; H241-Q245 WeakPolarHBondContact O-CG 3.45Å; H241-Q245 PolarHBondContact O-N 3.23Å; H241-Y277 WeakPolarHBondContact CA-OH 3.39Å; H241-Y277 PolarHBondContact N-OH 3.24Å
242	V	92.1	Very high	90	Very high	2 Å²	2	37.9 Å²	37.9	1%	0.012	20%	0.199	C	C	.	.	H	α-helix	trans	-62.6	-42.1	177	172.5	0	0	0	0	111.6	F200 S204 L214 L226 T238 V239 V244 Q245 W246	F200-V242 HydrophobicContact CE1-CB 4.32Å; F200-V242 HydrophobicContact CE1-CG2 3.81Å; F200-V242 HydrophobicContact CZ-CB 3.95Å; F200-V242 HydrophobicContact CZ-CG1 3.93Å; F200-V242 HydrophobicContact CZ-CG2 3.81Å; S204-V242 VanDerWaalsContact CB-CG2 3.4Å; L214-V242 HydrophobicContact CB-CG1 4.26Å; L214-V242 HydrophobicContact CD1-CG1 3.88Å; L214-V242 HydrophobicContact CD1-CG2 4.35Å; L226-V242 HydrophobicContact CD2-CG1 4.36Å; T238-V242 WeakPolarHBondContact O-CG2 3.43Å; T238-V242 PolarHBondContact O-N 2.99Å; T238-V242 VanDerWaalsContact O-N 3.09Å; V239-V242 PolarHBondContact O-N 3.46Å; V242-V244 VanDerWaalsContact C-N 3.3Å; V242-V244 PolarHBondContact O-N 2.9Å; V242-Q245 PolarHBondContact O-N 3.41Å; V242-W246 PolarHBondContact O-N 3.43Å
243	A	92.6	Very high	90	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-56.8	-45.2	174.8	0	0	0	0	0	111.9	L226 V239 C240 H241 W246 L247 V261	L226-A243 HydrophobicContact CD1-CB 4.3Å; V239-A243 PolarHBondContact O-N 3.03Å; C240-A243 WeakPolarHBondContact O-CB 3.45Å; C240-A243 PolarHBondContact O-N 3.44Å; H241-A243 PolarHBondContact O-N 3.49Å; A243-W246 PolarHBondContact O-N 2.72Å; A243-L247 VanDerWaalsContact O-CG 3.31Å; A243-L247 WeakPolarHBondContact O-CG 3.33Å; A243-L247 PolarHBondContact O-N 2.78Å; A243-L247 VanDerWaalsContact O-N 3.1Å; A243-V261 HydrophobicContact CB-CG1 3.5Å; A243-V261 VanDerWaalsContact CB-CG1 3.5Å
244	V	90.6	Very high	90.1	Very high	1 Å²	1	47 Å²	47	1%	0.006	24%	0.239	C	C	.	.	H	α-helix	trans	-67.5	-45	178.7	174.9	0	0	0	0	111.5	C240 H241 V242 W246 L247 E248 F262 L281 K284	C240-V244 VanDerWaalsContact O-CG2 3.23Å; C240-V244 WeakPolarHBondContact O-CG2 3.49Å; C240-V244 PolarHBondContact O-N 2.92Å; H241-V244 PolarHBondContact O-N 3.09Å; V242-V244 VanDerWaalsContact C-N 3.3Å; V242-V244 PolarHBondContact O-N 2.9Å; V244-W246 VanDerWaalsContact C-N 3.29Å; V244-W246 PolarHBondContact O-N 3.2Å; V244-L247 PolarHBondContact O-N 3.04Å; V244-L247 VanDerWaalsContact O-N 3.13Å; V244-E248 HydrophobicContact CG1-CG 4.13Å; V244-E248 WeakPolarHBondContact O-CB 3.25Å; V244-E248 WeakPolarHBondContact O-CG 3.49Å; V244-E248 PolarHBondContact O-N 3.31Å; V244-F262 HydrophobicContact CG2-CE1 3.92Å; V244-F262 HydrophobicContact CG2-CZ 3.74Å; V244-L281 HydrophobicContact CG2-CD1 3.49Å; V244-L281 VanDerWaalsContact CG2-CD1 3.49Å; V244-K284 HydrophobicContact CG1-CD 3.71Å
245	Q	90	Very high	90.1	Very high	59 Å²	59	42.1 Å²	42.1	28%	0.276	22%	0.216	S	C	.	.	H	α-helix	trans	-56.3	-44.1	175.8	-76	-179.9	-25.8	0	0	111.7	H241 V242 L247 E248 A249	H241-Q245 PolarHBondContact NE2-NE2 3.03Å; H241-Q245 WeakPolarHBondContact O-CG 3.45Å; H241-Q245 PolarHBondContact O-N 3.23Å; V242-Q245 PolarHBondContact O-N 3.41Å; Q245-L247 VanDerWaalsContact C-N 3.35Å; Q245-L247 PolarHBondContact O-N 2.65Å; Q245-E248 PolarHBondContact O-N 3.29Å; Q245-A249 PolarHBondContact O-N 3.23Å
246	W	92.1	Very high	90.1	Very high	7 Å²	7	45.5 Å²	45.5	3%	0.027	24%	0.237	C	C	.	.	H	α-helix	trans	-63.7	-40.1	177.3	-177.4	95.2	0	0	0	112.1	L217 L219 L222 V242 A243 V244 R254 V261	L217-W246 PolarHBondContact O-NE1 3.21Å; L219-W246 HydrophobicContact CB-CH2 4Å; L219-W246 HydrophobicContact CB-CZ2 4.16Å; L219-W246 HydrophobicContact CD1-CH2 3.77Å; L219-W246 HydrophobicContact CD1-CZ2 4.49Å; L219-W246 HydrophobicContact CD1-CZ3 4.15Å; L219-W246 HydrophobicContact CG-CH2 4.46Å; L222-W246 HydrophobicContact CD1-CG 4.42Å; L222-W246 HydrophobicContact CD2-CB 3.86Å; L222-W246 HydrophobicContact CD2-CD2 3.43Å; L222-W246 VanDerWaalsContact CD2-CD2 3.43Å; L222-W246 HydrophobicContact CD2-CE3 3.81Å; L222-W246 HydrophobicContact CD2-CG 3.43Å; L222-W246 VanDerWaalsContact CD2-CG 3.43Å; L222-W246 HydrophobicContact CG-CG 4.45Å; V242-W246 PolarHBondContact O-N 3.43Å; A243-W246 PolarHBondContact O-N 2.72Å; V244-W246 VanDerWaalsContact C-N 3.29Å; V244-W246 PolarHBondContact O-N 3.2Å; W246-R254 HydrophobicContact CE3-CB 4.26Å; W246-R254 HydrophobicContact CE3-CG 4.4Å; W246-R254 HydrophobicContact CH2-CB 3.91Å; W246-R254 HydrophobicContact CH2-CG 3.64Å; W246-R254 HydrophobicContact CZ2-CG 4.02Å; W246-R254 HydrophobicContact CZ3-CB 3.67Å; W246-R254 HydrophobicContact CZ3-CG 3.87Å; W246-R254 WeakPolarHBondContact O-CD 3.42Å; W246-R254 PolarHBondContact O-NH1 3.36Å; W246-V261 HydrophobicContact CE3-CG2 4.19Å; W246-V261 HydrophobicContact CZ3-CG2 3.91Å
247	L	90.9	Very high	90	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-67.8	-39.2	176.3	-71.5	171	0	0	0	112.3	A243 V244 Q245 A249 A250 P251 R254 A258 F262 I286	A243-L247 VanDerWaalsContact O-CG 3.31Å; A243-L247 WeakPolarHBondContact O-CG 3.33Å; A243-L247 PolarHBondContact O-N 2.78Å; A243-L247 VanDerWaalsContact O-N 3.1Å; V244-L247 PolarHBondContact O-N 3.04Å; V244-L247 VanDerWaalsContact O-N 3.13Å; Q245-L247 VanDerWaalsContact C-N 3.35Å; Q245-L247 PolarHBondContact O-N 2.65Å; L247-A249 VanDerWaalsContact C-N 3.31Å; L247-A249 PolarHBondContact O-N 3.49Å; L247-A250 CarbonylContact O-C 3.53Å; L247-P251 WeakPolarHBondContact O-CA 3.49Å; L247-R254 HydrophobicContact CD2-CB 4.12Å; L247-R254 WeakPolarHBondContact CD2-O 3.37Å; L247-A258 HydrophobicContact CD1-CB 3.69Å; L247-A258 HydrophobicContact CD2-CB 3.76Å; L247-A258 HydrophobicContact CG-CB 4.39Å; L247-F262 HydrophobicContact CD1-CD2 4.16Å; L247-F262 HydrophobicContact CD1-CE2 3.48Å; L247-F262 VanDerWaalsContact CD1-CE2 3.48Å; L247-F262 HydrophobicContact CD1-CZ 3.99Å; L247-I286 HydrophobicContact CB-CD1 3.71Å; L247-I286 HydrophobicContact CB-CG1 4.44Å
248	E	89.3	Confident	89.9	Confident	83 Å²	83	43.6 Å²	43.6	39%	0.388	23%	0.231	S	C	.	.	H	α-helix	trans	-70.7	-24.4	179.8	-75	177	165.4	0	0	113.1	V244 Q245 A250 P251 K284	V244-E248 HydrophobicContact CG1-CG 4.13Å; V244-E248 WeakPolarHBondContact O-CB 3.25Å; V244-E248 WeakPolarHBondContact O-CG 3.49Å; V244-E248 PolarHBondContact O-N 3.31Å; Q245-E248 PolarHBondContact O-N 3.29Å; E248-A250 VanDerWaalsContact C-N 3.33Å; E248-A250 PolarHBondContact O-N 2.98Å; E248-P251 VanDerWaalsContact O-CD 3.28Å; E248-P251 WeakPolarHBondContact O-CD 3.19Å; E248-P251 WeakPolarHBondContact O-CG 3.33Å; E248-K284 WeakPolarHBondContact OE1-CD 3.29Å; E248-K284 IonicContact OE1-NZ 3.35Å; E248-K284 PolarHBondContact OE1-NZ 3.38Å; E248-K284 IonicContact OE2-NZ 2.65Å; E248-K284 PolarHBondContact OE2-NZ 2.87Å
249	A	88.9	Confident	89.7	Confident	61 Å²	61	43.7 Å²	43.7	50%	0.504	24%	0.235	S	C	.	.	H	α-helix	trans	-66.3	-30.5	177.4	0	0	0	0	0	113.6	A215 Q245 L247	A215-A249 HydrophobicContact CB-CB 3.97Å; Q245-A249 PolarHBondContact O-N 3.23Å; L247-A249 VanDerWaalsContact C-N 3.31Å; L247-A249 PolarHBondContact O-N 3.49Å
250	A	87.8	Confident	89.5	Confident	23 Å²	23	48.3 Å²	48.3	19%	0.19	26%	0.257	C	S	.	.	S	Bend	trans	-145.8	74.1	172.5	0	0	0	0	0	111.7	L247 E248 K252 E253 R254	L247-A250 CarbonylContact O-C 3.53Å; E248-A250 VanDerWaalsContact C-N 3.33Å; E248-A250 PolarHBondContact O-N 2.98Å; A250-K252 VanDerWaalsContact C-N 3.29Å; A250-K252 PolarHBondContact O-N 3.35Å; A250-K252 VanDerWaalsContact O-N 3.15Å; A250-E253 PolarHBondContact O-N 3.32Å; A250-R254 HydrophobicContact CB-CG 4.05Å; A250-R254 WeakPolarHBondContact O-CB 3.44Å; A250-R254 PolarHBondContact O-N 3.04Å
251	P	86.2	Confident	89.5	Confident	67 Å²	67	48.3 Å²	48.3	44%	0.435	26%	0.257	S	S	.	.	H	α-helix	trans	-61.4	-32.3	-167.2	-26	35.6	0	0	0	114.6	L247 E248 G255 I286	L247-P251 WeakPolarHBondContact O-CA 3.49Å; E248-P251 VanDerWaalsContact O-CD 3.28Å; E248-P251 WeakPolarHBondContact O-CD 3.19Å; E248-P251 WeakPolarHBondContact O-CG 3.33Å; P251-G255 WeakPolarHBondContact O-CA 3.49Å; P251-G255 PolarHBondContact O-N 3.37Å; P251-G255 VanDerWaalsContact O-N 3.14Å; P251-I286 HydrophobicContact CB-CD1 4.1Å
252	K	87.8	Confident	89.4	Confident	192 Å²	192	45.2 Å²	45.2	84%	0.835	24%	0.242	S	C	*	.	H	α-helix	trans	-74.1	-41.6	-177.9	-66.6	-177.6	-178.9	176.5	0	112.3	A250	A250-K252 VanDerWaalsContact C-N 3.29Å; A250-K252 PolarHBondContact O-N 3.35Å; A250-K252 VanDerWaalsContact O-N 3.15Å
253	E	89.4	Confident	89.2	Confident	165 Å²	165	52.4 Å²	52.4	77%	0.771	27%	0.273	S	S	*	.	H	α-helix	trans	-83.1	-39	-177	-65	178.6	-177.8	0	0	111.5	A250	A250-E253 PolarHBondContact O-N 3.32Å
254	R	90.5	Very high	89.1	Confident	45 Å²	45	52.9 Å²	52.9	17%	0.17	28%	0.277	C	S	.	.	H	α-helix	trans	-92.9	-17.9	-173	-61.3	176.8	-178.4	-174.3	-3	114	A215 W246 L247 A250 S257 A258	A215-R254 VanDerWaalsContact O-CZ 3.25Å; A215-R254 PolarHBondContact O-NH1 2.82Å; A215-R254 PolarHBondContact O-NH2 3.02Å; W246-R254 HydrophobicContact CE3-CB 4.26Å; W246-R254 HydrophobicContact CE3-CG 4.4Å; W246-R254 HydrophobicContact CH2-CB 3.91Å; W246-R254 HydrophobicContact CH2-CG 3.64Å; W246-R254 HydrophobicContact CZ2-CG 4.02Å; W246-R254 HydrophobicContact CZ3-CB 3.67Å; W246-R254 HydrophobicContact CZ3-CG 3.87Å; W246-R254 WeakPolarHBondContact O-CD 3.42Å; W246-R254 PolarHBondContact O-NH1 3.36Å; L247-R254 HydrophobicContact CD2-CB 4.12Å; L247-R254 WeakPolarHBondContact CD2-O 3.37Å; A250-R254 HydrophobicContact CB-CG 4.05Å; A250-R254 WeakPolarHBondContact O-CB 3.44Å; A250-R254 PolarHBondContact O-N 3.04Å; R254-S257 WeakPolarHBondContact O-CB 3.49Å; R254-S257 PolarHBondContact O-N 3.04Å; R254-A258 PolarHBondContact O-N 3.43Å
255	G	85.8	Confident	89.1	Confident	0 Å²	0	53 Å²	53	0%	0	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-48.9	-48.2	179.2	0	0	0	0	0	114.4	P251 S257 A258 Y290	P251-G255 WeakPolarHBondContact O-CA 3.49Å; P251-G255 PolarHBondContact O-N 3.37Å; P251-G255 VanDerWaalsContact O-N 3.14Å; G255-S257 PolarHBondContact O-N 3.38Å; G255-A258 WeakPolarHBondContact O-CB 3.49Å; G255-A258 PolarHBondContact O-N 2.89Å; G255-Y290 WeakPolarHBondContact O-CD1 3.41Å; G255-Y290 VanDerWaalsContact O-CG 3.27Å
256	P	88.3	Confident	89	Confident	92 Å²	92	51.4 Å²	51.4	60%	0.597	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-59.5	-27	177.3	-25.1	35.4	0	0	0	114.5	A258 Y290	P256-A258 VanDerWaalsContact C-N 3.34Å; P256-Y290 HydrophobicContact CG-CE1 4.49Å
257	S	90.6	Very high	88.7	Confident	28 Å²	28	52 Å²	52	20%	0.196	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-85.7	-5	179.4	-53.2	0	0	0	0	113.3	L219 R254 G255 A259 E260 V261	L219-S257 WeakPolarHBondContact CD2-OG 3.37Å; R254-S257 WeakPolarHBondContact O-CB 3.49Å; R254-S257 PolarHBondContact O-N 3.04Å; G255-S257 PolarHBondContact O-N 3.38Å; S257-A259 VanDerWaalsContact C-N 3.27Å; S257-A259 PolarHBondContact O-N 3.29Å; S257-E260 PolarHBondContact O-N 3.41Å; S257-V261 WeakPolarHBondContact O-CG2 3.49Å; S257-V261 PolarHBondContact O-N 2.98Å
258	A	88.3	Confident	88.3	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-55.8	-40.7	-174.7	0	0	0	0	0	112.6	L247 R254 G255 P256 E260 V261 F262 C291	L247-A258 HydrophobicContact CD1-CB 3.69Å; L247-A258 HydrophobicContact CD2-CB 3.76Å; L247-A258 HydrophobicContact CG-CB 4.39Å; R254-A258 PolarHBondContact O-N 3.43Å; G255-A258 WeakPolarHBondContact O-CB 3.49Å; G255-A258 PolarHBondContact O-N 2.89Å; P256-A258 VanDerWaalsContact C-N 3.34Å; A258-E260 VanDerWaalsContact C-N 3.28Å; A258-E260 PolarHBondContact O-N 3.09Å; A258-V261 PolarHBondContact O-N 3.17Å; A258-V261 VanDerWaalsContact O-N 3.16Å; A258-F262 HydrophobicContact CB-CD2 4.33Å; A258-F262 HydrophobicContact CB-CE2 4.35Å; A258-F262 WeakPolarHBondContact O-CD2 3.41Å; A258-F262 PolarHBondContact O-N 2.97Å; A258-C291 WeakPolarHBondContact CB-SG 3.39Å
259	A	86.1	Confident	88.1	Confident	28 Å²	28	53 Å²	53	23%	0.231	28%	0.276	C	S	.	.	H	α-helix	trans	-62.7	-35.3	-179.3	0	0	0	0	0	112.3	S257 K263 C291	S257-A259 VanDerWaalsContact C-N 3.27Å; S257-A259 PolarHBondContact O-N 3.29Å; A259-K263 VanDerWaalsContact O-CG 3.26Å; A259-K263 WeakPolarHBondContact O-CG 3.27Å; A259-K263 PolarHBondContact O-N 3.25Å; A259-C291 VanDerWaalsContact CA-SG 3.53Å; A259-C291 PolarHBondContact N-SG 2.78Å
260	E	89.1	Confident	87.9	Confident	96 Å²	96	50 Å²	50	45%	0.449	25%	0.252	S	S	.	.	H	α-helix	trans	-72.5	-36.7	176.8	-61.8	-169.7	154.8	0	0	112.3	L223 S257 A258	L223-E260 WeakPolarHBondContact CD2-O 3.44Å; S257-E260 PolarHBondContact O-N 3.41Å; A258-E260 VanDerWaalsContact C-N 3.28Å; A258-E260 PolarHBondContact O-N 3.09Å
261	V	91.4	Very high	87.5	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-67.2	-47.6	177.1	-178	0	0	0	0	110.2	L219 L222 L223 L226 A243 W246 S257 A258 K263 C264	L219-V261 HydrophobicContact CD1-CG2 3.69Å; L222-V261 HydrophobicContact CD2-CG1 4.1Å; L222-V261 HydrophobicContact CD2-CG2 4.37Å; L223-V261 HydrophobicContact CD2-CG2 4.31Å; L226-V261 HydrophobicContact CD1-CG1 3.87Å; A243-V261 HydrophobicContact CB-CG1 3.5Å; A243-V261 VanDerWaalsContact CB-CG1 3.5Å; W246-V261 HydrophobicContact CE3-CG2 4.19Å; W246-V261 HydrophobicContact CZ3-CG2 3.91Å; S257-V261 WeakPolarHBondContact O-CG2 3.49Å; S257-V261 PolarHBondContact O-N 2.98Å; A258-V261 PolarHBondContact O-N 3.17Å; A258-V261 VanDerWaalsContact O-N 3.16Å; V261-K263 VanDerWaalsContact C-N 3.28Å; V261-K263 PolarHBondContact O-N 2.97Å; V261-C264 VanDerWaalsContact O-CB 3.28Å; V261-C264 WeakPolarHBondContact O-CB 3.47Å; V261-C264 PolarHBondContact O-N 3.31Å
262	F	90.1	Very high	87.1	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-68.6	-22.4	-179.8	-78.4	-64.9	0	0	0	114	V244 L247 A258 C264 V265 W267 V287 C291 I295	V244-F262 HydrophobicContact CG2-CE1 3.92Å; V244-F262 HydrophobicContact CG2-CZ 3.74Å; L247-F262 HydrophobicContact CD1-CD2 4.16Å; L247-F262 HydrophobicContact CD1-CE2 3.48Å; L247-F262 VanDerWaalsContact CD1-CE2 3.48Å; L247-F262 HydrophobicContact CD1-CZ 3.99Å; A258-F262 HydrophobicContact CB-CD2 4.33Å; A258-F262 HydrophobicContact CB-CE2 4.35Å; A258-F262 WeakPolarHBondContact O-CD2 3.41Å; A258-F262 PolarHBondContact O-N 2.97Å; F262-C264 PolarHBondContact O-N 3.28Å; F262-V265 HydrophobicContact CD1-CG2 4.34Å; F262-V265 WeakPolarHBondContact O-CB 3.1Å; F262-V265 PolarHBondContact O-N 3.07Å; F262-V265 VanDerWaalsContact O-N 3.16Å; F262-W267 HydrophobicContact CB-CZ2 4.11Å; F262-W267 AromaticContact CD1-CH2 3.88Å; F262-W267 HydrophobicContact CD1-CH2 3.88Å; F262-W267 AromaticContact CD1-CZ2 3.62Å; F262-W267 HydrophobicContact CD1-CZ2 3.62Å; F262-W267 HydrophobicContact CE1-CH2 4.3Å; F262-W267 HydrophobicContact CE1-CZ2 4.47Å; F262-W267 HydrophobicContact CG-CZ2 4.23Å; F262-W267 PolarHBondContact O-NE1 2.89Å; F262-W267 VanDerWaalsContact O-NE1 3.11Å; F262-V287 HydrophobicContact CE2-CG2 4.29Å; F262-V287 HydrophobicContact CZ-CG2 3.93Å; F262-C291 HydrophobicContact CD2-CB 3.79Å; F262-C291 VanDerWaalsContact CD2-SG 3.57Å; F262-C291 HydrophobicContact CE2-CB 4.15Å; F262-I295 HydrophobicContact CD1-CD1 4.24Å; F262-I295 HydrophobicContact CE1-CD1 4.22Å; F262-I295 HydrophobicContact CG-CD1 4.44Å; F262-I295 HydrophobicContact CZ-CD1 4.41Å
263	K	87.3	Confident	86.8	Confident	153 Å²	153	55.7 Å²	55.7	67%	0.665	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-20.2	168.1	-79.2	171.6	-174.9	179.1	0	113.4	A259 V261 V265	A259-K263 VanDerWaalsContact O-CG 3.26Å; A259-K263 WeakPolarHBondContact O-CG 3.27Å; A259-K263 PolarHBondContact O-N 3.25Å; V261-K263 VanDerWaalsContact C-N 3.28Å; V261-K263 PolarHBondContact O-N 2.97Å; K263-V265 VanDerWaalsContact C-N 3.32Å
264	C	90.1	Very high	86.5	Confident	10 Å²	10	48.5 Å²	48.5	7%	0.068	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-14.3	176.6	-57.1	0	0	0	0	112.9	L223 L226 R227 V261 F262 R337	L223-C264 WeakPolarHBondContact CD2-SG 3.29Å; L226-C264 HydrophobicContact CB-CB 3.81Å; R227-C264 HydrophobicContact CG-CB 4.31Å; V261-C264 VanDerWaalsContact O-CB 3.28Å; V261-C264 WeakPolarHBondContact O-CB 3.47Å; V261-C264 PolarHBondContact O-N 3.31Å; F262-C264 PolarHBondContact O-N 3.28Å; C264-R337 PolarHBondContact O-NH2 3.38Å
265	V	90.5	Very high	86.1	Confident	5 Å²	5	49.6 Å²	49.6	3%	0.03	25%	0.25	C	S	.	.	S	Bend	trans	-80.2	130.9	176.8	178.1	0	0	0	0	109.2	V239 C240 F262 K263 W267 F270	V239-V265 HydrophobicContact CG1-CG2 4.44Å; C240-V265 HydrophobicContact CB-CG1 4.06Å; C240-V265 HydrophobicContact CB-CG2 4.14Å; F262-V265 HydrophobicContact CD1-CG2 4.34Å; F262-V265 WeakPolarHBondContact O-CB 3.1Å; F262-V265 PolarHBondContact O-N 3.07Å; F262-V265 VanDerWaalsContact O-N 3.16Å; K263-V265 VanDerWaalsContact C-N 3.32Å; V265-W267 HydrophobicContact CB-CD2 4.43Å; V265-W267 HydrophobicContact CB-CZ2 3.95Å; V265-W267 HydrophobicContact CG1-CD2 3.94Å; V265-W267 HydrophobicContact CG1-CE3 4.15Å; V265-W267 HydrophobicContact CG1-CG 4.49Å; V265-W267 HydrophobicContact CG1-CH2 4.18Å; V265-W267 HydrophobicContact CG1-CZ2 3.97Å; V265-W267 HydrophobicContact CG1-CZ3 4.26Å; V265-W267 HydrophobicContact CG2-CZ2 4.44Å; V265-W267 PolarHBondContact O-N 2.97Å; V265-W267 PolarHBondContact O-NE1 2.9Å; V265-F270 HydrophobicContact CG1-CE2 3.62Å; V265-F270 HydrophobicContact CG1-CZ 3.96Å
266	R	89.6	Confident	86	Confident	24 Å²	24	56 Å²	56	9%	0.091	29%	0.285	C	S	.	.			trans	-90.3	78.8	-179.4	-57	174.5	-175.7	178.9	2.9	110	D229 E236 M268 H269 P334 P335 R337	D229-R266 IonicContact OD1-CZ 2.76Å; D229-R266 IonicContact OD1-NH1 3.75Å; D229-R266 PolarHBondContact OD1-NH1 3.22Å; D229-R266 IonicContact OD1-NH2 3.82Å; D229-R266 PolarHBondContact OD1-NH2 3.08Å; E236-R266 HydrophobicContact CG-CB 3.9Å; E236-R266 WeakPolarHBondContact OE1-CD 3.36Å; E236-R266 PolarHBondContact OE2-N 3.45Å; R266-M268 PolarHBondContact O-N 3.43Å; R266-H269 PolarHBondContact O-N 3.04Å; R266-P334 HydrophobicContact CB-CG 4.24Å; R266-P334 HydrophobicContact CG-CB 4.19Å; R266-P334 HydrophobicContact CG-CG 4.13Å; R266-P335 WeakPolarHBondContact CD-O 3.32Å; R266-P335 PolarHBondContact NH1-O 3.38Å; R266-R337 VanDerWaalsContact CZ-NE 3.27Å
267	W	85.1	Confident	85.9	Confident	21 Å²	21	54 Å²	54	8%	0.08	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-53	-22.9	-177.8	-56.7	100.6	0	0	0	115.1	F262 V265 H269 F270 L278 L281 I295 A298 R302	F262-W267 HydrophobicContact CB-CZ2 4.11Å; F262-W267 AromaticContact CD1-CH2 3.88Å; F262-W267 HydrophobicContact CD1-CH2 3.88Å; F262-W267 AromaticContact CD1-CZ2 3.62Å; F262-W267 HydrophobicContact CD1-CZ2 3.62Å; F262-W267 HydrophobicContact CE1-CH2 4.3Å; F262-W267 HydrophobicContact CE1-CZ2 4.47Å; F262-W267 HydrophobicContact CG-CZ2 4.23Å; F262-W267 PolarHBondContact O-NE1 2.89Å; F262-W267 VanDerWaalsContact O-NE1 3.11Å; V265-W267 HydrophobicContact CB-CD2 4.43Å; V265-W267 HydrophobicContact CB-CZ2 3.95Å; V265-W267 HydrophobicContact CG1-CD2 3.94Å; V265-W267 HydrophobicContact CG1-CE3 4.15Å; V265-W267 HydrophobicContact CG1-CG 4.49Å; V265-W267 HydrophobicContact CG1-CH2 4.18Å; V265-W267 HydrophobicContact CG1-CZ2 3.97Å; V265-W267 HydrophobicContact CG1-CZ3 4.26Å; V265-W267 HydrophobicContact CG2-CZ2 4.44Å; V265-W267 PolarHBondContact O-N 2.97Å; V265-W267 PolarHBondContact O-NE1 2.9Å; W267-H269 PolarHBondContact O-N 3.47Å; W267-F270 HydrophobicContact CE3-CD2 4.31Å; W267-F270 AromaticContact CE3-CE2 3.88Å; W267-F270 HydrophobicContact CE3-CE2 3.88Å; W267-F270 HydrophobicContact CE3-CZ 4.3Å; W267-F270 HydrophobicContact CZ3-CE2 4.28Å; W267-F270 HydrophobicContact CZ3-CZ 4.25Å; W267-L278 HydrophobicContact CE3-CD2 4.48Å; W267-L278 HydrophobicContact CZ3-CD2 4.09Å; W267-L281 HydrophobicContact CH2-CD2 3.84Å; W267-L281 HydrophobicContact CZ3-CD2 3.98Å; W267-I295 HydrophobicContact CE3-CG2 4.45Å; W267-I295 HydrophobicContact CH2-CB 4.47Å; W267-I295 HydrophobicContact CH2-CD1 3.78Å; W267-I295 HydrophobicContact CH2-CG1 3.78Å; W267-I295 HydrophobicContact CH2-CG2 3.99Å; W267-I295 HydrophobicContact CZ2-CD1 4.11Å; W267-I295 HydrophobicContact CZ2-CG1 3.73Å; W267-I295 HydrophobicContact CZ2-CG2 4.49Å; W267-I295 HydrophobicContact CZ3-CG2 3.97Å; W267-A298 HydrophobicContact CB-CB 3.8Å; W267-A298 HydrophobicContact CD2-CB 4.36Å; W267-A298 HydrophobicContact CG-CB 3.66Å; W267-R302 PolarHBondContact O-NH1 3.03Å
268	M	82.1	Confident	85.7	Confident	71 Å²	71	53 Å²	53	35%	0.35	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-67.3	-12.8	175.6	-64.6	-59	-70.4	0	0	114.6	R266 R302	R266-M268 PolarHBondContact O-N 3.43Å; M268-R302 PolarHBondContact O-NE 3.32Å; M268-R302 PolarHBondContact O-NH1 2.93Å; M268-R302 PolarHBondContact O-NH2 3.41Å; M268-R302 VanDerWaalsContact O-NH2 3.12Å; M268-R302 HydrophobicContact SD-CB 4.23Å; M268-R302 HydrophobicContact SD-CG 4.32Å
269	H	84.6	Confident	85.4	Confident	31 Å²	31	56.7 Å²	56.7	14%	0.144	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-109.5	4.4	-173.6	-66.8	-47.9	0	0	0	115.2	E236 R266 W267 P334 P335 M340	E236-H269 HydrophobicContact CG-CB 3.94Å; R266-H269 PolarHBondContact O-N 3.04Å; W267-H269 PolarHBondContact O-N 3.47Å; H269-P334 PolarHBondContact NE2-O 2.89Å; H269-P335 PolarHBondContact NE2-O 3.01Å; H269-M340 HydrophobicContact CB-CE 3.64Å; H269-M340 HydrophobicContact CB-SD 4.21Å
270	F	84.3	Confident	85.4	Confident	0 Å²	0	57 Å²	57	0%	0	28%	0.281	C	S	.	.			trans	-73	129.1	173.3	-78.8	-101.9	0	0	0	112.6	E236 Q237 C240 V265 W267 D274 Y277 L278 R302 Y303	E236-F270 HydrophobicContact CB-CD2 4.01Å; E236-F270 HydrophobicContact CB-CE2 3.56Å; E236-F270 HydrophobicContact CB-CZ 4.04Å; Q237-F270 HydrophobicContact CB-CE1 4.26Å; C240-F270 HydrophobicContact CB-CZ 3.91Å; V265-F270 HydrophobicContact CG1-CE2 3.62Å; V265-F270 HydrophobicContact CG1-CZ 3.96Å; W267-F270 HydrophobicContact CE3-CD2 4.31Å; W267-F270 AromaticContact CE3-CE2 3.88Å; W267-F270 HydrophobicContact CE3-CE2 3.88Å; W267-F270 HydrophobicContact CE3-CZ 4.3Å; W267-F270 HydrophobicContact CZ3-CE2 4.28Å; W267-F270 HydrophobicContact CZ3-CZ 4.25Å; F270-D274 VanDerWaalsContact CA-OD2 3.3Å; F270-D274 WeakPolarHBondContact CA-OD2 3.19Å; F270-D274 HydrophobicContact CB-CB 4.28Å; F270-D274 HydrophobicContact CD1-CB 3.78Å; F270-Y277 HydrophobicContact CE1-CD1 4.14Å; F270-Y277 HydrophobicContact CE1-CE1 4.11Å; F270-L278 HydrophobicContact CB-CD1 4.33Å; F270-L278 HydrophobicContact CD1-CD1 4.24Å; F270-L278 HydrophobicContact CD1-CD2 3.75Å; F270-L278 HydrophobicContact CD1-CG 4.09Å; F270-L278 HydrophobicContact CE1-CD2 3.83Å; F270-L278 HydrophobicContact CG-CD1 4.49Å; F270-L278 HydrophobicContact CG-CD2 4.33Å; F270-L278 HydrophobicContact CZ-CD2 4.47Å; F270-R302 VanDerWaalsContact C-NH1 3.35Å; F270-R302 PolarHBondContact O-NH1 3.13Å; F270-R302 PolarHBondContact O-NH2 3.31Å; F270-Y303 PolarHBondContact O-OH 3.35Å; F270-Y303 VanDerWaalsContact O-OH 3.14Å
271	T	81	Confident	85.3	Confident	66 Å²	66	52.6 Å²	52.6	41%	0.405	26%	0.261	S	S	.	.			trans	-84.1	175.4	-179	59.7	0	0	0	0	112	E273 D274 Y303	T271-E273 PolarHBondContact O-N 3.34Å; T271-D274 PolarHBondContact N-OD2 3.35Å; T271-D274 PolarHBondContact O-N 3.15Å; T271-D274 VanDerWaalsContact O-N 3.13Å; T271-Y303 PolarHBondContact O-OH 2.86Å
272	E	77.1	Confident	85	Confident	158 Å²	158	53.4 Å²	53.4	74%	0.738	27%	0.265	S	S	*	.	G	3₁₀ helix	trans	-60.2	-27.8	169.2	-68.1	-176.8	171.2	0	0	111.6	D274 Q275	E272-D274 PolarHBondContact O-N 2.85Å; E272-Q275 WeakPolarHBondContact O-CB 3.26Å; E272-Q275 PolarHBondContact O-N 3.19Å
273	E	80.9	Confident	84.8	Confident	177 Å²	177	57.9 Å²	57.9	83%	0.827	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-64.7	-22.1	175.6	-54.6	179.5	164.3	0	0	112.6	T271 Q275	T271-E273 PolarHBondContact O-N 3.34Å; E273-Q275 VanDerWaalsContact C-N 3.29Å; E273-Q275 PolarHBondContact O-N 2.99Å
274	D	84.1	Confident	84.8	Confident	14 Å²	14	53.4 Å²	53.4	8%	0.075	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-85	1.7	179.1	-64.5	-48.2	0	0	0	113.3	F270 T271 E272 D276 Y277 L278	F270-D274 VanDerWaalsContact CA-OD2 3.3Å; F270-D274 WeakPolarHBondContact CA-OD2 3.19Å; F270-D274 HydrophobicContact CB-CB 4.28Å; F270-D274 HydrophobicContact CD1-CB 3.78Å; T271-D274 PolarHBondContact N-OD2 3.35Å; T271-D274 PolarHBondContact O-N 3.15Å; T271-D274 VanDerWaalsContact O-N 3.13Å; E272-D274 PolarHBondContact O-N 2.85Å; D274-D276 PolarHBondContact O-N 3.08Å; D274-Y277 WeakPolarHBondContact O-CB 3.49Å; D274-Y277 PolarHBondContact O-N 3.19Å; D274-Y277 VanDerWaalsContact O-N 3.12Å; D274-L278 WeakPolarHBondContact O-CG 3.21Å; D274-L278 PolarHBondContact O-N 3.21Å
275	Q	80.8	Confident	84.6	Confident	67 Å²	67	58 Å²	58	31%	0.313	30%	0.302	S	S	.	.	H	α-helix	trans	-58.8	-46.3	-173.4	-175	177.6	-20.5	0	0	112.7	E272 E273 Y277 L278 E279 L311	E272-Q275 WeakPolarHBondContact O-CB 3.26Å; E272-Q275 PolarHBondContact O-N 3.19Å; E273-Q275 VanDerWaalsContact C-N 3.29Å; E273-Q275 PolarHBondContact O-N 2.99Å; Q275-Y277 PolarHBondContact O-N 3.26Å; Q275-L278 PolarHBondContact O-N 3.36Å; Q275-L278 VanDerWaalsContact O-N 3.1Å; Q275-E279 PolarHBondContact NE2-OE1 2.81Å; Q275-E279 PolarHBondContact O-N 3.17Å; Q275-L311 HydrophobicContact CG-CD2 4.36Å
276	D	84.5	Confident	84.3	Confident	134 Å²	134	58.3 Å²	58.3	72%	0.717	30%	0.304	S	S	*	.	H	α-helix	trans	-58.5	-37.1	178.5	-68.8	-21.1	0	0	0	111.8	D274 G280	D274-D276 PolarHBondContact O-N 3.08Å; D276-G280 PolarHBondContact O-N 2.76Å; D276-G280 VanDerWaalsContact O-N 3.1Å
277	Y	87.1	Confident	84	Confident	50 Å²	50	57.1 Å²	57.1	20%	0.196	30%	0.299	C	S	.	.	H	α-helix	trans	-69.2	-43	177	173.8	-95	0	0	0	111.8	Q237 C240 H241 F270 D274 Q275 G280 L281	Q237-Y277 HydrophobicContact CG-CD1 3.65Å; Q237-Y277 HydrophobicContact CG-CD2 3.89Å; Q237-Y277 HydrophobicContact CG-CE1 3.7Å; Q237-Y277 HydrophobicContact CG-CE2 3.93Å; Q237-Y277 HydrophobicContact CG-CG 3.73Å; Q237-Y277 VanDerWaalsContact NE2-CG 3.35Å; C240-Y277 HydrophobicContact CB-CE1 4.32Å; H241-Y277 WeakPolarHBondContact CA-OH 3.39Å; H241-Y277 PolarHBondContact N-OH 3.24Å; F270-Y277 HydrophobicContact CE1-CD1 4.14Å; F270-Y277 HydrophobicContact CE1-CE1 4.11Å; D274-Y277 WeakPolarHBondContact O-CB 3.49Å; D274-Y277 PolarHBondContact O-N 3.19Å; D274-Y277 VanDerWaalsContact O-N 3.12Å; Q275-Y277 PolarHBondContact O-N 3.26Å; Y277-G280 PolarHBondContact O-N 3.45Å; Y277-L281 WeakPolarHBondContact O-CB 3.49Å; Y277-L281 PolarHBondContact O-N 2.57Å
278	L	84.7	Confident	84	Confident	8 Å²	8	62 Å²	62	4%	0.042	32%	0.321	C	S	.	.	H	α-helix	trans	-64.1	-40.7	177.9	-68.7	172.3	0	0	0	111.7	W267 F270 D274 Q275 L281 L282 L299	W267-L278 HydrophobicContact CE3-CD2 4.48Å; W267-L278 HydrophobicContact CZ3-CD2 4.09Å; F270-L278 HydrophobicContact CB-CD1 4.33Å; F270-L278 HydrophobicContact CD1-CD1 4.24Å; F270-L278 HydrophobicContact CD1-CD2 3.75Å; F270-L278 HydrophobicContact CD1-CG 4.09Å; F270-L278 HydrophobicContact CE1-CD2 3.83Å; F270-L278 HydrophobicContact CG-CD1 4.49Å; F270-L278 HydrophobicContact CG-CD2 4.33Å; F270-L278 HydrophobicContact CZ-CD2 4.47Å; D274-L278 WeakPolarHBondContact O-CG 3.21Å; D274-L278 PolarHBondContact O-N 3.21Å; Q275-L278 PolarHBondContact O-N 3.36Å; Q275-L278 VanDerWaalsContact O-N 3.1Å; L278-L281 WeakPolarHBondContact O-CB 3.35Å; L278-L281 PolarHBondContact O-N 3.38Å; L278-L282 WeakPolarHBondContact O-CG 3.28Å; L278-L282 PolarHBondContact O-N 3.14Å; L278-L299 HydrophobicContact CD1-CD2 3.88Å; L278-L299 HydrophobicContact CD2-CD2 4.44Å
279	E	83.1	Confident	84.1	Confident	78 Å²	78	65.7 Å²	65.7	36%	0.364	34%	0.335	S	S	.	.	H	α-helix	trans	-59	-49.4	172.8	-74.6	-178.7	-162.5	0	0	110.9	Q275 L281 L282 T283 L311	Q275-E279 PolarHBondContact NE2-OE1 2.81Å; Q275-E279 PolarHBondContact O-N 3.17Å; E279-L281 VanDerWaalsContact C-N 3.29Å; E279-L281 PolarHBondContact O-N 2.84Å; E279-L282 PolarHBondContact O-N 3.2Å; E279-T283 WeakPolarHBondContact O-CG2 3.06Å; E279-T283 PolarHBondContact O-N 3.17Å; E279-L311 HydrophobicContact CG-CD2 3.25Å; E279-L311 WeakPolarHBondContact OE1-CD2 3.44Å
280	G	85.8	Confident	83.9	Confident	34 Å²	34	68 Å²	68	35%	0.351	34%	0.343	S	S	.	.	H	α-helix	trans	-57.1	-40.5	174.4	0	0	0	0	0	112.9	D276 Y277 T283	D276-G280 PolarHBondContact O-N 2.76Å; D276-G280 VanDerWaalsContact O-N 3.1Å; Y277-G280 PolarHBondContact O-N 3.45Å; G280-T283 PolarHBondContact O-N 2.71Å; G280-T283 PolarHBondContact O-OG1 3.35Å
281	L	87	Confident	83.8	Confident	4 Å²	4	68.1 Å²	68.1	2%	0.021	34%	0.344	C	S	.	.	H	α-helix	trans	-62.5	-45.2	178.8	-178.6	66.4	0	0	0	112.4	C240 V244 W267 Y277 L278 E279 T283 K284 V287 I295	C240-L281 VanDerWaalsContact SG-CD2 3.57Å; V244-L281 HydrophobicContact CG2-CD1 3.49Å; V244-L281 VanDerWaalsContact CG2-CD1 3.49Å; W267-L281 HydrophobicContact CH2-CD2 3.84Å; W267-L281 HydrophobicContact CZ3-CD2 3.98Å; Y277-L281 WeakPolarHBondContact O-CB 3.49Å; Y277-L281 PolarHBondContact O-N 2.57Å; L278-L281 WeakPolarHBondContact O-CB 3.35Å; L278-L281 PolarHBondContact O-N 3.38Å; E279-L281 VanDerWaalsContact C-N 3.29Å; E279-L281 PolarHBondContact O-N 2.84Å; L281-T283 PolarHBondContact O-N 3.37Å; L281-K284 HydrophobicContact CD1-CD 4.37Å; L281-K284 WeakPolarHBondContact O-CB 3.29Å; L281-K284 PolarHBondContact O-N 3.26Å; L281-K284 VanDerWaalsContact O-N 3.09Å; L281-V287 HydrophobicContact CD1-CG2 3.89Å; L281-V287 HydrophobicContact CG-CG2 4.24Å; L281-I295 HydrophobicContact CD2-CD1 4.16Å
282	L	84.6	Confident	83.7	Confident	17 Å²	17	67.1 Å²	67.1	9%	0.089	34%	0.336	C	S	.	.	H	α-helix	trans	-64.5	-24.9	179.1	-68.8	173.2	0	0	0	112.5	L278 E279 K284 K288 L292 I295 L299	L278-L282 WeakPolarHBondContact O-CG 3.28Å; L278-L282 PolarHBondContact O-N 3.14Å; E279-L282 PolarHBondContact O-N 3.2Å; L282-K284 VanDerWaalsContact C-N 3.29Å; L282-K284 PolarHBondContact O-N 3.18Å; L282-K288 WeakPolarHBondContact O-CE 3.4Å; L282-K288 VanDerWaalsContact O-CG 3.31Å; L282-K288 WeakPolarHBondContact O-CG 3.18Å; L282-L292 HydrophobicContact CD2-CD1 4.48Å; L282-I295 HydrophobicContact CD2-CB 4.46Å; L282-I295 HydrophobicContact CD2-CG2 3.98Å; L282-L299 HydrophobicContact CD1-CD1 4.48Å
283	T	86.6	Confident	83.6	Confident	93 Å²	93	65.8 Å²	65.8	57%	0.571	33%	0.334	S	S	*	.	H	α-helix	trans	-72.6	-20.2	175.3	69.7	0	0	0	0	113.7	E279 G280 L281	E279-T283 WeakPolarHBondContact O-CG2 3.06Å; E279-T283 PolarHBondContact O-N 3.17Å; G280-T283 PolarHBondContact O-N 2.71Å; G280-T283 PolarHBondContact O-OG1 3.35Å; L281-T283 PolarHBondContact O-N 3.37Å
284	K	86.6	Confident	83.4	Confident	59 Å²	59	60 Å²	60	26%	0.257	31%	0.31	S	S	.	.	S	Bend	trans	-66.1	136.8	-173.6	-68.4	-168.5	166.5	-147.5	0	112.2	V244 E248 L281 L282 I286 V287 K288	V244-K284 HydrophobicContact CG1-CD 3.71Å; E248-K284 WeakPolarHBondContact OE1-CD 3.29Å; E248-K284 IonicContact OE1-NZ 3.35Å; E248-K284 PolarHBondContact OE1-NZ 3.38Å; E248-K284 IonicContact OE2-NZ 2.65Å; E248-K284 PolarHBondContact OE2-NZ 2.87Å; L281-K284 HydrophobicContact CD1-CD 4.37Å; L281-K284 WeakPolarHBondContact O-CB 3.29Å; L281-K284 PolarHBondContact O-N 3.26Å; L281-K284 VanDerWaalsContact O-N 3.09Å; L282-K284 VanDerWaalsContact C-N 3.29Å; L282-K284 PolarHBondContact O-N 3.18Å; K284-I286 VanDerWaalsContact C-N 3.31Å; K284-I286 PolarHBondContact O-N 2.91Å; K284-V287 HydrophobicContact CB-CB 4.35Å; K284-V287 HydrophobicContact CB-CG2 4.11Å; K284-V287 PolarHBondContact O-N 2.81Å; K284-K288 PolarHBondContact O-N 2.98Å
285	P	86.1	Confident	83	Confident	106 Å²	106	59.3 Å²	59.3	69%	0.688	31%	0.307	S	S	*	.	H	α-helix	trans	-64.9	-33.6	-173.9	24.9	-33.7	0	0	0	113.1	K289	P285-K289 VanDerWaalsContact O-CB 3.3Å; P285-K289 WeakPolarHBondContact O-CB 3.34Å; P285-K289 PolarHBondContact O-N 3.35Å; P285-K289 VanDerWaalsContact O-N 3.11Å
286	I	84.6	Confident	82.7	Confident	12 Å²	12	57.3 Å²	57.3	6%	0.062	30%	0.297	C	S	.	.	H	α-helix	trans	-68.8	-37.3	178.2	-163.2	147	0	0	0	111.8	L247 P251 K284 Y290	L247-I286 HydrophobicContact CB-CD1 3.71Å; L247-I286 HydrophobicContact CB-CG1 4.44Å; P251-I286 HydrophobicContact CB-CD1 4.1Å; K284-I286 VanDerWaalsContact C-N 3.31Å; K284-I286 PolarHBondContact O-N 2.91Å; I286-Y290 HydrophobicContact CG1-CD2 4.11Å; I286-Y290 WeakPolarHBondContact O-CD2 3.17Å; I286-Y290 PolarHBondContact O-N 2.94Å; I286-Y290 VanDerWaalsContact O-N 3.15Å
287	V	84.2	Confident	82.2	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-67.9	-51.5	176.6	173.9	0	0	0	0	109.7	F262 L281 K284 K289 Y290 C291 L292 I295	F262-V287 HydrophobicContact CE2-CG2 4.29Å; F262-V287 HydrophobicContact CZ-CG2 3.93Å; L281-V287 HydrophobicContact CD1-CG2 3.89Å; L281-V287 HydrophobicContact CG-CG2 4.24Å; K284-V287 HydrophobicContact CB-CB 4.35Å; K284-V287 HydrophobicContact CB-CG2 4.11Å; K284-V287 PolarHBondContact O-N 2.81Å; V287-K289 PolarHBondContact O-N 3.35Å; V287-K289 VanDerWaalsContact O-N 3.16Å; V287-Y290 PolarHBondContact O-N 3.44Å; V287-C291 CarbonylContact O-C 3.49Å; V287-C291 PolarHBondContact O-N 3.44Å; V287-L292 PolarHBondContact O-N 2.8Å; V287-I295 HydrophobicContact CG1-CD1 3.6Å; V287-I295 HydrophobicContact CG2-CD1 4.45Å
288	K	84.6	Confident	81.5	Confident	123 Å²	123	51.1 Å²	51.1	54%	0.535	28%	0.278	S	S	.	.	H	α-helix	trans	-54.9	-36	177.9	-72.9	-175.1	172.8	173.9	0	113.6	L282 K284 L292	L282-K288 WeakPolarHBondContact O-CE 3.4Å; L282-K288 VanDerWaalsContact O-CG 3.31Å; L282-K288 WeakPolarHBondContact O-CG 3.18Å; K284-K288 PolarHBondContact O-N 2.98Å; K288-L292 HydrophobicContact CB-CD1 4.49Å; K288-L292 HydrophobicContact CG-CD1 4.05Å
289	K	83.4	Confident	80.9	Confident	148 Å²	148	51.4 Å²	51.4	64%	0.643	28%	0.28	S	S	*	.	H	α-helix	trans	-83.8	-33.7	-175.1	-173.1	174.4	176.5	-162.3	0	113.9	P285 V287	P285-K289 VanDerWaalsContact O-CB 3.3Å; P285-K289 WeakPolarHBondContact O-CB 3.34Å; P285-K289 PolarHBondContact O-N 3.35Å; P285-K289 VanDerWaalsContact O-N 3.11Å; V287-K289 PolarHBondContact O-N 3.35Å; V287-K289 VanDerWaalsContact O-N 3.16Å
290	Y	82	Confident	80.3	Confident	80 Å²	80	51.3 Å²	51.3	31%	0.314	28%	0.279	S	S	.	.	H	α-helix	trans	-123.3	-20.4	-167.1	-65.4	-77.3	0	0	0	115.2	G255 P256 I286 V287	G255-Y290 WeakPolarHBondContact O-CD1 3.41Å; G255-Y290 VanDerWaalsContact O-CG 3.27Å; P256-Y290 HydrophobicContact CG-CE1 4.49Å; I286-Y290 HydrophobicContact CG1-CD2 4.11Å; I286-Y290 WeakPolarHBondContact O-CD2 3.17Å; I286-Y290 PolarHBondContact O-N 2.94Å; I286-Y290 VanDerWaalsContact O-N 3.15Å; V287-Y290 PolarHBondContact O-N 3.44Å
291	C	80.9	Confident	79.4	Confident	2 Å²	2	57.5 Å²	57.5	1%	0.014	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-142.4	6.8	-167.1	-62.8	0	0	0	0	115.6	A258 A259 F262 V287 D293 V294 I295	A258-C291 WeakPolarHBondContact CB-SG 3.39Å; A259-C291 VanDerWaalsContact CA-SG 3.53Å; A259-C291 PolarHBondContact N-SG 2.78Å; F262-C291 HydrophobicContact CD2-CB 3.79Å; F262-C291 VanDerWaalsContact CD2-SG 3.57Å; F262-C291 HydrophobicContact CE2-CB 4.15Å; V287-C291 CarbonylContact O-C 3.49Å; V287-C291 PolarHBondContact O-N 3.44Å; C291-D293 PolarHBondContact O-N 3.35Å; C291-V294 PolarHBondContact O-N 2.83Å; C291-V294 VanDerWaalsContact O-N 3.15Å; C291-I295 HydrophobicContact CB-CD1 4.48Å; C291-I295 WeakPolarHBondContact O-CG1 3.39Å; C291-I295 PolarHBondContact O-N 3.19Å; C291-I295 VanDerWaalsContact O-N 3.12Å
292	L	78.4	Confident	78.4	Confident	46 Å²	46	60.9 Å²	60.9	24%	0.241	31%	0.314	C	S	.	.	H	α-helix	trans	-52	-54.8	-178	-163.2	95.5	0	0	0	110.9	L282 V287 K288 V294 I295 E296	L282-L292 HydrophobicContact CD2-CD1 4.48Å; V287-L292 PolarHBondContact O-N 2.8Å; K288-L292 HydrophobicContact CB-CD1 4.49Å; K288-L292 HydrophobicContact CG-CD1 4.05Å; L292-V294 VanDerWaalsContact C-N 3.26Å; L292-V294 PolarHBondContact O-N 2.64Å; L292-I295 PolarHBondContact O-N 2.96Å; L292-E296 VanDerWaalsContact CD2-OE1 3.26Å; L292-E296 WeakPolarHBondContact CD2-OE1 3.33Å; L292-E296 HydrophobicContact CG-CG 4.31Å; L292-E296 WeakPolarHBondContact CG-OE1 3.19Å; L292-E296 VanDerWaalsContact O-CB 3.3Å; L292-E296 WeakPolarHBondContact O-CB 3.46Å; L292-E296 WeakPolarHBondContact O-CG 3.43Å; L292-E296 PolarHBondContact O-N 3.28Å
293	D	75.6	Confident	77.3	Confident	130 Å²	130	63 Å²	63	70%	0.695	32%	0.321	S	S	*	.	H	α-helix	trans	-58.4	-34.7	-178.5	-49.3	-20.1	0	0	0	113.4	C291 G297	C291-D293 PolarHBondContact O-N 3.35Å; D293-G297 PolarHBondContact O-N 3.21Å
294	V	75.8	Confident	76	Confident	54 Å²	54	60.2 Å²	60.2	33%	0.327	31%	0.31	S	S	.	.	H	α-helix	trans	-72	-43.1	-178.7	178.1	0	0	0	0	110.7	C291 L292 A298	C291-V294 PolarHBondContact O-N 2.83Å; C291-V294 VanDerWaalsContact O-N 3.15Å; L292-V294 VanDerWaalsContact C-N 3.26Å; L292-V294 PolarHBondContact O-N 2.64Å; V294-A298 WeakPolarHBondContact O-CB 3.45Å; V294-A298 PolarHBondContact O-N 2.97Å
295	I	77.6	Confident	74.2	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-73.3	-43.1	179.7	-60.2	-179	0	0	0	109.7	F262 W267 L281 L282 V287 C291 L292 A298 L299	F262-I295 HydrophobicContact CD1-CD1 4.24Å; F262-I295 HydrophobicContact CE1-CD1 4.22Å; F262-I295 HydrophobicContact CG-CD1 4.44Å; F262-I295 HydrophobicContact CZ-CD1 4.41Å; W267-I295 HydrophobicContact CE3-CG2 4.45Å; W267-I295 HydrophobicContact CH2-CB 4.47Å; W267-I295 HydrophobicContact CH2-CD1 3.78Å; W267-I295 HydrophobicContact CH2-CG1 3.78Å; W267-I295 HydrophobicContact CH2-CG2 3.99Å; W267-I295 HydrophobicContact CZ2-CD1 4.11Å; W267-I295 HydrophobicContact CZ2-CG1 3.73Å; W267-I295 HydrophobicContact CZ2-CG2 4.49Å; W267-I295 HydrophobicContact CZ3-CG2 3.97Å; L281-I295 HydrophobicContact CD2-CD1 4.16Å; L282-I295 HydrophobicContact CD2-CB 4.46Å; L282-I295 HydrophobicContact CD2-CG2 3.98Å; V287-I295 HydrophobicContact CG1-CD1 3.6Å; V287-I295 HydrophobicContact CG2-CD1 4.45Å; C291-I295 HydrophobicContact CB-CD1 4.48Å; C291-I295 WeakPolarHBondContact O-CG1 3.39Å; C291-I295 PolarHBondContact O-N 3.19Å; C291-I295 VanDerWaalsContact O-N 3.12Å; L292-I295 PolarHBondContact O-N 2.96Å; I295-A298 PolarHBondContact O-N 3.39Å; I295-L299 HydrophobicContact CG2-CD1 3.94Å; I295-L299 HydrophobicContact CG2-CG 4.32Å; I295-L299 WeakPolarHBondContact O-CG 3.36Å; I295-L299 PolarHBondContact O-N 3.38Å
296	E	74.5	Confident	72.2	Confident	26 Å²	26	64.6 Å²	64.6	12%	0.121	33%	0.33	C	S	.	.	H	α-helix	trans	-59	-48.2	176.8	-80.3	-178.4	174.6	0	0	111.9	L292 A298 L299 Q300 Y308	L292-E296 VanDerWaalsContact CD2-OE1 3.26Å; L292-E296 WeakPolarHBondContact CD2-OE1 3.33Å; L292-E296 HydrophobicContact CG-CG 4.31Å; L292-E296 WeakPolarHBondContact CG-OE1 3.19Å; L292-E296 VanDerWaalsContact O-CB 3.3Å; L292-E296 WeakPolarHBondContact O-CB 3.46Å; L292-E296 WeakPolarHBondContact O-CG 3.43Å; L292-E296 PolarHBondContact O-N 3.28Å; E296-A298 VanDerWaalsContact C-N 3.3Å; E296-A298 PolarHBondContact O-N 3.28Å; E296-L299 PolarHBondContact O-N 3.08Å; E296-Q300 WeakPolarHBondContact O-CB 3.34Å; E296-Q300 PolarHBondContact O-N 2.93Å; E296-Y308 HydrophobicContact CB-CE2 4.07Å; E296-Y308 HydrophobicContact CG-CE2 4.24Å
297	G	73.4	Confident	70.3	Confident	31 Å²	31	66.6 Å²	66.6	32%	0.32	34%	0.34	S	S	.	.	H	α-helix	trans	-61	-38.4	175.8	0	0	0	0	0	112.9	D293 M301	D293-G297 PolarHBondContact O-N 3.21Å; G297-M301 VanDerWaalsContact O-CG 3.25Å; G297-M301 WeakPolarHBondContact O-CG 2.82Å; G297-M301 PolarHBondContact O-N 3.05Å; G297-M301 VanDerWaalsContact O-N 3.15Å
298	A	72.4	Confident	68.4	Low	23 Å²	23	70.3 Å²	70.3	19%	0.19	36%	0.355	C	S	.	.	H	α-helix	trans	-68.6	-38.6	177.7	0	0	0	0	0	112.7	W267 V294 I295 E296	W267-A298 HydrophobicContact CB-CB 3.8Å; W267-A298 HydrophobicContact CD2-CB 4.36Å; W267-A298 HydrophobicContact CG-CB 3.66Å; V294-A298 WeakPolarHBondContact O-CB 3.45Å; V294-A298 PolarHBondContact O-N 2.97Å; I295-A298 PolarHBondContact O-N 3.39Å; E296-A298 VanDerWaalsContact C-N 3.3Å; E296-A298 PolarHBondContact O-N 3.28Å
299	L	71.3	Confident	66.5	Low	13 Å²	13	72.1 Å²	72.1	7%	0.068	36%	0.363	C	S	.	.	H	α-helix	trans	-71.4	-39.9	176.4	-68.5	174.4	0	0	0	111.9	L278 L282 I295 E296 M301 R302 Y303	L278-L299 HydrophobicContact CD1-CD2 3.88Å; L278-L299 HydrophobicContact CD2-CD2 4.44Å; L282-L299 HydrophobicContact CD1-CD1 4.48Å; I295-L299 HydrophobicContact CG2-CD1 3.94Å; I295-L299 HydrophobicContact CG2-CG 4.32Å; I295-L299 WeakPolarHBondContact O-CG 3.36Å; I295-L299 PolarHBondContact O-N 3.38Å; E296-L299 PolarHBondContact O-N 3.08Å; L299-M301 PolarHBondContact O-N 2.61Å; L299-R302 PolarHBondContact O-N 3.23Å; L299-R302 VanDerWaalsContact O-N 3.1Å; L299-Y303 HydrophobicContact CD2-CD2 4.32Å; L299-Y303 HydrophobicContact CD2-CE2 4.07Å; L299-Y303 PolarHBondContact O-N 3.05Å
300	Q	70.4	Confident	64.8	Low	76 Å²	76	69.4 Å²	69.4	36%	0.355	36%	0.363	S	S	.	.	H	α-helix	trans	-64.3	-39.6	179	-168.1	177.7	19.1	0	0	112	E296 R302 G304 D305 Y308	E296-Q300 WeakPolarHBondContact O-CB 3.34Å; E296-Q300 PolarHBondContact O-N 2.93Å; Q300-R302 PolarHBondContact O-N 3.3Å; Q300-R302 VanDerWaalsContact O-N 3.16Å; Q300-G304 WeakPolarHBondContact O-CA 3.33Å; Q300-G304 PolarHBondContact O-N 2.98Å; Q300-G304 VanDerWaalsContact O-N 3.08Å; Q300-D305 PolarHBondContact NE2-OD1 2.76Å; Q300-Y308 HydrophobicContact CB-CD2 4.26Å; Q300-Y308 HydrophobicContact CG-CD2 4.45Å
301	M	67.7	Low	63.1	Low	165 Å²	165	67.6 Å²	67.6	81%	0.813	36%	0.358	S	S	*	.	H	α-helix	trans	-59.8	-23.1	174.5	-77.1	-69.4	-70.6	0	0	113.3	G297 L299	G297-M301 VanDerWaalsContact O-CG 3.25Å; G297-M301 WeakPolarHBondContact O-CG 2.82Å; G297-M301 PolarHBondContact O-N 3.05Å; G297-M301 VanDerWaalsContact O-N 3.15Å; L299-M301 PolarHBondContact O-N 2.61Å
302	R	65.3	Low	61.3	Low	75 Å²	75	69.6 Å²	69.6	28%	0.283	37%	0.37	S	S	.	.	H	α-helix	trans	-102.2	-48.5	-174.9	-170.9	179.4	-174.4	-160.3	-12.7	114.1	W267 M268 F270 L299 Q300	W267-R302 PolarHBondContact O-NH1 3.03Å; M268-R302 PolarHBondContact O-NE 3.32Å; M268-R302 PolarHBondContact O-NH1 2.93Å; M268-R302 PolarHBondContact O-NH2 3.41Å; M268-R302 VanDerWaalsContact O-NH2 3.12Å; M268-R302 HydrophobicContact SD-CB 4.23Å; M268-R302 HydrophobicContact SD-CG 4.32Å; F270-R302 VanDerWaalsContact C-NH1 3.35Å; F270-R302 PolarHBondContact O-NH1 3.13Å; F270-R302 PolarHBondContact O-NH2 3.31Å; L299-R302 PolarHBondContact O-N 3.23Å; L299-R302 VanDerWaalsContact O-N 3.1Å; Q300-R302 PolarHBondContact O-N 3.3Å; Q300-R302 VanDerWaalsContact O-N 3.16Å
303	Y	62.7	Low	59.3	Low	61 Å²	61	73 Å²	73	24%	0.239	40%	0.395	C	S	.	.	H	α-helix	trans	-98.1	-4.3	-173.9	-65.5	-79.6	0	0	0	113.3	F270 T271 L299 L307	F270-Y303 PolarHBondContact O-OH 3.35Å; F270-Y303 VanDerWaalsContact O-OH 3.14Å; T271-Y303 PolarHBondContact O-OH 2.86Å; L299-Y303 HydrophobicContact CD2-CD2 4.32Å; L299-Y303 HydrophobicContact CD2-CE2 4.07Å; L299-Y303 PolarHBondContact O-N 3.05Å; Y303-L307 HydrophobicContact CD1-CD1 3.58Å; Y303-L307 HydrophobicContact CE1-CD1 4.44Å; Y303-L307 HydrophobicContact CG-CD1 3.95Å
304	G	59	Low	57.5	Low	34 Å²	34	72.6 Å²	72.6	35%	0.351	40%	0.397	S	S	.	.	H	α-helix	trans	66.4	-175.7	-175.7	0	0	0	0	0	113.7	Q300 L306	Q300-G304 WeakPolarHBondContact O-CA 3.33Å; Q300-G304 PolarHBondContact O-N 2.98Å; Q300-G304 VanDerWaalsContact O-N 3.08Å; G304-L306 VanDerWaalsContact C-N 3.25Å; G304-L306 PolarHBondContact O-N 2.8Å
305	D	48.4	Very low	55.6	Low	92 Å²	92	75.2 Å²	75.2	49%	0.492	42%	0.415	S	S	.	.	H	α-helix	trans	-67.9	-16.5	-171.9	-111.9	15.5	0	0	0	115.1	Q300	Q300-D305 PolarHBondContact NE2-OD1 2.76Å
306	L	44.7	Very low	53.6	Low	165 Å²	165	83 Å²	83	86%	0.864	46%	0.457	S	S	*	.	H	α-helix	trans	-78.3	-37.1	-171.8	-90.4	131.1	0	0	0	113.7	G304	G304-L306 VanDerWaalsContact C-N 3.25Å; G304-L306 PolarHBondContact O-N 2.8Å
307	L	44.8	Very low	51.6	Low	54 Å²	54	86.9 Å²	86.9	28%	0.283	49%	0.487	S	S	.	.	H	α-helix	trans	-86.3	-29.5	175.4	-88.3	159.8	0	0	0	112.3	Y303 K309 S310 L311	Y303-L307 HydrophobicContact CD1-CD1 3.58Å; Y303-L307 HydrophobicContact CE1-CD1 4.44Å; Y303-L307 HydrophobicContact CG-CD1 3.95Å; L307-K309 PolarHBondContact O-N 3.34Å; L307-S310 PolarHBondContact O-N 3.3Å; L307-L311 WeakPolarHBondContact O-CG 3.39Å; L307-L311 PolarHBondContact O-N 2.85Å
308	Y	43.6	Very low	49.8	Very low	78 Å²	78	91.1 Å²	91.1	31%	0.306	51%	0.512	S	S	.	.	H	α-helix	trans	-54.1	-39.1	174.9	-178.4	-102.6	0	0	0	112.6	E296 Q300	E296-Y308 HydrophobicContact CB-CE2 4.07Å; E296-Y308 HydrophobicContact CG-CE2 4.24Å; Q300-Y308 HydrophobicContact CB-CD2 4.26Å; Q300-Y308 HydrophobicContact CG-CD2 4.45Å
309	K	45	Very low	47.8	Very low	161 Å²	161	95.6 Å²	95.6	70%	0.7	54%	0.541	S	S	*	.	H	α-helix	trans	-76.1	-19.1	177.2	-76.4	178	178.8	168.6	0	114.7	L307	L307-K309 PolarHBondContact O-N 3.34Å
310	S	48.2	Very low	45.9	Very low	92 Å²	92	100.4 Å²	100.4	64%	0.643	58%	0.576	S	S	*	*	H	α-helix	trans	-87.2	-25.7	-179.6	-160.9	0	0	0	0	112.6	L307	L307-S310 PolarHBondContact O-N 3.3Å
311	L	45.2	Very low	43.9	Very low	41 Å²	41	102.5 Å²	102.5	22%	0.215	60%	0.599	C	S	.	*	H	α-helix	trans	-91.2	-11.5	-174.3	-64.4	166.3	0	0	0	113.8	Q275 E279 L307	Q275-L311 HydrophobicContact CG-CD2 4.36Å; E279-L311 HydrophobicContact CG-CD2 3.25Å; E279-L311 WeakPolarHBondContact OE1-CD2 3.44Å; L307-L311 WeakPolarHBondContact O-CG 3.39Å; L307-L311 PolarHBondContact O-N 2.85Å
312	V	42.6	Very low	42.2	Very low	45 Å²	45	100 Å²	100	27%	0.273	60%	0.598	S	S	.	*			trans	-124.1	118.2	-174	-175	0	0	0	0	111.1	V314	V312-V314 PolarHBondContact O-N 3.46Å
313	P	37.3	Very low	40.4	Very low	118 Å²	118	102 Å²	102	77%	0.766	62%	0.623	S	S	*	*			trans	-73.7	114.2	166.5	-1	17	0	0	0	108.7	P315	P313-P315 WeakPolarHBondContact O-CD 3.36Å
314	V	37.6	Very low	38.7	Very low	120 Å²	120	104.7 Å²	104.7	73%	0.727	65%	0.651	S	S	*	*			trans	-60.5	123.9	177.3	179.2	0	0	0	0	110.6	V312	V312-V314 PolarHBondContact O-N 3.46Å
315	P	37.1	Very low	37.4	Very low	110 Å²	110	110.3 Å²	110.3	71%	0.714	67%	0.673	S	S	*	*			trans	-77.1	128.1	156.4	-2.9	21.4	0	0	0	108.2	P313 S317	P313-P315 WeakPolarHBondContact O-CD 3.36Å; P315-S317 PolarHBondContact O-N 2.95Å
316	N	34.5	Very low	36.4	Very low	164 Å²	164	111.1 Å²	111.1	88%	0.877	69%	0.686	S	S	*	*	S	Bend	trans	-55.1	104.9	178.5	-73.9	-29.8	0	0	0	112.2
317	S	32.9	Very low	35.7	Very low	107 Å²	107	110.7 Å²	110.7	75%	0.748	68%	0.684	S	S	*	*			trans	-159.3	116.2	147.5	56.4	0	0	0	0	111	P315	P315-S317 PolarHBondContact O-N 2.95Å
318	S	35.1	Very low	35.1	Very low	120 Å²	120	114 Å²	114	84%	0.839	71%	0.706	S	S	*	*			trans	-60.1	123.9	163.4	48.8	0	0	0	0	111.4
319	S	30.6	Very low	34.5	Very low	116 Å²	116	114.6 Å²	114.6	81%	0.811	72%	0.721	S	S	*	*			trans	-171.3	132.2	134.2	42.9	0	0	0	0	111.7
320	S	31.4	Very low	33.9	Very low	115 Å²	115	112.1 Å²	112.1	80%	0.804	73%	0.731	S	S	*	*			trans	-63.3	135.4	166.1	49	0	0	0	0	112.1
321	S	28.8	Very low	33.6	Very low	119 Å²	119	111.1 Å²	111.1	83%	0.832	73%	0.729	S	S	*	*			trans	-170.3	125.3	133.2	51.6	0	0	0	0	111.1
322	S	30.7	Very low	33.7	Very low	112 Å²	112	118 Å²	118	78%	0.783	76%	0.76	S	S	*	*			trans	-66.6	162	170.6	23	0	0	0	0	113
323	S	27.6	Very low	34.5	Very low	118 Å²	118	121.6 Å²	121.6	83%	0.825	78%	0.777	S	S	*	*			trans	85.7	108.1	160.5	63.8	0	0	0	0	119
324	S	28.3	Very low	36.2	Very low	118 Å²	118	118.1 Å²	118.1	83%	0.825	76%	0.755	S	S	*	*				-173.4	123.5	96.8	56.2	0	0	0	0	111.4	S326	S324-S326 PolarHBondContact O-N 3.37Å
325	N	31.1	Very low	38.3	Very low	152 Å²	152	116 Å²	116	81%	0.813	74%	0.744	S	S	*	*			trans	-52.1	121.8	171.4	-74.6	-29.3	0	0	0	112.3
326	S	27.7	Very low	40.7	Very low	108 Å²	108	115.4 Å²	115.4	76%	0.755	73%	0.731	S	S	*	*			trans	-109.5	95.9	140.8	68.6	0	0	0	0	107.3	S324 V328	S324-S326 PolarHBondContact O-N 3.37Å; S326-V328 PolarHBondContact O-N 2.94Å
327	L	29	Very low	43.3	Very low	156 Å²	156	107.7 Å²	107.7	82%	0.817	69%	0.69	S	S	*	*			trans	-57.5	98.4	170.7	-81.6	148.8	0	0	0	108.8	S329	L327-S329 PolarHBondContact O-N 2.81Å
328	V	31.9	Very low	45.9	Very low	123 Å²	123	103.8 Å²	103.8	75%	0.745	66%	0.66	S	S	*	*			trans	-71.1	109.6	151.9	-177.8	0	0	0	0	104.2	S326	S326-V328 PolarHBondContact O-N 2.94Å
329	S	31.2	Very low	48.2	Very low	91 Å²	91	98.1 Å²	98.1	64%	0.636	62%	0.621	S	S	*	*			trans	-38.5	138.9	171.7	50.1	0	0	0	0	110.6	L327 A331	L327-S329 PolarHBondContact O-N 2.81Å; S329-A331 PolarHBondContact O-N 2.87Å
330	A	34	Very low	50.9	Low	109 Å²	109	94.6 Å²	94.6	90%	0.901	59%	0.592	S	S	*	*			trans	-48.2	92.6	169.2	0	0	0	0	0	109.3
331	A	40.1	Very low	53.4	Low	72 Å²	72	90.8 Å²	90.8	60%	0.595	57%	0.566	S	S	*	*			trans	-79.3	127.7	-176.7	0	0	0	0	0	106.2	S329 N333	S329-A331 PolarHBondContact O-N 2.87Å; A331-N333 PolarHBondContact O-N 3.48Å
332	E	47.4	Very low	56.2	Low	185 Å²	185	86.2 Å²	86.2	86%	0.864	54%	0.535	S	S	*	.			trans	-42.7	126.4	163.1	-67.2	174.4	159	0	0	108.2	P334	E332-P334 VanDerWaalsContact O-N 3.15Å
333	N	60.8	Low	59	Low	120 Å²	120	84.6 Å²	84.6	64%	0.642	51%	0.514	S	S	*	.	P	Polyproline II helix	trans	-51.8	126.6	-179.9	-77.1	-33.6	0	0	0	108.3	A331	A331-N333 PolarHBondContact O-N 3.48Å
334	P	72.1	Confident	61.9	Low	46 Å²	46	82.7 Å²	82.7	30%	0.299	49%	0.492	S	S	.	.	P	Polyproline II helix	trans	-58.6	138.4	-178.2	24.9	-33.3	0	0	0	108.4	R266 H269 E332	R266-P334 HydrophobicContact CB-CG 4.24Å; R266-P334 HydrophobicContact CG-CB 4.19Å; R266-P334 HydrophobicContact CG-CG 4.13Å; H269-P334 PolarHBondContact NE2-O 2.89Å; E332-P334 VanDerWaalsContact O-N 3.15Å
335	P	82.9	Confident	64.9	Low	76 Å²	76	77 Å²	77	49%	0.494	45%	0.452	S	S	.	.	P	Polyproline II helix	trans	-56.7	156.3	-177.4	24.7	-34.8	0	0	0	110.2	D229 R266 H269	D229-P335 WeakPolarHBondContact OD1-CG 3.26Å; R266-P335 WeakPolarHBondContact CD-O 3.32Å; R266-P335 PolarHBondContact NH1-O 3.38Å; H269-P335 PolarHBondContact NE2-O 3.01Å
336	Q	85.6	Confident	67.7	Low	97 Å²	97	69.9 Å²	69.9	45%	0.453	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-63.6	149.6	169.4	-75	-179.4	-23.5	0	0	109.7	M340	Q336-M340 HydrophobicContact CB-CB 4.17Å; Q336-M340 HydrophobicContact CB-SD 4.48Å
337	R	89.8	Confident	70.7	Confident	1 Å²	1	64.8 Å²	64.8	0%	0.004	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-64.8	149.9	170	-58.6	-67.1	179.9	165.1	6	108.8	L226 L228 D229 V233 E236 C264 R266 G339 M340	L226-R337 VanDerWaalsContact O-CZ 3.26Å; L226-R337 PolarHBondContact O-NH1 3.49Å; L226-R337 PolarHBondContact O-NH2 3.08Å; L228-R337 PolarHBondContact O-NH1 2.97Å; D229-R337 WeakPolarHBondContact O-CA 3.48Å; V233-R337 HydrophobicContact CG2-CB 3.68Å; V233-R337 HydrophobicContact CG2-CG 3.75Å; E236-R337 WeakPolarHBondContact OE1-CG 3.28Å; E236-R337 IonicContact OE1-CZ 2.75Å; E236-R337 IonicContact OE1-NE 3.73Å; E236-R337 PolarHBondContact OE1-NE 3.28Å; E236-R337 IonicContact OE1-NH2 2.89Å; E236-R337 PolarHBondContact OE1-NH2 3.25Å; E236-R337 IonicContact OE2-NH2 3.84Å; C264-R337 PolarHBondContact O-NH2 3.38Å; R266-R337 VanDerWaalsContact CZ-NE 3.27Å; R337-G339 PolarHBondContact O-N 2.94Å; R337-G339 VanDerWaalsContact O-N 3.15Å; R337-M340 HydrophobicContact CB-CG 4.1Å; R337-M340 HydrophobicContact CB-SD 4.21Å; R337-M340 HydrophobicContact CG-SD 4.32Å; R337-M340 WeakPolarHBondContact O-CB 3.27Å; R337-M340 PolarHBondContact O-N 2.95Å
338	L	87.6	Confident	73.5	Confident	25 Å²	25	57.4 Å²	57.4	13%	0.131	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-49.7	-45.4	-178.8	178.9	62.7	0	0	0	112.4	D229 L231 M340 C341 A411 Y619 C622	D229-L338 PolarHBondContact O-N 3Å; L231-L338 PolarHBondContact O-N 3.11Å; L338-M340 VanDerWaalsContact C-N 3.26Å; L338-M340 PolarHBondContact O-N 3.29Å; L338-C341 PolarHBondContact O-N 2.62Å; L338-A411 HydrophobicContact CD2-CB 4.09Å; L338-Y619 HydrophobicContact CD1-CD1 3.71Å; L338-Y619 HydrophobicContact CD1-CE1 4.48Å; L338-Y619 HydrophobicContact CD1-CG 4.2Å; L338-Y619 HydrophobicContact CD2-CD1 4.44Å; L338-Y619 HydrophobicContact CG-CD1 3.65Å; L338-Y619 HydrophobicContact CG-CE1 3.93Å; L338-Y619 HydrophobicContact CG-CG 4.45Å; L338-Y619 WeakPolarHBondContact O-CD1 3.47Å; L338-C622 VanDerWaalsContact CD1-SG 3.57Å
339	G	84.6	Confident	76.1	Confident	2 Å²	2	51.7 Å²	51.7	2%	0.021	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-62.5	-25.5	178.8	0	0	0	0	0	115.9	L231 D232 V233 R337 C341 A342 R617	L231-G339 PolarHBondContact O-N 3.21Å; L231-G339 VanDerWaalsContact O-N 3.09Å; D232-G339 WeakPolarHBondContact OD1-CA 3.49Å; V233-G339 CarbonylContact O-C 3.55Å; V233-G339 VanDerWaalsContact O-CA 3.22Å; V233-G339 WeakPolarHBondContact O-CA 3.49Å; R337-G339 PolarHBondContact O-N 2.94Å; R337-G339 VanDerWaalsContact O-N 3.15Å; G339-C341 VanDerWaalsContact C-N 3.31Å; G339-A342 WeakPolarHBondContact O-CB 3.47Å; G339-A342 PolarHBondContact O-N 2.89Å; G339-R617 PolarHBondContact O-NH2 3.41Å
340	M	85.8	Confident	78.1	Confident	41 Å²	41	48.2 Å²	48.2	20%	0.202	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-77.5	-22.4	179.5	-61.2	-178.7	70.9	0	0	111.9	V233 E236 H269 Q336 R337 L338 A342	V233-M340 WeakPolarHBondContact O-CG 3.26Å; V233-M340 PolarHBondContact O-N 3.48Å; E236-M340 HydrophobicContact CG-SD 4.29Å; H269-M340 HydrophobicContact CB-CE 3.64Å; H269-M340 HydrophobicContact CB-SD 4.21Å; Q336-M340 HydrophobicContact CB-CB 4.17Å; Q336-M340 HydrophobicContact CB-SD 4.48Å; R337-M340 HydrophobicContact CB-CG 4.1Å; R337-M340 HydrophobicContact CB-SD 4.21Å; R337-M340 HydrophobicContact CG-SD 4.32Å; R337-M340 WeakPolarHBondContact O-CB 3.27Å; R337-M340 PolarHBondContact O-N 2.95Å; L338-M340 VanDerWaalsContact C-N 3.26Å; L338-M340 PolarHBondContact O-N 3.29Å; M340-A342 VanDerWaalsContact C-N 3.28Å
341	C	84.6	Confident	79.9	Confident	36 Å²	36	46.1 Å²	46.1	24%	0.243	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-83.3	-9.2	172.7	-55.6	0	0	0	0	112	L338 G339 K343 P620	L338-C341 PolarHBondContact O-N 2.62Å; G339-C341 VanDerWaalsContact C-N 3.31Å; C341-K343 PolarHBondContact O-N 3.24Å; C341-P620 VanDerWaalsContact O-CD 3.3Å; C341-P620 WeakPolarHBondContact O-CD 3.37Å
342	A	87.5	Confident	81.3	Confident	22 Å²	22	43.3 Å²	43.3	18%	0.182	23%	0.23	C	C	.	.			trans	-66.6	134.7	-175.4	0	0	0	0	0	111.1	G339 M340 R617 V618 Y619	G339-A342 WeakPolarHBondContact O-CB 3.47Å; G339-A342 PolarHBondContact O-N 2.89Å; M340-A342 VanDerWaalsContact C-N 3.28Å; A342-R617 HydrophobicContact CB-CG 3.97Å; A342-V618 CarbonylContact C-O 3.44Å; A342-V618 VanDerWaalsContact CA-O 3.26Å; A342-V618 WeakPolarHBondContact CA-O 3.26Å; A342-Y619 HydrophobicContact CB-CD1 3.83Å; A342-Y619 HydrophobicContact CB-CE1 3.66Å
343	K	88.7	Confident	82.2	Confident	79 Å²	79	39.3 Å²	39.3	34%	0.343	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	146.7	175.6	-71	-173	170.3	-166.4	0	109.6	C341 M345 D360 D365 R617 V618 P620	C341-K343 PolarHBondContact O-N 3.24Å; K343-M345 HydrophobicContact CB-CG 3.83Å; K343-M345 HydrophobicContact CB-SD 4.12Å; K343-D360 IonicContact NZ-OD2 2.88Å; K343-D360 PolarHBondContact NZ-OD2 2.89Å; K343-D365 IonicContact NZ-OD2 2.87Å; K343-R617 WeakPolarHBondContact O-CA 3.14Å; K343-V618 PolarHBondContact N-O 3.02Å; K343-V618 PolarHBondContact O-N 2.72Å; K343-P620 HydrophobicContact CB-CG 4.34Å; K343-P620 HydrophobicContact CD-CG 4.12Å; K343-P620 HydrophobicContact CG-CG 4.24Å
344	E	89.6	Confident	82.9	Confident	77 Å²	77	36 Å²	36	36%	0.36	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	126.4	163.5	-167.2	170.3	179.3	0	0	108.5	H564 G565 S615	E344-H564 PolarHBondContact O-CE1 2.83Å; E344-H564 VanDerWaalsContact O-CE1 3.22Å; E344-G565 PolarHBondContact OE1-N 3.36Å; E344-G565 WeakPolarHBondContact OE2-CA 3.18Å; E344-G565 PolarHBondContact OE2-N 3.41Å; E344-S615 VanDerWaalsContact CD-OG 3.32Å; E344-S615 WeakPolarHBondContact CG-OG 3.49Å; E344-S615 PolarHBondContact OE1-OG 3.25Å
345	M	91.1	Very high	83.2	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	155.6	-173.1	-60.3	-177.3	67.9	0	0	110.4	K343 C358 C359 D360 Y367 S615 A616 V618 P620	K343-M345 HydrophobicContact CB-CG 3.83Å; K343-M345 HydrophobicContact CB-SD 4.12Å; M345-C358 WeakPolarHBondContact CB-SG 3.48Å; M345-C359 WeakPolarHBondContact CB-O 3.31Å; M345-D360 HydrophobicContact CE-CB 3.99Å; M345-D360 VanDerWaalsContact CE-N 3.3Å; M345-Y367 HydrophobicContact CE-CD2 3.48Å; M345-Y367 VanDerWaalsContact CE-CD2 3.48Å; M345-Y367 HydrophobicContact CE-CE2 3.75Å; M345-Y367 HydrophobicContact SD-CD2 4.43Å; M345-S615 WeakPolarHBondContact O-CA 3.47Å; M345-A616 PolarHBondContact N-O 3.41Å; M345-A616 PolarHBondContact O-N 2.97Å; M345-V618 HydrophobicContact CB-CG2 3.64Å; M345-V618 HydrophobicContact CG-CG2 3.55Å; M345-V618 HydrophobicContact SD-CG2 3.27Å; M345-V618 WeakPolarHBondContact SD-CG2 2.93Å; M345-P620 HydrophobicContact SD-CG 3.95Å
346	V	90.8	Very high	83.3	Confident	1 Å²	1	32 Å²	32	1%	0.006	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	123.9	178.2	-176.6	0	0	0	0	109.3	F348 C358 C359 P361 I562 I571 C613 L614	V346-F348 HydrophobicContact CB-CE2 3.97Å; V346-F348 HydrophobicContact CB-CZ 4.48Å; V346-F348 HydrophobicContact CG1-CD2 4.16Å; V346-F348 HydrophobicContact CG1-CE2 3.55Å; V346-F348 HydrophobicContact CG1-CZ 3.78Å; V346-C358 CarbonylContact O-C 3.49Å; V346-C358 WeakPolarHBondContact O-CA 3.4Å; V346-C359 PolarHBondContact N-O 2.96Å; V346-C359 PolarHBondContact O-N 3.47Å; V346-P361 HydrophobicContact CG2-CB 4.47Å; V346-P361 HydrophobicContact CG2-CG 4.23Å; V346-I562 HydrophobicContact CB-CD1 4.35Å; V346-I562 HydrophobicContact CG1-CD1 3.74Å; V346-I562 HydrophobicContact CG2-CD1 3.71Å; V346-I571 HydrophobicContact CG1-CD1 3.7Å; V346-I571 HydrophobicContact CG2-CD1 4.4Å; V346-C613 HydrophobicContact CG1-CB 3.93Å; V346-L614 WeakPolarHBondContact CA-O 3.44Å
347	I	90.3	Very high	83.4	Confident	1 Å²	1	27.8 Å²	27.8	1%	0.005	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	126.7	175.2	-55.2	173.2	0	0	0	109	F349 F356 L357 C358 I395 C613 L614 A616 V618	I347-F349 HydrophobicContact CB-CE2 3.79Å; I347-F349 HydrophobicContact CB-CZ 4.24Å; I347-F349 HydrophobicContact CG2-CD2 4.02Å; I347-F349 HydrophobicContact CG2-CE1 4.26Å; I347-F349 HydrophobicContact CG2-CE2 3.41Å; I347-F349 VanDerWaalsContact CG2-CE2 3.41Å; I347-F349 HydrophobicContact CG2-CZ 3.57Å; I347-F356 HydrophobicContact CG2-CB 4.32Å; I347-L357 CarbonylContact C-O 3.6Å; I347-L357 WeakPolarHBondContact CA-O 3.32Å; I347-C358 HydrophobicContact CG1-CB 4.13Å; I347-I395 HydrophobicContact CD1-CD1 3.33Å; I347-C613 WeakPolarHBondContact O-CA 2.98Å; I347-C613 WeakPolarHBondContact O-CB 3.44Å; I347-L614 HydrophobicContact CB-CD1 4.23Å; I347-L614 HydrophobicContact CD1-CD1 4.2Å; I347-L614 HydrophobicContact CG1-CD1 4.5Å; I347-L614 PolarHBondContact N-O 3.09Å; I347-L614 PolarHBondContact O-N 3.41Å; I347-L614 VanDerWaalsContact O-N 3.17Å; I347-A616 HydrophobicContact CD1-CB 3.84Å; I347-V618 HydrophobicContact CD1-CG1 3.93Å
348	F	87.5	Confident	83.3	Confident	1 Å²	1	27.8 Å²	27.8	0%	0.004	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	120.5	176.5	-64.9	-97.9	0	0	0	109.3	V346 L357 C359 I571 V583 L602 L604 F607 F611 C613	V346-F348 HydrophobicContact CB-CE2 3.97Å; V346-F348 HydrophobicContact CB-CZ 4.48Å; V346-F348 HydrophobicContact CG1-CD2 4.16Å; V346-F348 HydrophobicContact CG1-CE2 3.55Å; V346-F348 HydrophobicContact CG1-CZ 3.78Å; F348-L357 PolarHBondContact N-O 3.3Å; F348-L357 PolarHBondContact O-N 3.19Å; F348-C359 WeakPolarHBondContact CE2-SG 3.4Å; F348-I571 HydrophobicContact CE1-CG2 3.94Å; F348-I571 HydrophobicContact CZ-CD1 4.28Å; F348-I571 HydrophobicContact CZ-CG2 4.32Å; F348-V583 HydrophobicContact CE1-CG1 4.16Å; F348-V583 HydrophobicContact CZ-CG1 4.44Å; F348-L602 HydrophobicContact CE2-CD1 4.39Å; F348-L602 HydrophobicContact CZ-CD1 4.01Å; F348-L604 HydrophobicContact CD1-CD1 4.29Å; F348-L604 HydrophobicContact CG-CD1 4.42Å; F348-F607 HydrophobicContact CB-CD1 4.48Å; F348-F607 HydrophobicContact CB-CE1 3.53Å; F348-F607 HydrophobicContact CB-CE2 4.24Å; F348-F607 HydrophobicContact CB-CZ 3.4Å; F348-F607 VanDerWaalsContact CB-CZ 3.4Å; F348-F607 HydrophobicContact CG-CZ 4.49Å; F348-F611 AromaticContact CD1-CD2 3.77Å; F348-F611 HydrophobicContact CD1-CD2 3.77Å; F348-F611 AromaticContact CD1-CE2 3.69Å; F348-F611 HydrophobicContact CD1-CE2 3.69Å; F348-F611 HydrophobicContact CD1-CG 4.44Å; F348-F611 HydrophobicContact CD1-CZ 4.25Å; F348-F611 HydrophobicContact CE1-CD2 4.3Å; F348-F611 AromaticContact CE1-CE2 3.73Å; F348-F611 HydrophobicContact CE1-CE2 3.73Å; F348-F611 HydrophobicContact CE1-CZ 4.1Å; F348-C613 HydrophobicContact CD1-CB 4.17Å; F348-C613 HydrophobicContact CE1-CB 4.35Å
349	F	85.2	Confident	83.3	Confident	4 Å²	4	26.7 Å²	26.7	2%	0.018	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	112.8	177.1	-64.1	-96.3	0	0	0	109.1	I347 F356 L385 V387 I395 L397 F612 L614	I347-F349 HydrophobicContact CB-CE2 3.79Å; I347-F349 HydrophobicContact CB-CZ 4.24Å; I347-F349 HydrophobicContact CG2-CD2 4.02Å; I347-F349 HydrophobicContact CG2-CE1 4.26Å; I347-F349 HydrophobicContact CG2-CE2 3.41Å; I347-F349 VanDerWaalsContact CG2-CE2 3.41Å; I347-F349 HydrophobicContact CG2-CZ 3.57Å; F349-F356 HydrophobicContact CB-CD1 4.23Å; F349-F356 HydrophobicContact CB-CE1 4.39Å; F349-F356 HydrophobicContact CD1-CB 4.49Å; F349-F356 AromaticContact CD1-CD1 3.74Å; F349-F356 HydrophobicContact CD1-CD1 3.74Å; F349-F356 AromaticContact CD1-CD2 3.79Å; F349-F356 HydrophobicContact CD1-CD2 3.79Å; F349-F356 AromaticContact CD1-CE1 3.8Å; F349-F356 HydrophobicContact CD1-CE1 3.8Å; F349-F356 AromaticContact CD1-CE2 3.84Å; F349-F356 HydrophobicContact CD1-CE2 3.84Å; F349-F356 AromaticContact CD1-CG 3.73Å; F349-F356 HydrophobicContact CD1-CG 3.73Å; F349-F356 AromaticContact CD1-CZ 3.85Å; F349-F356 HydrophobicContact CD1-CZ 3.85Å; F349-F356 AromaticContact CE1-CD2 3.79Å; F349-F356 HydrophobicContact CE1-CD2 3.79Å; F349-F356 AromaticContact CE1-CE2 3.94Å; F349-F356 HydrophobicContact CE1-CE2 3.94Å; F349-F356 HydrophobicContact CE1-CG 4.11Å; F349-F356 HydrophobicContact CE1-CZ 4.39Å; F349-F356 HydrophobicContact CG-CD1 4.3Å; F349-F356 HydrophobicContact CG-CG 4.48Å; F349-L385 HydrophobicContact CB-CD1 4.46Å; F349-V387 HydrophobicContact CD1-CG2 4.24Å; F349-V387 HydrophobicContact CE1-CG1 4.3Å; F349-V387 HydrophobicContact CE1-CG2 4.14Å; F349-V387 HydrophobicContact CE2-CG1 4.34Å; F349-V387 HydrophobicContact CZ-CG1 3.91Å; F349-V387 HydrophobicContact CZ-CG2 4.42Å; F349-I395 HydrophobicContact CZ-CG2 4.19Å; F349-L397 HydrophobicContact CD1-CD1 4.3Å; F349-L397 HydrophobicContact CE1-CD1 4.19Å; F349-F612 HydrophobicContact CB-CD1 3.75Å; F349-F612 HydrophobicContact CB-CD2 3.89Å; F349-F612 HydrophobicContact CB-CE1 3.16Å; F349-F612 HydrophobicContact CB-CE2 3.32Å; F349-F612 HydrophobicContact CB-CG 4.09Å; F349-F612 HydrophobicContact CB-CZ 2.94Å; F349-F612 AromaticContact CD1-CE2 3.98Å; F349-F612 HydrophobicContact CD1-CE2 3.98Å; F349-F612 AromaticContact CD1-CZ 3.74Å; F349-F612 HydrophobicContact CD1-CZ 3.74Å; F349-F612 AromaticContact CD2-CD2 3.76Å; F349-F612 HydrophobicContact CD2-CD2 3.76Å; F349-F612 AromaticContact CD2-CE2 3.21Å; F349-F612 HydrophobicContact CD2-CE2 3.21Å; F349-F612 AromaticContact CD2-CZ 3.76Å; F349-F612 HydrophobicContact CD2-CZ 3.76Å; F349-F612 AromaticContact CE2-CE2 3.99Å; F349-F612 HydrophobicContact CE2-CE2 3.99Å; F349-F612 HydrophobicContact CG-CD2 4.05Å; F349-F612 AromaticContact CG-CE1 3.98Å; F349-F612 HydrophobicContact CG-CE1 3.98Å; F349-F612 AromaticContact CG-CE2 3.22Å; F349-F612 HydrophobicContact CG-CE2 3.22Å; F349-F612 AromaticContact CG-CZ 3.21Å; F349-F612 HydrophobicContact CG-CZ 3.21Å; F349-F612 PolarHBondContact N-O 3.01Å; F349-F612 PolarHBondContact O-N 3.47Å; F349-L614 HydrophobicContact CD2-CD2 4.3Å; F349-L614 HydrophobicContact CE2-CD1 4.13Å; F349-L614 HydrophobicContact CE2-CD2 3.43Å; F349-L614 VanDerWaalsContact CE2-CD2 3.43Å; F349-L614 HydrophobicContact CE2-CG 3.64Å; F349-L614 HydrophobicContact CZ-CD2 3.93Å; F349-L614 HydrophobicContact CZ-CG 4.4Å
350	G	74.3	Confident	83.4	Confident	17 Å²	17	27.5 Å²	27.5	18%	0.175	14%	0.142	C	C	.	.			trans	-108.3	-145.8	-172.6	0	0	0	0	0	111.5
351	H	72.6	Confident	83.4	Confident	65 Å²	65	26.2 Å²	26.2	30%	0.301	14%	0.137	S	C	.	.			trans	-60.3	133.1	177.5	-169.4	-87.1	0	0	0	110.1	R353 D354 D608	H351-R353 PolarHBondContact ND1-N 3.04Å; H351-R353 PolarHBondContact O-N 3.19Å; H351-D354 PolarHBondContact O-N 3.35Å; H351-D608 IonicContact CD2-OD2 3.86Å
352	P	68.3	Low	83.4	Confident	14 Å²	14	30.1 Å²	30.1	9%	0.091	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-13.4	-173.2	-28.3	34.7	0	0	0	116.3	S371 L373 V382	P352-S371 PolarHBondContact O-OG 2.96Å; P352-L373 HydrophobicContact CB-CB 4.41Å; P352-L373 HydrophobicContact CB-CD1 3.96Å; P352-L373 WeakPolarHBondContact O-CB 3.24Å; P352-V382 HydrophobicContact CB-CB 4.24Å; P352-V382 HydrophobicContact CB-CG1 4.08Å; P352-V382 HydrophobicContact CG-CB 4.16Å; P352-V382 HydrophobicContact CG-CG1 3.74Å
353	R	67.4	Low	83.2	Confident	101 Å²	101	32 Å²	32	38%	0.381	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-24.6	-179.6	-64.6	-170.1	173.1	144.7	2	113.7	H351 A377	H351-R353 PolarHBondContact ND1-N 3.04Å; H351-R353 PolarHBondContact O-N 3.19Å; R353-A377 HydrophobicContact CB-CB 4.35Å; R353-A377 HydrophobicContact CG-CB 3.72Å; R353-A377 PolarHBondContact NE-O 3.48Å; R353-A377 PolarHBondContact NH2-O 3.04Å
354	D	73.9	Confident	82.6	Confident	50 Å²	50	30.6 Å²	30.6	27%	0.267	17%	0.167	S	C	.	.	S	Bend	trans	-93	152.3	-177.1	-65.7	-65.2	0	0	0	110.3	H351 S371 Q606	H351-D354 PolarHBondContact O-N 3.35Å; D354-S371 WeakPolarHBondContact O-CB 3.45Å; D354-Q606 PolarHBondContact OD1-NE2 3.43Å
355	P	78.8	Confident	82.3	Confident	38 Å²	38	30.1 Å²	30.1	25%	0.247	17%	0.167	C	C	.	.	P	Polyproline II helix	trans	-59.8	146.5	168	27.6	-34	0	0	0	109.6	K368	P355-K368 HydrophobicContact CG-CD 4.46Å
356	F	86.3	Confident	82	Confident	1 Å²	1	31.5 Å²	31.5	0%	0.004	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	152.7	172.9	-51.6	-48	0	0	0	109.3	I347 F349 V369 L385 L397 W415	I347-F356 HydrophobicContact CG2-CB 4.32Å; F349-F356 HydrophobicContact CB-CD1 4.23Å; F349-F356 HydrophobicContact CB-CE1 4.39Å; F349-F356 HydrophobicContact CD1-CB 4.49Å; F349-F356 AromaticContact CD1-CD1 3.74Å; F349-F356 HydrophobicContact CD1-CD1 3.74Å; F349-F356 AromaticContact CD1-CD2 3.79Å; F349-F356 HydrophobicContact CD1-CD2 3.79Å; F349-F356 AromaticContact CD1-CE1 3.8Å; F349-F356 HydrophobicContact CD1-CE1 3.8Å; F349-F356 AromaticContact CD1-CE2 3.84Å; F349-F356 HydrophobicContact CD1-CE2 3.84Å; F349-F356 AromaticContact CD1-CG 3.73Å; F349-F356 HydrophobicContact CD1-CG 3.73Å; F349-F356 AromaticContact CD1-CZ 3.85Å; F349-F356 HydrophobicContact CD1-CZ 3.85Å; F349-F356 AromaticContact CE1-CD2 3.79Å; F349-F356 HydrophobicContact CE1-CD2 3.79Å; F349-F356 AromaticContact CE1-CE2 3.94Å; F349-F356 HydrophobicContact CE1-CE2 3.94Å; F349-F356 HydrophobicContact CE1-CG 4.11Å; F349-F356 HydrophobicContact CE1-CZ 4.39Å; F349-F356 HydrophobicContact CG-CD1 4.3Å; F349-F356 HydrophobicContact CG-CG 4.48Å; F356-V369 HydrophobicContact CB-CB 4.15Å; F356-V369 HydrophobicContact CD2-CG1 4.48Å; F356-V369 PolarHBondContact N-O 2.7Å; F356-V369 PolarHBondContact O-N 2.78Å; F356-L385 HydrophobicContact CE1-CD1 3.9Å; F356-L385 HydrophobicContact CZ-CD1 3.95Å; F356-L397 HydrophobicContact CE2-CD1 3.71Å; F356-L397 HydrophobicContact CZ-CD1 3.69Å; F356-W415 HydrophobicContact CD2-CZ2 4.11Å; F356-W415 HydrophobicContact CE2-CH2 4.44Å; F356-W415 AromaticContact CE2-CZ2 3.84Å; F356-W415 HydrophobicContact CE2-CZ2 3.84Å
357	L	86.1	Confident	81.9	Confident	8 Å²	8	33.4 Å²	33.4	4%	0.042	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	142.7	177.8	-63.9	-173.2	0	0	0	110.2	I347 F348 L366 Y367 K368 L604 F607	I347-L357 CarbonylContact C-O 3.6Å; I347-L357 WeakPolarHBondContact CA-O 3.32Å; F348-L357 PolarHBondContact N-O 3.3Å; F348-L357 PolarHBondContact O-N 3.19Å; L357-L366 HydrophobicContact CB-CD1 4.12Å; L357-L366 HydrophobicContact CD1-CD1 4.21Å; L357-L366 HydrophobicContact CD1-CD2 4.42Å; L357-Y367 WeakPolarHBondContact CA-O 3.31Å; L357-K368 HydrophobicContact CD2-CG 3.92Å; L357-L604 HydrophobicContact CD1-CD2 3.46Å; L357-L604 VanDerWaalsContact CD1-CD2 3.46Å; L357-F607 HydrophobicContact CB-CE2 4.32Å; L357-F607 HydrophobicContact CB-CZ 4.07Å; L357-F607 HydrophobicContact CD1-CE2 3.56Å; L357-F607 HydrophobicContact CD1-CZ 4.11Å; L357-F607 HydrophobicContact CG-CE2 3.97Å; L357-F607 HydrophobicContact CG-CZ 4Å
358	C	88.3	Confident	81.7	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	127.9	176.1	-175.8	0	0	0	0	108.4	M345 V346 I347 Y367 V369 L623	M345-C358 WeakPolarHBondContact CB-SG 3.48Å; V346-C358 CarbonylContact O-C 3.49Å; V346-C358 WeakPolarHBondContact O-CA 3.4Å; I347-C358 HydrophobicContact CG1-CB 4.13Å; C358-Y367 PolarHBondContact N-O 2.93Å; C358-Y367 PolarHBondContact O-N 3.46Å; C358-V369 HydrophobicContact CB-CG2 3.89Å; C358-L623 HydrophobicContact CB-CD1 4.42Å
359	C	87.3	Confident	81.7	Confident	3 Å²	3	36.7 Å²	36.7	2%	0.02	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	149.7	179.5	83.8	0	0	0	0	113.4	M345 V346 F348 D365 L366 L602	M345-C359 WeakPolarHBondContact CB-O 3.31Å; V346-C359 PolarHBondContact N-O 2.96Å; V346-C359 PolarHBondContact O-N 3.47Å; F348-C359 WeakPolarHBondContact CE2-SG 3.4Å; C359-D365 WeakPolarHBondContact CA-O 3.48Å; C359-L366 HydrophobicContact CB-CD1 3.97Å; C359-L602 HydrophobicContact CB-CD2 4.34Å
360	D	87.9	Confident	81.7	Confident	18 Å²	18	39.1 Å²	39.1	10%	0.096	21%	0.212	C	C	.	.			trans	-85.4	114.5	168.8	-177.1	-29.3	0	0	0	106.5	K343 M345 Y362 S363 G364 D365	K343-D360 IonicContact NZ-OD2 2.88Å; K343-D360 PolarHBondContact NZ-OD2 2.89Å; M345-D360 HydrophobicContact CE-CB 3.99Å; M345-D360 VanDerWaalsContact CE-N 3.3Å; D360-Y362 PolarHBondContact O-N 2.84Å; D360-Y362 VanDerWaalsContact O-N 3.17Å; D360-Y362 PolarHBondContact OD1-N 3.43Å; D360-S363 WeakPolarHBondContact CB-OG 3.29Å; D360-S363 PolarHBondContact OD1-N 2.86Å; D360-S363 PolarHBondContact OD2-OG 3.49Å; D360-G364 WeakPolarHBondContact O-CA 3.39Å; D360-G364 PolarHBondContact O-N 3.22Å; D360-D365 HydrophobicContact CB-CB 4.32Å; D360-D365 PolarHBondContact N-O 3.37Å
361	P	84	Confident	82.2	Confident	15 Å²	15	38.8 Å²	38.8	10%	0.097	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-15.7	-174.5	26.7	-33	0	0	0	113.3	V346 L569 I598	V346-P361 HydrophobicContact CG2-CB 4.47Å; V346-P361 HydrophobicContact CG2-CG 4.23Å; P361-L569 HydrophobicContact CB-CD1 4.29Å; P361-L569 HydrophobicContact CG-CD1 4.19Å; P361-I598 HydrophobicContact CB-CD1 4.31Å
362	Y	85.1	Confident	82.8	Confident	117 Å²	117	36.5 Å²	36.5	46%	0.459	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.8	-46.1	-177.4	-60.6	-76.6	0	0	0	112.5	D360 H564 E587 I598	D360-Y362 PolarHBondContact O-N 2.84Å; D360-Y362 VanDerWaalsContact O-N 3.17Å; D360-Y362 PolarHBondContact OD1-N 3.43Å; Y362-H564 AromaticContact CE2-CD2 3.93Å; Y362-H564 AromaticContact CE2-NE2 3.83Å; Y362-E587 WeakPolarHBondContact CE1-OE2 3.32Å; Y362-E587 PolarHBondContact OH-OE2 2.94Å; Y362-I598 HydrophobicContact CD1-CD1 4.24Å; Y362-I598 HydrophobicContact CE1-CD1 3.87Å
363	S	82.8	Confident	83.2	Confident	62 Å²	62	36 Å²	36	43%	0.434	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-23.8	177.4	71.5	0	0	0	0	113	D360 D365	D360-S363 WeakPolarHBondContact CB-OG 3.29Å; D360-S363 PolarHBondContact OD1-N 2.86Å; D360-S363 PolarHBondContact OD2-OG 3.49Å; S363-D365 WeakPolarHBondContact CB-OD2 3.44Å; S363-D365 WeakPolarHBondContact OG-CB 3.3Å; S363-D365 PolarHBondContact OG-N 2.99Å; S363-D365 PolarHBondContact OG-OD2 2.92Å
364	G	77.7	Confident	83.4	Confident	49 Å²	49	34.1 Å²	34.1	51%	0.505	20%	0.195	S	C	.	.			trans	77.5	6.3	-172.6	0	0	0	0	0	113.9	D360 L366	D360-G364 WeakPolarHBondContact O-CA 3.39Å; D360-G364 PolarHBondContact O-N 3.22Å; G364-L366 PolarHBondContact O-N 3.17Å
365	D	83.1	Confident	82.7	Confident	67 Å²	67	37.5 Å²	37.5	36%	0.358	22%	0.221	S	C	.	.			trans	-62.5	134.2	177.8	-63.2	-38.9	0	0	0	110.4	K343 C359 D360 S363 Y367	K343-D365 IonicContact NZ-OD2 2.87Å; C359-D365 WeakPolarHBondContact CA-O 3.48Å; D360-D365 HydrophobicContact CB-CB 4.32Å; D360-D365 PolarHBondContact N-O 3.37Å; S363-D365 WeakPolarHBondContact CB-OD2 3.44Å; S363-D365 WeakPolarHBondContact OG-CB 3.3Å; S363-D365 PolarHBondContact OG-N 2.99Å; S363-D365 PolarHBondContact OG-OD2 2.92Å; D365-Y367 HydrophobicContact CB-CE2 3.68Å
366	L	84.9	Confident	81.9	Confident	29 Å²	29	38.7 Å²	38.7	15%	0.152	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	137.9	-176.3	-171.5	70	0	0	0	110.8	L357 C359 G364 L602 G626	L357-L366 HydrophobicContact CB-CD1 4.12Å; L357-L366 HydrophobicContact CD1-CD1 4.21Å; L357-L366 HydrophobicContact CD1-CD2 4.42Å; C359-L366 HydrophobicContact CB-CD1 3.97Å; G364-L366 PolarHBondContact O-N 3.17Å; L366-L602 HydrophobicContact CD1-CD2 4.49Å; L366-G626 WeakPolarHBondContact O-CA 3.45Å; L366-G626 PolarHBondContact O-N 2.83Å
367	Y	87.2	Confident	80.3	Confident	42 Å²	42	39.8 Å²	39.8	17%	0.165	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	156.2	177.5	-60.2	-93.6	0	0	0	110.5	M345 L357 C358 D365 P620 L623 E624	M345-Y367 HydrophobicContact CE-CD2 3.48Å; M345-Y367 VanDerWaalsContact CE-CD2 3.48Å; M345-Y367 HydrophobicContact CE-CE2 3.75Å; M345-Y367 HydrophobicContact SD-CD2 4.43Å; L357-Y367 WeakPolarHBondContact CA-O 3.31Å; C358-Y367 PolarHBondContact N-O 2.93Å; C358-Y367 PolarHBondContact O-N 3.46Å; D365-Y367 HydrophobicContact CB-CE2 3.68Å; Y367-P620 HydrophobicContact CE1-CB 3.92Å; Y367-P620 HydrophobicContact CE2-CB 4.28Å; Y367-L623 HydrophobicContact CD1-CB 3.88Å; Y367-L623 HydrophobicContact CG-CB 4.16Å; Y367-L623 HydrophobicContact CG-CD1 4.23Å; Y367-E624 CarbonylContact C-O 3.55Å; Y367-E624 WeakPolarHBondContact CA-O 3.12Å
368	K	87.3	Confident	78.7	Confident	69 Å²	69	48 Å²	48	30%	0.3	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	135.4	174.8	-65.1	179.6	-177.8	174.8	0	110.2	P355 L357 E624	P355-K368 HydrophobicContact CG-CD 4.46Å; L357-K368 HydrophobicContact CD2-CG 3.92Å; K368-E624 HydrophobicContact CB-CB 4.45Å; K368-E624 PolarHBondContact N-O 2.95Å
369	V	87.4	Confident	77	Confident	2 Å²	2	52 Å²	52	1%	0.012	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	126.3	170.2	176.3	0	0	0	0	106.9	F356 C358 Y408 L623	F356-V369 HydrophobicContact CB-CB 4.15Å; F356-V369 HydrophobicContact CD2-CG1 4.48Å; F356-V369 PolarHBondContact N-O 2.7Å; F356-V369 PolarHBondContact O-N 2.78Å; C358-V369 HydrophobicContact CB-CG2 3.89Å; V369-Y408 HydrophobicContact CG1-CE1 4.02Å; V369-Y408 HydrophobicContact CG1-CE2 3.99Å; V369-L623 HydrophobicContact CG2-CD1 4.47Å; V369-L623 HydrophobicContact CG2-CD2 3.98Å
370	P	85.4	Confident	75.5	Confident	54 Å²	54	62.3 Å²	62.3	35%	0.351	34%	0.335	S	S	.	.			trans	-58.9	143.4	179.5	24.9	-33.2	0	0	0	109.8	Y408 N413 W415	P370-Y408 HydrophobicContact CG-CE2 4.4Å; P370-N413 WeakPolarHBondContact CD-OD1 3.43Å; P370-N413 WeakPolarHBondContact CG-OD1 3.16Å; P370-W415 PolarHBondContact O-NE1 3.22Å
371	S	85.3	Confident	74.5	Confident	11 Å²	11	64.2 Å²	64.2	8%	0.077	35%	0.347	C	S	.	.			trans	-95.6	129.8	171.7	166.4	0	0	0	0	109.1	P352 D354 L373 T374	P352-S371 PolarHBondContact O-OG 2.96Å; D354-S371 WeakPolarHBondContact O-CB 3.45Å; S371-L373 PolarHBondContact O-N 2.93Å; S371-L373 VanDerWaalsContact O-N 3.14Å; S371-L373 PolarHBondContact OG-N 3.23Å; S371-T374 WeakPolarHBondContact CB-OG1 3.45Å; S371-T374 PolarHBondContact O-N 3.43Å; S371-T374 PolarHBondContact O-OG1 3.26Å
372	P	83.6	Confident	74.1	Confident	17 Å²	17	64.8 Å²	64.8	11%	0.11	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-12.2	176.1	29.6	-30.8	0	0	0	111.5	W406 W415	P372-W406 HydrophobicContact CB-CD2 3.81Å; P372-W406 HydrophobicContact CB-CE3 3.79Å; P372-W406 HydrophobicContact CB-CG 4.23Å; P372-W406 HydrophobicContact CB-CZ3 4.2Å; P372-W406 HydrophobicContact CG-CB 4.4Å; P372-W406 HydrophobicContact CG-CD2 4.26Å; P372-W406 HydrophobicContact CG-CG 4.15Å; P372-W415 HydrophobicContact CB-CB 3.87Å; P372-W415 HydrophobicContact CB-CD2 4.06Å; P372-W415 HydrophobicContact CB-CG 3.77Å; P372-W415 HydrophobicContact CG-CB 4.45Å; P372-W415 HydrophobicContact CG-CD2 3.65Å; P372-W415 HydrophobicContact CG-CE3 3.91Å; P372-W415 HydrophobicContact CG-CG 3.91Å; P372-W415 HydrophobicContact CG-CZ2 4.43Å; P372-W415 HydrophobicContact CG-CZ3 4.4Å
373	L	78.1	Confident	73.5	Confident	4 Å²	4	63.4 Å²	63.4	2%	0.021	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-10.2	-175.3	-52.5	179.7	0	0	0	112.9	P352 S371 C375 L376 A377 V382 L385 L397 A399	P352-L373 HydrophobicContact CB-CB 4.41Å; P352-L373 HydrophobicContact CB-CD1 3.96Å; P352-L373 WeakPolarHBondContact O-CB 3.24Å; S371-L373 PolarHBondContact O-N 2.93Å; S371-L373 VanDerWaalsContact O-N 3.14Å; S371-L373 PolarHBondContact OG-N 3.23Å; L373-C375 VanDerWaalsContact C-N 3.31Å; L373-C375 PolarHBondContact O-N 2.88Å; L373-L376 HydrophobicContact CD2-CD1 3.99Å; L373-L376 CarbonylContact O-C 3.53Å; L373-L376 WeakPolarHBondContact O-CA 3.16Å; L373-L376 WeakPolarHBondContact O-CB 3.4Å; L373-L376 PolarHBondContact O-N 2.7Å; L373-A377 PolarHBondContact O-N 3.04Å; L373-V382 HydrophobicContact CD1-CG1 4.19Å; L373-L385 HydrophobicContact CD1-CD2 3.44Å; L373-L385 VanDerWaalsContact CD1-CD2 3.44Å; L373-L397 HydrophobicContact CD1-CD2 4.38Å; L373-A399 HydrophobicContact CD1-CB 4.16Å; L373-A399 HydrophobicContact CD2-CB 4.14Å
374	T	70.8	Confident	73.3	Confident	61 Å²	61	63.6 Å²	63.6	37%	0.374	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-39	179.9	-54.9	0	0	0	0	111.9	S371 L376 A377	S371-T374 WeakPolarHBondContact CB-OG1 3.45Å; S371-T374 PolarHBondContact O-N 3.43Å; S371-T374 PolarHBondContact O-OG1 3.26Å; T374-L376 VanDerWaalsContact C-N 3.28Å; T374-L376 PolarHBondContact O-N 3Å; T374-A377 WeakPolarHBondContact O-CB 2.92Å; T374-A377 PolarHBondContact O-N 2.9Å
375	C	60.1	Low	73.7	Confident	121 Å²	121	62 Å²	62	82%	0.818	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-25.4	174.8	-62.3	0	0	0	0	112.9	L373	L373-C375 VanDerWaalsContact C-N 3.31Å; L373-C375 PolarHBondContact O-N 2.88Å
376	L	60.7	Low	74	Confident	63 Å²	63	59 Å²	59	33%	0.33	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89	-5.1	-179.1	-62.6	168	0	0	0	112.8	L373 T374 H378 T379 W406	L373-L376 HydrophobicContact CD2-CD1 3.99Å; L373-L376 CarbonylContact O-C 3.53Å; L373-L376 WeakPolarHBondContact O-CA 3.16Å; L373-L376 WeakPolarHBondContact O-CB 3.4Å; L373-L376 PolarHBondContact O-N 2.7Å; T374-L376 VanDerWaalsContact C-N 3.28Å; T374-L376 PolarHBondContact O-N 3Å; L376-H378 PolarHBondContact O-N 2.5Å; L376-T379 PolarHBondContact O-N 2.95Å; L376-T379 PolarHBondContact O-OG1 2.93Å; L376-W406 HydrophobicContact CD1-CZ2 4.28Å
377	A	52.3	Low	74.4	Confident	23 Å²	23	58.7 Å²	58.7	19%	0.19	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-61	-11.8	-170.8	0	0	0	0	0	116.6	R353 L373 T374 T379	R353-A377 HydrophobicContact CB-CB 4.35Å; R353-A377 HydrophobicContact CG-CB 3.72Å; R353-A377 PolarHBondContact NE-O 3.48Å; R353-A377 PolarHBondContact NH2-O 3.04Å; L373-A377 PolarHBondContact O-N 3.04Å; T374-A377 WeakPolarHBondContact O-CB 2.92Å; T374-A377 PolarHBondContact O-N 2.9Å; A377-T379 VanDerWaalsContact C-N 3.32Å; A377-T379 PolarHBondContact O-N 2.67Å
378	H	52.7	Low	74.7	Confident	181 Å²	181	57.3 Å²	57.3	84%	0.838	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-76.3	-12.3	-179	-68.8	88.7	0	0	0	113.9	L376	L376-H378 PolarHBondContact O-N 2.5Å
379	T	53.8	Low	75	Confident	85 Å²	85	56.2 Å²	56.2	52%	0.521	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-99.9	-3.5	-172.2	59.1	0	0	0	0	115.6	L376 A377 T381	L376-T379 PolarHBondContact O-N 2.95Å; L376-T379 PolarHBondContact O-OG1 2.93Å; A377-T379 VanDerWaalsContact C-N 3.32Å; A377-T379 PolarHBondContact O-N 2.67Å; T379-T381 WeakPolarHBondContact O-CG2 3.41Å; T379-T381 PolarHBondContact O-N 3.25Å; T379-T381 PolarHBondContact OG1-OG1 2.82Å
380	R	56	Low	75.1	Confident	219 Å²	219	56.4 Å²	56.4	83%	0.826	31%	0.311	S	S	*	.			trans	51.5	22.1	-179.5	-82.9	-174.3	-174.4	-166.8	-0.3	115
381	T	67.3	Low	75.1	Confident	57 Å²	57	58.4 Å²	58.4	35%	0.35	32%	0.324	S	S	.	.			trans	-89.7	-30.3	-174.3	59	0	0	0	0	114.7	T379 P401	T379-T381 WeakPolarHBondContact O-CG2 3.41Å; T379-T381 PolarHBondContact O-N 3.25Å; T379-T381 PolarHBondContact OG1-OG1 2.82Å; T381-P401 WeakPolarHBondContact O-CD 3.49Å
382	V	74.3	Confident	74.9	Confident	28 Å²	28	61 Å²	61	17%	0.17	34%	0.337	C	S	.	.			trans	-83.9	123.5	-172.7	-174.9	0	0	0	0	111	P352 L373 L385 A399 Q400 R402	P352-V382 HydrophobicContact CB-CB 4.24Å; P352-V382 HydrophobicContact CB-CG1 4.08Å; P352-V382 HydrophobicContact CG-CB 4.16Å; P352-V382 HydrophobicContact CG-CG1 3.74Å; L373-V382 HydrophobicContact CD1-CG1 4.19Å; V382-L385 HydrophobicContact CG1-CD2 3.91Å; V382-A399 HydrophobicContact CG1-CB 4.07Å; V382-A399 HydrophobicContact CG2-CB 4.24Å; V382-Q400 CarbonylContact C-O 3.54Å; V382-Q400 VanDerWaalsContact CA-O 3.3Å; V382-Q400 WeakPolarHBondContact CA-O 3.45Å; V382-Q400 WeakPolarHBondContact CG1-O 3.41Å; V382-R402 VanDerWaalsContact CG2-CD 3.42Å; V382-R402 HydrophobicContact CG2-CG 4.11Å
383	T	72.2	Confident	75	Confident	87 Å²	87	63 Å²	63	53%	0.534	35%	0.345	S	S	.	.			trans	-105.9	-42.3	-178.5	53.3	0	0	0	0	112.4	Q400	T383-Q400 PolarHBondContact N-O 3.39Å; T383-Q400 PolarHBondContact OG1-O 3.21Å
384	T	79.2	Confident	75.6	Confident	66 Å²	66	63.7 Å²	63.7	41%	0.405	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	167.4	-178.5	63.9	0	0	0	0	111.3	Q400	T384-Q400 WeakPolarHBondContact O-CB 3.42Å; T384-Q400 PolarHBondContact O-N 3.42Å; T384-Q400 WeakPolarHBondContact OG1-CB 2.9Å; T384-Q400 VanDerWaalsContact OG1-CD 3.29Å; T384-Q400 PolarHBondContact OG1-OE1 3.25Å
385	L	86.8	Confident	76.7	Confident	17 Å²	17	60.8 Å²	60.8	9%	0.089	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	148.4	177.6	-48.1	171.1	0	0	0	108.8	F349 F356 L373 V382 V387 L397 A399 F612	F349-L385 HydrophobicContact CB-CD1 4.46Å; F356-L385 HydrophobicContact CE1-CD1 3.9Å; F356-L385 HydrophobicContact CZ-CD1 3.95Å; L373-L385 HydrophobicContact CD1-CD2 3.44Å; L373-L385 VanDerWaalsContact CD1-CD2 3.44Å; V382-L385 HydrophobicContact CG1-CD2 3.91Å; L385-V387 HydrophobicContact CB-CG2 4.43Å; L385-L397 HydrophobicContact CD1-CD1 4.19Å; L385-L397 HydrophobicContact CD2-CD2 4.2Å; L385-A399 HydrophobicContact CD2-CB 4.16Å; L385-F612 HydrophobicContact CB-CE1 3.61Å; L385-F612 HydrophobicContact CB-CZ 3.61Å; L385-F612 HydrophobicContact CD1-CE1 3.93Å; L385-F612 HydrophobicContact CD1-CZ 3.97Å; L385-F612 HydrophobicContact CG-CE1 4.16Å; L385-F612 HydrophobicContact CG-CZ 4.36Å
386	A	88.8	Confident	78.4	Confident	4 Å²	4	55.3 Å²	55.3	3%	0.033	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	133.8	164.1	0	0	0	0	0	107.9	A398 M428 V430	A386-A398 PolarHBondContact N-O 3.24Å; A386-A398 PolarHBondContact O-N 2.91Å; A386-M428 HydrophobicContact CB-CE 4.22Å; A386-V430 VanDerWaalsContact C-CG1 3.41Å; A386-V430 HydrophobicContact CB-CB 4.15Å; A386-V430 HydrophobicContact CB-CG1 3.69Å
387	V	92.9	Very high	79.9	Confident	21 Å²	21	52.3 Å²	52.3	13%	0.127	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	138	-173.4	-174.6	0	0	0	0	111	F349 L385 I395 Y396 L397 V430 F612 L614	F349-V387 HydrophobicContact CD1-CG2 4.24Å; F349-V387 HydrophobicContact CE1-CG1 4.3Å; F349-V387 HydrophobicContact CE1-CG2 4.14Å; F349-V387 HydrophobicContact CE2-CG1 4.34Å; F349-V387 HydrophobicContact CZ-CG1 3.91Å; F349-V387 HydrophobicContact CZ-CG2 4.42Å; L385-V387 HydrophobicContact CB-CG2 4.43Å; V387-I395 HydrophobicContact CG1-CG2 3.34Å; V387-Y396 WeakPolarHBondContact CA-O 3.47Å; V387-Y396 VanDerWaalsContact CG1-O 3.29Å; V387-Y396 WeakPolarHBondContact CG1-O 3.48Å; V387-L397 HydrophobicContact CG2-CB 4.17Å; V387-L397 HydrophobicContact CG2-CD1 4.2Å; V387-L397 HydrophobicContact CG2-CG 4.02Å; V387-V430 VanDerWaalsContact C-CG1 3.48Å; V387-V430 VanDerWaalsContact N-CG1 3.33Å; V387-F612 HydrophobicContact CB-CE2 3.68Å; V387-F612 HydrophobicContact CB-CZ 4.25Å; V387-F612 HydrophobicContact CG2-CE2 3.34Å; V387-F612 HydrophobicContact CG2-CZ 3.39Å; V387-L614 HydrophobicContact CB-CD2 3.9Å; V387-L614 HydrophobicContact CG1-CD2 3.31Å
388	C	93.8	Very high	81.8	Confident	13 Å²	13	51.2 Å²	51.2	9%	0.088	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	167.4	171.4	69.8	0	0	0	0	111.2	Y396 V430	C388-Y396 PolarHBondContact N-O 3.47Å; C388-Y396 PolarHBondContact O-N 3.43Å; C388-V430 HydrophobicContact CB-CG1 4Å; C388-V430 WeakPolarHBondContact CB-O 3.36Å
389	I	92.8	Very high	83.5	Confident	47 Å²	47	42.6 Å²	42.6	24%	0.241	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	138.2	-177.1	-42.8	171.8	0	0	0	108.7	D394 L614 S615 A616	I389-D394 WeakPolarHBondContact CA-O 3.46Å; I389-L614 HydrophobicContact CD1-CB 4.15Å; I389-L614 HydrophobicContact CD1-CD1 3.39Å; I389-L614 HydrophobicContact CD1-CD2 4.44Å; I389-L614 HydrophobicContact CD1-CG 4.13Å; I389-L614 HydrophobicContact CG1-CD1 3.88Å; I389-L614 HydrophobicContact CG1-CD2 4.25Å; I389-L614 HydrophobicContact CG1-CG 4.47Å; I389-S615 WeakPolarHBondContact CD1-O 3.36Å; I389-A616 HydrophobicContact CD1-CB 4.01Å
390	S	91.5	Very high	85.2	Confident	6 Å²	6	38.7 Å²	38.7	4%	0.042	20%	0.204	C	C	.	.			trans	-80.5	162.7	168.5	61.2	0	0	0	0	112.4	D392 H393 D394	S390-D392 PolarHBondContact O-N 2.85Å; S390-D392 VanDerWaalsContact O-N 3.17Å; S390-D392 PolarHBondContact OG-N 3.03Å; S390-H393 PolarHBondContact O-N 3.14Å; S390-H393 PolarHBondContact OG-N 2.99Å; S390-D394 PolarHBondContact N-O 3.03Å; S390-D394 VanDerWaalsContact OG-CB 3.31Å; S390-D394 WeakPolarHBondContact OG-CB 3.34Å; S390-D394 PolarHBondContact OG-N 3Å; S390-D394 PolarHBondContact OG-O 3.46Å
391	P	84.8	Confident	86.6	Confident	95 Å²	95	29.8 Å²	29.8	62%	0.617	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55	-27.3	167.3	-26.3	35.7	0	0	0	113.6	H393 Y432	P391-H393 PolarHBondContact O-N 3.46Å; P391-Y432 VanDerWaalsContact CD-CD1 3.46Å; P391-Y432 HydrophobicContact CG-CD1 4.45Å; P391-Y432 HydrophobicContact CG-CE1 4.02Å
392	D	80.1	Confident	87.6	Confident	66 Å²	66	30.3 Å²	30.3	35%	0.353	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.5	9.2	177.9	-52.3	-42.1	0	0	0	112.7	Q202 S390 D394	Q202-D392 PolarHBondContact NE2-OD1 3.4Å; S390-D392 PolarHBondContact O-N 2.85Å; S390-D392 VanDerWaalsContact O-N 3.17Å; S390-D392 PolarHBondContact OG-N 3.03Å; D392-D394 PolarHBondContact O-N 3.13Å
393	H	86	Confident	88.4	Confident	59 Å²	59	31.1 Å²	31.1	27%	0.273	18%	0.175	S	C	.	.			trans	66.8	8.7	178.7	-44.7	-67.7	0	0	0	115.8	S390 P391 P410 R617	S390-H393 PolarHBondContact O-N 3.14Å; S390-H393 PolarHBondContact OG-N 2.99Å; P391-H393 PolarHBondContact O-N 3.46Å; H393-P410 VanDerWaalsContact O-CG 3.29Å; H393-P410 WeakPolarHBondContact O-CG 3.41Å; H393-R617 HydrophobicContact CB-CB 4.05Å; H393-R617 WeakPolarHBondContact ND1-CB 3.33Å; H393-R617 VanDerWaalsContact NE2-CD 3.32Å; H393-R617 WeakPolarHBondContact NE2-CD 3.22Å
394	D	91	Very high	89.2	Confident	18 Å²	18	27.5 Å²	27.5	10%	0.096	15%	0.152	C	C	.	.			trans	-64.5	136.8	166.3	-61	-31.9	0	0	0	110.2	I389 S390 D392 Y396 V407 K409	I389-D394 WeakPolarHBondContact CA-O 3.46Å; S390-D394 PolarHBondContact N-O 3.03Å; S390-D394 VanDerWaalsContact OG-CB 3.31Å; S390-D394 WeakPolarHBondContact OG-CB 3.34Å; S390-D394 PolarHBondContact OG-N 3Å; S390-D394 PolarHBondContact OG-O 3.46Å; D392-D394 PolarHBondContact O-N 3.13Å; D394-Y396 HydrophobicContact CB-CE2 3.9Å; D394-V407 HydrophobicContact CB-CG2 3.85Å; D394-K409 WeakPolarHBondContact OD1-CD 3.33Å; D394-K409 WeakPolarHBondContact OD1-CE 3.48Å; D394-K409 IonicContact OD1-NZ 3.37Å; D394-K409 PolarHBondContact OD1-NZ 2.9Å; D394-K409 IonicContact OD2-NZ 3.64Å; D394-K409 PolarHBondContact OD2-NZ 3.13Å
395	I	94.1	Very high	89.9	Confident	1 Å²	1	24.3 Å²	24.3	1%	0.005	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	121.3	-179.9	-51.8	177.5	0	0	0	108.8	I347 F349 V387 V407 Y408 L614 A616	I347-I395 HydrophobicContact CD1-CD1 3.33Å; F349-I395 HydrophobicContact CZ-CG2 4.19Å; V387-I395 HydrophobicContact CG1-CG2 3.34Å; I395-V407 CarbonylContact O-C 3.54Å; I395-V407 WeakPolarHBondContact O-CA 3.35Å; I395-Y408 HydrophobicContact CD1-CD1 3.98Å; I395-Y408 HydrophobicContact CG1-CD1 4.41Å; I395-Y408 PolarHBondContact N-O 2.82Å; I395-Y408 VanDerWaalsContact N-O 3.13Å; I395-Y408 PolarHBondContact O-N 3.12Å; I395-L614 HydrophobicContact CD1-CD1 4.45Å; I395-A616 HydrophobicContact CD1-CB 3.9Å; I395-A616 HydrophobicContact CG1-CB 4.37Å
396	Y	95	Very high	90.2	Very high	6 Å²	6	25.1 Å²	25.1	2%	0.024	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	129.2	178.5	-63.3	-86.6	0	0	0	110.1	V387 C388 D394 W406 V407 L418 Y432 I437 V459	V387-Y396 WeakPolarHBondContact CA-O 3.47Å; V387-Y396 VanDerWaalsContact CG1-O 3.29Å; V387-Y396 WeakPolarHBondContact CG1-O 3.48Å; C388-Y396 PolarHBondContact N-O 3.47Å; C388-Y396 PolarHBondContact O-N 3.43Å; D394-Y396 HydrophobicContact CB-CE2 3.9Å; Y396-W406 CarbonylContact C-O 3.54Å; Y396-W406 WeakPolarHBondContact CA-O 3.44Å; Y396-V407 HydrophobicContact CD1-CB 3.8Å; Y396-V407 HydrophobicContact CD1-CG2 3.84Å; Y396-V407 HydrophobicContact CE1-CB 3.74Å; Y396-V407 HydrophobicContact CE1-CG2 3.51Å; Y396-V407 HydrophobicContact CE2-CG2 4.47Å; Y396-V407 HydrophobicContact CG-CG2 4.49Å; Y396-L418 HydrophobicContact CD1-CD1 4Å; Y396-L418 HydrophobicContact CE1-CD1 3.91Å; Y396-Y432 HydrophobicContact CD2-CD2 4.42Å; Y396-Y432 AromaticContact CE2-CD2 3.92Å; Y396-Y432 HydrophobicContact CE2-CD2 3.92Å; Y396-Y432 HydrophobicContact CE2-CE2 4.27Å; Y396-I437 HydrophobicContact CD1-CD1 3.18Å; Y396-I437 HydrophobicContact CD1-CG1 4.39Å; Y396-I437 HydrophobicContact CD2-CD1 4.1Å; Y396-I437 HydrophobicContact CE1-CD1 3.48Å; Y396-I437 VanDerWaalsContact CE1-CD1 3.48Å; Y396-I437 HydrophobicContact CE2-CD1 4.37Å; Y396-I437 HydrophobicContact CG-CD1 3.5Å; Y396-I437 HydrophobicContact CG-CG1 4.38Å; Y396-V459 HydrophobicContact CE1-CG2 4.47Å; Y396-V459 WeakPolarHBondContact OH-CG1 3.26Å
397	L	93.6	Very high	90.4	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	123.9	-176.9	179.7	155.3	0	0	0	110	F349 F356 L373 L385 V387 A399 W406 W415	F349-L397 HydrophobicContact CD1-CD1 4.3Å; F349-L397 HydrophobicContact CE1-CD1 4.19Å; F356-L397 HydrophobicContact CE2-CD1 3.71Å; F356-L397 HydrophobicContact CZ-CD1 3.69Å; L373-L397 HydrophobicContact CD1-CD2 4.38Å; L385-L397 HydrophobicContact CD1-CD1 4.19Å; L385-L397 HydrophobicContact CD2-CD2 4.2Å; V387-L397 HydrophobicContact CG2-CB 4.17Å; V387-L397 HydrophobicContact CG2-CD1 4.2Å; V387-L397 HydrophobicContact CG2-CG 4.02Å; L397-A399 HydrophobicContact CD2-CB 4.48Å; L397-W406 PolarHBondContact N-O 2.98Å; L397-W406 PolarHBondContact O-N 2.85Å; L397-W415 HydrophobicContact CB-CH2 3.76Å; L397-W415 HydrophobicContact CB-CZ3 3.58Å; L397-W415 HydrophobicContact CD1-CH2 3.72Å; L397-W415 HydrophobicContact CD1-CZ2 4.36Å; L397-W415 HydrophobicContact CD1-CZ3 4.24Å; L397-W415 HydrophobicContact CG-CH2 4.39Å; L397-W415 HydrophobicContact CG-CZ3 4.48Å
398	A	92.4	Very high	90.5	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	117.7	173	0	0	0	0	0	110	A386 L405 M428 I439	A386-A398 PolarHBondContact N-O 3.24Å; A386-A398 PolarHBondContact O-N 2.91Å; A398-L405 HydrophobicContact CB-CD1 4.09Å; A398-M428 HydrophobicContact CB-CE 3.41Å; A398-M428 VanDerWaalsContact CB-CE 3.41Å; A398-I439 HydrophobicContact CB-CD1 4.25Å
399	A	87.9	Confident	90.2	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	137.8	-179.8	0	0	0	0	0	111.1	L373 V382 L385 L397 R402 R421	L373-A399 HydrophobicContact CD1-CB 4.16Å; L373-A399 HydrophobicContact CD2-CB 4.14Å; V382-A399 HydrophobicContact CG1-CB 4.07Å; V382-A399 HydrophobicContact CG2-CB 4.24Å; L385-A399 HydrophobicContact CD2-CB 4.16Å; L397-A399 HydrophobicContact CD2-CB 4.48Å; A399-R402 HydrophobicContact CB-CB 4.37Å; A399-R402 CarbonylContact O-C 3.55Å; A399-R402 PolarHBondContact O-N 3.05Å; A399-R421 PolarHBondContact O-NH2 2.96Å
400	Q	88.1	Confident	90	Very high	3 Å²	3	23.9 Å²	23.9	1%	0.014	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	137.1	-178.5	-54	-179.4	42.9	0	0	110	V382 T383 T384 M428	V382-Q400 CarbonylContact C-O 3.54Å; V382-Q400 VanDerWaalsContact CA-O 3.3Å; V382-Q400 WeakPolarHBondContact CA-O 3.45Å; V382-Q400 WeakPolarHBondContact CG1-O 3.41Å; T383-Q400 PolarHBondContact N-O 3.39Å; T383-Q400 PolarHBondContact OG1-O 3.21Å; T384-Q400 WeakPolarHBondContact O-CB 3.42Å; T384-Q400 PolarHBondContact O-N 3.42Å; T384-Q400 WeakPolarHBondContact OG1-CB 2.9Å; T384-Q400 VanDerWaalsContact OG1-CD 3.29Å; T384-Q400 PolarHBondContact OG1-OE1 3.25Å; Q400-M428 HydrophobicContact CG-CE 3.96Å; Q400-M428 HydrophobicContact CG-CG 4.01Å; Q400-M428 HydrophobicContact CG-SD 4.28Å; Q400-M428 PolarHBondContact NE2-O 2.78Å; Q400-M428 VanDerWaalsContact NE2-O 3.1Å
401	P	87.2	Confident	89.7	Confident	31 Å²	31	24.8 Å²	24.8	20%	0.201	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	cis	-95.5	63	-1.6	36.6	-25.7	0	0	0	110.9	T381 C424 E426 P445	T381-P401 WeakPolarHBondContact O-CD 3.49Å; P401-C424 VanDerWaalsContact C-SG 3.51Å; P401-C424 PolarHBondContact O-SG 2.84Å; P401-E426 HydrophobicContact CB-CB 4.49Å; P401-P445 HydrophobicContact CB-CB 3.61Å; P401-P445 HydrophobicContact CB-CG 3.77Å; P401-P445 HydrophobicContact CG-CB 4.16Å
402	R	87.4	Confident	89.7	Confident	69 Å²	69	24.1 Å²	24.1	26%	0.26	12%	0.121	S	C	.	.			trans	-110.1	161	177.3	-65.4	-175.7	61.1	73.5	11.1	110	V382 A399 D404 R421	V382-R402 VanDerWaalsContact CG2-CD 3.42Å; V382-R402 HydrophobicContact CG2-CG 4.11Å; A399-R402 HydrophobicContact CB-CB 4.37Å; A399-R402 CarbonylContact O-C 3.55Å; A399-R402 PolarHBondContact O-N 3.05Å; R402-D404 VanDerWaalsContact C-N 3.35Å; R402-D404 IonicContact CZ-OD1 3.74Å; R402-D404 IonicContact CZ-OD2 2.73Å; R402-D404 VanDerWaalsContact CZ-OD2 3.23Å; R402-D404 IonicContact NE-OD1 2.84Å; R402-D404 IonicContact NE-OD2 3.77Å; R402-D404 PolarHBondContact NE-OD2 2.84Å; R402-D404 IonicContact NH2-OD1 3.23Å; R402-D404 PolarHBondContact NH2-OD1 2.73Å; R402-D404 VanDerWaalsContact NH2-OD1 3.14Å; R402-D404 IonicContact NH2-OD2 2.97Å; R402-D404 PolarHBondContact NH2-OD2 2.78Å; R402-R421 PolarHBondContact O-NH2 2.81Å
403	T	90.5	Very high	90.1	Very high	45 Å²	45	22.9 Å²	22.9	28%	0.276	11%	0.114	S	C	.	.			trans	-88.4	-6.6	175	47.8	0	0	0	0	112.9	R421 C424	T403-R421 WeakPolarHBondContact O-CB 3.15Å; T403-R421 WeakPolarHBondContact O-CG 3.36Å; T403-R421 PolarHBondContact O-N 2.87Å; T403-C424 HydrophobicContact CG2-CB 4.11Å
404	D	89.8	Confident	90.2	Very high	10 Å²	10	21.9 Å²	21.9	5%	0.053	11%	0.114	C	C	.	.			trans	-64.8	135.2	-177.2	-40.8	-8.8	0	0	0	111.6	R402	R402-D404 VanDerWaalsContact C-N 3.35Å; R402-D404 IonicContact CZ-OD1 3.74Å; R402-D404 IonicContact CZ-OD2 2.73Å; R402-D404 VanDerWaalsContact CZ-OD2 3.23Å; R402-D404 IonicContact NE-OD1 2.84Å; R402-D404 IonicContact NE-OD2 3.77Å; R402-D404 PolarHBondContact NE-OD2 2.84Å; R402-D404 IonicContact NH2-OD1 3.23Å; R402-D404 PolarHBondContact NH2-OD1 2.73Å; R402-D404 VanDerWaalsContact NH2-OD1 3.14Å; R402-D404 IonicContact NH2-OD2 2.97Å; R402-D404 PolarHBondContact NH2-OD2 2.78Å
405	L	93.1	Very high	90.2	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	134.4	168.6	179.5	71.3	0	0	0	108.8	A398 L418 I437 Y457 W464	A398-L405 HydrophobicContact CB-CD1 4.09Å; L405-L418 HydrophobicContact CB-CB 4.32Å; L405-L418 HydrophobicContact CD2-CB 4.09Å; L405-L418 HydrophobicContact CD2-CD1 3.73Å; L405-L418 HydrophobicContact CG-CB 4.26Å; L405-L418 HydrophobicContact CG-CD1 4.1Å; L405-L418 PolarHBondContact O-N 3.19Å; L405-I437 HydrophobicContact CD2-CD1 4Å; L405-Y457 HydrophobicContact CD2-CD1 4.11Å; L405-Y457 HydrophobicContact CD2-CE1 4.17Å; L405-Y457 HydrophobicContact CD2-CG 4.31Å; L405-W464 HydrophobicContact CB-CZ2 4.21Å; L405-W464 HydrophobicContact CD2-CH2 4Å; L405-W464 HydrophobicContact CD2-CZ2 3.51Å; L405-W464 HydrophobicContact CG-CZ2 4.35Å
406	W	93.2	Very high	90.1	Very high	33 Å²	33	26.9 Å²	26.9	13%	0.125	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	147.1	-179.6	-61.3	84.4	0	0	0	110.8	P372 L376 Y396 L397 W415 Q416 Q417	P372-W406 HydrophobicContact CB-CD2 3.81Å; P372-W406 HydrophobicContact CB-CE3 3.79Å; P372-W406 HydrophobicContact CB-CG 4.23Å; P372-W406 HydrophobicContact CB-CZ3 4.2Å; P372-W406 HydrophobicContact CG-CB 4.4Å; P372-W406 HydrophobicContact CG-CD2 4.26Å; P372-W406 HydrophobicContact CG-CG 4.15Å; L376-W406 HydrophobicContact CD1-CZ2 4.28Å; Y396-W406 CarbonylContact C-O 3.54Å; Y396-W406 WeakPolarHBondContact CA-O 3.44Å; L397-W406 PolarHBondContact N-O 2.98Å; L397-W406 PolarHBondContact O-N 2.85Å; W406-W415 HydrophobicContact CB-CE3 3.67Å; W406-W415 HydrophobicContact CB-CZ3 4Å; W406-W415 HydrophobicContact CE3-CB 4.22Å; W406-Q416 WeakPolarHBondContact CA-O 3.37Å; W406-Q417 HydrophobicContact CD2-CB 4.27Å; W406-Q417 HydrophobicContact CD2-CG 4.38Å; W406-Q417 HydrophobicContact CE3-CB 3.85Å; W406-Q417 HydrophobicContact CE3-CG 4.44Å; W406-Q417 HydrophobicContact CH2-CB 3.75Å; W406-Q417 HydrophobicContact CH2-CG 4.09Å; W406-Q417 HydrophobicContact CZ2-CB 4.16Å; W406-Q417 HydrophobicContact CZ2-CG 4Å; W406-Q417 HydrophobicContact CZ3-CB 3.59Å; W406-Q417 HydrophobicContact CZ3-CG 4.32Å
407	V	94.3	Very high	89.9	Confident	6 Å²	6	31.3 Å²	31.3	4%	0.036	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	130.2	168.1	62.7	0	0	0	0	109.7	D394 I395 Y396 W415 Q416 L418	D394-V407 HydrophobicContact CB-CG2 3.85Å; I395-V407 CarbonylContact O-C 3.54Å; I395-V407 WeakPolarHBondContact O-CA 3.35Å; Y396-V407 HydrophobicContact CD1-CB 3.8Å; Y396-V407 HydrophobicContact CD1-CG2 3.84Å; Y396-V407 HydrophobicContact CE1-CB 3.74Å; Y396-V407 HydrophobicContact CE1-CG2 3.51Å; Y396-V407 HydrophobicContact CE2-CG2 4.47Å; Y396-V407 HydrophobicContact CG-CG2 4.49Å; V407-W415 CarbonylContact O-C 3.12Å; V407-W415 WeakPolarHBondContact O-CA 3.28Å; V407-Q416 HydrophobicContact CG1-CB 3.95Å; V407-Q416 PolarHBondContact N-O 2.66Å; V407-Q416 PolarHBondContact O-N 2.86Å; V407-L418 HydrophobicContact CB-CD1 3.98Å; V407-L418 HydrophobicContact CB-CG 4.41Å; V407-L418 HydrophobicContact CG1-CD1 4.04Å; V407-L418 HydrophobicContact CG1-CD2 3.91Å; V407-L418 HydrophobicContact CG1-CG 4.01Å
408	Y	92.9	Very high	89.9	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	131.5	171	-178	-115.1	0	0	0	109.5	V369 P370 I395 P410 N413 S414 W415 L623	V369-Y408 HydrophobicContact CG1-CE1 4.02Å; V369-Y408 HydrophobicContact CG1-CE2 3.99Å; P370-Y408 HydrophobicContact CG-CE2 4.4Å; I395-Y408 HydrophobicContact CD1-CD1 3.98Å; I395-Y408 HydrophobicContact CG1-CD1 4.41Å; I395-Y408 PolarHBondContact N-O 2.82Å; I395-Y408 VanDerWaalsContact N-O 3.13Å; I395-Y408 PolarHBondContact O-N 3.12Å; Y408-P410 HydrophobicContact CD1-CB 4.41Å; Y408-P410 HydrophobicContact CD1-CG 3.93Å; Y408-P410 HydrophobicContact CE1-CB 3.99Å; Y408-P410 HydrophobicContact CE1-CG 4Å; Y408-P410 WeakPolarHBondContact O-CD 3.5Å; Y408-N413 WeakPolarHBondContact OH-CA 3.38Å; Y408-N413 PolarHBondContact OH-OD1 2.89Å; Y408-S414 WeakPolarHBondContact CA-O 3.26Å; Y408-S414 VanDerWaalsContact CD2-O 3.31Å; Y408-S414 WeakPolarHBondContact CD2-O 3.48Å; Y408-W415 AromaticContact CD2-CD1 3.68Å; Y408-W415 AromaticContact CD2-CD2 3.84Å; Y408-W415 HydrophobicContact CD2-CD2 3.84Å; Y408-W415 AromaticContact CD2-CE2 3.54Å; Y408-W415 AromaticContact CD2-CG 3.94Å; Y408-W415 HydrophobicContact CD2-CG 3.94Å; Y408-W415 HydrophobicContact CD2-CZ2 4.12Å; Y408-W415 AromaticContact CD2-NE1 3.38Å; Y408-W415 AromaticContact CE2-NE1 3.92Å; Y408-W415 HydrophobicContact CG-CD2 4.16Å; Y408-W415 AromaticContact CG-CE2 3.83Å; Y408-W415 HydrophobicContact CG-CH2 4.38Å; Y408-W415 AromaticContact CG-CZ2 3.97Å; Y408-W415 HydrophobicContact CG-CZ2 3.97Å; Y408-L623 WeakPolarHBondContact OH-CD2 3.26Å
409	K	89.4	Confident	89.8	Confident	48 Å²	48	34 Å²	34	21%	0.209	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	100	174.6	-64.5	-59.5	-168	163.4	0	108.5	D394 A411 Q412 N413 S414	D394-K409 WeakPolarHBondContact OD1-CD 3.33Å; D394-K409 WeakPolarHBondContact OD1-CE 3.48Å; D394-K409 IonicContact OD1-NZ 3.37Å; D394-K409 PolarHBondContact OD1-NZ 2.9Å; D394-K409 IonicContact OD2-NZ 3.64Å; D394-K409 PolarHBondContact OD2-NZ 3.13Å; K409-A411 VanDerWaalsContact C-N 3.29Å; K409-A411 PolarHBondContact O-N 2.84Å; K409-Q412 HydrophobicContact CB-CB 4.06Å; K409-Q412 HydrophobicContact CB-CG 4.18Å; K409-Q412 CarbonylContact O-C 3.57Å; K409-Q412 PolarHBondContact O-N 2.93Å; K409-N413 PolarHBondContact O-N 2.8Å; K409-S414 PolarHBondContact N-O 2.89Å
410	P	88.3	Confident	90.1	Very high	6 Å²	6	38 Å²	38	4%	0.039	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-59	-38.2	-172.6	-24.9	33.7	0	0	0	113.8	H393 Y408 Q412 N413 V618 Y619	H393-P410 VanDerWaalsContact O-CG 3.29Å; H393-P410 WeakPolarHBondContact O-CG 3.41Å; Y408-P410 HydrophobicContact CD1-CB 4.41Å; Y408-P410 HydrophobicContact CD1-CG 3.93Å; Y408-P410 HydrophobicContact CE1-CB 3.99Å; Y408-P410 HydrophobicContact CE1-CG 4Å; Y408-P410 WeakPolarHBondContact O-CD 3.5Å; P410-Q412 PolarHBondContact O-N 2.81Å; P410-N413 PolarHBondContact O-N 2.82Å; P410-V618 HydrophobicContact CB-CG1 4.46Å; P410-Y619 HydrophobicContact CB-CD2 3.87Å; P410-Y619 HydrophobicContact CB-CE2 4.01Å
411	A	84.3	Confident	90.3	Very high	24 Å²	24	38.3 Å²	38.3	20%	0.198	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-62.5	-26.8	177.6	0	0	0	0	0	113.2	L338 K409 Y619 C622	L338-A411 HydrophobicContact CD2-CB 4.09Å; K409-A411 VanDerWaalsContact C-N 3.29Å; K409-A411 PolarHBondContact O-N 2.84Å; A411-Y619 HydrophobicContact CB-CD2 4.17Å; A411-Y619 HydrophobicContact CB-CE2 3.86Å; A411-C622 PolarHBondContact O-SG 3.46Å; A411-C622 VanDerWaalsContact O-SG 3.38Å
412	Q	84.4	Confident	90.5	Very high	81 Å²	81	41.3 Å²	41.3	38%	0.379	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	-101.9	-6.4	-178.5	-58.3	177.1	19.8	0	0	112.8	K409 P410 S414	K409-Q412 HydrophobicContact CB-CB 4.06Å; K409-Q412 HydrophobicContact CB-CG 4.18Å; K409-Q412 CarbonylContact O-C 3.57Å; K409-Q412 PolarHBondContact O-N 2.93Å; P410-Q412 PolarHBondContact O-N 2.81Å; Q412-S414 WeakPolarHBondContact CB-OG 3.43Å; Q412-S414 PolarHBondContact O-N 2.95Å
413	N	88.4	Confident	90.7	Very high	40 Å²	40	40.4 Å²	40.4	21%	0.214	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	42.7	48.9	-169.8	-172.1	14	0	0	0	112.8	P370 Y408 K409 P410 C622	P370-N413 WeakPolarHBondContact CD-OD1 3.43Å; P370-N413 WeakPolarHBondContact CG-OD1 3.16Å; Y408-N413 WeakPolarHBondContact OH-CA 3.38Å; Y408-N413 PolarHBondContact OH-OD1 2.89Å; K409-N413 PolarHBondContact O-N 2.8Å; P410-N413 PolarHBondContact O-N 2.82Å; N413-C622 HydrophobicContact CB-CB 4.23Å; N413-C622 WeakPolarHBondContact CB-O 3.32Å; N413-C622 PolarHBondContact ND2-O 2.94Å
414	S	88.9	Confident	90.7	Very high	38 Å²	38	40.4 Å²	40.4	27%	0.266	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	147.5	-176.6	66.5	0	0	0	0	112.9	Y408 K409 Q412	Y408-S414 WeakPolarHBondContact CA-O 3.26Å; Y408-S414 VanDerWaalsContact CD2-O 3.31Å; Y408-S414 WeakPolarHBondContact CD2-O 3.48Å; K409-S414 PolarHBondContact N-O 2.89Å; Q412-S414 WeakPolarHBondContact CB-OG 3.43Å; Q412-S414 PolarHBondContact O-N 2.95Å
415	W	91.6	Very high	90.7	Very high	38 Å²	38	39.9 Å²	39.9	14%	0.144	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	142.3	174	-70.3	93	0	0	0	110.8	F356 P370 P372 L397 W406 V407 Y408	F356-W415 HydrophobicContact CD2-CZ2 4.11Å; F356-W415 HydrophobicContact CE2-CH2 4.44Å; F356-W415 AromaticContact CE2-CZ2 3.84Å; F356-W415 HydrophobicContact CE2-CZ2 3.84Å; P370-W415 PolarHBondContact O-NE1 3.22Å; P372-W415 HydrophobicContact CB-CB 3.87Å; P372-W415 HydrophobicContact CB-CD2 4.06Å; P372-W415 HydrophobicContact CB-CG 3.77Å; P372-W415 HydrophobicContact CG-CB 4.45Å; P372-W415 HydrophobicContact CG-CD2 3.65Å; P372-W415 HydrophobicContact CG-CE3 3.91Å; P372-W415 HydrophobicContact CG-CG 3.91Å; P372-W415 HydrophobicContact CG-CZ2 4.43Å; P372-W415 HydrophobicContact CG-CZ3 4.4Å; L397-W415 HydrophobicContact CB-CH2 3.76Å; L397-W415 HydrophobicContact CB-CZ3 3.58Å; L397-W415 HydrophobicContact CD1-CH2 3.72Å; L397-W415 HydrophobicContact CD1-CZ2 4.36Å; L397-W415 HydrophobicContact CD1-CZ3 4.24Å; L397-W415 HydrophobicContact CG-CH2 4.39Å; L397-W415 HydrophobicContact CG-CZ3 4.48Å; W406-W415 HydrophobicContact CB-CE3 3.67Å; W406-W415 HydrophobicContact CB-CZ3 4Å; W406-W415 HydrophobicContact CE3-CB 4.22Å; V407-W415 CarbonylContact O-C 3.12Å; V407-W415 WeakPolarHBondContact O-CA 3.28Å; Y408-W415 AromaticContact CD2-CD1 3.68Å; Y408-W415 AromaticContact CD2-CD2 3.84Å; Y408-W415 HydrophobicContact CD2-CD2 3.84Å; Y408-W415 AromaticContact CD2-CE2 3.54Å; Y408-W415 AromaticContact CD2-CG 3.94Å; Y408-W415 HydrophobicContact CD2-CG 3.94Å; Y408-W415 HydrophobicContact CD2-CZ2 4.12Å; Y408-W415 AromaticContact CD2-NE1 3.38Å; Y408-W415 AromaticContact CE2-NE1 3.92Å; Y408-W415 HydrophobicContact CG-CD2 4.16Å; Y408-W415 AromaticContact CG-CE2 3.83Å; Y408-W415 HydrophobicContact CG-CH2 4.38Å; Y408-W415 AromaticContact CG-CZ2 3.97Å; Y408-W415 HydrophobicContact CG-CZ2 3.97Å
416	Q	90.8	Very high	90.6	Very high	86 Å²	86	41.9 Å²	41.9	40%	0.402	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	132.5	176.2	-57	178.9	18.8	0	0	109	W406 V407	W406-Q416 WeakPolarHBondContact CA-O 3.37Å; V407-Q416 HydrophobicContact CG1-CB 3.95Å; V407-Q416 PolarHBondContact N-O 2.66Å; V407-Q416 PolarHBondContact O-N 2.86Å
417	Q	91.5	Very high	90.4	Very high	99 Å²	99	42 Å²	42	46%	0.463	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	133.3	174.7	-165.3	176.4	-9.9	0	0	109.6	W406 D420	W406-Q417 HydrophobicContact CD2-CB 4.27Å; W406-Q417 HydrophobicContact CD2-CG 4.38Å; W406-Q417 HydrophobicContact CE3-CB 3.85Å; W406-Q417 HydrophobicContact CE3-CG 4.44Å; W406-Q417 HydrophobicContact CH2-CB 3.75Å; W406-Q417 HydrophobicContact CH2-CG 4.09Å; W406-Q417 HydrophobicContact CZ2-CB 4.16Å; W406-Q417 HydrophobicContact CZ2-CG 4Å; W406-Q417 HydrophobicContact CZ3-CB 3.59Å; W406-Q417 HydrophobicContact CZ3-CG 4.32Å; Q417-D420 PolarHBondContact NE2-OD1 2.8Å
418	L	93.2	Very high	90.4	Very high	28 Å²	28	42.1 Å²	42.1	15%	0.147	23%	0.231	C	C	.	.			trans	-100.8	179	175	-61.4	179.7	0	0	0	110.4	Y396 L405 V407 D420 Y457	Y396-L418 HydrophobicContact CD1-CD1 4Å; Y396-L418 HydrophobicContact CE1-CD1 3.91Å; L405-L418 HydrophobicContact CB-CB 4.32Å; L405-L418 HydrophobicContact CD2-CB 4.09Å; L405-L418 HydrophobicContact CD2-CD1 3.73Å; L405-L418 HydrophobicContact CG-CB 4.26Å; L405-L418 HydrophobicContact CG-CD1 4.1Å; L405-L418 PolarHBondContact O-N 3.19Å; V407-L418 HydrophobicContact CB-CD1 3.98Å; V407-L418 HydrophobicContact CB-CG 4.41Å; V407-L418 HydrophobicContact CG1-CD1 4.04Å; V407-L418 HydrophobicContact CG1-CD2 3.91Å; V407-L418 HydrophobicContact CG1-CG 4.01Å; L418-D420 PolarHBondContact O-N 3Å; L418-Y457 HydrophobicContact CD1-CE1 3.89Å
419	A	91.1	Very high	90.4	Very high	30 Å²	30	43.6 Å²	43.6	25%	0.248	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-57.4	137.4	176.9	0	0	0	0	0	111.2	Y457 N462 W464	A419-Y457 HydrophobicContact CB-CE2 4.23Å; A419-N462 WeakPolarHBondContact CB-OD1 3.34Å; A419-N462 PolarHBondContact N-OD1 2.78Å; A419-W464 PolarHBondContact O-NE1 3.02Å
420	D	92.8	Very high	90.7	Very high	84 Å²	84	41.5 Å²	41.5	45%	0.449	23%	0.23	S	C	.	.	P	Polyproline II helix	trans	-63.6	143	178.5	-64.8	-24.8	0	0	0	111.2	Q417 L418 W464	Q417-D420 PolarHBondContact NE2-OD1 2.8Å; L418-D420 PolarHBondContact O-N 3Å; D420-W464 PolarHBondContact O-NE1 2.93Å
421	R	92.8	Very high	91.1	Very high	9 Å²	9	41.4 Å²	41.4	3%	0.034	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-64.4	155.5	179.6	-63.9	-176.1	-55.4	133.6	-21	111.9	A399 R402 T403 L423 M428 I439 W464	A399-R421 PolarHBondContact O-NH2 2.96Å; R402-R421 PolarHBondContact O-NH2 2.81Å; T403-R421 WeakPolarHBondContact O-CB 3.15Å; T403-R421 WeakPolarHBondContact O-CG 3.36Å; T403-R421 PolarHBondContact O-N 2.87Å; R421-L423 PolarHBondContact NH1-O 2.97Å; R421-M428 VanDerWaalsContact CZ-CE 3.45Å; R421-M428 VanDerWaalsContact CZ-SD 3.6Å; R421-M428 VanDerWaalsContact NH1-CE 3.35Å; R421-M428 PolarHBondContact NH1-SD 2.88Å; R421-M428 VanDerWaalsContact NH2-CE 3.33Å; R421-M428 PolarHBondContact NH2-SD 3.29Å; R421-I439 HydrophobicContact CG-CD1 4.38Å; R421-W464 HydrophobicContact CB-CZ2 4.4Å; R421-W464 HydrophobicContact CG-CH2 3.73Å; R421-W464 HydrophobicContact CG-CZ2 3.41Å; R421-W464 VanDerWaalsContact CG-CZ2 3.41Å; R421-W464 HydrophobicContact CG-CZ3 4.4Å
422	L	91.3	Very high	91.7	Very high	93 Å²	93	42 Å²	42	49%	0.487	23%	0.227	S	C	.	.	S	Bend	trans	-73.6	-35.3	178.8	-58.1	175.2	0	0	0	111.2	E455 W464 L466	L422-E455 WeakPolarHBondContact CA-OE1 3.44Å; L422-E455 HydrophobicContact CB-CG 4.46Å; L422-E455 WeakPolarHBondContact CB-OE1 3.38Å; L422-E455 PolarHBondContact N-OE1 3.01Å; L422-W464 HydrophobicContact CD1-CB 3.89Å; L422-W464 HydrophobicContact CD2-CB 4Å; L422-W464 HydrophobicContact CG-CB 3.68Å; L422-W464 HydrophobicContact CG-CG 4.34Å; L422-L466 HydrophobicContact CD1-CD2 4Å; L422-L466 HydrophobicContact CD1-CG 3.94Å
423	L	91.6	Very high	92.2	Very high	51 Å²	51	38.3 Å²	38.3	27%	0.267	21%	0.21	S	C	.	.	S	Bend	trans	-124.7	139	-173.5	-60	170.6	0	0	0	111.7	R421 R425 E453 E455 L466	R421-L423 PolarHBondContact NH1-O 2.97Å; L423-R425 HydrophobicContact CB-CG 4.33Å; L423-E453 HydrophobicContact CD1-CB 3.63Å; L423-E453 HydrophobicContact CD1-CG 4.08Å; L423-E455 HydrophobicContact CD1-CG 4.44Å; L423-E455 PolarHBondContact N-OE1 3.38Å; L423-L466 HydrophobicContact CD1-CD2 4.44Å
424	C	90.4	Very high	92.4	Very high	44 Å²	44	41.2 Å²	41.2	30%	0.297	23%	0.225	S	C	.	.			trans	-89.1	126.9	172.2	-171.9	0	0	0	0	109.6	P401 T403 P445	P401-C424 VanDerWaalsContact C-SG 3.51Å; P401-C424 PolarHBondContact O-SG 2.84Å; T403-C424 HydrophobicContact CG2-CB 4.11Å; C424-P445 WeakPolarHBondContact O-CD 3.37Å
425	R	91.2	Very high	92.5	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.222	C	C	.	.			trans	-142.9	151.1	-173.4	-40.4	-175.4	-179.1	-128.9	5.6	112.3	L423 M428 G441 R443 L451 E453 E455	L423-R425 HydrophobicContact CB-CG 4.33Å; R425-M428 HydrophobicContact CB-CB 4.2Å; R425-M428 HydrophobicContact CB-CG 4.27Å; R425-M428 HydrophobicContact CB-SD 3.81Å; R425-M428 HydrophobicContact CG-SD 4.26Å; R425-G441 WeakPolarHBondContact CD-O 3.45Å; R425-G441 PolarHBondContact NH1-O 3.17Å; R425-R443 WeakPolarHBondContact CA-O 3.31Å; R425-L451 HydrophobicContact CB-CD1 4.34Å; R425-L451 HydrophobicContact CG-CD1 3.62Å; R425-L451 VanDerWaalsContact NH1-CB 3.31Å; R425-E453 VanDerWaalsContact CZ-O 3.27Å; R425-E453 PolarHBondContact NH1-O 2.68Å; R425-E453 PolarHBondContact NH2-O 3.17Å; R425-E455 IonicContact CZ-OE2 3.9Å; R425-E455 VanDerWaalsContact CZ-OE2 3.29Å; R425-E455 IonicContact NE-OE2 3.14Å; R425-E455 PolarHBondContact NE-OE2 3Å; R425-E455 IonicContact NH2-OE2 3.83Å; R425-E455 PolarHBondContact NH2-OE2 3.49Å
426	E	90.4	Very high	92.6	Very high	41 Å²	41	42.8 Å²	42.8	19%	0.192	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	148.4	162.9	60	171.9	-163.7	0	0	111.5	P401 M428 G442 R443 P445	P401-E426 HydrophobicContact CB-CB 4.49Å; E426-M428 VanDerWaalsContact C-N 3.35Å; E426-G442 CarbonylContact O-C 3.46Å; E426-G442 WeakPolarHBondContact O-CA 3.36Å; E426-R443 HydrophobicContact CG-CG 3.71Å; E426-R443 PolarHBondContact N-O 2.79Å; E426-R443 PolarHBondContact O-N 2.9Å; E426-R443 IonicContact OE1-CZ 3.11Å; E426-R443 IonicContact OE1-NE 2.64Å; E426-R443 PolarHBondContact OE1-NE 2.9Å; E426-R443 IonicContact OE1-NH2 3.04Å; E426-R443 PolarHBondContact OE1-NH2 2.78Å; E426-P445 HydrophobicContact CG-CB 4.24Å
427	G	89.6	Confident	92.9	Very high	35 Å²	35	38.7 Å²	38.7	36%	0.361	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	70.1	28.2	-176	0	0	0	0	0	114.1	G442	G427-G442 WeakPolarHBondContact O-CA 3.42Å; G427-G442 PolarHBondContact O-N 2.87Å
428	M	93.3	Very high	93.2	Very high	10 Å²	10	34.6 Å²	34.6	5%	0.049	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	166	175.7	64.3	177.4	-142.8	0	0	111.6	A386 A398 Q400 R421 R425 E426 I439 L440	A386-M428 HydrophobicContact CB-CE 4.22Å; A398-M428 HydrophobicContact CB-CE 3.41Å; A398-M428 VanDerWaalsContact CB-CE 3.41Å; Q400-M428 HydrophobicContact CG-CE 3.96Å; Q400-M428 HydrophobicContact CG-CG 4.01Å; Q400-M428 HydrophobicContact CG-SD 4.28Å; Q400-M428 PolarHBondContact NE2-O 2.78Å; Q400-M428 VanDerWaalsContact NE2-O 3.1Å; R421-M428 VanDerWaalsContact CZ-CE 3.45Å; R421-M428 VanDerWaalsContact CZ-SD 3.6Å; R421-M428 VanDerWaalsContact NH1-CE 3.35Å; R421-M428 PolarHBondContact NH1-SD 2.88Å; R421-M428 VanDerWaalsContact NH2-CE 3.33Å; R421-M428 PolarHBondContact NH2-SD 3.29Å; R425-M428 HydrophobicContact CB-CB 4.2Å; R425-M428 HydrophobicContact CB-CG 4.27Å; R425-M428 HydrophobicContact CB-SD 3.81Å; R425-M428 HydrophobicContact CG-SD 4.26Å; E426-M428 VanDerWaalsContact C-N 3.35Å; M428-I439 HydrophobicContact CB-CG2 4.36Å; M428-I439 HydrophobicContact CE-CD1 4.26Å; M428-I439 HydrophobicContact CE-CG2 3.99Å; M428-I439 HydrophobicContact CG-CG2 4.38Å; M428-I439 HydrophobicContact SD-CG2 3.54Å; M428-I439 VanDerWaalsContact SD-CG2 3.54Å; M428-L440 WeakPolarHBondContact CB-O 3.27Å
429	D	94.1	Very high	93.4	Very high	30 Å²	30	33.2 Å²	33.2	16%	0.16	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	162	172.3	-160.6	9.2	0	0	0	111.6	L440 F477 L479	D429-L440 PolarHBondContact N-O 2.84Å; D429-L440 PolarHBondContact O-N 2.98Å; D429-F477 HydrophobicContact CB-CE1 4.23Å; D429-F477 HydrophobicContact CB-CE2 3.86Å; D429-F477 HydrophobicContact CB-CZ 3.61Å; D429-L479 HydrophobicContact CB-CB 3.99Å; D429-L479 WeakPolarHBondContact OD2-CB 3.39Å; D429-L479 PolarHBondContact OD2-N 2.88Å
430	V	95.6	Very high	93.6	Very high	5 Å²	5	31.8 Å²	31.8	3%	0.03	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	140.3	-171.8	68.5	0	0	0	0	112.1	A386 V387 C388 I437 Y438 I439	A386-V430 VanDerWaalsContact C-CG1 3.41Å; A386-V430 HydrophobicContact CB-CB 4.15Å; A386-V430 HydrophobicContact CB-CG1 3.69Å; V387-V430 VanDerWaalsContact C-CG1 3.48Å; V387-V430 VanDerWaalsContact N-CG1 3.33Å; C388-V430 HydrophobicContact CB-CG1 4Å; C388-V430 WeakPolarHBondContact CB-O 3.36Å; V430-I437 HydrophobicContact CG2-CG2 3.29Å; V430-Y438 VanDerWaalsContact CA-O 3.31Å; V430-Y438 WeakPolarHBondContact CA-O 3.38Å; V430-I439 HydrophobicContact CB-CG1 4.05Å; V430-I439 HydrophobicContact CG2-CD1 4.23Å; V430-I439 HydrophobicContact CG2-CG1 3.64Å
431	A	96.4	Very high	93.6	Very high	4 Å²	4	27.8 Å²	27.8	3%	0.033	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	146.6	175.5	0	0	0	0	0	112.2	I437 Y438 L479 V481 L486	A431-I437 CarbonylContact O-C 3.55Å; A431-I437 WeakPolarHBondContact O-CA 3.33Å; A431-Y438 PolarHBondContact N-O 2.94Å; A431-Y438 PolarHBondContact O-N 2.89Å; A431-L479 HydrophobicContact CB-CB 4.49Å; A431-L479 HydrophobicContact CB-CD2 3.55Å; A431-L479 HydrophobicContact CB-CG 3.64Å; A431-V481 HydrophobicContact CB-CG2 3.81Å; A431-L486 HydrophobicContact CB-CD2 4.05Å
432	Y	96.4	Very high	93.7	Very high	36 Å²	36	27.4 Å²	27.4	14%	0.141	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	128.8	173.5	179.5	-81.7	0	0	0	110	P391 Y396 G435 Y436 I437 V459 V481	P391-Y432 VanDerWaalsContact CD-CD1 3.46Å; P391-Y432 HydrophobicContact CG-CD1 4.45Å; P391-Y432 HydrophobicContact CG-CE1 4.02Å; Y396-Y432 HydrophobicContact CD2-CD2 4.42Å; Y396-Y432 AromaticContact CE2-CD2 3.92Å; Y396-Y432 HydrophobicContact CE2-CD2 3.92Å; Y396-Y432 HydrophobicContact CE2-CE2 4.27Å; Y432-G435 VanDerWaalsContact OH-CA 3.31Å; Y432-G435 WeakPolarHBondContact OH-CA 3.44Å; Y432-G435 PolarHBondContact OH-N 2.87Å; Y432-Y436 CarbonylContact C-O 3.53Å; Y432-Y436 WeakPolarHBondContact CA-O 3.19Å; Y432-I437 HydrophobicContact CD2-CG1 4.16Å; Y432-V459 HydrophobicContact CE2-CG2 4.13Å; Y432-V481 VanDerWaalsContact O-CG2 3.24Å; Y432-V481 WeakPolarHBondContact O-CG2 3.37Å
433	L	95.9	Very high	93.8	Very high	4 Å²	4	28 Å²	28	2%	0.021	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	123	175.1	173.2	60.4	0	0	0	110.6	G435 Y436 Y438 V481 L486 P499	L433-G435 VanDerWaalsContact C-N 3.33Å; L433-G435 PolarHBondContact O-N 2.73Å; L433-Y436 PolarHBondContact N-O 2.85Å; L433-Y436 WeakPolarHBondContact O-CB 3.49Å; L433-Y436 PolarHBondContact O-N 2.77Å; L433-Y438 HydrophobicContact CB-CD2 4.18Å; L433-Y438 HydrophobicContact CB-CE2 3.93Å; L433-Y438 HydrophobicContact CD2-CE2 4.43Å; L433-Y438 HydrophobicContact CG-CE2 4.46Å; L433-V481 HydrophobicContact CB-CG1 4.4Å; L433-V481 HydrophobicContact CB-CG2 4.4Å; L433-V481 HydrophobicContact CD1-CG1 3.77Å; L433-L486 HydrophobicContact CB-CD2 3.84Å; L433-L486 HydrophobicContact CD2-CD1 4.45Å; L433-L486 HydrophobicContact CD2-CD2 3.65Å; L433-L486 HydrophobicContact CD2-CG 3.66Å; L433-L486 HydrophobicContact CG-CD2 4.38Å; L433-P499 HydrophobicContact CD2-CG 3.54Å
434	N	90.9	Very high	93.8	Very high	100 Å²	100	27.8 Å²	27.8	54%	0.535	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.5	41.2	170.7	-65.7	-15.4	0	0	0	115.6	Y436 D484	N434-Y436 VanDerWaalsContact C-N 3.33Å; N434-Y436 WeakPolarHBondContact O-CD2 3.35Å; N434-Y436 WeakPolarHBondContact O-CE2 3.49Å; N434-D484 PolarHBondContact ND2-OD1 3Å
435	G	90.9	Very high	93.8	Very high	19 Å²	19	27.6 Å²	27.6	20%	0.196	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.4	6	-179.6	0	0	0	0	0	114.5	Y432 L433 V459	Y432-G435 VanDerWaalsContact OH-CA 3.31Å; Y432-G435 WeakPolarHBondContact OH-CA 3.44Å; Y432-G435 PolarHBondContact OH-N 2.87Å; L433-G435 VanDerWaalsContact C-N 3.33Å; L433-G435 PolarHBondContact O-N 2.73Å; G435-V459 WeakPolarHBondContact O-CB 3.41Å; G435-V459 WeakPolarHBondContact O-CG2 3.32Å; G435-V459 PolarHBondContact O-N 2.83Å
436	Y	95.4	Very high	93.7	Very high	91 Å²	91	35.1 Å²	35.1	36%	0.357	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	146.9	178.2	-60.3	-90.3	0	0	0	111.3	Y432 L433 N434 C456 Y457 N458	Y432-Y436 CarbonylContact C-O 3.53Å; Y432-Y436 WeakPolarHBondContact CA-O 3.19Å; L433-Y436 PolarHBondContact N-O 2.85Å; L433-Y436 WeakPolarHBondContact O-CB 3.49Å; L433-Y436 PolarHBondContact O-N 2.77Å; N434-Y436 VanDerWaalsContact C-N 3.33Å; N434-Y436 WeakPolarHBondContact O-CD2 3.35Å; N434-Y436 WeakPolarHBondContact O-CE2 3.49Å; Y436-C456 VanDerWaalsContact CD1-SG 3.54Å; Y436-Y457 CarbonylContact C-O 3.49Å; Y436-Y457 WeakPolarHBondContact CA-O 3.49Å; Y436-N458 HydrophobicContact CD1-CB 3.97Å; Y436-N458 HydrophobicContact CE1-CB 3.75Å; Y436-N458 VanDerWaalsContact CE1-ND2 3.32Å; Y436-N458 WeakPolarHBondContact CE1-ND2 3.37Å; Y436-N458 PolarHBondContact OH-ND2 3.2Å
437	I	97.1	Very high	93.8	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	125.7	172	-56.2	170.8	0	0	0	108.1	Y396 L405 V430 A431 Y432 I439 C456 Y457 V459	Y396-I437 HydrophobicContact CD1-CD1 3.18Å; Y396-I437 HydrophobicContact CD1-CG1 4.39Å; Y396-I437 HydrophobicContact CD2-CD1 4.1Å; Y396-I437 HydrophobicContact CE1-CD1 3.48Å; Y396-I437 VanDerWaalsContact CE1-CD1 3.48Å; Y396-I437 HydrophobicContact CE2-CD1 4.37Å; Y396-I437 HydrophobicContact CG-CD1 3.5Å; Y396-I437 HydrophobicContact CG-CG1 4.38Å; L405-I437 HydrophobicContact CD2-CD1 4Å; V430-I437 HydrophobicContact CG2-CG2 3.29Å; A431-I437 CarbonylContact O-C 3.55Å; A431-I437 WeakPolarHBondContact O-CA 3.33Å; Y432-I437 HydrophobicContact CD2-CG1 4.16Å; I437-I439 HydrophobicContact CG2-CG1 4.47Å; I437-C456 CarbonylContact O-C 3.55Å; I437-C456 WeakPolarHBondContact O-CA 3.12Å; I437-Y457 HydrophobicContact CB-CD1 4.28Å; I437-Y457 HydrophobicContact CD1-CD1 3.67Å; I437-Y457 HydrophobicContact CD1-CE1 4.11Å; I437-Y457 HydrophobicContact CG1-CD1 4.11Å; I437-Y457 PolarHBondContact N-O 2.88Å; I437-Y457 PolarHBondContact O-N 3.03Å; I437-V459 HydrophobicContact CD1-CG2 4.1Å; I437-V459 HydrophobicContact CG1-CG2 4Å
438	Y	97.3	Very high	93.8	Very high	12 Å²	12	37.4 Å²	37.4	5%	0.047	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	129.9	179	-65.9	-93.8	0	0	0	109.9	V430 A431 L433 V454 E455 C456 V467 L486 Y497	V430-Y438 VanDerWaalsContact CA-O 3.31Å; V430-Y438 WeakPolarHBondContact CA-O 3.38Å; A431-Y438 PolarHBondContact N-O 2.94Å; A431-Y438 PolarHBondContact O-N 2.89Å; L433-Y438 HydrophobicContact CB-CD2 4.18Å; L433-Y438 HydrophobicContact CB-CE2 3.93Å; L433-Y438 HydrophobicContact CD2-CE2 4.43Å; L433-Y438 HydrophobicContact CG-CE2 4.46Å; Y438-V454 HydrophobicContact CD1-CG1 4.4Å; Y438-E455 CarbonylContact C-O 3.54Å; Y438-E455 WeakPolarHBondContact CA-O 2.98Å; Y438-C456 HydrophobicContact CD1-CB 4.04Å; Y438-C456 HydrophobicContact CE1-CB 3.9Å; Y438-C456 VanDerWaalsContact CE1-SG 3.6Å; Y438-V467 HydrophobicContact CD1-CG2 4.44Å; Y438-V467 HydrophobicContact CE1-CG2 4.37Å; Y438-L486 HydrophobicContact CD1-CD1 3.74Å; Y438-L486 HydrophobicContact CD2-CD1 3.63Å; Y438-L486 HydrophobicContact CD2-CD2 4.38Å; Y438-L486 HydrophobicContact CE1-CD1 4.26Å; Y438-L486 HydrophobicContact CE2-CD1 4.16Å; Y438-L486 HydrophobicContact CG-CD1 3.39Å; Y438-Y497 HydrophobicContact CD1-CE1 4.35Å; Y438-Y497 HydrophobicContact CE1-CD1 4.4Å; Y438-Y497 AromaticContact CE1-CE1 3.69Å; Y438-Y497 HydrophobicContact CE1-CE1 3.69Å
439	I	96.1	Very high	93.8	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	129.8	174.3	-64.4	177.5	0	0	0	108.4	A398 R421 M428 V430 I437 E455 W464	A398-I439 HydrophobicContact CB-CD1 4.25Å; R421-I439 HydrophobicContact CG-CD1 4.38Å; M428-I439 HydrophobicContact CB-CG2 4.36Å; M428-I439 HydrophobicContact CE-CD1 4.26Å; M428-I439 HydrophobicContact CE-CG2 3.99Å; M428-I439 HydrophobicContact CG-CG2 4.38Å; M428-I439 HydrophobicContact SD-CG2 3.54Å; M428-I439 VanDerWaalsContact SD-CG2 3.54Å; V430-I439 HydrophobicContact CB-CG1 4.05Å; V430-I439 HydrophobicContact CG2-CD1 4.23Å; V430-I439 HydrophobicContact CG2-CG1 3.64Å; I437-I439 HydrophobicContact CG2-CG1 4.47Å; I439-E455 HydrophobicContact CB-CB 4.35Å; I439-E455 PolarHBondContact N-O 3.45Å; I439-E455 PolarHBondContact O-N 3.05Å; I439-W464 HydrophobicContact CD1-CH2 3.59Å; I439-W464 HydrophobicContact CD1-CZ3 4.02Å; I439-W464 HydrophobicContact CG1-CH2 4.37Å; I439-W464 HydrophobicContact CG1-CZ3 4.44Å
440	L	95.8	Very high	93.8	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	172.7	-178.8	60.3	99.9	0	0	0	113	M428 D429 V454 L470 F477 L479 A488 W504	M428-L440 WeakPolarHBondContact CB-O 3.27Å; D429-L440 PolarHBondContact N-O 2.84Å; D429-L440 PolarHBondContact O-N 2.98Å; L440-V454 HydrophobicContact CB-CB 4.37Å; L440-V454 HydrophobicContact CB-CG1 4.14Å; L440-V454 HydrophobicContact CB-CG2 3.89Å; L440-V454 HydrophobicContact CD2-CG1 4.19Å; L440-L470 HydrophobicContact CB-CD1 4.21Å; L440-L470 HydrophobicContact CD1-CD1 3.81Å; L440-L470 HydrophobicContact CD1-CD2 4.18Å; L440-L470 HydrophobicContact CD1-CG 4.39Å; L440-F477 HydrophobicContact CD1-CD2 4.45Å; L440-F477 HydrophobicContact CD1-CE2 3.41Å; L440-F477 VanDerWaalsContact CD1-CE2 3.41Å; L440-F477 HydrophobicContact CD1-CZ 3.54Å; L440-F477 HydrophobicContact CG-CE2 4.37Å; L440-F477 HydrophobicContact CG-CZ 4.29Å; L440-F477 VanDerWaalsContact O-CZ 3.31Å; L440-F477 WeakPolarHBondContact O-CZ 3.38Å; L440-L479 HydrophobicContact CD1-CD1 4.41Å; L440-L479 HydrophobicContact CD2-CD1 3.77Å; L440-L479 HydrophobicContact CD2-CD2 3.77Å; L440-L479 HydrophobicContact CD2-CG 4.44Å; L440-L479 HydrophobicContact CG-CD1 4.37Å; L440-L479 HydrophobicContact CG-CD2 4.02Å; L440-A488 HydrophobicContact CD1-CB 4.19Å; L440-W504 HydrophobicContact CD2-CH2 3.65Å; L440-W504 HydrophobicContact CD2-CZ2 3.88Å
441	G	93.9	Very high	93.7	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	70.2	-156.7	-177.9	0	0	0	0	0	112.7	R425 F474	R425-G441 WeakPolarHBondContact CD-O 3.45Å; R425-G441 PolarHBondContact NH1-O 3.17Å; G441-F474 CarbonylContact C-O 3.53Å; G441-F474 WeakPolarHBondContact CA-O 3.43Å
442	G	93.4	Very high	93.7	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	74.2	-170.7	-176.5	0	0	0	0	0	113.9	E426 G427 L451 F474	E426-G442 CarbonylContact O-C 3.46Å; E426-G442 WeakPolarHBondContact O-CA 3.36Å; G427-G442 WeakPolarHBondContact O-CA 3.42Å; G427-G442 PolarHBondContact O-N 2.87Å; G442-L451 PolarHBondContact O-N 2.81Å; G442-F474 PolarHBondContact N-O 2.85Å
443	R	93.7	Very high	93.7	Very high	107 Å²	107	52.6 Å²	52.6	40%	0.404	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	157.9	175.4	64.3	-174.7	-174.8	-168.9	-0.1	110.4	R425 E426 V449 L475	R425-R443 WeakPolarHBondContact CA-O 3.31Å; E426-R443 HydrophobicContact CG-CG 3.71Å; E426-R443 PolarHBondContact N-O 2.79Å; E426-R443 PolarHBondContact O-N 2.9Å; E426-R443 IonicContact OE1-CZ 3.11Å; E426-R443 IonicContact OE1-NE 2.64Å; E426-R443 PolarHBondContact OE1-NE 2.9Å; E426-R443 IonicContact OE1-NH2 3.04Å; E426-R443 PolarHBondContact OE1-NH2 2.78Å; R443-V449 CarbonylContact C-O 3.59Å; R443-V449 WeakPolarHBondContact CA-O 3.43Å; R443-V449 VanDerWaalsContact CB-O 3.31Å; R443-V449 WeakPolarHBondContact CB-O 3.2Å; R443-L475 HydrophobicContact CB-CD2 4.36Å; R443-L475 HydrophobicContact CG-CD2 4.18Å
444	D	92.6	Very high	93.7	Very high	46 Å²	46	52.4 Å²	52.4	25%	0.246	27%	0.272	C	S	.	.			trans	-63.6	126.1	169.6	-179.7	-52.1	0	0	0	109	I446 T447 G448 V449	D444-I446 VanDerWaalsContact C-N 3.27Å; D444-I446 PolarHBondContact O-N 2.83Å; D444-I446 WeakPolarHBondContact OD1-CA 3.49Å; D444-I446 WeakPolarHBondContact OD1-CB 2.87Å; D444-I446 PolarHBondContact OD1-N 2.83Å; D444-T447 WeakPolarHBondContact CB-OG1 3.46Å; D444-T447 PolarHBondContact OD1-N 2.83Å; D444-T447 PolarHBondContact OD1-OG1 3.33Å; D444-T447 PolarHBondContact OD2-OG1 2.98Å; D444-G448 WeakPolarHBondContact O-CA 3.45Å; D444-G448 PolarHBondContact O-N 3.41Å; D444-V449 PolarHBondContact N-O 2.87Å
445	P	90	Very high	94	Very high	40 Å²	40	47.6 Å²	47.6	26%	0.26	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-20.7	-175.6	30.6	-39.3	0	0	0	113.8	P401 C424 E426	P401-P445 HydrophobicContact CB-CB 3.61Å; P401-P445 HydrophobicContact CB-CG 3.77Å; P401-P445 HydrophobicContact CG-CB 4.16Å; C424-P445 WeakPolarHBondContact O-CD 3.37Å; E426-P445 HydrophobicContact CG-CB 4.24Å
446	I	89.2	Confident	94.3	Very high	157 Å²	157	47.2 Å²	47.2	81%	0.805	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.4	-49.9	-178.9	-59.6	173.2	0	0	0	109.8	D444	D444-I446 VanDerWaalsContact C-N 3.27Å; D444-I446 PolarHBondContact O-N 2.83Å; D444-I446 WeakPolarHBondContact OD1-CA 3.49Å; D444-I446 WeakPolarHBondContact OD1-CB 2.87Å; D444-I446 PolarHBondContact OD1-N 2.83Å
447	T	91.8	Very high	94.3	Very high	87 Å²	87	42.9 Å²	42.9	53%	0.534	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-18.1	-174.4	67.2	0	0	0	0	113.3	D444 V449	D444-T447 WeakPolarHBondContact CB-OG1 3.46Å; D444-T447 PolarHBondContact OD1-N 2.83Å; D444-T447 PolarHBondContact OD1-OG1 3.33Å; D444-T447 PolarHBondContact OD2-OG1 2.98Å; T447-V449 PolarHBondContact O-N 3.3Å; T447-V449 WeakPolarHBondContact OG1-CG2 3.45Å; T447-V449 PolarHBondContact OG1-N 3.15Å
448	G	90.3	Very high	94.2	Very high	37 Å²	37	44 Å²	44	38%	0.381	23%	0.23	S	C	.	.			trans	71.5	3.3	-175	0	0	0	0	0	114.2	D444 K450	D444-G448 WeakPolarHBondContact O-CA 3.45Å; D444-G448 PolarHBondContact O-N 3.41Å; G448-K450 PolarHBondContact O-N 3.05Å
449	V	93.4	Very high	93.9	Very high	86 Å²	86	45.5 Å²	45.5	52%	0.521	24%	0.24	S	C	.	.	P	Polyproline II helix	trans	-67.4	127.9	-177.8	174.7	0	0	0	0	109.8	R443 D444 T447 L451	R443-V449 CarbonylContact C-O 3.59Å; R443-V449 WeakPolarHBondContact CA-O 3.43Å; R443-V449 VanDerWaalsContact CB-O 3.31Å; R443-V449 WeakPolarHBondContact CB-O 3.2Å; D444-V449 PolarHBondContact N-O 2.87Å; T447-V449 PolarHBondContact O-N 3.3Å; T447-V449 WeakPolarHBondContact OG1-CG2 3.45Å; T447-V449 PolarHBondContact OG1-N 3.15Å; V449-L451 PolarHBondContact O-N 2.84Å
450	K	94.3	Very high	93.4	Very high	124 Å²	124	52.9 Å²	52.9	54%	0.539	27%	0.272	S	S	.	.	B	Isolated β-bridge	trans	-72.6	124.5	178	-53	-173.2	177.2	-174.3	0	110	G448 S473 L475	G448-K450 PolarHBondContact O-N 3.05Å; K450-S473 VanDerWaalsContact CB-OG 3.32Å; K450-S473 WeakPolarHBondContact CB-OG 3.47Å; K450-L475 HydrophobicContact CD-CD1 3.62Å; K450-L475 VanDerWaalsContact CE-CD1 3.44Å; K450-L475 HydrophobicContact CG-CD1 3.79Å
451	L	93.7	Very high	92.8	Very high	20 Å²	20	61.4 Å²	61.4	11%	0.105	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-88.3	149.2	-174.1	-61.8	172.2	0	0	0	111.3	R425 G442 V449 S473	R425-L451 HydrophobicContact CB-CD1 4.34Å; R425-L451 HydrophobicContact CG-CD1 3.62Å; R425-L451 VanDerWaalsContact NH1-CB 3.31Å; G442-L451 PolarHBondContact O-N 2.81Å; V449-L451 PolarHBondContact O-N 2.84Å; L451-S473 WeakPolarHBondContact O-CB 3.23Å
452	K	95.3	Very high	92.6	Very high	95 Å²	95	64.9 Å²	64.9	41%	0.413	32%	0.323	S	S	.	.			trans	-117.2	-17.9	173.7	-66.9	-174.8	-179.3	-166.7	0	112	P469 L470 P471	K452-P469 HydrophobicContact CB-CB 4.32Å; K452-P469 CarbonylContact O-C 3.54Å; K452-P469 VanDerWaalsContact O-CA 3.29Å; K452-P469 WeakPolarHBondContact O-CA 3.23Å; K452-P469 WeakPolarHBondContact O-CB 3.5Å; K452-L470 HydrophobicContact CB-CB 4.5Å; K452-L470 PolarHBondContact O-N 3.31Å; K452-P471 PolarHBondContact NZ-O 2.87Å
453	E	96.3	Very high	92.6	Very high	79 Å²	79	70.7 Å²	70.7	37%	0.369	35%	0.35	S	S	.	.			trans	-60	135.9	-179.9	-63.1	72.5	-161.2	0	0	109.5	L423 R425 L466	L423-E453 HydrophobicContact CD1-CB 3.63Å; L423-E453 HydrophobicContact CD1-CG 4.08Å; R425-E453 VanDerWaalsContact CZ-O 3.27Å; R425-E453 PolarHBondContact NH1-O 2.68Å; R425-E453 PolarHBondContact NH2-O 3.17Å; E453-L466 HydrophobicContact CB-CD2 4.39Å
454	V	97	Very high	92.7	Very high	0 Å²	0	67.2 Å²	67.2	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	122.6	176.9	180	0	0	0	0	107.5	Y438 L440 L466 V467 A468 L470 W504	Y438-V454 HydrophobicContact CD1-CG1 4.4Å; L440-V454 HydrophobicContact CB-CB 4.37Å; L440-V454 HydrophobicContact CB-CG1 4.14Å; L440-V454 HydrophobicContact CB-CG2 3.89Å; L440-V454 HydrophobicContact CD2-CG1 4.19Å; V454-L466 WeakPolarHBondContact O-CA 3.16Å; V454-V467 HydrophobicContact CB-CG2 3.66Å; V454-V467 HydrophobicContact CG1-CG2 3.37Å; V454-V467 PolarHBondContact O-N 2.78Å; V454-A468 WeakPolarHBondContact CG2-O 3.46Å; V454-L470 HydrophobicContact CG2-CG 3.99Å; V454-W504 HydrophobicContact CG2-CZ2 3.93Å
455	E	96.4	Very high	92.8	Very high	0 Å²	0	67.5 Å²	67.5	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	133.4	177.3	-72.4	167.4	99.6	0	0	109.3	L422 L423 R425 Y438 I439 W464 L466	L422-E455 WeakPolarHBondContact CA-OE1 3.44Å; L422-E455 HydrophobicContact CB-CG 4.46Å; L422-E455 WeakPolarHBondContact CB-OE1 3.38Å; L422-E455 PolarHBondContact N-OE1 3.01Å; L423-E455 HydrophobicContact CD1-CG 4.44Å; L423-E455 PolarHBondContact N-OE1 3.38Å; R425-E455 IonicContact CZ-OE2 3.9Å; R425-E455 VanDerWaalsContact CZ-OE2 3.29Å; R425-E455 IonicContact NE-OE2 3.14Å; R425-E455 PolarHBondContact NE-OE2 3Å; R425-E455 IonicContact NH2-OE2 3.83Å; R425-E455 PolarHBondContact NH2-OE2 3.49Å; Y438-E455 CarbonylContact C-O 3.54Å; Y438-E455 WeakPolarHBondContact CA-O 2.98Å; I439-E455 HydrophobicContact CB-CB 4.35Å; I439-E455 PolarHBondContact N-O 3.45Å; I439-E455 PolarHBondContact O-N 3.05Å; E455-W464 HydrophobicContact CB-CE3 3.81Å; E455-W464 HydrophobicContact CB-CZ3 3.84Å; E455-L466 HydrophobicContact CG-CD2 3.8Å
456	C	96.9	Very high	93.2	Very high	10 Å²	10	70.5 Å²	70.5	7%	0.068	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	120.2	177.1	178.1	0	0	0	0	108.6	Y436 I437 Y438 W464 A465 V467	Y436-C456 VanDerWaalsContact CD1-SG 3.54Å; I437-C456 CarbonylContact O-C 3.55Å; I437-C456 WeakPolarHBondContact O-CA 3.12Å; Y438-C456 HydrophobicContact CD1-CB 4.04Å; Y438-C456 HydrophobicContact CE1-CB 3.9Å; Y438-C456 VanDerWaalsContact CE1-SG 3.6Å; C456-W464 CarbonylContact O-C 3.57Å; C456-A465 PolarHBondContact N-O 2.84Å; C456-A465 PolarHBondContact O-N 2.82Å; C456-V467 HydrophobicContact CB-CG1 3.56Å; C456-V467 HydrophobicContact CB-CG2 4.28Å
457	Y	97.1	Very high	93.5	Very high	1 Å²	1	64.4 Å²	64.4	0%	0.004	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	127.5	177.8	171.9	-100.2	0	0	0	110.6	L405 L418 A419 Y436 I437 V459 N462 Q463 W464	L405-Y457 HydrophobicContact CD2-CD1 4.11Å; L405-Y457 HydrophobicContact CD2-CE1 4.17Å; L405-Y457 HydrophobicContact CD2-CG 4.31Å; L418-Y457 HydrophobicContact CD1-CE1 3.89Å; A419-Y457 HydrophobicContact CB-CE2 4.23Å; Y436-Y457 CarbonylContact C-O 3.49Å; Y436-Y457 WeakPolarHBondContact CA-O 3.49Å; I437-Y457 HydrophobicContact CB-CD1 4.28Å; I437-Y457 HydrophobicContact CD1-CD1 3.67Å; I437-Y457 HydrophobicContact CD1-CE1 4.11Å; I437-Y457 HydrophobicContact CG1-CD1 4.11Å; I437-Y457 PolarHBondContact N-O 2.88Å; I437-Y457 PolarHBondContact O-N 3.03Å; Y457-V459 HydrophobicContact CD1-CG2 4.03Å; Y457-V459 HydrophobicContact CE1-CB 4.32Å; Y457-V459 HydrophobicContact CE1-CG2 3.95Å; Y457-N462 WeakPolarHBondContact CE2-OD1 3.16Å; Y457-N462 WeakPolarHBondContact OH-CA 3.38Å; Y457-N462 PolarHBondContact OH-OD1 2.84Å; Y457-Q463 WeakPolarHBondContact CA-O 3.48Å; Y457-Q463 WeakPolarHBondContact CD2-O 3.19Å; Y457-W464 VanDerWaalsContact CB-CZ3 3.44Å; Y457-W464 AromaticContact CD2-CD1 3.89Å; Y457-W464 AromaticContact CD2-CD2 3.84Å; Y457-W464 HydrophobicContact CD2-CD2 3.84Å; Y457-W464 AromaticContact CD2-CE2 3.46Å; Y457-W464 VanDerWaalsContact CD2-CE2 3.46Å; Y457-W464 HydrophobicContact CD2-CG 4.05Å; Y457-W464 AromaticContact CD2-CZ2 3.83Å; Y457-W464 HydrophobicContact CD2-CZ2 3.83Å; Y457-W464 AromaticContact CD2-NE1 3.52Å; Y457-W464 HydrophobicContact CG-CD2 4.22Å; Y457-W464 AromaticContact CG-CE2 3.93Å; Y457-W464 HydrophobicContact CG-CE3 4.49Å; Y457-W464 HydrophobicContact CG-CH2 4.18Å; Y457-W464 AromaticContact CG-CZ2 3.9Å; Y457-W464 HydrophobicContact CG-CZ2 3.9Å; Y457-W464 HydrophobicContact CG-CZ3 4.48Å
458	N	93.8	Very high	93.7	Very high	24 Å²	24	61.2 Å²	61.2	13%	0.128	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	112.3	173.5	-176.3	-49.6	0	0	0	109.6	Y436 K460 R461 N462 Q463	Y436-N458 HydrophobicContact CD1-CB 3.97Å; Y436-N458 HydrophobicContact CE1-CB 3.75Å; Y436-N458 VanDerWaalsContact CE1-ND2 3.32Å; Y436-N458 WeakPolarHBondContact CE1-ND2 3.37Å; Y436-N458 PolarHBondContact OH-ND2 3.2Å; N458-K460 VanDerWaalsContact C-N 3.31Å; N458-K460 PolarHBondContact O-N 2.85Å; N458-K460 WeakPolarHBondContact OD1-CB 3.42Å; N458-K460 PolarHBondContact OD1-N 3.43Å; N458-R461 HydrophobicContact CB-CB 4.2Å; N458-R461 PolarHBondContact O-N 2.9Å; N458-R461 PolarHBondContact OD1-N 2.69Å; N458-N462 PolarHBondContact O-N 3.36Å; N458-Q463 PolarHBondContact N-O 2.88Å
459	V	90.9	Very high	94	Very high	42 Å²	42	63.2 Å²	63.2	26%	0.255	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-38.6	-176.4	177.6	0	0	0	0	112.1	Y396 Y432 G435 I437 Y457	Y396-V459 HydrophobicContact CE1-CG2 4.47Å; Y396-V459 WeakPolarHBondContact OH-CG1 3.26Å; Y432-V459 HydrophobicContact CE2-CG2 4.13Å; G435-V459 WeakPolarHBondContact O-CB 3.41Å; G435-V459 WeakPolarHBondContact O-CG2 3.32Å; G435-V459 PolarHBondContact O-N 2.83Å; I437-V459 HydrophobicContact CD1-CG2 4.1Å; I437-V459 HydrophobicContact CG1-CG2 4Å; Y457-V459 HydrophobicContact CD1-CG2 4.03Å; Y457-V459 HydrophobicContact CE1-CB 4.32Å; Y457-V459 HydrophobicContact CE1-CG2 3.95Å
460	K	85.2	Confident	94.1	Very high	156 Å²	156	59.3 Å²	59.3	68%	0.678	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-36.7	-179.6	-64.4	-165	173.3	-155.5	0	113	D169 N458	D169-K460 IonicContact OD1-NZ 3.5Å; D169-K460 PolarHBondContact OD1-NZ 2.85Å; D169-K460 IonicContact OD2-NZ 2.71Å; D169-K460 PolarHBondContact OD2-NZ 2.6Å; N458-K460 VanDerWaalsContact C-N 3.31Å; N458-K460 PolarHBondContact O-N 2.85Å; N458-K460 WeakPolarHBondContact OD1-CB 3.42Å; N458-K460 PolarHBondContact OD1-N 3.43Å
461	R	84.3	Confident	94	Very high	178 Å²	178	55.8 Å²	55.8	67%	0.672	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	-13.1	-176.3	-67.5	-175.7	174.2	178.7	-0.5	113.7	N458 Q463	N458-R461 HydrophobicContact CB-CB 4.2Å; N458-R461 PolarHBondContact O-N 2.9Å; N458-R461 PolarHBondContact OD1-N 2.69Å; R461-Q463 VanDerWaalsContact C-N 3.31Å; R461-Q463 HydrophobicContact CB-CB 4.26Å; R461-Q463 HydrophobicContact CB-CG 4.38Å; R461-Q463 WeakPolarHBondContact O-CG 3.2Å; R461-Q463 PolarHBondContact O-N 2.83Å
462	N	89.6	Confident	93.9	Very high	74 Å²	74	58.5 Å²	58.5	40%	0.396	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.2	49.6	-171.9	-170.9	22.1	0	0	0	112.1	A419 Y457 N458	A419-N462 WeakPolarHBondContact CB-OD1 3.34Å; A419-N462 PolarHBondContact N-OD1 2.78Å; Y457-N462 WeakPolarHBondContact CE2-OD1 3.16Å; Y457-N462 WeakPolarHBondContact OH-CA 3.38Å; Y457-N462 PolarHBondContact OH-OD1 2.84Å; N458-N462 PolarHBondContact O-N 3.36Å
463	Q	92.3	Very high	93.6	Very high	121 Å²	121	55.8 Å²	55.8	57%	0.565	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.9	143.8	-173.3	-76.8	175.6	0.4	0	0	111.4	Y457 N458 R461	Y457-Q463 WeakPolarHBondContact CA-O 3.48Å; Y457-Q463 WeakPolarHBondContact CD2-O 3.19Å; N458-Q463 PolarHBondContact N-O 2.88Å; R461-Q463 VanDerWaalsContact C-N 3.31Å; R461-Q463 HydrophobicContact CB-CB 4.26Å; R461-Q463 HydrophobicContact CB-CG 4.38Å; R461-Q463 WeakPolarHBondContact O-CG 3.2Å; R461-Q463 PolarHBondContact O-N 2.83Å
464	W	96.3	Very high	93.3	Very high	34 Å²	34	52 Å²	52	13%	0.129	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	147.1	175.9	-67.3	93.7	0	0	0	112	L405 A419 D420 R421 L422 I439 E455 C456 Y457	L405-W464 HydrophobicContact CB-CZ2 4.21Å; L405-W464 HydrophobicContact CD2-CH2 4Å; L405-W464 HydrophobicContact CD2-CZ2 3.51Å; L405-W464 HydrophobicContact CG-CZ2 4.35Å; A419-W464 PolarHBondContact O-NE1 3.02Å; D420-W464 PolarHBondContact O-NE1 2.93Å; R421-W464 HydrophobicContact CB-CZ2 4.4Å; R421-W464 HydrophobicContact CG-CH2 3.73Å; R421-W464 HydrophobicContact CG-CZ2 3.41Å; R421-W464 VanDerWaalsContact CG-CZ2 3.41Å; R421-W464 HydrophobicContact CG-CZ3 4.4Å; L422-W464 HydrophobicContact CD1-CB 3.89Å; L422-W464 HydrophobicContact CD2-CB 4Å; L422-W464 HydrophobicContact CG-CB 3.68Å; L422-W464 HydrophobicContact CG-CG 4.34Å; I439-W464 HydrophobicContact CD1-CH2 3.59Å; I439-W464 HydrophobicContact CD1-CZ3 4.02Å; I439-W464 HydrophobicContact CG1-CH2 4.37Å; I439-W464 HydrophobicContact CG1-CZ3 4.44Å; E455-W464 HydrophobicContact CB-CE3 3.81Å; E455-W464 HydrophobicContact CB-CZ3 3.84Å; C456-W464 CarbonylContact O-C 3.57Å; Y457-W464 VanDerWaalsContact CB-CZ3 3.44Å; Y457-W464 AromaticContact CD2-CD1 3.89Å; Y457-W464 AromaticContact CD2-CD2 3.84Å; Y457-W464 HydrophobicContact CD2-CD2 3.84Å; Y457-W464 AromaticContact CD2-CE2 3.46Å; Y457-W464 VanDerWaalsContact CD2-CE2 3.46Å; Y457-W464 HydrophobicContact CD2-CG 4.05Å; Y457-W464 AromaticContact CD2-CZ2 3.83Å; Y457-W464 HydrophobicContact CD2-CZ2 3.83Å; Y457-W464 AromaticContact CD2-NE1 3.52Å; Y457-W464 HydrophobicContact CG-CD2 4.22Å; Y457-W464 AromaticContact CG-CE2 3.93Å; Y457-W464 HydrophobicContact CG-CE3 4.49Å; Y457-W464 HydrophobicContact CG-CH2 4.18Å; Y457-W464 AromaticContact CG-CZ2 3.9Å; Y457-W464 HydrophobicContact CG-CZ2 3.9Å; Y457-W464 HydrophobicContact CG-CZ3 4.48Å
465	A	95.6	Very high	92.8	Very high	53 Å²	53	54.3 Å²	54.3	44%	0.438	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	155	169.1	0	0	0	0	0	110	C456	C456-A465 PolarHBondContact N-O 2.84Å; C456-A465 PolarHBondContact O-N 2.82Å
466	L	96.8	Very high	92.2	Very high	103 Å²	103	59.4 Å²	59.4	54%	0.539	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	136.3	168.6	-65.7	175.6	0	0	0	109.6	L422 L423 E453 V454 E455	L422-L466 HydrophobicContact CD1-CD2 4Å; L422-L466 HydrophobicContact CD1-CG 3.94Å; L423-L466 HydrophobicContact CD1-CD2 4.44Å; E453-L466 HydrophobicContact CB-CD2 4.39Å; V454-L466 WeakPolarHBondContact O-CA 3.16Å; E455-L466 HydrophobicContact CG-CD2 3.8Å
467	V	96.8	Very high	92	Very high	28 Å²	28	59.5 Å²	59.5	17%	0.17	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	-177	174.1	-61.1	0	0	0	0	110.2	Y438 V454 C456 Y497 N502	Y438-V467 HydrophobicContact CD1-CG2 4.44Å; Y438-V467 HydrophobicContact CE1-CG2 4.37Å; V454-V467 HydrophobicContact CB-CG2 3.66Å; V454-V467 HydrophobicContact CG1-CG2 3.37Å; V454-V467 PolarHBondContact O-N 2.78Å; C456-V467 HydrophobicContact CB-CG1 3.56Å; C456-V467 HydrophobicContact CB-CG2 4.28Å; V467-Y497 WeakPolarHBondContact CB-OH 3.38Å; V467-N502 WeakPolarHBondContact CB-OD1 3.29Å
468	A	95.9	Very high	91.8	Very high	20 Å²	20	60.6 Å²	60.6	17%	0.165	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-53.6	127.1	-174	0	0	0	0	0	111.4	V454 Y497 N502 W504	V454-A468 WeakPolarHBondContact CG2-O 3.46Å; A468-Y497 HydrophobicContact CB-CE2 4.32Å; A468-N502 WeakPolarHBondContact CB-O 3.46Å; A468-N502 VanDerWaalsContact CB-OD1 3.23Å; A468-N502 WeakPolarHBondContact CB-OD1 3.27Å; A468-N502 PolarHBondContact N-OD1 3.37Å; A468-W504 PolarHBondContact O-NE1 2.88Å
469	P	96.4	Very high	91.9	Very high	80 Å²	80	60.1 Å²	60.1	52%	0.519	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-69	152.2	-176.2	29.1	-35.2	0	0	0	110.6	K452	K452-P469 HydrophobicContact CB-CB 4.32Å; K452-P469 CarbonylContact O-C 3.54Å; K452-P469 VanDerWaalsContact O-CA 3.29Å; K452-P469 WeakPolarHBondContact O-CA 3.23Å; K452-P469 WeakPolarHBondContact O-CB 3.5Å
470	L	94.6	Very high	92.1	Very high	3 Å²	3	58.8 Å²	58.8	2%	0.016	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-57.7	137.2	172.4	-73.9	166.8	0	0	0	110.4	L440 K452 V454 H472 F474 W504	L440-L470 HydrophobicContact CB-CD1 4.21Å; L440-L470 HydrophobicContact CD1-CD1 3.81Å; L440-L470 HydrophobicContact CD1-CD2 4.18Å; L440-L470 HydrophobicContact CD1-CG 4.39Å; K452-L470 HydrophobicContact CB-CB 4.5Å; K452-L470 PolarHBondContact O-N 3.31Å; V454-L470 HydrophobicContact CG2-CG 3.99Å; L470-H472 VanDerWaalsContact CB-O 3.27Å; L470-H472 WeakPolarHBondContact CB-O 3.37Å; L470-H472 PolarHBondContact O-N 3.46Å; L470-F474 HydrophobicContact CD1-CB 4.41Å; L470-F474 HydrophobicContact CD1-CD2 4.23Å; L470-W504 HydrophobicContact CD2-CD2 4.02Å; L470-W504 HydrophobicContact CD2-CE3 4.14Å; L470-W504 HydrophobicContact CD2-CH2 3.65Å; L470-W504 HydrophobicContact CD2-CZ2 3.53Å; L470-W504 HydrophobicContact CD2-CZ3 3.94Å; L470-W504 HydrophobicContact CG-CZ2 4.26Å
471	P	93.4	Very high	92.5	Very high	50 Å²	50	53.5 Å²	53.5	33%	0.325	29%	0.293	S	S	.	.	S	Bend	trans	-56.7	-35.3	173.3	-27.2	35.6	0	0	0	112.5	K452 F495 W504	K452-P471 PolarHBondContact NZ-O 2.87Å; P471-F495 HydrophobicContact CB-CE1 4.18Å; P471-F495 HydrophobicContact CB-CZ 4.02Å; P471-F495 HydrophobicContact CG-CD1 4.24Å; P471-F495 HydrophobicContact CG-CE1 3.99Å; P471-F495 HydrophobicContact CG-CZ 4.25Å; P471-W504 HydrophobicContact CG-CB 3.87Å; P471-W504 HydrophobicContact CG-CG 4.45Å
472	H	91.2	Very high	93	Very high	77 Å²	77	45.3 Å²	45.3	36%	0.356	26%	0.263	S	S	.	.	S	Bend	trans	-138.4	146.3	179.6	-62.5	78.7	0	0	0	109.5	L470 F474 R493 F495	L470-H472 VanDerWaalsContact CB-O 3.27Å; L470-H472 WeakPolarHBondContact CB-O 3.37Å; L470-H472 PolarHBondContact O-N 3.46Å; H472-F474 VanDerWaalsContact O-CD2 3.24Å; H472-F474 WeakPolarHBondContact O-CD2 3.3Å; H472-R493 PolarHBondContact CD2-NH1 3.04Å; H472-R493 PolarHBondContact CE1-NH1 3.17Å; H472-R493 PolarHBondContact ND1-NH1 2.75Å; H472-R493 PolarHBondContact NE2-NH1 2.84Å; H472-F495 HydrophobicContact CB-CE2 4.5Å; H472-F495 AromaticContact ND1-CZ 3.79Å
473	S	89.8	Confident	93	Very high	38 Å²	38	48.8 Å²	48.8	27%	0.266	27%	0.27	S	S	.	.			trans	-71.4	142.5	178.4	48.8	0	0	0	0	111.9	K450 L451	K450-S473 VanDerWaalsContact CB-OG 3.32Å; K450-S473 WeakPolarHBondContact CB-OG 3.47Å; L451-S473 WeakPolarHBondContact O-CB 3.23Å
474	F	89.1	Confident	93	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	27%	0.266	C	S	.	.			trans	-113.3	134.1	-179.1	-85	-123.4	0	0	0	109.6	G441 G442 L470 H472 F477 A488 N490 R493 F495	G441-F474 CarbonylContact C-O 3.53Å; G441-F474 WeakPolarHBondContact CA-O 3.43Å; G442-F474 PolarHBondContact N-O 2.85Å; L470-F474 HydrophobicContact CD1-CB 4.41Å; L470-F474 HydrophobicContact CD1-CD2 4.23Å; H472-F474 VanDerWaalsContact O-CD2 3.24Å; H472-F474 WeakPolarHBondContact O-CD2 3.3Å; F474-F477 HydrophobicContact CB-CB 4.26Å; F474-F477 HydrophobicContact CB-CD1 3.6Å; F474-F477 HydrophobicContact CB-CD2 4.17Å; F474-F477 HydrophobicContact CB-CE1 3.94Å; F474-F477 HydrophobicContact CB-CE2 4.48Å; F474-F477 HydrophobicContact CB-CG 3.73Å; F474-F477 HydrophobicContact CB-CZ 4.38Å; F474-F477 HydrophobicContact CD1-CB 3.64Å; F474-F477 HydrophobicContact CD1-CD1 4.45Å; F474-F477 AromaticContact CD1-CD2 3.79Å; F474-F477 HydrophobicContact CD1-CD2 3.79Å; F474-F477 AromaticContact CD1-CG 3.7Å; F474-F477 HydrophobicContact CD1-CG 3.7Å; F474-F477 HydrophobicContact CG-CB 4.43Å; F474-F477 HydrophobicContact CG-CD2 4.4Å; F474-F477 HydrophobicContact CG-CG 4.2Å; F474-A488 HydrophobicContact CD1-CB 4.22Å; F474-A488 HydrophobicContact CE1-CB 4.03Å; F474-N490 HydrophobicContact CD1-CB 4.11Å; F474-N490 WeakPolarHBondContact CD1-ND2 3.42Å; F474-N490 HydrophobicContact CE1-CB 4.08Å; F474-N490 WeakPolarHBondContact CE1-ND2 3.41Å; F474-R493 HydrophobicContact CZ-CB 3.98Å; F474-F495 AromaticContact CE2-CD2 3.52Å; F474-F495 HydrophobicContact CE2-CD2 3.52Å; F474-F495 AromaticContact CE2-CE2 3.72Å; F474-F495 HydrophobicContact CE2-CE2 3.72Å; F474-F495 AromaticContact CZ-CD2 3.5Å; F474-F495 HydrophobicContact CZ-CD2 3.5Å; F474-F495 VanDerWaalsContact CZ-CD2 3.5Å; F474-F495 AromaticContact CZ-CE2 3.94Å; F474-F495 HydrophobicContact CZ-CE2 3.94Å
475	L	85.7	Confident	92.9	Very high	49 Å²	49	49.9 Å²	49.9	26%	0.257	28%	0.277	S	S	.	.	S	Bend	trans	-138.9	141	171.6	-83.6	157.5	0	0	0	106	R443 K450	R443-L475 HydrophobicContact CB-CD2 4.36Å; R443-L475 HydrophobicContact CG-CD2 4.18Å; K450-L475 HydrophobicContact CD-CD1 3.62Å; K450-L475 VanDerWaalsContact CE-CD1 3.44Å; K450-L475 HydrophobicContact CG-CD1 3.79Å
476	S	85.1	Confident	93	Very high	107 Å²	107	47.4 Å²	47.4	75%	0.748	26%	0.256	S	S	*	.	S	Bend	trans	51.9	72.5	-176.8	-56.5	0	0	0	0	111.3
477	F	92	Very high	92.9	Very high	11 Å²	11	43.5 Å²	43.5	5%	0.048	23%	0.234	C	C	.	.			trans	-150.6	162.6	-171.5	78.8	-80.8	0	0	0	109.3	D429 L440 F474 L479 A488 L489 N490	D429-F477 HydrophobicContact CB-CE1 4.23Å; D429-F477 HydrophobicContact CB-CE2 3.86Å; D429-F477 HydrophobicContact CB-CZ 3.61Å; L440-F477 HydrophobicContact CD1-CD2 4.45Å; L440-F477 HydrophobicContact CD1-CE2 3.41Å; L440-F477 VanDerWaalsContact CD1-CE2 3.41Å; L440-F477 HydrophobicContact CD1-CZ 3.54Å; L440-F477 HydrophobicContact CG-CE2 4.37Å; L440-F477 HydrophobicContact CG-CZ 4.29Å; L440-F477 VanDerWaalsContact O-CZ 3.31Å; L440-F477 WeakPolarHBondContact O-CZ 3.38Å; F474-F477 HydrophobicContact CB-CB 4.26Å; F474-F477 HydrophobicContact CB-CD1 3.6Å; F474-F477 HydrophobicContact CB-CD2 4.17Å; F474-F477 HydrophobicContact CB-CE1 3.94Å; F474-F477 HydrophobicContact CB-CE2 4.48Å; F474-F477 HydrophobicContact CB-CG 3.73Å; F474-F477 HydrophobicContact CB-CZ 4.38Å; F474-F477 HydrophobicContact CD1-CB 3.64Å; F474-F477 HydrophobicContact CD1-CD1 4.45Å; F474-F477 AromaticContact CD1-CD2 3.79Å; F474-F477 HydrophobicContact CD1-CD2 3.79Å; F474-F477 AromaticContact CD1-CG 3.7Å; F474-F477 HydrophobicContact CD1-CG 3.7Å; F474-F477 HydrophobicContact CG-CB 4.43Å; F474-F477 HydrophobicContact CG-CD2 4.4Å; F474-F477 HydrophobicContact CG-CG 4.2Å; F477-L479 HydrophobicContact CE2-CB 4.11Å; F477-A488 HydrophobicContact CD2-CB 4.44Å; F477-L489 WeakPolarHBondContact CA-O 3.33Å; F477-L489 VanDerWaalsContact CB-O 3.28Å; F477-L489 WeakPolarHBondContact CB-O 3.5Å; F477-N490 HydrophobicContact CB-CB 3.78Å
478	D	92.8	Very high	92.9	Very high	25 Å²	25	42.2 Å²	42.2	13%	0.134	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	140.3	175.6	-64.3	-5.3	0	0	0	110.8	M480 L489 F515 E517 A518	D478-M480 HydrophobicContact CB-CE 4.27Å; D478-L489 PolarHBondContact N-O 2.97Å; D478-L489 PolarHBondContact O-N 3.02Å; D478-F515 HydrophobicContact CB-CE1 4.33Å; D478-F515 HydrophobicContact CB-CZ 3.91Å; D478-F515 VanDerWaalsContact OD2-CZ 3.25Å; D478-F515 WeakPolarHBondContact OD2-CZ 3.37Å; D478-E517 WeakPolarHBondContact OD2-CA 3.26Å; D478-A518 PolarHBondContact OD2-N 2.95Å
479	L	95.6	Very high	92.8	Very high	14 Å²	14	41.2 Å²	41.2	7%	0.073	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	122.7	176.2	-172.8	60.6	0	0	0	109.7	D429 A431 L440 F477 L486 Y487 A488	D429-L479 HydrophobicContact CB-CB 3.99Å; D429-L479 WeakPolarHBondContact OD2-CB 3.39Å; D429-L479 PolarHBondContact OD2-N 2.88Å; A431-L479 HydrophobicContact CB-CB 4.49Å; A431-L479 HydrophobicContact CB-CD2 3.55Å; A431-L479 HydrophobicContact CB-CG 3.64Å; L440-L479 HydrophobicContact CD1-CD1 4.41Å; L440-L479 HydrophobicContact CD2-CD1 3.77Å; L440-L479 HydrophobicContact CD2-CD2 3.77Å; L440-L479 HydrophobicContact CD2-CG 4.44Å; L440-L479 HydrophobicContact CG-CD1 4.37Å; L440-L479 HydrophobicContact CG-CD2 4.02Å; F477-L479 HydrophobicContact CE2-CB 4.11Å; L479-L486 HydrophobicContact CD1-CB 4.21Å; L479-Y487 WeakPolarHBondContact CA-O 3.41Å; L479-A488 HydrophobicContact CD1-CB 4.18Å
480	M	94.8	Very high	92.5	Very high	14 Å²	14	38.2 Å²	38.2	7%	0.069	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	155.4	-172.9	-72.4	167.6	-76.3	0	0	111.2	D478 L486 Y487 L489 A518 V520 I525	D478-M480 HydrophobicContact CB-CE 4.27Å; M480-L486 CarbonylContact O-C 3.58Å; M480-L486 WeakPolarHBondContact O-CA 3.02Å; M480-Y487 PolarHBondContact N-O 3.36Å; M480-Y487 PolarHBondContact O-N 3.17Å; M480-L489 HydrophobicContact CE-CB 3.87Å; M480-L489 HydrophobicContact CE-CD2 4.16Å; M480-A518 HydrophobicContact CE-CB 3.72Å; M480-A518 HydrophobicContact SD-CB 3.6Å; M480-V520 HydrophobicContact CB-CG2 3.64Å; M480-V520 HydrophobicContact CG-CG2 3.94Å; M480-V520 HydrophobicContact SD-CG2 4.04Å; M480-I525 HydrophobicContact CE-CD1 4.26Å; M480-I525 HydrophobicContact CE-CG2 3.79Å; M480-I525 HydrophobicContact SD-CG1 4.39Å; M480-I525 HydrophobicContact SD-CG2 3.61Å
481	V	95.3	Very high	92.1	Very high	45 Å²	45	40.2 Å²	40.2	27%	0.273	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	125.5	177.8	-179.5	0	0	0	0	108.3	A431 Y432 L433 L486	A431-V481 HydrophobicContact CB-CG2 3.81Å; Y432-V481 VanDerWaalsContact O-CG2 3.24Å; Y432-V481 WeakPolarHBondContact O-CG2 3.37Å; L433-V481 HydrophobicContact CB-CG1 4.4Å; L433-V481 HydrophobicContact CB-CG2 4.4Å; L433-V481 HydrophobicContact CD1-CG1 3.77Å; V481-L486 HydrophobicContact CG2-CD2 3.59Å
482	I	94	Very high	91.8	Very high	6 Å²	6	45.4 Å²	45.4	3%	0.031	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	115.5	172	-54.9	174.3	0	0	0	107.3	D484 Y485 Y487 V520 E523 I525 P539	I482-D484 PolarHBondContact O-N 3.33Å; I482-Y485 PolarHBondContact N-O 3.01Å; I482-Y485 PolarHBondContact O-N 2.77Å; I482-Y485 VanDerWaalsContact O-N 3.14Å; I482-Y487 HydrophobicContact CB-CD2 4.12Å; I482-Y487 HydrophobicContact CB-CE2 3.89Å; I482-Y487 HydrophobicContact CD1-CD2 3.97Å; I482-Y487 HydrophobicContact CD1-CE2 4.07Å; I482-Y487 HydrophobicContact CD1-CG 4.43Å; I482-Y487 HydrophobicContact CG1-CD2 4.08Å; I482-Y487 HydrophobicContact CG1-CE2 4.26Å; I482-V520 HydrophobicContact CD1-CG2 4.19Å; I482-V520 HydrophobicContact CG1-CB 4.49Å; I482-V520 HydrophobicContact CG1-CG1 3.91Å; I482-V520 HydrophobicContact CG1-CG2 3.69Å; I482-E523 HydrophobicContact CG2-CB 4.35Å; I482-I525 HydrophobicContact CD1-CD1 3.81Å; I482-I525 HydrophobicContact CD1-CG1 3.39Å; I482-P539 HydrophobicContact CD1-CG 4.33Å; I482-P539 HydrophobicContact CG2-CG 4.27Å
483	R	89.4	Confident	91.8	Very high	146 Å²	146	46.4 Å²	46.4	55%	0.551	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.2	-124.1	-173.1	-56.1	176.3	179.6	171.8	1.6	109.5	E523	R483-E523 WeakPolarHBondContact CG-OE1 3.25Å; R483-E523 IonicContact CZ-OE1 3.78Å; R483-E523 IonicContact CZ-OE2 3.55Å; R483-E523 IonicContact NE-OE1 2.8Å; R483-E523 PolarHBondContact NE-OE1 2.72Å; R483-E523 IonicContact NE-OE2 2.89Å; R483-E523 PolarHBondContact NE-OE2 2.79Å; R483-E523 IonicContact NH2-OE1 2.74Å; R483-E523 IonicContact NH2-OE2 3.47Å; R483-E523 PolarHBondContact NH2-OE2 3.03Å
484	D	92.5	Very high	91.9	Very high	91 Å²	91	44.6 Å²	44.6	49%	0.487	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.2	16.2	-177.2	-64.3	-53.9	0	0	0	114.6	N434 I482 P499	N434-D484 PolarHBondContact ND2-OD1 3Å; I482-D484 PolarHBondContact O-N 3.33Å; D484-P499 VanDerWaalsContact O-CD 3.28Å; D484-P499 WeakPolarHBondContact O-CD 3.39Å
485	Y	95.1	Very high	92.2	Very high	88 Å²	88	45.1 Å²	45.1	35%	0.345	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	147.2	-174.6	-64.7	-87.3	0	0	0	112.2	I482 Y497 D498	I482-Y485 PolarHBondContact N-O 3.01Å; I482-Y485 PolarHBondContact O-N 2.77Å; I482-Y485 VanDerWaalsContact O-N 3.14Å; Y485-Y497 WeakPolarHBondContact CD1-O 3.5Å; Y485-D498 HydrophobicContact CD1-CB 4.09Å; Y485-D498 HydrophobicContact CE1-CB 3.75Å
486	L	96.6	Very high	92.7	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	138.2	171	-53.3	169.1	0	0	0	110.4	A431 L433 Y438 L479 M480 V481 C496 Y497	A431-L486 HydrophobicContact CB-CD2 4.05Å; L433-L486 HydrophobicContact CB-CD2 3.84Å; L433-L486 HydrophobicContact CD2-CD1 4.45Å; L433-L486 HydrophobicContact CD2-CD2 3.65Å; L433-L486 HydrophobicContact CD2-CG 3.66Å; L433-L486 HydrophobicContact CG-CD2 4.38Å; Y438-L486 HydrophobicContact CD1-CD1 3.74Å; Y438-L486 HydrophobicContact CD2-CD1 3.63Å; Y438-L486 HydrophobicContact CD2-CD2 4.38Å; Y438-L486 HydrophobicContact CE1-CD1 4.26Å; Y438-L486 HydrophobicContact CE2-CD1 4.16Å; Y438-L486 HydrophobicContact CG-CD1 3.39Å; L479-L486 HydrophobicContact CD1-CB 4.21Å; M480-L486 CarbonylContact O-C 3.58Å; M480-L486 WeakPolarHBondContact O-CA 3.02Å; V481-L486 HydrophobicContact CG2-CD2 3.59Å; L486-C496 CarbonylContact O-C 3.55Å; L486-C496 WeakPolarHBondContact O-CA 3.33Å; L486-Y497 HydrophobicContact CD1-CD1 3.77Å; L486-Y497 HydrophobicContact CD1-CG 4.49Å; L486-Y497 HydrophobicContact CG-CD1 4.33Å; L486-Y497 PolarHBondContact N-O 3.1Å; L486-Y497 PolarHBondContact O-N 2.97Å
487	Y	95.8	Very high	93.3	Very high	22 Å²	22	38.1 Å²	38.1	9%	0.086	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	118.8	175.5	-72.4	-100.5	0	0	0	109.5	L479 M480 I482 M494 F495 C496 I525 Y537	L479-Y487 WeakPolarHBondContact CA-O 3.41Å; M480-Y487 PolarHBondContact N-O 3.36Å; M480-Y487 PolarHBondContact O-N 3.17Å; I482-Y487 HydrophobicContact CB-CD2 4.12Å; I482-Y487 HydrophobicContact CB-CE2 3.89Å; I482-Y487 HydrophobicContact CD1-CD2 3.97Å; I482-Y487 HydrophobicContact CD1-CE2 4.07Å; I482-Y487 HydrophobicContact CD1-CG 4.43Å; I482-Y487 HydrophobicContact CG1-CD2 4.08Å; I482-Y487 HydrophobicContact CG1-CE2 4.26Å; Y487-M494 HydrophobicContact CD1-SD 4.42Å; Y487-F495 WeakPolarHBondContact CA-O 3.33Å; Y487-C496 HydrophobicContact CD1-CB 4.06Å; Y487-C496 HydrophobicContact CE1-CB 3.78Å; Y487-I525 HydrophobicContact CD1-CD1 4.12Å; Y487-I525 HydrophobicContact CG-CD1 4.13Å; Y487-Y537 HydrophobicContact CE1-CE1 4.36Å
488	A	95.4	Very high	93.5	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	118.5	171.8	0	0	0	0	0	109	L440 F474 F477 L479 M494 F495 W504	L440-A488 HydrophobicContact CD1-CB 4.19Å; F474-A488 HydrophobicContact CD1-CB 4.22Å; F474-A488 HydrophobicContact CE1-CB 4.03Å; F477-A488 HydrophobicContact CD2-CB 4.44Å; L479-A488 HydrophobicContact CD1-CB 4.18Å; A488-M494 WeakPolarHBondContact O-CA 3.33Å; A488-F495 PolarHBondContact N-O 3.49Å; A488-F495 PolarHBondContact O-N 2.95Å; A488-W504 HydrophobicContact CB-CH2 4.36Å; A488-W504 HydrophobicContact CB-CZ3 4.11Å
489	L	93.9	Very high	93.5	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	130.8	-174.8	175.7	64.2	0	0	0	111.2	F477 D478 M480 M494 L510 F515 A518 I525 W544	F477-L489 WeakPolarHBondContact CA-O 3.33Å; F477-L489 VanDerWaalsContact CB-O 3.28Å; F477-L489 WeakPolarHBondContact CB-O 3.5Å; D478-L489 PolarHBondContact N-O 2.97Å; D478-L489 PolarHBondContact O-N 3.02Å; M480-L489 HydrophobicContact CE-CB 3.87Å; M480-L489 HydrophobicContact CE-CD2 4.16Å; L489-M494 HydrophobicContact CB-CG 4.38Å; L489-M494 HydrophobicContact CD1-CB 3.84Å; L489-M494 HydrophobicContact CD1-CG 4.04Å; L489-M494 HydrophobicContact CD1-SD 4Å; L489-L510 HydrophobicContact CD1-CD1 4.16Å; L489-L510 HydrophobicContact CD1-CG 4.43Å; L489-F515 HydrophobicContact CD2-CD2 4.11Å; L489-F515 HydrophobicContact CD2-CE2 3.54Å; L489-F515 HydrophobicContact CD2-CZ 4.29Å; L489-F515 HydrophobicContact CG-CD2 4.19Å; L489-F515 HydrophobicContact CG-CE2 3.83Å; L489-F515 HydrophobicContact CG-CZ 4.33Å; L489-A518 HydrophobicContact CD2-CB 4.21Å; L489-I525 HydrophobicContact CD2-CG2 4.23Å; L489-W544 HydrophobicContact CD1-CH2 4.49Å; L489-W544 HydrophobicContact CD1-CZ2 4.31Å; L489-W544 HydrophobicContact CD2-CH2 3.93Å
490	N	90.4	Very high	93.5	Very high	16 Å²	16	42.5 Å²	42.5	9%	0.086	21%	0.207	C	C	.	.			trans	-133.8	-176	165.8	68.4	23.2	0	0	0	110.9	F474 F477 K492 R493	F474-N490 HydrophobicContact CD1-CB 4.11Å; F474-N490 WeakPolarHBondContact CD1-ND2 3.42Å; F474-N490 HydrophobicContact CE1-CB 4.08Å; F474-N490 WeakPolarHBondContact CE1-ND2 3.41Å; F477-N490 HydrophobicContact CB-CB 3.78Å; N490-K492 PolarHBondContact O-N 2.81Å; N490-K492 WeakPolarHBondContact OD1-CA 3.46Å; N490-K492 PolarHBondContact OD1-N 2.66Å; N490-R493 PolarHBondContact N-O 2.96Å; N490-R493 PolarHBondContact OD1-N 2.81Å; N490-R493 PolarHBondContact OD1-O 3.16Å
491	S	87.1	Confident	93.4	Very high	45 Å²	45	48 Å²	48	32%	0.315	23%	0.233	S	C	.	.	S	Bend	trans	-58.7	-15	-180	58.6	0	0	0	0	115.6
492	K	86.3	Confident	93.4	Very high	159 Å²	159	49.6 Å²	49.6	69%	0.691	24%	0.24	S	C	*	.	S	Bend	trans	-118.2	-31.5	-173.9	-64.4	-178.7	-178.3	176.7	0	113.9	N490	N490-K492 PolarHBondContact O-N 2.81Å; N490-K492 WeakPolarHBondContact OD1-CA 3.46Å; N490-K492 PolarHBondContact OD1-N 2.66Å
493	R	91	Very high	93.6	Very high	99 Å²	99	53.6 Å²	53.6	37%	0.374	26%	0.26	S	S	.	.			trans	-148.1	145.3	-162.7	-58.6	-178.9	-170.4	-138.2	6.8	110.8	H472 F474 N490 F495 S509	H472-R493 PolarHBondContact CD2-NH1 3.04Å; H472-R493 PolarHBondContact CE1-NH1 3.17Å; H472-R493 PolarHBondContact ND1-NH1 2.75Å; H472-R493 PolarHBondContact NE2-NH1 2.84Å; F474-R493 HydrophobicContact CZ-CB 3.98Å; N490-R493 PolarHBondContact N-O 2.96Å; N490-R493 PolarHBondContact OD1-N 2.81Å; N490-R493 PolarHBondContact OD1-O 3.16Å; R493-F495 HydrophobicContact CB-CE2 4.11Å; R493-S509 WeakPolarHBondContact CA-OG 3.34Å
494	M	93.3	Very high	93.9	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	129.1	168	-169.3	166.5	69.8	0	0	109.6	Y487 A488 L489 C507 V508 S509 I525 Y537 W544	Y487-M494 HydrophobicContact CD1-SD 4.42Å; A488-M494 WeakPolarHBondContact O-CA 3.33Å; L489-M494 HydrophobicContact CB-CG 4.38Å; L489-M494 HydrophobicContact CD1-CB 3.84Å; L489-M494 HydrophobicContact CD1-CG 4.04Å; L489-M494 HydrophobicContact CD1-SD 4Å; M494-C507 HydrophobicContact CB-CB 4.04Å; M494-C507 HydrophobicContact CE-CB 3.33Å; M494-C507 HydrophobicContact CG-CB 3.92Å; M494-C507 PolarHBondContact O-N 2.87Å; M494-C507 HydrophobicContact SD-CB 4.43Å; M494-V508 WeakPolarHBondContact CE-O 3.29Å; M494-S509 PolarHBondContact N-OG 3.24Å; M494-S509 VanDerWaalsContact N-OG 3.16Å; M494-I525 HydrophobicContact SD-CD1 4.1Å; M494-Y537 HydrophobicContact CE-CD1 3.62Å; M494-Y537 HydrophobicContact CE-CD2 3.94Å; M494-Y537 HydrophobicContact CE-CE1 3.25Å; M494-Y537 HydrophobicContact CE-CE2 3.61Å; M494-Y537 HydrophobicContact CE-CG 3.93Å; M494-Y537 HydrophobicContact SD-CD1 4.25Å; M494-Y537 HydrophobicContact SD-CE1 4.3Å; M494-W544 HydrophobicContact CE-CZ2 4.23Å; M494-W544 HydrophobicContact SD-CZ2 4.02Å
495	F	95.4	Very high	94	Very high	11 Å²	11	47.5 Å²	47.5	5%	0.048	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	145.3	172.3	-67.7	-74.8	0	0	0	110.3	P471 H472 F474 Y487 A488 R493 W504 L505 K506	P471-F495 HydrophobicContact CB-CE1 4.18Å; P471-F495 HydrophobicContact CB-CZ 4.02Å; P471-F495 HydrophobicContact CG-CD1 4.24Å; P471-F495 HydrophobicContact CG-CE1 3.99Å; P471-F495 HydrophobicContact CG-CZ 4.25Å; H472-F495 HydrophobicContact CB-CE2 4.5Å; H472-F495 AromaticContact ND1-CZ 3.79Å; F474-F495 AromaticContact CE2-CD2 3.52Å; F474-F495 HydrophobicContact CE2-CD2 3.52Å; F474-F495 AromaticContact CE2-CE2 3.72Å; F474-F495 HydrophobicContact CE2-CE2 3.72Å; F474-F495 AromaticContact CZ-CD2 3.5Å; F474-F495 HydrophobicContact CZ-CD2 3.5Å; F474-F495 VanDerWaalsContact CZ-CD2 3.5Å; F474-F495 AromaticContact CZ-CE2 3.94Å; F474-F495 HydrophobicContact CZ-CE2 3.94Å; Y487-F495 WeakPolarHBondContact CA-O 3.33Å; A488-F495 PolarHBondContact N-O 3.49Å; A488-F495 PolarHBondContact O-N 2.95Å; R493-F495 HydrophobicContact CB-CE2 4.11Å; F495-W504 HydrophobicContact CB-CE3 3.62Å; F495-W504 HydrophobicContact CB-CZ3 4.07Å; F495-L505 CarbonylContact C-O 3.5Å; F495-L505 WeakPolarHBondContact CA-O 3.2Å; F495-K506 HydrophobicContact CD1-CB 4.21Å; F495-K506 HydrophobicContact CD1-CG 4.49Å; F495-K506 HydrophobicContact CE1-CB 4.01Å; F495-K506 HydrophobicContact CE1-CG 4.08Å
496	C	95.8	Very high	93.9	Very high	6 Å²	6	51.5 Å²	51.5	4%	0.041	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	129.1	172.6	171.2	0	0	0	0	108.7	L486 Y487 W504 L505 C507	L486-C496 CarbonylContact O-C 3.55Å; L486-C496 WeakPolarHBondContact O-CA 3.33Å; Y487-C496 HydrophobicContact CD1-CB 4.06Å; Y487-C496 HydrophobicContact CE1-CB 3.78Å; C496-W504 CarbonylContact O-C 3.51Å; C496-W504 WeakPolarHBondContact O-CA 3.33Å; C496-L505 HydrophobicContact CB-CB 4.48Å; C496-L505 PolarHBondContact N-O 3.4Å; C496-L505 PolarHBondContact O-N 2.85Å; C496-C507 WeakPolarHBondContact CB-SG 3.14Å
497	Y	97	Very high	93.7	Very high	3 Å²	3	52.6 Å²	52.6	1%	0.012	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	129.2	174.3	179.6	-110.6	0	0	0	109.7	Y438 V467 A468 Y485 L486 P499 N502 M503 W504	Y438-Y497 HydrophobicContact CD1-CE1 4.35Å; Y438-Y497 HydrophobicContact CE1-CD1 4.4Å; Y438-Y497 AromaticContact CE1-CE1 3.69Å; Y438-Y497 HydrophobicContact CE1-CE1 3.69Å; V467-Y497 WeakPolarHBondContact CB-OH 3.38Å; A468-Y497 HydrophobicContact CB-CE2 4.32Å; Y485-Y497 WeakPolarHBondContact CD1-O 3.5Å; L486-Y497 HydrophobicContact CD1-CD1 3.77Å; L486-Y497 HydrophobicContact CD1-CG 4.49Å; L486-Y497 HydrophobicContact CG-CD1 4.33Å; L486-Y497 PolarHBondContact N-O 3.1Å; L486-Y497 PolarHBondContact O-N 2.97Å; Y497-P499 HydrophobicContact CD1-CG 4.01Å; Y497-P499 HydrophobicContact CE1-CB 4.02Å; Y497-P499 HydrophobicContact CE1-CG 3.98Å; Y497-P499 WeakPolarHBondContact O-CD 3.34Å; Y497-N502 PolarHBondContact OH-OD1 3.37Å; Y497-M503 WeakPolarHBondContact CD2-O 3.19Å; Y497-W504 AromaticContact CD2-CD1 3.9Å; Y497-W504 AromaticContact CD2-CD2 3.83Å; Y497-W504 HydrophobicContact CD2-CD2 3.83Å; Y497-W504 AromaticContact CD2-CE2 3.53Å; Y497-W504 HydrophobicContact CD2-CE3 4.47Å; Y497-W504 HydrophobicContact CD2-CG 4.06Å; Y497-W504 AromaticContact CD2-CZ2 3.96Å; Y497-W504 HydrophobicContact CD2-CZ2 3.96Å; Y497-W504 AromaticContact CD2-NE1 3.55Å; Y497-W504 HydrophobicContact CG-CD2 4.27Å; Y497-W504 HydrophobicContact CG-CE3 4.5Å; Y497-W504 HydrophobicContact CG-CH2 4.32Å; Y497-W504 HydrophobicContact CG-CZ2 4.03Å
498	D	95.3	Very high	93.3	Very high	11 Å²	11	54.8 Å²	54.8	6%	0.059	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	108.7	170	-174.3	-18.7	0	0	0	109.4	Y485 S500 H501 N502 M503	Y485-D498 HydrophobicContact CD1-CB 4.09Å; Y485-D498 HydrophobicContact CE1-CB 3.75Å; D498-S500 VanDerWaalsContact C-N 3.26Å; D498-S500 PolarHBondContact O-N 3Å; D498-S500 WeakPolarHBondContact OD1-CA 3.32Å; D498-S500 WeakPolarHBondContact OD1-CB 3.44Å; D498-S500 PolarHBondContact OD1-N 3.27Å; D498-S500 PolarHBondContact OD1-OG 3.29Å; D498-S500 PolarHBondContact OD2-OG 3.32Å; D498-H501 PolarHBondContact OD1-N 3.25Å; D498-H501 IonicContact OD1-ND1 3.44Å; D498-H501 IonicContact OD2-CE1 2.76Å; D498-H501 IonicContact OD2-CG 3.69Å; D498-H501 IonicContact OD2-ND1 2.66Å; D498-H501 PolarHBondContact OD2-ND1 3.19Å; D498-N502 WeakPolarHBondContact O-CA 3.31Å; D498-N502 PolarHBondContact O-N 3.14Å; D498-M503 HydrophobicContact CB-CG 4.5Å; D498-M503 PolarHBondContact N-O 3.43Å; D498-M503 PolarHBondContact O-N 3.37Å
499	P	94.4	Very high	92.9	Very high	37 Å²	37	56 Å²	56	24%	0.24	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-28.2	177.5	-19.9	31.9	0	0	0	113.8	L433 D484 Y497	L433-P499 HydrophobicContact CD2-CG 3.54Å; D484-P499 VanDerWaalsContact O-CD 3.28Å; D484-P499 WeakPolarHBondContact O-CD 3.39Å; Y497-P499 HydrophobicContact CD1-CG 4.01Å; Y497-P499 HydrophobicContact CE1-CB 4.02Å; Y497-P499 HydrophobicContact CE1-CG 3.98Å; Y497-P499 WeakPolarHBondContact O-CD 3.34Å
500	S	94	Very high	92.5	Very high	93 Å²	93	56.6 Å²	56.6	65%	0.65	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-36.9	-176	70.2	0	0	0	0	112.2	D498	D498-S500 VanDerWaalsContact C-N 3.26Å; D498-S500 PolarHBondContact O-N 3Å; D498-S500 WeakPolarHBondContact OD1-CA 3.32Å; D498-S500 WeakPolarHBondContact OD1-CB 3.44Å; D498-S500 PolarHBondContact OD1-N 3.27Å; D498-S500 PolarHBondContact OD1-OG 3.29Å; D498-S500 PolarHBondContact OD2-OG 3.32Å
501	H	93.9	Very high	91.9	Very high	131 Å²	131	64.2 Å²	64.2	61%	0.606	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.4	-3.3	177.1	-61.6	99.1	0	0	0	113.3	D498 M503	D498-H501 PolarHBondContact OD1-N 3.25Å; D498-H501 IonicContact OD1-ND1 3.44Å; D498-H501 IonicContact OD2-CE1 2.76Å; D498-H501 IonicContact OD2-CG 3.69Å; D498-H501 IonicContact OD2-ND1 2.66Å; D498-H501 PolarHBondContact OD2-ND1 3.19Å; H501-M503 HydrophobicContact CB-CG 3.83Å; H501-M503 HydrophobicContact CB-SD 3.75Å; H501-M503 PolarHBondContact O-N 2.9Å
502	N	95.9	Very high	90.9	Very high	77 Å²	77	74 Å²	74	41%	0.412	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.6	54.4	-175.2	-175.6	24	0	0	0	111.4	V467 A468 Y497 D498	V467-N502 WeakPolarHBondContact CB-OD1 3.29Å; A468-N502 WeakPolarHBondContact CB-O 3.46Å; A468-N502 VanDerWaalsContact CB-OD1 3.23Å; A468-N502 WeakPolarHBondContact CB-OD1 3.27Å; A468-N502 PolarHBondContact N-OD1 3.37Å; Y497-N502 PolarHBondContact OH-OD1 3.37Å; D498-N502 WeakPolarHBondContact O-CA 3.31Å; D498-N502 PolarHBondContact O-N 3.14Å
503	M	96.4	Very high	90.2	Very high	91 Å²	91	67.5 Å²	67.5	45%	0.448	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	152.9	-176.2	73.8	-173.1	-49.1	0	0	113.8	Y497 D498 H501	Y497-M503 WeakPolarHBondContact CD2-O 3.19Å; D498-M503 HydrophobicContact CB-CG 4.5Å; D498-M503 PolarHBondContact N-O 3.43Å; D498-M503 PolarHBondContact O-N 3.37Å; H501-M503 HydrophobicContact CB-CG 3.83Å; H501-M503 HydrophobicContact CB-SD 3.75Å; H501-M503 PolarHBondContact O-N 2.9Å
504	W	96.6	Very high	89.5	Confident	29 Å²	29	67.9 Å²	67.9	11%	0.11	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	126.5	177.9	-69.6	93.6	0	0	0	111.6	L440 V454 A468 L470 P471 A488 F495 C496 Y497	L440-W504 HydrophobicContact CD2-CH2 3.65Å; L440-W504 HydrophobicContact CD2-CZ2 3.88Å; V454-W504 HydrophobicContact CG2-CZ2 3.93Å; A468-W504 PolarHBondContact O-NE1 2.88Å; L470-W504 HydrophobicContact CD2-CD2 4.02Å; L470-W504 HydrophobicContact CD2-CE3 4.14Å; L470-W504 HydrophobicContact CD2-CH2 3.65Å; L470-W504 HydrophobicContact CD2-CZ2 3.53Å; L470-W504 HydrophobicContact CD2-CZ3 3.94Å; L470-W504 HydrophobicContact CG-CZ2 4.26Å; P471-W504 HydrophobicContact CG-CB 3.87Å; P471-W504 HydrophobicContact CG-CG 4.45Å; A488-W504 HydrophobicContact CB-CH2 4.36Å; A488-W504 HydrophobicContact CB-CZ3 4.11Å; F495-W504 HydrophobicContact CB-CE3 3.62Å; F495-W504 HydrophobicContact CB-CZ3 4.07Å; C496-W504 CarbonylContact O-C 3.51Å; C496-W504 WeakPolarHBondContact O-CA 3.33Å; Y497-W504 AromaticContact CD2-CD1 3.9Å; Y497-W504 AromaticContact CD2-CD2 3.83Å; Y497-W504 HydrophobicContact CD2-CD2 3.83Å; Y497-W504 AromaticContact CD2-CE2 3.53Å; Y497-W504 HydrophobicContact CD2-CE3 4.47Å; Y497-W504 HydrophobicContact CD2-CG 4.06Å; Y497-W504 AromaticContact CD2-CZ2 3.96Å; Y497-W504 HydrophobicContact CD2-CZ2 3.96Å; Y497-W504 AromaticContact CD2-NE1 3.55Å; Y497-W504 HydrophobicContact CG-CD2 4.27Å; Y497-W504 HydrophobicContact CG-CE3 4.5Å; Y497-W504 HydrophobicContact CG-CH2 4.32Å; Y497-W504 HydrophobicContact CG-CZ2 4.03Å
505	L	94.4	Very high	89.2	Confident	80 Å²	80	68.9 Å²	68.9	42%	0.419	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	140.4	175.1	-57.3	177.1	0	0	0	110.1	F495 C496	F495-L505 CarbonylContact C-O 3.5Å; F495-L505 WeakPolarHBondContact CA-O 3.2Å; C496-L505 HydrophobicContact CB-CB 4.48Å; C496-L505 PolarHBondContact N-O 3.4Å; C496-L505 PolarHBondContact O-N 2.85Å
506	K	92.8	Very high	88.8	Confident	172 Å²	172	72.9 Å²	72.9	75%	0.748	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84	127.2	177.8	-174.3	-179.6	177.9	-174.9	0	110.3	F495	F495-K506 HydrophobicContact CD1-CB 4.21Å; F495-K506 HydrophobicContact CD1-CG 4.49Å; F495-K506 HydrophobicContact CE1-CB 4.01Å; F495-K506 HydrophobicContact CE1-CG 4.08Å
507	C	91.8	Very high	88.5	Confident	22 Å²	22	74 Å²	74	15%	0.149	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	167.4	177.7	-58.6	0	0	0	0	112.2	M494 C496 S509	M494-C507 HydrophobicContact CB-CB 4.04Å; M494-C507 HydrophobicContact CE-CB 3.33Å; M494-C507 HydrophobicContact CG-CB 3.92Å; M494-C507 PolarHBondContact O-N 2.87Å; M494-C507 HydrophobicContact SD-CB 4.43Å; C496-C507 WeakPolarHBondContact CB-SG 3.14Å; C507-S509 PolarHBondContact O-N 3.18Å; C507-S509 VanDerWaalsContact O-N 3.15Å; C507-S509 PolarHBondContact O-OG 3.26Å
508	V	88.9	Confident	88.3	Confident	69 Å²	69	74.3 Å²	74.3	42%	0.418	36%	0.364	S	S	.	.			trans	-65.9	114.3	175.4	-179.8	0	0	0	0	109.2	M494 Y537 A542 W544	M494-V508 WeakPolarHBondContact CE-O 3.29Å; V508-Y537 HydrophobicContact CB-CE2 4.23Å; V508-A542 HydrophobicContact CG2-CB 4.29Å; V508-A542 VanDerWaalsContact CG2-O 3.26Å; V508-A542 WeakPolarHBondContact CG2-O 3.34Å; V508-W544 PolarHBondContact O-NE1 3.12Å
509	S	86.9	Confident	88.2	Confident	26 Å²	26	74.8 Å²	74.8	18%	0.182	37%	0.368	C	S	.	.			trans	-87.7	159.9	-174.2	-50.8	0	0	0	0	112	R493 M494 C507 K511	R493-S509 WeakPolarHBondContact CA-OG 3.34Å; M494-S509 PolarHBondContact N-OG 3.24Å; M494-S509 VanDerWaalsContact N-OG 3.16Å; C507-S509 PolarHBondContact O-N 3.18Å; C507-S509 VanDerWaalsContact O-N 3.15Å; C507-S509 PolarHBondContact O-OG 3.26Å; S509-K511 PolarHBondContact O-N 3.07Å
510	L	84.1	Confident	88.2	Confident	11 Å²	11	74.5 Å²	74.5	6%	0.058	37%	0.366	C	S	.	.			trans	-58.3	134.5	171.8	-72.2	166.9	0	0	0	110.5	L489 F515 K535 W544	L489-L510 HydrophobicContact CD1-CD1 4.16Å; L489-L510 HydrophobicContact CD1-CG 4.43Å; L510-F515 HydrophobicContact CD1-CB 4.37Å; L510-F515 HydrophobicContact CD1-CD2 3.93Å; L510-K535 HydrophobicContact CD2-CD 3.97Å; L510-W544 HydrophobicContact CD1-CH2 4.45Å; L510-W544 HydrophobicContact CD2-CD2 3.83Å; L510-W544 HydrophobicContact CD2-CE3 3.74Å; L510-W544 HydrophobicContact CD2-CH2 3.75Å; L510-W544 HydrophobicContact CD2-CZ2 3.84Å; L510-W544 HydrophobicContact CD2-CZ3 3.71Å; L510-W544 HydrophobicContact CG-CH2 3.97Å; L510-W544 HydrophobicContact CG-CZ2 3.83Å; L510-W544 HydrophobicContact CG-CZ3 4.44Å
511	K	78.1	Confident	88.2	Confident	176 Å²	176	70.1 Å²	70.1	77%	0.765	34%	0.335	S	S	*	.			trans	-92.2	111.5	176.7	-66.9	-179.8	-178	174.8	0	109.6	S509 N513	S509-K511 PolarHBondContact O-N 3.07Å; K511-N513 PolarHBondContact O-N 2.83Å; K511-N513 PolarHBondContact O-OD1 2.88Å
512	R	65.9	Low	88	Confident	250 Å²	250	68.4 Å²	68.4	94%	0.943	33%	0.331	S	S	*	.	S	Bend	trans	49.7	51.2	167	-65.9	-175.3	173.1	167.1	-2.5	115.2
513	N	71.5	Confident	87.8	Confident	24 Å²	24	69.3 Å²	69.3	13%	0.128	33%	0.332	C	S	.	.			trans	-136	145.4	173.9	-75.6	50.3	0	0	0	110.8	K511 F515 C529 D530 K535	K511-N513 PolarHBondContact O-N 2.83Å; K511-N513 PolarHBondContact O-OD1 2.88Å; N513-F515 PolarHBondContact O-N 2.98Å; N513-C529 HydrophobicContact CB-CB 4.05Å; N513-D530 WeakPolarHBondContact CA-OD2 3.43Å; N513-D530 WeakPolarHBondContact CB-OD2 3.43Å; N513-D530 PolarHBondContact ND2-OD2 2.89Å; N513-D530 VanDerWaalsContact ND2-OD2 3.09Å; N513-K535 VanDerWaalsContact CG-NZ 3.25Å; N513-K535 PolarHBondContact ND2-NZ 2.89Å; N513-K535 PolarHBondContact OD1-NZ 2.98Å; N513-K535 VanDerWaalsContact OD1-NZ 3.1Å
514	D	77.6	Confident	87.7	Confident	107 Å²	107	66 Å²	66	57%	0.572	32%	0.316	S	S	*	.			trans	-77	110.6	171	-70.9	-24.8	0	0	0	109.6	C529 D530	D514-C529 CarbonylContact O-C 3.59Å; D514-C529 WeakPolarHBondContact O-CA 3.33Å; D514-D530 VanDerWaalsContact CB-OD1 3.31Å; D514-D530 WeakPolarHBondContact CB-OD1 3.47Å; D514-D530 PolarHBondContact N-OD1 3.37Å; D514-D530 PolarHBondContact O-N 3.49Å; D514-D530 VanDerWaalsContact O-N 3.12Å
515	F	86.1	Confident	87.6	Confident	21 Å²	21	64.7 Å²	64.7	9%	0.092	31%	0.311	C	S	.	.			trans	-70.4	133	174.8	174.5	-98.2	0	0	0	110.6	D478 L489 L510 N513 A518 C527	D478-F515 HydrophobicContact CB-CE1 4.33Å; D478-F515 HydrophobicContact CB-CZ 3.91Å; D478-F515 VanDerWaalsContact OD2-CZ 3.25Å; D478-F515 WeakPolarHBondContact OD2-CZ 3.37Å; L489-F515 HydrophobicContact CD2-CD2 4.11Å; L489-F515 HydrophobicContact CD2-CE2 3.54Å; L489-F515 HydrophobicContact CD2-CZ 4.29Å; L489-F515 HydrophobicContact CG-CD2 4.19Å; L489-F515 HydrophobicContact CG-CE2 3.83Å; L489-F515 HydrophobicContact CG-CZ 4.33Å; L510-F515 HydrophobicContact CD1-CB 4.37Å; L510-F515 HydrophobicContact CD1-CD2 3.93Å; N513-F515 PolarHBondContact O-N 2.98Å; F515-A518 HydrophobicContact CE2-CB 3.73Å; F515-A518 HydrophobicContact CZ-CB 3.86Å; F515-C527 HydrophobicContact CD2-CB 4.44Å; F515-C527 HydrophobicContact CE2-CB 4.12Å
516	Q	87.3	Confident	87.6	Confident	94 Å²	94	61.2 Å²	61.2	44%	0.439	29%	0.292	S	S	.	.			trans	-111.5	-55.8	177	-60.1	-59.6	-40.3	0	0	112.2	I528 I531	Q516-I528 HydrophobicContact CB-CB 4.27Å; Q516-I528 HydrophobicContact CB-CG2 4.11Å; Q516-I528 HydrophobicContact CG-CG2 4.38Å; Q516-I528 PolarHBondContact N-O 2.98Å; Q516-I531 HydrophobicContact CG-CD1 4.28Å; Q516-I531 HydrophobicContact CG-CG1 4.28Å
517	E	89.7	Confident	87.6	Confident	30 Å²	30	53 Å²	53	14%	0.14	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	151	-174.1	-170.5	80.5	178.5	0	0	109.7	D478 C527 I528 R560 I561	D478-E517 WeakPolarHBondContact OD2-CA 3.26Å; E517-C527 CarbonylContact O-C 3.59Å; E517-C527 VanDerWaalsContact O-CA 3.24Å; E517-C527 WeakPolarHBondContact O-CA 3.47Å; E517-I528 PolarHBondContact O-N 3.39Å; E517-R560 WeakPolarHBondContact OE1-CD 3.33Å; E517-R560 IonicContact OE2-CZ 3.27Å; E517-R560 IonicContact OE2-NE 2.78Å; E517-R560 IonicContact OE2-NH1 3.63Å; E517-R560 PolarHBondContact OE2-NH1 2.89Å; E517-I561 HydrophobicContact CB-CG2 4.38Å; E517-I561 HydrophobicContact CG-CG2 3.84Å
518	A	92.9	Very high	87.5	Confident	9 Å²	9	52 Å²	52	7%	0.074	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	151.4	169.6	0	0	0	0	0	113.6	D478 M480 L489 F515 I525 Y526 C527	D478-A518 PolarHBondContact OD2-N 2.95Å; M480-A518 HydrophobicContact CE-CB 3.72Å; M480-A518 HydrophobicContact SD-CB 3.6Å; L489-A518 HydrophobicContact CD2-CB 4.21Å; F515-A518 HydrophobicContact CE2-CB 3.73Å; F515-A518 HydrophobicContact CZ-CB 3.86Å; A518-I525 HydrophobicContact CB-CG2 3.91Å; A518-Y526 CarbonylContact C-O 2.97Å; A518-Y526 WeakPolarHBondContact CA-O 3.24Å; A518-C527 HydrophobicContact CB-CB 3.9Å
519	C	93.6	Very high	87.5	Confident	21 Å²	21	48.7 Å²	48.7	14%	0.142	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	153.6	173.2	-173.5	0	0	0	0	110.4	Y526 I561 K563	C519-Y526 PolarHBondContact N-O 2.86Å; C519-Y526 PolarHBondContact O-N 2.82Å; C519-I561 HydrophobicContact CB-CG1 4.44Å; C519-I561 HydrophobicContact CB-CG2 3.85Å; C519-I561 WeakPolarHBondContact CB-O 3.48Å; C519-K563 PolarHBondContact SG-N 3.42Å
520	V	93.9	Very high	87.5	Confident	32 Å²	32	50.2 Å²	50.2	19%	0.194	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	125	173.5	177	0	0	0	0	109.8	M480 I482 E524	M480-V520 HydrophobicContact CB-CG2 3.64Å; M480-V520 HydrophobicContact CG-CG2 3.94Å; M480-V520 HydrophobicContact SD-CG2 4.04Å; I482-V520 HydrophobicContact CD1-CG2 4.19Å; I482-V520 HydrophobicContact CG1-CB 4.49Å; I482-V520 HydrophobicContact CG1-CG1 3.91Å; I482-V520 HydrophobicContact CG1-CG2 3.69Å; V520-E524 WeakPolarHBondContact CA-O 3.4Å
521	F	93.4	Very high	87.5	Confident	1 Å²	1	53 Å²	53	0%	0.004	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	134.1	174.6	-177.1	-110.4	0	0	0	109.3	E523 E524 Y526 K563 Q566 L568 I590	F521-E523 VanDerWaalsContact C-N 3.26Å; F521-E523 PolarHBondContact O-N 3.06Å; F521-E524 PolarHBondContact N-O 3.1Å; F521-E524 PolarHBondContact O-N 3.37Å; F521-E524 VanDerWaalsContact O-O 3.11Å; F521-Y526 HydrophobicContact CB-CD2 3.74Å; F521-Y526 HydrophobicContact CB-CE2 3.78Å; F521-Y526 HydrophobicContact CB-CG 4.49Å; F521-Y526 AromaticContact CD1-CE2 3.87Å; F521-Y526 HydrophobicContact CD1-CE2 3.87Å; F521-Y526 AromaticContact CD1-CZ 3.86Å; F521-Y526 HydrophobicContact CG-CE2 4.33Å; F521-Y526 WeakPolarHBondContact O-CE2 3.43Å; F521-K563 HydrophobicContact CD2-CB 4.42Å; F521-K563 HydrophobicContact CD2-CD 4.37Å; F521-K563 HydrophobicContact CD2-CG 4.02Å; F521-Q566 WeakPolarHBondContact CZ-O 3.31Å; F521-L568 HydrophobicContact CB-CD1 3.97Å; F521-L568 HydrophobicContact CD1-CB 4.11Å; F521-L568 HydrophobicContact CD1-CD2 4.3Å; F521-L568 HydrophobicContact CD2-CB 4.26Å; F521-L568 HydrophobicContact CE1-CB 4.17Å; F521-L568 HydrophobicContact CE2-CB 4.34Å; F521-L568 HydrophobicContact CG-CB 4.15Å; F521-L568 HydrophobicContact CG-CD1 4.15Å; F521-L568 HydrophobicContact CZ-CB 4.29Å; F521-I590 HydrophobicContact CE1-CD1 3.67Å; F521-I590 HydrophobicContact CE1-CG1 4.17Å; F521-I590 HydrophobicContact CZ-CD1 3.75Å
522	N	90.5	Very high	88	Confident	94 Å²	94	45.8 Å²	45.8	50%	0.503	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.3	42.6	-177	-65.3	-15.6	0	0	0	114.8	E524	N522-E524 PolarHBondContact O-N 2.89Å; N522-E524 VanDerWaalsContact O-N 3.17Å
523	E	91.8	Very high	89.1	Confident	97 Å²	97	35.4 Å²	35.4	45%	0.453	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.9	16.2	-177.3	-49.1	-169.3	125.9	0	0	115.4	I482 R483 F521 P539	I482-E523 HydrophobicContact CG2-CB 4.35Å; R483-E523 WeakPolarHBondContact CG-OE1 3.25Å; R483-E523 IonicContact CZ-OE1 3.78Å; R483-E523 IonicContact CZ-OE2 3.55Å; R483-E523 IonicContact NE-OE1 2.8Å; R483-E523 PolarHBondContact NE-OE1 2.72Å; R483-E523 IonicContact NE-OE2 2.89Å; R483-E523 PolarHBondContact NE-OE2 2.79Å; R483-E523 IonicContact NH2-OE1 2.74Å; R483-E523 IonicContact NH2-OE2 3.47Å; R483-E523 PolarHBondContact NH2-OE2 3.03Å; F521-E523 VanDerWaalsContact C-N 3.26Å; F521-E523 PolarHBondContact O-N 3.06Å; E523-P539 VanDerWaalsContact O-CD 3.29Å; E523-P539 WeakPolarHBondContact O-CD 3.33Å; E523-P539 WeakPolarHBondContact O-CG 3.28Å
524	E	93.9	Very high	90	Very high	22 Å²	22	34.2 Å²	34.2	10%	0.103	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	156.1	174.7	-63	-178	132.5	0	0	109.9	V520 F521 N522 Y526 V536 Y537 N538 R545	V520-E524 WeakPolarHBondContact CA-O 3.4Å; F521-E524 PolarHBondContact N-O 3.1Å; F521-E524 PolarHBondContact O-N 3.37Å; F521-E524 VanDerWaalsContact O-O 3.11Å; N522-E524 PolarHBondContact O-N 2.89Å; N522-E524 VanDerWaalsContact O-N 3.17Å; E524-Y526 HydrophobicContact CB-CD2 4.43Å; E524-Y526 HydrophobicContact CB-CE2 3.98Å; E524-V536 HydrophobicContact CB-CG1 3.74Å; E524-V536 HydrophobicContact CG-CG1 4.44Å; E524-Y537 WeakPolarHBondContact CA-O 3.21Å; E524-Y537 WeakPolarHBondContact CB-O 3.35Å; E524-N538 PolarHBondContact OE1-ND2 3.12Å; E524-R545 IonicContact OE1-CZ 2.99Å; E524-R545 IonicContact OE1-NH1 3.5Å; E524-R545 PolarHBondContact OE1-NH1 3.07Å; E524-R545 IonicContact OE1-NH2 3.9Å; E524-R545 PolarHBondContact OE1-NH2 2.92Å; E524-R545 IonicContact OE2-CZ 2.83Å; E524-R545 IonicContact OE2-NH1 2.65Å; E524-R545 IonicContact OE2-NH2 3.57Å; E524-R545 PolarHBondContact OE2-NH2 3.2Å
525	I	94.4	Very high	90.7	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	115.8	177.2	-56	174.9	0	0	0	108.5	M480 I482 Y487 L489 M494 A518 V536 Y537	M480-I525 HydrophobicContact CE-CD1 4.26Å; M480-I525 HydrophobicContact CE-CG2 3.79Å; M480-I525 HydrophobicContact SD-CG1 4.39Å; M480-I525 HydrophobicContact SD-CG2 3.61Å; I482-I525 HydrophobicContact CD1-CD1 3.81Å; I482-I525 HydrophobicContact CD1-CG1 3.39Å; Y487-I525 HydrophobicContact CD1-CD1 4.12Å; Y487-I525 HydrophobicContact CG-CD1 4.13Å; L489-I525 HydrophobicContact CD2-CG2 4.23Å; M494-I525 HydrophobicContact SD-CD1 4.1Å; A518-I525 HydrophobicContact CB-CG2 3.91Å; I525-V536 CarbonylContact O-C 3.59Å; I525-V536 VanDerWaalsContact O-CA 3.23Å; I525-V536 WeakPolarHBondContact O-CA 3.38Å; I525-Y537 HydrophobicContact CD1-CD1 4.01Å; I525-Y537 HydrophobicContact CG1-CD1 4.44Å; I525-Y537 PolarHBondContact N-O 2.86Å; I525-Y537 PolarHBondContact O-N 3.27Å
526	Y	93.6	Very high	91	Very high	8 Å²	8	29.9 Å²	29.9	3%	0.031	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	122.7	174.5	-75.4	-109.2	0	0	0	108.2	A518 C519 F521 E524 M534 V536 L568	A518-Y526 CarbonylContact C-O 2.97Å; A518-Y526 WeakPolarHBondContact CA-O 3.24Å; C519-Y526 PolarHBondContact N-O 2.86Å; C519-Y526 PolarHBondContact O-N 2.82Å; F521-Y526 HydrophobicContact CB-CD2 3.74Å; F521-Y526 HydrophobicContact CB-CE2 3.78Å; F521-Y526 HydrophobicContact CB-CG 4.49Å; F521-Y526 AromaticContact CD1-CE2 3.87Å; F521-Y526 HydrophobicContact CD1-CE2 3.87Å; F521-Y526 AromaticContact CD1-CZ 3.86Å; F521-Y526 HydrophobicContact CG-CE2 4.33Å; F521-Y526 WeakPolarHBondContact O-CE2 3.43Å; E524-Y526 HydrophobicContact CB-CD2 4.43Å; E524-Y526 HydrophobicContact CB-CE2 3.98Å; Y526-M534 HydrophobicContact CD1-CE 3.57Å; Y526-M534 HydrophobicContact CG-CE 4.13Å; Y526-V536 HydrophobicContact CD1-CG2 3.39Å; Y526-V536 HydrophobicContact CD2-CG1 4.25Å; Y526-V536 HydrophobicContact CD2-CG2 4.27Å; Y526-V536 HydrophobicContact CE1-CG2 3.5Å; Y526-V536 VanDerWaalsContact CE1-CG2 3.5Å; Y526-V536 HydrophobicContact CE2-CG1 4.04Å; Y526-V536 HydrophobicContact CE2-CG2 4.34Å; Y526-V536 HydrophobicContact CG-CG2 3.82Å; Y526-L568 HydrophobicContact CD1-CD2 3.51Å; Y526-L568 HydrophobicContact CE1-CD2 3.81Å; Y526-L568 HydrophobicContact CG-CD2 4.04Å
527	C	92.6	Very high	91.3	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	141.2	-179.9	71.5	0	0	0	0	113.2	F515 E517 A518 M534 K535 W544	F515-C527 HydrophobicContact CD2-CB 4.44Å; F515-C527 HydrophobicContact CE2-CB 4.12Å; E517-C527 CarbonylContact O-C 3.59Å; E517-C527 VanDerWaalsContact O-CA 3.24Å; E517-C527 WeakPolarHBondContact O-CA 3.47Å; A518-C527 HydrophobicContact CB-CB 3.9Å; C527-M534 WeakPolarHBondContact O-CA 3.42Å; C527-M534 WeakPolarHBondContact O-CG 3.42Å; C527-K535 PolarHBondContact N-O 3.11Å; C527-K535 PolarHBondContact O-N 3.42Å; C527-K535 PolarHBondContact SG-O 2.89Å; C527-K535 VanDerWaalsContact SG-O 3.41Å; C527-W544 WeakPolarHBondContact SG-CZ3 3.4Å
528	I	91.5	Very high	91.4	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	121.7	167.7	-56.8	175.3	0	0	0	107	Q516 E517 I531 I550 I561 L570	Q516-I528 HydrophobicContact CB-CB 4.27Å; Q516-I528 HydrophobicContact CB-CG2 4.11Å; Q516-I528 HydrophobicContact CG-CG2 4.38Å; Q516-I528 PolarHBondContact N-O 2.98Å; E517-I528 PolarHBondContact O-N 3.39Å; I528-I531 HydrophobicContact CG2-CG1 4.03Å; I528-I550 HydrophobicContact CD1-CD1 4.38Å; I528-I550 HydrophobicContact CG1-CG2 4.49Å; I528-I550 HydrophobicContact CG2-CD1 3.9Å; I528-I561 HydrophobicContact CD1-CB 4.17Å; I528-I561 HydrophobicContact CD1-CG2 4.29Å; I528-I561 HydrophobicContact CG1-CG2 4.43Å; I528-L570 HydrophobicContact CD1-CD1 3.73Å
529	C	88.8	Confident	91.3	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.141	C	C	.	.			trans	-107.5	-154.7	177.1	-66	0	0	0	0	109.4	N513 D514 I531 V533	N513-C529 HydrophobicContact CB-CB 4.05Å; D514-C529 CarbonylContact O-C 3.59Å; D514-C529 WeakPolarHBondContact O-CA 3.33Å; C529-I531 WeakPolarHBondContact O-CA 3.42Å; C529-I531 PolarHBondContact O-N 2.65Å; C529-V533 HydrophobicContact CB-CB 4.41Å; C529-V533 HydrophobicContact CB-CG1 4.43Å; C529-V533 PolarHBondContact N-O 3.27Å
530	D	85.9	Confident	91.1	Very high	58 Å²	58	29.1 Å²	29.1	31%	0.31	16%	0.156	S	C	.	.	S	Bend	trans	-39.9	95.8	171.6	-51.9	-53.5	0	0	0	111.3	N513 D514 V533	N513-D530 WeakPolarHBondContact CA-OD2 3.43Å; N513-D530 WeakPolarHBondContact CB-OD2 3.43Å; N513-D530 PolarHBondContact ND2-OD2 2.89Å; N513-D530 VanDerWaalsContact ND2-OD2 3.09Å; D514-D530 VanDerWaalsContact CB-OD1 3.31Å; D514-D530 WeakPolarHBondContact CB-OD1 3.47Å; D514-D530 PolarHBondContact N-OD1 3.37Å; D514-D530 PolarHBondContact O-N 3.49Å; D514-D530 VanDerWaalsContact O-N 3.12Å; D530-V533 VanDerWaalsContact O-CB 3.31Å; D530-V533 WeakPolarHBondContact O-CB 3.48Å; D530-V533 WeakPolarHBondContact O-CG2 3.42Å; D530-V533 PolarHBondContact O-N 2.87Å
531	I	83.9	Confident	91	Very high	68 Å²	68	35.7 Å²	35.7	35%	0.349	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.7	128.6	-168.2	-70.9	163.1	0	0	0	108.9	Q516 I528 C529 I550 L552 Y559	Q516-I531 HydrophobicContact CG-CD1 4.28Å; Q516-I531 HydrophobicContact CG-CG1 4.28Å; I528-I531 HydrophobicContact CG2-CG1 4.03Å; C529-I531 WeakPolarHBondContact O-CA 3.42Å; C529-I531 PolarHBondContact O-N 2.65Å; I531-I550 HydrophobicContact CG1-CD1 4.43Å; I531-I550 HydrophobicContact CG2-CD1 4.29Å; I531-L552 HydrophobicContact CG2-CD2 3.52Å; I531-Y559 HydrophobicContact CD1-CD2 3.61Å; I531-Y559 HydrophobicContact CD1-CE2 3.61Å; I531-Y559 HydrophobicContact CD1-CG 4.42Å; I531-Y559 HydrophobicContact CG2-CE2 4.46Å
532	P	88.3	Confident	90.8	Very high	26 Å²	26	37.7 Å²	37.7	17%	0.169	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	cis	-100.8	20.7	13.3	39.7	-37.3	0	0	0	115.6	M534 N549 I550 L552	P532-M534 PolarHBondContact O-N 3.22Å; P532-N549 HydrophobicContact CB-CB 3.99Å; P532-N549 HydrophobicContact CG-CB 3.9Å; P532-N549 VanDerWaalsContact O-CA 3.28Å; P532-N549 WeakPolarHBondContact O-CA 3.24Å; P532-N549 WeakPolarHBondContact O-CB 3.24Å; P532-I550 HydrophobicContact CB-CG1 3.65Å; P532-I550 VanDerWaalsContact CB-O 3.3Å; P532-I550 WeakPolarHBondContact CB-O 3.28Å; P532-I550 PolarHBondContact O-N 3.09Å; P532-L552 HydrophobicContact CB-CD1 4.24Å; P532-L552 HydrophobicContact CB-CD2 3.73Å; P532-L552 HydrophobicContact CB-CG 3.76Å; P532-L552 HydrophobicContact CG-CD1 3.83Å; P532-L552 HydrophobicContact CG-CD2 4.14Å; P532-L552 HydrophobicContact CG-CG 3.93Å
533	V	89.6	Confident	90.9	Very high	31 Å²	31	38.5 Å²	38.5	19%	0.188	20%	0.195	C	C	.	.			trans	-69.2	129	-171.9	178.3	0	0	0	0	111.5	C529 D530 K535	C529-V533 HydrophobicContact CB-CB 4.41Å; C529-V533 HydrophobicContact CB-CG1 4.43Å; C529-V533 PolarHBondContact N-O 3.27Å; D530-V533 VanDerWaalsContact O-CB 3.31Å; D530-V533 WeakPolarHBondContact O-CB 3.48Å; D530-V533 WeakPolarHBondContact O-CG2 3.42Å; D530-V533 PolarHBondContact O-N 2.87Å; V533-K535 HydrophobicContact CG1-CG 4.34Å
534	M	90.6	Very high	90.9	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	134.8	174.2	-164.5	176.8	-169.5	0	0	111.6	Y526 C527 P532 M547 I550 I561 L568 W595	Y526-M534 HydrophobicContact CD1-CE 3.57Å; Y526-M534 HydrophobicContact CG-CE 4.13Å; C527-M534 WeakPolarHBondContact O-CA 3.42Å; C527-M534 WeakPolarHBondContact O-CG 3.42Å; P532-M534 PolarHBondContact O-N 3.22Å; M534-M547 PolarHBondContact O-N 3.35Å; M534-I550 HydrophobicContact SD-CG2 4.39Å; M534-I561 HydrophobicContact CE-CD1 3.16Å; M534-L568 HydrophobicContact CE-CD2 4.31Å; M534-W595 HydrophobicContact CE-CZ2 4.14Å; M534-W595 HydrophobicContact SD-CZ2 3.71Å
535	K	91.6	Very high	90.8	Very high	36 Å²	36	40 Å²	40	16%	0.157	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	149.4	177.5	-69.9	177.7	174.9	168	0	110.9	L510 N513 C527 V533 W544 R545	L510-K535 HydrophobicContact CD2-CD 3.97Å; N513-K535 VanDerWaalsContact CG-NZ 3.25Å; N513-K535 PolarHBondContact ND2-NZ 2.89Å; N513-K535 PolarHBondContact OD1-NZ 2.98Å; N513-K535 VanDerWaalsContact OD1-NZ 3.1Å; C527-K535 PolarHBondContact N-O 3.11Å; C527-K535 PolarHBondContact O-N 3.42Å; C527-K535 PolarHBondContact SG-O 2.89Å; C527-K535 VanDerWaalsContact SG-O 3.41Å; V533-K535 HydrophobicContact CG1-CG 4.34Å; K535-W544 HydrophobicContact CB-CE3 3.89Å; K535-W544 HydrophobicContact CB-CZ3 4.25Å; K535-R545 CarbonylContact C-O 3.49Å; K535-R545 VanDerWaalsContact CA-O 3.3Å; K535-R545 WeakPolarHBondContact CA-O 3.12Å
536	V	92.8	Very high	90.5	Very high	1 Å²	1	46 Å²	46	1%	0.006	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	131.7	177.9	179	0	0	0	0	109.5	E524 I525 Y526 W544 R545 M547	E524-V536 HydrophobicContact CB-CG1 3.74Å; E524-V536 HydrophobicContact CG-CG1 4.44Å; I525-V536 CarbonylContact O-C 3.59Å; I525-V536 VanDerWaalsContact O-CA 3.23Å; I525-V536 WeakPolarHBondContact O-CA 3.38Å; Y526-V536 HydrophobicContact CD1-CG2 3.39Å; Y526-V536 HydrophobicContact CD2-CG1 4.25Å; Y526-V536 HydrophobicContact CD2-CG2 4.27Å; Y526-V536 HydrophobicContact CE1-CG2 3.5Å; Y526-V536 VanDerWaalsContact CE1-CG2 3.5Å; Y526-V536 HydrophobicContact CE2-CG1 4.04Å; Y526-V536 HydrophobicContact CE2-CG2 4.34Å; Y526-V536 HydrophobicContact CG-CG2 3.82Å; V536-W544 CarbonylContact O-C 3.57Å; V536-W544 WeakPolarHBondContact O-CA 3.27Å; V536-R545 HydrophobicContact CB-CG 3.99Å; V536-R545 PolarHBondContact N-O 2.87Å; V536-R545 PolarHBondContact O-N 2.75Å; V536-M547 HydrophobicContact CB-CG 4.19Å; V536-M547 HydrophobicContact CG2-CG 3.34Å; V536-M547 HydrophobicContact CG2-SD 4.2Å
537	Y	93.6	Very high	90.2	Very high	6 Å²	6	47 Å²	47	2%	0.024	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	125.9	174.2	178.3	-108.8	0	0	0	110.8	Y487 M494 V508 E524 I525 P539 A542 E543 W544	Y487-Y537 HydrophobicContact CE1-CE1 4.36Å; M494-Y537 HydrophobicContact CE-CD1 3.62Å; M494-Y537 HydrophobicContact CE-CD2 3.94Å; M494-Y537 HydrophobicContact CE-CE1 3.25Å; M494-Y537 HydrophobicContact CE-CE2 3.61Å; M494-Y537 HydrophobicContact CE-CG 3.93Å; M494-Y537 HydrophobicContact SD-CD1 4.25Å; M494-Y537 HydrophobicContact SD-CE1 4.3Å; V508-Y537 HydrophobicContact CB-CE2 4.23Å; E524-Y537 WeakPolarHBondContact CA-O 3.21Å; E524-Y537 WeakPolarHBondContact CB-O 3.35Å; I525-Y537 HydrophobicContact CD1-CD1 4.01Å; I525-Y537 HydrophobicContact CG1-CD1 4.44Å; I525-Y537 PolarHBondContact N-O 2.86Å; I525-Y537 PolarHBondContact O-N 3.27Å; Y537-P539 HydrophobicContact CD1-CB 4.49Å; Y537-P539 HydrophobicContact CE1-CB 4.05Å; Y537-P539 WeakPolarHBondContact O-CD 3.47Å; Y537-A542 VanDerWaalsContact CE2-C 3.47Å; Y537-A542 WeakPolarHBondContact OH-CA 3.4Å; Y537-E543 WeakPolarHBondContact CA-O 3.43Å; Y537-E543 VanDerWaalsContact CD2-O 3.28Å; Y537-E543 WeakPolarHBondContact CD2-O 3.48Å; Y537-W544 AromaticContact CD2-CD1 3.81Å; Y537-W544 AromaticContact CD2-CD2 3.94Å; Y537-W544 HydrophobicContact CD2-CD2 3.94Å; Y537-W544 AromaticContact CD2-CE2 3.64Å; Y537-W544 HydrophobicContact CD2-CG 4.07Å; Y537-W544 HydrophobicContact CD2-CZ2 4.13Å; Y537-W544 AromaticContact CD2-NE1 3.53Å; Y537-W544 HydrophobicContact CG-CD2 4.3Å; Y537-W544 AromaticContact CG-CE2 4Å; Y537-W544 HydrophobicContact CG-CH2 4.38Å; Y537-W544 HydrophobicContact CG-CZ2 4.06Å
538	N	92.5	Very high	89.9	Confident	28 Å²	28	50.7 Å²	50.7	15%	0.15	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	113.3	170.9	-172.4	-62.9	0	0	0	109.6	E524 V540 R541 A542 E543	E524-N538 PolarHBondContact OE1-ND2 3.12Å; N538-V540 VanDerWaalsContact C-N 3.28Å; N538-V540 PolarHBondContact O-N 2.99Å; N538-V540 WeakPolarHBondContact OD1-CA 3.47Å; N538-V540 WeakPolarHBondContact OD1-CB 3.31Å; N538-V540 PolarHBondContact OD1-N 3.04Å; N538-R541 HydrophobicContact CB-CB 4.37Å; N538-R541 PolarHBondContact O-N 2.96Å; N538-R541 PolarHBondContact OD1-N 2.78Å; N538-A542 WeakPolarHBondContact O-CA 3.2Å; N538-A542 PolarHBondContact O-N 2.98Å; N538-E543 PolarHBondContact N-O 3.34Å; N538-E543 PolarHBondContact O-N 2.94Å
539	P	91	Very high	89.8	Confident	27 Å²	27	54.4 Å²	54.4	18%	0.175	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-24.7	-177.8	26.3	-33.2	0	0	0	113.4	I482 E523 Y537	I482-P539 HydrophobicContact CD1-CG 4.33Å; I482-P539 HydrophobicContact CG2-CG 4.27Å; E523-P539 VanDerWaalsContact O-CD 3.29Å; E523-P539 WeakPolarHBondContact O-CD 3.33Å; E523-P539 WeakPolarHBondContact O-CG 3.28Å; Y537-P539 HydrophobicContact CD1-CB 4.49Å; Y537-P539 HydrophobicContact CE1-CB 4.05Å; Y537-P539 WeakPolarHBondContact O-CD 3.47Å
540	V	89.8	Confident	89.9	Confident	77 Å²	77	54.7 Å²	54.7	47%	0.467	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-36.9	179.9	-169.1	0	0	0	0	111.3	N538	N538-V540 VanDerWaalsContact C-N 3.28Å; N538-V540 PolarHBondContact O-N 2.99Å; N538-V540 WeakPolarHBondContact OD1-CA 3.47Å; N538-V540 WeakPolarHBondContact OD1-CB 3.31Å; N538-V540 PolarHBondContact OD1-N 3.04Å
541	R	90.6	Very high	90	Very high	170 Å²	170	53.4 Å²	53.4	64%	0.642	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-11.1	179	-50.7	-45.7	168.5	-158.3	0.3	113.3	N538 E543	N538-R541 HydrophobicContact CB-CB 4.37Å; N538-R541 PolarHBondContact O-N 2.96Å; N538-R541 PolarHBondContact OD1-N 2.78Å; R541-E543 HydrophobicContact CB-CG 3.92Å; R541-E543 PolarHBondContact O-N 2.9Å
542	A	90.3	Very high	89.9	Confident	43 Å²	43	55.6 Å²	55.6	36%	0.355	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.6	37.2	-176.1	0	0	0	0	0	113.4	V508 Y537 N538	V508-A542 HydrophobicContact CG2-CB 4.29Å; V508-A542 VanDerWaalsContact CG2-O 3.26Å; V508-A542 WeakPolarHBondContact CG2-O 3.34Å; Y537-A542 VanDerWaalsContact CE2-C 3.47Å; Y537-A542 WeakPolarHBondContact OH-CA 3.4Å; N538-A542 WeakPolarHBondContact O-CA 3.2Å; N538-A542 PolarHBondContact O-N 2.98Å
543	E	91.9	Very high	89.1	Confident	110 Å²	110	56.8 Å²	56.8	51%	0.514	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	152.5	-176.3	75	-171.8	162.8	0	0	112.5	Y537 N538 R541	Y537-E543 WeakPolarHBondContact CA-O 3.43Å; Y537-E543 VanDerWaalsContact CD2-O 3.28Å; Y537-E543 WeakPolarHBondContact CD2-O 3.48Å; N538-E543 PolarHBondContact N-O 3.34Å; N538-E543 PolarHBondContact O-N 2.94Å; R541-E543 HydrophobicContact CB-CG 3.92Å; R541-E543 PolarHBondContact O-N 2.9Å
544	W	91.1	Very high	88.1	Confident	53 Å²	53	60.3 Å²	60.3	20%	0.201	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	132.1	173.8	-72	91.9	0	0	0	109.6	L489 M494 V508 L510 C527 K535 V536 Y537	L489-W544 HydrophobicContact CD1-CH2 4.49Å; L489-W544 HydrophobicContact CD1-CZ2 4.31Å; L489-W544 HydrophobicContact CD2-CH2 3.93Å; M494-W544 HydrophobicContact CE-CZ2 4.23Å; M494-W544 HydrophobicContact SD-CZ2 4.02Å; V508-W544 PolarHBondContact O-NE1 3.12Å; L510-W544 HydrophobicContact CD1-CH2 4.45Å; L510-W544 HydrophobicContact CD2-CD2 3.83Å; L510-W544 HydrophobicContact CD2-CE3 3.74Å; L510-W544 HydrophobicContact CD2-CH2 3.75Å; L510-W544 HydrophobicContact CD2-CZ2 3.84Å; L510-W544 HydrophobicContact CD2-CZ3 3.71Å; L510-W544 HydrophobicContact CG-CH2 3.97Å; L510-W544 HydrophobicContact CG-CZ2 3.83Å; L510-W544 HydrophobicContact CG-CZ3 4.44Å; C527-W544 WeakPolarHBondContact SG-CZ3 3.4Å; K535-W544 HydrophobicContact CB-CE3 3.89Å; K535-W544 HydrophobicContact CB-CZ3 4.25Å; V536-W544 CarbonylContact O-C 3.57Å; V536-W544 WeakPolarHBondContact O-CA 3.27Å; Y537-W544 AromaticContact CD2-CD1 3.81Å; Y537-W544 AromaticContact CD2-CD2 3.94Å; Y537-W544 HydrophobicContact CD2-CD2 3.94Å; Y537-W544 AromaticContact CD2-CE2 3.64Å; Y537-W544 HydrophobicContact CD2-CG 4.07Å; Y537-W544 HydrophobicContact CD2-CZ2 4.13Å; Y537-W544 AromaticContact CD2-NE1 3.53Å; Y537-W544 HydrophobicContact CG-CD2 4.3Å; Y537-W544 AromaticContact CG-CE2 4Å; Y537-W544 HydrophobicContact CG-CH2 4.38Å; Y537-W544 HydrophobicContact CG-CZ2 4.06Å
545	R	91.6	Very high	87.1	Confident	98 Å²	98	65 Å²	65	37%	0.37	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	150.9	170	67.5	-178.7	-170.8	-118.7	-3.7	110.8	E524 K535 V536 M547	E524-R545 IonicContact OE1-CZ 2.99Å; E524-R545 IonicContact OE1-NH1 3.5Å; E524-R545 PolarHBondContact OE1-NH1 3.07Å; E524-R545 IonicContact OE1-NH2 3.9Å; E524-R545 PolarHBondContact OE1-NH2 2.92Å; E524-R545 IonicContact OE2-CZ 2.83Å; E524-R545 IonicContact OE2-NH1 2.65Å; E524-R545 IonicContact OE2-NH2 3.57Å; E524-R545 PolarHBondContact OE2-NH2 3.2Å; K535-R545 CarbonylContact C-O 3.49Å; K535-R545 VanDerWaalsContact CA-O 3.3Å; K535-R545 WeakPolarHBondContact CA-O 3.12Å; V536-R545 HydrophobicContact CB-CG 3.99Å; V536-R545 PolarHBondContact N-O 2.87Å; V536-R545 PolarHBondContact O-N 2.75Å; R545-M547 HydrophobicContact CG-SD 4.49Å
546	Q	89.4	Confident	86.4	Confident	125 Å²	125	64.4 Å²	64.4	58%	0.584	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.7	140	173	-178.1	170.6	-12.8	0	0	109.4
547	M	87.4	Confident	85.5	Confident	30 Å²	30	68 Å²	68	15%	0.148	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	177.8	174.9	-63.3	-62.3	-62.1	0	0	110.1	M534 V536 R545 Y588	M534-M547 PolarHBondContact O-N 3.35Å; V536-M547 HydrophobicContact CB-CG 4.19Å; V536-M547 HydrophobicContact CG2-CG 3.34Å; V536-M547 HydrophobicContact CG2-SD 4.2Å; R545-M547 HydrophobicContact CG-SD 4.49Å; M547-Y588 WeakPolarHBondContact CE-OH 3.49Å
548	N	86.6	Confident	85.1	Confident	77 Å²	77	68.1 Å²	68.1	41%	0.412	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-59.8	143.6	171	-80.4	-19.3	0	0	0	112.1	D593	N548-D593 WeakPolarHBondContact CB-O 3.37Å; N548-D593 WeakPolarHBondContact CB-OD1 3.48Å; N548-D593 PolarHBondContact ND2-O 3.41Å; N548-D593 PolarHBondContact ND2-OD2 3.37Å; N548-D593 VanDerWaalsContact ND2-OD2 3.14Å
549	N	89.5	Confident	84.8	Confident	79 Å²	79	68 Å²	68	42%	0.422	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-64.8	151.7	-175.8	-70.5	-22	0	0	0	111.3	P532	P532-N549 HydrophobicContact CB-CB 3.99Å; P532-N549 HydrophobicContact CG-CB 3.9Å; P532-N549 VanDerWaalsContact O-CA 3.28Å; P532-N549 WeakPolarHBondContact O-CA 3.24Å; P532-N549 WeakPolarHBondContact O-CB 3.24Å
550	I	90.4	Very high	84.8	Confident	5 Å²	5	69 Å²	69	3%	0.026	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-69.5	152.6	171.3	61.7	169.5	0	0	0	111	I528 I531 P532 M534 L552 Y559 L570 W595	I528-I550 HydrophobicContact CD1-CD1 4.38Å; I528-I550 HydrophobicContact CG1-CG2 4.49Å; I528-I550 HydrophobicContact CG2-CD1 3.9Å; I531-I550 HydrophobicContact CG1-CD1 4.43Å; I531-I550 HydrophobicContact CG2-CD1 4.29Å; P532-I550 HydrophobicContact CB-CG1 3.65Å; P532-I550 VanDerWaalsContact CB-O 3.3Å; P532-I550 WeakPolarHBondContact CB-O 3.28Å; P532-I550 PolarHBondContact O-N 3.09Å; M534-I550 HydrophobicContact SD-CG2 4.39Å; I550-L552 PolarHBondContact O-N 2.77Å; I550-Y559 HydrophobicContact CD1-CD1 3.6Å; I550-Y559 HydrophobicContact CD1-CE1 3.78Å; I550-Y559 HydrophobicContact CD1-CG 4.27Å; I550-L570 HydrophobicContact CB-CD2 3.83Å; I550-L570 HydrophobicContact CG2-CD2 4Å; I550-W595 HydrophobicContact CG2-CZ2 4.15Å
551	P	87.1	Confident	84.9	Confident	31 Å²	31	65.5 Å²	65.5	20%	0.201	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-59.2	129	173.3	-23.6	34.7	0	0	0	111.6	Y586 W595	P551-Y586 HydrophobicContact CB-CD1 4.47Å; P551-Y586 HydrophobicContact CB-CE1 4.01Å; P551-Y586 HydrophobicContact CB-CE2 4.44Å; P551-Y586 HydrophobicContact CG-CD1 3.87Å; P551-Y586 HydrophobicContact CG-CE1 3.91Å; P551-Y586 HydrophobicContact CG-CG 4.19Å; P551-W595 HydrophobicContact CG-CB 3.57Å; P551-W595 HydrophobicContact CG-CG 4.01Å
552	L	81.6	Confident	85	Confident	114 Å²	114	57.7 Å²	57.7	60%	0.597	30%	0.298	S	S	*	.	P	Polyproline II helix	trans	-91	122	171.9	-72.8	173.5	0	0	0	109.6	I531 P532 I550	I531-L552 HydrophobicContact CG2-CD2 3.52Å; P532-L552 HydrophobicContact CB-CD1 4.24Å; P532-L552 HydrophobicContact CB-CD2 3.73Å; P532-L552 HydrophobicContact CB-CG 3.76Å; P532-L552 HydrophobicContact CG-CD1 3.83Å; P532-L552 HydrophobicContact CG-CD2 4.14Å; P532-L552 HydrophobicContact CG-CG 3.93Å; I550-L552 PolarHBondContact O-N 2.77Å
553	V	71.3	Confident	85.1	Confident	51 Å²	51	60.7 Å²	60.7	31%	0.309	30%	0.303	S	S	.	.			trans	-123.3	128.3	170.7	-174.2	0	0	0	0	108.1	T556 Y586	V553-T556 WeakPolarHBondContact O-CB 3.43Å; V553-T556 PolarHBondContact O-N 2.91Å; V553-T556 PolarHBondContact O-OG1 2.88Å; V553-Y586 WeakPolarHBondContact CG2-OH 3.48Å
554	S	68.6	Low	85.1	Confident	105 Å²	105	56.1 Å²	56.1	73%	0.734	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	142.3	176.1	-55.1	0	0	0	0	110.9	T556	S554-T556 VanDerWaalsContact C-N 3.29Å; S554-T556 PolarHBondContact O-N 3.38Å
555	E	71	Confident	84.9	Confident	100 Å²	100	54.7 Å²	54.7	47%	0.467	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.2	24.2	177.8	-46.5	-175.6	147.5	0	0	115.2	Q577	E555-Q577 PolarHBondContact OE1-NE2 2.84Å
556	T	75.7	Confident	84.7	Confident	22 Å²	22	58.3 Å²	58.3	14%	0.135	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	125.7	171	-53.2	0	0	0	0	110.6	V553 S554 Y559 T572	V553-T556 WeakPolarHBondContact O-CB 3.43Å; V553-T556 PolarHBondContact O-N 2.91Å; V553-T556 PolarHBondContact O-OG1 2.88Å; S554-T556 VanDerWaalsContact C-N 3.29Å; S554-T556 PolarHBondContact O-N 3.38Å; T556-Y559 WeakPolarHBondContact CB-OH 3.4Å; T556-Y559 HydrophobicContact CG2-CD1 4.27Å; T556-Y559 HydrophobicContact CG2-CD2 4.09Å; T556-Y559 HydrophobicContact CG2-CE1 3.78Å; T556-Y559 HydrophobicContact CG2-CE2 3.56Å; T556-Y559 HydrophobicContact CG2-CG 4.42Å; T556-Y559 VanDerWaalsContact CG2-CZ 3.4Å; T556-T572 HydrophobicContact CG2-CG2 4.43Å
557	N	74.9	Confident	84.8	Confident	76 Å²	76	56.3 Å²	56.3	41%	0.406	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	-22.5	-176.6	-65.9	-21	0	0	0	114	S573 T575	N557-S573 PolarHBondContact N-O 3.41Å; N557-T575 VanDerWaalsContact ND2-CG2 3.32Å; N557-T575 WeakPolarHBondContact ND2-CG2 3.42Å; N557-T575 PolarHBondContact ND2-OG1 3.36Å
558	N	84	Confident	85.1	Confident	10 Å²	10	54.9 Å²	54.9	5%	0.053	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	136.2	-172	-167.6	10.6	0	0	0	110.3	R560 T572 S573 S609 F611	N558-R560 PolarHBondContact OD1-NH2 2.98Å; N558-T572 WeakPolarHBondContact O-CA 3.42Å; N558-S573 WeakPolarHBondContact CB-OG 3.5Å; N558-S573 PolarHBondContact O-N 2.85Å; N558-S573 VanDerWaalsContact O-N 3.11Å; N558-S609 WeakPolarHBondContact CB-O 3.41Å; N558-S609 PolarHBondContact ND2-O 3.38Å; N558-F611 PolarHBondContact ND2-N 3.25Å; N558-F611 PolarHBondContact ND2-O 2.82Å
559	Y	87.6	Confident	85.4	Confident	26 Å²	26	51.2 Å²	51.2	10%	0.102	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	118.4	178.8	-65.1	-95	0	0	0	107.9	I531 I550 T556 L570 T572	I531-Y559 HydrophobicContact CD1-CD2 3.61Å; I531-Y559 HydrophobicContact CD1-CE2 3.61Å; I531-Y559 HydrophobicContact CD1-CG 4.42Å; I531-Y559 HydrophobicContact CG2-CE2 4.46Å; I550-Y559 HydrophobicContact CD1-CD1 3.6Å; I550-Y559 HydrophobicContact CD1-CE1 3.78Å; I550-Y559 HydrophobicContact CD1-CG 4.27Å; T556-Y559 WeakPolarHBondContact CB-OH 3.4Å; T556-Y559 HydrophobicContact CG2-CD1 4.27Å; T556-Y559 HydrophobicContact CG2-CD2 4.09Å; T556-Y559 HydrophobicContact CG2-CE1 3.78Å; T556-Y559 HydrophobicContact CG2-CE2 3.56Å; T556-Y559 HydrophobicContact CG2-CG 4.42Å; T556-Y559 VanDerWaalsContact CG2-CZ 3.4Å; Y559-L570 HydrophobicContact CD1-CD1 4.39Å; Y559-T572 HydrophobicContact CD1-CG2 3.6Å; Y559-T572 HydrophobicContact CE1-CG2 3.88Å
560	R	89.8	Confident	85.5	Confident	47 Å²	47	47.5 Å²	47.5	18%	0.177	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	132.8	175.1	-66.1	-64.6	179.2	-126.2	-9	109.7	E517 N558 L570 I571 F611 C613	E517-R560 WeakPolarHBondContact OE1-CD 3.33Å; E517-R560 IonicContact OE2-CZ 3.27Å; E517-R560 IonicContact OE2-NE 2.78Å; E517-R560 IonicContact OE2-NH1 3.63Å; E517-R560 PolarHBondContact OE2-NH1 2.89Å; N558-R560 PolarHBondContact OD1-NH2 2.98Å; R560-L570 WeakPolarHBondContact O-CA 3.21Å; R560-I571 HydrophobicContact CB-CB 4.43Å; R560-I571 PolarHBondContact N-O 3.05Å; R560-I571 PolarHBondContact O-N 2.91Å; R560-F611 HydrophobicContact CG-CE2 4.37Å; R560-F611 PolarHBondContact NE-O 2.74Å; R560-F611 VanDerWaalsContact NE-O 3.07Å; R560-F611 PolarHBondContact NH2-O 2.64Å; R560-F611 VanDerWaalsContact NH2-O 3.12Å; R560-C613 VanDerWaalsContact CB-SG 3.59Å
561	I	92.7	Very high	85.5	Confident	3 Å²	3	47.3 Å²	47.3	2%	0.015	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	126.7	173.6	-170.5	168	0	0	0	109.2	E517 C519 I528 M534 L568 L569 W595	E517-I561 HydrophobicContact CB-CG2 4.38Å; E517-I561 HydrophobicContact CG-CG2 3.84Å; C519-I561 HydrophobicContact CB-CG1 4.44Å; C519-I561 HydrophobicContact CB-CG2 3.85Å; C519-I561 WeakPolarHBondContact CB-O 3.48Å; I528-I561 HydrophobicContact CD1-CB 4.17Å; I528-I561 HydrophobicContact CD1-CG2 4.29Å; I528-I561 HydrophobicContact CG1-CG2 4.43Å; M534-I561 HydrophobicContact CE-CD1 3.16Å; I561-L568 HydrophobicContact CD1-CD1 3.77Å; I561-L568 HydrophobicContact CD1-CD2 3.96Å; I561-L568 HydrophobicContact CD1-CG 3.95Å; I561-L568 HydrophobicContact CG1-CD1 3.63Å; I561-L568 HydrophobicContact CG1-CG 4.1Å; I561-L569 WeakPolarHBondContact CA-O 3.45Å; I561-W595 HydrophobicContact CD1-CH2 4.11Å
562	I	93	Very high	85.5	Confident	7 Å²	7	46.1 Å²	46.1	4%	0.036	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	148	-177.7	65.7	169.4	0	0	0	110.6	V346 L569 I571	V346-I562 HydrophobicContact CB-CD1 4.35Å; V346-I562 HydrophobicContact CG1-CD1 3.74Å; V346-I562 HydrophobicContact CG2-CD1 3.71Å; I562-L569 HydrophobicContact CG1-CB 4.03Å; I562-L569 PolarHBondContact N-O 2.62Å; I562-L569 PolarHBondContact O-N 2.93Å; I562-I571 HydrophobicContact CD1-CD1 3.54Å; I562-I571 HydrophobicContact CG1-CD1 4.07Å
563	K	92.3	Very high	85.5	Confident	105 Å²	105	40.7 Å²	40.7	46%	0.457	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	130.1	164.2	174.2	-177.7	175.1	-167.1	0	108.5	C519 F521 G565 S615	C519-K563 PolarHBondContact SG-N 3.42Å; F521-K563 HydrophobicContact CD2-CB 4.42Å; F521-K563 HydrophobicContact CD2-CD 4.37Å; F521-K563 HydrophobicContact CD2-CG 4.02Å; K563-G565 WeakPolarHBondContact CE-O 3.33Å; K563-S615 WeakPolarHBondContact O-CB 3.42Å
564	H	90.9	Very high	85.8	Confident	14 Å²	14	41.8 Å²	41.8	7%	0.065	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	102.2	173.6	-176.1	79.1	0	0	0	108.3	E344 Y362 Q566 K567 L569 S615	E344-H564 PolarHBondContact O-CE1 2.83Å; E344-H564 VanDerWaalsContact O-CE1 3.22Å; Y362-H564 AromaticContact CE2-CD2 3.93Å; Y362-H564 AromaticContact CE2-NE2 3.83Å; H564-Q566 PolarHBondContact O-N 3.14Å; H564-K567 PolarHBondContact N-O 2.73Å; H564-K567 WeakPolarHBondContact O-CA 3.3Å; H564-K567 WeakPolarHBondContact O-CB 3.14Å; H564-K567 PolarHBondContact O-N 2.84Å; H564-L569 HydrophobicContact CB-CD1 3.5Å; H564-L569 HydrophobicContact CB-CG 3.84Å; H564-S615 PolarHBondContact ND1-OG 2.68Å
565	G	87	Confident	85.8	Confident	24 Å²	24	39 Å²	39	25%	0.247	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.2	-117.3	-174.4	0	0	0	0	0	111.7	E344 K563	E344-G565 PolarHBondContact OE1-N 3.36Å; E344-G565 WeakPolarHBondContact OE2-CA 3.18Å; E344-G565 PolarHBondContact OE2-N 3.41Å; K563-G565 WeakPolarHBondContact CE-O 3.33Å
566	Q	88.3	Confident	85.3	Confident	173 Å²	173	35.8 Å²	35.8	81%	0.808	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.3	12.9	175.6	-61.6	-174	-2.1	0	0	112.9	F521 H564	F521-Q566 WeakPolarHBondContact CZ-O 3.31Å; H564-Q566 PolarHBondContact O-N 3.14Å
567	K	91.4	Very high	84.3	Confident	83 Å²	83	41.8 Å²	41.8	36%	0.361	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	157.6	-176.6	-56.5	-62.4	-171	140.5	0	111.3	H564 E587	H564-K567 PolarHBondContact N-O 2.73Å; H564-K567 WeakPolarHBondContact O-CA 3.3Å; H564-K567 WeakPolarHBondContact O-CB 3.14Å; H564-K567 PolarHBondContact O-N 2.84Å; K567-E587 HydrophobicContact CB-CG 4.4Å; K567-E587 HydrophobicContact CD-CG 4.45Å; K567-E587 WeakPolarHBondContact CD-OE1 3.49Å; K567-E587 VanDerWaalsContact CE-OE1 3.29Å; K567-E587 WeakPolarHBondContact CE-OE1 3.19Å; K567-E587 IonicContact NZ-OE1 2.69Å; K567-E587 PolarHBondContact NZ-OE1 3.06Å
568	L	93.4	Very high	83.3	Confident	1 Å²	1	50.2 Å²	50.2	1%	0.005	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	121.3	173.7	-177.5	68.2	0	0	0	107.7	F521 Y526 M534 I561 Y588 W595	F521-L568 HydrophobicContact CB-CD1 3.97Å; F521-L568 HydrophobicContact CD1-CB 4.11Å; F521-L568 HydrophobicContact CD1-CD2 4.3Å; F521-L568 HydrophobicContact CD2-CB 4.26Å; F521-L568 HydrophobicContact CE1-CB 4.17Å; F521-L568 HydrophobicContact CE2-CB 4.34Å; F521-L568 HydrophobicContact CG-CB 4.15Å; F521-L568 HydrophobicContact CG-CD1 4.15Å; F521-L568 HydrophobicContact CZ-CB 4.29Å; Y526-L568 HydrophobicContact CD1-CD2 3.51Å; Y526-L568 HydrophobicContact CE1-CD2 3.81Å; Y526-L568 HydrophobicContact CG-CD2 4.04Å; M534-L568 HydrophobicContact CE-CD2 4.31Å; I561-L568 HydrophobicContact CD1-CD1 3.77Å; I561-L568 HydrophobicContact CD1-CD2 3.96Å; I561-L568 HydrophobicContact CD1-CG 3.95Å; I561-L568 HydrophobicContact CG1-CD1 3.63Å; I561-L568 HydrophobicContact CG1-CG 4.1Å; L568-Y588 HydrophobicContact CD2-CD1 4.12Å; L568-Y588 HydrophobicContact CD2-CG 4.34Å; L568-Y588 WeakPolarHBondContact O-CB 3.32Å; L568-Y588 PolarHBondContact O-N 2.85Å; L568-W595 HydrophobicContact CD2-CH2 4.32Å; L568-W595 HydrophobicContact CG-CH2 4.3Å
569	L	92.8	Very high	82	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	139.8	-178.3	-57.9	-176.5	0	0	0	110.5	P361 I561 I562 H564 V585 Y586 E587 I598	P361-L569 HydrophobicContact CB-CD1 4.29Å; P361-L569 HydrophobicContact CG-CD1 4.19Å; I561-L569 WeakPolarHBondContact CA-O 3.45Å; I562-L569 HydrophobicContact CG1-CB 4.03Å; I562-L569 PolarHBondContact N-O 2.62Å; I562-L569 PolarHBondContact O-N 2.93Å; H564-L569 HydrophobicContact CB-CD1 3.5Å; H564-L569 HydrophobicContact CB-CG 3.84Å; L569-V585 HydrophobicContact CB-CG1 4.31Å; L569-V585 HydrophobicContact CD1-CG1 4.17Å; L569-V585 HydrophobicContact CD2-CG1 4.42Å; L569-Y586 CarbonylContact C-O 3.52Å; L569-Y586 VanDerWaalsContact CA-O 3.26Å; L569-Y586 WeakPolarHBondContact CA-O 3.5Å; L569-E587 HydrophobicContact CD2-CB 3.84Å; L569-E587 HydrophobicContact CD2-CG 4.05Å; L569-I598 HydrophobicContact CD2-CD1 4.16Å
570	L	91.9	Very high	80.8	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	119.3	167.8	172.8	74.5	0	0	0	108.3	I528 I550 Y559 R560 T572 Y586 W595	I528-L570 HydrophobicContact CD1-CD1 3.73Å; I550-L570 HydrophobicContact CB-CD2 3.83Å; I550-L570 HydrophobicContact CG2-CD2 4Å; Y559-L570 HydrophobicContact CD1-CD1 4.39Å; R560-L570 WeakPolarHBondContact O-CA 3.21Å; L570-T572 HydrophobicContact CD1-CG2 4.41Å; L570-T572 HydrophobicContact CD2-CG2 4.11Å; L570-T572 HydrophobicContact CG-CG2 3.93Å; L570-Y586 HydrophobicContact CD2-CD2 4.15Å; L570-Y586 HydrophobicContact CG-CD2 4.43Å; L570-Y586 PolarHBondContact N-O 2.88Å; L570-Y586 PolarHBondContact O-N 2.95Å; L570-W595 HydrophobicContact CB-CE3 3.77Å; L570-W595 HydrophobicContact CB-CH2 3.62Å; L570-W595 HydrophobicContact CB-CZ2 4.39Å; L570-W595 HydrophobicContact CB-CZ3 3.25Å; L570-W595 HydrophobicContact CD2-CE3 4.47Å
571	I	89.6	Confident	79.7	Confident	1 Å²	1	58.6 Å²	58.6	1%	0.005	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	120.7	-179.9	-61.9	177.7	0	0	0	107.5	V346 F348 R560 I562 V583 V585 F611	V346-I571 HydrophobicContact CG1-CD1 3.7Å; V346-I571 HydrophobicContact CG2-CD1 4.4Å; F348-I571 HydrophobicContact CE1-CG2 3.94Å; F348-I571 HydrophobicContact CZ-CD1 4.28Å; F348-I571 HydrophobicContact CZ-CG2 4.32Å; R560-I571 HydrophobicContact CB-CB 4.43Å; R560-I571 PolarHBondContact N-O 3.05Å; R560-I571 PolarHBondContact O-N 2.91Å; I562-I571 HydrophobicContact CD1-CD1 3.54Å; I562-I571 HydrophobicContact CG1-CD1 4.07Å; I571-V583 HydrophobicContact CG2-CG1 3.36Å; I571-V585 HydrophobicContact CG1-CG1 4.16Å; I571-V585 HydrophobicContact CG1-CG2 4.29Å; I571-F611 HydrophobicContact CG2-CE2 4.08Å; I571-F611 HydrophobicContact CG2-CZ 4.04Å
572	T	86.9	Confident	78.8	Confident	6 Å²	6	62.8 Å²	62.8	4%	0.037	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	144.1	-178	60.3	0	0	0	0	110.1	T556 N558 Y559 L570 V583 T584 Y586	T556-T572 HydrophobicContact CG2-CG2 4.43Å; N558-T572 WeakPolarHBondContact O-CA 3.42Å; Y559-T572 HydrophobicContact CD1-CG2 3.6Å; Y559-T572 HydrophobicContact CE1-CG2 3.88Å; L570-T572 HydrophobicContact CD1-CG2 4.41Å; L570-T572 HydrophobicContact CD2-CG2 4.11Å; L570-T572 HydrophobicContact CG-CG2 3.93Å; T572-V583 CarbonylContact O-C 3.54Å; T572-V583 VanDerWaalsContact O-CA 3.27Å; T572-V583 WeakPolarHBondContact O-CA 3.45Å; T572-V583 WeakPolarHBondContact O-CG1 3.33Å; T572-T584 PolarHBondContact N-O 2.98Å; T572-T584 PolarHBondContact O-N 3.38Å; T572-T584 PolarHBondContact OG1-O 3.07Å; T572-Y586 HydrophobicContact CG2-CD2 4.35Å; T572-Y586 HydrophobicContact CG2-CE2 4.11Å
573	S	82.1	Confident	78.2	Confident	1 Å²	1	62.6 Å²	62.6	1%	0.007	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	134.1	176.4	80.3	0	0	0	0	112.3	N557 N558 R582 F611	N557-S573 PolarHBondContact N-O 3.41Å; N558-S573 WeakPolarHBondContact CB-OG 3.5Å; N558-S573 PolarHBondContact O-N 2.85Å; N558-S573 VanDerWaalsContact O-N 3.11Å; S573-R582 WeakPolarHBondContact CA-O 3.42Å; S573-F611 VanDerWaalsContact CB-CE1 3.43Å
574	R	76.8	Confident	77.9	Confident	74 Å²	74	58 Å²	58	28%	0.279	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	137.5	174.7	60	178.1	174.3	168.6	-4.1	110.9	P576 N581 R582	R574-P576 WeakPolarHBondContact O-CD 3.38Å; R574-N581 WeakPolarHBondContact O-CA 3.19Å; R574-R582 HydrophobicContact CG-CB 3.8Å; R574-R582 WeakPolarHBondContact CG-O 3.04Å; R574-R582 PolarHBondContact N-O 3.04Å; R574-R582 VanDerWaalsContact NH2-CD 3.33Å; R574-R582 PolarHBondContact O-N 2.98Å
575	T	68.9	Low	77.8	Confident	45 Å²	45	57.8 Å²	57.8	28%	0.276	26%	0.263	S	S	.	.			trans	-104	97.9	166.6	55.7	0	0	0	0	107.5	N557 Q577 N581	N557-T575 VanDerWaalsContact ND2-CG2 3.32Å; N557-T575 WeakPolarHBondContact ND2-CG2 3.42Å; N557-T575 PolarHBondContact ND2-OG1 3.36Å; T575-Q577 PolarHBondContact O-N 3.45Å; T575-N581 WeakPolarHBondContact CG2-OD1 3.31Å
576	P	62.2	Low	78	Confident	34 Å²	34	57.7 Å²	57.7	22%	0.221	26%	0.255	C	S	.	.			trans	-62.4	142	171.8	-7.4	21.1	0	0	0	108.3	R574 W578 K579 K580	R574-P576 WeakPolarHBondContact O-CD 3.38Å; P576-W578 PolarHBondContact O-N 2.88Å; P576-K579 HydrophobicContact CB-CB 4.1Å; P576-K579 HydrophobicContact CG-CB 4.04Å; P576-K579 PolarHBondContact O-N 3.03Å; P576-K580 WeakPolarHBondContact CD-O 3.39Å
577	Q	54	Low	78.2	Confident	148 Å²	148	50.6 Å²	50.6	69%	0.692	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-11.6	-165.4	-65.7	-176.4	3.8	0	0	116.3	E555 T575	E555-Q577 PolarHBondContact OE1-NE2 2.84Å; T575-Q577 PolarHBondContact O-N 3.45Å
578	W	53.8	Low	78.2	Confident	252 Å²	252	46.9 Å²	46.9	96%	0.955	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-149.3	23.2	172.9	-60.6	86	0	0	0	114.6	P576	P576-W578 PolarHBondContact O-N 2.88Å
579	K	55.8	Low	77.9	Confident	123 Å²	123	49.3 Å²	49.3	54%	0.535	22%	0.219	S	C	.	.	S	Bend	trans	-133.3	169.1	-176.9	-76	-168.8	174.1	-167.1	0	113.8	P576 E635	P576-K579 HydrophobicContact CB-CB 4.1Å; P576-K579 HydrophobicContact CG-CB 4.04Å; P576-K579 PolarHBondContact O-N 3.03Å; K579-E635 IonicContact NZ-OE1 3.41Å; K579-E635 PolarHBondContact NZ-OE1 2.99Å; K579-E635 IonicContact NZ-OE2 2.97Å; K579-E635 PolarHBondContact NZ-OE2 2.91Å
580	K	62.4	Low	77.5	Confident	111 Å²	111	53.4 Å²	53.4	48%	0.483	24%	0.24	S	C	.	.			trans	-50.9	143.9	176.2	-55.3	-177.9	-177.4	178.7	0	112	P576 R582 L605	P576-K580 WeakPolarHBondContact CD-O 3.39Å; K580-R582 PolarHBondContact O-N 3.39Å; K580-L605 HydrophobicContact CB-CD2 4.49Å; K580-L605 HydrophobicContact CD-CD1 4.37Å; K580-L605 HydrophobicContact CD-CD2 3.76Å; K580-L605 HydrophobicContact CD-CG 3.94Å; K580-L605 HydrophobicContact CG-CD2 3.68Å; K580-L605 HydrophobicContact CG-CG 4.3Å
581	N	67.1	Low	77.2	Confident	26 Å²	26	65 Å²	65	14%	0.139	28%	0.283	C	S	.	.			trans	-58.8	132.9	173.5	-74.1	-6.6	0	0	0	110.7	R574 T575 G603 L604 F607	R574-N581 WeakPolarHBondContact O-CA 3.19Å; T575-N581 WeakPolarHBondContact CG2-OD1 3.31Å; N581-G603 WeakPolarHBondContact O-CA 3.45Å; N581-L604 PolarHBondContact O-N 3.26Å; N581-F607 PolarHBondContact ND2-O 2.87Å
582	R	73.8	Confident	76.9	Confident	90 Å²	90	66.6 Å²	66.6	34%	0.34	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	124.6	173.9	-69.2	-175.8	169.7	-167.9	-9.5	108.5	S573 R574 K580 E632	S573-R582 WeakPolarHBondContact CA-O 3.42Å; R574-R582 HydrophobicContact CG-CB 3.8Å; R574-R582 WeakPolarHBondContact CG-O 3.04Å; R574-R582 PolarHBondContact N-O 3.04Å; R574-R582 VanDerWaalsContact NH2-CD 3.33Å; R574-R582 PolarHBondContact O-N 2.98Å; K580-R582 PolarHBondContact O-N 3.39Å; R582-E632 IonicContact NH2-OE1 2.74Å; R582-E632 PolarHBondContact NH2-OE1 3.09Å
583	V	80.4	Confident	76.8	Confident	3 Å²	3	68.4 Å²	68.4	2%	0.018	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	131.3	170.9	-179.5	0	0	0	0	109.5	F348 I571 T572 L602 L604 F611	F348-V583 HydrophobicContact CE1-CG1 4.16Å; F348-V583 HydrophobicContact CZ-CG1 4.44Å; I571-V583 HydrophobicContact CG2-CG1 3.36Å; T572-V583 CarbonylContact O-C 3.54Å; T572-V583 VanDerWaalsContact O-CA 3.27Å; T572-V583 WeakPolarHBondContact O-CA 3.45Å; T572-V583 WeakPolarHBondContact O-CG1 3.33Å; V583-L602 HydrophobicContact CB-CB 3.71Å; V583-L602 HydrophobicContact CB-CD1 3.97Å; V583-L602 HydrophobicContact CG1-CD1 4Å; V583-L602 HydrophobicContact CG2-CB 4.34Å; V583-L602 PolarHBondContact N-O 3.46Å; V583-L604 HydrophobicContact CG2-CD1 3.97Å; V583-F611 HydrophobicContact CG1-CZ 4.42Å; V583-F611 HydrophobicContact CG2-CE1 4.02Å; V583-F611 HydrophobicContact CG2-CZ 4.09Å
584	T	85.3	Confident	77.1	Confident	10 Å²	10	74.4 Å²	74.4	6%	0.061	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	134.4	175.1	-64.9	0	0	0	0	108.9	T572 Y586 T600	T572-T584 PolarHBondContact N-O 2.98Å; T572-T584 PolarHBondContact O-N 3.38Å; T572-T584 PolarHBondContact OG1-O 3.07Å; T584-Y586 HydrophobicContact CG2-CD2 4.11Å; T584-Y586 HydrophobicContact CG2-CE1 4.31Å; T584-Y586 HydrophobicContact CG2-CE2 3.48Å; T584-Y586 VanDerWaalsContact CG2-CE2 3.48Å; T584-T600 VanDerWaalsContact CG2-OG1 3.24Å; T584-T600 WeakPolarHBondContact CG2-OG1 3.3Å; T584-T600 WeakPolarHBondContact OG1-CG2 3.39Å; T584-T600 PolarHBondContact OG1-OG1 2.91Å
585	V	89.1	Confident	77.8	Confident	8 Å²	8	72.4 Å²	72.4	5%	0.048	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	128.6	-180	-170.3	0	0	0	0	109.2	L569 I571 I598 G599	L569-V585 HydrophobicContact CB-CG1 4.31Å; L569-V585 HydrophobicContact CD1-CG1 4.17Å; L569-V585 HydrophobicContact CD2-CG1 4.42Å; I571-V585 HydrophobicContact CG1-CG1 4.16Å; I571-V585 HydrophobicContact CG1-CG2 4.29Å; V585-I598 HydrophobicContact CB-CD1 4.2Å; V585-I598 HydrophobicContact CB-CG1 3.9Å; V585-I598 HydrophobicContact CG1-CD1 3.68Å; V585-I598 HydrophobicContact CG1-CG1 3.86Å; V585-I598 WeakPolarHBondContact O-CG1 2.92Å; V585-I598 PolarHBondContact O-N 3.43Å; V585-G599 PolarHBondContact N-O 2.98Å
586	Y	90.9	Very high	78.8	Confident	22 Å²	22	74.4 Å²	74.4	9%	0.086	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	136.1	172.3	-57.9	-93.6	0	0	0	109.6	P551 V553 L569 L570 T572 T584 I596 N597	P551-Y586 HydrophobicContact CB-CD1 4.47Å; P551-Y586 HydrophobicContact CB-CE1 4.01Å; P551-Y586 HydrophobicContact CB-CE2 4.44Å; P551-Y586 HydrophobicContact CG-CD1 3.87Å; P551-Y586 HydrophobicContact CG-CE1 3.91Å; P551-Y586 HydrophobicContact CG-CG 4.19Å; V553-Y586 WeakPolarHBondContact CG2-OH 3.48Å; L569-Y586 CarbonylContact C-O 3.52Å; L569-Y586 VanDerWaalsContact CA-O 3.26Å; L569-Y586 WeakPolarHBondContact CA-O 3.5Å; L570-Y586 HydrophobicContact CD2-CD2 4.15Å; L570-Y586 HydrophobicContact CG-CD2 4.43Å; L570-Y586 PolarHBondContact N-O 2.88Å; L570-Y586 PolarHBondContact O-N 2.95Å; T572-Y586 HydrophobicContact CG2-CD2 4.35Å; T572-Y586 HydrophobicContact CG2-CE2 4.11Å; T584-Y586 HydrophobicContact CG2-CD2 4.11Å; T584-Y586 HydrophobicContact CG2-CE1 4.31Å; T584-Y586 HydrophobicContact CG2-CE2 3.48Å; T584-Y586 VanDerWaalsContact CG2-CE2 3.48Å; Y586-I596 CarbonylContact C-O 3.54Å; Y586-I596 WeakPolarHBondContact CA-O 3.31Å; Y586-N597 HydrophobicContact CD1-CB 3.81Å; Y586-N597 HydrophobicContact CE1-CB 3.73Å
587	E	92.4	Very high	80.1	Confident	25 Å²	25	76.6 Å²	76.6	12%	0.117	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	134.8	169.2	-177.9	176.1	139.8	0	0	109.6	Y362 K567 L569 I596 I598	Y362-E587 WeakPolarHBondContact CE1-OE2 3.32Å; Y362-E587 PolarHBondContact OH-OE2 2.94Å; K567-E587 HydrophobicContact CB-CG 4.4Å; K567-E587 HydrophobicContact CD-CG 4.45Å; K567-E587 WeakPolarHBondContact CD-OE1 3.49Å; K567-E587 VanDerWaalsContact CE-OE1 3.29Å; K567-E587 WeakPolarHBondContact CE-OE1 3.19Å; K567-E587 IonicContact NZ-OE1 2.69Å; K567-E587 PolarHBondContact NZ-OE1 3.06Å; L569-E587 HydrophobicContact CD2-CB 3.84Å; L569-E587 HydrophobicContact CD2-CG 4.05Å; E587-I596 PolarHBondContact N-O 3.3Å; E587-I596 PolarHBondContact O-N 3.48Å; E587-I598 HydrophobicContact CB-CD1 4.45Å; E587-I598 HydrophobicContact CB-CG2 3.6Å
588	Y	92.1	Very high	81.6	Confident	4 Å²	4	72 Å²	72	2%	0.016	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	119.3	174.5	-176.3	-109.5	0	0	0	111.2	M547 L568 I590 D593 W595	M547-Y588 WeakPolarHBondContact CE-OH 3.49Å; L568-Y588 HydrophobicContact CD2-CD1 4.12Å; L568-Y588 HydrophobicContact CD2-CG 4.34Å; L568-Y588 WeakPolarHBondContact O-CB 3.32Å; L568-Y588 PolarHBondContact O-N 2.85Å; Y588-I590 HydrophobicContact CD1-CG1 4.11Å; Y588-I590 HydrophobicContact CE1-CG1 4.24Å; Y588-I590 PolarHBondContact O-N 3.41Å; Y588-D593 WeakPolarHBondContact CE2-OD1 3.38Å; Y588-D593 PolarHBondContact OH-OD1 3.04Å; Y588-W595 AromaticContact CD2-CD2 3.88Å; Y588-W595 HydrophobicContact CD2-CD2 3.88Å; Y588-W595 AromaticContact CD2-CE2 3.68Å; Y588-W595 HydrophobicContact CD2-CE3 4.32Å; Y588-W595 HydrophobicContact CD2-CG 4.26Å; Y588-W595 HydrophobicContact CD2-CH2 4.43Å; Y588-W595 AromaticContact CD2-CZ2 4Å; Y588-W595 HydrophobicContact CD2-CZ2 4Å; Y588-W595 AromaticContact CD2-NE1 3.9Å; Y588-W595 HydrophobicContact CG-CH2 4.39Å; Y588-W595 HydrophobicContact CG-CZ2 4.36Å; Y588-W595 HydrophobicContact CG-CZ3 4.47Å
589	D	88.1	Confident	82.6	Confident	53 Å²	53	61.1 Å²	61.1	28%	0.283	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	109.1	168.9	178	22.7	0	0	0	110.5	R591 G592 D593 Q594 I596	D589-R591 VanDerWaalsContact C-N 3.25Å; D589-R591 PolarHBondContact O-N 2.93Å; D589-R591 PolarHBondContact OD1-N 2.73Å; D589-G592 PolarHBondContact OD2-N 2.98Å; D589-D593 WeakPolarHBondContact O-CA 3.46Å; D589-D593 PolarHBondContact O-N 3.05Å; D589-Q594 PolarHBondContact N-O 2.97Å; D589-Q594 PolarHBondContact O-N 3.38Å; D589-I596 HydrophobicContact CB-CD1 3.87Å; D589-I596 HydrophobicContact CB-CG1 4.5Å
590	I	84.4	Confident	83.2	Confident	86 Å²	86	57.5 Å²	57.5	44%	0.441	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-31.2	179.2	-52	167.4	0	0	0	111.4	F521 Y588	F521-I590 HydrophobicContact CE1-CD1 3.67Å; F521-I590 HydrophobicContact CE1-CG1 4.17Å; F521-I590 HydrophobicContact CZ-CD1 3.75Å; Y588-I590 HydrophobicContact CD1-CG1 4.11Å; Y588-I590 HydrophobicContact CE1-CG1 4.24Å; Y588-I590 PolarHBondContact O-N 3.41Å
591	R	85.1	Confident	83.1	Confident	242 Å²	242	56.3 Å²	56.3	91%	0.913	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-41.2	-175.6	-65.2	-176.5	179.7	-174.9	1.5	111.7	D589	D589-R591 VanDerWaalsContact C-N 3.25Å; D589-R591 PolarHBondContact O-N 2.93Å; D589-R591 PolarHBondContact OD1-N 2.73Å
592	G	82.7	Confident	82.7	Confident	35 Å²	35	56.1 Å²	56.1	36%	0.361	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-9.9	178.1	0	0	0	0	0	115	D589 Q594	D589-G592 PolarHBondContact OD2-N 2.98Å; G592-Q594 VanDerWaalsContact C-N 3.28Å; G592-Q594 WeakPolarHBondContact O-CG 3.49Å; G592-Q594 PolarHBondContact O-N 3.4Å
593	D	85.9	Confident	81.8	Confident	44 Å²	44	53.1 Å²	53.1	24%	0.235	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.5	45	-168.8	-170.6	15.2	0	0	0	111.4	N548 Y588 D589	N548-D593 WeakPolarHBondContact CB-O 3.37Å; N548-D593 WeakPolarHBondContact CB-OD1 3.48Å; N548-D593 PolarHBondContact ND2-O 3.41Å; N548-D593 PolarHBondContact ND2-OD2 3.37Å; N548-D593 VanDerWaalsContact ND2-OD2 3.14Å; Y588-D593 WeakPolarHBondContact CE2-OD1 3.38Å; Y588-D593 PolarHBondContact OH-OD1 3.04Å; D589-D593 WeakPolarHBondContact O-CA 3.46Å; D589-D593 PolarHBondContact O-N 3.05Å
594	Q	88.6	Confident	80.7	Confident	127 Å²	127	53.4 Å²	53.4	59%	0.593	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.6	149.7	-174.4	-75.2	-177.9	6.6	0	0	112.4	D589 G592	D589-Q594 PolarHBondContact N-O 2.97Å; D589-Q594 PolarHBondContact O-N 3.38Å; G592-Q594 VanDerWaalsContact C-N 3.28Å; G592-Q594 WeakPolarHBondContact O-CG 3.49Å; G592-Q594 PolarHBondContact O-N 3.4Å
595	W	89.9	Confident	78.9	Confident	33 Å²	33	57.8 Å²	57.8	13%	0.125	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	123.3	173.6	-69	97.6	0	0	0	110.2	M534 I550 P551 I561 L568 L570 Y588	M534-W595 HydrophobicContact CE-CZ2 4.14Å; M534-W595 HydrophobicContact SD-CZ2 3.71Å; I550-W595 HydrophobicContact CG2-CZ2 4.15Å; P551-W595 HydrophobicContact CG-CB 3.57Å; P551-W595 HydrophobicContact CG-CG 4.01Å; I561-W595 HydrophobicContact CD1-CH2 4.11Å; L568-W595 HydrophobicContact CD2-CH2 4.32Å; L568-W595 HydrophobicContact CG-CH2 4.3Å; L570-W595 HydrophobicContact CB-CE3 3.77Å; L570-W595 HydrophobicContact CB-CH2 3.62Å; L570-W595 HydrophobicContact CB-CZ2 4.39Å; L570-W595 HydrophobicContact CB-CZ3 3.25Å; L570-W595 HydrophobicContact CD2-CE3 4.47Å; Y588-W595 AromaticContact CD2-CD2 3.88Å; Y588-W595 HydrophobicContact CD2-CD2 3.88Å; Y588-W595 AromaticContact CD2-CE2 3.68Å; Y588-W595 HydrophobicContact CD2-CE3 4.32Å; Y588-W595 HydrophobicContact CD2-CG 4.26Å; Y588-W595 HydrophobicContact CD2-CH2 4.43Å; Y588-W595 AromaticContact CD2-CZ2 4Å; Y588-W595 HydrophobicContact CD2-CZ2 4Å; Y588-W595 AromaticContact CD2-NE1 3.9Å; Y588-W595 HydrophobicContact CG-CH2 4.39Å; Y588-W595 HydrophobicContact CG-CZ2 4.36Å; Y588-W595 HydrophobicContact CG-CZ3 4.47Å
596	I	90.3	Very high	77.2	Confident	86 Å²	86	61 Å²	61	44%	0.441	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	125.6	-179.2	-56.8	174.4	0	0	0	108.2	Y586 E587 D589 I598	Y586-I596 CarbonylContact C-O 3.54Å; Y586-I596 WeakPolarHBondContact CA-O 3.31Å; E587-I596 PolarHBondContact N-O 3.3Å; E587-I596 PolarHBondContact O-N 3.48Å; D589-I596 HydrophobicContact CB-CD1 3.87Å; D589-I596 HydrophobicContact CB-CG1 4.5Å; I596-I598 PolarHBondContact O-N 3.49Å
597	N	89.1	Confident	75.5	Confident	80 Å²	80	60.5 Å²	60.5	43%	0.428	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	117.2	174.2	-172.8	-24.4	0	0	0	109.4	Y586 G599	Y586-N597 HydrophobicContact CD1-CB 3.81Å; Y586-N597 HydrophobicContact CE1-CB 3.73Å; N597-G599 PolarHBondContact OD1-N 3.15Å; N597-G599 PolarHBondContact OD1-O 3.46Å
598	I	85.8	Confident	73.8	Confident	51 Å²	51	64.3 Å²	64.3	26%	0.262	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	-12.7	-179.4	60.9	167.5	0	0	0	112.9	P361 Y362 L569 V585 E587 I596	P361-I598 HydrophobicContact CB-CD1 4.31Å; Y362-I598 HydrophobicContact CD1-CD1 4.24Å; Y362-I598 HydrophobicContact CE1-CD1 3.87Å; L569-I598 HydrophobicContact CD2-CD1 4.16Å; V585-I598 HydrophobicContact CB-CD1 4.2Å; V585-I598 HydrophobicContact CB-CG1 3.9Å; V585-I598 HydrophobicContact CG1-CD1 3.68Å; V585-I598 HydrophobicContact CG1-CG1 3.86Å; V585-I598 WeakPolarHBondContact O-CG1 2.92Å; V585-I598 PolarHBondContact O-N 3.43Å; E587-I598 HydrophobicContact CB-CD1 4.45Å; E587-I598 HydrophobicContact CB-CG2 3.6Å; I596-I598 PolarHBondContact O-N 3.49Å
599	G	75.3	Confident	72.1	Confident	25 Å²	25	66.1 Å²	66.1	26%	0.258	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	170.8	150.8	178.8	0	0	0	0	0	113.9	V585 N597	V585-G599 PolarHBondContact N-O 2.98Å; N597-G599 PolarHBondContact OD1-N 3.15Å; N597-G599 PolarHBondContact OD1-O 3.46Å
600	T	67.7	Low	71	Confident	47 Å²	47	69.6 Å²	69.6	29%	0.288	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	74.7	176.7	-62.2	0	0	0	0	109.2	T584	T584-T600 VanDerWaalsContact CG2-OG1 3.24Å; T584-T600 WeakPolarHBondContact CG2-OG1 3.3Å; T584-T600 WeakPolarHBondContact OG1-CG2 3.39Å; T584-T600 PolarHBondContact OG1-OG1 2.91Å
601	T	60.8	Low	70.7	Confident	85 Å²	85	65.7 Å²	65.7	52%	0.521	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	48.5	-168.3	-12.3	0	0	0	0	113.6	L630	T601-L630 HydrophobicContact CG2-CD1 3.32Å; T601-L630 HydrophobicContact CG2-CD2 3.67Å; T601-L630 HydrophobicContact CG2-CG 4.01Å
602	L	59.8	Low	70.5	Confident	22 Å²	22	56.5 Å²	56.5	12%	0.115	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	84.6	174.9	-81.3	167.8	0	0	0	107.4	F348 C359 L366 V583 L604	F348-L602 HydrophobicContact CE2-CD1 4.39Å; F348-L602 HydrophobicContact CZ-CD1 4.01Å; C359-L602 HydrophobicContact CB-CD2 4.34Å; L366-L602 HydrophobicContact CD1-CD2 4.49Å; V583-L602 HydrophobicContact CB-CB 3.71Å; V583-L602 HydrophobicContact CB-CD1 3.97Å; V583-L602 HydrophobicContact CG1-CD1 4Å; V583-L602 HydrophobicContact CG2-CB 4.34Å; V583-L602 PolarHBondContact N-O 3.46Å; L602-L604 HydrophobicContact CB-CD1 4.3Å; L602-L604 HydrophobicContact CB-CD2 4.36Å; L602-L604 HydrophobicContact CB-CG 3.97Å; L602-L604 HydrophobicContact CD2-CD2 3.83Å; L602-L604 HydrophobicContact CD2-CG 4.3Å; L602-L604 PolarHBondContact O-N 3.39Å
603	G	54.3	Low	70.8	Confident	27 Å²	27	55.4 Å²	55.4	28%	0.278	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	60.7	170	0	0	0	0	0	110.6	N581 L605	N581-G603 WeakPolarHBondContact O-CA 3.45Å; G603-L605 PolarHBondContact O-N 2.78Å
604	L	56.2	Low	71	Confident	10 Å²	10	54.2 Å²	54.2	5%	0.052	30%	0.297	C	S	.	.			trans	-75.6	94.3	-173.7	-55.7	174.8	0	0	0	109.4	F348 L357 N581 V583 L602 Q606 F607	F348-L604 HydrophobicContact CD1-CD1 4.29Å; F348-L604 HydrophobicContact CG-CD1 4.42Å; L357-L604 HydrophobicContact CD1-CD2 3.46Å; L357-L604 VanDerWaalsContact CD1-CD2 3.46Å; N581-L604 PolarHBondContact O-N 3.26Å; V583-L604 HydrophobicContact CG2-CD1 3.97Å; L602-L604 HydrophobicContact CB-CD1 4.3Å; L602-L604 HydrophobicContact CB-CD2 4.36Å; L602-L604 HydrophobicContact CB-CG 3.97Å; L602-L604 HydrophobicContact CD2-CD2 3.83Å; L602-L604 HydrophobicContact CD2-CG 4.3Å; L602-L604 PolarHBondContact O-N 3.39Å; L604-Q606 PolarHBondContact O-N 3.35Å; L604-F607 HydrophobicContact CB-CD2 3.53Å; L604-F607 HydrophobicContact CB-CE2 3.94Å; L604-F607 HydrophobicContact CD1-CD2 3.69Å; L604-F607 HydrophobicContact CD1-CE2 3.69Å; L604-F607 HydrophobicContact CD2-CE2 4.37Å; L604-F607 HydrophobicContact CG-CD2 4.15Å; L604-F607 HydrophobicContact CG-CE2 4.19Å
605	L	47.6	Very low	71.2	Confident	102 Å²	102	48.8 Å²	48.8	53%	0.534	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-9.5	177.5	-83.3	163.9	0	0	0	114.4	K580 G603 F629	K580-L605 HydrophobicContact CB-CD2 4.49Å; K580-L605 HydrophobicContact CD-CD1 4.37Å; K580-L605 HydrophobicContact CD-CD2 3.76Å; K580-L605 HydrophobicContact CD-CG 3.94Å; K580-L605 HydrophobicContact CG-CD2 3.68Å; K580-L605 HydrophobicContact CG-CG 4.3Å; G603-L605 PolarHBondContact O-N 2.78Å; L605-F629 HydrophobicContact CD1-CD2 4.49Å; L605-F629 HydrophobicContact CD1-CE2 4.41Å; L605-F629 HydrophobicContact CD1-CZ 4.45Å
606	Q	53.8	Low	71.3	Confident	74 Å²	74	47.3 Å²	47.3	35%	0.346	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.5	-6	-166.1	-73.4	-176.5	-48.9	0	0	116.1	D354 L604	D354-Q606 PolarHBondContact OD1-NE2 3.43Å; L604-Q606 PolarHBondContact O-N 3.35Å
607	F	54.9	Low	71.3	Confident	12 Å²	12	44.4 Å²	44.4	5%	0.053	25%	0.251	C	S	.	.			trans	-100.3	128.7	179.5	-62.7	-96.8	0	0	0	109.6	F348 L357 N581 L604 F611	F348-F607 HydrophobicContact CB-CD1 4.48Å; F348-F607 HydrophobicContact CB-CE1 3.53Å; F348-F607 HydrophobicContact CB-CE2 4.24Å; F348-F607 HydrophobicContact CB-CZ 3.4Å; F348-F607 VanDerWaalsContact CB-CZ 3.4Å; F348-F607 HydrophobicContact CG-CZ 4.49Å; L357-F607 HydrophobicContact CB-CE2 4.32Å; L357-F607 HydrophobicContact CB-CZ 4.07Å; L357-F607 HydrophobicContact CD1-CE2 3.56Å; L357-F607 HydrophobicContact CD1-CZ 4.11Å; L357-F607 HydrophobicContact CG-CE2 3.97Å; L357-F607 HydrophobicContact CG-CZ 4Å; N581-F607 PolarHBondContact ND2-O 2.87Å; L604-F607 HydrophobicContact CB-CD2 3.53Å; L604-F607 HydrophobicContact CB-CE2 3.94Å; L604-F607 HydrophobicContact CD1-CD2 3.69Å; L604-F607 HydrophobicContact CD1-CE2 3.69Å; L604-F607 HydrophobicContact CD2-CE2 4.37Å; L604-F607 HydrophobicContact CG-CD2 4.15Å; L604-F607 HydrophobicContact CG-CE2 4.19Å; F607-F611 HydrophobicContact CB-CB 4.45Å; F607-F611 HydrophobicContact CB-CD1 4.29Å; F607-F611 HydrophobicContact CD1-CB 3.62Å; F607-F611 HydrophobicContact CD1-CG 4.33Å; F607-F611 HydrophobicContact CE1-CB 4.36Å; F607-F611 HydrophobicContact CG-CB 4.33Å
608	D	56.9	Low	71.3	Confident	106 Å²	106	40.7 Å²	40.7	57%	0.567	23%	0.231	S	C	*	.			trans	-58.1	161.5	154.8	-66.6	-37.7	0	0	0	109	H351 N610	H351-D608 IonicContact CD2-OD2 3.86Å; D608-N610 PolarHBondContact O-N 3.42Å
609	S	57.9	Low	71.5	Confident	41 Å²	41	38.7 Å²	38.7	29%	0.287	22%	0.221	S	C	.	.	S	Bend	trans	-54.4	-14.7	179.9	43.6	0	0	0	0	114.7	N558	N558-S609 WeakPolarHBondContact CB-O 3.41Å; N558-S609 PolarHBondContact ND2-O 3.38Å
610	N	65	Low	72	Confident	126 Å²	126	38.4 Å²	38.4	67%	0.674	21%	0.214	S	C	*	.			trans	-110.4	67.5	-174.7	-67.6	-14	0	0	0	113	D608	D608-N610 PolarHBondContact O-N 3.42Å
611	F	76.8	Confident	72.8	Confident	4 Å²	4	40 Å²	40	2%	0.018	23%	0.227	C	C	.	.			trans	-90.7	164.2	168	67.7	-97.8	0	0	0	112.5	F348 N558 R560 I571 S573 V583 F607 C613	F348-F611 AromaticContact CD1-CD2 3.77Å; F348-F611 HydrophobicContact CD1-CD2 3.77Å; F348-F611 AromaticContact CD1-CE2 3.69Å; F348-F611 HydrophobicContact CD1-CE2 3.69Å; F348-F611 HydrophobicContact CD1-CG 4.44Å; F348-F611 HydrophobicContact CD1-CZ 4.25Å; F348-F611 HydrophobicContact CE1-CD2 4.3Å; F348-F611 AromaticContact CE1-CE2 3.73Å; F348-F611 HydrophobicContact CE1-CE2 3.73Å; F348-F611 HydrophobicContact CE1-CZ 4.1Å; N558-F611 PolarHBondContact ND2-N 3.25Å; N558-F611 PolarHBondContact ND2-O 2.82Å; R560-F611 HydrophobicContact CG-CE2 4.37Å; R560-F611 PolarHBondContact NE-O 2.74Å; R560-F611 VanDerWaalsContact NE-O 3.07Å; R560-F611 PolarHBondContact NH2-O 2.64Å; R560-F611 VanDerWaalsContact NH2-O 3.12Å; I571-F611 HydrophobicContact CG2-CE2 4.08Å; I571-F611 HydrophobicContact CG2-CZ 4.04Å; S573-F611 VanDerWaalsContact CB-CE1 3.43Å; V583-F611 HydrophobicContact CG1-CZ 4.42Å; V583-F611 HydrophobicContact CG2-CE1 4.02Å; V583-F611 HydrophobicContact CG2-CZ 4.09Å; F607-F611 HydrophobicContact CB-CB 4.45Å; F607-F611 HydrophobicContact CB-CD1 4.29Å; F607-F611 HydrophobicContact CD1-CB 3.62Å; F607-F611 HydrophobicContact CD1-CG 4.33Å; F607-F611 HydrophobicContact CE1-CB 4.36Å; F607-F611 HydrophobicContact CG-CB 4.33Å; F611-C613 HydrophobicContact CD2-CB 4.48Å
612	F	82.2	Confident	73.9	Confident	49 Å²	49	37.7 Å²	37.7	22%	0.215	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	157.1	162.1	69.4	-84.5	0	0	0	109.5	F349 L385 V387	F349-F612 HydrophobicContact CB-CD1 3.75Å; F349-F612 HydrophobicContact CB-CD2 3.89Å; F349-F612 HydrophobicContact CB-CE1 3.16Å; F349-F612 HydrophobicContact CB-CE2 3.32Å; F349-F612 HydrophobicContact CB-CG 4.09Å; F349-F612 HydrophobicContact CB-CZ 2.94Å; F349-F612 AromaticContact CD1-CE2 3.98Å; F349-F612 HydrophobicContact CD1-CE2 3.98Å; F349-F612 AromaticContact CD1-CZ 3.74Å; F349-F612 HydrophobicContact CD1-CZ 3.74Å; F349-F612 AromaticContact CD2-CD2 3.76Å; F349-F612 HydrophobicContact CD2-CD2 3.76Å; F349-F612 AromaticContact CD2-CE2 3.21Å; F349-F612 HydrophobicContact CD2-CE2 3.21Å; F349-F612 AromaticContact CD2-CZ 3.76Å; F349-F612 HydrophobicContact CD2-CZ 3.76Å; F349-F612 AromaticContact CE2-CE2 3.99Å; F349-F612 HydrophobicContact CE2-CE2 3.99Å; F349-F612 HydrophobicContact CG-CD2 4.05Å; F349-F612 AromaticContact CG-CE1 3.98Å; F349-F612 HydrophobicContact CG-CE1 3.98Å; F349-F612 AromaticContact CG-CE2 3.22Å; F349-F612 HydrophobicContact CG-CE2 3.22Å; F349-F612 AromaticContact CG-CZ 3.21Å; F349-F612 HydrophobicContact CG-CZ 3.21Å; F349-F612 PolarHBondContact N-O 3.01Å; F349-F612 PolarHBondContact O-N 3.47Å; L385-F612 HydrophobicContact CB-CE1 3.61Å; L385-F612 HydrophobicContact CB-CZ 3.61Å; L385-F612 HydrophobicContact CD1-CE1 3.93Å; L385-F612 HydrophobicContact CD1-CZ 3.97Å; L385-F612 HydrophobicContact CG-CE1 4.16Å; L385-F612 HydrophobicContact CG-CZ 4.36Å; V387-F612 HydrophobicContact CB-CE2 3.68Å; V387-F612 HydrophobicContact CB-CZ 4.25Å; V387-F612 HydrophobicContact CG2-CE2 3.34Å; V387-F612 HydrophobicContact CG2-CZ 3.39Å
613	C	87.4	Confident	75.2	Confident	12 Å²	12	37.3 Å²	37.3	8%	0.081	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	157.8	-178.7	58.2	0	0	0	0	111.6	V346 I347 F348 R560 F611	V346-C613 HydrophobicContact CG1-CB 3.93Å; I347-C613 WeakPolarHBondContact O-CA 2.98Å; I347-C613 WeakPolarHBondContact O-CB 3.44Å; F348-C613 HydrophobicContact CD1-CB 4.17Å; F348-C613 HydrophobicContact CE1-CB 4.35Å; R560-C613 VanDerWaalsContact CB-SG 3.59Å; F611-C613 HydrophobicContact CD2-CB 4.48Å
614	L	90.9	Very high	76.6	Confident	19 Å²	19	42.1 Å²	42.1	10%	0.099	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	157.7	176.6	58.2	85.5	0	0	0	109.3	V346 I347 F349 V387 I389 I395 A616	V346-L614 WeakPolarHBondContact CA-O 3.44Å; I347-L614 HydrophobicContact CB-CD1 4.23Å; I347-L614 HydrophobicContact CD1-CD1 4.2Å; I347-L614 HydrophobicContact CG1-CD1 4.5Å; I347-L614 PolarHBondContact N-O 3.09Å; I347-L614 PolarHBondContact O-N 3.41Å; I347-L614 VanDerWaalsContact O-N 3.17Å; F349-L614 HydrophobicContact CD2-CD2 4.3Å; F349-L614 HydrophobicContact CE2-CD1 4.13Å; F349-L614 HydrophobicContact CE2-CD2 3.43Å; F349-L614 VanDerWaalsContact CE2-CD2 3.43Å; F349-L614 HydrophobicContact CE2-CG 3.64Å; F349-L614 HydrophobicContact CZ-CD2 3.93Å; F349-L614 HydrophobicContact CZ-CG 4.4Å; V387-L614 HydrophobicContact CB-CD2 3.9Å; V387-L614 HydrophobicContact CG1-CD2 3.31Å; I389-L614 HydrophobicContact CD1-CB 4.15Å; I389-L614 HydrophobicContact CD1-CD1 3.39Å; I389-L614 HydrophobicContact CD1-CD2 4.44Å; I389-L614 HydrophobicContact CD1-CG 4.13Å; I389-L614 HydrophobicContact CG1-CD1 3.88Å; I389-L614 HydrophobicContact CG1-CD2 4.25Å; I389-L614 HydrophobicContact CG1-CG 4.47Å; I395-L614 HydrophobicContact CD1-CD1 4.45Å; L614-A616 HydrophobicContact CD1-CB 3.87Å
615	S	91.9	Very high	77.7	Confident	13 Å²	13	46.7 Å²	46.7	9%	0.091	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	125.2	173.7	-170.5	0	0	0	0	110.2	E344 M345 I389 K563 H564	E344-S615 VanDerWaalsContact CD-OG 3.32Å; E344-S615 WeakPolarHBondContact CG-OG 3.49Å; E344-S615 PolarHBondContact OE1-OG 3.25Å; M345-S615 WeakPolarHBondContact O-CA 3.47Å; I389-S615 WeakPolarHBondContact CD1-O 3.36Å; K563-S615 WeakPolarHBondContact O-CB 3.42Å; H564-S615 PolarHBondContact ND1-OG 2.68Å
616	A	92.1	Very high	78.4	Confident	2 Å²	2	42.5 Å²	42.5	2%	0.017	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	150.7	177.3	0	0	0	0	0	111.1	M345 I347 I389 I395 L614 V618	M345-A616 PolarHBondContact N-O 3.41Å; M345-A616 PolarHBondContact O-N 2.97Å; I347-A616 HydrophobicContact CD1-CB 3.84Å; I389-A616 HydrophobicContact CD1-CB 4.01Å; I395-A616 HydrophobicContact CD1-CB 3.9Å; I395-A616 HydrophobicContact CG1-CB 4.37Å; L614-A616 HydrophobicContact CD1-CB 3.87Å; A616-V618 HydrophobicContact CB-CG1 4.32Å; A616-V618 PolarHBondContact O-N 3.49Å
617	R	90.4	Very high	78.6	Confident	26 Å²	26	45.4 Å²	45.4	10%	0.098	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	119.9	166.9	-170.4	177.8	178	-132	-10.7	108.4	D232 G339 A342 K343 H393	D232-R617 IonicContact OD1-CZ 2.8Å; D232-R617 IonicContact OD1-NH1 2.61Å; D232-R617 PolarHBondContact OD1-NH1 2.93Å; D232-R617 IonicContact OD1-NH2 2.76Å; D232-R617 PolarHBondContact OD1-NH2 3.44Å; D232-R617 IonicContact OD2-CZ 3.32Å; D232-R617 IonicContact OD2-NH1 2.89Å; D232-R617 PolarHBondContact OD2-NH1 3.3Å; D232-R617 VanDerWaalsContact OD2-NH1 3.08Å; D232-R617 IonicContact OD2-NH2 2.62Å; G339-R617 PolarHBondContact O-NH2 3.41Å; A342-R617 HydrophobicContact CB-CG 3.97Å; K343-R617 WeakPolarHBondContact O-CA 3.14Å; H393-R617 HydrophobicContact CB-CB 4.05Å; H393-R617 WeakPolarHBondContact ND1-CB 3.33Å; H393-R617 VanDerWaalsContact NE2-CD 3.32Å; H393-R617 WeakPolarHBondContact NE2-CD 3.22Å
618	V	89.7	Confident	78.2	Confident	1 Å²	1	49.5 Å²	49.5	1%	0.006	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	169	-179	-62.7	0	0	0	0	110.3	A342 K343 M345 I347 P410 A616 P620 L623	A342-V618 CarbonylContact C-O 3.44Å; A342-V618 VanDerWaalsContact CA-O 3.26Å; A342-V618 WeakPolarHBondContact CA-O 3.26Å; K343-V618 PolarHBondContact N-O 3.02Å; K343-V618 PolarHBondContact O-N 2.72Å; M345-V618 HydrophobicContact CB-CG2 3.64Å; M345-V618 HydrophobicContact CG-CG2 3.55Å; M345-V618 HydrophobicContact SD-CG2 3.27Å; M345-V618 WeakPolarHBondContact SD-CG2 2.93Å; I347-V618 HydrophobicContact CD1-CG1 3.93Å; P410-V618 HydrophobicContact CB-CG1 4.46Å; A616-V618 HydrophobicContact CB-CG1 4.32Å; A616-V618 PolarHBondContact O-N 3.49Å; V618-P620 WeakPolarHBondContact O-CD 3.36Å; V618-L623 HydrophobicContact CB-CD1 4.3Å; V618-L623 HydrophobicContact CG2-CD1 4.31Å
619	Y	89.6	Confident	77.8	Confident	9 Å²	9	49.7 Å²	49.7	4%	0.035	28%	0.279	C	S	.	.			trans	-119.2	93.4	-174.4	-58	-97.8	0	0	0	108.4	D232 L338 A342 P410 A411 S621 C622 L623	D232-Y619 WeakPolarHBondContact OD1-CE1 3.32Å; D232-Y619 PolarHBondContact OD1-OH 3.27Å; D232-Y619 PolarHBondContact OD2-OH 3.44Å; L338-Y619 HydrophobicContact CD1-CD1 3.71Å; L338-Y619 HydrophobicContact CD1-CE1 4.48Å; L338-Y619 HydrophobicContact CD1-CG 4.2Å; L338-Y619 HydrophobicContact CD2-CD1 4.44Å; L338-Y619 HydrophobicContact CG-CD1 3.65Å; L338-Y619 HydrophobicContact CG-CE1 3.93Å; L338-Y619 HydrophobicContact CG-CG 4.45Å; L338-Y619 WeakPolarHBondContact O-CD1 3.47Å; A342-Y619 HydrophobicContact CB-CD1 3.83Å; A342-Y619 HydrophobicContact CB-CE1 3.66Å; P410-Y619 HydrophobicContact CB-CD2 3.87Å; P410-Y619 HydrophobicContact CB-CE2 4.01Å; A411-Y619 HydrophobicContact CB-CD2 4.17Å; A411-Y619 HydrophobicContact CB-CE2 3.86Å; Y619-S621 PolarHBondContact O-N 3.19Å; Y619-S621 VanDerWaalsContact O-N 3.09Å; Y619-C622 WeakPolarHBondContact O-CA 3.38Å; Y619-C622 WeakPolarHBondContact O-CB 3.48Å; Y619-C622 PolarHBondContact O-N 2.71Å; Y619-L623 PolarHBondContact O-N 3.04Å
620	P	85.9	Confident	76.8	Confident	19 Å²	19	53 Å²	53	12%	0.123	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-47.6	-36.6	177.7	-31.1	35.3	0	0	0	114	C341 K343 M345 Y367 V618 C622 L623	C341-P620 VanDerWaalsContact O-CD 3.3Å; C341-P620 WeakPolarHBondContact O-CD 3.37Å; K343-P620 HydrophobicContact CB-CG 4.34Å; K343-P620 HydrophobicContact CD-CG 4.12Å; K343-P620 HydrophobicContact CG-CG 4.24Å; M345-P620 HydrophobicContact SD-CG 3.95Å; Y367-P620 HydrophobicContact CE1-CB 3.92Å; Y367-P620 HydrophobicContact CE2-CB 4.28Å; V618-P620 WeakPolarHBondContact O-CD 3.36Å; P620-C622 PolarHBondContact O-N 3.1Å; P620-L623 PolarHBondContact O-N 3Å; P620-L623 VanDerWaalsContact O-N 3.12Å
621	S	84.1	Confident	75.2	Confident	80 Å²	80	53.2 Å²	53.2	56%	0.559	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-63.6	-21.3	176.3	51.4	0	0	0	0	114.4	Y619	Y619-S621 PolarHBondContact O-N 3.19Å; Y619-S621 VanDerWaalsContact O-N 3.09Å
622	C	85.3	Confident	73.3	Confident	38 Å²	38	60.7 Å²	60.7	26%	0.257	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-95	-11.8	175.8	-62.8	0	0	0	0	113.2	L338 A411 N413 Y619 P620	L338-C622 VanDerWaalsContact CD1-SG 3.57Å; A411-C622 PolarHBondContact O-SG 3.46Å; A411-C622 VanDerWaalsContact O-SG 3.38Å; N413-C622 HydrophobicContact CB-CB 4.23Å; N413-C622 WeakPolarHBondContact CB-O 3.32Å; N413-C622 PolarHBondContact ND2-O 2.94Å; Y619-C622 WeakPolarHBondContact O-CA 3.38Å; Y619-C622 WeakPolarHBondContact O-CB 3.48Å; Y619-C622 PolarHBondContact O-N 2.71Å; P620-C622 PolarHBondContact O-N 3.1Å
623	L	86.5	Confident	71.1	Confident	13 Å²	13	66.4 Å²	66.4	7%	0.068	36%	0.362	C	S	.	.	S	Bend	trans	-98.8	153.4	-173.7	-62.6	177.6	0	0	0	111.8	C358 Y367 V369 Y408 V618 Y619 P620	C358-L623 HydrophobicContact CB-CD1 4.42Å; Y367-L623 HydrophobicContact CD1-CB 3.88Å; Y367-L623 HydrophobicContact CG-CB 4.16Å; Y367-L623 HydrophobicContact CG-CD1 4.23Å; V369-L623 HydrophobicContact CG2-CD1 4.47Å; V369-L623 HydrophobicContact CG2-CD2 3.98Å; Y408-L623 WeakPolarHBondContact OH-CD2 3.26Å; V618-L623 HydrophobicContact CB-CD1 4.3Å; V618-L623 HydrophobicContact CG2-CD1 4.31Å; Y619-L623 PolarHBondContact O-N 3.04Å; P620-L623 PolarHBondContact O-N 3Å; P620-L623 VanDerWaalsContact O-N 3.12Å
624	E	82.9	Confident	68.6	Low	129 Å²	129	74.9 Å²	74.9	60%	0.603	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.8	132.1	172.5	-66.7	-176.9	175.3	0	0	110	Y367 K368 G626	Y367-E624 CarbonylContact C-O 3.55Å; Y367-E624 WeakPolarHBondContact CA-O 3.12Å; K368-E624 HydrophobicContact CB-CB 4.45Å; K368-E624 PolarHBondContact N-O 2.95Å; E624-G626 PolarHBondContact O-N 3.49Å
625	P	79.5	Confident	65.9	Low	105 Å²	105	81.4 Å²	81.4	68%	0.682	43%	0.43	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-57.7	132	174.3	-24	33.4	0	0	0	111.6
626	G	61.7	Low	62.9	Low	15 Å²	15	88.2 Å²	88.2	16%	0.155	46%	0.464	C	S	.	.	P	Polyproline II helix	trans	-78	148.2	167.4	0	0	0	0	0	110.3	L366 E624 S628	L366-G626 WeakPolarHBondContact O-CA 3.45Å; L366-G626 PolarHBondContact O-N 2.83Å; E624-G626 PolarHBondContact O-N 3.49Å; G626-S628 PolarHBondContact O-N 3.36Å
627	Q	59.1	Low	60.3	Low	134 Å²	134	93.7 Å²	93.7	63%	0.626	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-73.1	117.7	169.6	-77.4	179.1	-18.3	0	0	109	F629	Q627-F629 HydrophobicContact CB-CE1 4.43Å; Q627-F629 HydrophobicContact CB-CE2 4.1Å; Q627-F629 HydrophobicContact CB-CZ 3.97Å; Q627-F629 WeakPolarHBondContact O-CD2 3.48Å; Q627-F629 PolarHBondContact O-N 3.22Å
628	S	46.4	Very low	57.4	Low	98 Å²	98	98 Å²	98	69%	0.685	53%	0.533	S	S	*	.			trans	-71.1	106.6	168.5	57	0	0	0	0	109	G626 L630	G626-S628 PolarHBondContact O-N 3.36Å; S628-L630 VanDerWaalsContact C-N 3.32Å; S628-L630 PolarHBondContact O-N 3.19Å; S628-L630 VanDerWaalsContact O-N 3.07Å
629	F	47.5	Very low	54.7	Low	111 Å²	111	107 Å²	107	49%	0.487	58%	0.575	S	S	.	*			trans	-83.9	78.1	175	-64.7	-77.1	0	0	0	110.3	L605 Q627	L605-F629 HydrophobicContact CD1-CD2 4.49Å; L605-F629 HydrophobicContact CD1-CE2 4.41Å; L605-F629 HydrophobicContact CD1-CZ 4.45Å; Q627-F629 HydrophobicContact CB-CE1 4.43Å; Q627-F629 HydrophobicContact CB-CE2 4.1Å; Q627-F629 HydrophobicContact CB-CZ 3.97Å; Q627-F629 WeakPolarHBondContact O-CD2 3.48Å; Q627-F629 PolarHBondContact O-N 3.22Å
630	L	37.8	Very low	51.8	Low	111 Å²	111	111.7 Å²	111.7	58%	0.581	61%	0.609	S	S	*	*			trans	-139.4	106.1	164.8	-70.6	172.9	0	0	0	111.1	T601 S628	T601-L630 HydrophobicContact CG2-CD1 3.32Å; T601-L630 HydrophobicContact CG2-CD2 3.67Å; T601-L630 HydrophobicContact CG2-CG 4.01Å; S628-L630 VanDerWaalsContact C-N 3.32Å; S628-L630 PolarHBondContact O-N 3.19Å; S628-L630 VanDerWaalsContact O-N 3.07Å
631	T	30.7	Very low	49.3	Very low	129 Å²	129	116.3 Å²	116.3	79%	0.791	64%	0.642	S	S	*	*			trans	-137.7	95.4	135.1	46.6	0	0	0	0	105.7	E633	T631-E633 PolarHBondContact O-N 2.92Å
632	E	38	Very low	46.7	Very low	161 Å²	161	118.2 Å²	118.2	75%	0.752	65%	0.651	S	S	*	*			trans	-73.6	75.2	151.6	-83.4	-176.5	175.3	0	0	106.3	R582	R582-E632 IonicContact NH2-OE1 2.74Å; R582-E632 PolarHBondContact NH2-OE1 3.09Å
633	E	34.6	Very low	44.1	Very low	170 Å²	170	125 Å²	125	79%	0.794	68%	0.678	S	S	*	*			trans	-138.5	82.3	158.9	-77.4	-165.6	175	0	0	105.7	T631	T631-E633 PolarHBondContact O-N 2.92Å
634	E	35.6	Very low	41.6	Very low	190 Å²	190	135.9 Å²	135.9	89%	0.888	72%	0.719	S	S	*	*			trans	160.6	64.5	155.5	-90.5	-174.1	-170.6	0	0	109.6
635	E	33.9	Very low	39	Very low	155 Å²	155	136.6 Å²	136.6	72%	0.724	73%	0.727	S	S	*	*			trans	-135.3	79.3	153.1	-78.2	-170.8	177.3	0	0	106.9	K579	K579-E635 IonicContact NZ-OE1 3.41Å; K579-E635 PolarHBondContact NZ-OE1 2.99Å; K579-E635 IonicContact NZ-OE2 2.97Å; K579-E635 PolarHBondContact NZ-OE2 2.91Å
636	I	29.9	Very low	36.6	Very low	157 Å²	157	139.8 Å²	139.8	81%	0.805	74%	0.737	S	S	*	*			trans	-65.2	125.7	159.6	-61.7	172.3	0	0	0	106.1	S638	I636-S638 PolarHBondContact O-N 3.03Å
637	P	37.2	Very low	34.9	Very low	116 Å²	116	142.8 Å²	142.8	75%	0.753	77%	0.768	S	S	*	*			trans	-76	108.5	175.7	29	-29.1	0	0	0	108.9	E639	P637-E639 VanDerWaalsContact C-N 3.29Å; P637-E639 PolarHBondContact O-N 3.23Å; P637-E639 VanDerWaalsContact O-N 3.1Å
638	S	29.6	Very low	33.5	Very low	118 Å²	118	140.2 Å²	140.2	83%	0.825	78%	0.777	S	S	*	*			trans	-81.5	78.6	168	63.1	0	0	0	0	110	I636	I636-S638 PolarHBondContact O-N 3.03Å
639	E	33.4	Very low	32.6	Very low	189 Å²	189	145.3 Å²	145.3	88%	0.883	79%	0.788	S	S	*	*			trans	-116.3	99	151.1	-82.3	-167	168.9	0	0	108.1	P637	P637-E639 VanDerWaalsContact C-N 3.29Å; P637-E639 PolarHBondContact O-N 3.23Å; P637-E639 VanDerWaalsContact O-N 3.1Å
640	S	28	Very low	31.7	Very low	107 Å²	107	145.6 Å²	145.6	75%	0.748	80%	0.803	S	S	*	*			trans	-151	100.4	149.4	73	0	0	0	0	109.7	T642	S640-T642 PolarHBondContact O-N 3.08Å
641	S	33.9	Very low	31.3	Very low	116 Å²	116	149.1 Å²	149.1	81%	0.811	82%	0.817	S	S	*	*			trans	-53.9	123.1	150.1	48.9	0	0	0	0	109.9
642	T	29.8	Very low	31.9	Very low	121 Å²	121	147.5 Å²	147.5	74%	0.742	81%	0.809	S	S	*	*			trans	-166.5	125.1	138.2	9	0	0	0	0	110.5	S640	S640-T642 PolarHBondContact O-N 3.08Å
643	E	29.3	Very low	31.4	Very low	180 Å²	180	146.6 Å²	146.6	84%	0.841	81%	0.809	S	S	*	*			trans	-52.8	139.2	168.2	-64.8	159.4	142.2	0	0	111.5
644	W	34.3	Very low	31.3	Very low	241 Å²	241	144.3 Å²	144.3	91%	0.913	81%	0.812	S	S	*	*			trans	-133.9	103.1	148	-74.5	91.5	0	0	0	108
645	D	28	Very low	31	Very low	145 Å²	145	144.2 Å²	144.2	78%	0.775	81%	0.811	S	S	*	*			trans	-58.7	136.8	158.5	-90.4	-36.6	0	0	0	110.1
646	L	29.4	Very low	31	Very low	172 Å²	172	142.8 Å²	142.8	90%	0.901	82%	0.818	S	S	*	*				172.9	112.5	118.6	-92.7	160.4	0	0	0	111.8
647	G	27.1	Very low	31	Very low	78 Å²	78	138.5 Å²	138.5	80%	0.804	81%	0.813	S	S	*	*				83.6	102.2	122.6	0	0	0	0	0	118.3
648	G	28.6	Very low	30.8	Very low	79 Å²	79	138.8 Å²	138.8	81%	0.814	82%	0.817	S	S	*	*			trans	-170.5	70.8	164.3	0	0	0	0	0	112
649	F	27.2	Very low	30.9	Very low	206 Å²	206	137.8 Å²	137.8	90%	0.904	81%	0.811	S	S	*	*			trans	-57.3	130.4	171.9	-81.6	-92.4	0	0	0	112.1
650	S	29.5	Very low	30.8	Very low	117 Å²	117	134 Å²	134	82%	0.818	81%	0.805	S	S	*	*				171.7	114.5	119.9	35.7	0	0	0	0	111.7
651	E	28.5	Very low	31	Very low	185 Å²	185	133.2 Å²	133.2	86%	0.864	80%	0.799	S	S	*	*			trans	-71.5	178.6	149.9	-90.3	-169.4	172.8	0	0	110.2
652	P	45	Very low	30.7	Very low	95 Å²	95	135.3 Å²	135.3	62%	0.617	80%	0.801	S	S	*	*			cis	-137.5	-164.9	-2.6	22.6	4.7	0	0	0	113.4
653	D	26.4	Very low	30.8	Very low	141 Å²	141	133.1 Å²	133.1	75%	0.754	79%	0.79	S	S	*	*			trans	98.2	106.2	154.5	-57.2	-25.3	0	0	0	117.3
654	S	32.7	Very low	30.9	Very low	123 Å²	123	130.9 Å²	130.9	86%	0.86	78%	0.784	S	S	*	*				171.1	132.2	96.5	-70.3	0	0	0	0	112.8
655	E	29.2	Very low	30.7	Very low	188 Å²	188	125.6 Å²	125.6	88%	0.879	77%	0.774	S	S	*	*			trans	-52.1	170.9	179.9	-63.4	176.4	143.1	0	0	119.2
656	S	34.9	Very low	30.8	Very low	125 Å²	125	124.7 Å²	124.7	87%	0.874	77%	0.769	S	S	*	*			trans	94	129.5	151.3	78.2	0	0	0	0	116.5
657	G	28.9	Very low	30.6	Very low	67 Å²	67	124.9 Å²	124.9	69%	0.691	76%	0.763	S	S	*	*			cis	178.9	154.3	0.4	0	0	0	0	0	110
658	S	32.3	Very low	30.6	Very low	121 Å²	121	131.6 Å²	131.6	85%	0.846	76%	0.764	S	S	*	*			trans	44.7	140.6	140	-58.8	0	0	0	0	120.3
659	S	31.9	Very low	30.6	Very low	98 Å²	98	133.8 Å²	133.8	69%	0.685	76%	0.761	S	S	*	*			cis	169.7	157.3	0.6	42.8	0	0	0	0	107.7
660	S	31	Very low	30.7	Very low	110 Å²	110	134.4 Å²	134.4	77%	0.769	76%	0.758	S	S	*	*			trans	87.5	142.9	143.9	82.4	0	0	0	0	119
661	S	33	Very low	30.8	Very low	89 Å²	89	135 Å²	135	62%	0.622	76%	0.756	S	S	*	*			cis	172.9	149.6	-5.5	47.4	0	0	0	0	109.5
662	L	28.6	Very low	30.9	Very low	161 Å²	161	130.6 Å²	130.6	84%	0.843	75%	0.751	S	S	*	*			trans	71.4	148.3	149.9	-61.1	155	0	0	0	119.3
663	S	31.4	Very low	31.4	Very low	74 Å²	74	131.6 Å²	131.6	52%	0.517	76%	0.758	S	S	.	*			cis	-177	163.1	-16.6	60.1	0	0	0	0	109.1
664	D	30.1	Very low	32	Very low	134 Å²	134	137.7 Å²	137.7	72%	0.717	78%	0.782	S	S	*	*			trans	69.1	144.5	150	-47.8	-26.8	0	0	0	119.7
665	D	30.9	Very low	32	Very low	130 Å²	130	138.4 Å²	138.4	70%	0.695	78%	0.778	S	S	*	*			cis	-171.7	170.7	-11	-116.7	-26.8	0	0	0	108
666	D	29.2	Very low	32.1	Very low	125 Å²	125	135.8 Å²	135.8	67%	0.668	77%	0.772	S	S	*	*			trans	80.3	136.1	149.4	-72.5	-11.9	0	0	0	121.1
667	F	25.8	Very low	32	Very low	177 Å²	177	136.4 Å²	136.4	78%	0.776	77%	0.767	S	S	*	*			cis	-159.2	140.7	3.8	-124.7	-74.6	0	0	0	108.4
668	W	28.1	Very low	32.1	Very low	218 Å²	218	140.5 Å²	140.5	83%	0.826	77%	0.771	S	S	*	*			trans	-96.2	140.3	168.7	-82	88.1	0	0	0	111.1
669	V	27.1	Very low	32.1	Very low	126 Å²	126	141.7 Å²	141.7	76%	0.764	77%	0.766	S	S	*	*			trans	-142.2	114.5	149.7	179.6	0	0	0	0	110.3	V671	V669-V671 HydrophobicContact CG1-CG2 4Å
670	R	29.8	Very low	32.1	Very low	218 Å²	218	144.6 Å²	144.6	82%	0.823	77%	0.772	S	S	*	*			trans	-92.2	140.3	157.8	-85.8	-177.8	172.8	-178.3	-1.3	108.4
671	V	31	Very low	32.2	Very low	131 Å²	131	147.1 Å²	147.1	79%	0.794	77%	0.772	S	S	*	*			trans	-135.1	124.5	156.4	-179.3	0	0	0	0	108.3	V669	V669-V671 HydrophobicContact CG1-CG2 4Å
672	A	31.2	Very low	32.2	Very low	91 Å²	91	151.5 Å²	151.5	75%	0.752	78%	0.784	S	S	*	*			trans	-104.1	157.1	162.5	0	0	0	0	0	109
673	P	56.1	Low	32.5	Very low	117 Å²	117	150.8 Å²	150.8	76%	0.76	78%	0.779	S	S	*	*				-132	153.1	127	32.9	-19.4	0	0	0	109.2
674	Q	38.8	Very low	32.6	Very low	268 Å²	268	157.7 Å²	157.7	100%	1.252	80%	0.802	S	S	*	*			cis	-154	0	20	-127.8	176.5	11.6	0	0	108.5

Retrieved 674 of 674 residues in 4088.7 ms (Link to these results)

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