G7N3J4_MACMU Loading...

THO complex subunit 5

AlphaFold DB , UniProt , Accession G7N3J4, Species MACMU (Macaca mulatta, Rhesus macaque), Gene THOC5, Length 683 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	37.4	Very low	33.2	Very low	248 Å²	248	173.5 Å²	173.5	100%	1.222	90%	0.901	S	S	*	*				0	95.9	0	-73.9	-80.4	-163.6	0	0	107.5
2	S	28.9	Very low	32.9	Very low	122 Å²	122	175 Å²	175	85%	0.853	90%	0.895	S	S	*	*			trans	-67.9	144.4	178.7	-48.8	0	0	0	0	111.3
3	S	31.8	Very low	32.7	Very low	124 Å²	124	171.5 Å²	171.5	87%	0.867	89%	0.886	S	S	*	*			trans	-164.7	125.9	132.1	40.5	0	0	0	0	110.6
4	E	31.1	Very low	32.8	Very low	186 Å²	186	169.4 Å²	169.4	87%	0.869	88%	0.875	S	S	*	*			trans	-69.9	156.6	179.3	-64.6	161.9	116.3	0	0	112.5
5	S	32.7	Very low	32.7	Very low	115 Å²	115	172.6 Å²	172.6	80%	0.804	87%	0.871	S	S	*	*				-173.3	88.4	121.7	45.2	0	0	0	0	112
6	S	31.4	Very low	32.6	Very low	122 Å²	122	168.7 Å²	168.7	85%	0.853	87%	0.865	S	S	*	*			trans	-82.3	113.3	169.2	-45.7	0	0	0	0	109.7
7	K	35.5	Very low	32.4	Very low	212 Å²	212	168.1 Å²	168.1	92%	0.922	86%	0.864	S	S	*	*	P	Polyproline II helix	trans	-87.3	125.1	173	-83.6	-179.2	178.7	173.5	0	111.5
8	K	35.1	Very low	32.5	Very low	207 Å²	207	162.4 Å²	162.4	90%	0.9	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-62.6	136.3	-177.9	-70.4	174.1	174.9	175.7	0	113.3
9	R	30.7	Very low	32.4	Very low	248 Å²	248	159.3 Å²	159.3	94%	0.936	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-70.4	136	162.8	-74.8	175	167.6	176.8	-4.5	110.2
10	K	33.3	Very low	32.6	Very low	200 Å²	200	157.2 Å²	157.2	87%	0.87	85%	0.849	S	S	*	*			trans	-106.5	140.4	160.8	-77.2	-173.9	176.9	-178.2	0	109
11	P	37	Very low	32.5	Very low	125 Å²	125	154.5 Å²	154.5	81%	0.812	85%	0.848	S	S	*	*			trans	-82.4	143.1	-173.8	31.7	-33.1	0	0	0	113.1
12	K	30.5	Very low	32.2	Very low	191 Å²	191	152.1 Å²	152.1	83%	0.83	83%	0.834	S	S	*	*			trans	-69.7	125.3	171.2	-103.7	175.6	171.6	178.7	0	109.8
13	V	29.8	Very low	32.4	Very low	129 Å²	129	149.3 Å²	149.3	78%	0.782	82%	0.824	S	S	*	*			trans	-100.6	114.3	159.2	173.6	0	0	0	0	105.9
14	I	34.7	Very low	32.4	Very low	143 Å²	143	152.6 Å²	152.6	73%	0.733	82%	0.823	S	S	*	*			trans	-132.1	122.2	160.7	-63	-178.4	0	0	0	107.3
15	R	31.2	Very low	32.4	Very low	217 Å²	217	155.4 Å²	155.4	82%	0.819	83%	0.826	S	S	*	*			trans	-64.7	145.2	-177.5	-73.3	171.2	161.3	162.2	-7.9	111.5
16	S	30.5	Very low	32.1	Very low	110 Å²	110	156.6 Å²	156.6	77%	0.769	82%	0.823	S	S	*	*			trans	-69	122.4	160.9	55.8	0	0	0	0	110
17	D	30.1	Very low	32	Very low	159 Å²	159	161.5 Å²	161.5	85%	0.85	82%	0.823	S	S	*	*			trans	-120	85.9	158.8	-80.4	-34.8	0	0	0	107.7
18	G	32.8	Very low	31.7	Very low	65 Å²	65	155.9 Å²	155.9	67%	0.67	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-79.4	125.6	159.7	0	0	0	0	0	108.2	P20	G18-P20 WeakPolarHBondContact O-CD 3.33Å
19	A	31.4	Very low	31.4	Very low	103 Å²	103	153.3 Å²	153.3	85%	0.851	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-55.8	127.7	174.9	0	0	0	0	0	111.7
20	P	35.8	Very low	31.3	Very low	117 Å²	117	146.9 Å²	146.9	76%	0.76	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-89.4	134.6	156.9	2.4	17.5	0	0	0	109.3	G18 E22	G18-P20 WeakPolarHBondContact O-CD 3.33Å; P20-E22 PolarHBondContact O-N 2.84Å
21	A	31.1	Very low	31.1	Very low	102 Å²	102	145.8 Å²	145.8	84%	0.843	79%	0.793	S	S	*	*			trans	-59.6	112.8	167	0	0	0	0	0	110	G23	A21-G23 PolarHBondContact O-N 3.5Å; A21-G23 VanDerWaalsContact O-N 3.12Å
22	E	31.3	Very low	30.8	Very low	197 Å²	197	148.9 Å²	148.9	92%	0.921	80%	0.797	S	S	*	*			trans	-74.5	101.2	161.6	-80.6	-165.5	151.5	0	0	108.5	P20 K24	P20-E22 PolarHBondContact O-N 2.84Å; E22-K24 PolarHBondContact O-N 3.14Å
23	G	32.2	Very low	30.9	Very low	63 Å²	63	149.9 Å²	149.9	65%	0.649	80%	0.804	S	S	*	*			trans	-56.7	133.4	169.7	0	0	0	0	0	111.1	A21 R25	A21-G23 PolarHBondContact O-N 3.5Å; A21-G23 VanDerWaalsContact O-N 3.12Å; G23-R25 PolarHBondContact O-N 3.16Å
24	K	32	Very low	31	Very low	194 Å²	194	145.7 Å²	145.7	84%	0.843	79%	0.787	S	S	*	*			trans	-39.2	100.3	154.1	-75	174	172.6	175.4	0	110.1	E22 N26	E22-K24 PolarHBondContact O-N 3.14Å; K24-N26 VanDerWaalsContact C-N 3.28Å; K24-N26 PolarHBondContact O-N 3.11Å
25	R	31.7	Very low	31.2	Very low	245 Å²	245	148.8 Å²	148.8	93%	0.925	80%	0.795	S	S	*	*			trans	-85.3	83.9	151	-89.3	-178	171.5	172.5	-1.8	107.1	G23 R27	G23-R25 PolarHBondContact O-N 3.16Å; R25-R27 VanDerWaalsContact C-N 3.33Å; R25-R27 PolarHBondContact O-N 2.59Å
26	N	25.9	Very low	31.5	Very low	140 Å²	140	148.8 Å²	148.8	75%	0.749	80%	0.797	S	S	*	*			trans	-55.9	103.9	151.8	-81.1	-6.5	0	0	0	106.5	K24 S28	K24-N26 VanDerWaalsContact C-N 3.28Å; K24-N26 PolarHBondContact O-N 3.11Å; N26-S28 PolarHBondContact O-N 3.37Å
27	R	30	Very low	32.6	Very low	225 Å²	225	152.8 Å²	152.8	85%	0.849	80%	0.796	S	S	*	*			trans	-76.7	103	160.6	-154	175.6	-175.2	172.4	-0.6	105.3	R25 D29	R25-R27 VanDerWaalsContact C-N 3.33Å; R25-R27 PolarHBondContact O-N 2.59Å; R27-D29 VanDerWaalsContact C-N 3.34Å; R27-D29 PolarHBondContact O-N 3.31Å
28	S	28	Very low	34.3	Very low	93 Å²	93	148 Å²	148	65%	0.65	78%	0.776	S	S	*	*			trans	-60.9	94	166.9	50.1	0	0	0	0	108.9	N26 T30	N26-S28 PolarHBondContact O-N 3.37Å; S28-T30 PolarHBondContact O-N 2.92Å
29	D	29.1	Very low	36	Very low	153 Å²	153	147.2 Å²	147.2	82%	0.818	75%	0.754	S	S	*	*			trans	-90.8	76.3	153.3	-82.7	-20.9	0	0	0	106.7	R27	R27-D29 VanDerWaalsContact C-N 3.34Å; R27-D29 PolarHBondContact O-N 3.31Å
30	T	30.1	Very low	37.9	Very low	114 Å²	114	148.3 Å²	148.3	70%	0.699	74%	0.742	S	S	*	*			trans	-87.3	130.2	157	-11.4	0	0	0	0	106.3	S28	S28-T30 PolarHBondContact O-N 2.92Å
31	E	28.6	Very low	39.9	Very low	177 Å²	177	145.5 Å²	145.5	83%	0.827	73%	0.728	S	S	*	*			trans	84.6	85.5	164.7	-58.6	179.5	-178.7	0	0	117.3
32	Q	29.9	Very low	42	Very low	190 Å²	190	142.1 Å²	142.1	89%	0.888	70%	0.695	S	S	*	*				-149.2	103.4	111.2	-106.7	162.7	23.2	0	0	109.7	G34	Q32-G34 PolarHBondContact O-N 3.42Å
33	E	32.3	Very low	44.4	Very low	211 Å²	211	133 Å²	133	99%	0.986	65%	0.653	S	S	*	*			trans	-49.4	96.3	152.7	-77.2	-177.8	137.8	0	0	108.4
34	G	33.5	Very low	46.5	Very low	41 Å²	41	134.8 Å²	134.8	42%	0.423	65%	0.648	S	S	.	*			trans	-152.8	106.8	173	0	0	0	0	0	106	Q32 Y36	Q32-G34 PolarHBondContact O-N 3.42Å; G34-Y36 PolarHBondContact O-N 2.92Å
35	K	38.9	Very low	48.8	Very low	208 Å²	208	133 Å²	133	90%	0.904	65%	0.646	S	S	*	*			trans	-53.5	81.2	165.5	-83.3	174.2	171.1	171.9	0	109.3
36	Y	36.8	Very low	51.1	Low	218 Å²	218	125.6 Å²	125.6	86%	0.855	62%	0.618	S	S	*	*			trans	-92.8	106.6	165.6	-90.8	-86.5	0	0	0	106.5	G34 S38	G34-Y36 PolarHBondContact O-N 2.92Å; Y36-S38 VanDerWaalsContact C-N 3.32Å; Y36-S38 PolarHBondContact O-N 3.36Å
37	Y	52.6	Low	53.9	Low	193 Å²	193	123 Å²	123	76%	0.757	60%	0.604	S	S	*	*			trans	-55.2	95.3	166.9	-81	-101.9	0	0	0	108.5	E39	Y37-E39 PolarHBondContact O-N 2.68Å
38	S	65.9	Low	56.5	Low	60 Å²	60	115.9 Å²	115.9	42%	0.42	59%	0.587	S	S	.	*			trans	-74.8	121.8	172.9	179.1	0	0	0	0	108.4	Y36 E40 A41 E42	Y36-S38 VanDerWaalsContact C-N 3.32Å; Y36-S38 PolarHBondContact O-N 3.36Å; S38-E40 PolarHBondContact O-N 3.21Å; S38-E40 PolarHBondContact OG-N 3.02Å; S38-A41 PolarHBondContact O-N 3.34Å; S38-E42 PolarHBondContact O-N 3.35Å
39	E	68.9	Low	59.4	Low	48 Å²	48	113.1 Å²	113.1	22%	0.224	57%	0.573	C	S	.	*	H	α-helix	trans	-53.7	-25.6	175.1	-67.9	-179.2	170.4	0	0	111.3	Y37 E42 V43 R103 L104 I107	Y37-E39 PolarHBondContact O-N 2.68Å; E39-E42 PolarHBondContact O-N 2.95Å; E39-V43 WeakPolarHBondContact O-CG2 3.39Å; E39-V43 PolarHBondContact O-N 3.23Å; E39-R103 IonicContact OE1-NH1 2.72Å; E39-R103 WeakPolarHBondContact OE2-CB 3.39Å; E39-R103 VanDerWaalsContact OE2-CD 3.25Å; E39-R103 WeakPolarHBondContact OE2-CD 3.36Å; E39-L104 HydrophobicContact CB-CD2 3.85Å; E39-L104 HydrophobicContact CG-CD2 4.48Å; E39-L104 WeakPolarHBondContact O-CD2 3.41Å; E39-I107 HydrophobicContact CB-CD1 3.98Å
40	E	72.2	Confident	62.1	Low	126 Å²	126	114.6 Å²	114.6	59%	0.589	57%	0.567	S	S	*	*	H	α-helix	trans	-67.3	-37.9	176	-62.3	-172.9	154.7	0	0	114	S38 V43 I107	S38-E40 PolarHBondContact O-N 3.21Å; S38-E40 PolarHBondContact OG-N 3.02Å; E40-V43 PolarHBondContact O-N 3.02Å; E40-I107 HydrophobicContact CB-CG2 4.35Å; E40-I107 HydrophobicContact CG-CD1 4.32Å; E40-I107 HydrophobicContact CG-CG2 3.88Å
41	A	77.1	Confident	65	Low	57 Å²	57	109.7 Å²	109.7	47%	0.471	54%	0.537	S	S	.	.	H	α-helix	trans	-74.7	-29.6	176.9	0	0	0	0	0	111.8	S38 V43	S38-A41 PolarHBondContact O-N 3.34Å; A41-V43 VanDerWaalsContact C-N 3.32Å
42	E	76	Confident	68	Low	32 Å²	32	108.9 Å²	108.9	15%	0.15	53%	0.528	C	S	.	.	H	α-helix	trans	-66.5	-34.2	173.8	-72.5	-172	-178.7	0	0	112	S38 E39 D44 L45 R46 K100 L104	S38-E42 PolarHBondContact O-N 3.35Å; E39-E42 PolarHBondContact O-N 2.95Å; E42-D44 PolarHBondContact O-N 3.17Å; E42-L45 PolarHBondContact O-N 3.5Å; E42-R46 WeakPolarHBondContact O-CB 3.49Å; E42-R46 WeakPolarHBondContact O-CG 3.44Å; E42-R46 PolarHBondContact O-N 2.78Å; E42-R46 VanDerWaalsContact O-N 3.1Å; E42-K100 VanDerWaalsContact CD-NZ 3.32Å; E42-K100 IonicContact OE1-NZ 3.75Å; E42-K100 PolarHBondContact OE1-NZ 3.41Å; E42-K100 WeakPolarHBondContact OE2-CE 3.38Å; E42-K100 IonicContact OE2-NZ 3.9Å; E42-K100 PolarHBondContact OE2-NZ 2.66Å; E42-L104 HydrophobicContact CB-CD2 4.13Å
43	V	80.1	Confident	70.9	Confident	6 Å²	6	106.3 Å²	106.3	4%	0.036	52%	0.515	C	S	.	.	H	α-helix	trans	-58.8	-35.9	-179.7	165.1	0	0	0	0	112.6	E39 E40 A41 L104 I107 R108	E39-V43 WeakPolarHBondContact O-CG2 3.39Å; E39-V43 PolarHBondContact O-N 3.23Å; E40-V43 PolarHBondContact O-N 3.02Å; A41-V43 VanDerWaalsContact C-N 3.32Å; V43-L104 HydrophobicContact CG2-CB 3.99Å; V43-L104 HydrophobicContact CG2-CD2 3.58Å; V43-L104 HydrophobicContact CG2-CG 4.39Å; V43-L104 WeakPolarHBondContact CG2-O 3.29Å; V43-I107 HydrophobicContact CB-CG2 4.43Å; V43-I107 HydrophobicContact CG2-CB 4.07Å; V43-I107 HydrophobicContact CG2-CG2 3.83Å; V43-R108 HydrophobicContact CG1-CB 3.5Å; V43-R108 HydrophobicContact CG1-CG 3.67Å; V43-R108 PolarHBondContact O-NH2 3.35Å
44	D	76.9	Confident	73.6	Confident	100 Å²	100	99.8 Å²	99.8	54%	0.535	49%	0.487	S	S	.	.	H	α-helix	trans	-77.5	-28.7	-176.8	-71	-27.2	0	0	0	113.7	E42 K111	E42-D44 PolarHBondContact O-N 3.17Å; D44-K111 IonicContact OD1-NZ 3.53Å; D44-K111 PolarHBondContact OD1-NZ 3.34Å; D44-K111 IonicContact OD2-NZ 3.96Å; D44-K111 PolarHBondContact OD2-NZ 3.33Å
45	L	80.5	Confident	76.4	Confident	156 Å²	156	101.5 Å²	101.5	82%	0.817	48%	0.481	S	S	*	.	H	α-helix	trans	-92.1	-20.5	-177.6	-66.1	169.9	0	0	0	112.7	E42	E42-L45 PolarHBondContact O-N 3.5Å
46	R	80.1	Confident	79	Confident	90 Å²	90	97.2 Å²	97.2	34%	0.34	46%	0.463	S	S	.	.	S	Bend	trans	-93.8	133.5	-175.2	-67.8	176.8	75.2	101.9	8.4	111.9	E42 D51 R108	E42-R46 WeakPolarHBondContact O-CB 3.49Å; E42-R46 WeakPolarHBondContact O-CG 3.44Å; E42-R46 PolarHBondContact O-N 2.78Å; E42-R46 VanDerWaalsContact O-N 3.1Å; R46-D51 IonicContact CZ-OD1 3.27Å; R46-D51 VanDerWaalsContact CZ-OD1 3.25Å; R46-D51 IonicContact NE-OD1 3Å; R46-D51 PolarHBondContact NE-OD1 3.27Å; R46-D51 IonicContact NE-OD2 2.78Å; R46-D51 IonicContact NH2-OD1 2.77Å; R46-D51 PolarHBondContact NH2-OD1 3.01Å; R46-R108 PolarHBondContact O-NH2 3Å
47	D	84.9	Confident	81.7	Confident	85 Å²	85	92.7 Å²	92.7	46%	0.455	45%	0.445	S	S	.	.			trans	-71.4	125.3	176.5	-174.9	-82.4	0	0	0	110.9	G49 R50 D51	D47-G49 VanDerWaalsContact C-N 3.27Å; D47-G49 PolarHBondContact O-N 2.9Å; D47-G49 VanDerWaalsContact OD1-CA 3.3Å; D47-G49 WeakPolarHBondContact OD1-CA 3.36Å; D47-G49 PolarHBondContact OD1-N 3.15Å; D47-R50 HydrophobicContact CB-CB 4.12Å; D47-R50 HydrophobicContact CB-CG 4.03Å; D47-R50 PolarHBondContact O-N 2.95Å; D47-R50 PolarHBondContact OD1-N 3.4Å; D47-D51 PolarHBondContact O-N 3.43Å
48	P	85.3	Confident	83.5	Confident	75 Å²	75	84 Å²	84	49%	0.487	41%	0.412	S	S	.	.	H	α-helix	trans	-65.2	-29.7	-177.1	26	-34	0	0	0	113.1	Y52	P48-Y52 PolarHBondContact O-N 3.4Å; P48-Y52 VanDerWaalsContact O-N 3.14Å
49	G	87.1	Confident	84.7	Confident	35 Å²	35	83.2 Å²	83.2	36%	0.361	41%	0.406	S	S	.	.	H	α-helix	trans	-69.4	-46.6	176	0	0	0	0	0	111.5	D47 D51 Y52 E53	D47-G49 VanDerWaalsContact C-N 3.27Å; D47-G49 PolarHBondContact O-N 2.9Å; D47-G49 VanDerWaalsContact OD1-CA 3.3Å; D47-G49 WeakPolarHBondContact OD1-CA 3.36Å; D47-G49 PolarHBondContact OD1-N 3.15Å; G49-D51 PolarHBondContact O-N 3.26Å; G49-Y52 WeakPolarHBondContact O-CB 3.32Å; G49-Y52 PolarHBondContact O-N 2.89Å; G49-E53 WeakPolarHBondContact O-CG 3.46Å; G49-E53 PolarHBondContact O-N 3.01Å
50	R	87.4	Confident	85.8	Confident	184 Å²	184	85.8 Å²	85.8	69%	0.694	42%	0.418	S	S	*	.	H	α-helix	trans	-64.4	-37.4	176.1	-65.2	-176.3	-178.9	172.4	0.7	112.9	D47 Y52 E53 L54	D47-R50 HydrophobicContact CB-CB 4.12Å; D47-R50 HydrophobicContact CB-CG 4.03Å; D47-R50 PolarHBondContact O-N 2.95Å; D47-R50 PolarHBondContact OD1-N 3.4Å; R50-Y52 VanDerWaalsContact C-N 3.33Å; R50-E53 PolarHBondContact O-N 3.47Å; R50-L54 WeakPolarHBondContact O-CB 3.5Å; R50-L54 PolarHBondContact O-N 3.46Å
51	D	89.8	Confident	86.7	Confident	12 Å²	12	81.5 Å²	81.5	6%	0.064	40%	0.398	C	S	.	.	H	α-helix	trans	-63.2	-39.8	173.5	-82	-18.2	0	0	0	111.3	R46 D47 G49 L54 Y55 L101 R108	R46-D51 IonicContact CZ-OD1 3.27Å; R46-D51 VanDerWaalsContact CZ-OD1 3.25Å; R46-D51 IonicContact NE-OD1 3Å; R46-D51 PolarHBondContact NE-OD1 3.27Å; R46-D51 IonicContact NE-OD2 2.78Å; R46-D51 IonicContact NH2-OD1 2.77Å; R46-D51 PolarHBondContact NH2-OD1 3.01Å; D47-D51 PolarHBondContact O-N 3.43Å; G49-D51 PolarHBondContact O-N 3.26Å; D51-L54 PolarHBondContact O-N 3.18Å; D51-Y55 WeakPolarHBondContact O-CB 3.47Å; D51-Y55 PolarHBondContact O-N 3.18Å; D51-L101 WeakPolarHBondContact O-CD2 3.32Å; D51-R108 IonicContact OD2-CZ 3.64Å; D51-R108 IonicContact OD2-NH1 3.97Å; D51-R108 IonicContact OD2-NH2 3.86Å; D51-R108 PolarHBondContact OD2-NH2 3.4Å
52	Y	90.9	Very high	87.4	Confident	160 Å²	160	79.5 Å²	79.5	63%	0.627	38%	0.379	S	S	*	.	H	α-helix	trans	-67	-40.7	176.4	-177.2	-102.1	0	0	0	112.6	P48 G49 R50 L54 Y55 K56	P48-Y52 PolarHBondContact O-N 3.4Å; P48-Y52 VanDerWaalsContact O-N 3.14Å; G49-Y52 WeakPolarHBondContact O-CB 3.32Å; G49-Y52 PolarHBondContact O-N 2.89Å; R50-Y52 VanDerWaalsContact C-N 3.33Å; Y52-L54 VanDerWaalsContact C-N 3.34Å; Y52-L54 PolarHBondContact O-N 3.2Å; Y52-Y55 WeakPolarHBondContact O-CB 3.46Å; Y52-Y55 PolarHBondContact O-N 3.44Å; Y52-K56 PolarHBondContact O-N 2.93Å
53	E	91.8	Very high	88.1	Confident	135 Å²	135	84.7 Å²	84.7	63%	0.631	40%	0.403	S	S	*	.	H	α-helix	trans	-60.6	-44	173.5	-72	174.9	177.8	0	0	111.6	G49 R50 K56 Y57	G49-E53 WeakPolarHBondContact O-CG 3.46Å; G49-E53 PolarHBondContact O-N 3.01Å; R50-E53 PolarHBondContact O-N 3.47Å; E53-K56 PolarHBondContact O-N 3.37Å; E53-Y57 WeakPolarHBondContact O-CB 3.27Å; E53-Y57 PolarHBondContact O-N 2.95Å
54	L	89.8	Confident	88.7	Confident	74 Å²	74	90.1 Å²	90.1	39%	0.387	42%	0.423	S	S	.	.	H	α-helix	trans	-65.1	-38.5	176.4	-170.4	71.1	0	0	0	112.2	R50 D51 Y52 Y57 T58 L101	R50-L54 WeakPolarHBondContact O-CB 3.5Å; R50-L54 PolarHBondContact O-N 3.46Å; D51-L54 PolarHBondContact O-N 3.18Å; Y52-L54 VanDerWaalsContact C-N 3.34Å; Y52-L54 PolarHBondContact O-N 3.2Å; L54-Y57 PolarHBondContact O-N 3.11Å; L54-T58 WeakPolarHBondContact O-CG2 3.21Å; L54-T58 PolarHBondContact O-N 3.45Å; L54-T58 PolarHBondContact O-OG1 3.47Å; L54-L101 HydrophobicContact CB-CD2 4.37Å; L54-L101 HydrophobicContact CD2-CD1 4.46Å; L54-L101 HydrophobicContact CD2-CD2 4.49Å
55	Y	92.4	Very high	89.2	Confident	78 Å²	78	85.4 Å²	85.4	31%	0.306	40%	0.398	S	S	.	.	H	α-helix	trans	-60.1	-46.3	172.5	-174.9	-88.9	0	0	0	111.3	D51 Y52 T58 C59 L98 L101	D51-Y55 WeakPolarHBondContact O-CB 3.47Å; D51-Y55 PolarHBondContact O-N 3.18Å; Y52-Y55 WeakPolarHBondContact O-CB 3.46Å; Y52-Y55 PolarHBondContact O-N 3.44Å; Y55-T58 WeakPolarHBondContact CA-OG1 3.47Å; Y55-T58 PolarHBondContact O-N 3.03Å; Y55-T58 PolarHBondContact O-OG1 3.04Å; Y55-C59 PolarHBondContact O-N 2.98Å; Y55-C59 PolarHBondContact O-SG 3.44Å; Y55-C59 VanDerWaalsContact O-SG 3.35Å; Y55-L98 HydrophobicContact CD1-CD2 4.4Å; Y55-L98 HydrophobicContact CD2-CD2 3.41Å; Y55-L98 VanDerWaalsContact CD2-CD2 3.41Å; Y55-L98 HydrophobicContact CE1-CD2 4.37Å; Y55-L98 HydrophobicContact CE2-CB 4.35Å; Y55-L98 HydrophobicContact CE2-CD2 3.39Å; Y55-L98 HydrophobicContact CE2-CG 4.45Å; Y55-L98 HydrophobicContact CG-CD2 3.94Å; Y55-L101 HydrophobicContact CD2-CB 4.09Å; Y55-L101 HydrophobicContact CD2-CD2 4.2Å; Y55-L101 HydrophobicContact CG-CD2 4.44Å
56	K	93.1	Very high	89.5	Confident	117 Å²	117	83.2 Å²	83.2	51%	0.509	39%	0.385	S	S	.	.	H	α-helix	trans	-64.2	-43.4	178.7	-171.8	177.6	-180	-178.5	0	111.6	Y52 E53 C59 Q60	Y52-K56 PolarHBondContact O-N 2.93Å; E53-K56 PolarHBondContact O-N 3.37Å; K56-C59 WeakPolarHBondContact O-CB 3.34Å; K56-C59 PolarHBondContact O-N 2.97Å; K56-Q60 WeakPolarHBondContact O-CG 3.47Å; K56-Q60 PolarHBondContact O-N 3.45Å
57	Y	93.3	Very high	90	Very high	124 Å²	124	81.5 Å²	81.5	49%	0.486	39%	0.39	S	S	.	.	H	α-helix	trans	-61	-46.9	176.5	179	-98.7	0	0	0	112.1	E53 L54 C59 Q60 E61	E53-Y57 WeakPolarHBondContact O-CB 3.27Å; E53-Y57 PolarHBondContact O-N 2.95Å; L54-Y57 PolarHBondContact O-N 3.11Å; Y57-C59 VanDerWaalsContact C-N 3.31Å; Y57-C59 PolarHBondContact O-N 3.39Å; Y57-Q60 WeakPolarHBondContact O-CB 3.36Å; Y57-Q60 PolarHBondContact O-N 2.96Å; Y57-Q60 VanDerWaalsContact O-N 3.11Å; Y57-E61 HydrophobicContact CD1-CG 4.33Å; Y57-E61 HydrophobicContact CE1-CG 3.8Å; Y57-E61 HydrophobicContact CE2-CG 4.32Å; Y57-E61 PolarHBondContact O-N 2.9Å
58	T	90.1	Very high	90.1	Very high	9 Å²	9	79.9 Å²	79.9	6%	0.055	38%	0.38	C	S	.	.	H	α-helix	trans	-65.2	-33.2	178.2	48.6	0	0	0	0	112.9	L54 Y55 L62 L98	L54-T58 WeakPolarHBondContact O-CG2 3.21Å; L54-T58 PolarHBondContact O-N 3.45Å; L54-T58 PolarHBondContact O-OG1 3.47Å; Y55-T58 WeakPolarHBondContact CA-OG1 3.47Å; Y55-T58 PolarHBondContact O-N 3.03Å; Y55-T58 PolarHBondContact O-OG1 3.04Å; T58-L62 VanDerWaalsContact O-CB 3.3Å; T58-L62 WeakPolarHBondContact O-CB 3.47Å; T58-L62 PolarHBondContact O-N 3.16Å; T58-L98 VanDerWaalsContact OG1-CD2 3.26Å; T58-L98 WeakPolarHBondContact OG1-CD2 3.25Å
59	C	91.3	Very high	90	Very high	45 Å²	45	77.4 Å²	77.4	30%	0.304	36%	0.362	S	S	.	.	H	α-helix	trans	-64.7	-41	169.7	-74.8	0	0	0	0	112.7	Y55 K56 Y57 L62 Q63	Y55-C59 PolarHBondContact O-N 2.98Å; Y55-C59 PolarHBondContact O-SG 3.44Å; Y55-C59 VanDerWaalsContact O-SG 3.35Å; K56-C59 WeakPolarHBondContact O-CB 3.34Å; K56-C59 PolarHBondContact O-N 2.97Å; Y57-C59 VanDerWaalsContact C-N 3.31Å; Y57-C59 PolarHBondContact O-N 3.39Å; C59-L62 PolarHBondContact O-N 3.35Å; C59-Q63 WeakPolarHBondContact O-CB 3.4Å; C59-Q63 PolarHBondContact O-N 3.26Å
60	Q	92.8	Very high	90	Very high	102 Å²	102	82.8 Å²	82.8	48%	0.477	38%	0.378	S	S	.	.	H	α-helix	trans	-65.4	-43.8	177.1	-73	173.6	-18.2	0	0	111.9	K56 Y57 Q63 R64	K56-Q60 WeakPolarHBondContact O-CG 3.47Å; K56-Q60 PolarHBondContact O-N 3.45Å; Y57-Q60 WeakPolarHBondContact O-CB 3.36Å; Y57-Q60 PolarHBondContact O-N 2.96Å; Y57-Q60 VanDerWaalsContact O-N 3.11Å; Q60-Q63 WeakPolarHBondContact O-CB 3.49Å; Q60-Q63 PolarHBondContact O-N 2.94Å; Q60-R64 PolarHBondContact O-N 3.27Å
61	E	90.4	Very high	89.9	Confident	35 Å²	35	77.3 Å²	77.3	16%	0.164	36%	0.363	C	S	.	.	H	α-helix	trans	-64	-42.4	175.6	-72.1	-60.8	114.1	0	0	111.5	Y57 Q63 R64 L65	Y57-E61 HydrophobicContact CD1-CG 4.33Å; Y57-E61 HydrophobicContact CE1-CG 3.8Å; Y57-E61 HydrophobicContact CE2-CG 4.32Å; Y57-E61 PolarHBondContact O-N 2.9Å; E61-Q63 VanDerWaalsContact C-N 3.31Å; E61-Q63 PolarHBondContact O-N 3.46Å; E61-R64 VanDerWaalsContact CD-NH1 3.28Å; E61-R64 WeakPolarHBondContact O-CB 3.49Å; E61-R64 PolarHBondContact O-N 2.91Å; E61-R64 VanDerWaalsContact O-N 3.15Å; E61-R64 IonicContact OE1-CZ 3.16Å; E61-R64 IonicContact OE1-NH1 3.5Å; E61-R64 PolarHBondContact OE1-NH1 3.45Å; E61-R64 IonicContact OE2-CZ 3.14Å; E61-R64 VanDerWaalsContact OE2-CZ 3.26Å; E61-R64 IonicContact OE2-NH1 3.73Å; E61-R64 PolarHBondContact OE2-NH1 2.96Å; E61-R64 IonicContact OE2-NH2 2.82Å; E61-R64 PolarHBondContact OE2-NH2 3Å; E61-L65 WeakPolarHBondContact O-CG 3.47Å; E61-L65 PolarHBondContact O-N 3.16Å
62	L	90.9	Very high	89.6	Confident	15 Å²	15	78 Å²	78	8%	0.079	37%	0.366	C	S	.	.	H	α-helix	trans	-61.4	-39.5	174.8	-174.5	66.8	0	0	0	112	T58 C59 L65 M66 H94 F95 L98	T58-L62 VanDerWaalsContact O-CB 3.3Å; T58-L62 WeakPolarHBondContact O-CB 3.47Å; T58-L62 PolarHBondContact O-N 3.16Å; C59-L62 PolarHBondContact O-N 3.35Å; L62-L65 PolarHBondContact O-N 3.39Å; L62-M66 WeakPolarHBondContact O-CB 3.44Å; L62-M66 VanDerWaalsContact O-CG 3.3Å; L62-M66 WeakPolarHBondContact O-CG 3.3Å; L62-M66 PolarHBondContact O-N 2.76Å; L62-H94 HydrophobicContact CB-CB 4.44Å; L62-H94 HydrophobicContact CD1-CB 4.36Å; L62-F95 HydrophobicContact CD1-CD2 4.1Å; L62-F95 HydrophobicContact CD1-CE2 3.78Å; L62-F95 HydrophobicContact CD1-CZ 4.29Å; L62-F95 HydrophobicContact CD2-CD1 4.21Å; L62-F95 HydrophobicContact CD2-CD2 4.37Å; L62-F95 HydrophobicContact CD2-CE1 3.75Å; L62-F95 HydrophobicContact CD2-CE2 3.92Å; L62-F95 HydrophobicContact CD2-CZ 3.59Å; L62-F95 HydrophobicContact CG-CE2 4.43Å; L62-F95 HydrophobicContact CG-CZ 4.46Å; L62-L98 HydrophobicContact CD2-CD1 4.11Å
63	Q	91.3	Very high	89.1	Confident	141 Å²	141	76.5 Å²	76.5	66%	0.659	36%	0.363	S	S	*	.	H	α-helix	trans	-63	-41.4	173.8	-174.6	-179.5	1.3	0	0	111.7	C59 Q60 E61 M66 A67	C59-Q63 WeakPolarHBondContact O-CB 3.4Å; C59-Q63 PolarHBondContact O-N 3.26Å; Q60-Q63 WeakPolarHBondContact O-CB 3.49Å; Q60-Q63 PolarHBondContact O-N 2.94Å; E61-Q63 VanDerWaalsContact C-N 3.31Å; E61-Q63 PolarHBondContact O-N 3.46Å; Q63-M66 PolarHBondContact O-N 3.44Å; Q63-A67 PolarHBondContact O-N 2.93Å
64	R	91.7	Very high	88.6	Confident	121 Å²	121	74.4 Å²	74.4	46%	0.457	36%	0.363	S	S	.	.	H	α-helix	trans	-62.2	-47.6	175.4	-163.3	-176.3	85.9	-136.9	-8	111.3	Q60 E61 M66 A67 E68	Q60-R64 PolarHBondContact O-N 3.27Å; E61-R64 VanDerWaalsContact CD-NH1 3.28Å; E61-R64 WeakPolarHBondContact O-CB 3.49Å; E61-R64 PolarHBondContact O-N 2.91Å; E61-R64 VanDerWaalsContact O-N 3.15Å; E61-R64 IonicContact OE1-CZ 3.16Å; E61-R64 IonicContact OE1-NH1 3.5Å; E61-R64 PolarHBondContact OE1-NH1 3.45Å; E61-R64 IonicContact OE2-CZ 3.14Å; E61-R64 VanDerWaalsContact OE2-CZ 3.26Å; E61-R64 IonicContact OE2-NH1 3.73Å; E61-R64 PolarHBondContact OE2-NH1 2.96Å; E61-R64 IonicContact OE2-NH2 2.82Å; E61-R64 PolarHBondContact OE2-NH2 3Å; R64-M66 VanDerWaalsContact C-N 3.32Å; R64-M66 PolarHBondContact O-N 3.06Å; R64-A67 PolarHBondContact O-N 3.29Å; R64-E68 IonicContact NE-OE1 3.26Å; R64-E68 PolarHBondContact NE-OE1 3.22Å; R64-E68 VanDerWaalsContact NE-OE1 3.11Å; R64-E68 WeakPolarHBondContact O-CG 3.32Å; R64-E68 PolarHBondContact O-N 3.29Å
65	L	88.8	Confident	88	Confident	1 Å²	1	79.4 Å²	79.4	1%	0.005	38%	0.377	C	S	.	.	H	α-helix	trans	-60.7	-40.2	177.4	-68.2	171.8	0	0	0	111.9	E61 L62 E68 I69 R87 Q90	E61-L65 WeakPolarHBondContact O-CG 3.47Å; E61-L65 PolarHBondContact O-N 3.16Å; L62-L65 PolarHBondContact O-N 3.39Å; L65-E68 PolarHBondContact O-N 3.31Å; L65-I69 WeakPolarHBondContact O-CB 3.41Å; L65-I69 WeakPolarHBondContact O-CD1 3.28Å; L65-I69 WeakPolarHBondContact O-CG1 3.4Å; L65-I69 PolarHBondContact O-N 3.42Å; L65-R87 HydrophobicContact CD2-CB 4.44Å; L65-R87 HydrophobicContact CD2-CG 4.45Å; L65-Q90 HydrophobicContact CD1-CB 3.9Å; L65-Q90 HydrophobicContact CD2-CB 4.37Å
66	M	87.3	Confident	86.5	Confident	110 Å²	110	78.9 Å²	78.9	54%	0.542	40%	0.395	S	S	.	.	H	α-helix	trans	-64.7	-40.9	175.2	-76.2	-177.4	137.8	0	0	112.6	L62 Q63 R64 I69 Q70	L62-M66 WeakPolarHBondContact O-CB 3.44Å; L62-M66 VanDerWaalsContact O-CG 3.3Å; L62-M66 WeakPolarHBondContact O-CG 3.3Å; L62-M66 PolarHBondContact O-N 2.76Å; Q63-M66 PolarHBondContact O-N 3.44Å; R64-M66 VanDerWaalsContact C-N 3.32Å; R64-M66 PolarHBondContact O-N 3.06Å; M66-I69 PolarHBondContact O-N 3.17Å; M66-Q70 WeakPolarHBondContact O-CB 3.48Å; M66-Q70 PolarHBondContact O-N 3.14Å
67	A	89.4	Confident	85.2	Confident	54 Å²	54	75.6 Å²	75.6	45%	0.446	39%	0.394	S	S	.	.	H	α-helix	trans	-65.2	-40.9	175.5	0	0	0	0	0	111.8	Q63 R64 Q70 D71	Q63-A67 PolarHBondContact O-N 2.93Å; R64-A67 PolarHBondContact O-N 3.29Å; A67-Q70 WeakPolarHBondContact O-CB 3.46Å; A67-Q70 PolarHBondContact O-N 2.94Å; A67-D71 PolarHBondContact O-N 2.99Å
68	E	86.3	Confident	83.5	Confident	51 Å²	51	79.6 Å²	79.6	24%	0.238	41%	0.414	C	S	.	.	H	α-helix	trans	-64.4	-43.6	174.8	-70.8	163.7	171.2	0	0	111.6	R64 L65 Q70 D71 L72 R87	R64-E68 IonicContact NE-OE1 3.26Å; R64-E68 PolarHBondContact NE-OE1 3.22Å; R64-E68 VanDerWaalsContact NE-OE1 3.11Å; R64-E68 WeakPolarHBondContact O-CG 3.32Å; R64-E68 PolarHBondContact O-N 3.29Å; L65-E68 PolarHBondContact O-N 3.31Å; E68-Q70 VanDerWaalsContact C-N 3.26Å; E68-Q70 PolarHBondContact O-N 3Å; E68-D71 PolarHBondContact O-N 3.33Å; E68-L72 WeakPolarHBondContact O-CB 3.3Å; E68-L72 VanDerWaalsContact O-CG 3.29Å; E68-L72 WeakPolarHBondContact O-CG 3.47Å; E68-L72 PolarHBondContact O-N 2.98Å; E68-R87 IonicContact OE1-NH1 3.93Å; E68-R87 IonicContact OE2-CZ 3.98Å; E68-R87 IonicContact OE2-NE 2.67Å; E68-R87 IonicContact OE2-NH1 3.11Å; E68-R87 PolarHBondContact OE2-NH1 2.92Å
69	I	84.7	Confident	82.2	Confident	22 Å²	22	85.5 Å²	85.5	11%	0.113	45%	0.446	C	S	.	.	H	α-helix	trans	-60.8	-37.1	173.7	-69.8	165.1	0	0	0	110.9	L65 M66 K73 R87 R88	L65-I69 WeakPolarHBondContact O-CB 3.41Å; L65-I69 WeakPolarHBondContact O-CD1 3.28Å; L65-I69 WeakPolarHBondContact O-CG1 3.4Å; L65-I69 PolarHBondContact O-N 3.42Å; M66-I69 PolarHBondContact O-N 3.17Å; I69-K73 HydrophobicContact CG2-CD 4.24Å; I69-K73 WeakPolarHBondContact O-CB 3.23Å; I69-K73 VanDerWaalsContact O-CG 3.27Å; I69-K73 WeakPolarHBondContact O-CG 3.43Å; I69-K73 PolarHBondContact O-N 2.66Å; I69-R87 HydrophobicContact CD1-CB 3.93Å; I69-R87 HydrophobicContact CG1-CB 3.75Å; I69-R88 HydrophobicContact CD1-CG 4.37Å
70	Q	86	Confident	81.3	Confident	148 Å²	148	84.6 Å²	84.6	69%	0.692	44%	0.439	S	S	*	.	H	α-helix	trans	-67.2	-45.2	177.1	-173.6	177.2	10.2	0	0	111.9	M66 A67 E68 K73 S74	M66-Q70 WeakPolarHBondContact O-CB 3.48Å; M66-Q70 PolarHBondContact O-N 3.14Å; A67-Q70 WeakPolarHBondContact O-CB 3.46Å; A67-Q70 PolarHBondContact O-N 2.94Å; E68-Q70 VanDerWaalsContact C-N 3.26Å; E68-Q70 PolarHBondContact O-N 3Å; Q70-K73 PolarHBondContact O-N 3.46Å; Q70-S74 PolarHBondContact O-N 3.41Å
71	D	85.6	Confident	80.5	Confident	70 Å²	70	83 Å²	83	37%	0.374	44%	0.442	S	S	.	.	H	α-helix	trans	-62.6	-47.5	176.4	-173.3	38.9	0	0	0	111	A67 E68 K73 S74 R75	A67-D71 PolarHBondContact O-N 2.99Å; E68-D71 PolarHBondContact O-N 3.33Å; D71-K73 VanDerWaalsContact C-N 3.33Å; D71-K73 PolarHBondContact O-N 3.5Å; D71-S74 WeakPolarHBondContact O-CB 3.4Å; D71-S74 PolarHBondContact O-N 2.9Å; D71-S74 PolarHBondContact O-OG 2.95Å; D71-R75 PolarHBondContact O-N 3.31Å; D71-R75 IonicContact OD1-CZ 3.81Å; D71-R75 IonicContact OD1-NE 3.8Å; D71-R75 PolarHBondContact OD1-NE 3.35Å; D71-R75 VanDerWaalsContact OD1-NE 3.16Å; D71-R75 IonicContact OD1-NH2 3.5Å; D71-R75 PolarHBondContact OD1-NH2 2.96Å; D71-R75 IonicContact OD2-CZ 3.34Å; D71-R75 IonicContact OD2-NE 2.82Å; D71-R75 PolarHBondContact OD2-NE 3.03Å; D71-R75 VanDerWaalsContact OD2-NE 3.14Å; D71-R75 IonicContact OD2-NH2 2.84Å; D71-R75 PolarHBondContact OD2-NH2 3.16Å
72	L	83.4	Confident	79.9	Confident	26 Å²	26	87.3 Å²	87.3	14%	0.136	47%	0.465	C	S	.	.	H	α-helix	trans	-58.6	-42.3	177.3	-73.4	173.4	0	0	0	112.3	E68 S74 R75 V80 E83 I84	E68-L72 WeakPolarHBondContact O-CB 3.3Å; E68-L72 VanDerWaalsContact O-CG 3.29Å; E68-L72 WeakPolarHBondContact O-CG 3.47Å; E68-L72 PolarHBondContact O-N 2.98Å; L72-S74 VanDerWaalsContact C-N 3.27Å; L72-S74 PolarHBondContact O-N 2.93Å; L72-R75 PolarHBondContact O-N 2.87Å; L72-V80 HydrophobicContact CB-CG1 3.84Å; L72-V80 HydrophobicContact CD2-CG1 4.32Å; L72-E83 HydrophobicContact CD1-CB 4.29Å; L72-I84 HydrophobicContact CB-CD1 4.38Å; L72-I84 HydrophobicContact CB-CG1 4.13Å; L72-I84 HydrophobicContact CD1-CG1 4.32Å
73	K	80.6	Confident	79.4	Confident	128 Å²	128	91.3 Å²	91.3	56%	0.557	48%	0.484	S	S	*	.	H	α-helix	trans	-63.7	-29.4	175.4	-80.8	-178.2	176.1	-173.3	0	113.6	I69 Q70 D71 I84	I69-K73 HydrophobicContact CG2-CD 4.24Å; I69-K73 WeakPolarHBondContact O-CB 3.23Å; I69-K73 VanDerWaalsContact O-CG 3.27Å; I69-K73 WeakPolarHBondContact O-CG 3.43Å; I69-K73 PolarHBondContact O-N 2.66Å; Q70-K73 PolarHBondContact O-N 3.46Å; D71-K73 VanDerWaalsContact C-N 3.33Å; D71-K73 PolarHBondContact O-N 3.5Å; K73-I84 HydrophobicContact CG-CD1 3.81Å
74	S	81.3	Confident	78.9	Confident	92 Å²	92	85.7 Å²	85.7	64%	0.643	46%	0.458	S	S	*	.	H	α-helix	trans	-76.3	-25.3	-179.9	75.8	0	0	0	0	113.5	Q70 D71 L72	Q70-S74 PolarHBondContact O-N 3.41Å; D71-S74 WeakPolarHBondContact O-CB 3.4Å; D71-S74 PolarHBondContact O-N 2.9Å; D71-S74 PolarHBondContact O-OG 2.95Å; L72-S74 VanDerWaalsContact C-N 3.27Å; L72-S74 PolarHBondContact O-N 2.93Å
75	R	77.3	Confident	78.5	Confident	179 Å²	179	84.4 Å²	84.4	68%	0.675	46%	0.457	S	S	*	.	H	α-helix	trans	-86.2	-23	-173.9	-66.5	177.5	-174	-137.6	10.4	115	D71 L72	D71-R75 PolarHBondContact O-N 3.31Å; D71-R75 IonicContact OD1-CZ 3.81Å; D71-R75 IonicContact OD1-NE 3.8Å; D71-R75 PolarHBondContact OD1-NE 3.35Å; D71-R75 VanDerWaalsContact OD1-NE 3.16Å; D71-R75 IonicContact OD1-NH2 3.5Å; D71-R75 PolarHBondContact OD1-NH2 2.96Å; D71-R75 IonicContact OD2-CZ 3.34Å; D71-R75 IonicContact OD2-NE 2.82Å; D71-R75 PolarHBondContact OD2-NE 3.03Å; D71-R75 VanDerWaalsContact OD2-NE 3.14Å; D71-R75 IonicContact OD2-NH2 2.84Å; D71-R75 PolarHBondContact OD2-NH2 3.16Å; L72-R75 PolarHBondContact O-N 2.87Å
76	G	60.2	Low	78.3	Confident	67 Å²	67	89.6 Å²	89.6	69%	0.691	48%	0.481	S	S	*	.			trans	57.4	97.3	170.1	0	0	0	0	0	116.8
77	G	66.3	Low	78.2	Confident	47 Å²	47	87.6 Å²	87.6	49%	0.485	47%	0.468	S	S	.	.			trans	-158.1	159.7	174.2	0	0	0	0	0	113.3	D79 V80	G77-D79 PolarHBondContact O-N 3.44Å; G77-V80 VanDerWaalsContact O-CB 3.32Å; G77-V80 WeakPolarHBondContact O-CB 3.15Å; G77-V80 WeakPolarHBondContact O-CG2 3.44Å; G77-V80 PolarHBondContact O-N 2.85Å
78	K	58.8	Low	78	Confident	208 Å²	208	90.5 Å²	90.5	90%	0.904	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-29	-174.1	-77.6	-175.5	178.8	179.7	0	114.5	V80	K78-V80 VanDerWaalsContact C-N 3.35Å
79	D	62.1	Low	78	Confident	134 Å²	134	93 Å²	93	72%	0.717	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-12.4	176.2	-70.8	-32.3	0	0	0	113.7	G77 A81 I82	G77-D79 PolarHBondContact O-N 3.44Å; D79-A81 PolarHBondContact O-N 3.39Å; D79-I82 PolarHBondContact O-N 3.29Å
80	V	73	Confident	78	Confident	26 Å²	26	95.3 Å²	95.3	16%	0.158	49%	0.491	C	S	.	.	H	α-helix	trans	-67	-21.5	-178.5	-173.5	0	0	0	0	111.9	L72 G77 K78 I82 I84	L72-V80 HydrophobicContact CB-CG1 3.84Å; L72-V80 HydrophobicContact CD2-CG1 4.32Å; G77-V80 VanDerWaalsContact O-CB 3.32Å; G77-V80 WeakPolarHBondContact O-CB 3.15Å; G77-V80 WeakPolarHBondContact O-CG2 3.44Å; G77-V80 PolarHBondContact O-N 2.85Å; K78-V80 VanDerWaalsContact C-N 3.35Å; V80-I82 VanDerWaalsContact C-N 3.34Å; V80-I82 PolarHBondContact O-N 3.23Å; V80-I84 HydrophobicContact CG1-CD1 3.68Å; V80-I84 HydrophobicContact CG1-CG1 4.04Å; V80-I84 WeakPolarHBondContact O-CB 3.42Å; V80-I84 VanDerWaalsContact O-CG1 3.25Å; V80-I84 WeakPolarHBondContact O-CG1 3.46Å; V80-I84 PolarHBondContact O-N 2.83Å
81	A	74.6	Confident	78.1	Confident	67 Å²	67	88.7 Å²	88.7	55%	0.554	46%	0.462	S	S	*	.	H	α-helix	trans	-64.7	-35.4	179.5	0	0	0	0	0	113.1	D79 E85	D79-A81 PolarHBondContact O-N 3.39Å; A81-E85 PolarHBondContact O-N 2.85Å
82	I	78.8	Confident	78.2	Confident	126 Å²	126	88.9 Å²	88.9	65%	0.646	47%	0.467	S	S	*	.	H	α-helix	trans	-75.1	-45.1	-178.3	-59	174.5	0	0	0	110.1	D79 V80 I84 E85 E86	D79-I82 PolarHBondContact O-N 3.29Å; V80-I82 VanDerWaalsContact C-N 3.34Å; V80-I82 PolarHBondContact O-N 3.23Å; I82-I84 PolarHBondContact O-N 3.17Å; I82-E85 PolarHBondContact O-N 3.34Å; I82-E86 PolarHBondContact O-N 3.47Å
83	E	79.6	Confident	78.5	Confident	100 Å²	100	91.4 Å²	91.4	47%	0.467	48%	0.484	S	S	.	.	H	α-helix	trans	-64.5	-38.5	177.2	-67.5	-174.6	170.5	0	0	112.4	L72 E85 E86 R87	L72-E83 HydrophobicContact CD1-CB 4.29Å; E83-E85 VanDerWaalsContact C-N 3.31Å; E83-E85 PolarHBondContact O-N 3.01Å; E83-E86 PolarHBondContact O-N 2.88Å; E83-R87 WeakPolarHBondContact O-CG 3.37Å; E83-R87 PolarHBondContact O-N 2.93Å
84	I	81.1	Confident	78.9	Confident	22 Å²	22	87.1 Å²	87.1	11%	0.113	47%	0.465	C	S	.	.	H	α-helix	trans	-62.2	-40.6	173.9	-73.5	174.4	0	0	0	110.8	L72 K73 V80 I82 R87 R88	L72-I84 HydrophobicContact CB-CD1 4.38Å; L72-I84 HydrophobicContact CB-CG1 4.13Å; L72-I84 HydrophobicContact CD1-CG1 4.32Å; K73-I84 HydrophobicContact CG-CD1 3.81Å; V80-I84 HydrophobicContact CG1-CD1 3.68Å; V80-I84 HydrophobicContact CG1-CG1 4.04Å; V80-I84 WeakPolarHBondContact O-CB 3.42Å; V80-I84 VanDerWaalsContact O-CG1 3.25Å; V80-I84 WeakPolarHBondContact O-CG1 3.46Å; V80-I84 PolarHBondContact O-N 2.83Å; I82-I84 PolarHBondContact O-N 3.17Å; I84-R87 PolarHBondContact O-N 2.8Å; I84-R88 HydrophobicContact CG2-CG 4.46Å; I84-R88 WeakPolarHBondContact O-CB 3.41Å; I84-R88 VanDerWaalsContact O-CG 3.23Å; I84-R88 WeakPolarHBondContact O-CG 3.47Å; I84-R88 PolarHBondContact O-N 3.36Å
85	E	83.4	Confident	79.3	Confident	95 Å²	95	87.1 Å²	87.1	44%	0.444	45%	0.454	S	S	.	.	H	α-helix	trans	-70.1	-35.9	179.6	-159.9	58.8	-153.3	0	0	111.7	A81 I82 E83 R88 I89	A81-E85 PolarHBondContact O-N 2.85Å; I82-E85 PolarHBondContact O-N 3.34Å; E83-E85 VanDerWaalsContact C-N 3.31Å; E83-E85 PolarHBondContact O-N 3.01Å; E85-R88 WeakPolarHBondContact O-CB 3.26Å; E85-R88 PolarHBondContact O-N 3.46Å; E85-R88 VanDerWaalsContact OE2-CD 3.28Å; E85-R88 WeakPolarHBondContact OE2-CD 3.44Å; E85-R88 IonicContact OE2-NH1 2.59Å; E85-R88 PolarHBondContact OE2-NH1 3.41Å; E85-I89 VanDerWaalsContact O-CG1 3.28Å; E85-I89 WeakPolarHBondContact O-CG1 3.5Å; E85-I89 PolarHBondContact O-N 3.11Å
86	E	84.6	Confident	79.9	Confident	109 Å²	109	85 Å²	85	51%	0.509	45%	0.454	S	S	.	.	H	α-helix	trans	-63.4	-45.4	172.6	-169.3	178.4	-179.6	0	0	112.1	I82 E83 R88 I89 Q90	I82-E86 PolarHBondContact O-N 3.47Å; E83-E86 PolarHBondContact O-N 2.88Å; E86-R88 VanDerWaalsContact C-N 3.28Å; E86-R88 PolarHBondContact O-N 3.01Å; E86-I89 PolarHBondContact O-N 2.81Å; E86-I89 VanDerWaalsContact O-N 3.16Å; E86-Q90 WeakPolarHBondContact O-CG 3.47Å; E86-Q90 PolarHBondContact O-N 2.95Å
87	R	85.8	Confident	81.2	Confident	69 Å²	69	84.1 Å²	84.1	26%	0.26	44%	0.435	S	S	.	.	H	α-helix	trans	-66.3	-30.2	176.1	-63.7	-67.4	166.3	83.6	8.7	112.4	L65 E68 I69 E83 I84 S91	L65-R87 HydrophobicContact CD2-CB 4.44Å; L65-R87 HydrophobicContact CD2-CG 4.45Å; E68-R87 IonicContact OE1-NH1 3.93Å; E68-R87 IonicContact OE2-CZ 3.98Å; E68-R87 IonicContact OE2-NE 2.67Å; E68-R87 IonicContact OE2-NH1 3.11Å; E68-R87 PolarHBondContact OE2-NH1 2.92Å; I69-R87 HydrophobicContact CD1-CB 3.93Å; I69-R87 HydrophobicContact CG1-CB 3.75Å; E83-R87 WeakPolarHBondContact O-CG 3.37Å; E83-R87 PolarHBondContact O-N 2.93Å; I84-R87 PolarHBondContact O-N 2.8Å; R87-S91 VanDerWaalsContact O-CB 3.32Å; R87-S91 WeakPolarHBondContact O-CB 3.39Å; R87-S91 PolarHBondContact O-N 3.39Å; R87-S91 PolarHBondContact O-OG 2.94Å
88	R	84.9	Confident	82.4	Confident	115 Å²	115	82.6 Å²	82.6	43%	0.434	42%	0.415	S	S	.	.	H	α-helix	trans	-66.4	-43.4	170.2	-78.5	169.5	165.1	-157.9	-4.2	111.9	I69 I84 E85 E86 S91 C92	I69-R88 HydrophobicContact CD1-CG 4.37Å; I84-R88 HydrophobicContact CG2-CG 4.46Å; I84-R88 WeakPolarHBondContact O-CB 3.41Å; I84-R88 VanDerWaalsContact O-CG 3.23Å; I84-R88 WeakPolarHBondContact O-CG 3.47Å; I84-R88 PolarHBondContact O-N 3.36Å; E85-R88 WeakPolarHBondContact O-CB 3.26Å; E85-R88 PolarHBondContact O-N 3.46Å; E85-R88 VanDerWaalsContact OE2-CD 3.28Å; E85-R88 WeakPolarHBondContact OE2-CD 3.44Å; E85-R88 IonicContact OE2-NH1 2.59Å; E85-R88 PolarHBondContact OE2-NH1 3.41Å; E86-R88 VanDerWaalsContact C-N 3.28Å; E86-R88 PolarHBondContact O-N 3.01Å; R88-S91 WeakPolarHBondContact O-CB 3.3Å; R88-S91 PolarHBondContact O-N 3.14Å; R88-C92 WeakPolarHBondContact O-CB 3.39Å; R88-C92 PolarHBondContact O-N 3.3Å; R88-C92 PolarHBondContact O-SG 2.87Å
89	I	86.4	Confident	84	Confident	102 Å²	102	79 Å²	79	52%	0.523	40%	0.4	S	S	.	.	H	α-helix	trans	-61.7	-45.9	175.9	-66.7	163.4	0	0	0	110.1	E85 E86 S91 C92 V93	E85-I89 VanDerWaalsContact O-CG1 3.28Å; E85-I89 WeakPolarHBondContact O-CG1 3.5Å; E85-I89 PolarHBondContact O-N 3.11Å; E86-I89 PolarHBondContact O-N 2.81Å; E86-I89 VanDerWaalsContact O-N 3.16Å; I89-S91 VanDerWaalsContact C-N 3.34Å; I89-S91 PolarHBondContact O-N 3.23Å; I89-C92 WeakPolarHBondContact O-CB 3.45Å; I89-C92 PolarHBondContact O-N 3.42Å; I89-C92 VanDerWaalsContact O-N 3.17Å; I89-V93 WeakPolarHBondContact O-CG2 3.35Å; I89-V93 PolarHBondContact O-N 3.31Å
90	Q	85.2	Confident	85.2	Confident	71 Å²	71	76 Å²	76	33%	0.332	38%	0.381	S	S	.	.	H	α-helix	trans	-60.8	-42.5	175.3	-68	176.7	4.1	0	0	112	L65 E86 C92 V93 H94	L65-Q90 HydrophobicContact CD1-CB 3.9Å; L65-Q90 HydrophobicContact CD2-CB 4.37Å; E86-Q90 WeakPolarHBondContact O-CG 3.47Å; E86-Q90 PolarHBondContact O-N 2.95Å; Q90-C92 VanDerWaalsContact C-N 3.34Å; Q90-C92 PolarHBondContact O-N 3.47Å; Q90-V93 WeakPolarHBondContact O-CB 3.3Å; Q90-V93 PolarHBondContact O-N 2.89Å; Q90-H94 PolarHBondContact O-CD2 2.96Å; Q90-H94 PolarHBondContact O-N 3.4Å
91	S	87.1	Confident	86	Confident	10 Å²	10	75.7 Å²	75.7	7%	0.07	38%	0.378	C	S	.	.	H	α-helix	trans	-61.8	-40.9	174.4	-62.3	0	0	0	0	112	R87 R88 I89 V93 H94 F95	R87-S91 VanDerWaalsContact O-CB 3.32Å; R87-S91 WeakPolarHBondContact O-CB 3.39Å; R87-S91 PolarHBondContact O-N 3.39Å; R87-S91 PolarHBondContact O-OG 2.94Å; R88-S91 WeakPolarHBondContact O-CB 3.3Å; R88-S91 PolarHBondContact O-N 3.14Å; I89-S91 VanDerWaalsContact C-N 3.34Å; I89-S91 PolarHBondContact O-N 3.23Å; S91-V93 VanDerWaalsContact C-N 3.34Å; S91-V93 PolarHBondContact O-N 3.46Å; S91-H94 PolarHBondContact O-N 2.8Å; S91-F95 WeakPolarHBondContact O-CD2 3.18Å; S91-F95 PolarHBondContact O-N 2.92Å
92	C	87.5	Confident	86.8	Confident	73 Å²	73	75.7 Å²	75.7	49%	0.493	37%	0.368	S	S	.	.	H	α-helix	trans	-61.7	-40.1	175.4	-75.9	0	0	0	0	111.9	R88 I89 Q90 F95 M96	R88-C92 WeakPolarHBondContact O-CB 3.39Å; R88-C92 PolarHBondContact O-N 3.3Å; R88-C92 PolarHBondContact O-SG 2.87Å; I89-C92 WeakPolarHBondContact O-CB 3.45Å; I89-C92 PolarHBondContact O-N 3.42Å; I89-C92 VanDerWaalsContact O-N 3.17Å; Q90-C92 VanDerWaalsContact C-N 3.34Å; Q90-C92 PolarHBondContact O-N 3.47Å; C92-F95 PolarHBondContact O-N 3.35Å; C92-M96 VanDerWaalsContact O-CG 3.3Å; C92-M96 WeakPolarHBondContact O-CG 3.28Å; C92-M96 PolarHBondContact O-N 3.1Å
93	V	89.2	Confident	87.3	Confident	80 Å²	80	76.5 Å²	76.5	49%	0.485	36%	0.363	S	S	.	.	H	α-helix	trans	-61.2	-46.3	173.6	176.1	0	0	0	0	110.4	I89 Q90 S91 F95 M96 T97	I89-V93 WeakPolarHBondContact O-CG2 3.35Å; I89-V93 PolarHBondContact O-N 3.31Å; Q90-V93 WeakPolarHBondContact O-CB 3.3Å; Q90-V93 PolarHBondContact O-N 2.89Å; S91-V93 VanDerWaalsContact C-N 3.34Å; S91-V93 PolarHBondContact O-N 3.46Å; V93-F95 PolarHBondContact O-N 3.23Å; V93-M96 WeakPolarHBondContact O-CB 3.17Å; V93-M96 PolarHBondContact O-N 3.28Å; V93-M96 VanDerWaalsContact O-N 3.16Å; V93-T97 WeakPolarHBondContact O-CG2 3.09Å; V93-T97 PolarHBondContact O-N 3Å
94	H	89.6	Confident	87.7	Confident	37 Å²	37	71.8 Å²	71.8	17%	0.171	34%	0.341	C	S	.	.	H	α-helix	trans	-61.2	-42.2	175.1	-70.5	-60	0	0	0	112.4	L62 Q90 S91 M96 T97 L98	L62-H94 HydrophobicContact CB-CB 4.44Å; L62-H94 HydrophobicContact CD1-CB 4.36Å; Q90-H94 PolarHBondContact O-CD2 2.96Å; Q90-H94 PolarHBondContact O-N 3.4Å; S91-H94 PolarHBondContact O-N 2.8Å; H94-M96 VanDerWaalsContact C-N 3.32Å; H94-M96 PolarHBondContact O-N 3.24Å; H94-T97 WeakPolarHBondContact CA-OG1 3.48Å; H94-T97 PolarHBondContact O-N 3.4Å; H94-T97 VanDerWaalsContact O-N 3.14Å; H94-T97 PolarHBondContact O-OG1 3.4Å; H94-L98 WeakPolarHBondContact O-CG 3.33Å; H94-L98 PolarHBondContact O-N 2.95Å
95	F	90.4	Very high	88	Confident	92 Å²	92	73 Å²	73	40%	0.404	36%	0.355	S	S	.	.	H	α-helix	trans	-61	-38.3	173.4	-83.8	-63.9	0	0	0	113.1	L62 S91 C92 V93 L98 K99	L62-F95 HydrophobicContact CD1-CD2 4.1Å; L62-F95 HydrophobicContact CD1-CE2 3.78Å; L62-F95 HydrophobicContact CD1-CZ 4.29Å; L62-F95 HydrophobicContact CD2-CD1 4.21Å; L62-F95 HydrophobicContact CD2-CD2 4.37Å; L62-F95 HydrophobicContact CD2-CE1 3.75Å; L62-F95 HydrophobicContact CD2-CE2 3.92Å; L62-F95 HydrophobicContact CD2-CZ 3.59Å; L62-F95 HydrophobicContact CG-CE2 4.43Å; L62-F95 HydrophobicContact CG-CZ 4.46Å; S91-F95 WeakPolarHBondContact O-CD2 3.18Å; S91-F95 PolarHBondContact O-N 2.92Å; C92-F95 PolarHBondContact O-N 3.35Å; V93-F95 PolarHBondContact O-N 3.23Å; F95-L98 PolarHBondContact O-N 3.04Å; F95-K99 WeakPolarHBondContact O-CB 3.42Å; F95-K99 WeakPolarHBondContact O-CG 3.31Å; F95-K99 PolarHBondContact O-N 3.13Å
96	M	89.4	Confident	88.4	Confident	136 Å²	136	74.8 Å²	74.8	67%	0.67	36%	0.363	S	S	*	.	H	α-helix	trans	-63.6	-42.3	174	-71	173.1	67.7	0	0	111	C92 V93 H94 K99 K100	C92-M96 VanDerWaalsContact O-CG 3.3Å; C92-M96 WeakPolarHBondContact O-CG 3.28Å; C92-M96 PolarHBondContact O-N 3.1Å; V93-M96 WeakPolarHBondContact O-CB 3.17Å; V93-M96 PolarHBondContact O-N 3.28Å; V93-M96 VanDerWaalsContact O-N 3.16Å; H94-M96 VanDerWaalsContact C-N 3.32Å; H94-M96 PolarHBondContact O-N 3.24Å; M96-K99 PolarHBondContact O-N 2.9Å; M96-K100 PolarHBondContact O-N 3.19Å
97	T	88.1	Confident	88.6	Confident	48 Å²	48	71.4 Å²	71.4	29%	0.294	35%	0.348	S	S	.	.	H	α-helix	trans	-63.2	-45.9	175.4	62.2	0	0	0	0	112.2	V93 H94 K99 K100 L101	V93-T97 WeakPolarHBondContact O-CG2 3.09Å; V93-T97 PolarHBondContact O-N 3Å; H94-T97 WeakPolarHBondContact CA-OG1 3.48Å; H94-T97 PolarHBondContact O-N 3.4Å; H94-T97 VanDerWaalsContact O-N 3.14Å; H94-T97 PolarHBondContact O-OG1 3.4Å; T97-K99 VanDerWaalsContact C-N 3.33Å; T97-K99 PolarHBondContact O-N 3.42Å; T97-K100 WeakPolarHBondContact O-CB 3.15Å; T97-K100 PolarHBondContact O-N 2.65Å; T97-K100 VanDerWaalsContact O-N 3.11Å; T97-L101 WeakPolarHBondContact O-CD1 3.07Å; T97-L101 PolarHBondContact O-N 3.38Å
98	L	90.5	Very high	88.7	Confident	14 Å²	14	71 Å²	71	7%	0.073	35%	0.347	C	S	.	.	H	α-helix	trans	-61.2	-40.8	176.7	-68.5	172.5	0	0	0	112	Y55 T58 L62 H94 F95 L101 N102	Y55-L98 HydrophobicContact CD1-CD2 4.4Å; Y55-L98 HydrophobicContact CD2-CD2 3.41Å; Y55-L98 VanDerWaalsContact CD2-CD2 3.41Å; Y55-L98 HydrophobicContact CE1-CD2 4.37Å; Y55-L98 HydrophobicContact CE2-CB 4.35Å; Y55-L98 HydrophobicContact CE2-CD2 3.39Å; Y55-L98 HydrophobicContact CE2-CG 4.45Å; Y55-L98 HydrophobicContact CG-CD2 3.94Å; T58-L98 VanDerWaalsContact OG1-CD2 3.26Å; T58-L98 WeakPolarHBondContact OG1-CD2 3.25Å; L62-L98 HydrophobicContact CD2-CD1 4.11Å; H94-L98 WeakPolarHBondContact O-CG 3.33Å; H94-L98 PolarHBondContact O-N 2.95Å; F95-L98 PolarHBondContact O-N 3.04Å; L98-L101 PolarHBondContact O-N 3.42Å; L98-N102 WeakPolarHBondContact O-CB 3.41Å; L98-N102 PolarHBondContact O-N 3.03Å; L98-N102 PolarHBondContact O-ND2 3.44Å
99	K	91.9	Very high	89	Confident	133 Å²	133	70.9 Å²	70.9	58%	0.578	35%	0.354	S	S	*	.	H	α-helix	trans	-62.7	-41.6	174	-77.3	179.7	178.7	-178.9	0	111.5	F95 M96 T97 N102 R103	F95-K99 WeakPolarHBondContact O-CB 3.42Å; F95-K99 WeakPolarHBondContact O-CG 3.31Å; F95-K99 PolarHBondContact O-N 3.13Å; M96-K99 PolarHBondContact O-N 2.9Å; T97-K99 VanDerWaalsContact C-N 3.33Å; T97-K99 PolarHBondContact O-N 3.42Å; K99-N102 PolarHBondContact O-N 3.05Å; K99-R103 WeakPolarHBondContact O-CG 3.25Å; K99-R103 PolarHBondContact O-N 3.35Å
100	K	88.8	Confident	89.2	Confident	72 Å²	72	72.3 Å²	72.3	31%	0.313	36%	0.356	S	S	.	.	H	α-helix	trans	-62.6	-48.8	174.9	-172.5	175.4	179.9	-176.6	0	111.1	E42 M96 T97 N102 R103 L104	E42-K100 VanDerWaalsContact CD-NZ 3.32Å; E42-K100 IonicContact OE1-NZ 3.75Å; E42-K100 PolarHBondContact OE1-NZ 3.41Å; E42-K100 WeakPolarHBondContact OE2-CE 3.38Å; E42-K100 IonicContact OE2-NZ 3.9Å; E42-K100 PolarHBondContact OE2-NZ 2.66Å; M96-K100 PolarHBondContact O-N 3.19Å; T97-K100 WeakPolarHBondContact O-CB 3.15Å; T97-K100 PolarHBondContact O-N 2.65Å; T97-K100 VanDerWaalsContact O-N 3.11Å; K100-N102 VanDerWaalsContact C-N 3.31Å; K100-N102 PolarHBondContact O-N 2.86Å; K100-R103 WeakPolarHBondContact O-CB 3.43Å; K100-R103 PolarHBondContact O-N 3.02Å; K100-R103 VanDerWaalsContact O-N 3.13Å; K100-L104 HydrophobicContact CG-CD1 4.36Å; K100-L104 WeakPolarHBondContact O-CG 3.46Å; K100-L104 PolarHBondContact O-N 3.46Å
101	L	88.8	Confident	89.4	Confident	18 Å²	18	73.4 Å²	73.4	9%	0.094	36%	0.36	C	S	.	.	H	α-helix	trans	-61.5	-37.7	178.5	-87.4	77.1	0	0	0	112.6	D51 L54 Y55 T97 L98 L104 A105	D51-L101 WeakPolarHBondContact O-CD2 3.32Å; L54-L101 HydrophobicContact CB-CD2 4.37Å; L54-L101 HydrophobicContact CD2-CD1 4.46Å; L54-L101 HydrophobicContact CD2-CD2 4.49Å; Y55-L101 HydrophobicContact CD2-CB 4.09Å; Y55-L101 HydrophobicContact CD2-CD2 4.2Å; Y55-L101 HydrophobicContact CG-CD2 4.44Å; T97-L101 WeakPolarHBondContact O-CD1 3.07Å; T97-L101 PolarHBondContact O-N 3.38Å; L98-L101 PolarHBondContact O-N 3.42Å; L101-L104 PolarHBondContact O-N 3.38Å; L101-A105 WeakPolarHBondContact O-CB 3.39Å; L101-A105 PolarHBondContact O-N 2.87Å
102	N	90.6	Very high	89.4	Confident	68 Å²	68	74.4 Å²	74.4	36%	0.364	37%	0.372	S	S	.	.	H	α-helix	trans	-64.1	-42.2	173.3	-83.2	-39.1	0	0	0	112.5	L98 K99 K100 A105 H106	L98-N102 WeakPolarHBondContact O-CB 3.41Å; L98-N102 PolarHBondContact O-N 3.03Å; L98-N102 PolarHBondContact O-ND2 3.44Å; K99-N102 PolarHBondContact O-N 3.05Å; K100-N102 VanDerWaalsContact C-N 3.31Å; K100-N102 PolarHBondContact O-N 2.86Å; N102-A105 PolarHBondContact O-N 3.29Å; N102-H106 PolarHBondContact O-CD2 2.67Å; N102-H106 PolarHBondContact O-N 3.43Å
103	R	89.6	Confident	89.7	Confident	143 Å²	143	79.3 Å²	79.3	54%	0.54	38%	0.38	S	S	.	.	H	α-helix	trans	-60.4	-47.6	174.4	-71.1	174.2	-172.3	174.8	-1.5	110.8	E39 K99 K100 A105 H106 I107	E39-R103 IonicContact OE1-NH1 2.72Å; E39-R103 WeakPolarHBondContact OE2-CB 3.39Å; E39-R103 VanDerWaalsContact OE2-CD 3.25Å; E39-R103 WeakPolarHBondContact OE2-CD 3.36Å; K99-R103 WeakPolarHBondContact O-CG 3.25Å; K99-R103 PolarHBondContact O-N 3.35Å; K100-R103 WeakPolarHBondContact O-CB 3.43Å; K100-R103 PolarHBondContact O-N 3.02Å; K100-R103 VanDerWaalsContact O-N 3.13Å; R103-A105 VanDerWaalsContact C-N 3.33Å; R103-A105 PolarHBondContact O-N 3.44Å; R103-H106 PolarHBondContact O-N 2.91Å; R103-I107 WeakPolarHBondContact O-CB 3.35Å; R103-I107 VanDerWaalsContact O-CG1 3.22Å; R103-I107 WeakPolarHBondContact O-CG1 3.22Å; R103-I107 PolarHBondContact O-N 2.9Å
104	L	88.7	Confident	89.8	Confident	1 Å²	1	79 Å²	79	1%	0.005	38%	0.375	C	S	.	.	H	α-helix	trans	-58.2	-43.7	176.5	-66	174.4	0	0	0	111.9	E39 E42 V43 K100 L101 I107 R108	E39-L104 HydrophobicContact CB-CD2 3.85Å; E39-L104 HydrophobicContact CG-CD2 4.48Å; E39-L104 WeakPolarHBondContact O-CD2 3.41Å; E42-L104 HydrophobicContact CB-CD2 4.13Å; V43-L104 HydrophobicContact CG2-CB 3.99Å; V43-L104 HydrophobicContact CG2-CD2 3.58Å; V43-L104 HydrophobicContact CG2-CG 4.39Å; V43-L104 WeakPolarHBondContact CG2-O 3.29Å; K100-L104 HydrophobicContact CG-CD1 4.36Å; K100-L104 WeakPolarHBondContact O-CG 3.46Å; K100-L104 PolarHBondContact O-N 3.46Å; L101-L104 PolarHBondContact O-N 3.38Å; L104-I107 PolarHBondContact O-N 2.87Å; L104-R108 VanDerWaalsContact O-CB 3.31Å; L104-R108 WeakPolarHBondContact O-CB 3.44Å; L104-R108 PolarHBondContact O-N 2.99Å
105	A	88.3	Confident	89.9	Confident	48 Å²	48	83.6 Å²	83.6	40%	0.397	40%	0.397	S	S	.	.	H	α-helix	trans	-63.6	-43.9	177.2	0	0	0	0	0	112.5	L101 N102 R103 R108 L109	L101-A105 WeakPolarHBondContact O-CB 3.39Å; L101-A105 PolarHBondContact O-N 2.87Å; N102-A105 PolarHBondContact O-N 3.29Å; R103-A105 VanDerWaalsContact C-N 3.33Å; R103-A105 PolarHBondContact O-N 3.44Å; A105-R108 PolarHBondContact O-N 2.83Å; A105-L109 WeakPolarHBondContact O-CB 3.41Å; A105-L109 PolarHBondContact O-N 3.39Å
106	H	90.3	Very high	90	Very high	131 Å²	131	83.6 Å²	83.6	61%	0.606	41%	0.405	S	S	*	.	H	α-helix	trans	-66	-40.1	176.4	-80.6	-62	0	0	0	112.6	N102 R103 L109 K110	N102-H106 PolarHBondContact O-CD2 2.67Å; N102-H106 PolarHBondContact O-N 3.43Å; R103-H106 PolarHBondContact O-N 2.91Å; H106-L109 PolarHBondContact O-N 3.04Å; H106-K110 WeakPolarHBondContact O-CB 3.38Å; H106-K110 PolarHBondContact O-N 3.41Å
107	I	89.1	Confident	90.2	Very high	39 Å²	39	81.6 Å²	81.6	20%	0.2	39%	0.394	C	S	.	.	H	α-helix	trans	-62.1	-47	174.2	-69.2	165.7	0	0	0	109.9	E39 E40 V43 R103 L104 L109 K110 K111	E39-I107 HydrophobicContact CB-CD1 3.98Å; E40-I107 HydrophobicContact CB-CG2 4.35Å; E40-I107 HydrophobicContact CG-CD1 4.32Å; E40-I107 HydrophobicContact CG-CG2 3.88Å; V43-I107 HydrophobicContact CB-CG2 4.43Å; V43-I107 HydrophobicContact CG2-CB 4.07Å; V43-I107 HydrophobicContact CG2-CG2 3.83Å; R103-I107 WeakPolarHBondContact O-CB 3.35Å; R103-I107 VanDerWaalsContact O-CG1 3.22Å; R103-I107 WeakPolarHBondContact O-CG1 3.22Å; R103-I107 PolarHBondContact O-N 2.9Å; L104-I107 PolarHBondContact O-N 2.87Å; I107-L109 PolarHBondContact O-N 3.45Å; I107-K110 PolarHBondContact O-N 2.87Å; I107-K111 WeakPolarHBondContact O-CB 3.32Å; I107-K111 PolarHBondContact O-N 2.85Å
108	R	88	Confident	90.4	Very high	61 Å²	61	84.6 Å²	84.6	23%	0.23	40%	0.404	C	S	.	.	H	α-helix	trans	-59.3	-44.9	177.4	-165.2	177.5	-72.2	128.9	-5.1	112.1	V43 R46 D51 L104 A105 K111 G112	V43-R108 HydrophobicContact CG1-CB 3.5Å; V43-R108 HydrophobicContact CG1-CG 3.67Å; V43-R108 PolarHBondContact O-NH2 3.35Å; R46-R108 PolarHBondContact O-NH2 3Å; D51-R108 IonicContact OD2-CZ 3.64Å; D51-R108 IonicContact OD2-NH1 3.97Å; D51-R108 IonicContact OD2-NH2 3.86Å; D51-R108 PolarHBondContact OD2-NH2 3.4Å; L104-R108 VanDerWaalsContact O-CB 3.31Å; L104-R108 WeakPolarHBondContact O-CB 3.44Å; L104-R108 PolarHBondContact O-N 2.99Å; A105-R108 PolarHBondContact O-N 2.83Å; R108-K111 PolarHBondContact O-N 3.45Å; R108-G112 PolarHBondContact O-N 3.21Å
109	L	90.7	Very high	90.5	Very high	111 Å²	111	86.4 Å²	86.4	58%	0.581	42%	0.421	S	S	*	.	H	α-helix	trans	-63.8	-46.9	177.4	-172.7	158.9	0	0	0	111.2	A105 H106 I107 K111 G112 R113	A105-L109 WeakPolarHBondContact O-CB 3.41Å; A105-L109 PolarHBondContact O-N 3.39Å; H106-L109 PolarHBondContact O-N 3.04Å; I107-L109 PolarHBondContact O-N 3.45Å; L109-K111 VanDerWaalsContact C-N 3.34Å; L109-K111 PolarHBondContact O-N 3.49Å; L109-G112 PolarHBondContact O-N 3.37Å; L109-R113 WeakPolarHBondContact O-CB 3.36Å; L109-R113 PolarHBondContact O-N 2.96Å
110	K	91.4	Very high	90.6	Very high	133 Å²	133	85.3 Å²	85.3	58%	0.578	42%	0.417	S	S	*	.	H	α-helix	trans	-59.8	-46.5	178	-173.3	179	177.9	-170.5	0	110.8	H106 I107 G112 R113 D114	H106-K110 WeakPolarHBondContact O-CB 3.38Å; H106-K110 PolarHBondContact O-N 3.41Å; I107-K110 PolarHBondContact O-N 2.87Å; K110-G112 PolarHBondContact O-N 2.93Å; K110-R113 PolarHBondContact O-N 2.99Å; K110-D114 WeakPolarHBondContact O-CB 3.34Å; K110-D114 VanDerWaalsContact O-CG 3.26Å; K110-D114 PolarHBondContact O-N 3.24Å
111	K	88.7	Confident	90.8	Very high	94 Å²	94	87.6 Å²	87.6	41%	0.409	43%	0.428	S	S	.	.	H	α-helix	trans	-57.8	-47.6	176.9	-172.5	174.4	-176.4	176.8	0	112.5	D44 I107 R108 L109 R113 D114 Q115	D44-K111 IonicContact OD1-NZ 3.53Å; D44-K111 PolarHBondContact OD1-NZ 3.34Å; D44-K111 IonicContact OD2-NZ 3.96Å; D44-K111 PolarHBondContact OD2-NZ 3.33Å; I107-K111 WeakPolarHBondContact O-CB 3.32Å; I107-K111 PolarHBondContact O-N 2.85Å; R108-K111 PolarHBondContact O-N 3.45Å; L109-K111 VanDerWaalsContact C-N 3.34Å; L109-K111 PolarHBondContact O-N 3.49Å; K111-R113 PolarHBondContact O-N 3.48Å; K111-D114 PolarHBondContact O-N 2.84Å; K111-Q115 WeakPolarHBondContact O-CB 3.21Å; K111-Q115 PolarHBondContact O-N 3.46Å
112	G	88.6	Confident	91	Very high	31 Å²	31	93.1 Å²	93.1	32%	0.32	45%	0.452	S	S	.	.	H	α-helix	trans	-65.2	-37.6	177.2	0	0	0	0	0	113.2	R108 L109 K110 T116	R108-G112 PolarHBondContact O-N 3.21Å; L109-G112 PolarHBondContact O-N 3.37Å; K110-G112 PolarHBondContact O-N 2.93Å; G112-T116 WeakPolarHBondContact O-CB 3.42Å; G112-T116 WeakPolarHBondContact O-CG2 3.32Å; G112-T116 PolarHBondContact O-N 3.48Å; G112-T116 PolarHBondContact O-OG1 3.46Å
113	R	93.2	Very high	91.2	Very high	175 Å²	175	94.4 Å²	94.4	66%	0.66	46%	0.462	S	S	*	.	H	α-helix	trans	-65.6	-44.8	175.3	-175.4	176	-178.9	166	0.6	111.8	L109 K110 K111 T116 H117	L109-R113 WeakPolarHBondContact O-CB 3.36Å; L109-R113 PolarHBondContact O-N 2.96Å; K110-R113 PolarHBondContact O-N 2.99Å; K111-R113 PolarHBondContact O-N 3.48Å; R113-T116 PolarHBondContact O-OG1 2.84Å; R113-H117 WeakPolarHBondContact O-CB 3.48Å; R113-H117 PolarHBondContact O-N 2.88Å
114	D	91.6	Very high	91.4	Very high	73 Å²	73	91.8 Å²	91.8	39%	0.39	46%	0.458	S	S	.	.	H	α-helix	trans	-67.2	-43.4	-179.7	-67.5	-14.5	0	0	0	110.2	K110 K111 T116 H117 E118	K110-D114 WeakPolarHBondContact O-CB 3.34Å; K110-D114 VanDerWaalsContact O-CG 3.26Å; K110-D114 PolarHBondContact O-N 3.24Å; K111-D114 PolarHBondContact O-N 2.84Å; D114-T116 PolarHBondContact O-N 3.08Å; D114-H117 PolarHBondContact O-N 2.92Å; D114-E118 WeakPolarHBondContact O-CG 3.38Å; D114-E118 PolarHBondContact O-N 2.99Å
115	Q	91.4	Very high	91.6	Very high	134 Å²	134	94 Å²	94	63%	0.626	48%	0.477	S	S	*	.	H	α-helix	trans	-60.6	-46	176.4	-172.9	-178.7	17.3	0	0	112.8	K111 H117 E118 A119	K111-Q115 WeakPolarHBondContact O-CB 3.21Å; K111-Q115 PolarHBondContact O-N 3.46Å; Q115-H117 VanDerWaalsContact C-N 3.33Å; Q115-E118 PolarHBondContact O-N 3.29Å; Q115-A119 PolarHBondContact O-N 3.03Å; Q115-A119 VanDerWaalsContact O-N 3.08Å
116	T	92.8	Very high	91.8	Very high	93 Å²	93	99.7 Å²	99.7	57%	0.571	49%	0.49	S	S	*	.	H	α-helix	trans	-67.7	-36	177.2	49.9	0	0	0	0	111.7	G112 R113 D114 A119 K120	G112-T116 WeakPolarHBondContact O-CB 3.42Å; G112-T116 WeakPolarHBondContact O-CG2 3.32Å; G112-T116 PolarHBondContact O-N 3.48Å; G112-T116 PolarHBondContact O-OG1 3.46Å; R113-T116 PolarHBondContact O-OG1 2.84Å; D114-T116 PolarHBondContact O-N 3.08Å; T116-A119 PolarHBondContact O-N 3.45Å; T116-K120 WeakPolarHBondContact O-CB 3.45Å; T116-K120 PolarHBondContact O-N 3.38Å
117	H	92.8	Very high	91.9	Very high	94 Å²	94	98.2 Å²	98.2	44%	0.435	48%	0.483	S	S	.	.	H	α-helix	trans	-65.6	-42.8	175.3	-170.3	-77.7	0	0	0	112.2	R113 D114 Q115 K120 Q121	R113-H117 WeakPolarHBondContact O-CB 3.48Å; R113-H117 PolarHBondContact O-N 2.88Å; D114-H117 PolarHBondContact O-N 2.92Å; Q115-H117 VanDerWaalsContact C-N 3.33Å; H117-K120 PolarHBondContact O-N 2.84Å; H117-Q121 WeakPolarHBondContact O-CB 3.4Å; H117-Q121 PolarHBondContact O-N 3.21Å
118	E	92.3	Very high	92.1	Very high	110 Å²	110	101.4 Å²	101.4	51%	0.514	50%	0.5	S	S	.	.	H	α-helix	trans	-61.8	-44.2	175.3	-75.7	179.8	-167.1	0	0	112.1	D114 Q115 Q121 K122	D114-E118 WeakPolarHBondContact O-CG 3.38Å; D114-E118 PolarHBondContact O-N 2.99Å; Q115-E118 PolarHBondContact O-N 3.29Å; E118-Q121 PolarHBondContact O-N 3.04Å; E118-K122 WeakPolarHBondContact O-CG 3.42Å; E118-K122 PolarHBondContact O-N 3.06Å
119	A	92.7	Very high	92.3	Very high	53 Å²	53	103.9 Å²	103.9	44%	0.438	51%	0.514	S	S	.	.	H	α-helix	trans	-63.4	-44.6	176.5	0	0	0	0	0	111.4	Q115 T116 Q121 K122 V123	Q115-A119 PolarHBondContact O-N 3.03Å; Q115-A119 VanDerWaalsContact O-N 3.08Å; T116-A119 PolarHBondContact O-N 3.45Å; A119-Q121 PolarHBondContact O-N 3.43Å; A119-K122 PolarHBondContact O-N 3.41Å; A119-V123 WeakPolarHBondContact O-CG2 3.33Å; A119-V123 PolarHBondContact O-N 2.8Å
120	K	93.9	Very high	92.4	Very high	110 Å²	110	102.9 Å²	102.9	48%	0.478	51%	0.509	S	S	.	.	H	α-helix	trans	-57.6	-47.5	174.7	-171.8	-165.6	69.5	169.2	0	111.2	T116 H117 K122 V123 D124	T116-K120 WeakPolarHBondContact O-CB 3.45Å; T116-K120 PolarHBondContact O-N 3.38Å; H117-K120 PolarHBondContact O-N 2.84Å; K120-K122 VanDerWaalsContact C-N 3.29Å; K120-K122 PolarHBondContact O-N 3.11Å; K120-V123 PolarHBondContact O-N 3.44Å; K120-V123 VanDerWaalsContact O-N 3.11Å; K120-D124 VanDerWaalsContact O-CG 3.28Å; K120-D124 PolarHBondContact O-N 3.47Å
121	Q	93.2	Very high	92.5	Very high	120 Å²	120	100.9 Å²	100.9	56%	0.561	50%	0.501	S	S	*	.	H	α-helix	trans	-60.9	-37.2	179.3	-171.3	177.4	2.1	0	0	112.5	H117 E118 A119 A125	H117-Q121 WeakPolarHBondContact O-CB 3.4Å; H117-Q121 PolarHBondContact O-N 3.21Å; E118-Q121 PolarHBondContact O-N 3.04Å; A119-Q121 PolarHBondContact O-N 3.43Å; Q121-A125 WeakPolarHBondContact O-CB 3.27Å; Q121-A125 PolarHBondContact O-N 3.32Å
122	K	92.9	Very high	92.7	Very high	133 Å²	133	101 Å²	101	58%	0.578	51%	0.506	S	S	*	.	H	α-helix	trans	-66.6	-43.4	173.6	-71.1	170.9	-175.6	168.2	0	111.8	E118 A119 K120 A125 Y126	E118-K122 WeakPolarHBondContact O-CG 3.42Å; E118-K122 PolarHBondContact O-N 3.06Å; A119-K122 PolarHBondContact O-N 3.41Å; K120-K122 VanDerWaalsContact C-N 3.29Å; K120-K122 PolarHBondContact O-N 3.11Å; K122-A125 PolarHBondContact O-N 3.38Å; K122-Y126 VanDerWaalsContact O-CD2 3.27Å; K122-Y126 WeakPolarHBondContact O-CD2 3.39Å; K122-Y126 PolarHBondContact O-N 3.21Å
123	V	94.6	Very high	92.9	Very high	96 Å²	96	104.3 Å²	104.3	58%	0.582	52%	0.516	S	S	*	.	H	α-helix	trans	-63.1	-44	176.7	172	0	0	0	0	111	A119 K120 A125 Y126 H127	A119-V123 WeakPolarHBondContact O-CG2 3.33Å; A119-V123 PolarHBondContact O-N 2.8Å; K120-V123 PolarHBondContact O-N 3.44Å; K120-V123 VanDerWaalsContact O-N 3.11Å; V123-A125 VanDerWaalsContact C-N 3.28Å; V123-A125 PolarHBondContact O-N 2.87Å; V123-Y126 PolarHBondContact O-N 3.29Å; V123-H127 WeakPolarHBondContact O-CB 3.47Å; V123-H127 PolarHBondContact O-N 2.95Å
124	D	94.1	Very high	92.8	Very high	87 Å²	87	100.2 Å²	100.2	47%	0.465	51%	0.507	S	S	.	.	H	α-helix	trans	-60.7	-39.3	176.4	-67.8	-26.7	0	0	0	111.1	K120 H127 L128	K120-D124 VanDerWaalsContact O-CG 3.28Å; K120-D124 PolarHBondContact O-N 3.47Å; D124-H127 PolarHBondContact O-N 3.23Å; D124-L128 WeakPolarHBondContact O-CB 3.31Å; D124-L128 PolarHBondContact O-N 3.28Å
125	A	92.6	Very high	92.9	Very high	49 Å²	49	103.9 Å²	103.9	41%	0.405	52%	0.516	S	S	.	.	H	α-helix	trans	-65.5	-43.9	175.2	0	0	0	0	0	112.7	Q121 K122 V123 L128 Q129	Q121-A125 WeakPolarHBondContact O-CB 3.27Å; Q121-A125 PolarHBondContact O-N 3.32Å; K122-A125 PolarHBondContact O-N 3.38Å; V123-A125 VanDerWaalsContact C-N 3.28Å; V123-A125 PolarHBondContact O-N 2.87Å; A125-L128 WeakPolarHBondContact O-CB 3.38Å; A125-L128 PolarHBondContact O-N 2.9Å; A125-Q129 WeakPolarHBondContact O-CG 3.37Å; A125-Q129 PolarHBondContact O-N 3.06Å
126	Y	93	Very high	93	Very high	167 Å²	167	102.7 Å²	102.7	66%	0.655	51%	0.511	S	S	*	.	H	α-helix	trans	-66.4	-39.4	174.6	-83.7	-67.7	0	0	0	112.2	K122 V123 L128 Q129 L130	K122-Y126 VanDerWaalsContact O-CD2 3.27Å; K122-Y126 WeakPolarHBondContact O-CD2 3.39Å; K122-Y126 PolarHBondContact O-N 3.21Å; V123-Y126 PolarHBondContact O-N 3.29Å; Y126-L128 VanDerWaalsContact C-N 3.3Å; Y126-L128 PolarHBondContact O-N 3.21Å; Y126-Q129 WeakPolarHBondContact O-CB 3.44Å; Y126-Q129 PolarHBondContact O-N 3.46Å; Y126-L130 PolarHBondContact O-N 3.35Å
127	H	92.3	Very high	92.9	Very high	99 Å²	99	102.3 Å²	102.3	46%	0.458	51%	0.508	S	S	.	.	H	α-helix	trans	-63.8	-37.8	175.3	-175.6	-96.8	0	0	0	111	V123 D124 L130 Q131	V123-H127 WeakPolarHBondContact O-CB 3.47Å; V123-H127 PolarHBondContact O-N 2.95Å; D124-H127 PolarHBondContact O-N 3.23Å; H127-L130 PolarHBondContact O-N 3.45Å; H127-Q131 PolarHBondContact CE1-NE2 3.23Å; H127-Q131 PolarHBondContact NE2-NE2 3.03Å; H127-Q131 VanDerWaalsContact O-CG 3.31Å; H127-Q131 WeakPolarHBondContact O-CG 3.5Å; H127-Q131 PolarHBondContact O-N 3.1Å
128	L	94.4	Very high	92.8	Very high	106 Å²	106	101.5 Å²	101.5	56%	0.555	51%	0.505	S	S	*	.	H	α-helix	trans	-62.9	-42.7	172.8	-176.5	64.1	0	0	0	111.9	D124 A125 Y126 L130 Q131 N132	D124-L128 WeakPolarHBondContact O-CB 3.31Å; D124-L128 PolarHBondContact O-N 3.28Å; A125-L128 WeakPolarHBondContact O-CB 3.38Å; A125-L128 PolarHBondContact O-N 2.9Å; Y126-L128 VanDerWaalsContact C-N 3.3Å; Y126-L128 PolarHBondContact O-N 3.21Å; L128-L130 VanDerWaalsContact C-N 3.33Å; L128-L130 PolarHBondContact O-N 3.42Å; L128-Q131 PolarHBondContact O-N 3.5Å; L128-N132 VanDerWaalsContact O-CG 3.23Å; L128-N132 PolarHBondContact O-N 3.32Å; L128-N132 PolarHBondContact O-ND2 2.9Å
129	Q	91.9	Very high	92.7	Very high	114 Å²	114	100.6 Å²	100.6	53%	0.533	50%	0.501	S	S	.	.	H	α-helix	trans	-60.3	-42.8	174	-70.3	177.1	0.7	0	0	111.8	A125 Y126 N132 L133	A125-Q129 WeakPolarHBondContact O-CG 3.37Å; A125-Q129 PolarHBondContact O-N 3.06Å; Y126-Q129 WeakPolarHBondContact O-CB 3.44Å; Y126-Q129 PolarHBondContact O-N 3.46Å; Q129-N132 WeakPolarHBondContact O-CB 3.49Å; Q129-N132 PolarHBondContact O-N 2.88Å; Q129-L133 PolarHBondContact O-N 3.37Å; Q129-L133 VanDerWaalsContact O-N 3.1Å
130	L	93.1	Very high	92.5	Very high	90 Å²	90	102 Å²	102	47%	0.471	50%	0.501	S	S	.	.	H	α-helix	trans	-62	-44.1	175.5	178.6	63.5	0	0	0	111.8	Y126 H127 L128 N132 L133 L134	Y126-L130 PolarHBondContact O-N 3.35Å; H127-L130 PolarHBondContact O-N 3.45Å; L128-L130 VanDerWaalsContact C-N 3.33Å; L128-L130 PolarHBondContact O-N 3.42Å; L130-N132 VanDerWaalsContact C-N 3.31Å; L130-N132 PolarHBondContact O-N 2.85Å; L130-L133 PolarHBondContact O-N 3.18Å; L130-L134 HydrophobicContact CD1-CD1 4.48Å; L130-L134 HydrophobicContact CD1-CG 4.32Å; L130-L134 HydrophobicContact CG-CD1 4.18Å; L130-L134 HydrophobicContact CG-CG 4.43Å; L130-L134 WeakPolarHBondContact O-CG 3.49Å; L130-L134 PolarHBondContact O-N 3.43Å
131	Q	92.9	Very high	92.2	Very high	90 Å²	90	102.8 Å²	102.8	42%	0.421	51%	0.506	S	S	.	.	H	α-helix	trans	-62.7	-38.4	177.3	-71.5	-64.2	-23.4	0	0	112.1	H127 L128 L133 L134 Y135	H127-Q131 PolarHBondContact CE1-NE2 3.23Å; H127-Q131 PolarHBondContact NE2-NE2 3.03Å; H127-Q131 VanDerWaalsContact O-CG 3.31Å; H127-Q131 WeakPolarHBondContact O-CG 3.5Å; H127-Q131 PolarHBondContact O-N 3.1Å; L128-Q131 PolarHBondContact O-N 3.5Å; Q131-L133 PolarHBondContact O-N 2.92Å; Q131-L134 PolarHBondContact O-N 2.97Å; Q131-Y135 WeakPolarHBondContact O-CB 3.28Å; Q131-Y135 PolarHBondContact O-N 3.39Å
132	N	92.5	Very high	92	Very high	97 Å²	97	103 Å²	103	52%	0.519	51%	0.505	S	S	.	.	H	α-helix	trans	-60.6	-44.8	173.8	-67.1	-21.3	0	0	0	111.5	L128 Q129 L130 Y135 E136	L128-N132 VanDerWaalsContact O-CG 3.23Å; L128-N132 PolarHBondContact O-N 3.32Å; L128-N132 PolarHBondContact O-ND2 2.9Å; Q129-N132 WeakPolarHBondContact O-CB 3.49Å; Q129-N132 PolarHBondContact O-N 2.88Å; L130-N132 VanDerWaalsContact C-N 3.31Å; L130-N132 PolarHBondContact O-N 2.85Å; N132-Y135 WeakPolarHBondContact O-CB 3.5Å; N132-Y135 PolarHBondContact O-N 2.91Å; N132-E136 PolarHBondContact O-N 3.31Å
133	L	92.7	Very high	91.8	Very high	100 Å²	100	101 Å²	101	52%	0.524	50%	0.498	S	S	.	.	H	α-helix	trans	-67.5	-40.9	177.7	-68.9	173.6	0	0	0	112.6	Q129 L130 Q131 Y135 E136 V137	Q129-L133 PolarHBondContact O-N 3.37Å; Q129-L133 VanDerWaalsContact O-N 3.1Å; L130-L133 PolarHBondContact O-N 3.18Å; Q131-L133 PolarHBondContact O-N 2.92Å; L133-Y135 VanDerWaalsContact C-N 3.27Å; L133-Y135 PolarHBondContact O-N 3.38Å; L133-E136 WeakPolarHBondContact O-CB 3.49Å; L133-E136 PolarHBondContact O-N 2.94Å; L133-V137 WeakPolarHBondContact O-CG2 3.27Å; L133-V137 PolarHBondContact O-N 2.99Å
134	L	92.1	Very high	91.4	Very high	89 Å²	89	101.3 Å²	101.3	47%	0.466	50%	0.495	S	S	.	.	H	α-helix	trans	-63.2	-37.8	175.9	-73	176.7	0	0	0	111.6	L130 Q131 M138	L130-L134 HydrophobicContact CD1-CD1 4.48Å; L130-L134 HydrophobicContact CD1-CG 4.32Å; L130-L134 HydrophobicContact CG-CD1 4.18Å; L130-L134 HydrophobicContact CG-CG 4.43Å; L130-L134 WeakPolarHBondContact O-CG 3.49Å; L130-L134 PolarHBondContact O-N 3.43Å; Q131-L134 PolarHBondContact O-N 2.97Å; L134-M138 VanDerWaalsContact O-CB 3.28Å; L134-M138 WeakPolarHBondContact O-CB 3.43Å; L134-M138 PolarHBondContact O-N 2.85Å
135	Y	93.8	Very high	91	Very high	151 Å²	151	100.2 Å²	100.2	59%	0.592	49%	0.492	S	S	*	.	H	α-helix	trans	-63.6	-43.7	172.6	-178.3	-94	0	0	0	111.6	Q131 N132 L133 M138 H139	Q131-Y135 WeakPolarHBondContact O-CB 3.28Å; Q131-Y135 PolarHBondContact O-N 3.39Å; N132-Y135 WeakPolarHBondContact O-CB 3.5Å; N132-Y135 PolarHBondContact O-N 2.91Å; L133-Y135 VanDerWaalsContact C-N 3.27Å; L133-Y135 PolarHBondContact O-N 3.38Å; Y135-M138 HydrophobicContact CD2-CE 3.89Å; Y135-M138 HydrophobicContact CE2-CE 4.09Å; Y135-M138 PolarHBondContact O-N 3.41Å; Y135-H139 VanDerWaalsContact O-CB 3.31Å; Y135-H139 WeakPolarHBondContact O-CB 3.31Å; Y135-H139 PolarHBondContact O-N 3.42Å
136	E	92.4	Very high	90.6	Very high	108 Å²	108	105.3 Å²	105.3	51%	0.505	51%	0.505	S	S	.	.	H	α-helix	trans	-62	-47.1	176.6	-173.7	174.8	-173.9	0	0	111.8	N132 L133 M138 H139 L140	N132-E136 PolarHBondContact O-N 3.31Å; L133-E136 WeakPolarHBondContact O-CB 3.49Å; L133-E136 PolarHBondContact O-N 2.94Å; E136-M138 PolarHBondContact O-N 3.38Å; E136-H139 PolarHBondContact O-N 3.07Å; E136-L140 HydrophobicContact CG-CD1 4.06Å; E136-L140 HydrophobicContact CG-CG 4.43Å; E136-L140 WeakPolarHBondContact O-CB 3.33Å; E136-L140 VanDerWaalsContact O-CG 3.31Å; E136-L140 WeakPolarHBondContact O-CG 3.4Å; E136-L140 PolarHBondContact O-N 2.82Å
137	V	90.8	Very high	90	Very high	85 Å²	85	101.4 Å²	101.4	52%	0.515	50%	0.501	S	S	.	.	H	α-helix	trans	-59.6	-46.2	175.4	171.3	0	0	0	0	110.9	L133 H139 L140 Q141	L133-V137 WeakPolarHBondContact O-CG2 3.27Å; L133-V137 PolarHBondContact O-N 2.99Å; V137-H139 VanDerWaalsContact C-N 3.32Å; V137-H139 PolarHBondContact O-N 3.46Å; V137-L140 PolarHBondContact O-N 3.45Å; V137-Q141 VanDerWaalsContact O-CB 3.27Å; V137-Q141 WeakPolarHBondContact O-CB 3.29Å; V137-Q141 PolarHBondContact O-N 3.44Å
138	M	90.3	Very high	89.3	Confident	77 Å²	77	103.4 Å²	103.4	38%	0.379	51%	0.514	S	S	.	.	H	α-helix	trans	-63.6	-39.8	177.6	-175.1	-167.7	59.4	0	0	111.4	L134 Y135 E136 K142	L134-M138 VanDerWaalsContact O-CB 3.28Å; L134-M138 WeakPolarHBondContact O-CB 3.43Å; L134-M138 PolarHBondContact O-N 2.85Å; Y135-M138 HydrophobicContact CD2-CE 3.89Å; Y135-M138 HydrophobicContact CE2-CE 4.09Å; Y135-M138 PolarHBondContact O-N 3.41Å; E136-M138 PolarHBondContact O-N 3.38Å; M138-K142 HydrophobicContact CG-CD 4.26Å; M138-K142 WeakPolarHBondContact O-CB 3.35Å; M138-K142 VanDerWaalsContact O-CG 3.29Å; M138-K142 WeakPolarHBondContact O-CG 3.31Å; M138-K142 PolarHBondContact O-N 3.22Å
139	H	90.5	Very high	88.5	Confident	92 Å²	92	105.1 Å²	105.1	43%	0.426	52%	0.519	S	S	.	.	H	α-helix	trans	-63.7	-51.3	176.7	-178.2	-79.6	0	0	0	110.8	Y135 E136 V137 Q141 K142 E143	Y135-H139 VanDerWaalsContact O-CB 3.31Å; Y135-H139 WeakPolarHBondContact O-CB 3.31Å; Y135-H139 PolarHBondContact O-N 3.42Å; E136-H139 PolarHBondContact O-N 3.07Å; V137-H139 VanDerWaalsContact C-N 3.32Å; V137-H139 PolarHBondContact O-N 3.46Å; H139-Q141 VanDerWaalsContact C-N 3.32Å; H139-Q141 PolarHBondContact O-N 3.49Å; H139-K142 PolarHBondContact O-N 2.8Å; H139-E143 IonicContact CE1-OE2 3.57Å; H139-E143 PolarHBondContact CE1-OE2 2.78Å; H139-E143 VanDerWaalsContact CE1-OE2 3.26Å; H139-E143 IonicContact ND1-OE2 3.94Å; H139-E143 PolarHBondContact ND1-OE2 3.19Å; H139-E143 VanDerWaalsContact O-CB 3.3Å; H139-E143 WeakPolarHBondContact O-CB 3.33Å; H139-E143 PolarHBondContact O-N 3.1Å
140	L	89.1	Confident	87.7	Confident	82 Å²	82	107.1 Å²	107.1	43%	0.429	53%	0.527	S	S	.	.	H	α-helix	trans	-61.5	-40.1	178.6	-70.2	174	0	0	0	111.8	E136 V137 E143 I144	E136-L140 HydrophobicContact CG-CD1 4.06Å; E136-L140 HydrophobicContact CG-CG 4.43Å; E136-L140 WeakPolarHBondContact O-CB 3.33Å; E136-L140 VanDerWaalsContact O-CG 3.31Å; E136-L140 WeakPolarHBondContact O-CG 3.4Å; E136-L140 PolarHBondContact O-N 2.82Å; V137-L140 PolarHBondContact O-N 3.45Å; L140-E143 PolarHBondContact O-N 3.19Å; L140-I144 WeakPolarHBondContact O-CB 3.46Å; L140-I144 VanDerWaalsContact O-CG1 3.29Å; L140-I144 WeakPolarHBondContact O-CG1 3.36Å; L140-I144 PolarHBondContact O-N 3.29Å
141	Q	87.9	Confident	86.3	Confident	126 Å²	126	110.6 Å²	110.6	59%	0.589	54%	0.538	S	S	*	.	H	α-helix	trans	-65.7	-43.3	176.3	-172	175	-0.3	0	0	111.5	V137 H139 E143 I144 T145	V137-Q141 VanDerWaalsContact O-CB 3.27Å; V137-Q141 WeakPolarHBondContact O-CB 3.29Å; V137-Q141 PolarHBondContact O-N 3.44Å; H139-Q141 VanDerWaalsContact C-N 3.32Å; H139-Q141 PolarHBondContact O-N 3.49Å; Q141-E143 VanDerWaalsContact C-N 3.28Å; Q141-E143 PolarHBondContact O-N 3.12Å; Q141-I144 PolarHBondContact O-N 3.19Å; Q141-T145 PolarHBondContact O-N 2.94Å; Q141-T145 PolarHBondContact O-OG1 2.96Å; Q141-T145 VanDerWaalsContact O-OG1 3.07Å
142	K	88	Confident	85.1	Confident	126 Å²	126	108.3 Å²	108.3	55%	0.548	53%	0.532	S	S	.	.	H	α-helix	trans	-62.3	-37.3	173.2	-78.5	176.1	178.3	174.8	0	112	M138 H139 T145 K146	M138-K142 HydrophobicContact CG-CD 4.26Å; M138-K142 WeakPolarHBondContact O-CB 3.35Å; M138-K142 VanDerWaalsContact O-CG 3.29Å; M138-K142 WeakPolarHBondContact O-CG 3.31Å; M138-K142 PolarHBondContact O-N 3.22Å; H139-K142 PolarHBondContact O-N 2.8Å; K142-T145 WeakPolarHBondContact CA-OG1 3.47Å; K142-T145 PolarHBondContact O-OG1 3.42Å; K142-K146 WeakPolarHBondContact O-CB 3.23Å; K142-K146 PolarHBondContact O-N 2.93Å
143	E	88.8	Confident	83.8	Confident	91 Å²	91	111.9 Å²	111.9	43%	0.425	54%	0.543	S	S	.	.	H	α-helix	trans	-69.2	-43.3	178	-169.8	167	-162.8	0	0	110.9	H139 L140 Q141 K146 C147	H139-E143 IonicContact CE1-OE2 3.57Å; H139-E143 PolarHBondContact CE1-OE2 2.78Å; H139-E143 VanDerWaalsContact CE1-OE2 3.26Å; H139-E143 IonicContact ND1-OE2 3.94Å; H139-E143 PolarHBondContact ND1-OE2 3.19Å; H139-E143 VanDerWaalsContact O-CB 3.3Å; H139-E143 WeakPolarHBondContact O-CB 3.33Å; H139-E143 PolarHBondContact O-N 3.1Å; L140-E143 PolarHBondContact O-N 3.19Å; Q141-E143 VanDerWaalsContact C-N 3.28Å; Q141-E143 PolarHBondContact O-N 3.12Å; E143-K146 CarbonylContact O-C 3.57Å; E143-K146 WeakPolarHBondContact O-CB 3.44Å; E143-K146 PolarHBondContact O-N 3.38Å; E143-C147 WeakPolarHBondContact O-CB 3.29Å; E143-C147 PolarHBondContact O-N 2.81Å; E143-C147 PolarHBondContact O-SG 2.8Å
144	I	85.7	Confident	82.5	Confident	102 Å²	102	110.1 Å²	110.1	52%	0.523	53%	0.532	S	S	.	.	H	α-helix	trans	-62.4	-48	173.7	-71.4	168.2	0	0	0	111	L140 Q141 K146 C147 L148	L140-I144 WeakPolarHBondContact O-CB 3.46Å; L140-I144 VanDerWaalsContact O-CG1 3.29Å; L140-I144 WeakPolarHBondContact O-CG1 3.36Å; L140-I144 PolarHBondContact O-N 3.29Å; Q141-I144 PolarHBondContact O-N 3.19Å; I144-K146 VanDerWaalsContact C-N 3.27Å; I144-K146 PolarHBondContact O-N 3.26Å; I144-C147 CarbonylContact O-C 3.57Å; I144-C147 PolarHBondContact O-N 3.4Å; I144-C147 VanDerWaalsContact O-N 3.1Å; I144-L148 HydrophobicContact CG2-CD1 3.71Å; I144-L148 HydrophobicContact CG2-CG 4.22Å; I144-L148 WeakPolarHBondContact O-CB 3.15Å; I144-L148 WeakPolarHBondContact O-CG 3.3Å; I144-L148 PolarHBondContact O-N 3.27Å
145	T	85.7	Confident	81.2	Confident	64 Å²	64	112.3 Å²	112.3	39%	0.393	54%	0.54	S	S	.	.	H	α-helix	trans	-60.6	-41.5	176.8	48.1	0	0	0	0	110.9	Q141 K142 C147 L148 E149	Q141-T145 PolarHBondContact O-N 2.94Å; Q141-T145 PolarHBondContact O-OG1 2.96Å; Q141-T145 VanDerWaalsContact O-OG1 3.07Å; K142-T145 WeakPolarHBondContact CA-OG1 3.47Å; K142-T145 PolarHBondContact O-OG1 3.42Å; T145-C147 VanDerWaalsContact C-N 3.32Å; T145-C147 PolarHBondContact O-N 2.85Å; T145-L148 PolarHBondContact O-N 3.32Å; T145-E149 WeakPolarHBondContact O-CB 3.38Å; T145-E149 VanDerWaalsContact O-CG 3.23Å; T145-E149 WeakPolarHBondContact O-CG 3.23Å; T145-E149 PolarHBondContact O-N 3.4Å
146	K	84.1	Confident	79.7	Confident	155 Å²	155	113.1 Å²	113.1	67%	0.674	55%	0.549	S	S	*	.	H	α-helix	trans	-63	-37.5	174.5	-178	-177.3	177.5	-174.5	0	112.4	K142 E143 I144	K142-K146 WeakPolarHBondContact O-CB 3.23Å; K142-K146 PolarHBondContact O-N 2.93Å; E143-K146 CarbonylContact O-C 3.57Å; E143-K146 WeakPolarHBondContact O-CB 3.44Å; E143-K146 PolarHBondContact O-N 3.38Å; I144-K146 VanDerWaalsContact C-N 3.27Å; I144-K146 PolarHBondContact O-N 3.26Å
147	C	80.7	Confident	78.5	Confident	85 Å²	85	110.9 Å²	110.9	57%	0.574	54%	0.54	S	S	*	.	H	α-helix	trans	-71.2	-34.1	176	-73.1	0	0	0	0	112.3	E143 I144 T145 F150	E143-C147 WeakPolarHBondContact O-CB 3.29Å; E143-C147 PolarHBondContact O-N 2.81Å; E143-C147 PolarHBondContact O-SG 2.8Å; I144-C147 CarbonylContact O-C 3.57Å; I144-C147 PolarHBondContact O-N 3.4Å; I144-C147 VanDerWaalsContact O-N 3.1Å; T145-C147 VanDerWaalsContact C-N 3.32Å; T145-C147 PolarHBondContact O-N 2.85Å; C147-F150 VanDerWaalsContact O-CB 3.23Å; C147-F150 WeakPolarHBondContact O-CB 3.4Å; C147-F150 PolarHBondContact O-N 2.79Å
148	L	77.8	Confident	77.4	Confident	141 Å²	141	114.4 Å²	114.4	74%	0.738	56%	0.556	S	S	*	*	H	α-helix	trans	-80.1	-22	177	-69.3	173.7	0	0	0	113.1	I144 T145 F150	I144-L148 HydrophobicContact CG2-CD1 3.71Å; I144-L148 HydrophobicContact CG2-CG 4.22Å; I144-L148 WeakPolarHBondContact O-CB 3.15Å; I144-L148 WeakPolarHBondContact O-CG 3.3Å; I144-L148 PolarHBondContact O-N 3.27Å; T145-L148 PolarHBondContact O-N 3.32Å; L148-F150 PolarHBondContact O-N 3.24Å
149	E	78	Confident	76.3	Confident	142 Å²	142	113.7 Å²	113.7	66%	0.664	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.1	-3.4	169.4	-76.9	169.2	-166.9	0	0	112.7	T145 K151	T145-E149 WeakPolarHBondContact O-CB 3.38Å; T145-E149 VanDerWaalsContact O-CG 3.23Å; T145-E149 WeakPolarHBondContact O-CG 3.23Å; T145-E149 PolarHBondContact O-N 3.4Å; E149-K151 PolarHBondContact O-N 2.89Å
150	F	74.3	Confident	75.5	Confident	156 Å²	156	111.6 Å²	111.6	68%	0.684	55%	0.547	S	S	*	.			trans	-66.2	98.1	173.4	-179.2	-103.8	0	0	0	110.1	C147 L148	C147-F150 VanDerWaalsContact O-CB 3.23Å; C147-F150 WeakPolarHBondContact O-CB 3.4Å; C147-F150 PolarHBondContact O-N 2.79Å; L148-F150 PolarHBondContact O-N 3.24Å
151	K	64.2	Low	75.1	Confident	163 Å²	163	110.2 Å²	110.2	71%	0.709	54%	0.544	S	S	*	.			trans	-89.3	114.8	166	-63.5	-173.7	179.6	-172.8	0	108.2	E149	E149-K151 PolarHBondContact O-N 2.89Å
152	S	67.1	Low	74.5	Confident	42 Å²	42	108.2 Å²	108.2	29%	0.294	54%	0.537	S	S	.	.			trans	-80.1	135.9	173.4	173.4	0	0	0	0	109	H154 E155	S152-H154 VanDerWaalsContact CB-CE1 3.45Å; S152-H154 WeakPolarHBondContact CB-CE1 3.11Å; S152-H154 WeakPolarHBondContact CB-ND1 3.45Å; S152-H154 PolarHBondContact O-N 3.36Å; S152-H154 PolarHBondContact O-ND1 2.91Å; S152-H154 PolarHBondContact OG-ND1 3.48Å; S152-E155 PolarHBondContact O-N 3.41Å; S152-E155 VanDerWaalsContact O-N 3.11Å
153	K	65.8	Low	74	Confident	173 Å²	173	108.9 Å²	108.9	75%	0.752	54%	0.542	S	S	*	.	G	3₁₀ helix	trans	-57.1	-16.9	-174.4	-65.9	-174.7	176.5	-175	0	114.8	E155 E156	K153-E155 PolarHBondContact O-N 3.03Å; K153-E156 PolarHBondContact O-N 3.28Å
154	H	65.2	Low	73.5	Confident	62 Å²	62	109.4 Å²	109.4	29%	0.287	54%	0.544	S	S	.	.	G	3₁₀ helix	trans	-65	-21.7	176.5	75.2	-57.1	0	0	0	114.2	S152 E156 I157 L191	S152-H154 VanDerWaalsContact CB-CE1 3.45Å; S152-H154 WeakPolarHBondContact CB-CE1 3.11Å; S152-H154 WeakPolarHBondContact CB-ND1 3.45Å; S152-H154 PolarHBondContact O-N 3.36Å; S152-H154 PolarHBondContact O-ND1 2.91Å; S152-H154 PolarHBondContact OG-ND1 3.48Å; H154-E156 VanDerWaalsContact C-N 3.25Å; H154-E156 PolarHBondContact O-N 3.11Å; H154-I157 PolarHBondContact O-N 3.35Å; H154-L191 HydrophobicContact CB-CD1 3.89Å; H154-L191 HydrophobicContact CB-CD2 4.33Å
155	E	64.8	Low	73.4	Confident	136 Å²	136	104.5 Å²	104.5	64%	0.636	52%	0.519	S	S	*	.	G	3₁₀ helix	trans	-71.5	-18.7	177.5	-68.2	178.5	-174.7	0	0	113.3	S152 K153	S152-E155 PolarHBondContact O-N 3.41Å; S152-E155 VanDerWaalsContact O-N 3.11Å; K153-E155 PolarHBondContact O-N 3.03Å
156	E	63	Low	73.1	Confident	167 Å²	167	104.1 Å²	104.1	78%	0.78	51%	0.511	S	S	*	.	G	3₁₀ helix	trans	-95.7	0.8	179.1	-64.5	178.6	173	0	0	112.8	K153 H154	K153-E156 PolarHBondContact O-N 3.28Å; H154-E156 VanDerWaalsContact C-N 3.25Å; H154-E156 PolarHBondContact O-N 3.11Å
157	I	67.6	Low	73	Confident	62 Å²	62	104.6 Å²	104.6	32%	0.318	51%	0.513	S	S	.	.	S	Bend	trans	-100.8	121.2	-175.7	-57.9	176	0	0	0	108.9	H154 L159	H154-I157 PolarHBondContact O-N 3.35Å; I157-L159 PolarHBondContact O-N 3.25Å
158	D	66.1	Low	73	Confident	159 Å²	159	106.5 Å²	106.5	85%	0.85	51%	0.514	S	S	*	.			trans	-66.5	112.9	170	-64.9	-36.5	0	0	0	109.1
159	L	68.4	Low	73.1	Confident	61 Å²	61	100.2 Å²	100.2	32%	0.319	48%	0.482	S	S	.	.	P	Polyproline II helix	trans	-89	147.4	-177.1	-69.1	163.5	0	0	0	111.4	I157 R190 L191 E194	I157-L159 PolarHBondContact O-N 3.25Å; L159-R190 HydrophobicContact CD2-CB 4.45Å; L159-L191 HydrophobicContact CD2-CD2 3.82Å; L159-L191 HydrophobicContact CD2-CG 4.3Å; L159-E194 VanDerWaalsContact CA-OE1 3.26Å; L159-E194 WeakPolarHBondContact CA-OE1 3.42Å; L159-E194 WeakPolarHBondContact CD2-OE1 3.5Å
160	V	72.8	Confident	73.3	Confident	48 Å²	48	95.4 Å²	95.4	29%	0.291	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-55.4	142.5	170.5	179.6	0	0	0	0	110.7	E164 E194	V160-E164 HydrophobicContact CG1-CB 3.76Å; V160-E194 HydrophobicContact CG2-CG 4.02Å; V160-E194 PolarHBondContact N-OE1 3.14Å
161	S	80.6	Confident	73.4	Confident	53 Å²	53	92.9 Å²	92.9	37%	0.371	46%	0.462	S	S	.	.	P	Polyproline II helix	trans	-59	149.4	-179	73.6	0	0	0	0	111.4	E163 E164 F165	S161-E163 PolarHBondContact O-N 3.08Å; S161-E164 PolarHBondContact O-N 3.04Å; S161-E164 WeakPolarHBondContact OG-CB 3.45Å; S161-E164 VanDerWaalsContact OG-CG 3.22Å; S161-E164 WeakPolarHBondContact OG-CG 3.49Å; S161-E164 PolarHBondContact OG-N 3.4Å; S161-E164 PolarHBondContact OG-OE2 3.18Å; S161-F165 WeakPolarHBondContact O-CB 3.46Å; S161-F165 PolarHBondContact O-N 2.96Å
162	L	75.8	Confident	74.1	Confident	84 Å²	84	91.5 Å²	91.5	44%	0.44	46%	0.462	S	S	.	.	H	α-helix	trans	-54	-42.2	-180	-100.8	94	0	0	0	112	F165 Y166 R190	L162-F165 PolarHBondContact O-N 3.1Å; L162-Y166 HydrophobicContact CD2-CE2 4.41Å; L162-Y166 VanDerWaalsContact O-CD2 3.3Å; L162-Y166 WeakPolarHBondContact O-CD2 3.22Å; L162-Y166 PolarHBondContact O-N 3.26Å; L162-Y166 VanDerWaalsContact O-N 3.11Å; L162-R190 VanDerWaalsContact CD1-CZ 3.42Å; L162-R190 VanDerWaalsContact CD1-NH1 3.34Å
163	E	77.3	Confident	74.6	Confident	140 Å²	140	91 Å²	91	65%	0.654	46%	0.456	S	S	*	.	H	α-helix	trans	-69.8	-39.9	-172.3	-61.1	-175.1	-170	0	0	111.7	S161 K167	S161-E163 PolarHBondContact O-N 3.08Å; E163-K167 WeakPolarHBondContact O-CB 3.43Å; E163-K167 WeakPolarHBondContact O-CD 3.45Å; E163-K167 WeakPolarHBondContact O-CG 3.3Å; E163-K167 PolarHBondContact O-N 3.32Å
164	E	79.1	Confident	75	Confident	102 Å²	102	83.4 Å²	83.4	48%	0.477	43%	0.425	S	S	.	.	H	α-helix	trans	-70.7	-40.4	176.2	-69.3	163.3	163.7	0	0	110.8	V160 S161 Y166 K167 E168	V160-E164 HydrophobicContact CG1-CB 3.76Å; S161-E164 PolarHBondContact O-N 3.04Å; S161-E164 WeakPolarHBondContact OG-CB 3.45Å; S161-E164 VanDerWaalsContact OG-CG 3.22Å; S161-E164 WeakPolarHBondContact OG-CG 3.49Å; S161-E164 PolarHBondContact OG-N 3.4Å; S161-E164 PolarHBondContact OG-OE2 3.18Å; E164-Y166 PolarHBondContact O-N 3.4Å; E164-K167 PolarHBondContact O-N 3.36Å; E164-E168 WeakPolarHBondContact O-CB 3.43Å; E164-E168 PolarHBondContact O-N 2.8Å
165	F	82.6	Confident	75.5	Confident	0 Å²	0	86.8 Å²	86.8	0%	0	44%	0.439	C	S	.	.	H	α-helix	trans	-58.1	-50.3	176.6	171.7	-107	0	0	0	112.3	S161 L162 K167 A169 A189 R190 W193	S161-F165 WeakPolarHBondContact O-CB 3.46Å; S161-F165 PolarHBondContact O-N 2.96Å; L162-F165 PolarHBondContact O-N 3.1Å; F165-K167 VanDerWaalsContact C-N 3.3Å; F165-K167 PolarHBondContact O-N 3.45Å; F165-A169 HydrophobicContact CD2-CB 3.95Å; F165-A169 HydrophobicContact CE2-CB 3.84Å; F165-A169 HydrophobicContact CZ-CB 4.44Å; F165-A169 WeakPolarHBondContact O-CB 3.48Å; F165-A169 PolarHBondContact O-N 3.41Å; F165-A189 HydrophobicContact CZ-CB 3.89Å; F165-R190 HydrophobicContact CB-CG 4.46Å; F165-R190 HydrophobicContact CD1-CG 3.86Å; F165-R190 HydrophobicContact CD2-CB 4.48Å; F165-R190 HydrophobicContact CD2-CG 3.8Å; F165-R190 HydrophobicContact CE1-CG 3.98Å; F165-R190 HydrophobicContact CE2-CB 4.43Å; F165-R190 HydrophobicContact CE2-CG 3.93Å; F165-R190 HydrophobicContact CG-CG 3.76Å; F165-R190 HydrophobicContact CZ-CG 4.01Å; F165-W193 HydrophobicContact CD2-CB 4.09Å; F165-W193 AromaticContact CD2-CD1 3.69Å; F165-W193 HydrophobicContact CD2-CG 4.02Å; F165-W193 HydrophobicContact CE2-CB 3.66Å; F165-W193 HydrophobicContact CE2-CG 4.01Å
166	Y	80.8	Confident	75.6	Confident	56 Å²	56	82.6 Å²	82.6	22%	0.22	43%	0.427	C	S	.	.	H	α-helix	trans	-73.3	-19.4	-178.9	-78.7	-73.6	0	0	0	113.9	L162 E164 A176 T179 M180 Q186	L162-Y166 HydrophobicContact CD2-CE2 4.41Å; L162-Y166 VanDerWaalsContact O-CD2 3.3Å; L162-Y166 WeakPolarHBondContact O-CD2 3.22Å; L162-Y166 PolarHBondContact O-N 3.26Å; L162-Y166 VanDerWaalsContact O-N 3.11Å; E164-Y166 PolarHBondContact O-N 3.4Å; Y166-A176 HydrophobicContact CE1-CB 4.19Å; Y166-T179 WeakPolarHBondContact OH-CB 3.37Å; Y166-T179 PolarHBondContact OH-OG1 2.83Å; Y166-M180 HydrophobicContact CE2-SD 4.16Å; Y166-Q186 PolarHBondContact OH-NE2 3.5Å
167	K	81.8	Confident	76	Confident	164 Å²	164	83.8 Å²	83.8	71%	0.713	43%	0.433	S	S	*	.	H	α-helix	trans	-83.3	-39	175.9	-75.2	172.1	-174.1	168.6	0	112.8	E163 E164 F165	E163-K167 WeakPolarHBondContact O-CB 3.43Å; E163-K167 WeakPolarHBondContact O-CD 3.45Å; E163-K167 WeakPolarHBondContact O-CG 3.3Å; E163-K167 PolarHBondContact O-N 3.32Å; E164-K167 PolarHBondContact O-N 3.36Å; F165-K167 VanDerWaalsContact C-N 3.3Å; F165-K167 PolarHBondContact O-N 3.45Å
168	E	79.8	Confident	76	Confident	126 Å²	126	84.4 Å²	84.4	59%	0.589	44%	0.439	S	S	*	.	H	α-helix	trans	-102.2	-24.1	-170.4	-62.3	-173.2	173.5	0	0	114	E164 W193	E164-E168 WeakPolarHBondContact O-CB 3.43Å; E164-E168 PolarHBondContact O-N 2.8Å; E168-W193 HydrophobicContact CB-CZ2 4.24Å; E168-W193 WeakPolarHBondContact O-CH2 3.39Å; E168-W193 WeakPolarHBondContact O-CZ2 3.38Å
169	A	80.8	Confident	76.2	Confident	9 Å²	9	77 Å²	77	7%	0.074	40%	0.4	C	S	.	.	S	Bend	trans	-74.7	131.3	-178.3	0	0	0	0	0	111.4	F165 W193	F165-A169 HydrophobicContact CD2-CB 3.95Å; F165-A169 HydrophobicContact CE2-CB 3.84Å; F165-A169 HydrophobicContact CZ-CB 4.44Å; F165-A169 WeakPolarHBondContact O-CB 3.48Å; F165-A169 PolarHBondContact O-N 3.41Å; A169-W193 HydrophobicContact CB-CD2 3.87Å; A169-W193 HydrophobicContact CB-CE3 4.25Å; A169-W193 HydrophobicContact CB-CG 4.14Å; A169-W193 HydrophobicContact CB-CZ2 4.38Å
170	P	82.4	Confident	76.2	Confident	41 Å²	41	80.6 Å²	80.6	27%	0.266	42%	0.417	S	S	.	.			trans	-53.6	147.9	172.6	-26.5	33.5	0	0	0	112.1	D172 I173 S174 W193	P170-D172 PolarHBondContact O-N 3.01Å; P170-D172 VanDerWaalsContact O-N 3.1Å; P170-I173 PolarHBondContact O-N 3.02Å; P170-S174 PolarHBondContact O-N 2.78Å; P170-S174 PolarHBondContact O-OG 3.11Å; P170-W193 HydrophobicContact CG-CH2 4.21Å; P170-W193 HydrophobicContact CG-CZ3 3.82Å
171	P	76.6	Confident	76.2	Confident	103 Å²	103	81.8 Å²	81.8	67%	0.669	44%	0.438	S	S	*	.	H	α-helix	trans	-59.2	-26.6	-178.5	23.5	-33.3	0	0	0	113.2	I173 S174 K175	P171-I173 VanDerWaalsContact C-N 3.28Å; P171-I173 PolarHBondContact O-N 3.01Å; P171-S174 WeakPolarHBondContact CA-OG 3.39Å; P171-K175 PolarHBondContact O-N 3.33Å
172	D	78.9	Confident	76.3	Confident	133 Å²	133	81.9 Å²	81.9	71%	0.711	44%	0.435	S	S	*	.	H	α-helix	trans	-65.3	-28.5	176.7	-64.9	-29	0	0	0	113.5	P170 K175	P170-D172 PolarHBondContact O-N 3.01Å; P170-D172 VanDerWaalsContact O-N 3.1Å; D172-K175 WeakPolarHBondContact O-CE 3.38Å
173	I	76.8	Confident	76.6	Confident	32 Å²	32	82.2 Å²	82.2	16%	0.164	44%	0.442	C	S	.	.	H	α-helix	trans	-102.4	-39.5	-179.2	-60.8	174.9	0	0	0	110.8	P170 P171 K175 W193	P170-I173 PolarHBondContact O-N 3.02Å; P171-I173 VanDerWaalsContact C-N 3.28Å; P171-I173 PolarHBondContact O-N 3.01Å; I173-K175 PolarHBondContact O-N 3.35Å; I173-W193 HydrophobicContact CD1-CE3 3.96Å; I173-W193 HydrophobicContact CD1-CZ3 4.43Å; I173-W193 HydrophobicContact CG2-CB 4.01Å
174	S	73.6	Confident	76.8	Confident	13 Å²	13	81 Å²	81	9%	0.091	44%	0.436	C	S	.	.	H	α-helix	trans	-70.3	-32.6	-175.2	66.9	0	0	0	0	113.7	P170 P171 A176 T179	P170-S174 PolarHBondContact O-N 2.78Å; P170-S174 PolarHBondContact O-OG 3.11Å; P171-S174 WeakPolarHBondContact CA-OG 3.39Å; S174-A176 VanDerWaalsContact C-N 3.28Å; S174-A176 PolarHBondContact O-N 3.43Å; S174-A176 VanDerWaalsContact O-N 3.08Å; S174-T179 WeakPolarHBondContact O-CG2 3.39Å; S174-T179 PolarHBondContact O-OG1 3.48Å
175	K	75.5	Confident	76.9	Confident	134 Å²	134	80 Å²	80	58%	0.583	43%	0.432	S	S	*	.			trans	35	57	174.7	-66.3	-177.9	-178.2	171.9	0	113.3	P171 D172 I173 E177 V178 T179	P171-K175 PolarHBondContact O-N 3.33Å; D172-K175 WeakPolarHBondContact O-CE 3.38Å; I173-K175 PolarHBondContact O-N 3.35Å; K175-E177 PolarHBondContact O-N 3.45Å; K175-V178 PolarHBondContact O-N 3.02Å; K175-T179 PolarHBondContact O-N 3.18Å; K175-T179 VanDerWaalsContact O-N 3.11Å; K175-T179 PolarHBondContact O-OG1 2.97Å
176	A	68.6	Low	76.9	Confident	48 Å²	48	81.5 Å²	81.5	40%	0.397	44%	0.439	S	S	.	.	H	α-helix	trans	-54.8	-28.5	-167.6	0	0	0	0	0	114.7	Y166 S174 V178 T179 M180	Y166-A176 HydrophobicContact CE1-CB 4.19Å; S174-A176 VanDerWaalsContact C-N 3.28Å; S174-A176 PolarHBondContact O-N 3.43Å; S174-A176 VanDerWaalsContact O-N 3.08Å; A176-V178 VanDerWaalsContact C-N 3.33Å; A176-V178 PolarHBondContact O-N 3.22Å; A176-T179 WeakPolarHBondContact CA-OG1 3.33Å; A176-M180 WeakPolarHBondContact O-CB 3.46Å; A176-M180 WeakPolarHBondContact O-CG 3.26Å; A176-M180 PolarHBondContact O-N 3.11Å
177	E	69.9	Low	77	Confident	191 Å²	191	80.7 Å²	80.7	89%	0.893	44%	0.439	S	S	*	.	H	α-helix	trans	-66.7	-30.4	178.9	-63.2	-177.8	176.5	0	0	113.7	K175	K175-E177 PolarHBondContact O-N 3.45Å
178	V	67.8	Low	77.1	Confident	75 Å²	75	76.6 Å²	76.6	46%	0.455	43%	0.425	S	S	.	.	H	α-helix	trans	-104.7	-33.7	-176.3	-161.6	0	0	0	0	111.2	K175 A176 G181	K175-V178 PolarHBondContact O-N 3.02Å; A176-V178 VanDerWaalsContact C-N 3.33Å; A176-V178 PolarHBondContact O-N 3.22Å; V178-G181 PolarHBondContact O-N 3.4Å
179	T	70.9	Confident	77.4	Confident	5 Å²	5	71.1 Å²	71.1	3%	0.031	40%	0.401	C	S	.	.	H	α-helix	trans	-76.2	-22.7	-178.4	52	0	0	0	0	114.1	Y166 S174 K175 A176 G181 Q186 A189	Y166-T179 WeakPolarHBondContact OH-CB 3.37Å; Y166-T179 PolarHBondContact OH-OG1 2.83Å; S174-T179 WeakPolarHBondContact O-CG2 3.39Å; S174-T179 PolarHBondContact O-OG1 3.48Å; K175-T179 PolarHBondContact O-N 3.18Å; K175-T179 VanDerWaalsContact O-N 3.11Å; K175-T179 PolarHBondContact O-OG1 2.97Å; A176-T179 WeakPolarHBondContact CA-OG1 3.33Å; T179-G181 VanDerWaalsContact C-N 3.35Å; T179-Q186 WeakPolarHBondContact O-CB 3.22Å; T179-A189 HydrophobicContact CG2-CB 3.76Å
180	M	69.2	Low	77.5	Confident	136 Å²	136	71.8 Å²	71.8	67%	0.67	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-19.8	175.7	-72.4	-69.2	-127.6	0	0	113.4	Y166 A176	Y166-M180 HydrophobicContact CE2-SD 4.16Å; A176-M180 WeakPolarHBondContact O-CB 3.46Å; A176-M180 WeakPolarHBondContact O-CG 3.26Å; A176-M180 PolarHBondContact O-N 3.11Å
181	G	72.1	Confident	77.6	Confident	72 Å²	72	71.9 Å²	71.9	74%	0.742	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.5	-24.6	-178.3	0	0	0	0	0	114.9	V178 T179	V178-G181 PolarHBondContact O-N 3.4Å; T179-G181 VanDerWaalsContact C-N 3.35Å
182	D	82.9	Confident	78	Confident	56 Å²	56	71.5 Å²	71.5	30%	0.299	39%	0.392	S	S	.	.			trans	-130.1	114.5	-175.7	-177.7	-3.4	0	0	0	111.5	H184 Q185 Q186	D182-H184 PolarHBondContact O-N 2.68Å; D182-H184 WeakPolarHBondContact OD1-CB 3.17Å; D182-H184 PolarHBondContact OD1-N 2.98Å; D182-Q185 HydrophobicContact CB-CB 4.27Å; D182-Q185 HydrophobicContact CB-CG 4.31Å; D182-Q185 PolarHBondContact O-N 2.98Å; D182-Q185 WeakPolarHBondContact OD2-CG 3.34Å; D182-Q185 PolarHBondContact OD2-NE2 3.36Å; D182-Q185 VanDerWaalsContact OD2-NE2 3.14Å; D182-Q186 PolarHBondContact O-N 3.19Å
183	P	80.6	Confident	78.4	Confident	91 Å²	91	65.6 Å²	65.6	59%	0.591	36%	0.36	S	S	*	.	H	α-helix	trans	-63.5	-26.3	-179.1	26.7	-34.5	0	0	0	113.2	T187	P183-T187 WeakPolarHBondContact O-CG2 3.4Å; P183-T187 PolarHBondContact O-N 3.13Å; P183-T187 VanDerWaalsContact O-N 3.1Å; P183-T187 PolarHBondContact O-OG1 3.34Å; P183-T187 VanDerWaalsContact O-OG1 3.08Å
184	H	81.6	Confident	78.7	Confident	115 Å²	115	64.8 Å²	64.8	53%	0.532	36%	0.356	S	S	.	.	H	α-helix	trans	-70.8	-45.7	177.3	-178.1	57.4	0	0	0	111.2	D182 Q186 T187 L188	D182-H184 PolarHBondContact O-N 2.68Å; D182-H184 WeakPolarHBondContact OD1-CB 3.17Å; D182-H184 PolarHBondContact OD1-N 2.98Å; H184-Q186 VanDerWaalsContact C-N 3.27Å; H184-Q186 PolarHBondContact O-N 2.91Å; H184-T187 PolarHBondContact O-N 3.27Å; H184-T187 PolarHBondContact O-OG1 2.81Å; H184-L188 WeakPolarHBondContact O-CG 3.41Å; H184-L188 PolarHBondContact O-N 2.95Å
185	Q	82.4	Confident	79.3	Confident	81 Å²	81	68.2 Å²	68.2	38%	0.379	37%	0.372	S	S	.	.	H	α-helix	trans	-67.8	-31.9	176.4	-67.3	-175.8	44	0	0	112.1	D182 L188 A189	D182-Q185 HydrophobicContact CB-CB 4.27Å; D182-Q185 HydrophobicContact CB-CG 4.31Å; D182-Q185 PolarHBondContact O-N 2.98Å; D182-Q185 WeakPolarHBondContact OD2-CG 3.34Å; D182-Q185 PolarHBondContact OD2-NE2 3.36Å; D182-Q185 VanDerWaalsContact OD2-NE2 3.14Å; Q185-L188 PolarHBondContact O-N 3.01Å; Q185-A189 WeakPolarHBondContact O-CB 3.03Å; Q185-A189 PolarHBondContact O-N 3.08Å
186	Q	83.3	Confident	79.8	Confident	31 Å²	31	65.4 Å²	65.4	15%	0.145	36%	0.361	C	S	.	.	H	α-helix	trans	-60.5	-45	172.5	-159	-178.7	28	0	0	112.5	Y166 T179 D182 H184 R190	Y166-Q186 PolarHBondContact OH-NE2 3.5Å; T179-Q186 WeakPolarHBondContact O-CB 3.22Å; D182-Q186 PolarHBondContact O-N 3.19Å; H184-Q186 VanDerWaalsContact C-N 3.27Å; H184-Q186 PolarHBondContact O-N 2.91Å; Q186-R190 WeakPolarHBondContact O-CG 3.4Å; Q186-R190 PolarHBondContact O-N 3.31Å
187	T	82.1	Confident	80.7	Confident	38 Å²	38	66 Å²	66	23%	0.233	36%	0.356	C	S	.	.	H	α-helix	trans	-70.1	-39	178.8	46.8	0	0	0	0	112	P183 H184 R190 L191	P183-T187 WeakPolarHBondContact O-CG2 3.4Å; P183-T187 PolarHBondContact O-N 3.13Å; P183-T187 VanDerWaalsContact O-N 3.1Å; P183-T187 PolarHBondContact O-OG1 3.34Å; P183-T187 VanDerWaalsContact O-OG1 3.08Å; H184-T187 PolarHBondContact O-N 3.27Å; H184-T187 PolarHBondContact O-OG1 2.81Å; T187-R190 PolarHBondContact O-N 3.4Å; T187-L191 WeakPolarHBondContact O-CG 3.48Å; T187-L191 PolarHBondContact O-N 2.99Å
188	L	84	Confident	81.5	Confident	78 Å²	78	63.9 Å²	63.9	41%	0.408	34%	0.34	S	S	.	.	H	α-helix	trans	-60.4	-46.5	173.2	-70.3	177.3	0	0	0	112.4	H184 Q185 R190 L191 D192	H184-L188 WeakPolarHBondContact O-CG 3.41Å; H184-L188 PolarHBondContact O-N 2.95Å; Q185-L188 PolarHBondContact O-N 3.01Å; L188-R190 VanDerWaalsContact C-N 3.29Å; L188-R190 PolarHBondContact O-N 3.48Å; L188-L191 PolarHBondContact O-N 2.97Å; L188-D192 PolarHBondContact O-N 3.27Å
189	A	84.6	Confident	82.6	Confident	11 Å²	11	66.9 Å²	66.9	9%	0.091	35%	0.346	C	S	.	.	H	α-helix	trans	-63	-35.5	178.9	0	0	0	0	0	112.4	F165 T179 Q185 W193	F165-A189 HydrophobicContact CZ-CB 3.89Å; T179-A189 HydrophobicContact CG2-CB 3.76Å; Q185-A189 WeakPolarHBondContact O-CB 3.03Å; Q185-A189 PolarHBondContact O-N 3.08Å; A189-W193 WeakPolarHBondContact O-CB 3.33Å; A189-W193 PolarHBondContact O-N 3.02Å
190	R	83.8	Confident	83.5	Confident	24 Å²	24	72.2 Å²	72.2	9%	0.091	37%	0.366	C	S	.	.	H	α-helix	trans	-67.3	-43.6	173	-71.6	-172.9	-153.3	162.6	19.7	112.5	L159 L162 F165 Q186 T187 L188 D192 W193 E194	L159-R190 HydrophobicContact CD2-CB 4.45Å; L162-R190 VanDerWaalsContact CD1-CZ 3.42Å; L162-R190 VanDerWaalsContact CD1-NH1 3.34Å; F165-R190 HydrophobicContact CB-CG 4.46Å; F165-R190 HydrophobicContact CD1-CG 3.86Å; F165-R190 HydrophobicContact CD2-CB 4.48Å; F165-R190 HydrophobicContact CD2-CG 3.8Å; F165-R190 HydrophobicContact CE1-CG 3.98Å; F165-R190 HydrophobicContact CE2-CB 4.43Å; F165-R190 HydrophobicContact CE2-CG 3.93Å; F165-R190 HydrophobicContact CG-CG 3.76Å; F165-R190 HydrophobicContact CZ-CG 4.01Å; Q186-R190 WeakPolarHBondContact O-CG 3.4Å; Q186-R190 PolarHBondContact O-N 3.31Å; T187-R190 PolarHBondContact O-N 3.4Å; L188-R190 VanDerWaalsContact C-N 3.29Å; L188-R190 PolarHBondContact O-N 3.48Å; R190-D192 VanDerWaalsContact C-N 3.34Å; R190-W193 PolarHBondContact O-N 2.9Å; R190-E194 PolarHBondContact O-N 2.93Å
191	L	84.5	Confident	84.5	Confident	42 Å²	42	70.7 Å²	70.7	22%	0.22	36%	0.36	C	S	.	.	H	α-helix	trans	-63.2	-41.2	177.5	-72.7	169.1	0	0	0	111.8	H154 L159 T187 L188 E194 L195	H154-L191 HydrophobicContact CB-CD1 3.89Å; H154-L191 HydrophobicContact CB-CD2 4.33Å; L159-L191 HydrophobicContact CD2-CD2 3.82Å; L159-L191 HydrophobicContact CD2-CG 4.3Å; T187-L191 WeakPolarHBondContact O-CG 3.48Å; T187-L191 PolarHBondContact O-N 2.99Å; L188-L191 PolarHBondContact O-N 2.97Å; L191-E194 PolarHBondContact O-N 3.48Å; L191-L195 VanDerWaalsContact O-CB 3.24Å; L191-L195 WeakPolarHBondContact O-CB 3.18Å; L191-L195 PolarHBondContact O-N 3.36Å
192	D	86.1	Confident	85.5	Confident	96 Å²	96	69.5 Å²	69.5	51%	0.513	34%	0.343	S	S	.	.	H	α-helix	trans	-66.3	-41.6	176.6	-77.6	-20.9	0	0	0	111.5	L188 R190 L195 E196	L188-D192 PolarHBondContact O-N 3.27Å; R190-D192 VanDerWaalsContact C-N 3.34Å; D192-L195 PolarHBondContact O-N 2.88Å; D192-E196 WeakPolarHBondContact O-CB 3.24Å; D192-E196 PolarHBondContact O-N 3.34Å
193	W	85.7	Confident	86	Confident	9 Å²	9	70.8 Å²	70.8	3%	0.034	35%	0.347	C	S	.	.	H	α-helix	trans	-61	-47	173.7	174.6	-117.6	0	0	0	112.4	F165 E168 A169 P170 I173 A189 R190 L195 E196 Q197	F165-W193 HydrophobicContact CD2-CB 4.09Å; F165-W193 AromaticContact CD2-CD1 3.69Å; F165-W193 HydrophobicContact CD2-CG 4.02Å; F165-W193 HydrophobicContact CE2-CB 3.66Å; F165-W193 HydrophobicContact CE2-CG 4.01Å; E168-W193 HydrophobicContact CB-CZ2 4.24Å; E168-W193 WeakPolarHBondContact O-CH2 3.39Å; E168-W193 WeakPolarHBondContact O-CZ2 3.38Å; A169-W193 HydrophobicContact CB-CD2 3.87Å; A169-W193 HydrophobicContact CB-CE3 4.25Å; A169-W193 HydrophobicContact CB-CG 4.14Å; A169-W193 HydrophobicContact CB-CZ2 4.38Å; P170-W193 HydrophobicContact CG-CH2 4.21Å; P170-W193 HydrophobicContact CG-CZ3 3.82Å; I173-W193 HydrophobicContact CD1-CE3 3.96Å; I173-W193 HydrophobicContact CD1-CZ3 4.43Å; I173-W193 HydrophobicContact CG2-CB 4.01Å; A189-W193 WeakPolarHBondContact O-CB 3.33Å; A189-W193 PolarHBondContact O-N 3.02Å; R190-W193 PolarHBondContact O-N 2.9Å; W193-L195 VanDerWaalsContact C-N 3.33Å; W193-L195 PolarHBondContact O-N 3.2Å; W193-E196 PolarHBondContact O-N 3.45Å; W193-Q197 HydrophobicContact CD2-CG 3.93Å; W193-Q197 HydrophobicContact CE3-CG 4.38Å; W193-Q197 HydrophobicContact CG-CG 4.38Å; W193-Q197 HydrophobicContact CH2-CG 4.33Å; W193-Q197 HydrophobicContact CZ2-CG 3.89Å; W193-Q197 VanDerWaalsContact O-CB 3.28Å; W193-Q197 WeakPolarHBondContact O-CB 3.29Å; W193-Q197 VanDerWaalsContact O-CG 3.29Å; W193-Q197 WeakPolarHBondContact O-CG 3.28Å; W193-Q197 PolarHBondContact O-N 2.79Å
194	E	83.8	Confident	86.6	Confident	15 Å²	15	73.3 Å²	73.3	7%	0.07	35%	0.349	C	S	.	.	H	α-helix	trans	-63.7	-39.4	176.9	-83.4	-169.1	-149	0	0	112.6	L159 V160 R190 L191 E196 Q197 R198	L159-E194 VanDerWaalsContact CA-OE1 3.26Å; L159-E194 WeakPolarHBondContact CA-OE1 3.42Å; L159-E194 WeakPolarHBondContact CD2-OE1 3.5Å; V160-E194 HydrophobicContact CG2-CG 4.02Å; V160-E194 PolarHBondContact N-OE1 3.14Å; R190-E194 PolarHBondContact O-N 2.93Å; L191-E194 PolarHBondContact O-N 3.48Å; E194-E196 VanDerWaalsContact C-N 3.3Å; E194-E196 PolarHBondContact O-N 3.44Å; E194-Q197 WeakPolarHBondContact O-CB 3.24Å; E194-Q197 PolarHBondContact O-N 2.8Å; E194-R198 WeakPolarHBondContact O-CB 3.48Å; E194-R198 VanDerWaalsContact O-CG 3.24Å; E194-R198 WeakPolarHBondContact O-CG 3.48Å; E194-R198 PolarHBondContact O-N 3.26Å; E194-R198 IonicContact OE2-CZ 2.98Å; E194-R198 IonicContact OE2-NE 3.1Å; E194-R198 IonicContact OE2-NH2 2.72Å; E194-R198 PolarHBondContact OE2-NH2 3.47Å
195	L	85.6	Confident	87.1	Confident	84 Å²	84	75 Å²	75	44%	0.44	35%	0.352	S	S	.	.	H	α-helix	trans	-61.2	-44.4	176	-177.6	158.8	0	0	0	110.1	L191 D192 W193 R198 K199	L191-L195 VanDerWaalsContact O-CB 3.24Å; L191-L195 WeakPolarHBondContact O-CB 3.18Å; L191-L195 PolarHBondContact O-N 3.36Å; D192-L195 PolarHBondContact O-N 2.88Å; W193-L195 VanDerWaalsContact C-N 3.33Å; W193-L195 PolarHBondContact O-N 3.2Å; L195-R198 PolarHBondContact O-N 2.95Å; L195-K199 HydrophobicContact CD2-CD 3.71Å; L195-K199 HydrophobicContact CD2-CG 4.28Å; L195-K199 WeakPolarHBondContact O-CB 3.31Å; L195-K199 WeakPolarHBondContact O-CG 3.49Å; L195-K199 PolarHBondContact O-N 3.1Å
196	E	87.1	Confident	87.6	Confident	76 Å²	76	77.9 Å²	77.9	36%	0.355	36%	0.359	S	S	.	.	H	α-helix	trans	-71.6	-38.9	179.7	-160.8	161.8	156.7	0	0	112.6	D192 W193 E194 K199 R200	D192-E196 WeakPolarHBondContact O-CB 3.24Å; D192-E196 PolarHBondContact O-N 3.34Å; W193-E196 PolarHBondContact O-N 3.45Å; E194-E196 VanDerWaalsContact C-N 3.3Å; E194-E196 PolarHBondContact O-N 3.44Å; E196-K199 PolarHBondContact O-N 3.34Å; E196-R200 WeakPolarHBondContact O-CB 3.37Å; E196-R200 VanDerWaalsContact O-CG 3.31Å; E196-R200 WeakPolarHBondContact O-CG 3.49Å; E196-R200 PolarHBondContact O-N 3.39Å; E196-R200 IonicContact OE1-CZ 3.31Å; E196-R200 IonicContact OE1-NE 3.89Å; E196-R200 IonicContact OE1-NH2 3.64Å; E196-R200 PolarHBondContact OE1-NH2 3.32Å
197	Q	86.3	Confident	88.1	Confident	61 Å²	61	81.7 Å²	81.7	29%	0.285	38%	0.377	S	S	.	.	H	α-helix	trans	-54.2	-54.4	167.8	-83.3	-88.5	-26.7	0	0	110.8	W193 E194 K199 R200 L201	W193-Q197 HydrophobicContact CD2-CG 3.93Å; W193-Q197 HydrophobicContact CE3-CG 4.38Å; W193-Q197 HydrophobicContact CG-CG 4.38Å; W193-Q197 HydrophobicContact CH2-CG 4.33Å; W193-Q197 HydrophobicContact CZ2-CG 3.89Å; W193-Q197 VanDerWaalsContact O-CB 3.28Å; W193-Q197 WeakPolarHBondContact O-CB 3.29Å; W193-Q197 VanDerWaalsContact O-CG 3.29Å; W193-Q197 WeakPolarHBondContact O-CG 3.28Å; W193-Q197 PolarHBondContact O-N 2.79Å; E194-Q197 WeakPolarHBondContact O-CB 3.24Å; E194-Q197 PolarHBondContact O-N 2.8Å; Q197-K199 VanDerWaalsContact C-N 3.31Å; Q197-K199 PolarHBondContact O-N 2.99Å; Q197-R200 PolarHBondContact O-N 3.1Å; Q197-R200 VanDerWaalsContact O-N 3.13Å; Q197-L201 WeakPolarHBondContact O-CB 3.49Å; Q197-L201 WeakPolarHBondContact O-CD1 3.5Å; Q197-L201 PolarHBondContact O-N 2.91Å
198	R	87.6	Confident	88.5	Confident	146 Å²	146	83.2 Å²	83.2	55%	0.551	39%	0.388	S	S	*	.	H	α-helix	trans	-61.9	-36.9	179.5	-71.6	179.7	-161.6	-164.7	9.6	112	E194 L195 A202	E194-R198 WeakPolarHBondContact O-CB 3.48Å; E194-R198 VanDerWaalsContact O-CG 3.24Å; E194-R198 WeakPolarHBondContact O-CG 3.48Å; E194-R198 PolarHBondContact O-N 3.26Å; E194-R198 IonicContact OE2-CZ 2.98Å; E194-R198 IonicContact OE2-NE 3.1Å; E194-R198 IonicContact OE2-NH2 2.72Å; E194-R198 PolarHBondContact OE2-NH2 3.47Å; L195-R198 PolarHBondContact O-N 2.95Å; R198-A202 WeakPolarHBondContact O-CB 3.12Å; R198-A202 PolarHBondContact O-N 2.86Å
199	K	90.2	Very high	88.8	Confident	137 Å²	137	82.5 Å²	82.5	60%	0.596	39%	0.385	S	S	*	.	H	α-helix	trans	-62.7	-47.8	172.3	-79.2	-179.8	179	171.1	0	111.9	L195 E196 Q197 A202 E203	L195-K199 HydrophobicContact CD2-CD 3.71Å; L195-K199 HydrophobicContact CD2-CG 4.28Å; L195-K199 WeakPolarHBondContact O-CB 3.31Å; L195-K199 WeakPolarHBondContact O-CG 3.49Å; L195-K199 PolarHBondContact O-N 3.1Å; E196-K199 PolarHBondContact O-N 3.34Å; Q197-K199 VanDerWaalsContact C-N 3.31Å; Q197-K199 PolarHBondContact O-N 2.99Å; K199-A202 PolarHBondContact O-N 3.36Å; K199-E203 WeakPolarHBondContact O-CB 3.29Å; K199-E203 PolarHBondContact O-N 3.32Å
200	R	89.8	Confident	89.3	Confident	118 Å²	118	84.3 Å²	84.3	45%	0.445	40%	0.397	S	S	.	.	H	α-helix	trans	-62	-44.4	177.5	-71.7	175.2	-169.7	177.7	5.5	111.5	E196 Q197 E203 K204	E196-R200 WeakPolarHBondContact O-CB 3.37Å; E196-R200 VanDerWaalsContact O-CG 3.31Å; E196-R200 WeakPolarHBondContact O-CG 3.49Å; E196-R200 PolarHBondContact O-N 3.39Å; E196-R200 IonicContact OE1-CZ 3.31Å; E196-R200 IonicContact OE1-NE 3.89Å; E196-R200 IonicContact OE1-NH2 3.64Å; E196-R200 PolarHBondContact OE1-NH2 3.32Å; Q197-R200 PolarHBondContact O-N 3.1Å; Q197-R200 VanDerWaalsContact O-N 3.13Å; R200-E203 PolarHBondContact O-N 2.88Å; R200-K204 VanDerWaalsContact O-CB 3.29Å; R200-K204 WeakPolarHBondContact O-CB 3.48Å; R200-K204 PolarHBondContact O-N 3.13Å
201	L	90.3	Very high	89.7	Confident	104 Å²	104	87 Å²	87	55%	0.545	41%	0.413	S	S	.	.	H	α-helix	trans	-64.8	-42.7	176.9	-90.5	76.2	0	0	0	111.6	Q197 K204 Y205	Q197-L201 WeakPolarHBondContact O-CB 3.49Å; Q197-L201 WeakPolarHBondContact O-CD1 3.5Å; Q197-L201 PolarHBondContact O-N 2.91Å; L201-K204 PolarHBondContact O-N 3.34Å; L201-Y205 WeakPolarHBondContact O-CB 3.17Å; L201-Y205 PolarHBondContact O-N 3.44Å
202	A	92.5	Very high	90.1	Very high	46 Å²	46	91.3 Å²	91.3	38%	0.38	43%	0.43	S	S	.	.	H	α-helix	trans	-65.3	-38.2	177.7	0	0	0	0	0	112.3	R198 K199 R206	R198-A202 WeakPolarHBondContact O-CB 3.12Å; R198-A202 PolarHBondContact O-N 2.86Å; K199-A202 PolarHBondContact O-N 3.36Å; A202-R206 PolarHBondContact O-N 2.9Å
203	E	94.3	Very high	90.5	Very high	83 Å²	83	92.2 Å²	92.2	39%	0.388	43%	0.431	S	S	.	.	H	α-helix	trans	-67.5	-49.8	174.9	-162.9	60.4	-135.3	0	0	111	K199 R200 Y205 R206 E207	K199-E203 WeakPolarHBondContact O-CB 3.29Å; K199-E203 PolarHBondContact O-N 3.32Å; R200-E203 PolarHBondContact O-N 2.88Å; E203-Y205 VanDerWaalsContact C-N 3.26Å; E203-Y205 PolarHBondContact O-N 2.81Å; E203-R206 VanDerWaalsContact CD-NH1 3.28Å; E203-R206 CarbonylContact O-C 3.59Å; E203-R206 WeakPolarHBondContact O-CA 3.37Å; E203-R206 WeakPolarHBondContact O-CB 3.43Å; E203-R206 PolarHBondContact O-N 2.81Å; E203-R206 IonicContact OE1-CZ 3.25Å; E203-R206 IonicContact OE1-NH1 3.57Å; E203-R206 PolarHBondContact OE1-NH1 3.42Å; E203-R206 VanDerWaalsContact OE1-NH1 3.07Å; E203-R206 IonicContact OE2-CZ 2.81Å; E203-R206 IonicContact OE2-NH1 2.93Å; E203-R206 PolarHBondContact OE2-NH1 2.94Å; E203-R206 IonicContact OE2-NH2 3.74Å; E203-R206 PolarHBondContact OE2-NH2 3.35Å; E203-E207 PolarHBondContact O-N 2.81Å
204	K	93.4	Very high	90.9	Very high	144 Å²	144	97.3 Å²	97.3	63%	0.626	45%	0.454	S	S	*	.	H	α-helix	trans	-57.7	-39.7	176	-169.4	175.6	-176.5	179	0	111.8	R200 L201 E207 C208	R200-K204 VanDerWaalsContact O-CB 3.29Å; R200-K204 WeakPolarHBondContact O-CB 3.48Å; R200-K204 PolarHBondContact O-N 3.13Å; L201-K204 PolarHBondContact O-N 3.34Å; K204-E207 PolarHBondContact O-N 2.92Å; K204-C208 WeakPolarHBondContact O-CB 3.21Å; K204-C208 PolarHBondContact O-N 3.35Å; K204-C208 PolarHBondContact O-SG 2.8Å
205	Y	91.4	Very high	91.3	Very high	151 Å²	151	101.1 Å²	101.1	59%	0.592	47%	0.473	S	S	*	.	H	α-helix	trans	-65.1	-42.3	174.8	-176.2	-108.7	0	0	0	111.9	L201 E203 C208 L209	L201-Y205 WeakPolarHBondContact O-CB 3.17Å; L201-Y205 PolarHBondContact O-N 3.44Å; E203-Y205 VanDerWaalsContact C-N 3.26Å; E203-Y205 PolarHBondContact O-N 2.81Å; Y205-C208 PolarHBondContact O-N 2.91Å; Y205-L209 HydrophobicContact CD1-CD1 3.89Å; Y205-L209 HydrophobicContact CD1-CG 4.33Å; Y205-L209 HydrophobicContact CE1-CD1 3.38Å; Y205-L209 HydrophobicContact CE1-CG 3.96Å; Y205-L209 HydrophobicContact CE2-CG 4.36Å; Y205-L209 WeakPolarHBondContact O-CB 3.4Å; Y205-L209 WeakPolarHBondContact O-CG 3.48Å; Y205-L209 PolarHBondContact O-N 3.46Å
206	R	93.8	Very high	91.5	Very high	141 Å²	141	101.2 Å²	101.2	53%	0.532	47%	0.474	S	S	.	.	H	α-helix	trans	-61.8	-42.6	173.5	-101.7	-170.6	-80.7	118.8	4.6	112.2	A202 E203 L209 S210	A202-R206 PolarHBondContact O-N 2.9Å; E203-R206 VanDerWaalsContact CD-NH1 3.28Å; E203-R206 CarbonylContact O-C 3.59Å; E203-R206 WeakPolarHBondContact O-CA 3.37Å; E203-R206 WeakPolarHBondContact O-CB 3.43Å; E203-R206 PolarHBondContact O-N 2.81Å; E203-R206 IonicContact OE1-CZ 3.25Å; E203-R206 IonicContact OE1-NH1 3.57Å; E203-R206 PolarHBondContact OE1-NH1 3.42Å; E203-R206 VanDerWaalsContact OE1-NH1 3.07Å; E203-R206 IonicContact OE2-CZ 2.81Å; E203-R206 IonicContact OE2-NH1 2.93Å; E203-R206 PolarHBondContact OE2-NH1 2.94Å; E203-R206 IonicContact OE2-NH2 3.74Å; E203-R206 PolarHBondContact OE2-NH2 3.35Å; R206-L209 PolarHBondContact O-N 2.87Å; R206-S210 PolarHBondContact O-N 3.02Å
207	E	93.9	Very high	91.9	Very high	111 Å²	111	104.1 Å²	104.1	52%	0.519	49%	0.485	S	S	.	.	H	α-helix	trans	-62	-46.6	174.3	-71.4	-179.7	172.8	0	0	111.7	E203 K204 L209 S210 N211	E203-E207 PolarHBondContact O-N 2.81Å; K204-E207 PolarHBondContact O-N 2.92Å; E207-L209 VanDerWaalsContact C-N 3.34Å; E207-L209 PolarHBondContact O-N 2.86Å; E207-S210 PolarHBondContact O-N 3.28Å; E207-N211 WeakPolarHBondContact O-CB 3.47Å; E207-N211 VanDerWaalsContact O-CG 3.31Å; E207-N211 PolarHBondContact O-N 3.25Å
208	C	90.1	Very high	92.2	Very high	70 Å²	70	106.4 Å²	106.4	47%	0.473	50%	0.496	S	S	.	.	H	α-helix	trans	-60.8	-41.2	176.1	-73.9	0	0	0	0	112.2	K204 Y205 N211 K212	K204-C208 WeakPolarHBondContact O-CB 3.21Å; K204-C208 PolarHBondContact O-N 3.35Å; K204-C208 PolarHBondContact O-SG 2.8Å; Y205-C208 PolarHBondContact O-N 2.91Å; C208-N211 PolarHBondContact O-N 2.88Å; C208-K212 WeakPolarHBondContact O-CB 3.47Å; C208-K212 PolarHBondContact O-N 2.95Å
209	L	91.1	Very high	92.3	Very high	63 Å²	63	102.8 Å²	102.8	33%	0.33	49%	0.487	S	S	.	.	H	α-helix	trans	-63.4	-44.3	174.4	-77	-178.8	0	0	0	111.7	Y205 R206 E207 N211 K212 E213	Y205-L209 HydrophobicContact CD1-CD1 3.89Å; Y205-L209 HydrophobicContact CD1-CG 4.33Å; Y205-L209 HydrophobicContact CE1-CD1 3.38Å; Y205-L209 HydrophobicContact CE1-CG 3.96Å; Y205-L209 HydrophobicContact CE2-CG 4.36Å; Y205-L209 WeakPolarHBondContact O-CB 3.4Å; Y205-L209 WeakPolarHBondContact O-CG 3.48Å; Y205-L209 PolarHBondContact O-N 3.46Å; R206-L209 PolarHBondContact O-N 2.87Å; E207-L209 VanDerWaalsContact C-N 3.34Å; E207-L209 PolarHBondContact O-N 2.86Å; L209-N211 VanDerWaalsContact C-N 3.33Å; L209-N211 PolarHBondContact O-N 2.72Å; L209-K212 PolarHBondContact O-N 3.1Å; L209-E213 PolarHBondContact O-N 3.4Å
210	S	93.8	Very high	92.4	Very high	50 Å²	50	101.6 Å²	101.6	35%	0.35	48%	0.484	S	S	.	.	H	α-helix	trans	-60.7	-43	175.7	-173.6	0	0	0	0	111.7	R206 E207 E213 K214	R206-S210 PolarHBondContact O-N 3.02Å; E207-S210 PolarHBondContact O-N 3.28Å; S210-E213 PolarHBondContact O-N 3Å; S210-K214 VanDerWaalsContact O-CG 3.32Å; S210-K214 WeakPolarHBondContact O-CG 3.3Å; S210-K214 PolarHBondContact O-N 2.85Å
211	N	92.2	Very high	92.6	Very high	81 Å²	81	100.5 Å²	100.5	43%	0.433	49%	0.49	S	S	.	.	H	α-helix	trans	-66.4	-41.1	177.2	-71	-16.3	0	0	0	111.8	E207 C208 L209 E213 K214 I215	E207-N211 WeakPolarHBondContact O-CB 3.47Å; E207-N211 VanDerWaalsContact O-CG 3.31Å; E207-N211 PolarHBondContact O-N 3.25Å; C208-N211 PolarHBondContact O-N 2.88Å; L209-N211 VanDerWaalsContact C-N 3.33Å; L209-N211 PolarHBondContact O-N 2.72Å; N211-E213 PolarHBondContact O-N 3.07Å; N211-K214 PolarHBondContact O-N 2.85Å; N211-I215 WeakPolarHBondContact O-CB 3.41Å; N211-I215 VanDerWaalsContact O-CG1 3.27Å; N211-I215 WeakPolarHBondContact O-CG1 3.2Å; N211-I215 PolarHBondContact O-N 3.02Å
212	K	93.9	Very high	92.7	Very high	131 Å²	131	101.7 Å²	101.7	57%	0.57	49%	0.49	S	S	*	.	H	α-helix	trans	-59	-46	173.4	-178.9	-176.9	175.2	-178.5	0	111.2	C208 L209 I215 L216	C208-K212 WeakPolarHBondContact O-CB 3.47Å; C208-K212 PolarHBondContact O-N 2.95Å; L209-K212 PolarHBondContact O-N 3.1Å; K212-I215 PolarHBondContact O-N 3.34Å; K212-L216 HydrophobicContact CG-CD1 3.98Å; K212-L216 WeakPolarHBondContact O-CB 3.29Å; K212-L216 VanDerWaalsContact O-CG 3.3Å; K212-L216 WeakPolarHBondContact O-CG 3.49Å; K212-L216 PolarHBondContact O-N 3.26Å
213	E	93.2	Very high	92.5	Very high	116 Å²	116	105.7 Å²	105.7	54%	0.542	50%	0.499	S	S	.	.	H	α-helix	trans	-63.8	-40.4	176.8	-78.3	-174.9	-176.6	0	0	112.8	L209 S210 N211 L216 K217	L209-E213 PolarHBondContact O-N 3.4Å; S210-E213 PolarHBondContact O-N 3Å; N211-E213 PolarHBondContact O-N 3.07Å; E213-L216 PolarHBondContact O-N 2.82Å; E213-K217 WeakPolarHBondContact O-CB 3.47Å; E213-K217 WeakPolarHBondContact O-CG 3.34Å; E213-K217 PolarHBondContact O-N 3.37Å
214	K	94.7	Very high	92.2	Very high	116 Å²	116	107.6 Å²	107.6	50%	0.504	51%	0.508	S	S	.	.	H	α-helix	trans	-60.9	-48.9	174.8	-73.6	171.8	-172.7	171.4	0	111.2	S210 N211 L216 K217 E218	S210-K214 VanDerWaalsContact O-CG 3.32Å; S210-K214 WeakPolarHBondContact O-CG 3.3Å; S210-K214 PolarHBondContact O-N 2.85Å; N211-K214 PolarHBondContact O-N 2.85Å; K214-L216 VanDerWaalsContact C-N 3.35Å; K214-L216 PolarHBondContact O-N 3.02Å; K214-K217 PolarHBondContact O-N 2.87Å; K214-E218 PolarHBondContact O-N 3.49Å
215	I	91.8	Very high	91.9	Very high	94 Å²	94	107.8 Å²	107.8	48%	0.482	51%	0.506	S	S	.	.	H	α-helix	trans	-62.7	-42.6	178.8	-67.7	166.9	0	0	0	110.7	N211 K212 K217 E218 I219	N211-I215 WeakPolarHBondContact O-CB 3.41Å; N211-I215 VanDerWaalsContact O-CG1 3.27Å; N211-I215 WeakPolarHBondContact O-CG1 3.2Å; N211-I215 PolarHBondContact O-N 3.02Å; K212-I215 PolarHBondContact O-N 3.34Å; I215-K217 PolarHBondContact O-N 3.23Å; I215-E218 PolarHBondContact O-N 3.13Å; I215-I219 HydrophobicContact CG2-CD1 3.73Å; I215-I219 HydrophobicContact CG2-CG1 4.33Å; I215-I219 WeakPolarHBondContact O-CB 3.42Å; I215-I219 VanDerWaalsContact O-CG1 3.25Å; I215-I219 WeakPolarHBondContact O-CG1 3.27Å; I215-I219 PolarHBondContact O-N 3.48Å
216	L	91.1	Very high	91.6	Very high	87 Å²	87	105.6 Å²	105.6	46%	0.455	50%	0.504	S	S	.	.	H	α-helix	trans	-61.9	-44	176.8	-75.9	168.5	0	0	0	111.6	K212 E213 K214 E218 I219 E220	K212-L216 HydrophobicContact CG-CD1 3.98Å; K212-L216 WeakPolarHBondContact O-CB 3.29Å; K212-L216 VanDerWaalsContact O-CG 3.3Å; K212-L216 WeakPolarHBondContact O-CG 3.49Å; K212-L216 PolarHBondContact O-N 3.26Å; E213-L216 PolarHBondContact O-N 2.82Å; K214-L216 VanDerWaalsContact C-N 3.35Å; K214-L216 PolarHBondContact O-N 3.02Å; L216-E218 PolarHBondContact O-N 3.44Å; L216-I219 PolarHBondContact O-N 2.85Å; L216-E220 PolarHBondContact O-N 3.39Å
217	K	93.7	Very high	91.1	Very high	137 Å²	137	102.6 Å²	102.6	60%	0.596	50%	0.504	S	S	*	.	H	α-helix	trans	-61.7	-42.2	174.6	-74.3	171.2	-179.2	168.2	0	112	E213 K214 I215 I219 E220 V221	E213-K217 WeakPolarHBondContact O-CB 3.47Å; E213-K217 WeakPolarHBondContact O-CG 3.34Å; E213-K217 PolarHBondContact O-N 3.37Å; K214-K217 PolarHBondContact O-N 2.87Å; I215-K217 PolarHBondContact O-N 3.23Å; K217-I219 VanDerWaalsContact C-N 3.34Å; K217-I219 PolarHBondContact O-N 3.45Å; K217-E220 PolarHBondContact O-N 2.93Å; K217-V221 VanDerWaalsContact O-CG2 3.29Å; K217-V221 WeakPolarHBondContact O-CG2 3.32Å; K217-V221 PolarHBondContact O-N 3.38Å
218	E	93.2	Very high	90.7	Very high	108 Å²	108	99.6 Å²	99.6	51%	0.505	50%	0.496	S	S	.	.	H	α-helix	trans	-63	-40	174.9	-76.9	-176.7	-162	0	0	112.6	K214 I215 L216 K222	K214-E218 PolarHBondContact O-N 3.49Å; I215-E218 PolarHBondContact O-N 3.13Å; L216-E218 PolarHBondContact O-N 3.44Å; E218-K222 WeakPolarHBondContact O-CB 3.4Å; E218-K222 VanDerWaalsContact O-CG 3.27Å; E218-K222 WeakPolarHBondContact O-CG 3.45Å; E218-K222 PolarHBondContact O-N 3.29Å
219	I	90.6	Very high	90.5	Very high	71 Å²	71	99 Å²	99	36%	0.364	49%	0.487	S	S	.	.	H	α-helix	trans	-64.8	-43.9	175.6	-70.4	167.9	0	0	0	110.2	I215 L216 K217 K222 K223	I215-I219 HydrophobicContact CG2-CD1 3.73Å; I215-I219 HydrophobicContact CG2-CG1 4.33Å; I215-I219 WeakPolarHBondContact O-CB 3.42Å; I215-I219 VanDerWaalsContact O-CG1 3.25Å; I215-I219 WeakPolarHBondContact O-CG1 3.27Å; I215-I219 PolarHBondContact O-N 3.48Å; L216-I219 PolarHBondContact O-N 2.85Å; K217-I219 VanDerWaalsContact C-N 3.34Å; K217-I219 PolarHBondContact O-N 3.45Å; I219-K222 PolarHBondContact O-N 3.27Å; I219-K223 HydrophobicContact CG2-CD 4Å; I219-K223 HydrophobicContact CG2-CG 4.28Å; I219-K223 VanDerWaalsContact O-CB 3.32Å; I219-K223 WeakPolarHBondContact O-CB 3.25Å; I219-K223 VanDerWaalsContact O-CG 3.31Å; I219-K223 WeakPolarHBondContact O-CG 3.34Å; I219-K223 PolarHBondContact O-N 2.78Å
220	E	92.7	Very high	90	Very high	112 Å²	112	102 Å²	102	52%	0.523	50%	0.5	S	S	.	.	H	α-helix	trans	-58.8	-50.1	177.1	-149.3	79	-139.9	0	0	110.5	L216 K217 K222 K223 E224	L216-E220 PolarHBondContact O-N 3.39Å; K217-E220 PolarHBondContact O-N 2.93Å; E220-K222 PolarHBondContact O-N 2.83Å; E220-K223 WeakPolarHBondContact O-CB 3.48Å; E220-K223 PolarHBondContact O-N 3.21Å; E220-K223 VanDerWaalsContact O-N 3.16Å; E220-E224 WeakPolarHBondContact O-CG 3.49Å; E220-E224 PolarHBondContact O-N 2.91Å
221	V	93.9	Very high	89.6	Confident	95 Å²	95	102.8 Å²	102.8	58%	0.576	50%	0.504	S	S	*	.	H	α-helix	trans	-61	-43.3	178	172.3	0	0	0	0	111.4	K217 E224 Y225	K217-V221 VanDerWaalsContact O-CG2 3.29Å; K217-V221 WeakPolarHBondContact O-CG2 3.32Å; K217-V221 PolarHBondContact O-N 3.38Å; V221-E224 PolarHBondContact O-N 2.89Å; V221-Y225 VanDerWaalsContact O-CB 3.31Å; V221-Y225 WeakPolarHBondContact O-CB 3.43Å; V221-Y225 PolarHBondContact O-N 3.41Å
222	K	90.7	Very high	89.2	Confident	128 Å²	128	107.1 Å²	107.1	56%	0.557	51%	0.514	S	S	*	.	H	α-helix	trans	-66.3	-37.4	176.7	-75.7	172.8	179.6	167.8	0	111.8	E218 I219 E220 Y225 L226	E218-K222 WeakPolarHBondContact O-CB 3.4Å; E218-K222 VanDerWaalsContact O-CG 3.27Å; E218-K222 WeakPolarHBondContact O-CG 3.45Å; E218-K222 PolarHBondContact O-N 3.29Å; I219-K222 PolarHBondContact O-N 3.27Å; E220-K222 PolarHBondContact O-N 2.83Å; K222-Y225 PolarHBondContact O-N 2.85Å; K222-L226 WeakPolarHBondContact O-CB 3.4Å; K222-L226 VanDerWaalsContact O-CG 3.26Å; K222-L226 WeakPolarHBondContact O-CG 3.31Å; K222-L226 PolarHBondContact O-N 3.35Å
223	K	88.4	Confident	88.4	Confident	130 Å²	130	105.5 Å²	105.5	57%	0.565	51%	0.511	S	S	*	.	H	α-helix	trans	-66.2	-45.9	175.2	-81	-179.7	177.8	179.6	0	111.5	I219 E220 Y225 L226 S227	I219-K223 HydrophobicContact CG2-CD 4Å; I219-K223 HydrophobicContact CG2-CG 4.28Å; I219-K223 VanDerWaalsContact O-CB 3.32Å; I219-K223 WeakPolarHBondContact O-CB 3.25Å; I219-K223 VanDerWaalsContact O-CG 3.31Å; I219-K223 WeakPolarHBondContact O-CG 3.34Å; I219-K223 PolarHBondContact O-N 2.78Å; E220-K223 WeakPolarHBondContact O-CB 3.48Å; E220-K223 PolarHBondContact O-N 3.21Å; E220-K223 VanDerWaalsContact O-N 3.16Å; K223-Y225 VanDerWaalsContact C-N 3.31Å; K223-Y225 PolarHBondContact O-N 2.94Å; K223-L226 PolarHBondContact O-N 3.29Å; K223-S227 WeakPolarHBondContact O-CB 3.45Å; K223-S227 PolarHBondContact O-N 3.31Å; K223-S227 PolarHBondContact O-OG 2.91Å
224	E	89.7	Confident	87.8	Confident	123 Å²	123	103.4 Å²	103.4	58%	0.575	50%	0.504	S	S	*	.	H	α-helix	trans	-62.2	-39.5	175	-75.2	-177.1	171.1	0	0	111.8	E220 V221 S227 S228	E220-E224 WeakPolarHBondContact O-CG 3.49Å; E220-E224 PolarHBondContact O-N 2.91Å; V221-E224 PolarHBondContact O-N 2.89Å; E224-S227 VanDerWaalsContact CA-OG 3.32Å; E224-S227 WeakPolarHBondContact CA-OG 3.14Å; E224-S227 PolarHBondContact O-OG 3.44Å; E224-S228 VanDerWaalsContact O-CB 3.28Å; E224-S228 WeakPolarHBondContact O-CB 3.48Å; E224-S228 PolarHBondContact O-N 3.42Å; E224-S228 PolarHBondContact O-OG 2.95Å
225	Y	86.8	Confident	87.3	Confident	149 Å²	149	101.7 Å²	101.7	58%	0.584	51%	0.507	S	S	*	.	H	α-helix	trans	-62.5	-48.3	173.7	-178	-103.5	0	0	0	111.4	V221 K222 K223 S228 L229	V221-Y225 VanDerWaalsContact O-CB 3.31Å; V221-Y225 WeakPolarHBondContact O-CB 3.43Å; V221-Y225 PolarHBondContact O-N 3.41Å; K222-Y225 PolarHBondContact O-N 2.85Å; K223-Y225 VanDerWaalsContact C-N 3.31Å; K223-Y225 PolarHBondContact O-N 2.94Å; Y225-S228 PolarHBondContact O-N 2.9Å; Y225-S228 PolarHBondContact O-OG 3.09Å; Y225-L229 HydrophobicContact CE1-CD2 4.07Å; Y225-L229 WeakPolarHBondContact O-CB 3.48Å; Y225-L229 PolarHBondContact O-N 2.92Å
226	L	85.5	Confident	86.8	Confident	104 Å²	104	102.5 Å²	102.5	55%	0.545	51%	0.511	S	S	.	.	H	α-helix	trans	-64.2	-42.6	177.1	-73.5	166.9	0	0	0	112.2	K222 K223 S228 L229 Q230	K222-L226 WeakPolarHBondContact O-CB 3.4Å; K222-L226 VanDerWaalsContact O-CG 3.26Å; K222-L226 WeakPolarHBondContact O-CG 3.31Å; K222-L226 PolarHBondContact O-N 3.35Å; K223-L226 PolarHBondContact O-N 3.29Å; L226-S228 VanDerWaalsContact C-N 3.26Å; L226-S228 PolarHBondContact O-N 3.5Å; L226-L229 PolarHBondContact O-N 3.29Å; L226-Q230 WeakPolarHBondContact O-CB 3.42Å; L226-Q230 PolarHBondContact O-N 3.35Å
227	S	82.3	Confident	85.9	Confident	78 Å²	78	102 Å²	102	55%	0.545	51%	0.507	S	S	.	.	H	α-helix	trans	-68.6	-25	178.5	68	0	0	0	0	112.8	K223 E224 P231	K223-S227 WeakPolarHBondContact O-CB 3.45Å; K223-S227 PolarHBondContact O-N 3.31Å; K223-S227 PolarHBondContact O-OG 2.91Å; E224-S227 VanDerWaalsContact CA-OG 3.32Å; E224-S227 WeakPolarHBondContact CA-OG 3.14Å; E224-S227 PolarHBondContact O-OG 3.44Å; S227-P231 WeakPolarHBondContact O-CD 3.34Å; S227-P231 VanDerWaalsContact O-CG 3.27Å; S227-P231 WeakPolarHBondContact O-CG 3.27Å
228	S	85.4	Confident	85.1	Confident	48 Å²	48	101.1 Å²	101.1	34%	0.336	51%	0.505	S	S	.	.	H	α-helix	trans	-86.6	-26.8	172.1	68.4	0	0	0	0	113.1	E224 Y225 L226 R232	E224-S228 VanDerWaalsContact O-CB 3.28Å; E224-S228 WeakPolarHBondContact O-CB 3.48Å; E224-S228 PolarHBondContact O-N 3.42Å; E224-S228 PolarHBondContact O-OG 2.95Å; Y225-S228 PolarHBondContact O-N 2.9Å; Y225-S228 PolarHBondContact O-OG 3.09Å; L226-S228 VanDerWaalsContact C-N 3.26Å; L226-S228 PolarHBondContact O-N 3.5Å; S228-R232 WeakPolarHBondContact O-CD 3.34Å; S228-R232 VanDerWaalsContact O-CG 3.26Å; S228-R232 WeakPolarHBondContact O-CG 3.31Å
229	L	85.3	Confident	84.5	Confident	57 Å²	57	99.4 Å²	99.4	30%	0.298	51%	0.509	S	S	.	.	H	α-helix	trans	-76.1	-42.9	177.9	-176.1	65.4	0	0	0	112.1	Y225 L226 R232 L233	Y225-L229 HydrophobicContact CE1-CD2 4.07Å; Y225-L229 WeakPolarHBondContact O-CB 3.48Å; Y225-L229 PolarHBondContact O-N 2.92Å; L226-L229 PolarHBondContact O-N 3.29Å; L229-R232 PolarHBondContact O-N 3.48Å; L229-R232 VanDerWaalsContact O-N 3.15Å; L229-L233 HydrophobicContact CD1-CD1 4.17Å; L229-L233 HydrophobicContact CD1-CG 4.26Å; L229-L233 HydrophobicContact CD2-CD1 4.21Å; L229-L233 HydrophobicContact CG-CD1 3.75Å; L229-L233 HydrophobicContact CG-CG 4.28Å; L229-L233 PolarHBondContact O-N 2.94Å
230	Q	80.6	Confident	83.8	Confident	126 Å²	126	97.8 Å²	97.8	59%	0.589	50%	0.504	S	S	*	.	H	α-helix	trans	-53.5	-52.3	179.3	-169.3	98.9	17.2	0	0	113.4	L226 R232 L233 N234	L226-Q230 WeakPolarHBondContact O-CB 3.42Å; L226-Q230 PolarHBondContact O-N 3.35Å; Q230-R232 VanDerWaalsContact C-N 3.35Å; Q230-R232 PolarHBondContact O-N 3.49Å; Q230-L233 PolarHBondContact O-N 3.45Å; Q230-N234 WeakPolarHBondContact O-CB 3.32Å; Q230-N234 PolarHBondContact O-N 3.33Å
231	P	85.1	Confident	82.7	Confident	67 Å²	67	95.3 Å²	95.3	44%	0.435	49%	0.494	S	S	.	.	H	α-helix	trans	-66.4	-34	176.9	25.5	-35.3	0	0	0	112.5	S227 N234 S235	S227-P231 WeakPolarHBondContact O-CD 3.34Å; S227-P231 VanDerWaalsContact O-CG 3.27Å; S227-P231 WeakPolarHBondContact O-CG 3.27Å; P231-N234 PolarHBondContact O-N 2.87Å; P231-S235 WeakPolarHBondContact O-CB 3.42Å; P231-S235 PolarHBondContact O-N 3.28Å; P231-S235 PolarHBondContact O-OG 2.96Å; P231-S235 VanDerWaalsContact O-OG 3.1Å
232	R	84	Confident	81.8	Confident	173 Å²	173	94.4 Å²	94.4	65%	0.653	49%	0.49	S	S	*	.	H	α-helix	trans	-65	-45.1	175.2	-70.8	173.9	-167.2	-98	2.2	111.7	S228 L229 Q230 S235 I236	S228-R232 WeakPolarHBondContact O-CD 3.34Å; S228-R232 VanDerWaalsContact O-CG 3.26Å; S228-R232 WeakPolarHBondContact O-CG 3.31Å; L229-R232 PolarHBondContact O-N 3.48Å; L229-R232 VanDerWaalsContact O-N 3.15Å; Q230-R232 VanDerWaalsContact C-N 3.35Å; Q230-R232 PolarHBondContact O-N 3.49Å; R232-S235 PolarHBondContact O-N 3.47Å; R232-I236 VanDerWaalsContact O-CG1 3.28Å; R232-I236 WeakPolarHBondContact O-CG1 3.34Å; R232-I236 PolarHBondContact O-N 2.93Å
233	L	78.7	Confident	81	Confident	96 Å²	96	92.4 Å²	92.4	50%	0.503	49%	0.489	S	S	.	.	H	α-helix	trans	-62.9	-42.8	174.6	-79.9	167.2	0	0	0	111.5	L229 Q230 S235 I236 M237	L229-L233 HydrophobicContact CD1-CD1 4.17Å; L229-L233 HydrophobicContact CD1-CG 4.26Å; L229-L233 HydrophobicContact CD2-CD1 4.21Å; L229-L233 HydrophobicContact CG-CD1 3.75Å; L229-L233 HydrophobicContact CG-CG 4.28Å; L229-L233 PolarHBondContact O-N 2.94Å; Q230-L233 PolarHBondContact O-N 3.45Å; L233-S235 PolarHBondContact O-N 3.27Å; L233-I236 PolarHBondContact O-N 2.86Å; L233-M237 WeakPolarHBondContact O-CB 3.49Å; L233-M237 PolarHBondContact O-N 2.91Å
234	N	79.1	Confident	79.8	Confident	72 Å²	72	88.5 Å²	88.5	39%	0.385	47%	0.472	S	S	.	.	H	α-helix	trans	-62.8	-41.3	175.1	-81.8	-14.6	0	0	0	112.3	Q230 P231 I236 M237 Q238	Q230-N234 WeakPolarHBondContact O-CB 3.32Å; Q230-N234 PolarHBondContact O-N 3.33Å; P231-N234 PolarHBondContact O-N 2.87Å; N234-I236 VanDerWaalsContact C-N 3.34Å; N234-M237 PolarHBondContact O-N 3.37Å; N234-Q238 WeakPolarHBondContact O-CB 3.5Å; N234-Q238 VanDerWaalsContact O-CG 3.25Å; N234-Q238 WeakPolarHBondContact O-CG 3.49Å; N234-Q238 PolarHBondContact O-N 3.23Å
235	S	84.1	Confident	78.7	Confident	81 Å²	81	89.2 Å²	89.2	57%	0.566	48%	0.476	S	S	*	.	H	α-helix	trans	-62.8	-40	174	-67.5	0	0	0	0	112.1	P231 R232 L233 A239	P231-S235 WeakPolarHBondContact O-CB 3.42Å; P231-S235 PolarHBondContact O-N 3.28Å; P231-S235 PolarHBondContact O-OG 2.96Å; P231-S235 VanDerWaalsContact O-OG 3.1Å; R232-S235 PolarHBondContact O-N 3.47Å; L233-S235 PolarHBondContact O-N 3.27Å; S235-A239 VanDerWaalsContact O-CB 3.22Å; S235-A239 WeakPolarHBondContact O-CB 3.19Å; S235-A239 PolarHBondContact O-N 2.9Å
236	I	81.6	Confident	77.9	Confident	111 Å²	111	91.4 Å²	91.4	57%	0.569	48%	0.484	S	S	*	.	H	α-helix	trans	-64.7	-45.5	175.1	-68.5	164.4	0	0	0	110.6	R232 L233 N234 A239 S240	R232-I236 VanDerWaalsContact O-CG1 3.28Å; R232-I236 WeakPolarHBondContact O-CG1 3.34Å; R232-I236 PolarHBondContact O-N 2.93Å; L233-I236 PolarHBondContact O-N 2.86Å; N234-I236 VanDerWaalsContact C-N 3.34Å; I236-A239 PolarHBondContact O-N 3.23Å; I236-S240 WeakPolarHBondContact O-CB 3.29Å; I236-S240 PolarHBondContact O-N 3.39Å; I236-S240 PolarHBondContact O-OG 3.15Å
237	M	72.9	Confident	77	Confident	75 Å²	75	91.4 Å²	91.4	37%	0.369	48%	0.484	S	S	.	.	H	α-helix	trans	-59	-50.2	177.5	-176	176.2	64.8	0	0	111.4	L233 N234 A239 S240 L241	L233-M237 WeakPolarHBondContact O-CB 3.49Å; L233-M237 PolarHBondContact O-N 2.91Å; N234-M237 PolarHBondContact O-N 3.37Å; M237-A239 PolarHBondContact O-N 3.41Å; M237-S240 PolarHBondContact O-N 3.12Å; M237-S240 VanDerWaalsContact O-N 3.13Å; M237-S240 PolarHBondContact O-OG 3.39Å; M237-L241 PolarHBondContact O-N 3.4Å; M237-L241 VanDerWaalsContact O-N 3.11Å
238	Q	76.4	Confident	75.8	Confident	120 Å²	120	96.6 Å²	96.6	56%	0.561	50%	0.497	S	S	*	.	H	α-helix	trans	-62.9	-37.6	176.6	-69.2	-64	-30.2	0	0	112.9	N234 S240 P242	N234-Q238 WeakPolarHBondContact O-CB 3.5Å; N234-Q238 VanDerWaalsContact O-CG 3.25Å; N234-Q238 WeakPolarHBondContact O-CG 3.49Å; N234-Q238 PolarHBondContact O-N 3.23Å; Q238-S240 VanDerWaalsContact C-N 3.29Å; Q238-S240 PolarHBondContact O-N 2.92Å; Q238-P242 WeakPolarHBondContact O-CD 3.32Å
239	A	81.3	Confident	74.5	Confident	72 Å²	72	98.5 Å²	98.5	60%	0.595	50%	0.502	S	S	*	.	H	α-helix	trans	-69.6	-26.9	175.1	0	0	0	0	0	112.8	S235 I236 M237	S235-A239 VanDerWaalsContact O-CB 3.22Å; S235-A239 WeakPolarHBondContact O-CB 3.19Å; S235-A239 PolarHBondContact O-N 2.9Å; I236-A239 PolarHBondContact O-N 3.23Å; M237-A239 PolarHBondContact O-N 3.41Å
240	S	75.2	Confident	73.3	Confident	37 Å²	37	99.5 Å²	99.5	26%	0.259	51%	0.512	S	S	.	.	H	α-helix	trans	-84.9	-22.3	-179.8	75.7	0	0	0	0	114.3	I236 M237 Q238 V243 Q244	I236-S240 WeakPolarHBondContact O-CB 3.29Å; I236-S240 PolarHBondContact O-N 3.39Å; I236-S240 PolarHBondContact O-OG 3.15Å; M237-S240 PolarHBondContact O-N 3.12Å; M237-S240 VanDerWaalsContact O-N 3.13Å; M237-S240 PolarHBondContact O-OG 3.39Å; Q238-S240 VanDerWaalsContact C-N 3.29Å; Q238-S240 PolarHBondContact O-N 2.92Å; S240-V243 PolarHBondContact O-N 2.74Å; S240-Q244 WeakPolarHBondContact O-CG 3.32Å; S240-Q244 PolarHBondContact O-N 3.19Å; S240-Q244 PolarHBondContact OG-NE2 3.36Å
241	L	70.6	Confident	72.2	Confident	59 Å²	59	99.1 Å²	99.1	31%	0.309	51%	0.508	S	S	.	.	H	α-helix	trans	-55.4	-48.5	-178.7	-99.8	146.3	0	0	0	113.8	M237 V243 Q244 E245	M237-L241 PolarHBondContact O-N 3.4Å; M237-L241 VanDerWaalsContact O-N 3.11Å; L241-V243 VanDerWaalsContact C-N 3.28Å; L241-V243 PolarHBondContact O-N 3.45Å; L241-Q244 PolarHBondContact O-N 3.18Å; L241-E245 WeakPolarHBondContact O-CG 3.48Å; L241-E245 PolarHBondContact O-N 3.3Å
242	P	74.7	Confident	70.9	Confident	77 Å²	77	99.3 Å²	99.3	50%	0.5	51%	0.506	S	S	.	.	H	α-helix	trans	-63.4	-33.8	179.4	-20.3	31	0	0	0	112.9	Q238 Y246	Q238-P242 WeakPolarHBondContact O-CD 3.32Å; P242-Y246 VanDerWaalsContact O-CB 3.24Å; P242-Y246 WeakPolarHBondContact O-CB 3.12Å; P242-Y246 PolarHBondContact O-N 3.27Å
243	V	74.4	Confident	69.8	Low	86 Å²	86	97.7 Å²	97.7	52%	0.521	51%	0.506	S	S	.	.	H	α-helix	trans	-74.1	-38.3	178	176.9	0	0	0	0	110.7	S240 L241 Y246 L247	S240-V243 PolarHBondContact O-N 2.74Å; L241-V243 VanDerWaalsContact C-N 3.28Å; L241-V243 PolarHBondContact O-N 3.45Å; V243-Y246 PolarHBondContact O-N 3.29Å; V243-L247 HydrophobicContact CG1-CD1 3.75Å; V243-L247 HydrophobicContact CG1-CG 4.49Å; V243-L247 WeakPolarHBondContact O-CB 3.33Å; V243-L247 WeakPolarHBondContact O-CG 3.31Å; V243-L247 PolarHBondContact O-N 3.22Å
244	Q	62.6	Low	69	Low	47 Å²	47	95.7 Å²	95.7	22%	0.22	50%	0.503	C	S	.	.	H	α-helix	trans	-64.6	-43.2	174.2	-74.3	179.5	25.4	0	0	112.1	S240 L241 F248 M249 F251	S240-Q244 WeakPolarHBondContact O-CG 3.32Å; S240-Q244 PolarHBondContact O-N 3.19Å; S240-Q244 PolarHBondContact OG-NE2 3.36Å; L241-Q244 PolarHBondContact O-N 3.18Å; Q244-F248 PolarHBondContact O-N 3.47Å; Q244-F248 VanDerWaalsContact O-N 3.13Å; Q244-M249 WeakPolarHBondContact CB-O 3.35Å; Q244-M249 PolarHBondContact O-N 2.82Å; Q244-F251 HydrophobicContact CG-CD2 4.5Å
245	E	65.6	Low	68.4	Low	139 Å²	139	97.1 Å²	97.1	65%	0.65	51%	0.507	S	S	*	.	H	α-helix	trans	-64.9	-41.9	175.7	-72.5	176.9	172.3	0	0	111.5	L241 F248	L241-E245 WeakPolarHBondContact O-CG 3.48Å; L241-E245 PolarHBondContact O-N 3.3Å; E245-F248 PolarHBondContact O-N 3.24Å
246	Y	70.7	Confident	67.6	Low	195 Å²	195	98.5 Å²	98.5	77%	0.765	50%	0.503	S	S	*	.	H	α-helix	trans	-68	-35.7	178.8	-172	-100.4	0	0	0	113.4	P242 V243 F248	P242-Y246 VanDerWaalsContact O-CB 3.24Å; P242-Y246 WeakPolarHBondContact O-CB 3.12Å; P242-Y246 PolarHBondContact O-N 3.27Å; V243-Y246 PolarHBondContact O-N 3.29Å; Y246-F248 VanDerWaalsContact C-N 3.34Å
247	L	66.9	Low	67	Low	104 Å²	104	96.7 Å²	96.7	55%	0.545	49%	0.492	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	4.8	178.4	-67.2	171.4	0	0	0	113.5	V243 M249	V243-L247 HydrophobicContact CG1-CD1 3.75Å; V243-L247 HydrophobicContact CG1-CG 4.49Å; V243-L247 WeakPolarHBondContact O-CB 3.33Å; V243-L247 WeakPolarHBondContact O-CG 3.31Å; V243-L247 PolarHBondContact O-N 3.22Å; L247-M249 VanDerWaalsContact C-N 3.27Å; L247-M249 HydrophobicContact CB-CG 4.08Å; L247-M249 VanDerWaalsContact O-CG 3.31Å; L247-M249 WeakPolarHBondContact O-CG 3.35Å; L247-M249 PolarHBondContact O-N 2.71Å
248	F	56.9	Low	67.1	Low	187 Å²	187	98.7 Å²	98.7	82%	0.82	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.3	42.9	-175	-69.9	-89.5	0	0	0	113.2	Q244 E245 Y246 P250	Q244-F248 PolarHBondContact O-N 3.47Å; Q244-F248 VanDerWaalsContact O-N 3.13Å; E245-F248 PolarHBondContact O-N 3.24Å; Y246-F248 VanDerWaalsContact C-N 3.34Å; F248-P250 WeakPolarHBondContact O-CD 3.47Å
249	M	58.5	Low	67.1	Low	88 Å²	88	97.6 Å²	97.6	43%	0.433	49%	0.491	S	S	.	.			trans	-118.8	82.7	-175.4	-70.8	-108.8	-90.9	0	0	110.9	Q244 L247 F251	Q244-M249 WeakPolarHBondContact CB-O 3.35Å; Q244-M249 PolarHBondContact O-N 2.82Å; L247-M249 VanDerWaalsContact C-N 3.27Å; L247-M249 HydrophobicContact CB-CG 4.08Å; L247-M249 VanDerWaalsContact O-CG 3.31Å; L247-M249 WeakPolarHBondContact O-CG 3.35Å; L247-M249 PolarHBondContact O-N 2.71Å; M249-F251 HydrophobicContact CB-CD2 4.04Å; M249-F251 HydrophobicContact CB-CE2 3.67Å; M249-F251 HydrophobicContact CB-CZ 4.28Å; M249-F251 HydrophobicContact CE-CE2 3.57Å; M249-F251 HydrophobicContact CE-CZ 3.37Å; M249-F251 HydrophobicContact CG-CE2 4.33Å; M249-F251 PolarHBondContact O-N 3.3Å; M249-F251 HydrophobicContact SD-CE1 4.48Å; M249-F251 HydrophobicContact SD-CE2 3.95Å; M249-F251 HydrophobicContact SD-CZ 3.64Å
250	P	58.9	Low	66.9	Low	78 Å²	78	96.1 Å²	96.1	51%	0.506	48%	0.475	S	S	.	.			trans	-82	67.8	-178.2	35.1	-34.4	0	0	0	110.6	F248 D252 Q253 A254	F248-P250 WeakPolarHBondContact O-CD 3.47Å; P250-D252 PolarHBondContact O-N 3.39Å; P250-Q253 PolarHBondContact O-N 3.29Å; P250-A254 PolarHBondContact O-N 3.09Å
251	F	58.5	Low	67.2	Low	117 Å²	117	94.4 Å²	94.4	51%	0.513	46%	0.463	S	S	.	.	H	α-helix	trans	-59.8	-31.1	178.6	-70.4	-68.6	0	0	0	112.4	Q244 M249 A254 H255	Q244-F251 HydrophobicContact CG-CD2 4.5Å; M249-F251 HydrophobicContact CB-CD2 4.04Å; M249-F251 HydrophobicContact CB-CE2 3.67Å; M249-F251 HydrophobicContact CB-CZ 4.28Å; M249-F251 HydrophobicContact CE-CE2 3.57Å; M249-F251 HydrophobicContact CE-CZ 3.37Å; M249-F251 HydrophobicContact CG-CE2 4.33Å; M249-F251 PolarHBondContact O-N 3.3Å; M249-F251 HydrophobicContact SD-CE1 4.48Å; M249-F251 HydrophobicContact SD-CE2 3.95Å; M249-F251 HydrophobicContact SD-CZ 3.64Å; F251-A254 PolarHBondContact O-N 3.44Å; F251-H255 WeakPolarHBondContact O-CB 3.46Å; F251-H255 PolarHBondContact O-N 3.39Å
252	D	57.3	Low	67.7	Low	72 Å²	72	99.6 Å²	99.6	39%	0.385	48%	0.478	S	S	.	.	H	α-helix	trans	-69.6	-36.8	-175.5	-157	41.6	0	0	0	112.9	P250 K256	P250-D252 PolarHBondContact O-N 3.39Å; D252-K256 WeakPolarHBondContact O-CB 3.41Å; D252-K256 WeakPolarHBondContact O-CD 3.4Å; D252-K256 VanDerWaalsContact O-CG 3.26Å; D252-K256 WeakPolarHBondContact O-CG 3.16Å; D252-K256 PolarHBondContact O-N 3.47Å; D252-K256 IonicContact OD1-NZ 3Å; D252-K256 IonicContact OD2-NZ 2.8Å; D252-K256 PolarHBondContact OD2-NZ 3.24Å
253	Q	59.9	Low	68.2	Low	139 Å²	139	98 Å²	98	65%	0.65	46%	0.464	S	S	*	.	H	α-helix	trans	-73	-43.7	174.1	-75	179.9	-4.5	0	0	111.6	P250 H255 K256 Q257	P250-Q253 PolarHBondContact O-N 3.29Å; Q253-H255 VanDerWaalsContact C-N 3.3Å; Q253-H255 PolarHBondContact O-N 2.94Å; Q253-K256 PolarHBondContact O-N 3.5Å; Q253-Q257 WeakPolarHBondContact O-CB 3.06Å; Q253-Q257 VanDerWaalsContact O-CG 3.3Å; Q253-Q257 WeakPolarHBondContact O-CG 3.06Å; Q253-Q257 PolarHBondContact O-N 2.92Å
254	A	62.5	Low	68.8	Low	53 Å²	53	94.2 Å²	94.2	44%	0.438	44%	0.441	S	S	.	.	H	α-helix	trans	-63.2	-37.3	176.1	0	0	0	0	0	111.7	P250 F251 Y258	P250-A254 PolarHBondContact O-N 3.09Å; F251-A254 PolarHBondContact O-N 3.44Å; A254-Y258 WeakPolarHBondContact O-CB 3.38Å; A254-Y258 PolarHBondContact O-N 3.16Å
255	H	66.3	Low	70	Confident	102 Å²	102	92.4 Å²	92.4	47%	0.472	43%	0.433	S	S	.	.	H	α-helix	trans	-69.7	-46.2	177.9	-162.7	72.5	0	0	0	111.8	F251 Q253 Q257 Y258 E259	F251-H255 WeakPolarHBondContact O-CB 3.46Å; F251-H255 PolarHBondContact O-N 3.39Å; Q253-H255 VanDerWaalsContact C-N 3.3Å; Q253-H255 PolarHBondContact O-N 2.94Å; H255-Q257 VanDerWaalsContact C-N 3.3Å; H255-Q257 PolarHBondContact O-N 3.49Å; H255-Y258 CarbonylContact O-C 3.43Å; H255-Y258 WeakPolarHBondContact O-CA 3.45Å; H255-Y258 WeakPolarHBondContact O-CB 3.36Å; H255-Y258 PolarHBondContact O-N 2.8Å; H255-E259 IonicContact CD2-OE1 3.63Å; H255-E259 IonicContact NE2-OE1 3.52Å; H255-E259 PolarHBondContact O-N 3.41Å
256	K	68.1	Low	71	Confident	111 Å²	111	90.3 Å²	90.3	48%	0.483	43%	0.431	S	S	.	.	H	α-helix	trans	-58.9	-40.8	173.8	-77.3	167.3	178.2	154.1	0	112.3	D252 Q253 Y258 T260	D252-K256 WeakPolarHBondContact O-CB 3.41Å; D252-K256 WeakPolarHBondContact O-CD 3.4Å; D252-K256 VanDerWaalsContact O-CG 3.26Å; D252-K256 WeakPolarHBondContact O-CG 3.16Å; D252-K256 PolarHBondContact O-N 3.47Å; D252-K256 IonicContact OD1-NZ 3Å; D252-K256 IonicContact OD2-NZ 2.8Å; D252-K256 PolarHBondContact OD2-NZ 3.24Å; Q253-K256 PolarHBondContact O-N 3.5Å; K256-Y258 VanDerWaalsContact C-N 3.34Å; K256-T260 WeakPolarHBondContact O-CB 3.49Å; K256-T260 PolarHBondContact O-N 3.35Å; K256-T260 PolarHBondContact O-OG1 2.96Å
257	Q	68.3	Low	71.8	Confident	72 Å²	72	81.2 Å²	81.2	34%	0.336	40%	0.397	S	S	.	.	H	α-helix	trans	-64.8	-37.9	173.4	-73.2	-178.6	-11.7	0	0	111.8	Q253 H255 T260 A261 F272	Q253-Q257 WeakPolarHBondContact O-CB 3.06Å; Q253-Q257 VanDerWaalsContact O-CG 3.3Å; Q253-Q257 WeakPolarHBondContact O-CG 3.06Å; Q253-Q257 PolarHBondContact O-N 2.92Å; H255-Q257 VanDerWaalsContact C-N 3.3Å; H255-Q257 PolarHBondContact O-N 3.49Å; Q257-T260 PolarHBondContact O-N 2.83Å; Q257-A261 VanDerWaalsContact O-CB 3.27Å; Q257-A261 WeakPolarHBondContact O-CB 3.29Å; Q257-A261 PolarHBondContact O-N 3.15Å; Q257-F272 HydrophobicContact CB-CZ 4.05Å
258	Y	75.7	Confident	72.9	Confident	117 Å²	117	76.3 Å²	76.3	46%	0.459	37%	0.371	S	S	.	.	H	α-helix	trans	-70.9	-38.8	177.4	-157	-94.9	0	0	0	113.1	A254 H255 K256 T260 A261 R262 Y269	A254-Y258 WeakPolarHBondContact O-CB 3.38Å; A254-Y258 PolarHBondContact O-N 3.16Å; H255-Y258 CarbonylContact O-C 3.43Å; H255-Y258 WeakPolarHBondContact O-CA 3.45Å; H255-Y258 WeakPolarHBondContact O-CB 3.36Å; H255-Y258 PolarHBondContact O-N 2.8Å; K256-Y258 VanDerWaalsContact C-N 3.34Å; Y258-T260 VanDerWaalsContact C-N 3.32Å; Y258-A261 WeakPolarHBondContact O-CB 3.28Å; Y258-A261 PolarHBondContact O-N 3.04Å; Y258-R262 PolarHBondContact O-N 3.47Å; Y258-Y269 PolarHBondContact OH-OH 2.92Å
259	E	76.9	Confident	74.4	Confident	98 Å²	98	70.6 Å²	70.6	46%	0.458	34%	0.344	S	S	.	.	H	α-helix	trans	-61.7	-42.1	171.9	-73	-172	152.1	0	0	111.3	H255 A261 R262	H255-E259 IonicContact CD2-OE1 3.63Å; H255-E259 IonicContact NE2-OE1 3.52Å; H255-E259 PolarHBondContact O-N 3.41Å; E259-A261 VanDerWaalsContact C-N 3.34Å; E259-R262 WeakPolarHBondContact O-CB 3.26Å; E259-R262 PolarHBondContact O-N 2.78Å
260	T	77	Confident	75.9	Confident	40 Å²	40	66.9 Å²	66.9	25%	0.245	33%	0.327	C	S	.	.	H	α-helix	trans	-66.6	-38.3	174.6	-51	0	0	0	0	111.1	K256 Q257 Y258 R262 H263 I290 V294	K256-T260 WeakPolarHBondContact O-CB 3.49Å; K256-T260 PolarHBondContact O-N 3.35Å; K256-T260 PolarHBondContact O-OG1 2.96Å; Q257-T260 PolarHBondContact O-N 2.83Å; Y258-T260 VanDerWaalsContact C-N 3.32Å; T260-R262 PolarHBondContact O-N 3.28Å; T260-H263 PolarHBondContact O-N 3.02Å; T260-H263 VanDerWaalsContact O-N 3.16Å; T260-I290 HydrophobicContact CG2-CB 4.14Å; T260-I290 HydrophobicContact CG2-CD1 4.12Å; T260-I290 HydrophobicContact CG2-CG2 3.82Å; T260-V294 HydrophobicContact CG2-CG2 4.09Å
261	A	80.7	Confident	77.3	Confident	1 Å²	1	63.2 Å²	63.2	1%	0.008	30%	0.303	C	S	.	.	H	α-helix	trans	-63.6	-24.3	178.3	0	0	0	0	0	113.4	Q257 Y258 E259 H263 L264 Y269 F272 I290	Q257-A261 VanDerWaalsContact O-CB 3.27Å; Q257-A261 WeakPolarHBondContact O-CB 3.29Å; Q257-A261 PolarHBondContact O-N 3.15Å; Y258-A261 WeakPolarHBondContact O-CB 3.28Å; Y258-A261 PolarHBondContact O-N 3.04Å; E259-A261 VanDerWaalsContact C-N 3.34Å; A261-H263 PolarHBondContact O-N 3.45Å; A261-L264 HydrophobicContact CB-CD1 4.11Å; A261-L264 WeakPolarHBondContact O-CB 3.31Å; A261-L264 PolarHBondContact O-N 3.1Å; A261-Y269 HydrophobicContact CB-CD2 4.14Å; A261-Y269 HydrophobicContact CB-CE2 4.16Å; A261-Y269 WeakPolarHBondContact O-CD2 3.27Å; A261-F272 HydrophobicContact CB-CD1 3.8Å; A261-F272 HydrophobicContact CB-CE1 3.77Å; A261-I290 HydrophobicContact CB-CD1 4Å
262	R	82.3	Confident	78.9	Confident	168 Å²	168	58 Å²	58	63%	0.634	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-24.7	174.9	-70.6	-179.5	172.8	177.2	-0.8	113.5	Y258 E259 T260	Y258-R262 PolarHBondContact O-N 3.47Å; E259-R262 WeakPolarHBondContact O-CB 3.26Å; E259-R262 PolarHBondContact O-N 2.78Å; T260-R262 PolarHBondContact O-N 3.28Å
263	H	85.1	Confident	80.4	Confident	44 Å²	44	56.4 Å²	56.4	20%	0.204	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	2.8	179.8	-61.7	-59	0	0	0	113.1	T260 A261 A297 K298 L346	T260-H263 PolarHBondContact O-N 3.02Å; T260-H263 VanDerWaalsContact O-N 3.16Å; A261-H263 PolarHBondContact O-N 3.45Å; H263-A297 HydrophobicContact CB-CB 4.23Å; H263-K298 VanDerWaalsContact NE2-CE 3.28Å; H263-K298 WeakPolarHBondContact NE2-CE 3.35Å; H263-L346 HydrophobicContact CB-CD1 3.84Å; H263-L346 WeakPolarHBondContact O-CD1 3.41Å
264	L	85.8	Confident	81.7	Confident	7 Å²	7	51.1 Å²	51.1	4%	0.037	25%	0.248	C	C	.	.	S	Bend	trans	-75.2	145.6	176.6	-71.5	175.1	0	0	0	111.6	A261 L268 F272 I290 L346 V348	A261-L264 HydrophobicContact CB-CD1 4.11Å; A261-L264 WeakPolarHBondContact O-CB 3.31Å; A261-L264 PolarHBondContact O-N 3.1Å; L264-L268 HydrophobicContact CB-CB 4.33Å; L264-L268 HydrophobicContact CD2-CB 4.29Å; L264-L268 HydrophobicContact CD2-CD1 4.48Å; L264-F272 HydrophobicContact CD1-CB 4.05Å; L264-F272 HydrophobicContact CD1-CG 4.33Å; L264-I290 HydrophobicContact CD1-CD1 3.76Å; L264-I290 HydrophobicContact CD1-CG1 4.17Å; L264-I290 HydrophobicContact CD2-CG2 3.92Å; L264-I290 HydrophobicContact CG-CD1 4.36Å; L264-L346 HydrophobicContact CD2-CB 3.86Å; L264-L346 HydrophobicContact CD2-CD1 4.22Å; L264-V348 HydrophobicContact CD1-CG2 4.09Å; L264-V348 HydrophobicContact CD2-CG2 4.16Å
265	P	87.3	Confident	82.9	Confident	8 Å²	8	48.6 Å²	48.6	5%	0.052	23%	0.227	C	C	.	.			trans	-55.5	149.1	166	-25.5	34.7	0	0	0	111.4	P267 L268 Y269 H344 Y366	P265-P267 VanDerWaalsContact C-N 3.34Å; P265-L268 HydrophobicContact CG-CD1 4.22Å; P265-L268 PolarHBondContact O-N 3.29Å; P265-Y269 PolarHBondContact O-N 3.23Å; P265-H344 VanDerWaalsContact CD-CE1 3.45Å; P265-H344 WeakPolarHBondContact CD-CE1 3.26Å; P265-H344 HydrophobicContact CG-CB 4.22Å; P265-H344 VanDerWaalsContact CG-CD2 3.47Å; P265-H344 WeakPolarHBondContact CG-CD2 3.44Å; P265-H344 VanDerWaalsContact CG-CG 3.45Å; P265-Y366 HydrophobicContact CB-CD1 3.53Å; P265-Y366 HydrophobicContact CB-CE1 3.75Å; P265-Y366 HydrophobicContact CB-CG 4.1Å; P265-Y366 HydrophobicContact CG-CD1 3.63Å; P265-Y366 HydrophobicContact CG-CE1 4.26Å; P265-Y366 HydrophobicContact CG-CG 4.22Å
266	P	87.2	Confident	83.9	Confident	95 Å²	95	45.3 Å²	45.3	62%	0.617	21%	0.214	S	C	*	.	H	α-helix	trans	-51.5	-43.5	-176.7	-23.7	30.6	0	0	0	114.3	L268 Y269 V270	P266-L268 PolarHBondContact O-N 3.49Å; P266-Y269 PolarHBondContact O-N 2.81Å; P266-V270 WeakPolarHBondContact O-CG2 3.5Å; P266-V270 PolarHBondContact O-N 3.34Å
267	P	88.8	Confident	84.8	Confident	5 Å²	5	42.1 Å²	42.1	3%	0.032	21%	0.208	C	C	.	.	H	α-helix	trans	-66.3	-37.6	178.2	-24.8	38.3	0	0	0	113.9	P265 L271 Y366 G448 L450	P265-P267 VanDerWaalsContact C-N 3.34Å; P267-L271 WeakPolarHBondContact O-CB 3.28Å; P267-L271 PolarHBondContact O-N 3.47Å; P267-Y366 HydrophobicContact CB-CD2 4.45Å; P267-Y366 HydrophobicContact CB-CE2 4.19Å; P267-Y366 HydrophobicContact CG-CD2 4.37Å; P267-Y366 HydrophobicContact CG-CE2 3.67Å; P267-G448 WeakPolarHBondContact CA-O 3.2Å; P267-G448 WeakPolarHBondContact O-CA 3.4Å; P267-L450 HydrophobicContact CB-CD1 4Å; P267-L450 HydrophobicContact CB-CG 4.1Å; P267-L450 HydrophobicContact CG-CD1 3.87Å; P267-L450 HydrophobicContact CG-CD2 3.98Å; P267-L450 HydrophobicContact CG-CG 3.97Å
268	L	89.6	Confident	85.7	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-72.2	-33.6	176.3	-71.2	-174.6	0	0	0	111.8	L264 P265 P266 L271 F272 V348 F364	L264-L268 HydrophobicContact CB-CB 4.33Å; L264-L268 HydrophobicContact CD2-CB 4.29Å; L264-L268 HydrophobicContact CD2-CD1 4.48Å; P265-L268 HydrophobicContact CG-CD1 4.22Å; P265-L268 PolarHBondContact O-N 3.29Å; P266-L268 PolarHBondContact O-N 3.49Å; L268-L271 PolarHBondContact O-N 3.39Å; L268-F272 WeakPolarHBondContact O-CB 2.93Å; L268-F272 PolarHBondContact O-N 3.44Å; L268-V348 HydrophobicContact CB-CG2 4.03Å; L268-V348 HydrophobicContact CD1-CG2 4.46Å; L268-V348 HydrophobicContact CD2-CB 4.48Å; L268-V348 HydrophobicContact CD2-CG2 4.18Å; L268-V348 HydrophobicContact CG-CG2 4.46Å; L268-F364 HydrophobicContact CD2-CB 3.96Å
269	Y	88.3	Confident	86.1	Confident	68 Å²	68	34.8 Å²	34.8	27%	0.267	18%	0.181	S	C	.	.	H	α-helix	trans	-64.7	-46.7	173.5	-179.7	-99.5	0	0	0	111.4	Y258 A261 P265 P266 L271 F272 V273	Y258-Y269 PolarHBondContact OH-OH 2.92Å; A261-Y269 HydrophobicContact CB-CD2 4.14Å; A261-Y269 HydrophobicContact CB-CE2 4.16Å; A261-Y269 WeakPolarHBondContact O-CD2 3.27Å; P265-Y269 PolarHBondContact O-N 3.23Å; P266-Y269 PolarHBondContact O-N 2.81Å; Y269-L271 VanDerWaalsContact C-N 3.31Å; Y269-L271 PolarHBondContact O-N 3.23Å; Y269-F272 PolarHBondContact O-N 3.32Å; Y269-V273 HydrophobicContact CD1-CG2 4.2Å; Y269-V273 HydrophobicContact CE1-CG2 3.77Å; Y269-V273 HydrophobicContact CE2-CG2 4.1Å; Y269-V273 WeakPolarHBondContact O-CG2 3.45Å; Y269-V273 PolarHBondContact O-N 3.37Å
270	V	89	Confident	86.5	Confident	10 Å²	10	37.6 Å²	37.6	6%	0.061	19%	0.194	C	C	.	.	H	α-helix	trans	-56.5	-48.8	174.1	172.2	0	0	0	0	109.9	P266 F272 V273 Q274	P266-V270 WeakPolarHBondContact O-CG2 3.5Å; P266-V270 PolarHBondContact O-N 3.34Å; V270-F272 VanDerWaalsContact C-N 3.34Å; V270-F272 PolarHBondContact O-N 3.38Å; V270-V273 PolarHBondContact O-N 3.45Å; V270-Q274 HydrophobicContact CG1-CG 4.29Å; V270-Q274 WeakPolarHBondContact O-CB 3.38Å; V270-Q274 VanDerWaalsContact O-CG 3.26Å; V270-Q274 WeakPolarHBondContact O-CG 3.46Å; V270-Q274 PolarHBondContact O-N 2.83Å
271	L	89.5	Confident	86.8	Confident	1 Å²	1	39.7 Å²	39.7	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-58.5	-45.2	178	-172.4	145.5	0	0	0	112.3	P267 L268 Y269 Q274 A275 V348 F364 M373 L447	P267-L271 WeakPolarHBondContact O-CB 3.28Å; P267-L271 PolarHBondContact O-N 3.47Å; L268-L271 PolarHBondContact O-N 3.39Å; Y269-L271 VanDerWaalsContact C-N 3.31Å; Y269-L271 PolarHBondContact O-N 3.23Å; L271-Q274 PolarHBondContact O-N 3.18Å; L271-A275 WeakPolarHBondContact O-CB 3.4Å; L271-A275 PolarHBondContact O-N 3.03Å; L271-V348 HydrophobicContact CD2-CB 4.29Å; L271-V348 HydrophobicContact CD2-CG1 3.74Å; L271-F364 HydrophobicContact CD1-CD2 3.41Å; L271-F364 VanDerWaalsContact CD1-CD2 3.41Å; L271-F364 HydrophobicContact CD1-CE2 3.34Å; L271-F364 HydrophobicContact CD1-CG 4.02Å; L271-F364 HydrophobicContact CD1-CZ 3.99Å; L271-F364 HydrophobicContact CD2-CD2 3.63Å; L271-F364 HydrophobicContact CD2-CE2 3.82Å; L271-F364 HydrophobicContact CG-CD2 4.19Å; L271-F364 HydrophobicContact CG-CE2 4.15Å; L271-M373 HydrophobicContact CD1-CE 3.36Å; L271-L447 HydrophobicContact CD1-CB 4.21Å
272	F	90.6	Very high	86.7	Confident	7 Å²	7	43.8 Å²	43.8	3%	0.031	24%	0.243	C	C	.	.	H	α-helix	trans	-61.5	-46.8	178.9	175.4	-99.8	0	0	0	112	Q257 A261 L264 L268 Y269 V270 Q274 A275 T276 V288 I290	Q257-F272 HydrophobicContact CB-CZ 4.05Å; A261-F272 HydrophobicContact CB-CD1 3.8Å; A261-F272 HydrophobicContact CB-CE1 3.77Å; L264-F272 HydrophobicContact CD1-CB 4.05Å; L264-F272 HydrophobicContact CD1-CG 4.33Å; L268-F272 WeakPolarHBondContact O-CB 2.93Å; L268-F272 PolarHBondContact O-N 3.44Å; Y269-F272 PolarHBondContact O-N 3.32Å; V270-F272 VanDerWaalsContact C-N 3.34Å; V270-F272 PolarHBondContact O-N 3.38Å; F272-Q274 VanDerWaalsContact C-N 3.35Å; F272-Q274 PolarHBondContact O-N 3.48Å; F272-A275 PolarHBondContact O-N 2.86Å; F272-T276 HydrophobicContact CD1-CG2 4.5Å; F272-T276 HydrophobicContact CD2-CG2 4.31Å; F272-T276 HydrophobicContact CE1-CG2 4.07Å; F272-T276 HydrophobicContact CE2-CG2 3.86Å; F272-T276 HydrophobicContact CZ-CG2 3.71Å; F272-T276 WeakPolarHBondContact O-CB 3.35Å; F272-T276 WeakPolarHBondContact O-CG2 2.99Å; F272-T276 PolarHBondContact O-N 2.84Å; F272-T276 PolarHBondContact O-OG1 3.06Å; F272-V288 HydrophobicContact CD2-CG2 4.37Å; F272-V288 HydrophobicContact CE2-CG2 3.89Å; F272-I290 HydrophobicContact CD2-CD1 4.11Å; F272-I290 HydrophobicContact CD2-CG1 4.09Å; F272-I290 HydrophobicContact CE2-CD1 3.99Å; F272-I290 HydrophobicContact CE2-CG1 4.13Å; F272-I290 HydrophobicContact CZ-CD1 4.32Å
273	V	89.1	Confident	86.6	Confident	38 Å²	38	37.2 Å²	37.2	23%	0.23	22%	0.22	C	C	.	.	H	α-helix	trans	-61.4	-43.6	176.5	172.9	0	0	0	0	111.1	Y269 V270 T276 A277	Y269-V273 HydrophobicContact CD1-CG2 4.2Å; Y269-V273 HydrophobicContact CE1-CG2 3.77Å; Y269-V273 HydrophobicContact CE2-CG2 4.1Å; Y269-V273 WeakPolarHBondContact O-CG2 3.45Å; Y269-V273 PolarHBondContact O-N 3.37Å; V270-V273 PolarHBondContact O-N 3.45Å; V273-T276 WeakPolarHBondContact CA-OG1 3.14Å; V273-T276 PolarHBondContact O-OG1 2.78Å; V273-A277 VanDerWaalsContact O-CB 3.23Å; V273-A277 WeakPolarHBondContact O-CB 3.18Å; V273-A277 PolarHBondContact O-N 3.38Å
274	Q	87.7	Confident	86.6	Confident	28 Å²	28	43.9 Å²	43.9	13%	0.131	25%	0.248	C	C	.	.	H	α-helix	trans	-69.9	-36.4	179.3	-65.9	-55.8	112	0	0	112.6	V270 L271 F272 Y278 A469 M472	V270-Q274 HydrophobicContact CG1-CG 4.29Å; V270-Q274 WeakPolarHBondContact O-CB 3.38Å; V270-Q274 VanDerWaalsContact O-CG 3.26Å; V270-Q274 WeakPolarHBondContact O-CG 3.46Å; V270-Q274 PolarHBondContact O-N 2.83Å; L271-Q274 PolarHBondContact O-N 3.18Å; F272-Q274 VanDerWaalsContact C-N 3.35Å; F272-Q274 PolarHBondContact O-N 3.48Å; Q274-Y278 WeakPolarHBondContact O-CB 3.5Å; Q274-Y278 PolarHBondContact O-N 2.69Å; Q274-A469 VanDerWaalsContact NE2-CB 3.3Å; Q274-M472 HydrophobicContact CB-CE 4.27Å
275	A	87.7	Confident	86.6	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-70.4	-43.8	179.2	0	0	0	0	0	111.8	L271 F272 Y278 G279 L286 V288 M472	L271-A275 WeakPolarHBondContact O-CB 3.4Å; L271-A275 PolarHBondContact O-N 3.03Å; F272-A275 PolarHBondContact O-N 2.86Å; A275-Y278 PolarHBondContact O-N 3.02Å; A275-G279 PolarHBondContact O-N 3.02Å; A275-L286 HydrophobicContact CB-CD2 4.39Å; A275-V288 HydrophobicContact CB-CG1 3.61Å; A275-M472 HydrophobicContact CB-CE 3.54Å
276	T	86.8	Confident	86.6	Confident	33 Å²	33	45.7 Å²	45.7	20%	0.202	26%	0.259	C	S	.	.	H	α-helix	trans	-60.5	-46	171.9	49.1	0	0	0	0	111.5	F272 V273 Y278 G279 Q280 V288	F272-T276 HydrophobicContact CD1-CG2 4.5Å; F272-T276 HydrophobicContact CD2-CG2 4.31Å; F272-T276 HydrophobicContact CE1-CG2 4.07Å; F272-T276 HydrophobicContact CE2-CG2 3.86Å; F272-T276 HydrophobicContact CZ-CG2 3.71Å; F272-T276 WeakPolarHBondContact O-CB 3.35Å; F272-T276 WeakPolarHBondContact O-CG2 2.99Å; F272-T276 PolarHBondContact O-N 2.84Å; F272-T276 PolarHBondContact O-OG1 3.06Å; V273-T276 WeakPolarHBondContact CA-OG1 3.14Å; V273-T276 PolarHBondContact O-OG1 2.78Å; T276-Y278 PolarHBondContact O-N 2.73Å; T276-G279 PolarHBondContact O-N 3.09Å; T276-Q280 WeakPolarHBondContact O-CB 3.46Å; T276-Q280 WeakPolarHBondContact O-CG 3.48Å; T276-Q280 PolarHBondContact O-N 3.34Å; T276-V288 HydrophobicContact CG2-CG2 3.6Å
277	A	86.8	Confident	86.6	Confident	44 Å²	44	44.5 Å²	44.5	36%	0.364	25%	0.253	S	S	.	.	H	α-helix	trans	-60	-46.2	177.2	0	0	0	0	0	112.3	V273 Q280 A281	V273-A277 VanDerWaalsContact O-CB 3.23Å; V273-A277 WeakPolarHBondContact O-CB 3.18Å; V273-A277 PolarHBondContact O-N 3.38Å; A277-Q280 PolarHBondContact O-N 3.39Å; A277-A281 WeakPolarHBondContact O-CB 3.5Å; A277-A281 PolarHBondContact O-N 2.87Å
278	Y	87.5	Confident	86.7	Confident	24 Å²	24	45.4 Å²	45.4	9%	0.094	26%	0.258	C	S	.	.	H	α-helix	trans	-64.5	-42	177.8	-177.7	-100.9	0	0	0	112.5	Q274 A275 T276 Q280 A281 C282 D283 L286 M472 E473 M476	Q274-Y278 WeakPolarHBondContact O-CB 3.5Å; Q274-Y278 PolarHBondContact O-N 2.69Å; A275-Y278 PolarHBondContact O-N 3.02Å; T276-Y278 PolarHBondContact O-N 2.73Å; Y278-Q280 VanDerWaalsContact C-N 3.31Å; Y278-Q280 PolarHBondContact O-N 2.81Å; Y278-A281 PolarHBondContact O-N 3.47Å; Y278-C282 HydrophobicContact CD2-CB 4.06Å; Y278-C282 HydrophobicContact CE2-CB 3.76Å; Y278-C282 PolarHBondContact O-N 2.9Å; Y278-D283 HydrophobicContact CD1-CB 4.48Å; Y278-D283 HydrophobicContact CE1-CB 3.82Å; Y278-D283 PolarHBondContact O-N 2.89Å; Y278-L286 HydrophobicContact CD1-CD1 3.79Å; Y278-L286 HydrophobicContact CE1-CD1 4.33Å; Y278-M472 HydrophobicContact CD2-CG 4.4Å; Y278-M472 HydrophobicContact CG-CG 4.14Å; Y278-E473 HydrophobicContact CE2-CB 3.87Å; Y278-E473 HydrophobicContact CE2-CG 3.98Å; Y278-M476 HydrophobicContact CD1-CG 4.21Å; Y278-M476 HydrophobicContact CE1-CB 3.92Å; Y278-M476 HydrophobicContact CE1-CG 3.88Å
279	G	85.6	Confident	86.6	Confident	12 Å²	12	46.9 Å²	46.9	12%	0.124	27%	0.271	C	S	.	.	H	α-helix	trans	-63	-35.6	177.6	0	0	0	0	0	113.3	A275 T276 D283 K284	A275-G279 PolarHBondContact O-N 3.02Å; T276-G279 PolarHBondContact O-N 3.09Å; G279-D283 WeakPolarHBondContact CA-O 3.45Å; G279-D283 CarbonylContact O-C 3.29Å; G279-D283 VanDerWaalsContact O-C 3.29Å; G279-K284 PolarHBondContact O-N 3.22Å
280	Q	83.8	Confident	86.7	Confident	156 Å²	156	45.1 Å²	45.1	73%	0.729	27%	0.266	S	S	*	.	H	α-helix	trans	-79	-40.5	176.9	-70.2	176.5	2.7	0	0	112.9	T276 A277 Y278	T276-Q280 WeakPolarHBondContact O-CB 3.46Å; T276-Q280 WeakPolarHBondContact O-CG 3.48Å; T276-Q280 PolarHBondContact O-N 3.34Å; A277-Q280 PolarHBondContact O-N 3.39Å; Y278-Q280 VanDerWaalsContact C-N 3.31Å; Y278-Q280 PolarHBondContact O-N 2.81Å
281	A	83	Confident	86.5	Confident	84 Å²	84	49.8 Å²	49.8	69%	0.694	29%	0.287	S	S	*	.	H	α-helix	trans	-83.7	-45.2	-170.9	0	0	0	0	0	113.6	A277 Y278	A277-A281 WeakPolarHBondContact O-CB 3.5Å; A277-A281 PolarHBondContact O-N 2.87Å; Y278-A281 PolarHBondContact O-N 3.47Å
282	C	79.9	Confident	86.3	Confident	87 Å²	87	52.2 Å²	52.2	59%	0.588	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.4	-42.5	-168.5	-62	0	0	0	0	112.6	Y278	Y278-C282 HydrophobicContact CD2-CB 4.06Å; Y278-C282 HydrophobicContact CE2-CB 3.76Å; Y278-C282 PolarHBondContact O-N 2.9Å
283	D	80.7	Confident	86	Confident	30 Å²	30	54 Å²	54	16%	0.16	33%	0.326	C	S	.	.			trans	-143.5	98.5	-165.3	-162.6	-11.9	0	0	0	114.2	Y278 G279 T285 L286 K480	Y278-D283 HydrophobicContact CD1-CB 4.48Å; Y278-D283 HydrophobicContact CE1-CB 3.82Å; Y278-D283 PolarHBondContact O-N 2.89Å; G279-D283 WeakPolarHBondContact CA-O 3.45Å; G279-D283 CarbonylContact O-C 3.29Å; G279-D283 VanDerWaalsContact O-C 3.29Å; D283-T285 PolarHBondContact O-N 2.85Å; D283-T285 VanDerWaalsContact OD1-CB 3.24Å; D283-T285 WeakPolarHBondContact OD1-CB 3.25Å; D283-T285 WeakPolarHBondContact OD1-CG2 3.21Å; D283-T285 PolarHBondContact OD1-N 3.37Å; D283-T285 PolarHBondContact OD1-OG1 2.92Å; D283-T285 PolarHBondContact OD2-OG1 3.47Å; D283-T285 VanDerWaalsContact OD2-OG1 3.12Å; D283-L286 PolarHBondContact O-N 2.98Å; D283-K480 IonicContact OD1-NZ 3.98Å; D283-K480 IonicContact OD2-NZ 3.13Å; D283-K480 PolarHBondContact OD2-NZ 2.95Å
284	K	83.5	Confident	85.6	Confident	184 Å²	184	54.2 Å²	54.2	80%	0.8	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	2.8	176.4	-58.1	-176.2	-180	-177.2	0	113.7	G279 L286	G279-K284 PolarHBondContact O-N 3.22Å; K284-L286 VanDerWaalsContact C-N 3.32Å
285	T	86.3	Confident	85.2	Confident	38 Å²	38	58.6 Å²	58.6	23%	0.233	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-1.8	174.9	69.4	0	0	0	0	114.3	D283 K353 K480	D283-T285 PolarHBondContact O-N 2.85Å; D283-T285 VanDerWaalsContact OD1-CB 3.24Å; D283-T285 WeakPolarHBondContact OD1-CB 3.25Å; D283-T285 WeakPolarHBondContact OD1-CG2 3.21Å; D283-T285 PolarHBondContact OD1-N 3.37Å; D283-T285 PolarHBondContact OD1-OG1 2.92Å; D283-T285 PolarHBondContact OD2-OG1 3.47Å; D283-T285 VanDerWaalsContact OD2-OG1 3.12Å; T285-K353 VanDerWaalsContact CA-CE 3.42Å; T285-K353 HydrophobicContact CG2-CD 4.44Å; T285-K353 HydrophobicContact CG2-CG 4.08Å; T285-K353 WeakPolarHBondContact O-CG 3.18Å; T285-K353 PolarHBondContact O-N 3.43Å; T285-K480 PolarHBondContact OG1-NZ 3.49Å
286	L	88.1	Confident	84.8	Confident	15 Å²	15	64.4 Å²	64.4	8%	0.079	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	125.2	176.7	-169.7	156.7	0	0	0	110.6	A275 Y278 D283 K284 V288 L352 M476	A275-L286 HydrophobicContact CB-CD2 4.39Å; Y278-L286 HydrophobicContact CD1-CD1 3.79Å; Y278-L286 HydrophobicContact CE1-CD1 4.33Å; D283-L286 PolarHBondContact O-N 2.98Å; K284-L286 VanDerWaalsContact C-N 3.32Å; L286-V288 HydrophobicContact CD2-CG1 3.44Å; L286-V288 VanDerWaalsContact CD2-CG1 3.44Å; L286-L352 HydrophobicContact CB-CD2 3.84Å; L286-L352 HydrophobicContact CD1-CD2 3.57Å; L286-L352 HydrophobicContact CG-CD2 3.6Å; L286-M476 HydrophobicContact CD1-CE 3.8Å; L286-M476 HydrophobicContact CD1-SD 3.91Å
287	S	87	Confident	84.3	Confident	71 Å²	71	62.8 Å²	62.8	50%	0.497	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	143.4	171	-61.8	0	0	0	0	110.2	L350 D351	S287-L350 WeakPolarHBondContact O-CA 3.26Å; S287-D351 PolarHBondContact N-O 3.38Å; S287-D351 PolarHBondContact O-N 3.49Å
288	V	89.5	Confident	83.8	Confident	23 Å²	23	65.4 Å²	65.4	14%	0.139	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	140.9	176.6	-62.2	0	0	0	0	111.1	F272 A275 T276 L286 M349	F272-V288 HydrophobicContact CD2-CG2 4.37Å; F272-V288 HydrophobicContact CE2-CG2 3.89Å; A275-V288 HydrophobicContact CB-CG1 3.61Å; T276-V288 HydrophobicContact CG2-CG2 3.6Å; L286-V288 HydrophobicContact CD2-CG1 3.44Å; L286-V288 VanDerWaalsContact CD2-CG1 3.44Å; V288-M349 WeakPolarHBondContact CA-O 3.45Å
289	A	88.6	Confident	83.1	Confident	32 Å²	32	67.4 Å²	67.4	26%	0.264	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	149	174.6	0	0	0	0	0	110.2	M349	A289-M349 PolarHBondContact N-O 3.3Å; A289-M349 PolarHBondContact O-N 2.89Å
290	I	89.7	Confident	82.2	Confident	30 Å²	30	70.5 Å²	70.5	15%	0.154	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	122	171.8	-59.4	167.2	0	0	0	106.7	T260 A261 L264 F272 L346	T260-I290 HydrophobicContact CG2-CB 4.14Å; T260-I290 HydrophobicContact CG2-CD1 4.12Å; T260-I290 HydrophobicContact CG2-CG2 3.82Å; A261-I290 HydrophobicContact CB-CD1 4Å; L264-I290 HydrophobicContact CD1-CD1 3.76Å; L264-I290 HydrophobicContact CD1-CG1 4.17Å; L264-I290 HydrophobicContact CD2-CG2 3.92Å; L264-I290 HydrophobicContact CG-CD1 4.36Å; F272-I290 HydrophobicContact CD2-CD1 4.11Å; F272-I290 HydrophobicContact CD2-CG1 4.09Å; F272-I290 HydrophobicContact CE2-CD1 3.99Å; F272-I290 HydrophobicContact CE2-CG1 4.13Å; F272-I290 HydrophobicContact CZ-CD1 4.32Å; I290-L346 HydrophobicContact CG2-CD2 4.48Å
291	E	86.2	Confident	80.9	Confident	108 Å²	108	68.9 Å²	68.9	51%	0.505	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	139.1	-177.9	-73.2	-67.6	161.4	0	0	109.9	L346 S347 M349	E291-L346 WeakPolarHBondContact O-CA 3.39Å; E291-S347 PolarHBondContact N-O 3.47Å; E291-S347 PolarHBondContact O-N 3.31Å; E291-M349 HydrophobicContact CG-CB 4.32Å
292	G	85.1	Confident	79.1	Confident	52 Å²	52	72.6 Å²	72.6	54%	0.536	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	131.9	-175.1	174.3	0	0	0	0	0	115.3	P345	G292-P345 VanDerWaalsContact CA-O 3.29Å; G292-P345 WeakPolarHBondContact CA-O 3.43Å
293	S	82.8	Confident	77.1	Confident	46 Å²	46	73.4 Å²	73.4	32%	0.322	40%	0.402	S	S	.	.			trans	-91.4	114.4	-178.3	-177.8	0	0	0	0	111.8	D295 E296 A297	S293-D295 VanDerWaalsContact C-N 3.29Å; S293-E296 PolarHBondContact OG-N 2.92Å; S293-A297 PolarHBondContact O-N 3.04Å
294	V	81.8	Confident	75.2	Confident	41 Å²	41	77.3 Å²	77.3	25%	0.248	43%	0.429	C	S	.	.	H	α-helix	trans	-68.9	-30.2	176	-176.9	0	0	0	0	111.5	T260 A297 K298 L346	T260-V294 HydrophobicContact CG2-CG2 4.09Å; V294-A297 PolarHBondContact O-N 3.25Å; V294-K298 HydrophobicContact CG1-CD 4.32Å; V294-K298 WeakPolarHBondContact O-CG 3.42Å; V294-K298 PolarHBondContact O-N 3.15Å; V294-L346 HydrophobicContact CG2-CD2 4.36Å
295	D	79.5	Confident	72.8	Confident	120 Å²	120	77.5 Å²	77.5	64%	0.642	43%	0.433	S	S	*	.	H	α-helix	trans	-71.4	-40.1	-178.4	-66.7	-27.5	0	0	0	111.8	S293 A297 K298 A299	S293-D295 VanDerWaalsContact C-N 3.29Å; D295-A297 VanDerWaalsContact C-N 3.35Å; D295-K298 PolarHBondContact O-N 3.24Å; D295-A299 PolarHBondContact O-N 3.14Å; D295-A299 VanDerWaalsContact O-N 3.09Å
296	E	77.8	Confident	70.5	Confident	122 Å²	122	83 Å²	83	57%	0.57	46%	0.461	S	S	*	.	H	α-helix	trans	-66.6	-37.2	172.5	-70.9	-173.2	175.5	0	0	111.8	S293 A299 L300 P345	S293-E296 PolarHBondContact OG-N 2.92Å; E296-A299 PolarHBondContact O-N 3.38Å; E296-L300 PolarHBondContact O-N 2.85Å; E296-P345 HydrophobicContact CB-CB 3.79Å; E296-P345 HydrophobicContact CB-CG 3.91Å; E296-P345 WeakPolarHBondContact OE2-CB 3.4Å
297	A	76.4	Confident	68	Low	0 Å²	0	86.9 Å²	86.9	0%	0	49%	0.489	C	S	.	.	H	α-helix	trans	-64.6	-41.1	175.2	0	0	0	0	0	112.1	H263 S293 V294 D295 A299 L300 F301 P345 L346	H263-A297 HydrophobicContact CB-CB 4.23Å; S293-A297 PolarHBondContact O-N 3.04Å; V294-A297 PolarHBondContact O-N 3.25Å; D295-A297 VanDerWaalsContact C-N 3.35Å; A297-A299 VanDerWaalsContact C-N 3.3Å; A297-A299 PolarHBondContact O-N 3.24Å; A297-L300 PolarHBondContact O-N 3.13Å; A297-F301 WeakPolarHBondContact O-CD2 3.49Å; A297-F301 PolarHBondContact O-N 2.92Å; A297-P345 HydrophobicContact CB-CG 4.2Å; A297-L346 HydrophobicContact CB-CD1 3.58Å; A297-L346 HydrophobicContact CB-CG 3.81Å
298	K	76.3	Confident	65.6	Low	98 Å²	98	91.2 Å²	91.2	43%	0.426	50%	0.502	S	S	.	.	H	α-helix	trans	-63.5	-35.2	174.4	-76.7	172.1	-178.8	167.3	0	112.5	H263 V294 D295 L300 F301 K302	H263-K298 VanDerWaalsContact NE2-CE 3.28Å; H263-K298 WeakPolarHBondContact NE2-CE 3.35Å; V294-K298 HydrophobicContact CG1-CD 4.32Å; V294-K298 WeakPolarHBondContact O-CG 3.42Å; V294-K298 PolarHBondContact O-N 3.15Å; D295-K298 PolarHBondContact O-N 3.24Å; K298-L300 VanDerWaalsContact C-N 3.29Å; K298-L300 PolarHBondContact O-N 3.29Å; K298-F301 PolarHBondContact O-N 3.02Å; K298-K302 PolarHBondContact O-N 3.28Å
299	A	72.6	Confident	63	Low	67 Å²	67	97.3 Å²	97.3	55%	0.554	53%	0.533	S	S	*	.	H	α-helix	trans	-65.6	-31.9	176	0	0	0	0	0	112.5	D295 E296 A297	D295-A299 PolarHBondContact O-N 3.14Å; D295-A299 VanDerWaalsContact O-N 3.09Å; E296-A299 PolarHBondContact O-N 3.38Å; A297-A299 VanDerWaalsContact C-N 3.3Å; A297-A299 PolarHBondContact O-N 3.24Å
300	L	66.8	Low	60.3	Low	76 Å²	76	102.3 Å²	102.3	40%	0.398	56%	0.556	S	S	.	*	H	α-helix	trans	-74.6	-25.2	175	-67.8	169.1	0	0	0	113.5	E296 A297 K298 P345 M368	E296-L300 PolarHBondContact O-N 2.85Å; A297-L300 PolarHBondContact O-N 3.13Å; K298-L300 VanDerWaalsContact C-N 3.29Å; K298-L300 PolarHBondContact O-N 3.29Å; L300-P345 HydrophobicContact CD1-CG 3.87Å; L300-M368 HydrophobicContact CD1-CE 4.29Å
301	F	57.4	Low	57.8	Low	123 Å²	123	109.7 Å²	109.7	54%	0.539	59%	0.59	S	S	.	*	H	α-helix	trans	-82.5	-17.2	177.3	-93.8	-82.2	0	0	0	113.8	A297 K298 P303	A297-F301 WeakPolarHBondContact O-CD2 3.49Å; A297-F301 PolarHBondContact O-N 2.92Å; K298-F301 PolarHBondContact O-N 3.02Å; F301-P303 WeakPolarHBondContact O-CD 3.29Å
302	K	45	Very low	55.4	Low	161 Å²	161	109.2 Å²	109.2	70%	0.7	60%	0.598	S	S	*	*	S	Bend	trans	-68.5	119.1	169.2	-76.4	-173	176.2	-174.6	0	107.1	K298	K298-K302 PolarHBondContact O-N 3.28Å
303	P	38.9	Very low	53.4	Low	104 Å²	104	114.2 Å²	114.2	68%	0.675	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-54.4	143.1	166.9	24.2	-30	0	0	0	107.2	F301 E305	F301-P303 WeakPolarHBondContact O-CD 3.29Å; P303-E305 PolarHBondContact O-N 3Å
304	P	40.8	Very low	51	Low	112 Å²	112	116.8 Å²	116.8	73%	0.727	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-53.5	117.1	166.3	23.5	-28.5	0	0	0	105.7	D306	P304-D306 PolarHBondContact O-N 2.67Å
305	E	32.9	Very low	49.1	Very low	188 Å²	188	122.8 Å²	122.8	88%	0.879	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-51.7	128.7	165.4	-78.8	-172.8	159.1	0	0	106.1	P303 S307	P303-E305 PolarHBondContact O-N 3Å; E305-S307 PolarHBondContact O-N 2.9Å
306	D	37.2	Very low	47	Very low	155 Å²	155	121.3 Å²	121.3	83%	0.829	67%	0.666	S	S	*	*			trans	-32.3	95.5	-178.4	-68.3	-48.9	0	0	0	111.5	P304 Q308	P304-D306 PolarHBondContact O-N 2.67Å; D306-Q308 PolarHBondContact O-N 3.01Å
307	S	36.3	Very low	45.4	Very low	96 Å²	96	124.7 Å²	124.7	67%	0.671	68%	0.682	S	S	*	*			trans	-72.9	88	155.6	56.7	0	0	0	0	104.2	E305 D309	E305-S307 PolarHBondContact O-N 2.9Å; S307-D309 PolarHBondContact O-N 3.19Å
308	Q	35.1	Very low	43.5	Very low	162 Å²	162	133.6 Å²	133.6	76%	0.757	72%	0.723	S	S	*	*			trans	-46.7	114.3	163.1	-73.2	177.8	-46.3	0	0	107.2	D306 D310	D306-Q308 PolarHBondContact O-N 3.01Å; Q308-D310 PolarHBondContact O-N 2.93Å
309	D	36.7	Very low	41.8	Very low	150 Å²	150	138 Å²	138	80%	0.802	75%	0.745	S	S	*	*			trans	-62.1	81.4	161.9	-70.8	-40.5	0	0	0	107.6	S307 E311	S307-D309 PolarHBondContact O-N 3.19Å; D309-E311 PolarHBondContact O-N 3.04Å
310	D	31.4	Very low	40.1	Very low	138 Å²	138	143.7 Å²	143.7	74%	0.738	76%	0.76	S	S	*	*			trans	-87.2	73.2	157.7	-85.6	-26.6	0	0	0	107.6	Q308 S312	Q308-D310 PolarHBondContact O-N 2.93Å; D310-S312 PolarHBondContact O-N 2.9Å
311	E	37.7	Very low	38.7	Very low	185 Å²	185	146.3 Å²	146.3	86%	0.864	78%	0.78	S	S	*	*			trans	-68.7	76.6	154.2	-77.6	-81.6	171.2	0	0	107.1	D309	D309-E311 PolarHBondContact O-N 3.04Å
312	S	34.6	Very low	37.7	Very low	97 Å²	97	146.4 Å²	146.4	68%	0.678	79%	0.79	S	S	*	*			trans	-97.3	93.6	167	-158.6	0	0	0	0	108.3	D310 S314	D310-S312 PolarHBondContact O-N 2.9Å; S312-S314 PolarHBondContact O-N 3.08Å; S312-S314 VanDerWaalsContact O-N 3.1Å
313	D	43.8	Very low	37.5	Very low	157 Å²	157	149.2 Å²	149.2	84%	0.84	80%	0.803	S	S	*	*			trans	-43.4	105.9	165.6	-158.3	9.5	0	0	0	110.2
314	S	31.6	Very low	37.5	Very low	100 Å²	100	155.2 Å²	155.2	70%	0.699	81%	0.812	S	S	*	*			trans	-137.8	97.1	167.1	47.9	0	0	0	0	109.9	S312 A316	S312-S314 PolarHBondContact O-N 3.08Å; S312-S314 VanDerWaalsContact O-N 3.1Å; S314-A316 PolarHBondContact O-N 3.07Å; S314-A316 VanDerWaalsContact O-N 3.13Å
315	D	42.8	Very low	37.7	Very low	167 Å²	167	161.4 Å²	161.4	89%	0.893	82%	0.821	S	S	*	*			trans	-48.3	107.4	154.7	-107.8	-19.4	0	0	0	109.3
316	A	35.3	Very low	38.1	Very low	90 Å²	90	163.7 Å²	163.7	74%	0.744	82%	0.821	S	S	*	*			trans	-145.6	101.2	161.2	0	0	0	0	0	108.3	S314 E318	S314-A316 PolarHBondContact O-N 3.07Å; S314-A316 VanDerWaalsContact O-N 3.13Å; A316-E318 PolarHBondContact O-N 3.18Å
317	E	44.5	Very low	38.3	Very low	193 Å²	193	160 Å²	160	90%	0.902	81%	0.806	S	S	*	*			trans	-55.7	123	161	-65.3	-164.4	152	0	0	109.2
318	E	35.3	Very low	39.1	Very low	187 Å²	187	160.6 Å²	160.6	87%	0.874	81%	0.806	S	S	*	*			trans	-154	120.5	144.8	-114.7	176.8	-160.4	0	0	110.7	A316 Q320	A316-E318 PolarHBondContact O-N 3.18Å; E318-Q320 PolarHBondContact O-N 3.16Å
319	E	42.2	Very low	40.1	Very low	190 Å²	190	159.4 Å²	159.4	89%	0.888	80%	0.804	S	S	*	*			trans	-56.2	124.9	170.4	-70.6	178.4	125.8	0	0	110.4
320	Q	35.2	Very low	41.1	Very low	186 Å²	186	154.2 Å²	154.2	87%	0.869	79%	0.786	S	S	*	*			trans	-152	134.8	146.2	-113.5	168.4	55.7	0	0	113.4	E318	E318-Q320 PolarHBondContact O-N 3.16Å
321	T	39	Very low	42.5	Very low	132 Å²	132	151 Å²	151	81%	0.81	77%	0.771	S	S	*	*			trans	-69.7	116.9	-168.7	52.3	0	0	0	0	113
322	T	34.5	Very low	43.7	Very low	124 Å²	124	146.5 Å²	146.5	76%	0.761	75%	0.75	S	S	*	*			trans	-149.8	128.3	136.9	51.5	0	0	0	0	109.5	R324	T322-R324 VanDerWaalsContact C-N 3.27Å; T322-R324 PolarHBondContact O-N 2.99Å
323	K	41.8	Very low	45.3	Very low	221 Å²	221	145.1 Å²	145.1	96%	0.961	74%	0.735	S	S	*	*			trans	-67	80.6	176	-70.5	177.2	177.1	174.9	0	110.3
324	R	39	Very low	46.5	Very low	229 Å²	229	141.3 Å²	141.3	86%	0.864	71%	0.714	S	S	*	*			trans	-90.5	110.9	157.3	-88.4	-177.1	170.4	-180	-2.1	108	T322 R326	T322-R324 VanDerWaalsContact C-N 3.27Å; T322-R324 PolarHBondContact O-N 2.99Å; R324-R326 PolarHBondContact O-N 2.99Å
325	R	44.5	Very low	48.7	Very low	243 Å²	243	140.9 Å²	140.9	92%	0.917	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-50.2	121.3	170.2	-77.7	175.9	166.9	175.9	-4.7	108.6
326	R	40.8	Very low	50.3	Low	235 Å²	235	138.2 Å²	138.2	89%	0.887	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-54	129.7	165.1	-74	178.5	179.1	174.2	-1.3	107.9	R324 T328	R324-R326 PolarHBondContact O-N 2.99Å; R326-T328 PolarHBondContact O-N 2.74Å
327	P	42.8	Very low	52.3	Low	78 Å²	78	136.9 Å²	136.9	51%	0.506	66%	0.661	S	S	.	*	P	Polyproline II helix	trans	-62.6	128.9	174.5	-11.8	24.8	0	0	0	108.5	V331 Q332	P327-V331 HydrophobicContact CB-CB 4.32Å; P327-Q332 HydrophobicContact CB-CG 4.33Å
328	T	52.2	Low	54	Low	109 Å²	109	134.9 Å²	134.9	67%	0.669	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-57.7	139.9	170.7	-13.4	0	0	0	0	108.7	R326 G330 V331	R326-T328 PolarHBondContact O-N 2.74Å; T328-G330 PolarHBondContact O-N 2.95Å; T328-V331 WeakPolarHBondContact O-CB 3.45Å; T328-V331 PolarHBondContact O-N 2.92Å
329	L	55.8	Low	56.2	Low	136 Å²	136	132 Å²	132	71%	0.712	64%	0.636	S	S	*	*	H	α-helix	trans	-44.7	-31.3	-179.8	-100.3	142.1	0	0	0	114.5	Q332 L333	L329-Q332 PolarHBondContact O-N 2.97Å; L329-L333 PolarHBondContact O-N 2.82Å
330	G	58.7	Low	58	Low	42 Å²	42	124.6 Å²	124.6	43%	0.433	60%	0.601	S	S	.	*	H	α-helix	trans	-64.5	-36.8	174.5	0	0	0	0	0	114.7	T328 L333 D334	T328-G330 PolarHBondContact O-N 2.95Å; G330-L333 PolarHBondContact O-N 3.22Å; G330-D334 PolarHBondContact O-N 3.23Å; G330-D334 VanDerWaalsContact O-N 3.1Å
331	V	61.3	Low	60.3	Low	70 Å²	70	116.8 Å²	116.8	42%	0.424	57%	0.565	S	S	.	*	H	α-helix	trans	-68.6	-37.4	178.7	-176.7	0	0	0	0	110.7	P327 T328 L333 D334 D335	P327-V331 HydrophobicContact CB-CB 4.32Å; T328-V331 WeakPolarHBondContact O-CB 3.45Å; T328-V331 PolarHBondContact O-N 2.92Å; V331-L333 VanDerWaalsContact C-N 3.35Å; V331-L333 PolarHBondContact O-N 2.91Å; V331-D334 PolarHBondContact O-N 3.18Å; V331-D335 PolarHBondContact O-N 2.83Å
332	Q	62.7	Low	62.5	Low	91 Å²	91	115.6 Å²	115.6	43%	0.425	55%	0.549	S	S	.	.	H	α-helix	trans	-67.5	-33.9	176.1	-67.5	-177.1	-8.5	0	0	112.9	P327 L329 K336	P327-Q332 HydrophobicContact CB-CG 4.33Å; L329-Q332 PolarHBondContact O-N 2.97Å; Q332-K336 WeakPolarHBondContact O-CB 3.32Å; Q332-K336 VanDerWaalsContact O-CG 3.29Å; Q332-K336 WeakPolarHBondContact O-CG 3.38Å; Q332-K336 PolarHBondContact O-N 2.8Å; Q332-K336 VanDerWaalsContact O-N 3.13Å
333	L	67.1	Low	65	Low	68 Å²	68	113 Å²	113	36%	0.356	53%	0.525	S	S	.	.	H	α-helix	trans	-72	-38.3	175.8	-71.7	173.4	0	0	0	111.4	L329 G330 V331 K336 R337	L329-L333 PolarHBondContact O-N 2.82Å; G330-L333 PolarHBondContact O-N 3.22Å; V331-L333 VanDerWaalsContact C-N 3.35Å; V331-L333 PolarHBondContact O-N 2.91Å; L333-K336 PolarHBondContact O-N 3.25Å; L333-R337 WeakPolarHBondContact O-CB 3.38Å; L333-R337 WeakPolarHBondContact O-CG 3.49Å; L333-R337 PolarHBondContact O-N 3.37Å
334	D	70.2	Confident	67.2	Low	76 Å²	76	103.2 Å²	103.2	41%	0.406	48%	0.483	S	S	.	.	H	α-helix	trans	-68.5	-36.4	176.4	-77.6	-16.4	0	0	0	112.9	G330 V331 R337 K338	G330-D334 PolarHBondContact O-N 3.23Å; G330-D334 VanDerWaalsContact O-N 3.1Å; V331-D334 PolarHBondContact O-N 3.18Å; D334-R337 PolarHBondContact O-N 3.44Å; D334-R337 IonicContact OD1-CZ 2.8Å; D334-R337 IonicContact OD1-NH1 3.37Å; D334-R337 PolarHBondContact OD1-NH1 3.24Å; D334-K338 WeakPolarHBondContact O-CG 3.43Å; D334-K338 PolarHBondContact O-N 3.41Å
335	D	76.1	Confident	69.5	Low	92 Å²	92	93.6 Å²	93.6	49%	0.492	45%	0.45	S	S	.	.	H	α-helix	trans	-65.5	-42.5	172.6	-71.5	-24.6	0	0	0	111.1	V331 R337 K338 E339	V331-D335 PolarHBondContact O-N 2.83Å; D335-R337 VanDerWaalsContact C-N 3.33Å; D335-R337 PolarHBondContact O-N 3.35Å; D335-K338 PolarHBondContact O-N 3Å; D335-E339 WeakPolarHBondContact O-CB 3.37Å; D335-E339 PolarHBondContact O-N 2.77Å
336	K	76.9	Confident	71.6	Confident	111 Å²	111	82 Å²	82	48%	0.483	41%	0.406	S	S	.	.	H	α-helix	trans	-62.6	-36.3	172.8	-76.1	175.6	180	178.6	0	112.9	Q332 L333 E339 M340	Q332-K336 WeakPolarHBondContact O-CB 3.32Å; Q332-K336 VanDerWaalsContact O-CG 3.29Å; Q332-K336 WeakPolarHBondContact O-CG 3.38Å; Q332-K336 PolarHBondContact O-N 2.8Å; Q332-K336 VanDerWaalsContact O-N 3.13Å; L333-K336 PolarHBondContact O-N 3.25Å; K336-E339 PolarHBondContact O-N 3.44Å; K336-M340 WeakPolarHBondContact O-CB 3.48Å; K336-M340 WeakPolarHBondContact O-CG 3.33Å; K336-M340 PolarHBondContact O-N 3.03Å
337	R	78.8	Confident	74	Confident	62 Å²	62	71.5 Å²	71.5	23%	0.234	37%	0.368	C	S	.	.	H	α-helix	trans	-66	-45.8	174.9	-73.5	166.7	177.6	174.7	-10.6	111.1	L333 D334 D335 E339 M340 L341 V425 G426 I427	L333-R337 WeakPolarHBondContact O-CB 3.38Å; L333-R337 WeakPolarHBondContact O-CG 3.49Å; L333-R337 PolarHBondContact O-N 3.37Å; D334-R337 PolarHBondContact O-N 3.44Å; D334-R337 IonicContact OD1-CZ 2.8Å; D334-R337 IonicContact OD1-NH1 3.37Å; D334-R337 PolarHBondContact OD1-NH1 3.24Å; D335-R337 VanDerWaalsContact C-N 3.33Å; D335-R337 PolarHBondContact O-N 3.35Å; R337-E339 VanDerWaalsContact C-N 3.3Å; R337-E339 PolarHBondContact O-N 3.15Å; R337-M340 PolarHBondContact O-N 3.43Å; R337-L341 WeakPolarHBondContact O-CB 3.22Å; R337-L341 VanDerWaalsContact O-CG 3.31Å; R337-L341 WeakPolarHBondContact O-CG 3.45Å; R337-L341 PolarHBondContact O-N 3.41Å; R337-V425 HydrophobicContact CG-CB 4.46Å; R337-V425 PolarHBondContact NE-O 2.97Å; R337-G426 PolarHBondContact NH2-O 2.77Å; R337-I427 HydrophobicContact CB-CD1 4.48Å; R337-I427 HydrophobicContact CG-CD1 4.05Å; R337-I427 HydrophobicContact CG-CG1 4Å
338	K	79.5	Confident	76.4	Confident	150 Å²	150	67.8 Å²	67.8	65%	0.652	35%	0.345	S	S	*	.	H	α-helix	trans	-62.3	-39.1	175.8	-75.7	177.4	-179.3	171.2	0	112.2	D334 D335 L341 K342	D334-K338 WeakPolarHBondContact O-CG 3.43Å; D334-K338 PolarHBondContact O-N 3.41Å; D335-K338 PolarHBondContact O-N 3Å; K338-L341 CarbonylContact O-C 3.52Å; K338-L341 PolarHBondContact O-N 2.93Å; K338-K342 PolarHBondContact O-N 3.2Å; K338-K342 VanDerWaalsContact O-N 3.09Å
339	E	81.9	Confident	78.3	Confident	128 Å²	128	65 Å²	65	60%	0.598	32%	0.324	S	S	*	.	H	α-helix	trans	-65.8	-44.5	175.3	-168.9	167.8	-157.1	0	0	111.2	D335 K336 R337 L341 K342 N369	D335-E339 WeakPolarHBondContact O-CB 3.37Å; D335-E339 PolarHBondContact O-N 2.77Å; K336-E339 PolarHBondContact O-N 3.44Å; R337-E339 VanDerWaalsContact C-N 3.3Å; R337-E339 PolarHBondContact O-N 3.15Å; E339-L341 VanDerWaalsContact C-N 3.33Å; E339-L341 PolarHBondContact O-N 2.85Å; E339-K342 WeakPolarHBondContact O-CB 2.92Å; E339-K342 PolarHBondContact O-N 2.85Å; E339-N369 PolarHBondContact O-ND2 3.32Å
340	M	79.9	Confident	80.1	Confident	33 Å²	33	58.6 Å²	58.6	16%	0.163	29%	0.291	C	S	.	.	H	α-helix	trans	-60.2	-38.9	173.5	-83.4	-59	-35.8	0	0	113.3	K336 R337 K342 N369 L370 V425	K336-M340 WeakPolarHBondContact O-CB 3.48Å; K336-M340 WeakPolarHBondContact O-CG 3.33Å; K336-M340 PolarHBondContact O-N 3.03Å; R337-M340 PolarHBondContact O-N 3.43Å; M340-K342 VanDerWaalsContact C-N 3.27Å; M340-K342 PolarHBondContact O-N 3.13Å; M340-N369 HydrophobicContact CE-CB 3.65Å; M340-N369 HydrophobicContact SD-CB 4.27Å; M340-L370 HydrophobicContact CE-CD2 3.39Å; M340-L370 HydrophobicContact CE-CG 4.03Å; M340-V425 HydrophobicContact CG-CG1 4.07Å
341	L	82.4	Confident	81.6	Confident	22 Å²	22	58.6 Å²	58.6	12%	0.115	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	9.4	-179.9	-60.7	178	0	0	0	113.3	R337 K338 E339 R343 L370 Y433 L437	R337-L341 WeakPolarHBondContact O-CB 3.22Å; R337-L341 VanDerWaalsContact O-CG 3.31Å; R337-L341 WeakPolarHBondContact O-CG 3.45Å; R337-L341 PolarHBondContact O-N 3.41Å; K338-L341 CarbonylContact O-C 3.52Å; K338-L341 PolarHBondContact O-N 2.93Å; E339-L341 VanDerWaalsContact C-N 3.33Å; E339-L341 PolarHBondContact O-N 2.85Å; L341-R343 PolarHBondContact O-N 3.24Å; L341-L370 HydrophobicContact CD2-CD1 3.92Å; L341-Y433 HydrophobicContact CD1-CD1 3.57Å; L341-Y433 HydrophobicContact CD1-CD2 4.07Å; L341-Y433 HydrophobicContact CD1-CE1 3.8Å; L341-Y433 HydrophobicContact CD1-CE2 4.27Å; L341-Y433 HydrophobicContact CD1-CG 3.71Å; L341-L437 HydrophobicContact CB-CD1 4.24Å; L341-L437 HydrophobicContact CD1-CD1 4.39Å; L341-L437 HydrophobicContact CD2-CD1 3.8Å; L341-L437 HydrophobicContact CG-CD1 4.35Å
342	K	85.4	Confident	82.9	Confident	107 Å²	107	55.3 Å²	55.3	47%	0.465	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-59.1	121.3	-177.6	-170.9	176.7	-177.2	-179.2	0	110.9	K338 E339 M340 M368	K338-K342 PolarHBondContact O-N 3.2Å; K338-K342 VanDerWaalsContact O-N 3.09Å; E339-K342 WeakPolarHBondContact O-CB 2.92Å; E339-K342 PolarHBondContact O-N 2.85Å; M340-K342 VanDerWaalsContact C-N 3.27Å; M340-K342 PolarHBondContact O-N 3.13Å; K342-M368 HydrophobicContact CG-CE 4.42Å
343	R	86.4	Confident	84.1	Confident	70 Å²	70	56.4 Å²	56.4	26%	0.264	26%	0.264	S	S	.	.	B	Isolated β-bridge	trans	-78.5	148.3	176.2	-57.3	-175.9	-155.2	-166.7	6.7	110.5	L341 L367 M368 E436 L437	L341-R343 PolarHBondContact O-N 3.24Å; R343-L367 HydrophobicContact CG-CD2 3.86Å; R343-M368 WeakPolarHBondContact O-CE 3.44Å; R343-E436 IonicContact CZ-OE1 2.85Å; R343-E436 PolarHBondContact NH1-O 3.16Å; R343-E436 PolarHBondContact NH2-O 3.5Å; R343-E436 IonicContact NH2-OE1 2.56Å; R343-E436 PolarHBondContact NH2-OE1 3.19Å; R343-L437 HydrophobicContact CG-CD2 4Å
344	H	88	Confident	84.8	Confident	16 Å²	16	53.7 Å²	53.7	7%	0.074	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-66.6	136	165.2	-167.8	-91.7	0	0	0	110.1	P265 L346 Y366 M368	P265-H344 VanDerWaalsContact CD-CE1 3.45Å; P265-H344 WeakPolarHBondContact CD-CE1 3.26Å; P265-H344 HydrophobicContact CG-CB 4.22Å; P265-H344 VanDerWaalsContact CG-CD2 3.47Å; P265-H344 WeakPolarHBondContact CG-CD2 3.44Å; P265-H344 VanDerWaalsContact CG-CG 3.45Å; H344-L346 VanDerWaalsContact C-N 3.25Å; H344-L346 PolarHBondContact ND1-N 3.1Å; H344-L346 PolarHBondContact ND1-O 2.85Å; H344-L346 PolarHBondContact O-N 3.42Å; H344-Y366 HydrophobicContact CB-CD1 4.32Å; H344-Y366 WeakPolarHBondContact CB-O 3.49Å; H344-Y366 PolarHBondContact N-O 3.18Å; H344-M368 HydrophobicContact CB-CE 4.08Å
345	P	87.1	Confident	85.2	Confident	26 Å²	26	59.2 Å²	59.2	17%	0.169	27%	0.272	C	S	.	.	S	Bend	trans	-66.8	-25.2	-177.1	25.5	-35.7	0	0	0	113.5	G292 E296 A297 L300	G292-P345 VanDerWaalsContact CA-O 3.29Å; G292-P345 WeakPolarHBondContact CA-O 3.43Å; E296-P345 HydrophobicContact CB-CB 3.79Å; E296-P345 HydrophobicContact CB-CG 3.91Å; E296-P345 WeakPolarHBondContact OE2-CB 3.4Å; A297-P345 HydrophobicContact CB-CG 4.2Å; L300-P345 HydrophobicContact CD1-CG 3.87Å
346	L	90.3	Very high	85	Confident	1 Å²	1	59 Å²	59	1%	0.005	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	139.8	171.5	-58.5	174.8	0	0	0	111.7	H263 L264 I290 E291 V294 A297 H344	H263-L346 HydrophobicContact CB-CD1 3.84Å; H263-L346 WeakPolarHBondContact O-CD1 3.41Å; L264-L346 HydrophobicContact CD2-CB 3.86Å; L264-L346 HydrophobicContact CD2-CD1 4.22Å; I290-L346 HydrophobicContact CG2-CD2 4.48Å; E291-L346 WeakPolarHBondContact O-CA 3.39Å; V294-L346 HydrophobicContact CG2-CD2 4.36Å; A297-L346 HydrophobicContact CB-CD1 3.58Å; A297-L346 HydrophobicContact CB-CG 3.81Å; H344-L346 VanDerWaalsContact C-N 3.25Å; H344-L346 PolarHBondContact ND1-N 3.1Å; H344-L346 PolarHBondContact ND1-O 2.85Å; H344-L346 PolarHBondContact O-N 3.42Å
347	S	90.9	Very high	85.1	Confident	13 Å²	13	59.8 Å²	59.8	9%	0.091	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	155.3	179.7	-53.9	0	0	0	0	109.9	E291 F364 Y365	E291-S347 PolarHBondContact N-O 3.47Å; E291-S347 PolarHBondContact O-N 3.31Å; S347-F364 WeakPolarHBondContact CA-O 3.35Å; S347-F364 VanDerWaalsContact CB-O 3.32Å; S347-F364 WeakPolarHBondContact CB-O 3.47Å; S347-Y365 WeakPolarHBondContact OG-CD1 3.38Å; S347-Y365 WeakPolarHBondContact OG-CE1 3.5Å
348	V	93	Very high	85.4	Confident	1 Å²	1	56.9 Å²	56.9	1%	0.006	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	125.1	176.8	179.2	0	0	0	0	109	L264 L268 L271 F364	L264-V348 HydrophobicContact CD1-CG2 4.09Å; L264-V348 HydrophobicContact CD2-CG2 4.16Å; L268-V348 HydrophobicContact CB-CG2 4.03Å; L268-V348 HydrophobicContact CD1-CG2 4.46Å; L268-V348 HydrophobicContact CD2-CB 4.48Å; L268-V348 HydrophobicContact CD2-CG2 4.18Å; L268-V348 HydrophobicContact CG-CG2 4.46Å; L271-V348 HydrophobicContact CD2-CB 4.29Å; L271-V348 HydrophobicContact CD2-CG1 3.74Å; V348-F364 PolarHBondContact N-O 3.15Å; V348-F364 VanDerWaalsContact N-O 3.08Å; V348-F364 PolarHBondContact O-N 3.29Å
349	M	92.6	Very high	85.9	Confident	49 Å²	49	51.7 Å²	51.7	24%	0.241	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	135	173.6	-175.6	-178.2	-98	0	0	109.7	V288 A289 E291 L362 T363	V288-M349 WeakPolarHBondContact CA-O 3.45Å; A289-M349 PolarHBondContact N-O 3.3Å; A289-M349 PolarHBondContact O-N 2.89Å; E291-M349 HydrophobicContact CG-CB 4.32Å; M349-L362 WeakPolarHBondContact CA-O 3.49Å; M349-T363 HydrophobicContact CB-CG2 4.21Å; M349-T363 HydrophobicContact CE-CG2 3.36Å; M349-T363 HydrophobicContact CG-CG2 3.98Å
350	L	92.6	Very high	86.4	Confident	2 Å²	2	45.6 Å²	45.6	1%	0.01	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	135.8	173.9	59.4	156.8	0	0	0	109.6	S287 L362 F364 M476	S287-L350 WeakPolarHBondContact O-CA 3.26Å; L350-L362 HydrophobicContact CD1-CB 4.34Å; L350-L362 HydrophobicContact CD1-CD1 3.75Å; L350-L362 HydrophobicContact CD1-CG 4.48Å; L350-L362 HydrophobicContact CD2-CB 3.68Å; L350-L362 WeakPolarHBondContact CD2-O 3.39Å; L350-L362 HydrophobicContact CG-CB 3.8Å; L350-L362 HydrophobicContact CG-CD1 3.78Å; L350-L362 HydrophobicContact CG-CG 4.36Å; L350-L362 PolarHBondContact N-O 3.2Å; L350-L362 PolarHBondContact O-N 3.24Å; L350-F364 HydrophobicContact CD1-CE2 3.98Å; L350-F364 HydrophobicContact CD1-CZ 4.44Å; L350-F364 HydrophobicContact CD2-CD2 3.2Å; L350-F364 HydrophobicContact CD2-CE2 2.95Å; L350-F364 HydrophobicContact CD2-CG 4.29Å; L350-F364 HydrophobicContact CD2-CZ 3.83Å; L350-F364 HydrophobicContact CG-CE2 4.1Å; L350-M476 HydrophobicContact CD1-CE 3.85Å
351	D	90.7	Very high	87	Confident	42 Å²	42	46.1 Å²	46.1	23%	0.225	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	121.8	-179.3	-64.1	-22.8	0	0	0	109	S287 V359 L360 H361	S287-D351 PolarHBondContact N-O 3.38Å; S287-D351 PolarHBondContact O-N 3.49Å; D351-V359 HydrophobicContact CB-CG1 4.04Å; D351-L360 WeakPolarHBondContact CA-O 3.39Å; D351-H361 IonicContact OD1-CE1 2.78Å; D351-H361 IonicContact OD1-CG 2.62Å; D351-H361 IonicContact OD1-ND1 3.29Å; D351-H361 PolarHBondContact OD1-ND1 3.16Å; D351-H361 IonicContact OD2-CE1 3.64Å; D351-H361 IonicContact OD2-ND1 2.65Å
352	L	88.5	Confident	87.5	Confident	2 Å²	2	45 Å²	45	1%	0.01	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	110.3	177.1	-66	173.8	0	0	0	109.3	L286 V359 L360 L362 M476 L479	L286-L352 HydrophobicContact CB-CD2 3.84Å; L286-L352 HydrophobicContact CD1-CD2 3.57Å; L286-L352 HydrophobicContact CG-CD2 3.6Å; L352-V359 WeakPolarHBondContact O-CA 3.25Å; L352-L360 HydrophobicContact CB-CB 4.38Å; L352-L360 HydrophobicContact CD1-CD2 4.38Å; L352-L360 PolarHBondContact N-O 3.27Å; L352-L360 PolarHBondContact O-N 2.88Å; L352-L362 HydrophobicContact CD1-CD1 4.23Å; L352-M476 HydrophobicContact CD1-SD 3.69Å; L352-M476 HydrophobicContact CD2-SD 3.96Å; L352-M476 HydrophobicContact CG-SD 4.38Å; L352-L479 HydrophobicContact CD1-CB 4.22Å; L352-L479 HydrophobicContact CD1-CD1 3.93Å
353	K	88.2	Confident	87.9	Confident	113 Å²	113	41 Å²	41	49%	0.491	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	123.6	169.4	65.3	-176.7	166.8	177.3	0	110.3	T285 V359	T285-K353 VanDerWaalsContact CA-CE 3.42Å; T285-K353 HydrophobicContact CG2-CD 4.44Å; T285-K353 HydrophobicContact CG2-CG 4.08Å; T285-K353 WeakPolarHBondContact O-CG 3.18Å; T285-K353 PolarHBondContact O-N 3.43Å; K353-V359 HydrophobicContact CB-CG2 4.38Å
354	C	82.2	Confident	88.3	Confident	12 Å²	12	37.8 Å²	37.8	8%	0.081	19%	0.19	C	C	.	.			trans	-86.2	165.9	172.3	-67.8	0	0	0	0	110.1	D356 S358	C354-D356 PolarHBondContact O-N 3.45Å; C354-S358 WeakPolarHBondContact CB-OG 3.38Å; C354-S358 PolarHBondContact N-O 3.12Å
355	K	78.6	Confident	88.5	Confident	192 Å²	192	39.4 Å²	39.4	84%	0.835	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66	-16.7	179.9	-67.3	-174.4	177.7	-177.7	0	113.8	D357	K355-D357 VanDerWaalsContact C-N 3.31Å; K355-D357 PolarHBondContact O-N 3.31Å
356	D	71.4	Confident	88.8	Confident	86 Å²	86	39.2 Å²	39.2	46%	0.46	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.3	28.6	-174.7	-49.4	-39	0	0	0	112	C354 S358	C354-D356 PolarHBondContact O-N 3.45Å; D356-S358 PolarHBondContact O-N 3.43Å
357	D	78.7	Confident	88.7	Confident	129 Å²	129	39.5 Å²	39.5	69%	0.69	19%	0.193	S	C	*	.	S	Bend	trans	52.3	23.8	-175.5	-61.6	-34	0	0	0	115	K355 A382	K355-D357 VanDerWaalsContact C-N 3.31Å; K355-D357 PolarHBondContact O-N 3.31Å; D357-A382 HydrophobicContact CB-CB 4.1Å; D357-A382 PolarHBondContact O-N 3.37Å
358	S	85.7	Confident	88.4	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	145.2	173.2	49.4	0	0	0	0	110.9	C354 D356 T380 L487	C354-S358 WeakPolarHBondContact CB-OG 3.38Å; C354-S358 PolarHBondContact N-O 3.12Å; D356-S358 PolarHBondContact O-N 3.43Å; S358-T380 CarbonylContact C-O 3.58Å; S358-T380 WeakPolarHBondContact CA-O 3.26Å; S358-L487 WeakPolarHBondContact OG-CD1 3.38Å
359	V	90.1	Very high	88	Confident	41 Å²	41	44.4 Å²	44.4	25%	0.248	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	127.4	178.4	-172.5	0	0	0	0	109	D351 L352 K353 T380	D351-V359 HydrophobicContact CB-CG1 4.04Å; L352-V359 WeakPolarHBondContact O-CA 3.25Å; K353-V359 HydrophobicContact CB-CG2 4.38Å; V359-T380 PolarHBondContact N-O 2.89Å; V359-T380 PolarHBondContact O-N 2.82Å; V359-T380 PolarHBondContact O-OG1 2.77Å
360	L	92	Very high	87.6	Confident	1 Å²	1	42.3 Å²	42.3	1%	0.005	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	112.1	169.1	174.6	68.6	0	0	0	108.1	D351 L352 L362 A377 V379 L479 V483	D351-L360 WeakPolarHBondContact CA-O 3.39Å; L352-L360 HydrophobicContact CB-CB 4.38Å; L352-L360 HydrophobicContact CD1-CD2 4.38Å; L352-L360 PolarHBondContact N-O 3.27Å; L352-L360 PolarHBondContact O-N 2.88Å; L360-L362 HydrophobicContact CD2-CD1 3.72Å; L360-L362 HydrophobicContact CD2-CD2 4.43Å; L360-L362 HydrophobicContact CD2-CG 4.24Å; L360-L362 HydrophobicContact CG-CD1 3.64Å; L360-L362 HydrophobicContact CG-CG 4.1Å; L360-A377 HydrophobicContact CD1-CB 4.42Å; L360-V379 HydrophobicContact CD1-CG2 3.74Å; L360-L479 HydrophobicContact CD2-CB 4.19Å; L360-L479 HydrophobicContact CD2-CD2 4.33Å; L360-V483 HydrophobicContact CB-CG2 4Å; L360-V483 HydrophobicContact CD1-CG2 4.22Å; L360-V483 HydrophobicContact CD2-CG2 3.73Å; L360-V483 HydrophobicContact CG-CG2 4.19Å
361	H	92.1	Very high	87.3	Confident	43 Å²	43	45.3 Å²	45.3	20%	0.199	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	127.4	172	-54.9	-76.8	0	0	0	108.9	D351 A377 K378 T380	D351-H361 IonicContact OD1-CE1 2.78Å; D351-H361 IonicContact OD1-CG 2.62Å; D351-H361 IonicContact OD1-ND1 3.29Å; D351-H361 PolarHBondContact OD1-ND1 3.16Å; D351-H361 IonicContact OD2-CE1 3.64Å; D351-H361 IonicContact OD2-ND1 2.65Å; H361-A377 CarbonylContact O-C 3.39Å; H361-A377 WeakPolarHBondContact O-CA 3.35Å; H361-K378 HydrophobicContact CB-CB 4.33Å; H361-K378 PolarHBondContact N-O 3.05Å; H361-K378 PolarHBondContact O-N 3.43Å; H361-T380 PolarHBondContact CD2-OG1 3.24Å; H361-T380 PolarHBondContact NE2-OG1 3.25Å
362	L	93.8	Very high	87.3	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	131	169.8	-49.8	92.5	0	0	0	109.1	M349 L350 L352 L360 V375 K376 L401 W443 L479	M349-L362 WeakPolarHBondContact CA-O 3.49Å; L350-L362 HydrophobicContact CD1-CB 4.34Å; L350-L362 HydrophobicContact CD1-CD1 3.75Å; L350-L362 HydrophobicContact CD1-CG 4.48Å; L350-L362 HydrophobicContact CD2-CB 3.68Å; L350-L362 WeakPolarHBondContact CD2-O 3.39Å; L350-L362 HydrophobicContact CG-CB 3.8Å; L350-L362 HydrophobicContact CG-CD1 3.78Å; L350-L362 HydrophobicContact CG-CG 4.36Å; L350-L362 PolarHBondContact N-O 3.2Å; L350-L362 PolarHBondContact O-N 3.24Å; L352-L362 HydrophobicContact CD1-CD1 4.23Å; L360-L362 HydrophobicContact CD2-CD1 3.72Å; L360-L362 HydrophobicContact CD2-CD2 4.43Å; L360-L362 HydrophobicContact CD2-CG 4.24Å; L360-L362 HydrophobicContact CG-CD1 3.64Å; L360-L362 HydrophobicContact CG-CG 4.1Å; L362-V375 HydrophobicContact CB-CG2 3.94Å; L362-V375 HydrophobicContact CD2-CG2 4.07Å; L362-K376 WeakPolarHBondContact CA-O 3.46Å; L362-L401 HydrophobicContact CD2-CD1 3.7Å; L362-W443 HydrophobicContact CD2-CH2 3.97Å; L362-L479 HydrophobicContact CD2-CD1 4.13Å; L362-L479 HydrophobicContact CD2-CD2 4.45Å
363	T	92.8	Very high	87.4	Confident	23 Å²	23	43.3 Å²	43.3	14%	0.141	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	119	172.4	54.9	0	0	0	0	109.8	M349 Y365 V375 K376	M349-T363 HydrophobicContact CB-CG2 4.21Å; M349-T363 HydrophobicContact CE-CG2 3.36Å; M349-T363 HydrophobicContact CG-CG2 3.98Å; T363-Y365 PolarHBondContact OG1-OH 2.65Å; T363-V375 WeakPolarHBondContact O-CA 3.47Å; T363-K376 PolarHBondContact N-O 2.88Å; T363-K376 PolarHBondContact O-N 3.47Å
364	F	94.4	Very high	87.5	Confident	1 Å²	1	38.1 Å²	38.1	0%	0.004	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	118.8	176.4	-66.1	-58.4	0	0	0	110.6	L268 L271 S347 V348 L350 M373 T374 V375 W443 V444	L268-F364 HydrophobicContact CD2-CB 3.96Å; L271-F364 HydrophobicContact CD1-CD2 3.41Å; L271-F364 VanDerWaalsContact CD1-CD2 3.41Å; L271-F364 HydrophobicContact CD1-CE2 3.34Å; L271-F364 HydrophobicContact CD1-CG 4.02Å; L271-F364 HydrophobicContact CD1-CZ 3.99Å; L271-F364 HydrophobicContact CD2-CD2 3.63Å; L271-F364 HydrophobicContact CD2-CE2 3.82Å; L271-F364 HydrophobicContact CG-CD2 4.19Å; L271-F364 HydrophobicContact CG-CE2 4.15Å; S347-F364 WeakPolarHBondContact CA-O 3.35Å; S347-F364 VanDerWaalsContact CB-O 3.32Å; S347-F364 WeakPolarHBondContact CB-O 3.47Å; V348-F364 PolarHBondContact N-O 3.15Å; V348-F364 VanDerWaalsContact N-O 3.08Å; V348-F364 PolarHBondContact O-N 3.29Å; L350-F364 HydrophobicContact CD1-CE2 3.98Å; L350-F364 HydrophobicContact CD1-CZ 4.44Å; L350-F364 HydrophobicContact CD2-CD2 3.2Å; L350-F364 HydrophobicContact CD2-CE2 2.95Å; L350-F364 HydrophobicContact CD2-CG 4.29Å; L350-F364 HydrophobicContact CD2-CZ 3.83Å; L350-F364 HydrophobicContact CG-CE2 4.1Å; F364-M373 HydrophobicContact CB-CE 4.33Å; F364-M373 HydrophobicContact CD1-CE 3.89Å; F364-M373 HydrophobicContact CE1-CE 4.35Å; F364-M373 HydrophobicContact CG-CE 4.06Å; F364-T374 CarbonylContact C-O 3.32Å; F364-T374 VanDerWaalsContact CA-O 3.29Å; F364-T374 WeakPolarHBondContact CA-O 3.34Å; F364-V375 HydrophobicContact CD1-CB 3.68Å; F364-V375 HydrophobicContact CD1-CG2 3.64Å; F364-V375 HydrophobicContact CE1-CB 3.62Å; F364-V375 HydrophobicContact CE1-CG2 3.39Å; F364-V375 HydrophobicContact CZ-CG2 4.26Å; F364-W443 HydrophobicContact CE1-CH2 4.33Å; F364-W443 HydrophobicContact CE1-CZ3 4.36Å; F364-W443 HydrophobicContact CZ-CH2 4.39Å; F364-W443 HydrophobicContact CZ-CZ3 4.17Å; F364-V444 HydrophobicContact CD1-CG1 3.7Å; F364-V444 HydrophobicContact CE1-CB 4.39Å; F364-V444 HydrophobicContact CE1-CG1 3.6Å; F364-V444 HydrophobicContact CE1-CG2 4Å
365	Y	93.3	Very high	88.1	Confident	51 Å²	51	37.6 Å²	37.6	20%	0.2	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	157.9	171.2	-56	-74.7	0	0	0	110	S347 T363 M373 T374 K376	S347-Y365 WeakPolarHBondContact OG-CD1 3.38Å; S347-Y365 WeakPolarHBondContact OG-CE1 3.5Å; T363-Y365 PolarHBondContact OG1-OH 2.65Å; Y365-M373 CarbonylContact O-C 3.3Å; Y365-M373 WeakPolarHBondContact O-CA 3.48Å; Y365-M373 WeakPolarHBondContact O-CB 3.45Å; Y365-T374 WeakPolarHBondContact CB-OG1 3.49Å; Y365-T374 PolarHBondContact N-O 3.38Å; Y365-T374 PolarHBondContact O-N 3.11Å; Y365-K376 HydrophobicContact CE2-CB 4.43Å; Y365-K376 HydrophobicContact CE2-CD 3.98Å; Y365-K376 HydrophobicContact CE2-CG 3.93Å
366	Y	92.6	Very high	88.7	Confident	22 Å²	22	31.8 Å²	31.8	9%	0.086	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	129.7	175.2	-175.5	-110.7	0	0	0	110.9	P265 P267 H344 M368 N371 M373	P265-Y366 HydrophobicContact CB-CD1 3.53Å; P265-Y366 HydrophobicContact CB-CE1 3.75Å; P265-Y366 HydrophobicContact CB-CG 4.1Å; P265-Y366 HydrophobicContact CG-CD1 3.63Å; P265-Y366 HydrophobicContact CG-CE1 4.26Å; P265-Y366 HydrophobicContact CG-CG 4.22Å; P267-Y366 HydrophobicContact CB-CD2 4.45Å; P267-Y366 HydrophobicContact CB-CE2 4.19Å; P267-Y366 HydrophobicContact CG-CD2 4.37Å; P267-Y366 HydrophobicContact CG-CE2 3.67Å; H344-Y366 HydrophobicContact CB-CD1 4.32Å; H344-Y366 WeakPolarHBondContact CB-O 3.49Å; H344-Y366 PolarHBondContact N-O 3.18Å; Y366-M368 HydrophobicContact CD1-CB 4.43Å; Y366-M368 HydrophobicContact CE1-CB 4.14Å; Y366-N371 PolarHBondContact OH-OD1 2.86Å; Y366-M373 HydrophobicContact CD2-CB 4.31Å
367	L	89	Confident	89.7	Confident	6 Å²	6	28.1 Å²	28.1	3%	0.031	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	101.3	176.8	-60	175.1	0	0	0	108	R343 N369 L370 N371 I372 T374 L437	R343-L367 HydrophobicContact CG-CD2 3.86Å; L367-N369 PolarHBondContact O-N 2.97Å; L367-L370 HydrophobicContact CB-CB 4.1Å; L367-L370 HydrophobicContact CD1-CD1 4Å; L367-L370 PolarHBondContact O-N 3.48Å; L367-N371 WeakPolarHBondContact O-CA 3.41Å; L367-N371 PolarHBondContact O-N 2.7Å; L367-I372 PolarHBondContact N-O 3.14Å; L367-I372 PolarHBondContact O-N 3.47Å; L367-T374 HydrophobicContact CD1-CG2 4.05Å; L367-L437 HydrophobicContact CD1-CD1 4.07Å; L367-L437 HydrophobicContact CD2-CD1 4.46Å; L367-L437 HydrophobicContact CD2-CD2 4.21Å
368	M	84.8	Confident	90.2	Very high	52 Å²	52	28.2 Å²	28.2	26%	0.256	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-40.9	-170.9	62.9	-164.3	81.8	0	0	113.1	L300 K342 R343 H344 Y366 N371	L300-M368 HydrophobicContact CD1-CE 4.29Å; K342-M368 HydrophobicContact CG-CE 4.42Å; R343-M368 WeakPolarHBondContact O-CE 3.44Å; H344-M368 HydrophobicContact CB-CE 4.08Å; Y366-M368 HydrophobicContact CD1-CB 4.43Å; Y366-M368 HydrophobicContact CE1-CB 4.14Å; M368-N371 PolarHBondContact O-N 3.35Å
369	N	84.9	Confident	90.4	Very high	65 Å²	65	29.7 Å²	29.7	35%	0.348	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-26.4	-177	-66.6	-25.7	0	0	0	113.2	E339 M340 L367 Q421	E339-N369 PolarHBondContact O-ND2 3.32Å; M340-N369 HydrophobicContact CE-CB 3.65Å; M340-N369 HydrophobicContact SD-CB 4.27Å; L367-N369 PolarHBondContact O-N 2.97Å; N369-Q421 PolarHBondContact O-OE1 3.13Å
370	L	82.4	Confident	90.1	Very high	6 Å²	6	30 Å²	30	3%	0.031	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.1	-8.4	178.4	-64.9	-178.8	0	0	0	112.9	M340 L341 L367 I372 N418 F422	M340-L370 HydrophobicContact CE-CD2 3.39Å; M340-L370 HydrophobicContact CE-CG 4.03Å; L341-L370 HydrophobicContact CD2-CD1 3.92Å; L367-L370 HydrophobicContact CB-CB 4.1Å; L367-L370 HydrophobicContact CD1-CD1 4Å; L367-L370 PolarHBondContact O-N 3.48Å; L370-I372 VanDerWaalsContact C-N 3.27Å; L370-I372 PolarHBondContact O-N 3.01Å; L370-N418 HydrophobicContact CD2-CB 4.34Å; L370-N418 PolarHBondContact O-ND2 2.94Å; L370-N418 PolarHBondContact O-OD1 3.3Å; L370-N418 VanDerWaalsContact O-OD1 3.14Å; L370-F422 HydrophobicContact CD1-CE1 3.84Å; L370-F422 HydrophobicContact CD1-CZ 3.84Å; L370-F422 HydrophobicContact CD2-CD1 4.39Å; L370-F422 HydrophobicContact CD2-CE1 3.64Å; L370-F422 HydrophobicContact CD2-CZ 4.02Å; L370-F422 HydrophobicContact CG-CE1 4.42Å
371	N	87.6	Confident	89.7	Confident	64 Å²	64	32.2 Å²	32.2	34%	0.342	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.5	48.8	-174.5	-167.5	15.5	0	0	0	112.6	Y366 L367 M368 F452	Y366-N371 PolarHBondContact OH-OD1 2.86Å; L367-N371 WeakPolarHBondContact O-CA 3.41Å; L367-N371 PolarHBondContact O-N 2.7Å; M368-N371 PolarHBondContact O-N 3.35Å; N371-F452 WeakPolarHBondContact O-CZ 3.26Å
372	I	89.6	Confident	88.8	Confident	3 Å²	3	34.1 Å²	34.1	2%	0.015	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	138.3	-178.5	-78.9	179.2	0	0	0	108.6	L367 L370 T374 T413 N418 P440	L367-I372 PolarHBondContact N-O 3.14Å; L367-I372 PolarHBondContact O-N 3.47Å; L370-I372 VanDerWaalsContact C-N 3.27Å; L370-I372 PolarHBondContact O-N 3.01Å; I372-T374 HydrophobicContact CG2-CG2 4.08Å; I372-T413 HydrophobicContact CD1-CG2 3.76Å; I372-N418 WeakPolarHBondContact CD1-ND2 3.13Å; I372-P440 HydrophobicContact CG2-CB 3.62Å
373	M	91	Very high	87.8	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	142.5	162.9	47.6	176.9	-46.2	0	0	111.9	L271 F364 Y365 Y366 V444 Q445	L271-M373 HydrophobicContact CD1-CE 3.36Å; F364-M373 HydrophobicContact CB-CE 4.33Å; F364-M373 HydrophobicContact CD1-CE 3.89Å; F364-M373 HydrophobicContact CE1-CE 4.35Å; F364-M373 HydrophobicContact CG-CE 4.06Å; Y365-M373 CarbonylContact O-C 3.3Å; Y365-M373 WeakPolarHBondContact O-CA 3.48Å; Y365-M373 WeakPolarHBondContact O-CB 3.45Å; Y366-M373 HydrophobicContact CD2-CB 4.31Å; M373-V444 HydrophobicContact CB-CG1 4.28Å; M373-V444 HydrophobicContact CE-CB 4.5Å; M373-V444 HydrophobicContact CE-CG1 3.26Å; M373-V444 HydrophobicContact CG-CG1 3.76Å; M373-V444 HydrophobicContact SD-CG1 3.85Å; M373-Q445 VanDerWaalsContact N-OE1 3.17Å; M373-Q445 PolarHBondContact O-NE2 3.13Å
374	T	91.7	Very high	86.6	Confident	3 Å²	3	47.3 Å²	47.3	2%	0.018	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	156.2	178.5	54.8	0	0	0	0	110.1	F364 Y365 L367 I372 L437 G438 H439 P440	F364-T374 CarbonylContact C-O 3.32Å; F364-T374 VanDerWaalsContact CA-O 3.29Å; F364-T374 WeakPolarHBondContact CA-O 3.34Å; Y365-T374 WeakPolarHBondContact CB-OG1 3.49Å; Y365-T374 PolarHBondContact N-O 3.38Å; Y365-T374 PolarHBondContact O-N 3.11Å; L367-T374 HydrophobicContact CD1-CG2 4.05Å; I372-T374 HydrophobicContact CG2-CG2 4.08Å; T374-L437 WeakPolarHBondContact CB-O 3.26Å; T374-L437 PolarHBondContact OG1-O 2.91Å; T374-G438 WeakPolarHBondContact CG2-O 3.45Å; T374-H439 WeakPolarHBondContact CA-O 3.4Å; T374-P440 HydrophobicContact CG2-CB 4.11Å
375	V	93.7	Very high	85.4	Confident	2 Å²	2	50.6 Å²	50.6	1%	0.012	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	140.4	177.9	70.1	0	0	0	0	111.6	L362 T363 F364 G438 H439 Y441 W443 V444	L362-V375 HydrophobicContact CB-CG2 3.94Å; L362-V375 HydrophobicContact CD2-CG2 4.07Å; T363-V375 WeakPolarHBondContact O-CA 3.47Å; F364-V375 HydrophobicContact CD1-CB 3.68Å; F364-V375 HydrophobicContact CD1-CG2 3.64Å; F364-V375 HydrophobicContact CE1-CB 3.62Å; F364-V375 HydrophobicContact CE1-CG2 3.39Å; F364-V375 HydrophobicContact CZ-CG2 4.26Å; V375-G438 WeakPolarHBondContact O-CA 3.43Å; V375-H439 PolarHBondContact N-O 2.91Å; V375-H439 PolarHBondContact O-N 2.84Å; V375-Y441 HydrophobicContact CG1-CD2 3.59Å; V375-Y441 HydrophobicContact CG1-CE2 3.86Å; V375-W443 HydrophobicContact CG1-CH2 4.46Å; V375-W443 HydrophobicContact CG1-CZ2 4.16Å; V375-V444 HydrophobicContact CB-CG2 4.06Å; V375-V444 HydrophobicContact CG1-CG2 3.76Å
376	K	91.6	Very high	84.5	Confident	69 Å²	69	55.6 Å²	55.6	30%	0.3	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	136.8	159.3	-64	-168	-177.9	-151.8	0	109.5	L362 T363 Y365 L435 E436	L362-K376 WeakPolarHBondContact CA-O 3.46Å; T363-K376 PolarHBondContact N-O 2.88Å; T363-K376 PolarHBondContact O-N 3.47Å; Y365-K376 HydrophobicContact CE2-CB 4.43Å; Y365-K376 HydrophobicContact CE2-CD 3.98Å; Y365-K376 HydrophobicContact CE2-CG 3.93Å; K376-L435 PolarHBondContact NZ-O 2.81Å; K376-E436 WeakPolarHBondContact CE-O 3.2Å; K376-E436 PolarHBondContact NZ-O 3.43Å
377	A	91.1	Very high	83.7	Confident	9 Å²	9	58.9 Å²	58.9	7%	0.074	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	139	-179.7	0	0	0	0	0	110.1	L360 H361 P397 L401	L360-A377 HydrophobicContact CD1-CB 4.42Å; H361-A377 CarbonylContact O-C 3.39Å; H361-A377 WeakPolarHBondContact O-CA 3.35Å; A377-P397 WeakPolarHBondContact O-CA 3.48Å; A377-P397 VanDerWaalsContact O-CB 3.22Å; A377-P397 WeakPolarHBondContact O-CB 3.27Å; A377-L401 HydrophobicContact CB-CD1 3.62Å; A377-L401 HydrophobicContact CB-CG 3.97Å
378	K	90.3	Very high	83.4	Confident	132 Å²	132	59 Å²	59	57%	0.574	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.7	123.3	171.6	-175.7	-178.9	179.7	-178	0	108.8	H361 T380	H361-K378 HydrophobicContact CB-CB 4.33Å; H361-K378 PolarHBondContact N-O 3.05Å; H361-K378 PolarHBondContact O-N 3.43Å; K378-T380 HydrophobicContact CD-CG2 4.4Å; K378-T380 HydrophobicContact CG-CG2 4.31Å
379	V	88.8	Confident	83.3	Confident	31 Å²	31	63.5 Å²	63.5	19%	0.188	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	124.2	175.1	-176.6	0	0	0	0	108	L360 L395 V400 V483	L360-V379 HydrophobicContact CD1-CG2 3.74Å; V379-L395 HydrophobicContact CG1-CD2 4.48Å; V379-V400 HydrophobicContact CG2-CG1 4.23Å; V379-V483 HydrophobicContact CG1-CG1 4.49Å
380	T	85.4	Confident	83.2	Confident	46 Å²	46	60.6 Å²	60.6	28%	0.282	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	140.2	173.2	55.5	0	0	0	0	109.3	S358 V359 H361 K378	S358-T380 CarbonylContact C-O 3.58Å; S358-T380 WeakPolarHBondContact CA-O 3.26Å; V359-T380 PolarHBondContact N-O 2.89Å; V359-T380 PolarHBondContact O-N 2.82Å; V359-T380 PolarHBondContact O-OG1 2.77Å; H361-T380 PolarHBondContact CD2-OG1 3.24Å; H361-T380 PolarHBondContact NE2-OG1 3.25Å; K378-T380 HydrophobicContact CD-CG2 4.4Å; K378-T380 HydrophobicContact CG-CG2 4.31Å
381	T	83	Confident	83.1	Confident	48 Å²	48	60.4 Å²	60.4	29%	0.294	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	146.8	178.8	49.9	0	0	0	0	109.1	T383 L385 L487	T381-T383 PolarHBondContact O-N 3.19Å; T381-T383 PolarHBondContact OG1-O 3.08Å; T381-L385 HydrophobicContact CG2-CD1 4.05Å; T381-L385 HydrophobicContact CG2-CD2 4.46Å; T381-L487 HydrophobicContact CG2-CD2 3.94Å
382	A	73.3	Confident	82.6	Confident	84 Å²	84	59.8 Å²	59.8	69%	0.694	34%	0.339	S	S	*	.	S	Bend	trans	-61.9	-23.8	179.1	0	0	0	0	0	113.8	D357	D357-A382 HydrophobicContact CB-CB 4.1Å; D357-A382 PolarHBondContact O-N 3.37Å
383	T	72.3	Confident	82.2	Confident	108 Å²	108	64.2 Å²	64.2	66%	0.663	36%	0.362	S	S	*	.	S	Bend	trans	-110.3	143.6	175.2	-41.8	0	0	0	0	109.8	T381 L385	T381-T383 PolarHBondContact O-N 3.19Å; T381-T383 PolarHBondContact OG1-O 3.08Å; T383-L385 PolarHBondContact O-N 2.92Å; T383-L385 VanDerWaalsContact O-N 3.08Å
384	E	68.9	Low	81.7	Confident	191 Å²	191	64.2 Å²	64.2	89%	0.893	36%	0.362	S	S	*	.			trans	-59.1	112.2	169	-71.9	-174.5	171.4	0	0	109.3	I386	E384-I386 PolarHBondContact O-N 2.81Å
385	L	67.6	Low	81.3	Confident	70 Å²	70	66.1 Å²	66.1	37%	0.366	37%	0.372	S	S	.	.			trans	-79.8	111.9	179.5	-121.7	71.1	0	0	0	108.8	T381 T383 T387 L395 L487 H490	T381-L385 HydrophobicContact CG2-CD1 4.05Å; T381-L385 HydrophobicContact CG2-CD2 4.46Å; T383-L385 PolarHBondContact O-N 2.92Å; T383-L385 VanDerWaalsContact O-N 3.08Å; L385-T387 PolarHBondContact O-N 3.01Å; L385-T387 VanDerWaalsContact O-N 3.13Å; L385-L395 HydrophobicContact CD2-CD1 3.69Å; L385-L487 HydrophobicContact CD2-CD2 4.17Å; L385-H490 VanDerWaalsContact CD2-CE1 3.41Å; L385-H490 WeakPolarHBondContact CD2-CE1 3.5Å; L385-H490 WeakPolarHBondContact CD2-ND1 3.43Å
386	I	74.6	Confident	80.8	Confident	157 Å²	157	67 Å²	67	81%	0.805	38%	0.378	S	S	*	.			trans	-67.4	110.6	166.8	-58.7	172.9	0	0	0	106.7	E384 H490	E384-I386 PolarHBondContact O-N 2.81Å; I386-H490 PolarHBondContact O-CE1 3.44Å
387	T	77.1	Confident	80.4	Confident	90 Å²	90	67 Å²	67	55%	0.552	39%	0.386	S	S	*	.			trans	-81.4	125.5	-176.9	-142.8	0	0	0	0	110.6	L385 H490	L385-T387 PolarHBondContact O-N 3.01Å; L385-T387 VanDerWaalsContact O-N 3.13Å; T387-H490 PolarHBondContact OG1-NE2 3.42Å
388	P	81	Confident	79.9	Confident	9 Å²	9	70.2 Å²	70.2	6%	0.058	40%	0.402	C	S	.	.			trans	-69.9	155.6	172.1	28.6	-30.1	0	0	0	109.8	S390 A391 H490 F493 A494 E497	P388-S390 PolarHBondContact O-N 3.05Å; P388-A391 HydrophobicContact CG-CB 3.58Å; P388-A391 WeakPolarHBondContact O-CB 3.34Å; P388-A391 PolarHBondContact O-N 2.86Å; P388-H490 VanDerWaalsContact CD-NE2 3.33Å; P388-H490 WeakPolarHBondContact CD-NE2 3.48Å; P388-F493 HydrophobicContact CG-CB 4.08Å; P388-A494 HydrophobicContact CB-CB 4.42Å; P388-A494 HydrophobicContact CG-CB 4.19Å; P388-E497 HydrophobicContact CB-CG 4.48Å; P388-E497 WeakPolarHBondContact CB-OE2 3.16Å
389	I	84	Confident	79.6	Confident	147 Å²	147	65.3 Å²	65.3	75%	0.754	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-62	-39.8	-175.7	-59.4	170.6	0	0	0	110	A391 G392 E497	I389-A391 VanDerWaalsContact C-N 3.25Å; I389-A391 PolarHBondContact O-N 3.32Å; I389-G392 PolarHBondContact O-N 2.81Å; I389-E497 PolarHBondContact N-OE1 2.68Å; I389-E497 PolarHBondContact N-OE2 2.69Å
390	S	82.6	Confident	79.4	Confident	4 Å²	4	63.9 Å²	63.9	3%	0.028	38%	0.375	C	S	.	.	G	3₁₀ helix	trans	-75.8	-7.4	179.6	-49.1	0	0	0	0	113.1	P388 G392 F493 E497 W522 Y552	P388-S390 PolarHBondContact O-N 3.05Å; S390-G392 VanDerWaalsContact C-N 3.35Å; S390-F493 WeakPolarHBondContact O-CD2 3.33Å; S390-E497 WeakPolarHBondContact CB-OE1 3.4Å; S390-E497 PolarHBondContact N-OE1 2.85Å; S390-E497 PolarHBondContact OG-OE1 2.85Å; S390-W522 PolarHBondContact OG-O 2.89Å; S390-Y552 VanDerWaalsContact O-CE1 3.32Å; S390-Y552 WeakPolarHBondContact O-CE1 3.34Å
391	A	79.1	Confident	79.5	Confident	1 Å²	1	61.9 Å²	61.9	1%	0.008	36%	0.363	C	S	.	.	G	3₁₀ helix	trans	-73.3	-28.6	172.5	0	0	0	0	0	112.5	P388 I389 D393 L394	P388-A391 HydrophobicContact CG-CB 3.58Å; P388-A391 WeakPolarHBondContact O-CB 3.34Å; P388-A391 PolarHBondContact O-N 2.86Å; I389-A391 VanDerWaalsContact C-N 3.25Å; I389-A391 PolarHBondContact O-N 3.32Å; A391-D393 PolarHBondContact O-N 2.91Å; A391-L394 HydrophobicContact CB-CD1 4.1Å; A391-L394 WeakPolarHBondContact O-CB 3.32Å; A391-L394 VanDerWaalsContact O-CG 3.27Å; A391-L394 WeakPolarHBondContact O-CG 3.44Å; A391-L394 PolarHBondContact O-N 2.92Å
392	G	78.9	Confident	79.6	Confident	52 Å²	52	60 Å²	60	54%	0.536	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	34	-108.1	176.6	0	0	0	0	0	113.5	I389 S390 L394	I389-G392 PolarHBondContact O-N 2.81Å; S390-G392 VanDerWaalsContact C-N 3.35Å; G392-L394 PolarHBondContact O-N 2.72Å
393	D	79.9	Confident	80.1	Confident	95 Å²	95	56.5 Å²	56.5	51%	0.508	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-83.9	2.4	-174.4	-65.4	-26	0	0	0	115.8	A391 L395 S396 S399 L550	A391-D393 PolarHBondContact O-N 2.91Å; D393-L395 VanDerWaalsContact C-N 3.31Å; D393-L395 PolarHBondContact O-N 2.86Å; D393-S396 WeakPolarHBondContact CA-OG 3.34Å; D393-S396 PolarHBondContact O-N 3.03Å; D393-S396 PolarHBondContact O-OG 2.97Å; D393-S399 PolarHBondContact O-OG 2.8Å; D393-L550 HydrophobicContact CB-CD2 4.38Å
394	L	80.5	Confident	80.6	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-57.2	-41.1	-175.1	-81.3	-176.2	0	0	0	113.8	A391 G392 R486 L489 F493 L550	A391-L394 HydrophobicContact CB-CD1 4.1Å; A391-L394 WeakPolarHBondContact O-CB 3.32Å; A391-L394 VanDerWaalsContact O-CG 3.27Å; A391-L394 WeakPolarHBondContact O-CG 3.44Å; A391-L394 PolarHBondContact O-N 2.92Å; G392-L394 PolarHBondContact O-N 2.72Å; L394-R486 WeakPolarHBondContact O-CD 3.28Å; L394-R486 PolarHBondContact O-NH1 3.05Å; L394-L489 HydrophobicContact CD1-CB 3.97Å; L394-L489 HydrophobicContact CD2-CB 4.44Å; L394-L489 HydrophobicContact CD2-CD1 4.07Å; L394-F493 HydrophobicContact CD1-CD2 3.42Å; L394-F493 VanDerWaalsContact CD1-CD2 3.42Å; L394-F493 HydrophobicContact CD1-CE2 3.39Å; L394-F493 HydrophobicContact CD1-CG 4.45Å; L394-F493 HydrophobicContact CD1-CZ 4.41Å; L394-F493 HydrophobicContact CD2-CE2 4.36Å; L394-F493 HydrophobicContact CG-CD2 4.43Å; L394-F493 HydrophobicContact CG-CE2 4.05Å; L394-L550 HydrophobicContact CD2-CD1 3.58Å; L394-L550 HydrophobicContact CG-CD1 4.44Å
395	L	83.4	Confident	81.3	Confident	44 Å²	44	46 Å²	46	23%	0.23	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-112	11.2	179	-63.9	175.5	0	0	0	112.1	V379 L385 D393 V400 R486 L487	V379-L395 HydrophobicContact CG1-CD2 4.48Å; L385-L395 HydrophobicContact CD2-CD1 3.69Å; D393-L395 VanDerWaalsContact C-N 3.31Å; D393-L395 PolarHBondContact O-N 2.86Å; L395-V400 VanDerWaalsContact C-CG2 3.49Å; L395-R486 HydrophobicContact CD2-CB 4.09Å; L395-L487 HydrophobicContact CD1-CD2 4.22Å; L395-L487 HydrophobicContact CD2-CD2 4.16Å
396	S	84.3	Confident	81.7	Confident	19 Å²	19	48.6 Å²	48.6	13%	0.133	29%	0.285	C	S	.	.			trans	-63.3	128.5	176.3	65.6	0	0	0	0	110.4	D393 D398 S399 V400	D393-S396 WeakPolarHBondContact CA-OG 3.34Å; D393-S396 PolarHBondContact O-N 3.03Å; D393-S396 PolarHBondContact O-OG 2.97Å; S396-D398 PolarHBondContact O-N 3.05Å; S396-S399 PolarHBondContact O-N 2.94Å; S396-S399 PolarHBondContact OG-OG 3.46Å; S396-V400 WeakPolarHBondContact O-CG2 3.33Å; S396-V400 PolarHBondContact O-N 3.39Å
397	P	82.4	Confident	81.6	Confident	70 Å²	70	43.7 Å²	43.7	46%	0.455	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.2	-28.8	177	-34.4	40.2	0	0	0	114.9	A377	A377-P397 WeakPolarHBondContact O-CA 3.48Å; A377-P397 VanDerWaalsContact O-CB 3.22Å; A377-P397 WeakPolarHBondContact O-CB 3.27Å
398	D	81.3	Confident	81.7	Confident	77 Å²	77	40 Å²	40	41%	0.412	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-34.7	-171.5	-52.4	-36.4	0	0	0	112.7	S396 L435 H439	S396-D398 PolarHBondContact O-N 3.05Å; D398-L435 HydrophobicContact CB-CD2 4.13Å; D398-L435 VanDerWaalsContact CG-CD2 3.46Å; D398-L435 WeakPolarHBondContact OD1-CD2 3.4Å; D398-H439 PolarHBondContact O-CE1 3.44Å; D398-H439 PolarHBondContact O-NE2 3.33Å
399	S	82.8	Confident	81.3	Confident	28 Å²	28	43.5 Å²	43.5	20%	0.196	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.6	5.9	-170.8	76.8	0	0	0	0	115.3	D393 S396 L401 S402 R486	D393-S399 PolarHBondContact O-OG 2.8Å; S396-S399 PolarHBondContact O-N 2.94Å; S396-S399 PolarHBondContact OG-OG 3.46Å; S399-L401 VanDerWaalsContact C-N 3.31Å; S399-L401 PolarHBondContact O-N 3.35Å; S399-S402 PolarHBondContact O-N 3.3Å; S399-S402 PolarHBondContact O-OG 3.4Å; S399-R486 PolarHBondContact O-NH2 3.43Å; S399-R486 VanDerWaalsContact O-NH2 3.08Å
400	V	85.8	Confident	81	Confident	2 Å²	2	36.6 Å²	36.6	1%	0.012	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-42.8	176.9	170	0	0	0	0	112.1	V379 L395 S396 R482	V379-V400 HydrophobicContact CG2-CG1 4.23Å; L395-V400 VanDerWaalsContact C-CG2 3.49Å; S396-V400 WeakPolarHBondContact O-CG2 3.33Å; S396-V400 PolarHBondContact O-N 3.39Å; V400-R482 PolarHBondContact O-NH1 2.97Å
401	L	87.2	Confident	80.8	Confident	3 Å²	3	40.8 Å²	40.8	2%	0.016	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.1	8.7	-173.8	-56.8	-174.3	0	0	0	113.6	L362 A377 S399 L404 Y441 W443 L479 R482	L362-L401 HydrophobicContact CD2-CD1 3.7Å; A377-L401 HydrophobicContact CB-CD1 3.62Å; A377-L401 HydrophobicContact CB-CG 3.97Å; S399-L401 VanDerWaalsContact C-N 3.31Å; S399-L401 PolarHBondContact O-N 3.35Å; L401-L404 HydrophobicContact CB-CD1 3.87Å; L401-L404 HydrophobicContact CB-CG 4.43Å; L401-L404 HydrophobicContact CD2-CD1 4.13Å; L401-L404 HydrophobicContact CG-CD1 4.43Å; L401-L404 WeakPolarHBondContact O-CG 3.46Å; L401-Y441 HydrophobicContact CB-CE2 4.2Å; L401-W443 HydrophobicContact CD1-CH2 4.32Å; L401-W443 HydrophobicContact CD1-CZ2 4.03Å; L401-L479 HydrophobicContact CD1-CD2 3.99Å; L401-L479 HydrophobicContact CD2-CD2 3.63Å; L401-L479 HydrophobicContact CG-CD2 4.42Å; L401-R482 HydrophobicContact CD2-CG 4.27Å
402	S	85.1	Confident	80.9	Confident	9 Å²	9	48.1 Å²	48.1	6%	0.063	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	145	172.8	66	0	0	0	0	110.2	S399 L404 Y441 R482 P571	S399-S402 PolarHBondContact O-N 3.3Å; S399-S402 PolarHBondContact O-OG 3.4Å; S402-L404 PolarHBondContact O-N 2.87Å; S402-L404 VanDerWaalsContact O-N 3.15Å; S402-Y441 PolarHBondContact N-OH 3.17Å; S402-R482 PolarHBondContact O-NH1 2.92Å; S402-P571 WeakPolarHBondContact O-CB 3.27Å
403	C	83.4	Confident	81	Confident	10 Å²	10	47.1 Å²	47.1	7%	0.068	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	50.8	41.4	178.8	-56.6	0	0	0	0	113.3	Y405 D408 R482 P571	C403-Y405 VanDerWaalsContact C-N 3.31Å; C403-Y405 CarbonylContact C-O 3.57Å; C403-Y405 WeakPolarHBondContact CA-O 3.38Å; C403-D408 WeakPolarHBondContact CA-O 3.49Å; C403-D408 PolarHBondContact N-O 3.25Å; C403-R482 PolarHBondContact O-NH2 2.93Å; C403-P571 HydrophobicContact CB-CB 4.11Å; C403-P571 HydrophobicContact CB-CG 4.34Å
404	L	83.3	Confident	81.1	Confident	21 Å²	21	43.4 Å²	43.4	11%	0.11	25%	0.245	C	C	.	.	S	Bend	trans	-62.6	-43.4	165.9	-83.7	168.3	0	0	0	110.6	L401 S402 W443 L478 L479 R482	L401-L404 HydrophobicContact CB-CD1 3.87Å; L401-L404 HydrophobicContact CB-CG 4.43Å; L401-L404 HydrophobicContact CD2-CD1 4.13Å; L401-L404 HydrophobicContact CG-CD1 4.43Å; L401-L404 WeakPolarHBondContact O-CG 3.46Å; S402-L404 PolarHBondContact O-N 2.87Å; S402-L404 VanDerWaalsContact O-N 3.15Å; L404-W443 HydrophobicContact CD1-CD2 4.31Å; L404-W443 HydrophobicContact CD1-CZ2 3.8Å; L404-L478 HydrophobicContact CD2-CB 4.38Å; L404-L479 HydrophobicContact CD1-CD2 3.56Å; L404-L479 HydrophobicContact CD2-CD2 4.35Å; L404-R482 HydrophobicContact CD2-CB 3.95Å; L404-R482 HydrophobicContact CD2-CG 4.16Å
405	Y	82.2	Confident	81.1	Confident	57 Å²	57	44.7 Å²	44.7	22%	0.224	25%	0.251	C	S	.	.	S	Bend	trans	-98.6	148.1	161.1	-67.9	-48.8	0	0	0	110.1	C403 G407 D408 W443 T475 L478	C403-Y405 VanDerWaalsContact C-N 3.31Å; C403-Y405 CarbonylContact C-O 3.57Å; C403-Y405 WeakPolarHBondContact CA-O 3.38Å; Y405-G407 PolarHBondContact O-N 3.33Å; Y405-D408 PolarHBondContact O-N 3.44Å; Y405-W443 HydrophobicContact CD2-CB 3.58Å; Y405-W443 HydrophobicContact CD2-CG 4.47Å; Y405-W443 HydrophobicContact CE2-CB 3.32Å; Y405-W443 HydrophobicContact CE2-CG 4.45Å; Y405-T475 HydrophobicContact CE2-CG2 4.35Å; Y405-T475 VanDerWaalsContact OH-CG2 3.23Å; Y405-T475 WeakPolarHBondContact OH-CG2 3.48Å; Y405-L478 HydrophobicContact CD1-CD1 4.31Å; Y405-L478 HydrophobicContact CE1-CD1 3.73Å
406	P	76.7	Confident	80.9	Confident	126 Å²	126	46 Å²	46	82%	0.818	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	125.9	178.4	-24.7	34.2	0	0	0	111.7	D408	P406-D408 VanDerWaalsContact C-N 3.35Å; P406-D408 PolarHBondContact O-N 2.92Å
407	G	71.9	Confident	80.8	Confident	54 Å²	54	47.2 Å²	47.2	56%	0.557	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	82	0.9	177.2	0	0	0	0	0	116	Y405 H409	Y405-G407 PolarHBondContact O-N 3.33Å; G407-H409 PolarHBondContact O-CD2 3.37Å; G407-H409 PolarHBondContact O-N 3.46Å
408	D	80.2	Confident	80.9	Confident	12 Å²	12	43.9 Å²	43.9	6%	0.064	25%	0.252	C	S	.	.			trans	-87	87.9	177.6	-165.1	2.6	0	0	0	111.1	C403 Y405 P406 L442	C403-D408 WeakPolarHBondContact CA-O 3.49Å; C403-D408 PolarHBondContact N-O 3.25Å; Y405-D408 PolarHBondContact O-N 3.44Å; P406-D408 VanDerWaalsContact C-N 3.35Å; P406-D408 PolarHBondContact O-N 2.92Å; D408-L442 PolarHBondContact OD1-N 3.07Å; D408-L442 WeakPolarHBondContact OD2-CB 3.46Å; D408-L442 PolarHBondContact OD2-N 3.14Å
409	H	73	Confident	80.9	Confident	82 Å²	82	47 Å²	47	38%	0.38	26%	0.264	S	S	.	.			trans	-82.9	-14.4	-176.5	-56.6	-70.4	0	0	0	113.6	G407 K411 T548	G407-H409 PolarHBondContact O-CD2 3.37Å; G407-H409 PolarHBondContact O-N 3.46Å; H409-K411 PolarHBondContact O-N 3.33Å; H409-T548 HydrophobicContact CB-CG2 4.25Å; H409-T548 PolarHBondContact CE1-OG1 3.31Å; H409-T548 VanDerWaalsContact ND1-CG2 3.26Å; H409-T548 WeakPolarHBondContact ND1-CG2 3.32Å; H409-T548 PolarHBondContact ND1-OG1 2.91Å
410	G	76.1	Confident	80.9	Confident	3 Å²	3	54.1 Å²	54.1	3%	0.031	29%	0.288	C	S	.	.	S	Bend	trans	64.7	15.8	-176.7	0	0	0	0	0	114.9	P440	G410-P440 WeakPolarHBondContact O-CD 3.17Å
411	K	79.6	Confident	80.6	Confident	92 Å²	92	57.4 Å²	57.4	40%	0.4	30%	0.303	S	S	.	.			trans	-100.9	-15.3	177.5	-63.4	-174.2	-176.8	-176.1	0	113.8	H409 L430 D547	H409-K411 PolarHBondContact O-N 3.33Å; K411-L430 WeakPolarHBondContact O-CD1 3.22Å; K411-L430 WeakPolarHBondContact O-CD2 3.46Å; K411-L430 WeakPolarHBondContact O-CG 3.27Å; K411-D547 IonicContact NZ-OD2 3.96Å; K411-D547 PolarHBondContact NZ-OD2 2.93Å
412	K	80.1	Confident	80.4	Confident	155 Å²	155	58 Å²	58	67%	0.674	31%	0.306	S	S	*	.	S	Bend	trans	-108.8	146.9	179.5	-66.7	-177	-179.7	179.3	0	110
413	T	81.8	Confident	80.4	Confident	31 Å²	31	63.9 Å²	63.9	19%	0.19	34%	0.336	C	S	.	.			trans	-73.5	131.1	171.8	42.2	0	0	0	0	111.1	I372 N415 N418 F422 L430	I372-T413 HydrophobicContact CD1-CG2 3.76Å; T413-N415 PolarHBondContact O-N 3.38Å; T413-N418 HydrophobicContact CG2-CB 4.19Å; T413-F422 HydrophobicContact CG2-CE2 3.56Å; T413-F422 HydrophobicContact CG2-CZ 4.03Å; T413-L430 HydrophobicContact CG2-CD1 4.13Å; T413-L430 HydrophobicContact CG2-CD2 4.05Å
414	P	81.9	Confident	80.2	Confident	16 Å²	16	72.3 Å²	72.3	10%	0.104	37%	0.372	C	S	.	.	S	Bend	trans	-60.9	-28.5	174.4	-29.4	38.3	0	0	0	114.8	P416 P440 L442 Q445 F452	P414-P416 WeakPolarHBondContact O-CD 3.47Å; P414-P440 WeakPolarHBondContact CG-O 3.36Å; P414-L442 HydrophobicContact CB-CD2 3.7Å; P414-L442 HydrophobicContact CG-CD2 3.85Å; P414-Q445 HydrophobicContact CB-CG 4.23Å; P414-Q445 HydrophobicContact CG-CG 3.99Å; P414-F452 HydrophobicContact CB-CB 4.32Å; P414-F452 HydrophobicContact CB-CD2 3.48Å; P414-F452 VanDerWaalsContact CB-CD2 3.48Å; P414-F452 HydrophobicContact CB-CE2 3.99Å; P414-F452 HydrophobicContact CB-CG 3.96Å; P414-F452 WeakPolarHBondContact O-CB 3.47Å
415	N	80.6	Confident	79.9	Confident	27 Å²	27	72 Å²	72	14%	0.144	37%	0.371	C	S	.	.			trans	-95.8	118	-177.2	-172.4	1.7	0	0	0	111.2	T413 A417 N418 F452	T413-N415 PolarHBondContact O-N 3.38Å; N415-A417 PolarHBondContact O-N 3.47Å; N415-A417 WeakPolarHBondContact OD1-CB 3.3Å; N415-A417 PolarHBondContact OD1-N 3.21Å; N415-N418 PolarHBondContact ND2-OD1 2.98Å; N415-N418 WeakPolarHBondContact O-CB 3.44Å; N415-N418 PolarHBondContact O-N 3.39Å; N415-N418 VanDerWaalsContact O-N 3.13Å; N415-F452 HydrophobicContact CB-CD1 3.8Å; N415-F452 HydrophobicContact CB-CE1 3.49Å; N415-F452 VanDerWaalsContact CB-CE1 3.49Å; N415-F452 HydrophobicContact CB-CZ 4.09Å
416	P	79.9	Confident	79.4	Confident	72 Å²	72	71 Å²	71	47%	0.468	38%	0.379	S	S	.	.	H	α-helix	trans	-60.3	-28	174.4	-24.1	34.8	0	0	0	113.6	P414 N418 Q419 Y420	P414-P416 WeakPolarHBondContact O-CD 3.47Å; P416-N418 PolarHBondContact O-N 3.08Å; P416-Q419 WeakPolarHBondContact O-CB 3.15Å; P416-Q419 PolarHBondContact O-N 2.8Å; P416-Q419 VanDerWaalsContact O-N 3.15Å; P416-Y420 WeakPolarHBondContact O-CD2 3.48Å
417	A	81.8	Confident	79.3	Confident	44 Å²	44	65.7 Å²	65.7	36%	0.364	34%	0.343	S	S	.	.	H	α-helix	trans	-61.2	-30.1	177.6	0	0	0	0	0	112.3	N415 Q419 Y420 Q421	N415-A417 PolarHBondContact O-N 3.47Å; N415-A417 WeakPolarHBondContact OD1-CB 3.3Å; N415-A417 PolarHBondContact OD1-N 3.21Å; A417-Q419 VanDerWaalsContact C-N 3.26Å; A417-Q419 PolarHBondContact O-N 3.36Å; A417-Y420 PolarHBondContact O-N 3.46Å; A417-Q421 PolarHBondContact O-N 3.46Å; A417-Q421 VanDerWaalsContact O-N 3.1Å
418	N	83.8	Confident	79	Confident	1 Å²	1	71.4 Å²	71.4	1%	0.005	36%	0.36	C	S	.	.	H	α-helix	trans	-70.3	-27.1	-179	-65.2	5.8	0	0	0	111.6	L370 I372 T413 N415 P416 Y420 Q421 F422	L370-N418 HydrophobicContact CD2-CB 4.34Å; L370-N418 PolarHBondContact O-ND2 2.94Å; L370-N418 PolarHBondContact O-OD1 3.3Å; L370-N418 VanDerWaalsContact O-OD1 3.14Å; I372-N418 WeakPolarHBondContact CD1-ND2 3.13Å; T413-N418 HydrophobicContact CG2-CB 4.19Å; N415-N418 PolarHBondContact ND2-OD1 2.98Å; N415-N418 WeakPolarHBondContact O-CB 3.44Å; N415-N418 PolarHBondContact O-N 3.39Å; N415-N418 VanDerWaalsContact O-N 3.13Å; P416-N418 PolarHBondContact O-N 3.08Å; N418-Y420 VanDerWaalsContact C-N 3.33Å; N418-Y420 PolarHBondContact O-N 2.91Å; N418-Q421 PolarHBondContact O-N 3.11Å; N418-F422 HydrophobicContact CB-CE2 4.23Å; N418-F422 WeakPolarHBondContact O-CB 3.41Å; N418-F422 WeakPolarHBondContact O-CD2 3.37Å; N418-F422 WeakPolarHBondContact O-CG 3.49Å; N418-F422 PolarHBondContact O-N 2.98Å
419	Q	82.6	Confident	78.2	Confident	141 Å²	141	74.5 Å²	74.5	66%	0.659	38%	0.379	S	S	*	.	H	α-helix	trans	-62.7	-42.5	174	-168.7	174.6	0.3	0	0	111.1	P416 A417 F422 D423	P416-Q419 WeakPolarHBondContact O-CB 3.15Å; P416-Q419 PolarHBondContact O-N 2.8Å; P416-Q419 VanDerWaalsContact O-N 3.15Å; A417-Q419 VanDerWaalsContact C-N 3.26Å; A417-Q419 PolarHBondContact O-N 3.36Å; Q419-F422 PolarHBondContact O-N 3.35Å; Q419-D423 WeakPolarHBondContact O-CB 3.28Å; Q419-D423 PolarHBondContact O-N 3.33Å
420	Y	81.9	Confident	78.1	Confident	179 Å²	179	71.9 Å²	71.9	70%	0.702	37%	0.368	S	S	*	.	H	α-helix	trans	-68.2	-37.8	174.6	-64.5	-80.3	0	0	0	112.5	P416 A417 N418 K424	P416-Y420 WeakPolarHBondContact O-CD2 3.48Å; A417-Y420 PolarHBondContact O-N 3.46Å; N418-Y420 VanDerWaalsContact C-N 3.33Å; N418-Y420 PolarHBondContact O-N 2.91Å; Y420-K424 PolarHBondContact O-N 3.1Å; Y420-K424 VanDerWaalsContact O-N 3.12Å
421	Q	80.3	Confident	77.8	Confident	70 Å²	70	73.9 Å²	73.9	33%	0.327	38%	0.381	S	S	.	.	H	α-helix	trans	-66.5	-39.4	175.9	-70	179.9	-15.6	0	0	111.9	N369 A417 N418 K424 V425	N369-Q421 PolarHBondContact O-OE1 3.13Å; A417-Q421 PolarHBondContact O-N 3.46Å; A417-Q421 VanDerWaalsContact O-N 3.1Å; N418-Q421 PolarHBondContact O-N 3.11Å; Q421-K424 WeakPolarHBondContact O-CB 3.36Å; Q421-K424 PolarHBondContact O-N 3.39Å; Q421-V425 WeakPolarHBondContact O-CG2 3.33Å; Q421-V425 PolarHBondContact O-N 3.43Å
422	F	83.3	Confident	77.4	Confident	15 Å²	15	75.4 Å²	75.4	7%	0.066	39%	0.394	C	S	.	.	H	α-helix	trans	-66.8	-41	175.9	-70	-29.2	0	0	0	112.4	L370 T413 N418 Q419 K424 V425 G426 I427 L430	L370-F422 HydrophobicContact CD1-CE1 3.84Å; L370-F422 HydrophobicContact CD1-CZ 3.84Å; L370-F422 HydrophobicContact CD2-CD1 4.39Å; L370-F422 HydrophobicContact CD2-CE1 3.64Å; L370-F422 HydrophobicContact CD2-CZ 4.02Å; L370-F422 HydrophobicContact CG-CE1 4.42Å; T413-F422 HydrophobicContact CG2-CE2 3.56Å; T413-F422 HydrophobicContact CG2-CZ 4.03Å; N418-F422 HydrophobicContact CB-CE2 4.23Å; N418-F422 WeakPolarHBondContact O-CB 3.41Å; N418-F422 WeakPolarHBondContact O-CD2 3.37Å; N418-F422 WeakPolarHBondContact O-CG 3.49Å; N418-F422 PolarHBondContact O-N 2.98Å; Q419-F422 PolarHBondContact O-N 3.35Å; F422-K424 VanDerWaalsContact C-N 3.27Å; F422-K424 PolarHBondContact O-N 3.21Å; F422-V425 CarbonylContact O-C 3.44Å; F422-V425 PolarHBondContact O-N 3.28Å; F422-V425 VanDerWaalsContact O-N 3.15Å; F422-G426 PolarHBondContact O-N 3.38Å; F422-I427 HydrophobicContact CB-CB 4Å; F422-I427 HydrophobicContact CB-CG2 4.35Å; F422-I427 HydrophobicContact CD1-CB 4.09Å; F422-I427 HydrophobicContact CD1-CD1 3.87Å; F422-I427 HydrophobicContact CD1-CG2 4.13Å; F422-I427 HydrophobicContact CE1-CD1 4.22Å; F422-I427 HydrophobicContact CG-CB 4.19Å; F422-I427 HydrophobicContact CG-CG2 4.15Å; F422-I427 PolarHBondContact O-N 3.26Å; F422-L430 HydrophobicContact CE2-CB 4.37Å; F422-L430 HydrophobicContact CE2-CD2 4.39Å
423	D	83.3	Confident	77.2	Confident	133 Å²	133	71.2 Å²	71.2	71%	0.711	37%	0.374	S	S	*	.	H	α-helix	trans	-60.2	-40.1	174.7	-164.9	38.5	0	0	0	111.2	Q419 V425 G426	Q419-D423 WeakPolarHBondContact O-CB 3.28Å; Q419-D423 PolarHBondContact O-N 3.33Å; D423-V425 VanDerWaalsContact C-N 3.27Å; D423-V425 PolarHBondContact O-N 2.87Å; D423-G426 PolarHBondContact O-N 3.2Å
424	K	80.6	Confident	77.1	Confident	187 Å²	187	70.3 Å²	70.3	81%	0.813	37%	0.369	S	S	*	.	H	α-helix	trans	-61.4	-28.6	176.3	-169.2	177.6	-179.2	-178.8	0	114.2	Y420 Q421 F422	Y420-K424 PolarHBondContact O-N 3.1Å; Y420-K424 VanDerWaalsContact O-N 3.12Å; Q421-K424 WeakPolarHBondContact O-CB 3.36Å; Q421-K424 PolarHBondContact O-N 3.39Å; F422-K424 VanDerWaalsContact C-N 3.27Å; F422-K424 PolarHBondContact O-N 3.21Å
425	V	76.6	Confident	76.7	Confident	14 Å²	14	74.5 Å²	74.5	9%	0.085	39%	0.39	C	S	.	.	H	α-helix	trans	-109.9	7	179.8	-60.3	0	0	0	0	113.3	R337 M340 Q421 F422 D423 I427	R337-V425 HydrophobicContact CG-CB 4.46Å; R337-V425 PolarHBondContact NE-O 2.97Å; M340-V425 HydrophobicContact CG-CG1 4.07Å; Q421-V425 WeakPolarHBondContact O-CG2 3.33Å; Q421-V425 PolarHBondContact O-N 3.43Å; F422-V425 CarbonylContact O-C 3.44Å; F422-V425 PolarHBondContact O-N 3.28Å; F422-V425 VanDerWaalsContact O-N 3.15Å; D423-V425 VanDerWaalsContact C-N 3.27Å; D423-V425 PolarHBondContact O-N 2.87Å; V425-I427 HydrophobicContact CG2-CB 4.42Å; V425-I427 HydrophobicContact CG2-CD1 3.71Å; V425-I427 HydrophobicContact CG2-CG1 3.86Å
426	G	72.1	Confident	76.8	Confident	38 Å²	38	78.6 Å²	78.6	39%	0.392	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.6	39.6	179.7	0	0	0	0	0	114	R337 F422 D423	R337-G426 PolarHBondContact NH2-O 2.77Å; F422-G426 PolarHBondContact O-N 3.38Å; D423-G426 PolarHBondContact O-N 3.2Å
427	I	73.4	Confident	76.8	Confident	14 Å²	14	75.6 Å²	75.6	7%	0.072	39%	0.388	C	S	.	.			trans	-91.6	115.1	168.7	-69.2	170.3	0	0	0	108.1	R337 F422 V425 Y433	R337-I427 HydrophobicContact CB-CD1 4.48Å; R337-I427 HydrophobicContact CG-CD1 4.05Å; R337-I427 HydrophobicContact CG-CG1 4Å; F422-I427 HydrophobicContact CB-CB 4Å; F422-I427 HydrophobicContact CB-CG2 4.35Å; F422-I427 HydrophobicContact CD1-CB 4.09Å; F422-I427 HydrophobicContact CD1-CD1 3.87Å; F422-I427 HydrophobicContact CD1-CG2 4.13Å; F422-I427 HydrophobicContact CE1-CD1 4.22Å; F422-I427 HydrophobicContact CG-CB 4.19Å; F422-I427 HydrophobicContact CG-CG2 4.15Å; F422-I427 PolarHBondContact O-N 3.26Å; V425-I427 HydrophobicContact CG2-CB 4.42Å; V425-I427 HydrophobicContact CG2-CD1 3.71Å; V425-I427 HydrophobicContact CG2-CG1 3.86Å; I427-Y433 HydrophobicContact CG1-CE2 4.49Å; I427-Y433 HydrophobicContact CG2-CE2 4.19Å
428	L	65.4	Low	77.1	Confident	174 Å²	174	73.6 Å²	73.6	91%	0.911	37%	0.372	S	S	*	.			trans	-81.9	-41.8	-177.6	-80.6	143.8	0	0	0	112.9
429	T	64.6	Low	77.3	Confident	76 Å²	76	74.6 Å²	74.6	47%	0.466	38%	0.376	S	S	.	.			trans	-143.9	132.6	-175.8	-15.5	0	0	0	0	110.5	S431	T429-S431 VanDerWaalsContact C-N 3.28Å; T429-S431 PolarHBondContact O-N 2.89Å
430	L	70	Confident	77.7	Confident	28 Å²	28	68.2 Å²	68.2	15%	0.147	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-13.9	178.3	57.1	133.8	0	0	0	113.7	K411 T413 F422 D432 Y433 V434 P440	K411-L430 WeakPolarHBondContact O-CD1 3.22Å; K411-L430 WeakPolarHBondContact O-CD2 3.46Å; K411-L430 WeakPolarHBondContact O-CG 3.27Å; T413-L430 HydrophobicContact CG2-CD1 4.13Å; T413-L430 HydrophobicContact CG2-CD2 4.05Å; F422-L430 HydrophobicContact CE2-CB 4.37Å; F422-L430 HydrophobicContact CE2-CD2 4.39Å; L430-D432 VanDerWaalsContact C-N 3.25Å; L430-D432 PolarHBondContact O-N 3.1Å; L430-Y433 PolarHBondContact O-N 2.98Å; L430-V434 HydrophobicContact CD1-CG2 3.93Å; L430-V434 VanDerWaalsContact O-CG2 3.31Å; L430-V434 WeakPolarHBondContact O-CG2 3.35Å; L430-V434 PolarHBondContact O-N 3.28Å; L430-P440 HydrophobicContact CD1-CG 4.1Å
431	S	69.3	Low	78	Confident	44 Å²	44	59.9 Å²	59.9	31%	0.308	32%	0.315	S	S	.	.	H	α-helix	trans	-57.9	-34.8	-174.7	-55.3	0	0	0	0	113.6	T429 Y433 V434	T429-S431 VanDerWaalsContact C-N 3.28Å; T429-S431 PolarHBondContact O-N 2.89Å; S431-Y433 VanDerWaalsContact C-N 3.26Å; S431-Y433 PolarHBondContact O-N 3.27Å; S431-V434 PolarHBondContact O-N 3.11Å
432	D	71.1	Confident	78.4	Confident	125 Å²	125	60 Å²	60	67%	0.668	32%	0.317	S	S	*	.	H	α-helix	trans	-67.5	-30.4	179.1	-58.5	-27.5	0	0	0	112	L430	L430-D432 VanDerWaalsContact C-N 3.25Å; L430-D432 PolarHBondContact O-N 3.1Å
433	Y	77	Confident	78.7	Confident	66 Å²	66	59.3 Å²	59.3	26%	0.259	31%	0.314	S	S	.	.	H	α-helix	trans	-92.7	-13.8	179.7	-57.9	-69.5	0	0	0	112.9	L341 I427 L430 S431 L435 E436 L437	L341-Y433 HydrophobicContact CD1-CD1 3.57Å; L341-Y433 HydrophobicContact CD1-CD2 4.07Å; L341-Y433 HydrophobicContact CD1-CE1 3.8Å; L341-Y433 HydrophobicContact CD1-CE2 4.27Å; L341-Y433 HydrophobicContact CD1-CG 3.71Å; I427-Y433 HydrophobicContact CG1-CE2 4.49Å; I427-Y433 HydrophobicContact CG2-CE2 4.19Å; L430-Y433 PolarHBondContact O-N 2.98Å; S431-Y433 VanDerWaalsContact C-N 3.26Å; S431-Y433 PolarHBondContact O-N 3.27Å; Y433-L435 PolarHBondContact O-N 3.01Å; Y433-E436 PolarHBondContact O-N 3.38Å; Y433-L437 WeakPolarHBondContact O-CB 3.22Å; Y433-L437 WeakPolarHBondContact O-CG 3.5Å; Y433-L437 PolarHBondContact O-N 3.14Å
434	V	78.9	Confident	79.1	Confident	12 Å²	12	53 Å²	53	7%	0.073	28%	0.28	C	S	.	.	H	α-helix	trans	-65.1	-37.4	-179.4	163.5	0	0	0	0	111.9	L430 S431 E436 G438 H439	L430-V434 HydrophobicContact CD1-CG2 3.93Å; L430-V434 VanDerWaalsContact O-CG2 3.31Å; L430-V434 WeakPolarHBondContact O-CG2 3.35Å; L430-V434 PolarHBondContact O-N 3.28Å; S431-V434 PolarHBondContact O-N 3.11Å; V434-E436 VanDerWaalsContact C-N 3.25Å; V434-E436 PolarHBondContact O-N 3.23Å; V434-G438 CarbonylContact O-C 3.55Å; V434-G438 WeakPolarHBondContact O-CA 3.44Å; V434-G438 PolarHBondContact O-N 3.2Å; V434-H439 HydrophobicContact CG1-CB 4.38Å; V434-H439 WeakPolarHBondContact CG1-CE1 3.25Å; V434-H439 WeakPolarHBondContact CG1-ND1 3.45Å
435	L	74.1	Confident	79.5	Confident	105 Å²	105	44.1 Å²	44.1	55%	0.55	24%	0.242	S	C	.	.	H	α-helix	trans	-63	-36.6	175	-66.6	173.6	0	0	0	111.4	K376 D398 Y433	K376-L435 PolarHBondContact NZ-O 2.81Å; D398-L435 HydrophobicContact CB-CD2 4.13Å; D398-L435 VanDerWaalsContact CG-CD2 3.46Å; D398-L435 WeakPolarHBondContact OD1-CD2 3.4Å; Y433-L435 PolarHBondContact O-N 3.01Å
436	E	81.9	Confident	80	Confident	113 Å²	113	45.3 Å²	45.3	53%	0.528	25%	0.245	S	C	.	.	H	α-helix	trans	-76.9	-50.7	-179.5	-152.1	-151.5	117.5	0	0	111.6	R343 K376 Y433 V434	R343-E436 IonicContact CZ-OE1 2.85Å; R343-E436 PolarHBondContact NH1-O 3.16Å; R343-E436 PolarHBondContact NH2-O 3.5Å; R343-E436 IonicContact NH2-OE1 2.56Å; R343-E436 PolarHBondContact NH2-OE1 3.19Å; K376-E436 WeakPolarHBondContact CE-O 3.2Å; K376-E436 PolarHBondContact NZ-O 3.43Å; Y433-E436 PolarHBondContact O-N 3.38Å; V434-E436 VanDerWaalsContact C-N 3.25Å; V434-E436 PolarHBondContact O-N 3.23Å
437	L	81.9	Confident	80.7	Confident	9 Å²	9	43.5 Å²	43.5	5%	0.047	23%	0.227	C	C	.	.	H	α-helix	trans	-89	-21.6	-170.9	-58.5	175.2	0	0	0	113.6	L341 R343 L367 T374 Y433	L341-L437 HydrophobicContact CB-CD1 4.24Å; L341-L437 HydrophobicContact CD1-CD1 4.39Å; L341-L437 HydrophobicContact CD2-CD1 3.8Å; L341-L437 HydrophobicContact CG-CD1 4.35Å; R343-L437 HydrophobicContact CG-CD2 4Å; L367-L437 HydrophobicContact CD1-CD1 4.07Å; L367-L437 HydrophobicContact CD2-CD1 4.46Å; L367-L437 HydrophobicContact CD2-CD2 4.21Å; T374-L437 WeakPolarHBondContact CB-O 3.26Å; T374-L437 PolarHBondContact OG1-O 2.91Å; Y433-L437 WeakPolarHBondContact O-CB 3.22Å; Y433-L437 WeakPolarHBondContact O-CG 3.5Å; Y433-L437 PolarHBondContact O-N 3.14Å
438	G	86.1	Confident	81.2	Confident	2 Å²	2	42.9 Å²	42.9	2%	0.021	22%	0.224	C	C	.	.			trans	97.5	170.1	-170.8	0	0	0	0	0	113.2	T374 V375 V434	T374-G438 WeakPolarHBondContact CG2-O 3.45Å; V375-G438 WeakPolarHBondContact O-CA 3.43Å; V434-G438 CarbonylContact O-C 3.55Å; V434-G438 WeakPolarHBondContact O-CA 3.44Å; V434-G438 PolarHBondContact O-N 3.2Å
439	H	89.2	Confident	82	Confident	22 Å²	22	34.6 Å²	34.6	10%	0.102	18%	0.18	C	C	.	.	B	Isolated β-bridge	trans	-86.4	127	-174.4	-66.9	-93.5	0	0	0	112.1	T374 V375 D398 V434 Y441	T374-H439 WeakPolarHBondContact CA-O 3.4Å; V375-H439 PolarHBondContact N-O 2.91Å; V375-H439 PolarHBondContact O-N 2.84Å; D398-H439 PolarHBondContact O-CE1 3.44Å; D398-H439 PolarHBondContact O-NE2 3.33Å; V434-H439 HydrophobicContact CG1-CB 4.38Å; V434-H439 WeakPolarHBondContact CG1-CE1 3.25Å; V434-H439 WeakPolarHBondContact CG1-ND1 3.45Å; H439-Y441 VanDerWaalsContact C-N 3.31Å; H439-Y441 HydrophobicContact CB-CD2 3.74Å; H439-Y441 HydrophobicContact CB-CE1 4.21Å; H439-Y441 HydrophobicContact CB-CE2 3.29Å; H439-Y441 HydrophobicContact CB-CG 4.35Å; H439-Y441 AromaticContact CG-CE2 3.94Å; H439-Y441 AromaticContact CG-CZ 3.82Å; H439-Y441 PolarHBondContact O-N 3.38Å; H439-Y441 VanDerWaalsContact O-N 3.14Å
440	P	90.3	Very high	82.8	Confident	7 Å²	7	31.9 Å²	31.9	5%	0.045	16%	0.163	C	C	.	.			trans	-86.5	61.1	177	35.7	-37.7	0	0	0	112.1	I372 T374 G410 P414 L430	I372-P440 HydrophobicContact CG2-CB 3.62Å; T374-P440 HydrophobicContact CG2-CB 4.11Å; G410-P440 WeakPolarHBondContact O-CD 3.17Å; P414-P440 WeakPolarHBondContact CG-O 3.36Å; L430-P440 HydrophobicContact CD1-CG 4.1Å
441	Y	89.6	Confident	83.2	Confident	4 Å²	4	33.2 Å²	33.2	2%	0.016	17%	0.168	C	C	.	.			trans	-64.2	152.9	178.5	-62.2	-66.2	0	0	0	112.5	V375 L401 S402 H439 W443 V444 Q445	V375-Y441 HydrophobicContact CG1-CD2 3.59Å; V375-Y441 HydrophobicContact CG1-CE2 3.86Å; L401-Y441 HydrophobicContact CB-CE2 4.2Å; S402-Y441 PolarHBondContact N-OH 3.17Å; H439-Y441 VanDerWaalsContact C-N 3.31Å; H439-Y441 HydrophobicContact CB-CD2 3.74Å; H439-Y441 HydrophobicContact CB-CE1 4.21Å; H439-Y441 HydrophobicContact CB-CE2 3.29Å; H439-Y441 HydrophobicContact CB-CG 4.35Å; H439-Y441 AromaticContact CG-CE2 3.94Å; H439-Y441 AromaticContact CG-CZ 3.82Å; H439-Y441 PolarHBondContact O-N 3.38Å; H439-Y441 VanDerWaalsContact O-N 3.14Å; Y441-W443 AromaticContact CD2-CE2 3.97Å; Y441-W443 HydrophobicContact CD2-CZ2 4.02Å; Y441-W443 AromaticContact CD2-NE1 3.51Å; Y441-W443 AromaticContact CG-CD1 3.97Å; Y441-W443 AromaticContact CG-NE1 3.36Å; Y441-V444 HydrophobicContact CD2-CG2 4.24Å; Y441-V444 WeakPolarHBondContact O-CB 3.41Å; Y441-V444 PolarHBondContact O-N 3.1Å; Y441-Q445 PolarHBondContact O-N 3.34Å
442	L	87.6	Confident	83.6	Confident	71 Å²	71	32.5 Å²	32.5	37%	0.372	16%	0.16	S	C	.	.	H	α-helix	trans	-67.1	-38.2	178.5	-65.3	173.7	0	0	0	112.2	D408 P414 V444 Q445 K446	D408-L442 PolarHBondContact OD1-N 3.07Å; D408-L442 WeakPolarHBondContact OD2-CB 3.46Å; D408-L442 PolarHBondContact OD2-N 3.14Å; P414-L442 HydrophobicContact CB-CD2 3.7Å; P414-L442 HydrophobicContact CG-CD2 3.85Å; L442-V444 PolarHBondContact O-N 3.36Å; L442-Q445 PolarHBondContact O-N 3.32Å; L442-K446 WeakPolarHBondContact O-CG 3.44Å; L442-K446 PolarHBondContact O-N 3.31Å; L442-K446 VanDerWaalsContact O-N 3.17Å
443	W	89	Confident	83.7	Confident	2 Å²	2	29.4 Å²	29.4	1%	0.008	15%	0.146	C	C	.	.	H	α-helix	trans	-63.9	-33.1	178.6	65.9	-94.1	0	0	0	112.2	L362 F364 V375 L401 L404 Y405 Y441 K446 L447 T475 L479	L362-W443 HydrophobicContact CD2-CH2 3.97Å; F364-W443 HydrophobicContact CE1-CH2 4.33Å; F364-W443 HydrophobicContact CE1-CZ3 4.36Å; F364-W443 HydrophobicContact CZ-CH2 4.39Å; F364-W443 HydrophobicContact CZ-CZ3 4.17Å; V375-W443 HydrophobicContact CG1-CH2 4.46Å; V375-W443 HydrophobicContact CG1-CZ2 4.16Å; L401-W443 HydrophobicContact CD1-CH2 4.32Å; L401-W443 HydrophobicContact CD1-CZ2 4.03Å; L404-W443 HydrophobicContact CD1-CD2 4.31Å; L404-W443 HydrophobicContact CD1-CZ2 3.8Å; Y405-W443 HydrophobicContact CD2-CB 3.58Å; Y405-W443 HydrophobicContact CD2-CG 4.47Å; Y405-W443 HydrophobicContact CE2-CB 3.32Å; Y405-W443 HydrophobicContact CE2-CG 4.45Å; Y441-W443 AromaticContact CD2-CE2 3.97Å; Y441-W443 HydrophobicContact CD2-CZ2 4.02Å; Y441-W443 AromaticContact CD2-NE1 3.51Å; Y441-W443 AromaticContact CG-CD1 3.97Å; Y441-W443 AromaticContact CG-NE1 3.36Å; W443-K446 PolarHBondContact O-N 3.06Å; W443-L447 HydrophobicContact CE3-CD1 3.72Å; W443-L447 HydrophobicContact CE3-CG 4.4Å; W443-L447 HydrophobicContact CZ3-CD1 3.73Å; W443-L447 WeakPolarHBondContact O-CG 3.47Å; W443-L447 PolarHBondContact O-N 3.16Å; W443-L447 VanDerWaalsContact O-N 3.1Å; W443-T475 HydrophobicContact CB-CG2 4.43Å; W443-L479 HydrophobicContact CH2-CD2 4.38Å
444	V	91.4	Very high	83.3	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-63.8	-48.7	177.8	178.1	0	0	0	0	109.5	F364 M373 V375 Y441 L442 K446 L447 G448	F364-V444 HydrophobicContact CD1-CG1 3.7Å; F364-V444 HydrophobicContact CE1-CB 4.39Å; F364-V444 HydrophobicContact CE1-CG1 3.6Å; F364-V444 HydrophobicContact CE1-CG2 4Å; M373-V444 HydrophobicContact CB-CG1 4.28Å; M373-V444 HydrophobicContact CE-CB 4.5Å; M373-V444 HydrophobicContact CE-CG1 3.26Å; M373-V444 HydrophobicContact CG-CG1 3.76Å; M373-V444 HydrophobicContact SD-CG1 3.85Å; V375-V444 HydrophobicContact CB-CG2 4.06Å; V375-V444 HydrophobicContact CG1-CG2 3.76Å; Y441-V444 HydrophobicContact CD2-CG2 4.24Å; Y441-V444 WeakPolarHBondContact O-CB 3.41Å; Y441-V444 PolarHBondContact O-N 3.1Å; L442-V444 PolarHBondContact O-N 3.36Å; V444-K446 VanDerWaalsContact C-N 3.29Å; V444-K446 PolarHBondContact O-N 3.48Å; V444-L447 WeakPolarHBondContact O-CB 3.29Å; V444-L447 PolarHBondContact O-N 2.85Å; V444-G448 PolarHBondContact O-N 2.79Å; V444-G448 VanDerWaalsContact O-N 3.14Å
445	Q	89.9	Confident	82.5	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.005	20%	0.198	C	C	.	.	H	α-helix	trans	-56.4	-44.7	176.3	-51.4	-51.5	-33.7	0	0	111.8	M373 P414 Y441 L442 L447 G448 G449 L450 F452	M373-Q445 VanDerWaalsContact N-OE1 3.17Å; M373-Q445 PolarHBondContact O-NE2 3.13Å; P414-Q445 HydrophobicContact CB-CG 4.23Å; P414-Q445 HydrophobicContact CG-CG 3.99Å; Y441-Q445 PolarHBondContact O-N 3.34Å; L442-Q445 PolarHBondContact O-N 3.32Å; Q445-L447 VanDerWaalsContact C-N 3.26Å; Q445-L447 PolarHBondContact O-N 3.15Å; Q445-G448 CarbonylContact O-C 3.55Å; Q445-G448 PolarHBondContact O-N 2.93Å; Q445-G448 VanDerWaalsContact O-N 3.07Å; Q445-G449 PolarHBondContact O-N 3.15Å; Q445-G449 VanDerWaalsContact O-N 3.15Å; Q445-L450 CarbonylContact C-O 3.59Å; Q445-L450 VanDerWaalsContact C-O 3.29Å; Q445-L450 HydrophobicContact CB-CB 4.04Å; Q445-L450 WeakPolarHBondContact CB-O 3.49Å; Q445-L450 PolarHBondContact O-N 3.4Å; Q445-F452 HydrophobicContact CB-CD2 4.08Å; Q445-F452 HydrophobicContact CB-CE2 3.94Å; Q445-F452 HydrophobicContact CG-CD2 3.94Å; Q445-F452 HydrophobicContact CG-CE2 3.68Å
446	K	86.6	Confident	81.3	Confident	38 Å²	38	43.3 Å²	43.3	17%	0.165	21%	0.208	C	C	.	.	H	α-helix	trans	-61	-33.1	178	-70.8	179.7	171.2	-162	0	113.3	L442 W443 V444 G449 S468	L442-K446 WeakPolarHBondContact O-CG 3.44Å; L442-K446 PolarHBondContact O-N 3.31Å; L442-K446 VanDerWaalsContact O-N 3.17Å; W443-K446 PolarHBondContact O-N 3.06Å; V444-K446 VanDerWaalsContact C-N 3.29Å; V444-K446 PolarHBondContact O-N 3.48Å; K446-G449 PolarHBondContact O-N 2.83Å; K446-S468 PolarHBondContact O-OG 2.95Å
447	L	86.6	Confident	79.3	Confident	1 Å²	1	43.9 Å²	43.9	1%	0.005	22%	0.222	C	C	.	.	H	α-helix	trans	-73.4	-31	175.1	-67.9	-175	0	0	0	112.8	L271 W443 V444 Q445 G449 S468 H471 M472 T475	L271-L447 HydrophobicContact CD1-CB 4.21Å; W443-L447 HydrophobicContact CE3-CD1 3.72Å; W443-L447 HydrophobicContact CE3-CG 4.4Å; W443-L447 HydrophobicContact CZ3-CD1 3.73Å; W443-L447 WeakPolarHBondContact O-CG 3.47Å; W443-L447 PolarHBondContact O-N 3.16Å; W443-L447 VanDerWaalsContact O-N 3.1Å; V444-L447 WeakPolarHBondContact O-CB 3.29Å; V444-L447 PolarHBondContact O-N 2.85Å; Q445-L447 VanDerWaalsContact C-N 3.26Å; Q445-L447 PolarHBondContact O-N 3.15Å; L447-G449 PolarHBondContact O-N 3.47Å; L447-S468 PolarHBondContact O-OG 3.43Å; L447-H471 HydrophobicContact CD2-CB 4.41Å; L447-M472 HydrophobicContact CD1-SD 4.24Å; L447-M472 HydrophobicContact CD2-CB 4.42Å; L447-M472 HydrophobicContact CD2-SD 3.67Å; L447-M472 HydrophobicContact CG-SD 4.47Å; L447-T475 HydrophobicContact CD2-CG2 4.26Å
448	G	83.6	Confident	77.4	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	7.6	171	0	0	0	0	0	114.2	P267 V444 Q445 L450	P267-G448 WeakPolarHBondContact CA-O 3.2Å; P267-G448 WeakPolarHBondContact O-CA 3.4Å; V444-G448 PolarHBondContact O-N 2.79Å; V444-G448 VanDerWaalsContact O-N 3.14Å; Q445-G448 CarbonylContact O-C 3.55Å; Q445-G448 PolarHBondContact O-N 2.93Å; Q445-G448 VanDerWaalsContact O-N 3.07Å; G448-L450 PolarHBondContact O-N 3.22Å
449	G	82.5	Confident	75.1	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.5	-7.6	-177.4	0	0	0	0	0	115.1	Q445 K446 L447 H451 A463 S468	Q445-G449 PolarHBondContact O-N 3.15Å; Q445-G449 VanDerWaalsContact O-N 3.15Å; K446-G449 PolarHBondContact O-N 2.83Å; L447-G449 PolarHBondContact O-N 3.47Å; G449-H451 PolarHBondContact O-N 3.43Å; G449-A463 VanDerWaalsContact O-CA 3.25Å; G449-A463 WeakPolarHBondContact O-CA 3.43Å; G449-S468 VanDerWaalsContact CA-OG 3.29Å; G449-S468 WeakPolarHBondContact CA-OG 3.45Å; G449-S468 PolarHBondContact N-OG 3.35Å; G449-S468 VanDerWaalsContact N-OG 3.13Å
450	L	81.5	Confident	72.5	Confident	19 Å²	19	63 Å²	63	10%	0.099	32%	0.317	C	S	.	.			trans	-72.2	115.6	179.9	-64.9	176	0	0	0	110.7	P267 Q445 G448 F452	P267-L450 HydrophobicContact CB-CD1 4Å; P267-L450 HydrophobicContact CB-CG 4.1Å; P267-L450 HydrophobicContact CG-CD1 3.87Å; P267-L450 HydrophobicContact CG-CD2 3.98Å; P267-L450 HydrophobicContact CG-CG 3.97Å; Q445-L450 CarbonylContact C-O 3.59Å; Q445-L450 VanDerWaalsContact C-O 3.29Å; Q445-L450 HydrophobicContact CB-CB 4.04Å; Q445-L450 WeakPolarHBondContact CB-O 3.49Å; Q445-L450 PolarHBondContact O-N 3.4Å; G448-L450 PolarHBondContact O-N 3.22Å; L450-F452 HydrophobicContact CB-CE2 3.96Å; L450-F452 HydrophobicContact CB-CZ 4.32Å
451	H	78.6	Confident	69.9	Low	57 Å²	57	67.8 Å²	67.8	26%	0.264	35%	0.346	S	S	.	.			trans	-106.9	110.6	177.4	-173.3	-84.2	0	0	0	111.1	G449 L467	G449-H451 PolarHBondContact O-N 3.43Å; H451-L467 HydrophobicContact CB-CD2 4.09Å
452	F	78.3	Confident	67.9	Low	29 Å²	29	74.6 Å²	74.6	13%	0.127	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-96.3	139.3	173.6	-63	-72	0	0	0	110.8	N371 P414 N415 Q445 L450 K454	N371-F452 WeakPolarHBondContact O-CZ 3.26Å; P414-F452 HydrophobicContact CB-CB 4.32Å; P414-F452 HydrophobicContact CB-CD2 3.48Å; P414-F452 VanDerWaalsContact CB-CD2 3.48Å; P414-F452 HydrophobicContact CB-CE2 3.99Å; P414-F452 HydrophobicContact CB-CG 3.96Å; P414-F452 WeakPolarHBondContact O-CB 3.47Å; N415-F452 HydrophobicContact CB-CD1 3.8Å; N415-F452 HydrophobicContact CB-CE1 3.49Å; N415-F452 VanDerWaalsContact CB-CE1 3.49Å; N415-F452 HydrophobicContact CB-CZ 4.09Å; Q445-F452 HydrophobicContact CB-CD2 4.08Å; Q445-F452 HydrophobicContact CB-CE2 3.94Å; Q445-F452 HydrophobicContact CG-CD2 3.94Å; Q445-F452 HydrophobicContact CG-CE2 3.68Å; L450-F452 HydrophobicContact CB-CE2 3.96Å; L450-F452 HydrophobicContact CB-CZ 4.32Å; F452-K454 PolarHBondContact O-N 3.33Å
453	P	72.7	Confident	65.7	Low	60 Å²	60	73.3 Å²	73.3	39%	0.39	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-56.4	130.1	171.8	-22.8	33.8	0	0	0	110.2	T460	P453-T460 HydrophobicContact CG-CG2 3.67Å
454	K	68.5	Low	64	Low	129 Å²	129	77 Å²	77	56%	0.561	40%	0.401	S	S	*	.	P	Polyproline II helix	trans	-73	163.7	168.9	-66.9	-177.7	176.8	-176.8	0	109.5	F452 Q456	F452-K454 PolarHBondContact O-N 3.33Å; K454-Q456 PolarHBondContact O-N 2.93Å; K454-Q456 VanDerWaalsContact O-O 3.14Å
455	E	62.5	Low	62.5	Low	185 Å²	185	81.4 Å²	81.4	86%	0.864	42%	0.421	S	S	*	.	S	Bend	trans	-61.4	-8.6	173.5	-62.9	137.1	160.8	0	0	112.9
456	Q	47.8	Very low	61.1	Low	160 Å²	160	84.8 Å²	84.8	75%	0.748	45%	0.445	S	S	*	.	S	Bend	trans	-115.5	144	165.9	-81.6	179.4	-9.8	0	0	111.3	K454 Q458	K454-Q456 PolarHBondContact O-N 2.93Å; K454-Q456 VanDerWaalsContact O-O 3.14Å; Q456-Q458 PolarHBondContact O-N 3.15Å
457	P	40.8	Very low	60	Low	126 Å²	126	84.8 Å²	84.8	82%	0.818	45%	0.447	S	S	*	.			trans	-74.2	120.8	-161.3	29.2	-33.9	0	0	0	112.7
458	Q	42.2	Very low	59	Low	149 Å²	149	84.7 Å²	84.7	70%	0.696	45%	0.446	S	S	*	.			trans	-142	147.4	154	-74.9	-173.1	-33.4	0	0	109.6	Q456	Q456-Q458 PolarHBondContact O-N 3.15Å
459	Q	37	Very low	58.2	Low	185 Å²	185	87.1 Å²	87.1	86%	0.864	47%	0.466	S	S	*	.			trans	-54.5	141.5	-168.8	-88.6	165.7	-35.9	0	0	114.7
460	T	35.3	Very low	57.7	Low	100 Å²	100	90.5 Å²	90.5	61%	0.613	49%	0.49	S	S	*	.			trans	-79.4	125.4	174.3	42	0	0	0	0	112.1	P453	P453-T460 HydrophobicContact CG-CG2 3.67Å
461	V	36.8	Very low	57.7	Low	108 Å²	108	91.6 Å²	91.6	66%	0.655	49%	0.494	S	S	*	.			trans	-151.3	153.3	154.1	-166.3	0	0	0	0	111.2
462	I	45.8	Very low	58	Low	146 Å²	146	89.1 Å²	89.1	75%	0.749	48%	0.483	S	S	*	.			trans	-37.6	159.9	172.6	-59.9	152.5	0	0	0	114.9	D464	I462-D464 PolarHBondContact O-N 2.84Å; I462-D464 VanDerWaalsContact O-N 3.11Å
463	A	42.2	Very low	58.4	Low	45 Å²	45	91.7 Å²	91.7	37%	0.372	50%	0.495	S	S	.	.			trans	-46.1	113.8	176.9	0	0	0	0	0	113.4	G449	G449-A463 VanDerWaalsContact O-CA 3.25Å; G449-A463 WeakPolarHBondContact O-CA 3.43Å
464	D	53.6	Low	59.1	Low	80 Å²	80	92 Å²	92	43%	0.428	50%	0.496	S	S	.	.			trans	-117.6	129.7	-178.1	-168.2	-5.6	0	0	0	110.8	I462 S466 L467	I462-D464 PolarHBondContact O-N 2.84Å; I462-D464 VanDerWaalsContact O-N 3.11Å; D464-S466 PolarHBondContact O-N 3.36Å; D464-S466 WeakPolarHBondContact OD1-CB 3.26Å; D464-S466 PolarHBondContact OD1-N 2.8Å; D464-S466 PolarHBondContact OD1-OG 2.87Å; D464-S466 PolarHBondContact OD2-OG 3.05Å; D464-L467 PolarHBondContact O-N 2.83Å
465	H	59.3	Low	60.1	Low	91 Å²	91	86.1 Å²	86.1	42%	0.421	47%	0.471	S	S	.	.	H	α-helix	trans	-62.2	-31.1	173.9	-73.7	-85.9	0	0	0	111.8	L467 S468 A469	H465-L467 PolarHBondContact O-N 2.88Å; H465-S468 PolarHBondContact O-N 3.41Å; H465-A469 PolarHBondContact O-N 2.93Å; H465-A469 VanDerWaalsContact O-N 3.11Å
466	S	61.5	Low	61.3	Low	72 Å²	72	77.3 Å²	77.3	50%	0.503	43%	0.43	S	S	.	.	H	α-helix	trans	-66	-37.9	-177.4	81.1	0	0	0	0	112.8	D464 S470	D464-S466 PolarHBondContact O-N 3.36Å; D464-S466 WeakPolarHBondContact OD1-CB 3.26Å; D464-S466 PolarHBondContact OD1-N 2.8Å; D464-S466 PolarHBondContact OD1-OG 2.87Å; D464-S466 PolarHBondContact OD2-OG 3.05Å; S466-S470 PolarHBondContact O-N 2.83Å; S466-S470 PolarHBondContact O-OG 3.33Å
467	L	63.1	Low	63.2	Low	38 Å²	38	75.2 Å²	75.2	20%	0.199	42%	0.418	C	S	.	.	H	α-helix	trans	-66.8	-46.4	178.4	-173.2	73.7	0	0	0	110.6	H451 D464 H465 A469 S470 H471	H451-L467 HydrophobicContact CB-CD2 4.09Å; D464-L467 PolarHBondContact O-N 2.83Å; H465-L467 PolarHBondContact O-N 2.88Å; L467-A469 PolarHBondContact O-N 2.72Å; L467-S470 PolarHBondContact O-OG 3.37Å; L467-H471 PolarHBondContact O-N 2.87Å; L467-H471 PolarHBondContact O-ND1 2.89Å
468	S	66.3	Low	65.5	Low	0 Å²	0	72 Å²	72	0%	0	39%	0.394	C	S	.	.	H	α-helix	trans	-64.6	-40	-179	-54.3	0	0	0	0	111.5	K446 L447 G449 H465 H471 M472	K446-S468 PolarHBondContact O-OG 2.95Å; L447-S468 PolarHBondContact O-OG 3.43Å; G449-S468 VanDerWaalsContact CA-OG 3.29Å; G449-S468 WeakPolarHBondContact CA-OG 3.45Å; G449-S468 PolarHBondContact N-OG 3.35Å; G449-S468 VanDerWaalsContact N-OG 3.13Å; H465-S468 PolarHBondContact O-N 3.41Å; S468-H471 PolarHBondContact O-N 2.88Å; S468-M472 VanDerWaalsContact O-CB 3.3Å; S468-M472 WeakPolarHBondContact O-CB 3.48Å; S468-M472 PolarHBondContact O-N 3Å
469	A	65.5	Low	67.8	Low	51 Å²	51	65 Å²	65	42%	0.421	36%	0.361	S	S	.	.	H	α-helix	trans	-61	-47.1	179.5	0	0	0	0	0	113.7	Q274 H465 L467 H471	Q274-A469 VanDerWaalsContact NE2-CB 3.3Å; H465-A469 PolarHBondContact O-N 2.93Å; H465-A469 VanDerWaalsContact O-N 3.11Å; L467-A469 PolarHBondContact O-N 2.72Å; A469-H471 VanDerWaalsContact C-N 3.33Å; A469-H471 PolarHBondContact O-N 2.96Å
470	S	73.3	Confident	70.2	Confident	71 Å²	71	58.4 Å²	58.4	50%	0.497	33%	0.33	S	S	.	.	H	α-helix	trans	-69.6	-29.9	-179.5	55.2	0	0	0	0	113.1	S466 L467	S466-S470 PolarHBondContact O-N 2.83Å; S466-S470 PolarHBondContact O-OG 3.33Å; L467-S470 PolarHBondContact O-OG 3.37Å
471	H	79.8	Confident	72.7	Confident	41 Å²	41	55.8 Å²	55.8	19%	0.19	31%	0.314	C	S	.	.	H	α-helix	trans	-89	-20.4	179.8	-67.8	78	0	0	0	113.1	L447 L467 S468 A469 T474 T475	L447-H471 HydrophobicContact CD2-CB 4.41Å; L467-H471 PolarHBondContact O-N 2.87Å; L467-H471 PolarHBondContact O-ND1 2.89Å; S468-H471 PolarHBondContact O-N 2.88Å; A469-H471 VanDerWaalsContact C-N 3.33Å; A469-H471 PolarHBondContact O-N 2.96Å; H471-T474 PolarHBondContact O-N 3.42Å; H471-T474 PolarHBondContact O-OG1 3.42Å; H471-T474 VanDerWaalsContact O-OG1 3.04Å; H471-T475 WeakPolarHBondContact O-CB 3.36Å; H471-T475 VanDerWaalsContact O-CG2 3.27Å; H471-T475 WeakPolarHBondContact O-CG2 3.35Å; H471-T475 PolarHBondContact O-N 3.33Å; H471-T475 PolarHBondContact O-OG1 2.86Å
472	M	85.1	Confident	75.3	Confident	5 Å²	5	51.3 Å²	51.3	3%	0.025	29%	0.285	C	S	.	.	H	α-helix	trans	-61.3	-50.5	-177.5	-166	60.1	144.3	0	0	111.8	Q274 A275 Y278 L447 S468 T474 T475 M476	Q274-M472 HydrophobicContact CB-CE 4.27Å; A275-M472 HydrophobicContact CB-CE 3.54Å; Y278-M472 HydrophobicContact CD2-CG 4.4Å; Y278-M472 HydrophobicContact CG-CG 4.14Å; L447-M472 HydrophobicContact CD1-SD 4.24Å; L447-M472 HydrophobicContact CD2-CB 4.42Å; L447-M472 HydrophobicContact CD2-SD 3.67Å; L447-M472 HydrophobicContact CG-SD 4.47Å; S468-M472 VanDerWaalsContact O-CB 3.3Å; S468-M472 WeakPolarHBondContact O-CB 3.48Å; S468-M472 PolarHBondContact O-N 3Å; M472-T474 PolarHBondContact O-N 2.94Å; M472-T475 PolarHBondContact O-OG1 3.44Å; M472-M476 HydrophobicContact CE-CE 3.51Å; M472-M476 HydrophobicContact CG-CE 4.49Å; M472-M476 HydrophobicContact CG-CG 4.41Å; M472-M476 WeakPolarHBondContact O-CB 3.45Å; M472-M476 WeakPolarHBondContact O-CG 3.35Å; M472-M476 PolarHBondContact O-N 3.05Å; M472-M476 HydrophobicContact SD-CE 3.45Å; M472-M476 WeakPolarHBondContact SD-CE 3.46Å; M472-M476 HydrophobicContact SD-CG 4.32Å
473	E	87.4	Confident	77.4	Confident	83 Å²	83	44.5 Å²	44.5	39%	0.388	25%	0.251	S	S	.	.	H	α-helix	trans	-63.9	-42.3	-179.2	-176.8	-178.3	176.7	0	0	112.3	Y278 K477	Y278-E473 HydrophobicContact CE2-CB 3.87Å; Y278-E473 HydrophobicContact CE2-CG 3.98Å; E473-K477 HydrophobicContact CG-CD 4.34Å; E473-K477 WeakPolarHBondContact O-CG 3.33Å; E473-K477 PolarHBondContact O-N 3.03Å; E473-K477 WeakPolarHBondContact OE1-CE 3.39Å; E473-K477 IonicContact OE1-NZ 3.14Å; E473-K477 PolarHBondContact OE1-NZ 3.15Å
474	T	87.4	Confident	79.6	Confident	66 Å²	66	44.3 Å²	44.3	41%	0.405	24%	0.242	S	C	.	.	H	α-helix	trans	-68.2	-45.4	-177.5	55.6	0	0	0	0	111.6	H471 M472 K477 L478	H471-T474 PolarHBondContact O-N 3.42Å; H471-T474 PolarHBondContact O-OG1 3.42Å; H471-T474 VanDerWaalsContact O-OG1 3.04Å; M472-T474 PolarHBondContact O-N 2.94Å; T474-K477 PolarHBondContact O-N 3.37Å; T474-L478 WeakPolarHBondContact O-CG 3.46Å; T474-L478 PolarHBondContact O-N 2.93Å
475	T	89.2	Confident	81.3	Confident	6 Å²	6	40.6 Å²	40.6	4%	0.037	22%	0.222	C	C	.	.	H	α-helix	trans	-63.1	-44.6	175.8	53	0	0	0	0	111.7	Y405 W443 L447 H471 M472 K477 L478 L479	Y405-T475 HydrophobicContact CE2-CG2 4.35Å; Y405-T475 VanDerWaalsContact OH-CG2 3.23Å; Y405-T475 WeakPolarHBondContact OH-CG2 3.48Å; W443-T475 HydrophobicContact CB-CG2 4.43Å; L447-T475 HydrophobicContact CD2-CG2 4.26Å; H471-T475 WeakPolarHBondContact O-CB 3.36Å; H471-T475 VanDerWaalsContact O-CG2 3.27Å; H471-T475 WeakPolarHBondContact O-CG2 3.35Å; H471-T475 PolarHBondContact O-N 3.33Å; H471-T475 PolarHBondContact O-OG1 2.86Å; M472-T475 PolarHBondContact O-OG1 3.44Å; T475-K477 VanDerWaalsContact C-N 3.33Å; T475-K477 PolarHBondContact O-N 3.13Å; T475-L478 CarbonylContact O-C 3.59Å; T475-L478 WeakPolarHBondContact O-CB 3.21Å; T475-L478 PolarHBondContact O-N 3.46Å; T475-L478 VanDerWaalsContact O-N 3.09Å; T475-L479 WeakPolarHBondContact O-CG 3.35Å; T475-L479 PolarHBondContact O-N 3.47Å
476	M	88.6	Confident	82.8	Confident	1 Å²	1	36.5 Å²	36.5	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-61.2	-40.4	177.6	-68.2	-63.5	172.4	0	0	112.1	Y278 L286 L350 L352 M472 L479 K480	Y278-M476 HydrophobicContact CD1-CG 4.21Å; Y278-M476 HydrophobicContact CE1-CB 3.92Å; Y278-M476 HydrophobicContact CE1-CG 3.88Å; L286-M476 HydrophobicContact CD1-CE 3.8Å; L286-M476 HydrophobicContact CD1-SD 3.91Å; L350-M476 HydrophobicContact CD1-CE 3.85Å; L352-M476 HydrophobicContact CD1-SD 3.69Å; L352-M476 HydrophobicContact CD2-SD 3.96Å; L352-M476 HydrophobicContact CG-SD 4.38Å; M472-M476 HydrophobicContact CE-CE 3.51Å; M472-M476 HydrophobicContact CG-CE 4.49Å; M472-M476 HydrophobicContact CG-CG 4.41Å; M472-M476 WeakPolarHBondContact O-CB 3.45Å; M472-M476 WeakPolarHBondContact O-CG 3.35Å; M472-M476 PolarHBondContact O-N 3.05Å; M472-M476 HydrophobicContact SD-CE 3.45Å; M472-M476 WeakPolarHBondContact SD-CE 3.46Å; M472-M476 HydrophobicContact SD-CG 4.32Å; M476-L479 PolarHBondContact O-N 3.44Å; M476-L479 HydrophobicContact SD-CD1 4.09Å; M476-K480 WeakPolarHBondContact O-CG 3.2Å; M476-K480 PolarHBondContact O-N 3.25Å; M476-K480 VanDerWaalsContact O-N 3.08Å
477	K	87.7	Confident	84	Confident	115 Å²	115	33.7 Å²	33.7	50%	0.5	18%	0.182	S	C	.	.	H	α-helix	trans	-62.5	-43.2	172.2	-74.8	177.6	-174.6	171.8	0	112	E473 T474 T475 K480 T481	E473-K477 HydrophobicContact CG-CD 4.34Å; E473-K477 WeakPolarHBondContact O-CG 3.33Å; E473-K477 PolarHBondContact O-N 3.03Å; E473-K477 WeakPolarHBondContact OE1-CE 3.39Å; E473-K477 IonicContact OE1-NZ 3.14Å; E473-K477 PolarHBondContact OE1-NZ 3.15Å; T474-K477 PolarHBondContact O-N 3.37Å; T475-K477 VanDerWaalsContact C-N 3.33Å; T475-K477 PolarHBondContact O-N 3.13Å; K477-K480 PolarHBondContact O-N 2.81Å; K477-T481 WeakPolarHBondContact O-CG2 3.42Å; K477-T481 PolarHBondContact O-N 3.43Å; K477-T481 PolarHBondContact O-OG1 2.82Å
478	L	89.1	Confident	85.3	Confident	59 Å²	59	32.7 Å²	32.7	31%	0.309	18%	0.179	S	C	.	.	H	α-helix	trans	-64.8	-36.7	177	-71.2	173.5	0	0	0	112.7	L404 Y405 T474 T475 T481 R482	L404-L478 HydrophobicContact CD2-CB 4.38Å; Y405-L478 HydrophobicContact CD1-CD1 4.31Å; Y405-L478 HydrophobicContact CE1-CD1 3.73Å; T474-L478 WeakPolarHBondContact O-CG 3.46Å; T474-L478 PolarHBondContact O-N 2.93Å; T475-L478 CarbonylContact O-C 3.59Å; T475-L478 WeakPolarHBondContact O-CB 3.21Å; T475-L478 PolarHBondContact O-N 3.46Å; T475-L478 VanDerWaalsContact O-N 3.09Å; L478-T481 WeakPolarHBondContact CA-OG1 3.38Å; L478-T481 PolarHBondContact O-OG1 3.33Å; L478-R482 WeakPolarHBondContact O-CB 3.41Å; L478-R482 PolarHBondContact O-N 3.08Å
479	L	90.1	Very high	86.5	Confident	2 Å²	2	32.9 Å²	32.9	1%	0.01	18%	0.18	C	C	.	.	H	α-helix	trans	-63	-45	173.8	-69.5	176.1	0	0	0	110.8	L352 L360 L362 L401 L404 W443 T475 M476 R482 V483	L352-L479 HydrophobicContact CD1-CB 4.22Å; L352-L479 HydrophobicContact CD1-CD1 3.93Å; L360-L479 HydrophobicContact CD2-CB 4.19Å; L360-L479 HydrophobicContact CD2-CD2 4.33Å; L362-L479 HydrophobicContact CD2-CD1 4.13Å; L362-L479 HydrophobicContact CD2-CD2 4.45Å; L401-L479 HydrophobicContact CD1-CD2 3.99Å; L401-L479 HydrophobicContact CD2-CD2 3.63Å; L401-L479 HydrophobicContact CG-CD2 4.42Å; L404-L479 HydrophobicContact CD1-CD2 3.56Å; L404-L479 HydrophobicContact CD2-CD2 4.35Å; W443-L479 HydrophobicContact CH2-CD2 4.38Å; T475-L479 WeakPolarHBondContact O-CG 3.35Å; T475-L479 PolarHBondContact O-N 3.47Å; M476-L479 PolarHBondContact O-N 3.44Å; M476-L479 HydrophobicContact SD-CD1 4.09Å; L479-R482 PolarHBondContact O-N 2.92Å; L479-V483 WeakPolarHBondContact O-CG2 3.46Å; L479-V483 PolarHBondContact O-N 3.13Å
480	K	87.8	Confident	87.7	Confident	46 Å²	46	30.8 Å²	30.8	20%	0.2	16%	0.162	C	C	.	.	H	α-helix	trans	-61.9	-48.4	177	-72.5	-175.7	174.3	-161.2	0	112.1	D283 T285 M476 K477 R482 V483 Q484	D283-K480 IonicContact OD1-NZ 3.98Å; D283-K480 IonicContact OD2-NZ 3.13Å; D283-K480 PolarHBondContact OD2-NZ 2.95Å; T285-K480 PolarHBondContact OG1-NZ 3.49Å; M476-K480 WeakPolarHBondContact O-CG 3.2Å; M476-K480 PolarHBondContact O-N 3.25Å; M476-K480 VanDerWaalsContact O-N 3.08Å; K477-K480 PolarHBondContact O-N 2.81Å; K480-R482 VanDerWaalsContact C-N 3.28Å; K480-R482 PolarHBondContact O-N 3.26Å; K480-V483 PolarHBondContact O-N 2.71Å; K480-Q484 WeakPolarHBondContact O-CB 3.41Å; K480-Q484 VanDerWaalsContact O-CG 3.3Å; K480-Q484 WeakPolarHBondContact O-CG 3.33Å; K480-Q484 PolarHBondContact O-N 3.27Å
481	T	87.6	Confident	88.4	Confident	46 Å²	46	34.3 Å²	34.3	28%	0.282	17%	0.168	S	C	.	.	H	α-helix	trans	-63.8	-36.2	177.4	57.9	0	0	0	0	111.6	K477 L478 S485	K477-T481 WeakPolarHBondContact O-CG2 3.42Å; K477-T481 PolarHBondContact O-N 3.43Å; K477-T481 PolarHBondContact O-OG1 2.82Å; L478-T481 WeakPolarHBondContact CA-OG1 3.38Å; L478-T481 PolarHBondContact O-OG1 3.33Å; T481-S485 VanDerWaalsContact O-CB 3.23Å; T481-S485 WeakPolarHBondContact O-CB 3.34Å; T481-S485 PolarHBondContact O-N 2.93Å; T481-S485 PolarHBondContact O-OG 3.23Å
482	R	90.4	Very high	89	Confident	14 Å²	14	32.6 Å²	32.6	5%	0.053	16%	0.16	C	C	.	.	H	α-helix	trans	-62.7	-51.5	175.9	179.1	58.1	62.1	81.1	-1.2	111.7	V400 L401 S402 C403 L404 L478 L479 K480 Q484 S485 R486 P571	V400-R482 PolarHBondContact O-NH1 2.97Å; L401-R482 HydrophobicContact CD2-CG 4.27Å; S402-R482 PolarHBondContact O-NH1 2.92Å; C403-R482 PolarHBondContact O-NH2 2.93Å; L404-R482 HydrophobicContact CD2-CB 3.95Å; L404-R482 HydrophobicContact CD2-CG 4.16Å; L478-R482 WeakPolarHBondContact O-CB 3.41Å; L478-R482 PolarHBondContact O-N 3.08Å; L479-R482 PolarHBondContact O-N 2.92Å; K480-R482 VanDerWaalsContact C-N 3.28Å; K480-R482 PolarHBondContact O-N 3.26Å; R482-Q484 VanDerWaalsContact C-N 3.33Å; R482-Q484 PolarHBondContact O-N 2.76Å; R482-S485 WeakPolarHBondContact CA-OG 3.48Å; R482-S485 PolarHBondContact O-N 3.19Å; R482-S485 PolarHBondContact O-OG 3.02Å; R482-R486 HydrophobicContact CG-CG 4.47Å; R482-R486 WeakPolarHBondContact O-CG 3.48Å; R482-R486 PolarHBondContact O-N 3.34Å; R482-P571 PolarHBondContact NE-O 3.5Å; R482-P571 VanDerWaalsContact NE-O 3.13Å; R482-P571 PolarHBondContact NH2-O 3.4Å
483	V	89.8	Confident	89.4	Confident	3 Å²	3	32.3 Å²	32.3	2%	0.018	16%	0.159	C	C	.	.	H	α-helix	trans	-58.8	-47.2	179.1	173.7	0	0	0	0	110.5	L360 V379 L479 K480 S485 R486 L487	L360-V483 HydrophobicContact CB-CG2 4Å; L360-V483 HydrophobicContact CD1-CG2 4.22Å; L360-V483 HydrophobicContact CD2-CG2 3.73Å; L360-V483 HydrophobicContact CG-CG2 4.19Å; V379-V483 HydrophobicContact CG1-CG1 4.49Å; L479-V483 WeakPolarHBondContact O-CG2 3.46Å; L479-V483 PolarHBondContact O-N 3.13Å; K480-V483 PolarHBondContact O-N 2.71Å; V483-S485 PolarHBondContact O-N 3.35Å; V483-R486 PolarHBondContact O-N 3.32Å; V483-L487 HydrophobicContact CG1-CD1 3.85Å; V483-L487 HydrophobicContact CG1-CG 4.39Å; V483-L487 WeakPolarHBondContact O-CB 3.36Å; V483-L487 WeakPolarHBondContact O-CG 3.32Å; V483-L487 PolarHBondContact O-N 3.01Å
484	Q	88.6	Confident	89.5	Confident	40 Å²	40	30 Å²	30	19%	0.187	15%	0.154	C	C	.	.	H	α-helix	trans	-60.9	-43.5	177.4	-70.6	178.9	-32.2	0	0	112.3	K480 R482 L487 A488	K480-Q484 WeakPolarHBondContact O-CB 3.41Å; K480-Q484 VanDerWaalsContact O-CG 3.3Å; K480-Q484 WeakPolarHBondContact O-CG 3.33Å; K480-Q484 PolarHBondContact O-N 3.27Å; R482-Q484 VanDerWaalsContact C-N 3.33Å; R482-Q484 PolarHBondContact O-N 2.76Å; Q484-L487 PolarHBondContact O-N 3.19Å; Q484-A488 VanDerWaalsContact O-CB 3.25Å; Q484-A488 WeakPolarHBondContact O-CB 3.48Å; Q484-A488 PolarHBondContact O-N 3.4Å
485	S	89.6	Confident	89.8	Confident	2 Å²	2	28.2 Å²	28.2	1%	0.014	14%	0.144	C	C	.	.	H	α-helix	trans	-64.6	-40.6	178.6	73	0	0	0	0	112.8	T481 R482 V483 A488 L489	T481-S485 VanDerWaalsContact O-CB 3.23Å; T481-S485 WeakPolarHBondContact O-CB 3.34Å; T481-S485 PolarHBondContact O-N 2.93Å; T481-S485 PolarHBondContact O-OG 3.23Å; R482-S485 WeakPolarHBondContact CA-OG 3.48Å; R482-S485 PolarHBondContact O-N 3.19Å; R482-S485 PolarHBondContact O-OG 3.02Å; V483-S485 PolarHBondContact O-N 3.35Å; S485-A488 PolarHBondContact O-N 2.95Å; S485-L489 WeakPolarHBondContact O-CB 3.48Å; S485-L489 WeakPolarHBondContact O-CG 3.4Å; S485-L489 PolarHBondContact O-N 3.3Å
486	R	90.2	Very high	90	Very high	5 Å²	5	28 Å²	28	2%	0.019	14%	0.143	C	C	.	.	H	α-helix	trans	-70.2	-41.1	178.5	-68.9	-67.1	-172.3	111.1	-1.1	111.5	L394 L395 S399 R482 V483 L489 H490	L394-R486 WeakPolarHBondContact O-CD 3.28Å; L394-R486 PolarHBondContact O-NH1 3.05Å; L395-R486 HydrophobicContact CD2-CB 4.09Å; S399-R486 PolarHBondContact O-NH2 3.43Å; S399-R486 VanDerWaalsContact O-NH2 3.08Å; R482-R486 HydrophobicContact CG-CG 4.47Å; R482-R486 WeakPolarHBondContact O-CG 3.48Å; R482-R486 PolarHBondContact O-N 3.34Å; V483-R486 PolarHBondContact O-N 3.32Å; R486-L489 PolarHBondContact O-N 3.29Å; R486-H490 WeakPolarHBondContact O-CB 3.24Å; R486-H490 PolarHBondContact O-N 3.03Å
487	L	88.6	Confident	90.1	Very high	14 Å²	14	31 Å²	31	7%	0.073	16%	0.157	C	C	.	.	H	α-helix	trans	-66.5	-37	174.2	-69.1	175.3	0	0	0	112	S358 T381 L385 L395 V483 Q484 H490 K491	S358-L487 WeakPolarHBondContact OG-CD1 3.38Å; T381-L487 HydrophobicContact CG2-CD2 3.94Å; L385-L487 HydrophobicContact CD2-CD2 4.17Å; L395-L487 HydrophobicContact CD1-CD2 4.22Å; L395-L487 HydrophobicContact CD2-CD2 4.16Å; V483-L487 HydrophobicContact CG1-CD1 3.85Å; V483-L487 HydrophobicContact CG1-CG 4.39Å; V483-L487 WeakPolarHBondContact O-CB 3.36Å; V483-L487 WeakPolarHBondContact O-CG 3.32Å; V483-L487 PolarHBondContact O-N 3.01Å; Q484-L487 PolarHBondContact O-N 3.19Å; L487-H490 PolarHBondContact O-N 3.05Å; L487-K491 WeakPolarHBondContact O-CG 3.33Å; L487-K491 PolarHBondContact O-N 3.5Å; L487-K491 VanDerWaalsContact O-N 3.08Å
488	A	89.4	Confident	90.2	Very high	16 Å²	16	32.6 Å²	32.6	13%	0.132	17%	0.166	C	C	.	.	H	α-helix	trans	-64.9	-46	173.9	0	0	0	0	0	111.6	Q484 S485 H490 K491 Q492 H619	Q484-A488 VanDerWaalsContact O-CB 3.25Å; Q484-A488 WeakPolarHBondContact O-CB 3.48Å; Q484-A488 PolarHBondContact O-N 3.4Å; S485-A488 PolarHBondContact O-N 2.95Å; A488-H490 VanDerWaalsContact C-N 3.33Å; A488-H490 PolarHBondContact O-N 3.41Å; A488-K491 PolarHBondContact O-N 2.64Å; A488-Q492 VanDerWaalsContact O-CG 3.23Å; A488-Q492 WeakPolarHBondContact O-CG 3.32Å; A488-Q492 PolarHBondContact O-N 2.96Å; A488-H619 HydrophobicContact CB-CB 3.63Å
489	L	91.3	Very high	90.2	Very high	4 Å²	4	31 Å²	31	2%	0.021	16%	0.163	C	C	.	.	H	α-helix	trans	-60	-42	173.9	-79.1	174.4	0	0	0	112	L394 S485 R486 K491 Q492 F493 Y573 L622	L394-L489 HydrophobicContact CD1-CB 3.97Å; L394-L489 HydrophobicContact CD2-CB 4.44Å; L394-L489 HydrophobicContact CD2-CD1 4.07Å; S485-L489 WeakPolarHBondContact O-CB 3.48Å; S485-L489 WeakPolarHBondContact O-CG 3.4Å; S485-L489 PolarHBondContact O-N 3.3Å; R486-L489 PolarHBondContact O-N 3.29Å; L489-K491 PolarHBondContact O-N 3.3Å; L489-Q492 WeakPolarHBondContact O-CB 3.5Å; L489-Q492 PolarHBondContact O-N 2.9Å; L489-Q492 VanDerWaalsContact O-N 3.15Å; L489-F493 HydrophobicContact CD2-CE1 4.18Å; L489-F493 HydrophobicContact CD2-CZ 4.3Å; L489-F493 WeakPolarHBondContact O-CB 3.48Å; L489-F493 WeakPolarHBondContact O-CG 3.39Å; L489-F493 PolarHBondContact O-N 3.25Å; L489-Y573 HydrophobicContact CD1-CD1 3.48Å; L489-Y573 VanDerWaalsContact CD1-CD1 3.48Å; L489-Y573 HydrophobicContact CD1-CE1 4.02Å; L489-Y573 HydrophobicContact CD1-CG 3.76Å; L489-Y573 HydrophobicContact CD2-CD1 3.85Å; L489-Y573 HydrophobicContact CD2-CD2 4.45Å; L489-Y573 HydrophobicContact CD2-CE1 3.49Å; L489-Y573 VanDerWaalsContact CD2-CE1 3.49Å; L489-Y573 HydrophobicContact CD2-CE2 4.15Å; L489-Y573 HydrophobicContact CD2-CG 4.31Å; L489-Y573 HydrophobicContact CG-CD1 3.54Å; L489-Y573 HydrophobicContact CG-CE1 3.54Å; L489-Y573 HydrophobicContact CG-CG 4.23Å; L489-L622 HydrophobicContact CD2-CD2 3.99Å
490	H	90.6	Very high	90.3	Very high	7 Å²	7	36 Å²	36	3%	0.032	19%	0.189	C	C	.	.	H	α-helix	trans	-57.2	-48.9	176.6	-176.8	-77.6	0	0	0	111.6	L385 I386 T387 P388 R486 L487 A488 Q492 F493 A494	L385-H490 VanDerWaalsContact CD2-CE1 3.41Å; L385-H490 WeakPolarHBondContact CD2-CE1 3.5Å; L385-H490 WeakPolarHBondContact CD2-ND1 3.43Å; I386-H490 PolarHBondContact O-CE1 3.44Å; T387-H490 PolarHBondContact OG1-NE2 3.42Å; P388-H490 VanDerWaalsContact CD-NE2 3.33Å; P388-H490 WeakPolarHBondContact CD-NE2 3.48Å; R486-H490 WeakPolarHBondContact O-CB 3.24Å; R486-H490 PolarHBondContact O-N 3.03Å; L487-H490 PolarHBondContact O-N 3.05Å; A488-H490 VanDerWaalsContact C-N 3.33Å; A488-H490 PolarHBondContact O-N 3.41Å; H490-Q492 VanDerWaalsContact C-N 3.33Å; H490-Q492 PolarHBondContact O-N 3.45Å; H490-F493 PolarHBondContact O-N 2.78Å; H490-A494 PolarHBondContact O-N 3.29Å
491	K	89	Confident	90.6	Very high	146 Å²	146	34.8 Å²	34.8	64%	0.635	19%	0.185	S	C	*	.	H	α-helix	trans	-61.7	-39.4	174.6	-69.8	175.2	-178.2	178.7	0	112.5	L487 A488 L489 S495	L487-K491 WeakPolarHBondContact O-CG 3.33Å; L487-K491 PolarHBondContact O-N 3.5Å; L487-K491 VanDerWaalsContact O-N 3.08Å; A488-K491 PolarHBondContact O-N 2.64Å; L489-K491 PolarHBondContact O-N 3.3Å; K491-S495 PolarHBondContact O-N 3.26Å
492	Q	91.5	Very high	90.7	Very high	4 Å²	4	34.4 Å²	34.4	2%	0.019	18%	0.184	C	C	.	.	H	α-helix	trans	-66.2	-45.9	178	-72	167.6	2.2	0	0	111.4	A488 L489 H490 A494 S495 L496 P502 H619 T623	A488-Q492 VanDerWaalsContact O-CG 3.23Å; A488-Q492 WeakPolarHBondContact O-CG 3.32Å; A488-Q492 PolarHBondContact O-N 2.96Å; L489-Q492 WeakPolarHBondContact O-CB 3.5Å; L489-Q492 PolarHBondContact O-N 2.9Å; L489-Q492 VanDerWaalsContact O-N 3.15Å; H490-Q492 VanDerWaalsContact C-N 3.33Å; H490-Q492 PolarHBondContact O-N 3.45Å; Q492-A494 VanDerWaalsContact C-N 3.32Å; Q492-A494 PolarHBondContact O-N 3.46Å; Q492-S495 WeakPolarHBondContact O-CA 3.44Å; Q492-S495 WeakPolarHBondContact O-CB 3.44Å; Q492-S495 PolarHBondContact O-N 3.03Å; Q492-L496 WeakPolarHBondContact O-CG 3.5Å; Q492-L496 PolarHBondContact O-N 3.48Å; Q492-P502 HydrophobicContact CG-CG 4.41Å; Q492-H619 PolarHBondContact NE2-O 3Å; Q492-T623 HydrophobicContact CB-CG2 3.99Å; Q492-T623 HydrophobicContact CG-CG2 3.68Å
493	F	92.9	Very high	90.6	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-63.6	-39.5	179.3	-70.4	-3.3	0	0	0	112	P388 S390 L394 L489 H490 S495 L496 E497 W522 Y552 L569 L622	P388-F493 HydrophobicContact CG-CB 4.08Å; S390-F493 WeakPolarHBondContact O-CD2 3.33Å; L394-F493 HydrophobicContact CD1-CD2 3.42Å; L394-F493 VanDerWaalsContact CD1-CD2 3.42Å; L394-F493 HydrophobicContact CD1-CE2 3.39Å; L394-F493 HydrophobicContact CD1-CG 4.45Å; L394-F493 HydrophobicContact CD1-CZ 4.41Å; L394-F493 HydrophobicContact CD2-CE2 4.36Å; L394-F493 HydrophobicContact CG-CD2 4.43Å; L394-F493 HydrophobicContact CG-CE2 4.05Å; L489-F493 HydrophobicContact CD2-CE1 4.18Å; L489-F493 HydrophobicContact CD2-CZ 4.3Å; L489-F493 WeakPolarHBondContact O-CB 3.48Å; L489-F493 WeakPolarHBondContact O-CG 3.39Å; L489-F493 PolarHBondContact O-N 3.25Å; H490-F493 PolarHBondContact O-N 2.78Å; F493-S495 PolarHBondContact O-N 3.02Å; F493-L496 HydrophobicContact CD1-CD1 4.08Å; F493-L496 PolarHBondContact O-N 3.5Å; F493-L496 VanDerWaalsContact O-N 3.13Å; F493-E497 WeakPolarHBondContact O-CG 3.24Å; F493-E497 PolarHBondContact O-N 2.98Å; F493-W522 HydrophobicContact CD1-CZ2 4.13Å; F493-W522 AromaticContact CD1-NE1 3.75Å; F493-W522 AromaticContact CE1-CE2 3.95Å; F493-W522 AromaticContact CE1-CZ2 3.52Å; F493-W522 HydrophobicContact CE1-CZ2 3.52Å; F493-W522 AromaticContact CE1-NE1 3.96Å; F493-W522 AromaticContact CG-NE1 3.98Å; F493-W522 AromaticContact CZ-CZ2 3.92Å; F493-W522 HydrophobicContact CZ-CZ2 3.92Å; F493-Y552 AromaticContact CE2-CE1 3.86Å; F493-Y552 HydrophobicContact CE2-CE1 3.86Å; F493-Y552 HydrophobicContact CE2-CE2 4.17Å; F493-Y552 AromaticContact CE2-CZ 3.5Å; F493-Y552 VanDerWaalsContact CE2-OH 3.28Å; F493-Y552 WeakPolarHBondContact CE2-OH 3.24Å; F493-Y552 HydrophobicContact CZ-CD2 4.49Å; F493-Y552 HydrophobicContact CZ-CE1 4.12Å; F493-Y552 AromaticContact CZ-CE2 3.86Å; F493-Y552 HydrophobicContact CZ-CE2 3.86Å; F493-Y552 AromaticContact CZ-CZ 3.66Å; F493-L569 HydrophobicContact CZ-CD1 3.94Å; F493-L622 HydrophobicContact CD1-CD2 4.47Å; F493-L622 HydrophobicContact CE1-CD2 3.57Å; F493-L622 HydrophobicContact CZ-CD2 4.38Å
494	A	91.2	Very high	90.6	Very high	34 Å²	34	38.6 Å²	38.6	28%	0.281	21%	0.211	S	C	.	.	H	α-helix	trans	-56.5	-36.7	172.3	0	0	0	0	0	111.9	P388 H490 Q492 H498	P388-A494 HydrophobicContact CB-CB 4.42Å; P388-A494 HydrophobicContact CG-CB 4.19Å; H490-A494 PolarHBondContact O-N 3.29Å; Q492-A494 VanDerWaalsContact C-N 3.32Å; Q492-A494 PolarHBondContact O-N 3.46Å; A494-H498 PolarHBondContact O-CE1 2.91Å; A494-H498 PolarHBondContact O-ND1 3.02Å
495	S	92.6	Very high	90.5	Very high	29 Å²	29	41.2 Å²	41.2	20%	0.203	23%	0.233	C	C	.	.	H	α-helix	trans	-75.3	-41.8	173.7	-174.9	0	0	0	0	112.9	K491 Q492 F493 E497 H498 I500	K491-S495 PolarHBondContact O-N 3.26Å; Q492-S495 WeakPolarHBondContact O-CA 3.44Å; Q492-S495 WeakPolarHBondContact O-CB 3.44Å; Q492-S495 PolarHBondContact O-N 3.03Å; F493-S495 PolarHBondContact O-N 3.02Å; S495-E497 VanDerWaalsContact C-N 3.33Å; S495-E497 PolarHBondContact O-N 2.87Å; S495-H498 WeakPolarHBondContact O-CB 3.49Å; S495-H498 PolarHBondContact O-N 2.82Å; S495-H498 VanDerWaalsContact O-N 3.13Å; S495-I500 CarbonylContact C-O 3.59Å; S495-I500 VanDerWaalsContact C-O 3.3Å; S495-I500 PolarHBondContact O-N 3.43Å; S495-I500 VanDerWaalsContact O-O 3.1Å; S495-I500 PolarHBondContact OG-O 2.9Å
496	L	93.4	Very high	90.4	Very high	1 Å²	1	46 Å²	46	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-66.9	-31.6	-175.6	-69.1	175.4	0	0	0	112.9	Q492 F493 H498 G499 V501 L519 W522 L626	Q492-L496 WeakPolarHBondContact O-CG 3.5Å; Q492-L496 PolarHBondContact O-N 3.48Å; F493-L496 HydrophobicContact CD1-CD1 4.08Å; F493-L496 PolarHBondContact O-N 3.5Å; F493-L496 VanDerWaalsContact O-N 3.13Å; L496-H498 PolarHBondContact O-N 3.38Å; L496-G499 WeakPolarHBondContact O-CA 3.43Å; L496-G499 PolarHBondContact O-N 3.11Å; L496-V501 HydrophobicContact CD2-CB 4.38Å; L496-V501 HydrophobicContact CD2-CG1 4.48Å; L496-V501 HydrophobicContact CD2-CG2 4.05Å; L496-L519 HydrophobicContact CB-CD2 4.11Å; L496-L519 HydrophobicContact CD2-CD2 3.59Å; L496-L519 HydrophobicContact CG-CD2 4.4Å; L496-W522 HydrophobicContact CB-CB 4.27Å; L496-W522 HydrophobicContact CB-CD2 4.44Å; L496-W522 HydrophobicContact CB-CG 4.05Å; L496-W522 HydrophobicContact CD1-CD2 4.23Å; L496-W522 HydrophobicContact CD1-CE3 4.48Å; L496-L626 HydrophobicContact CD1-CD1 3.69Å; L496-L626 HydrophobicContact CD2-CD1 3.75Å; L496-L626 HydrophobicContact CG-CD1 4.41Å
497	E	90.8	Very high	90.3	Very high	65 Å²	65	45.8 Å²	45.8	30%	0.304	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-28.3	173.7	-74.7	-171.7	166	0	0	113	P388 I389 S390 F493 S495 G499	P388-E497 HydrophobicContact CB-CG 4.48Å; P388-E497 WeakPolarHBondContact CB-OE2 3.16Å; I389-E497 PolarHBondContact N-OE1 2.68Å; I389-E497 PolarHBondContact N-OE2 2.69Å; S390-E497 WeakPolarHBondContact CB-OE1 3.4Å; S390-E497 PolarHBondContact N-OE1 2.85Å; S390-E497 PolarHBondContact OG-OE1 2.85Å; F493-E497 WeakPolarHBondContact O-CG 3.24Å; F493-E497 PolarHBondContact O-N 2.98Å; S495-E497 VanDerWaalsContact C-N 3.33Å; S495-E497 PolarHBondContact O-N 2.87Å; E497-G499 PolarHBondContact O-N 3.39Å
498	H	90.2	Very high	90.2	Very high	148 Å²	148	50.8 Å²	50.8	69%	0.685	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	4.7	173.5	-61.8	92.9	0	0	0	112.7	A494 S495 L496 I500	A494-H498 PolarHBondContact O-CE1 2.91Å; A494-H498 PolarHBondContact O-ND1 3.02Å; S495-H498 WeakPolarHBondContact O-CB 3.49Å; S495-H498 PolarHBondContact O-N 2.82Å; S495-H498 VanDerWaalsContact O-N 3.13Å; L496-H498 PolarHBondContact O-N 3.38Å; H498-I500 HydrophobicContact CB-CD1 4.48Å; H498-I500 PolarHBondContact O-N 2.89Å
499	G	89.8	Confident	90.3	Very high	25 Å²	25	55.6 Å²	55.6	26%	0.258	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	74	12.1	-177.1	0	0	0	0	0	114.2	L496 E497 L519	L496-G499 WeakPolarHBondContact O-CA 3.43Å; L496-G499 PolarHBondContact O-N 3.11Å; E497-G499 PolarHBondContact O-N 3.39Å; G499-L519 VanDerWaalsContact CA-O 3.24Å; G499-L519 WeakPolarHBondContact CA-O 3.33Å
500	I	92.1	Very high	90.1	Very high	107 Å²	107	56.3 Å²	56.3	55%	0.549	30%	0.301	S	S	.	.			trans	-104.9	119.3	-178.4	-57.7	172.9	0	0	0	108.8	S495 H498 P502	S495-I500 CarbonylContact C-O 3.59Å; S495-I500 VanDerWaalsContact C-O 3.3Å; S495-I500 PolarHBondContact O-N 3.43Å; S495-I500 VanDerWaalsContact O-O 3.1Å; S495-I500 PolarHBondContact OG-O 2.9Å; H498-I500 HydrophobicContact CB-CD1 4.48Å; H498-I500 PolarHBondContact O-N 2.89Å; I500-P502 VanDerWaalsContact O-CD 3.26Å; I500-P502 WeakPolarHBondContact O-CD 3.23Å
501	V	93	Very high	90.2	Very high	20 Å²	20	56.7 Å²	56.7	12%	0.121	30%	0.302	C	S	.	.			trans	-83.8	110.2	173.6	-175.8	0	0	0	0	108.9	L496 V503 L519 T623 L626 Q627	L496-V501 HydrophobicContact CD2-CB 4.38Å; L496-V501 HydrophobicContact CD2-CG1 4.48Å; L496-V501 HydrophobicContact CD2-CG2 4.05Å; V501-V503 HydrophobicContact CG1-CG1 4.49Å; V501-V503 PolarHBondContact O-N 2.81Å; V501-L519 HydrophobicContact CG2-CB 4.22Å; V501-L519 HydrophobicContact CG2-CD2 4.32Å; V501-T623 WeakPolarHBondContact CG1-O 3.37Å; V501-L626 HydrophobicContact CG1-CB 4.29Å; V501-Q627 HydrophobicContact CG1-CB 4.13Å
502	P	90.8	Very high	90.3	Very high	38 Å²	38	50.5 Å²	50.5	25%	0.247	28%	0.277	C	S	.	.			trans	-79.9	109	-176.4	32.1	-31.9	0	0	0	109.7	Q492 I500 T623	Q492-P502 HydrophobicContact CG-CG 4.41Å; I500-P502 VanDerWaalsContact O-CD 3.26Å; I500-P502 WeakPolarHBondContact O-CD 3.23Å; P502-T623 HydrophobicContact CG-CG2 3.78Å; P502-T623 WeakPolarHBondContact O-CB 3.33Å; P502-T623 PolarHBondContact O-OG1 3.19Å
503	V	87.9	Confident	90.1	Very high	58 Å²	58	55.6 Å²	55.6	35%	0.352	32%	0.32	S	S	.	.			trans	-102.6	130.8	173.4	-67.9	0	0	0	0	110.1	V501 F511 Q627	V501-V503 HydrophobicContact CG1-CG1 4.49Å; V501-V503 PolarHBondContact O-N 2.81Å; V503-F511 HydrophobicContact CG1-CD2 4.48Å; V503-F511 HydrophobicContact CG1-CE2 4.2Å; V503-Q627 HydrophobicContact CG1-CB 4.04Å; V503-Q627 HydrophobicContact CG1-CG 3.89Å
504	T	88.6	Confident	89.9	Confident	47 Å²	47	62.6 Å²	62.6	29%	0.288	35%	0.35	S	S	.	.			trans	-77.5	155.6	176.8	58.7	0	0	0	0	111	D506 C507 Q508 Q620	T504-D506 PolarHBondContact O-N 2.89Å; T504-C507 PolarHBondContact O-N 3.06Å; T504-C507 PolarHBondContact OG1-SG 2.95Å; T504-C507 VanDerWaalsContact OG1-SG 3.36Å; T504-Q508 PolarHBondContact O-N 2.99Å; T504-Q620 HydrophobicContact CG2-CG 3.84Å
505	S	87.2	Confident	89.8	Confident	95 Å²	95	63.8 Å²	63.8	66%	0.664	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-54.1	-37.1	176.4	-53.7	0	0	0	0	112.4	C507 Q508	S505-C507 PolarHBondContact O-N 3.2Å; S505-Q508 PolarHBondContact O-N 3.21Å
506	D	86.7	Confident	89.7	Confident	103 Å²	103	65.5 Å²	65.5	55%	0.551	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-67.5	-20.2	178.6	-57.5	-30.6	0	0	0	113.3	T504 Y509	T504-D506 PolarHBondContact O-N 2.89Å; D506-Y509 WeakPolarHBondContact O-CD1 3.37Å; D506-Y509 WeakPolarHBondContact O-CE1 3.3Å
507	C	87.9	Confident	89.7	Confident	1 Å²	1	65.7 Å²	65.7	1%	0.007	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-103.5	-1.1	-177.5	-63.6	0	0	0	0	113.1	T504 S505 Y509 L510 F511 N624	T504-C507 PolarHBondContact O-N 3.06Å; T504-C507 PolarHBondContact OG1-SG 2.95Å; T504-C507 VanDerWaalsContact OG1-SG 3.36Å; S505-C507 PolarHBondContact O-N 3.2Å; C507-Y509 PolarHBondContact O-N 2.92Å; C507-L510 HydrophobicContact CB-CD1 4.07Å; C507-L510 WeakPolarHBondContact O-CB 3.19Å; C507-L510 PolarHBondContact O-N 3.26Å; C507-L510 VanDerWaalsContact O-N 3.09Å; C507-F511 WeakPolarHBondContact O-CD2 3.48Å; C507-F511 WeakPolarHBondContact O-CE2 3.42Å; C507-N624 WeakPolarHBondContact CB-OD1 3.35Å; C507-N624 PolarHBondContact SG-ND2 3.38Å
508	Q	88.3	Confident	89.8	Confident	118 Å²	118	70.8 Å²	70.8	55%	0.551	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-61.8	-30.7	-177.1	-69.5	-173.3	17.7	0	0	112.9	T504 S505 L510 F511	T504-Q508 PolarHBondContact O-N 2.99Å; S505-Q508 PolarHBondContact O-N 3.21Å; Q508-L510 PolarHBondContact O-N 2.74Å; Q508-F511 PolarHBondContact O-N 2.98Å
509	Y	89.7	Confident	90.1	Very high	118 Å²	118	64 Å²	64	46%	0.463	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-66.3	-19.2	179.4	72.3	-97.8	0	0	0	113.5	D506 C507 F511 H675	D506-Y509 WeakPolarHBondContact O-CD1 3.37Å; D506-Y509 WeakPolarHBondContact O-CE1 3.3Å; C507-Y509 PolarHBondContact O-N 2.92Å; Y509-F511 PolarHBondContact O-N 2.94Å; Y509-H675 WeakPolarHBondContact CA-CE1 3.37Å; Y509-H675 WeakPolarHBondContact CA-ND1 3.34Å; Y509-H675 VanDerWaalsContact CB-CE1 3.48Å; Y509-H675 WeakPolarHBondContact CB-CE1 3.4Å; Y509-H675 WeakPolarHBondContact CB-NE2 3.28Å; Y509-H675 VanDerWaalsContact O-CB 3.27Å; Y509-H675 WeakPolarHBondContact O-CB 3.27Å; Y509-H675 PolarHBondContact O-ND1 2.96Å
510	L	89.1	Confident	90.3	Very high	19 Å²	19	65.4 Å²	65.4	10%	0.099	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-73.4	-15.5	-179.9	-61.4	173.3	0	0	0	113	C507 Q508 E611 L612	C507-L510 HydrophobicContact CB-CD1 4.07Å; C507-L510 WeakPolarHBondContact O-CB 3.19Å; C507-L510 PolarHBondContact O-N 3.26Å; C507-L510 VanDerWaalsContact O-N 3.09Å; Q508-L510 PolarHBondContact O-N 2.74Å; L510-E611 WeakPolarHBondContact CD2-O 3.23Å; L510-L612 HydrophobicContact CD1-CD2 4.26Å
511	F	91.6	Very high	90.4	Very high	14 Å²	14	66.4 Å²	66.4	6%	0.061	35%	0.353	C	S	.	.	S	Bend	trans	-127.6	154.5	-171.1	-48.8	-67	0	0	0	111.5	V503 C507 Q508 Y509 L612 N624 Q627 R628 V631 Y673	V503-F511 HydrophobicContact CG1-CD2 4.48Å; V503-F511 HydrophobicContact CG1-CE2 4.2Å; C507-F511 WeakPolarHBondContact O-CD2 3.48Å; C507-F511 WeakPolarHBondContact O-CE2 3.42Å; Q508-F511 PolarHBondContact O-N 2.98Å; Y509-F511 PolarHBondContact O-N 2.94Å; F511-L612 HydrophobicContact CE1-CD2 4.13Å; F511-L612 HydrophobicContact CZ-CD2 4.13Å; F511-N624 WeakPolarHBondContact CE1-O 3.36Å; F511-N624 HydrophobicContact CZ-CB 3.94Å; F511-N624 WeakPolarHBondContact CZ-O 3.37Å; F511-Q627 HydrophobicContact CB-CG 4.39Å; F511-Q627 HydrophobicContact CD1-CB 4.18Å; F511-Q627 HydrophobicContact CD1-CG 3.68Å; F511-Q627 HydrophobicContact CD2-CB 4.43Å; F511-Q627 HydrophobicContact CD2-CG 3.74Å; F511-Q627 HydrophobicContact CE1-CB 3.8Å; F511-Q627 HydrophobicContact CE1-CG 3.83Å; F511-Q627 HydrophobicContact CE2-CB 4.07Å; F511-Q627 HydrophobicContact CE2-CG 3.88Å; F511-Q627 HydrophobicContact CG-CB 4.49Å; F511-Q627 HydrophobicContact CG-CG 3.64Å; F511-Q627 HydrophobicContact CZ-CB 3.75Å; F511-Q627 HydrophobicContact CZ-CG 3.94Å; F511-R628 HydrophobicContact CE1-CB 3.97Å; F511-V631 HydrophobicContact CD1-CG2 4.39Å; F511-Y673 VanDerWaalsContact C-CE1 3.46Å; F511-Y673 WeakPolarHBondContact O-CE1 3.48Å
512	P	91.6	Very high	90.5	Very high	17 Å²	17	66 Å²	66	11%	0.11	35%	0.349	C	S	.	.			trans	-68.1	151.6	166.8	30.7	-36.4	0	0	0	111.2	K514 V631 Y673 F680	P512-K514 VanDerWaalsContact C-N 3.33Å; P512-K514 PolarHBondContact O-N 3.04Å; P512-V631 HydrophobicContact CG-CG1 3.86Å; P512-V631 HydrophobicContact CG-CG2 3.89Å; P512-Y673 HydrophobicContact CB-CE2 3.94Å; P512-F680 HydrophobicContact CG-CZ 4.18Å
513	A	86	Confident	90.7	Very high	111 Å²	111	67.7 Å²	67.7	92%	0.917	36%	0.359	S	S	*	.	S	Bend	trans	-64.6	-32.9	-177.3	0	0	0	0	0	114
514	K	88.8	Confident	91	Very high	147 Å²	147	67.9 Å²	67.9	64%	0.639	36%	0.361	S	S	*	.			trans	-99.9	127.4	175.3	-67.6	-175.3	177.8	-176.2	0	109.5	P512 K656	P512-K514 VanDerWaalsContact C-N 3.33Å; P512-K514 PolarHBondContact O-N 3.04Å; K514-K656 PolarHBondContact O-NZ 2.86Å
515	V	89.4	Confident	91.2	Very high	58 Å²	58	67 Å²	67	35%	0.352	36%	0.355	S	S	.	.			trans	-128.5	133.4	168.3	62.4	0	0	0	0	107.3	C630 V631	V515-C630 HydrophobicContact CG2-CB 3.78Å; V515-V631 HydrophobicContact CG2-CG2 4.47Å
516	V	91.6	Very high	91.4	Very high	65 Å²	65	64.4 Å²	64.4	39%	0.394	34%	0.339	S	S	.	.			trans	-109.3	-40.9	-172	-176.3	0	0	0	0	111.4	R558 D634	V516-R558 HydrophobicContact CG1-CG 4.02Å; V516-D634 PolarHBondContact N-OD2 3.12Å
517	S	92.4	Very high	91.6	Very high	5 Å²	5	61.4 Å²	61.4	4%	0.035	32%	0.322	C	S	.	.			trans	-62.1	143.4	169.7	57.8	0	0	0	0	111.2	C630 D634	S517-C630 VanDerWaalsContact OG-C 3.24Å; S517-C630 VanDerWaalsContact OG-CA 3.24Å; S517-C630 WeakPolarHBondContact OG-CA 3.43Å; S517-C630 VanDerWaalsContact OG-CB 3.27Å; S517-C630 WeakPolarHBondContact OG-CB 3.44Å; S517-C630 PolarHBondContact OG-O 2.98Å; S517-D634 VanDerWaalsContact CB-OD1 3.3Å; S517-D634 WeakPolarHBondContact CB-OD1 3.35Å; S517-D634 PolarHBondContact N-OD1 3.48Å; S517-D634 PolarHBondContact OG-OD1 3.28Å; S517-D634 VanDerWaalsContact OG-OD1 3.12Å
518	R	93.3	Very high	91.8	Very high	173 Å²	173	67.1 Å²	67.1	65%	0.653	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133	146.5	-177.1	69.8	-175.6	76.1	-175.7	4.7	111.3	V520 I556 E557	R518-V520 HydrophobicContact CG-CG1 3.94Å; R518-V520 PolarHBondContact O-N 3.44Å; R518-I556 WeakPolarHBondContact O-CA 3.35Å; R518-E557 PolarHBondContact N-O 3.47Å; R518-E557 VanDerWaalsContact N-O 3.14Å; R518-E557 PolarHBondContact O-N 2.97Å
519	L	96.2	Very high	92.1	Very high	6 Å²	6	65.4 Å²	65.4	3%	0.031	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	120.4	169.5	-177.6	68.5	0	0	0	108.5	L496 G499 V501 K521 W522 A554 I556	L496-L519 HydrophobicContact CB-CD2 4.11Å; L496-L519 HydrophobicContact CD2-CD2 3.59Å; L496-L519 HydrophobicContact CG-CD2 4.4Å; G499-L519 VanDerWaalsContact CA-O 3.24Å; G499-L519 WeakPolarHBondContact CA-O 3.33Å; V501-L519 HydrophobicContact CG2-CB 4.22Å; V501-L519 HydrophobicContact CG2-CD2 4.32Å; L519-K521 WeakPolarHBondContact CD1-O 3.09Å; L519-W522 HydrophobicContact CD2-CB 4.43Å; L519-A554 HydrophobicContact CD1-CB 3.9Å; L519-I556 HydrophobicContact CD1-CG1 4.09Å
520	V	94.3	Very high	92.2	Very high	54 Å²	54	59.9 Å²	59.9	33%	0.327	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	-27.7	179.4	-62	0	0	0	0	112.6	R518 L555 E557	R518-V520 HydrophobicContact CG-CG1 3.94Å; R518-V520 PolarHBondContact O-N 3.44Å; V520-L555 HydrophobicContact CG2-CB 4.02Å; V520-L555 HydrophobicContact CG2-CD2 3.53Å; V520-L555 HydrophobicContact CG2-CG 4.28Å; V520-L555 WeakPolarHBondContact CG2-O 3.39Å; V520-L555 PolarHBondContact N-O 2.53Å; V520-E557 HydrophobicContact CG1-CB 4.03Å; V520-E557 HydrophobicContact CG1-CG 4.17Å; V520-E557 HydrophobicContact CG2-CB 4.39Å; V520-E557 HydrophobicContact CG2-CG 3.66Å
521	K	94.3	Very high	92.4	Very high	127 Å²	127	63.4 Å²	63.4	55%	0.552	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142.3	138.1	178.8	-62.8	-175.9	179.9	-176.7	0	110.8	L519 A554 L555	L519-K521 WeakPolarHBondContact CD1-O 3.09Å; K521-A554 WeakPolarHBondContact O-CA 3.37Å; K521-L555 HydrophobicContact CB-CB 3.91Å; K521-L555 HydrophobicContact CD-CD1 4.28Å; K521-L555 PolarHBondContact N-O 2.96Å; K521-L555 PolarHBondContact O-N 3.29Å
522	W	95.4	Very high	92.4	Very high	11 Å²	11	70.1 Å²	70.1	4%	0.042	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	116.3	169	178.3	-98.6	0	0	0	107.1	S390 F493 L496 L519 Y552 A554 V567 L622 L626	S390-W522 PolarHBondContact OG-O 2.89Å; F493-W522 HydrophobicContact CD1-CZ2 4.13Å; F493-W522 AromaticContact CD1-NE1 3.75Å; F493-W522 AromaticContact CE1-CE2 3.95Å; F493-W522 AromaticContact CE1-CZ2 3.52Å; F493-W522 HydrophobicContact CE1-CZ2 3.52Å; F493-W522 AromaticContact CE1-NE1 3.96Å; F493-W522 AromaticContact CG-NE1 3.98Å; F493-W522 AromaticContact CZ-CZ2 3.92Å; F493-W522 HydrophobicContact CZ-CZ2 3.92Å; L496-W522 HydrophobicContact CB-CB 4.27Å; L496-W522 HydrophobicContact CB-CD2 4.44Å; L496-W522 HydrophobicContact CB-CG 4.05Å; L496-W522 HydrophobicContact CD1-CD2 4.23Å; L496-W522 HydrophobicContact CD1-CE3 4.48Å; L519-W522 HydrophobicContact CD2-CB 4.43Å; W522-Y552 AromaticContact CE2-CD1 3.86Å; W522-Y552 HydrophobicContact CH2-CD2 4.25Å; W522-Y552 AromaticContact CH2-CG 3.87Å; W522-Y552 HydrophobicContact CH2-CG 3.87Å; W522-Y552 AromaticContact CZ2-CD1 3.66Å; W522-Y552 HydrophobicContact CZ2-CD1 3.66Å; W522-Y552 AromaticContact CZ2-CD2 3.87Å; W522-Y552 HydrophobicContact CZ2-CD2 3.87Å; W522-Y552 HydrophobicContact CZ2-CE1 4.36Å; W522-Y552 AromaticContact CZ2-CG 3.39Å; W522-Y552 HydrophobicContact CZ2-CG 3.39Å; W522-Y552 AromaticContact NE1-CD1 3.88Å; W522-A554 HydrophobicContact CE3-CB 3.78Å; W522-A554 HydrophobicContact CZ3-CB 3.88Å; W522-V567 HydrophobicContact CH2-CB 4.47Å; W522-V567 HydrophobicContact CH2-CG2 4.32Å; W522-V567 HydrophobicContact CZ3-CG2 4.2Å; W522-L622 HydrophobicContact CH2-CD2 4.29Å; W522-L622 HydrophobicContact CZ2-CD2 4.41Å; W522-L626 HydrophobicContact CE3-CD1 4.43Å; W522-L626 HydrophobicContact CZ3-CD1 4.11Å; W522-L626 HydrophobicContact CZ3-CD2 4.34Å
523	V	94	Very high	92.5	Very high	74 Å²	74	71.1 Å²	71.1	45%	0.448	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	138.5	-172.4	-174.1	0	0	0	0	109.8	Y552 M553	V523-Y552 CarbonylContact O-C 3.52Å; V523-Y552 WeakPolarHBondContact O-CA 3.23Å; V523-M553 PolarHBondContact N-O 3.4Å; V523-M553 PolarHBondContact O-N 3.19Å
524	T	93.8	Very high	92.7	Very high	63 Å²	63	70.2 Å²	70.2	39%	0.387	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	142.5	171.3	-170.7	0	0	0	0	110.9
525	V	92.7	Very high	92.8	Very high	27 Å²	27	63.7 Å²	63.7	16%	0.164	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	146.9	-173.7	-178.3	0	0	0	0	108.7	D529 Y551 M553	V525-D529 HydrophobicContact CG1-CB 3.37Å; V525-Y551 PolarHBondContact N-O 2.99Å; V525-Y551 WeakPolarHBondContact O-CB 3.26Å; V525-M553 HydrophobicContact CG2-CB 3.76Å; V525-M553 HydrophobicContact CG2-CG 3.4Å
526	A	92.1	Very high	93	Very high	41 Å²	41	61 Å²	61	34%	0.339	31%	0.306	S	S	.	.			trans	-72.9	164.4	175	0	0	0	0	0	111.3	E528 D529 Y530	A526-E528 VanDerWaalsContact C-N 3.33Å; A526-D529 HydrophobicContact CB-CB 4.36Å; A526-Y530 PolarHBondContact O-N 3.39Å; A526-Y530 VanDerWaalsContact O-N 3.11Å
527	H	91.6	Very high	92.9	Very high	41 Å²	41	64.3 Å²	64.3	19%	0.19	32%	0.315	C	S	.	.	H	α-helix	trans	-63.2	-42.7	177.4	176.8	-129.7	0	0	0	111.2	Y530 M531 A545 Y551	H527-Y530 WeakPolarHBondContact O-CB 3.31Å; H527-Y530 PolarHBondContact O-N 2.84Å; H527-M531 PolarHBondContact CE1-SD 2.88Å; H527-M531 PolarHBondContact NE2-SD 2.98Å; H527-M531 WeakPolarHBondContact O-CG 3.39Å; H527-M531 PolarHBondContact O-N 3Å; H527-M531 VanDerWaalsContact O-N 3.12Å; H527-A545 PolarHBondContact NE2-O 3.4Å; H527-Y551 HydrophobicContact CB-CD2 4.23Å; H527-Y551 HydrophobicContact CB-CE2 3.87Å; H527-Y551 AromaticContact CD2-CE2 3.49Å; H527-Y551 VanDerWaalsContact CD2-CE2 3.49Å; H527-Y551 WeakPolarHBondContact CD2-CE2 3.28Å; H527-Y551 AromaticContact CD2-CZ 3.44Å; H527-Y551 VanDerWaalsContact CD2-CZ 3.44Å; H527-Y551 PolarHBondContact CD2-OH 2.82Å; H527-Y551 VanDerWaalsContact CD2-OH 3.24Å; H527-Y551 AromaticContact CG-CE2 4Å
528	E	92.4	Very high	92.8	Very high	121 Å²	121	67.9 Å²	67.9	57%	0.565	33%	0.334	S	S	*	.	H	α-helix	trans	-62.7	-48.3	179.3	-60.8	79.9	-175.5	0	0	111	A526 Y530 M531 E532	A526-E528 VanDerWaalsContact C-N 3.33Å; E528-Y530 VanDerWaalsContact C-N 3.25Å; E528-Y530 PolarHBondContact O-N 3.17Å; E528-M531 WeakPolarHBondContact O-CB 3.41Å; E528-M531 PolarHBondContact O-N 3.11Å; E528-E532 WeakPolarHBondContact O-CG 3.35Å; E528-E532 PolarHBondContact O-N 3.13Å
529	D	92.9	Very high	92.7	Very high	82 Å²	82	60.3 Å²	60.3	44%	0.439	31%	0.306	S	S	.	.	H	α-helix	trans	-59.3	-36.6	177.5	-65.5	-23.6	0	0	0	111.9	V525 A526 E532	V525-D529 HydrophobicContact CG1-CB 3.37Å; A526-D529 HydrophobicContact CB-CB 4.36Å; D529-E532 PolarHBondContact O-N 3.09Å
530	Y	93.7	Very high	92.5	Very high	1 Å²	1	62 Å²	62	0%	0.004	32%	0.317	C	S	.	.	H	α-helix	trans	-67.5	-35.9	175.7	-178.2	-88.2	0	0	0	112.3	A526 H527 E528 L533 T536 A545 Y551 A566 V568	A526-Y530 PolarHBondContact O-N 3.39Å; A526-Y530 VanDerWaalsContact O-N 3.11Å; H527-Y530 WeakPolarHBondContact O-CB 3.31Å; H527-Y530 PolarHBondContact O-N 2.84Å; E528-Y530 VanDerWaalsContact C-N 3.25Å; E528-Y530 PolarHBondContact O-N 3.17Å; Y530-L533 HydrophobicContact CD2-CD1 4.36Å; Y530-L533 WeakPolarHBondContact O-CB 3.45Å; Y530-L533 PolarHBondContact O-N 2.98Å; Y530-T536 HydrophobicContact CD2-CG2 4.43Å; Y530-T536 HydrophobicContact CE1-CG2 4.05Å; Y530-T536 HydrophobicContact CE2-CG2 3.87Å; Y530-T536 PolarHBondContact O-OG1 2.83Å; Y530-A545 HydrophobicContact CD1-CB 4.41Å; Y530-A545 HydrophobicContact CE1-CB 4.1Å; Y530-Y551 AromaticContact CD1-CD1 3.72Å; Y530-Y551 HydrophobicContact CD1-CD1 3.72Å; Y530-Y551 AromaticContact CD1-CE1 3.62Å; Y530-Y551 HydrophobicContact CD1-CE1 3.62Å; Y530-Y551 AromaticContact CD2-CD1 3.47Å; Y530-Y551 HydrophobicContact CD2-CD1 3.47Å; Y530-Y551 VanDerWaalsContact CD2-CD1 3.47Å; Y530-Y551 HydrophobicContact CD2-CE1 4.21Å; Y530-Y551 HydrophobicContact CD2-CG 4.25Å; Y530-Y551 HydrophobicContact CE1-CD1 4.2Å; Y530-Y551 AromaticContact CE1-CE1 3.99Å; Y530-Y551 HydrophobicContact CE1-CE1 3.99Å; Y530-Y551 AromaticContact CE2-CD1 3.95Å; Y530-Y551 HydrophobicContact CE2-CD1 3.95Å; Y530-Y551 HydrophobicContact CE2-CE1 4.49Å; Y530-Y551 AromaticContact CG-CD1 3.34Å; Y530-Y551 HydrophobicContact CG-CD1 3.34Å; Y530-Y551 AromaticContact CG-CE1 3.77Å; Y530-Y551 HydrophobicContact CG-CE1 3.77Å; Y530-Y551 HydrophobicContact CG-CG 4.09Å; Y530-A566 HydrophobicContact CD2-CB 4.15Å; Y530-A566 HydrophobicContact CE2-CB 3.57Å; Y530-V568 HydrophobicContact CE1-CG2 3.95Å; Y530-V568 HydrophobicContact CE2-CG2 3.7Å; Y530-V568 WeakPolarHBondContact OH-CG2 3.44Å
531	M	91.4	Very high	92.3	Very high	93 Å²	93	66 Å²	66	46%	0.458	34%	0.336	S	S	.	.	H	α-helix	trans	-73.2	-27.8	177.2	-67.8	-177.7	71.4	0	0	112.7	H527 E528 L533 V540	H527-M531 PolarHBondContact CE1-SD 2.88Å; H527-M531 PolarHBondContact NE2-SD 2.98Å; H527-M531 WeakPolarHBondContact O-CG 3.39Å; H527-M531 PolarHBondContact O-N 3Å; H527-M531 VanDerWaalsContact O-N 3.12Å; E528-M531 WeakPolarHBondContact O-CB 3.41Å; E528-M531 PolarHBondContact O-N 3.11Å; M531-L533 PolarHBondContact O-N 3.39Å; M531-V540 HydrophobicContact CE-CG1 3.99Å; M531-V540 HydrophobicContact CG-CG2 4.35Å
532	E	92.9	Very high	92.1	Very high	155 Å²	155	63 Å²	63	72%	0.724	34%	0.335	S	S	*	.	H	α-helix	trans	-70.8	-18.9	175	-71.4	-173.4	177.3	0	0	113.1	E528 D529 H534	E528-E532 WeakPolarHBondContact O-CG 3.35Å; E528-E532 PolarHBondContact O-N 3.13Å; D529-E532 PolarHBondContact O-N 3.09Å; E532-H534 PolarHBondContact O-N 3.08Å
533	L	92.5	Very high	91.7	Very high	39 Å²	39	65.4 Å²	65.4	20%	0.204	36%	0.364	C	S	.	.			trans	-65	124.7	177.6	-63.4	174.6	0	0	0	111.2	Y530 M531 F535 T536 M553 A566	Y530-L533 HydrophobicContact CD2-CD1 4.36Å; Y530-L533 WeakPolarHBondContact O-CB 3.45Å; Y530-L533 PolarHBondContact O-N 2.98Å; M531-L533 PolarHBondContact O-N 3.39Å; L533-F535 HydrophobicContact CB-CD1 4.41Å; L533-F535 HydrophobicContact CB-CE1 4.18Å; L533-F535 HydrophobicContact CD1-CE1 4.45Å; L533-F535 HydrophobicContact CD1-CZ 4.15Å; L533-F535 HydrophobicContact CD2-CE1 4.16Å; L533-F535 HydrophobicContact CG-CE1 4.5Å; L533-F535 PolarHBondContact O-N 3.48Å; L533-F535 VanDerWaalsContact O-N 3.14Å; L533-T536 HydrophobicContact CB-CG2 3.81Å; L533-T536 HydrophobicContact CD1-CG2 3.98Å; L533-T536 PolarHBondContact O-N 2.97Å; L533-T536 PolarHBondContact O-OG1 2.53Å; L533-M553 HydrophobicContact CD1-SD 3.76Å; L533-A566 HydrophobicContact CD1-CB 3.97Å
534	H	90.9	Very high	91.4	Very high	92 Å²	92	66.4 Å²	66.4	43%	0.426	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-21.4	-174.8	63.5	-93.2	0	0	0	114.1	E532 E589	E532-H534 PolarHBondContact O-N 3.08Å; H534-E589 IonicContact CE1-OE1 3.26Å; H534-E589 PolarHBondContact CE1-OE1 2.92Å; H534-E589 IonicContact NE2-OE1 2.66Å; H534-E589 PolarHBondContact NE2-OE1 3.42Å; H534-E589 VanDerWaalsContact NE2-OE1 3.1Å; H534-E589 IonicContact NE2-OE2 3.01Å
535	F	91.4	Very high	91.1	Very high	10 Å²	10	64.1 Å²	64.1	4%	0.044	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.2	7.7	-174.9	64.4	-88.3	0	0	0	114.4	L533 M553 Q564 A566 Q581 C583 T591	L533-F535 HydrophobicContact CB-CD1 4.41Å; L533-F535 HydrophobicContact CB-CE1 4.18Å; L533-F535 HydrophobicContact CD1-CE1 4.45Å; L533-F535 HydrophobicContact CD1-CZ 4.15Å; L533-F535 HydrophobicContact CD2-CE1 4.16Å; L533-F535 HydrophobicContact CG-CE1 4.5Å; L533-F535 PolarHBondContact O-N 3.48Å; L533-F535 VanDerWaalsContact O-N 3.14Å; F535-M553 HydrophobicContact CZ-CE 4.24Å; F535-Q564 HydrophobicContact CZ-CB 4.46Å; F535-A566 HydrophobicContact CE2-CB 3.89Å; F535-A566 HydrophobicContact CZ-CB 4.21Å; F535-Q581 HydrophobicContact CD2-CB 4.04Å; F535-Q581 HydrophobicContact CE2-CB 4.19Å; F535-Q581 PolarHBondContact O-OE1 2.96Å; F535-C583 HydrophobicContact CB-CB 4.46Å; F535-C583 HydrophobicContact CD1-CB 3.65Å; F535-C583 HydrophobicContact CD2-CB 3.91Å; F535-C583 HydrophobicContact CE1-CB 3.73Å; F535-C583 HydrophobicContact CE2-CB 4Å; F535-C583 HydrophobicContact CG-CB 3.74Å; F535-C583 HydrophobicContact CZ-CB 3.92Å; F535-T591 WeakPolarHBondContact CB-OG1 3.41Å
536	T	92.4	Very high	90.7	Very high	1 Å²	1	64.2 Å²	64.2	1%	0.006	36%	0.36	C	S	.	.			trans	-106.7	1.8	-178.7	57.6	0	0	0	0	114.3	Y530 L533 D538 I539 V540 A566 Q581	Y530-T536 HydrophobicContact CD2-CG2 4.43Å; Y530-T536 HydrophobicContact CE1-CG2 4.05Å; Y530-T536 HydrophobicContact CE2-CG2 3.87Å; Y530-T536 PolarHBondContact O-OG1 2.83Å; L533-T536 HydrophobicContact CB-CG2 3.81Å; L533-T536 HydrophobicContact CD1-CG2 3.98Å; L533-T536 PolarHBondContact O-N 2.97Å; L533-T536 PolarHBondContact O-OG1 2.53Å; T536-D538 VanDerWaalsContact C-N 3.3Å; T536-D538 PolarHBondContact O-N 3.06Å; T536-I539 PolarHBondContact O-N 2.91Å; T536-V540 PolarHBondContact O-N 2.94Å; T536-A566 HydrophobicContact CG2-CB 3.91Å; T536-Q581 HydrophobicContact CG2-CB 4.12Å; T536-Q581 HydrophobicContact CG2-CG 4.43Å
537	K	90	Very high	90.4	Very high	134 Å²	134	67 Å²	67	58%	0.583	37%	0.369	S	S	*	.	H	α-helix	trans	-52.5	-42.7	-174.1	-64.1	-178.5	-176.5	179.3	0	113.7	I539 V540 D541	K537-I539 PolarHBondContact O-N 3.42Å; K537-V540 WeakPolarHBondContact O-CB 3.3Å; K537-V540 PolarHBondContact O-N 2.92Å; K537-V540 VanDerWaalsContact O-N 3.1Å; K537-D541 PolarHBondContact O-N 3.24Å
538	D	90.6	Very high	90	Very high	80 Å²	80	66.5 Å²	66.5	43%	0.428	37%	0.369	S	S	.	.	H	α-helix	trans	-60	-33.2	-179.1	-65.2	-18.6	0	0	0	112.9	T536 A542	T536-D538 VanDerWaalsContact C-N 3.3Å; T536-D538 PolarHBondContact O-N 3.06Å; D538-A542 WeakPolarHBondContact O-CB 3.23Å; D538-A542 PolarHBondContact O-N 3.03Å
539	I	91.8	Very high	89.9	Confident	14 Å²	14	61.6 Å²	61.6	7%	0.072	35%	0.346	C	S	.	.	H	α-helix	trans	-75.3	-37.4	178.3	-57.9	-52.2	0	0	0	111.2	T536 K537 G543 L544 A545 V568 V579 Q581	T536-I539 PolarHBondContact O-N 2.91Å; K537-I539 PolarHBondContact O-N 3.42Å; I539-G543 PolarHBondContact O-N 2.86Å; I539-L544 HydrophobicContact CG2-CB 3.79Å; I539-L544 PolarHBondContact O-N 3.43Å; I539-A545 HydrophobicContact CG2-CB 4.14Å; I539-A545 PolarHBondContact O-N 2.84Å; I539-V568 HydrophobicContact CG2-CG2 4.18Å; I539-V579 HydrophobicContact CD1-CG1 3.69Å; I539-V579 HydrophobicContact CG1-CG1 4.5Å; I539-Q581 HydrophobicContact CD1-CG 4.13Å; I539-Q581 VanDerWaalsContact CD1-NE2 3.27Å; I539-Q581 HydrophobicContact CG1-CG 3.42Å; I539-Q581 VanDerWaalsContact CG1-CG 3.42Å
540	V	91.5	Very high	89.8	Confident	43 Å²	43	58.9 Å²	58.9	26%	0.261	33%	0.332	S	S	.	.	H	α-helix	trans	-66.1	-49.1	176.7	-179.6	0	0	0	0	109.6	M531 T536 K537 A542 G543 A545	M531-V540 HydrophobicContact CE-CG1 3.99Å; M531-V540 HydrophobicContact CG-CG2 4.35Å; T536-V540 PolarHBondContact O-N 2.94Å; K537-V540 WeakPolarHBondContact O-CB 3.3Å; K537-V540 PolarHBondContact O-N 2.92Å; K537-V540 VanDerWaalsContact O-N 3.1Å; V540-A542 VanDerWaalsContact C-N 3.3Å; V540-A542 PolarHBondContact O-N 3.44Å; V540-G543 PolarHBondContact O-N 2.73Å; V540-A545 HydrophobicContact CG2-CB 3.95Å
541	D	90.8	Very high	89.8	Confident	136 Å²	136	59.1 Å²	59.1	73%	0.727	33%	0.333	S	S	*	.	H	α-helix	trans	-66.2	-32	179.8	-68.3	-20.7	0	0	0	112.3	K537 G543	K537-D541 PolarHBondContact O-N 3.24Å; D541-G543 PolarHBondContact O-N 3.23Å
542	A	89.5	Confident	90	Very high	64 Å²	64	54.8 Å²	54.8	53%	0.529	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-5.8	172.6	0	0	0	0	0	113.9	D538 V540 L544	D538-A542 WeakPolarHBondContact O-CB 3.23Å; D538-A542 PolarHBondContact O-N 3.03Å; V540-A542 VanDerWaalsContact C-N 3.3Å; V540-A542 PolarHBondContact O-N 3.44Å; A542-L544 VanDerWaalsContact C-N 3.26Å; A542-L544 HydrophobicContact CB-CD1 4.25Å; A542-L544 HydrophobicContact CB-CG 4.19Å; A542-L544 PolarHBondContact O-N 3.05Å
543	G	87.1	Confident	90.1	Very high	62 Å²	62	49.1 Å²	49.1	64%	0.639	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	71	18.9	-178.6	0	0	0	0	0	114.1	I539 V540 D541	I539-G543 PolarHBondContact O-N 2.86Å; V540-G543 PolarHBondContact O-N 2.73Å; D541-G543 PolarHBondContact O-N 3.23Å
544	L	86.7	Confident	90.3	Very high	96 Å²	96	47.3 Å²	47.3	50%	0.503	28%	0.276	S	S	.	.			trans	-88.7	-19.8	179.3	-65.7	176.4	0	0	0	112.3	I539 A542 G546 N549	I539-L544 HydrophobicContact CG2-CB 3.79Å; I539-L544 PolarHBondContact O-N 3.43Å; A542-L544 VanDerWaalsContact C-N 3.26Å; A542-L544 HydrophobicContact CB-CD1 4.25Å; A542-L544 HydrophobicContact CB-CG 4.19Å; A542-L544 PolarHBondContact O-N 3.05Å; L544-G546 PolarHBondContact O-N 3.4Å; L544-N549 PolarHBondContact O-ND2 2.95Å
545	A	88.8	Confident	90.6	Very high	14 Å²	14	44.3 Å²	44.3	12%	0.116	26%	0.263	C	S	.	.			trans	-87.3	68.7	173.9	0	0	0	0	0	111.9	H527 Y530 I539 V540 Y551	H527-A545 PolarHBondContact NE2-O 3.4Å; Y530-A545 HydrophobicContact CD1-CB 4.41Å; Y530-A545 HydrophobicContact CE1-CB 4.1Å; I539-A545 HydrophobicContact CG2-CB 4.14Å; I539-A545 PolarHBondContact O-N 2.84Å; V540-A545 HydrophobicContact CG2-CB 3.95Å; A545-Y551 VanDerWaalsContact CA-OH 3.26Å; A545-Y551 WeakPolarHBondContact CA-OH 3.25Å; A545-Y551 HydrophobicContact CB-CE1 4.25Å; A545-Y551 PolarHBondContact O-OH 3.29Å
546	G	84.8	Confident	90.9	Very high	29 Å²	29	43.9 Å²	43.9	30%	0.299	26%	0.261	S	S	.	.			trans	-80.5	154.2	175.8	0	0	0	0	0	114	L544 T548 N549 Y551	L544-G546 PolarHBondContact O-N 3.4Å; G546-T548 PolarHBondContact O-N 3.35Å; G546-N549 PolarHBondContact N-ND2 3.14Å; G546-N549 VanDerWaalsContact N-ND2 3.16Å; G546-N549 WeakPolarHBondContact O-CB 3.47Å; G546-N549 PolarHBondContact O-N 3.39Å; G546-N549 VanDerWaalsContact O-N 3.15Å; G546-Y551 PolarHBondContact N-OH 2.87Å; G546-Y551 PolarHBondContact O-OH 3.43Å
547	D	84.8	Confident	91	Very high	99 Å²	99	46.1 Å²	46.1	53%	0.529	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-35.2	178.8	173.1	41.7	0	0	0	113.5	K411 N549	K411-D547 IonicContact NZ-OD2 3.96Å; K411-D547 PolarHBondContact NZ-OD2 2.93Å; D547-N549 VanDerWaalsContact C-N 3.27Å; D547-N549 PolarHBondContact O-N 3Å
548	T	84.1	Confident	91.1	Very high	31 Å²	31	40.6 Å²	40.6	19%	0.19	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85	9.7	-177.6	60.4	0	0	0	0	115.1	H409 G546 P571	H409-T548 HydrophobicContact CB-CG2 4.25Å; H409-T548 PolarHBondContact CE1-OG1 3.31Å; H409-T548 VanDerWaalsContact ND1-CG2 3.26Å; H409-T548 WeakPolarHBondContact ND1-CG2 3.32Å; H409-T548 PolarHBondContact ND1-OG1 2.91Å; G546-T548 PolarHBondContact O-N 3.35Å; T548-P571 WeakPolarHBondContact O-CD 3.19Å; T548-P571 VanDerWaalsContact O-CG 3.26Å; T548-P571 WeakPolarHBondContact O-CG 3.33Å
549	N	89.3	Confident	91	Very high	18 Å²	18	40 Å²	40	10%	0.096	26%	0.26	C	S	.	.	S	Bend	trans	-89	160.1	177.7	-66.7	-25.7	0	0	0	111.3	L544 G546 D547 Y551 V568	L544-N549 PolarHBondContact O-ND2 2.95Å; G546-N549 PolarHBondContact N-ND2 3.14Å; G546-N549 VanDerWaalsContact N-ND2 3.16Å; G546-N549 WeakPolarHBondContact O-CB 3.47Å; G546-N549 PolarHBondContact O-N 3.39Å; G546-N549 VanDerWaalsContact O-N 3.15Å; D547-N549 VanDerWaalsContact C-N 3.27Å; D547-N549 PolarHBondContact O-N 3Å; N549-Y551 HydrophobicContact CB-CE1 4.47Å; N549-Y551 HydrophobicContact CB-CE2 3.98Å; N549-Y551 WeakPolarHBondContact O-CE2 3.23Å; N549-V568 HydrophobicContact CB-CG1 3.87Å; N549-V568 WeakPolarHBondContact ND2-CG1 3.49Å
550	L	91	Very high	90.9	Very high	26 Å²	26	43.7 Å²	43.7	14%	0.136	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	128.9	172	-58.4	172.5	0	0	0	109	D393 L394 Y552 L569	D393-L550 HydrophobicContact CB-CD2 4.38Å; L394-L550 HydrophobicContact CD2-CD1 3.58Å; L394-L550 HydrophobicContact CG-CD1 4.44Å; L550-Y552 HydrophobicContact CB-CE2 3.57Å; L550-L569 HydrophobicContact CB-CB 4.13Å; L550-L569 PolarHBondContact N-O 2.78Å; L550-L569 PolarHBondContact O-N 3.08Å
551	Y	94.1	Very high	90.9	Very high	6 Å²	6	41.6 Å²	41.6	2%	0.024	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	133.6	-176.9	-60.3	-84.2	0	0	0	110.5	V525 H527 Y530 A545 G546 N549 V567 V568	V525-Y551 PolarHBondContact N-O 2.99Å; V525-Y551 WeakPolarHBondContact O-CB 3.26Å; H527-Y551 HydrophobicContact CB-CD2 4.23Å; H527-Y551 HydrophobicContact CB-CE2 3.87Å; H527-Y551 AromaticContact CD2-CE2 3.49Å; H527-Y551 VanDerWaalsContact CD2-CE2 3.49Å; H527-Y551 WeakPolarHBondContact CD2-CE2 3.28Å; H527-Y551 AromaticContact CD2-CZ 3.44Å; H527-Y551 VanDerWaalsContact CD2-CZ 3.44Å; H527-Y551 PolarHBondContact CD2-OH 2.82Å; H527-Y551 VanDerWaalsContact CD2-OH 3.24Å; H527-Y551 AromaticContact CG-CE2 4Å; Y530-Y551 AromaticContact CD1-CD1 3.72Å; Y530-Y551 HydrophobicContact CD1-CD1 3.72Å; Y530-Y551 AromaticContact CD1-CE1 3.62Å; Y530-Y551 HydrophobicContact CD1-CE1 3.62Å; Y530-Y551 AromaticContact CD2-CD1 3.47Å; Y530-Y551 HydrophobicContact CD2-CD1 3.47Å; Y530-Y551 VanDerWaalsContact CD2-CD1 3.47Å; Y530-Y551 HydrophobicContact CD2-CE1 4.21Å; Y530-Y551 HydrophobicContact CD2-CG 4.25Å; Y530-Y551 HydrophobicContact CE1-CD1 4.2Å; Y530-Y551 AromaticContact CE1-CE1 3.99Å; Y530-Y551 HydrophobicContact CE1-CE1 3.99Å; Y530-Y551 AromaticContact CE2-CD1 3.95Å; Y530-Y551 HydrophobicContact CE2-CD1 3.95Å; Y530-Y551 HydrophobicContact CE2-CE1 4.49Å; Y530-Y551 AromaticContact CG-CD1 3.34Å; Y530-Y551 HydrophobicContact CG-CD1 3.34Å; Y530-Y551 AromaticContact CG-CE1 3.77Å; Y530-Y551 HydrophobicContact CG-CE1 3.77Å; Y530-Y551 HydrophobicContact CG-CG 4.09Å; A545-Y551 VanDerWaalsContact CA-OH 3.26Å; A545-Y551 WeakPolarHBondContact CA-OH 3.25Å; A545-Y551 HydrophobicContact CB-CE1 4.25Å; A545-Y551 PolarHBondContact O-OH 3.29Å; G546-Y551 PolarHBondContact N-OH 2.87Å; G546-Y551 PolarHBondContact O-OH 3.43Å; N549-Y551 HydrophobicContact CB-CE1 4.47Å; N549-Y551 HydrophobicContact CB-CE2 3.98Å; N549-Y551 WeakPolarHBondContact O-CE2 3.23Å; Y551-V567 WeakPolarHBondContact CA-O 3.34Å; Y551-V568 HydrophobicContact CD1-CG1 4.37Å; Y551-V568 HydrophobicContact CD1-CG2 3.89Å; Y551-V568 HydrophobicContact CE1-CB 4.37Å; Y551-V568 HydrophobicContact CE1-CG1 3.88Å; Y551-V568 HydrophobicContact CE1-CG2 3.76Å
552	Y	95.5	Very high	91.1	Very high	2 Å²	2	39.6 Å²	39.6	1%	0.008	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	152.3	179.1	-58.3	-82.9	0	0	0	111.3	S390 F493 W522 V523 L550 V567 L569	S390-Y552 VanDerWaalsContact O-CE1 3.32Å; S390-Y552 WeakPolarHBondContact O-CE1 3.34Å; F493-Y552 AromaticContact CE2-CE1 3.86Å; F493-Y552 HydrophobicContact CE2-CE1 3.86Å; F493-Y552 HydrophobicContact CE2-CE2 4.17Å; F493-Y552 AromaticContact CE2-CZ 3.5Å; F493-Y552 VanDerWaalsContact CE2-OH 3.28Å; F493-Y552 WeakPolarHBondContact CE2-OH 3.24Å; F493-Y552 HydrophobicContact CZ-CD2 4.49Å; F493-Y552 HydrophobicContact CZ-CE1 4.12Å; F493-Y552 AromaticContact CZ-CE2 3.86Å; F493-Y552 HydrophobicContact CZ-CE2 3.86Å; F493-Y552 AromaticContact CZ-CZ 3.66Å; W522-Y552 AromaticContact CE2-CD1 3.86Å; W522-Y552 HydrophobicContact CH2-CD2 4.25Å; W522-Y552 AromaticContact CH2-CG 3.87Å; W522-Y552 HydrophobicContact CH2-CG 3.87Å; W522-Y552 AromaticContact CZ2-CD1 3.66Å; W522-Y552 HydrophobicContact CZ2-CD1 3.66Å; W522-Y552 AromaticContact CZ2-CD2 3.87Å; W522-Y552 HydrophobicContact CZ2-CD2 3.87Å; W522-Y552 HydrophobicContact CZ2-CE1 4.36Å; W522-Y552 AromaticContact CZ2-CG 3.39Å; W522-Y552 HydrophobicContact CZ2-CG 3.39Å; W522-Y552 AromaticContact NE1-CD1 3.88Å; V523-Y552 CarbonylContact O-C 3.52Å; V523-Y552 WeakPolarHBondContact O-CA 3.23Å; L550-Y552 HydrophobicContact CB-CE2 3.57Å; Y552-V567 PolarHBondContact N-O 3.47Å; Y552-V567 PolarHBondContact O-N 2.98Å; Y552-L569 HydrophobicContact CD2-CD1 3.74Å; Y552-L569 HydrophobicContact CD2-CG 4.47Å; Y552-L569 HydrophobicContact CE2-CB 4.25Å; Y552-L569 HydrophobicContact CE2-CD1 3.52Å; Y552-L569 HydrophobicContact CE2-CG 4.39Å
553	M	95.3	Very high	91.4	Very high	35 Å²	35	36.6 Å²	36.6	17%	0.172	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	118.2	169.5	-79	-57.1	-63.8	0	0	109.5	V523 V525 L533 F535 Q564 A566	V523-M553 PolarHBondContact N-O 3.4Å; V523-M553 PolarHBondContact O-N 3.19Å; V525-M553 HydrophobicContact CG2-CB 3.76Å; V525-M553 HydrophobicContact CG2-CG 3.4Å; L533-M553 HydrophobicContact CD1-SD 3.76Å; F535-M553 HydrophobicContact CZ-CE 4.24Å; M553-Q564 HydrophobicContact CE-CB 3.84Å; M553-Q564 HydrophobicContact CE-CG 4.44Å; M553-A566 HydrophobicContact CE-CB 4.45Å; M553-A566 WeakPolarHBondContact SD-CA 3.5Å; M553-A566 HydrophobicContact SD-CB 3.4Å; M553-A566 WeakPolarHBondContact SD-CB 3.18Å
554	A	96.6	Very high	91.9	Very high	1 Å²	1	36.8 Å²	36.8	1%	0.008	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	138.8	168	0	0	0	0	0	109.9	L519 K521 W522 A565 L626	L519-A554 HydrophobicContact CD1-CB 3.9Å; K521-A554 WeakPolarHBondContact O-CA 3.37Å; W522-A554 HydrophobicContact CE3-CB 3.78Å; W522-A554 HydrophobicContact CZ3-CB 3.88Å; A554-A565 HydrophobicContact CB-CB 4.22Å; A554-A565 PolarHBondContact N-O 3.13Å; A554-A565 PolarHBondContact O-N 2.93Å; A554-L626 HydrophobicContact CB-CD2 4.14Å
555	L	96.8	Very high	92.3	Very high	30 Å²	30	32.2 Å²	32.2	16%	0.157	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	115.9	172.1	-153.8	166.9	0	0	0	108.4	V520 K521 E557 K562 L563	V520-L555 HydrophobicContact CG2-CB 4.02Å; V520-L555 HydrophobicContact CG2-CD2 3.53Å; V520-L555 HydrophobicContact CG2-CG 4.28Å; V520-L555 WeakPolarHBondContact CG2-O 3.39Å; V520-L555 PolarHBondContact N-O 2.53Å; K521-L555 HydrophobicContact CB-CB 3.91Å; K521-L555 HydrophobicContact CD-CD1 4.28Å; K521-L555 PolarHBondContact N-O 2.96Å; K521-L555 PolarHBondContact O-N 3.29Å; L555-E557 HydrophobicContact CD2-CG 3.27Å; L555-E557 WeakPolarHBondContact CD2-OE1 3.38Å; L555-K562 HydrophobicContact CD2-CB 4.38Å; L555-L563 WeakPolarHBondContact CA-O 3.31Å
556	I	96.9	Very high	92.7	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.005	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	128.8	178.2	-58.9	170	0	0	0	108.1	R518 L519 L563 L629 L633	R518-I556 WeakPolarHBondContact O-CA 3.35Å; L519-I556 HydrophobicContact CD1-CG1 4.09Å; I556-L563 HydrophobicContact CB-CB 4.38Å; I556-L563 PolarHBondContact N-O 3.36Å; I556-L563 PolarHBondContact O-N 2.9Å; I556-L629 HydrophobicContact CD1-CB 4.29Å; I556-L629 HydrophobicContact CD1-CD2 3.76Å; I556-L629 HydrophobicContact CD1-CG 3.98Å; I556-L633 HydrophobicContact CB-CD2 4.29Å; I556-L633 HydrophobicContact CG2-CD2 3.64Å
557	E	94.9	Very high	93.2	Very high	48 Å²	48	30.2 Å²	30.2	22%	0.224	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	147.1	-178.1	-63.8	-173.4	159.9	0	0	112.3	R518 V520 L555 A561 K562	R518-E557 PolarHBondContact N-O 3.47Å; R518-E557 VanDerWaalsContact N-O 3.14Å; R518-E557 PolarHBondContact O-N 2.97Å; V520-E557 HydrophobicContact CG1-CB 4.03Å; V520-E557 HydrophobicContact CG1-CG 4.17Å; V520-E557 HydrophobicContact CG2-CB 4.39Å; V520-E557 HydrophobicContact CG2-CG 3.66Å; L555-E557 HydrophobicContact CD2-CG 3.27Å; L555-E557 WeakPolarHBondContact CD2-OE1 3.38Å; E557-A561 WeakPolarHBondContact CA-O 3.05Å; E557-K562 HydrophobicContact CG-CG 4.12Å; E557-K562 WeakPolarHBondContact OE1-CD 3.38Å; E557-K562 WeakPolarHBondContact OE1-CE 3.46Å; E557-K562 IonicContact OE1-NZ 3.4Å; E557-K562 PolarHBondContact OE1-NZ 3.33Å
558	R	91.9	Very high	93.7	Very high	17 Å²	17	25.8 Å²	25.8	6%	0.064	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	114.8	165.6	-159.6	176.3	80.7	161	9	109.8	V516 T560 A561 D634 L637 E638 F652	V516-R558 HydrophobicContact CG1-CG 4.02Å; R558-T560 PolarHBondContact O-N 2.86Å; R558-A561 PolarHBondContact N-O 3.2Å; R558-A561 WeakPolarHBondContact O-CB 3.26Å; R558-A561 PolarHBondContact O-N 3.45Å; R558-D634 WeakPolarHBondContact CD-OD1 3.33Å; R558-D634 IonicContact CZ-OD1 2.8Å; R558-D634 IonicContact NE-OD1 3.74Å; R558-D634 VanDerWaalsContact NH1-CB 3.29Å; R558-D634 IonicContact NH1-OD1 3.89Å; R558-D634 PolarHBondContact NH1-OD1 2.84Å; R558-L637 HydrophobicContact CB-CD1 4.11Å; R558-E638 IonicContact CZ-OE1 3.65Å; R558-E638 IonicContact NH1-OE1 3.93Å; R558-E638 PolarHBondContact NH1-OE1 2.9Å; R558-F652 HydrophobicContact CG-CE1 4.31Å; R558-F652 WeakPolarHBondContact O-CE1 3.42Å; R558-F652 WeakPolarHBondContact O-CZ 3.18Å
559	G	88.6	Confident	94.1	Very high	68 Å²	68	24.5 Å²	24.5	70%	0.701	14%	0.14	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.6	-125.7	-175.4	0	0	0	0	0	111.1
560	T	89	Confident	94.1	Very high	91 Å²	91	25.9 Å²	25.9	56%	0.558	15%	0.147	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-8.9	175.3	70.8	0	0	0	0	114.1	R558 E651	R558-T560 PolarHBondContact O-N 2.86Å; T560-E651 VanDerWaalsContact CB-OE1 3.31Å; T560-E651 WeakPolarHBondContact CB-OE1 3.27Å; T560-E651 VanDerWaalsContact CG2-OE1 3.28Å; T560-E651 WeakPolarHBondContact CG2-OE1 3.33Å; T560-E651 PolarHBondContact N-OE1 3.3Å; T560-E651 PolarHBondContact OG1-OE1 3.13Å
561	A	92.1	Very high	93.9	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	126.6	-176.6	0	0	0	0	0	111.6	E557 R558 L584 W586 L637 F652	E557-A561 WeakPolarHBondContact CA-O 3.05Å; R558-A561 PolarHBondContact N-O 3.2Å; R558-A561 WeakPolarHBondContact O-CB 3.26Å; R558-A561 PolarHBondContact O-N 3.45Å; A561-L584 HydrophobicContact CB-CD1 4.47Å; A561-W586 HydrophobicContact CB-CB 3.92Å; A561-W586 HydrophobicContact CB-CD2 4.39Å; A561-W586 HydrophobicContact CB-CG 3.8Å; A561-L637 HydrophobicContact CB-CD1 3.71Å; A561-L637 HydrophobicContact CB-CD2 3.81Å; A561-L637 HydrophobicContact CB-CG 4.42Å; A561-F652 HydrophobicContact CB-CZ 4.09Å
562	K	95.3	Very high	93.5	Very high	94 Å²	94	25.1 Å²	25.1	41%	0.409	15%	0.146	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	113.5	179.2	-56	-169.2	178.8	-125.7	0	110.5	L555 E557 N585	L555-K562 HydrophobicContact CD2-CB 4.38Å; E557-K562 HydrophobicContact CG-CG 4.12Å; E557-K562 WeakPolarHBondContact OE1-CD 3.38Å; E557-K562 WeakPolarHBondContact OE1-CE 3.46Å; E557-K562 IonicContact OE1-NZ 3.4Å; E557-K562 PolarHBondContact OE1-NZ 3.33Å; K562-N585 PolarHBondContact N-O 3.47Å; K562-N585 PolarHBondContact O-N 3.41Å
563	L	96.7	Very high	93.1	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	116.1	175.2	-179.6	66.3	0	0	0	109.6	L555 I556 L582 L584 L629 L633	L555-L563 WeakPolarHBondContact CA-O 3.31Å; I556-L563 HydrophobicContact CB-CB 4.38Å; I556-L563 PolarHBondContact N-O 3.36Å; I556-L563 PolarHBondContact O-N 2.9Å; L563-L582 HydrophobicContact CD1-CB 4.2Å; L563-L582 HydrophobicContact CD1-CD2 4.05Å; L563-L582 HydrophobicContact CD1-CG 4.18Å; L563-L582 HydrophobicContact CD2-CD2 4.21Å; L563-L584 HydrophobicContact CB-CD1 4.04Å; L563-L584 HydrophobicContact CD1-CB 3.97Å; L563-L584 HydrophobicContact CD1-CD1 4.3Å; L563-L629 HydrophobicContact CD2-CD1 4.25Å; L563-L629 HydrophobicContact CD2-CD2 4.31Å; L563-L629 HydrophobicContact CD2-CG 4.05Å; L563-L633 HydrophobicContact CB-CD1 4.29Å; L563-L633 HydrophobicContact CB-CD2 3.91Å; L563-L633 HydrophobicContact CD2-CB 4.34Å; L563-L633 HydrophobicContact CD2-CD1 4.34Å; L563-L633 HydrophobicContact CD2-CD2 4.2Å
564	Q	96.1	Very high	92.6	Very high	67 Å²	67	25.5 Å²	25.5	31%	0.313	15%	0.152	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	128.3	168.3	-65.6	-175.6	-1.6	0	0	108.8	F535 M553 C583	F535-Q564 HydrophobicContact CZ-CB 4.46Å; M553-Q564 HydrophobicContact CE-CB 3.84Å; M553-Q564 HydrophobicContact CE-CG 4.44Å; Q564-C583 HydrophobicContact CB-CB 4.43Å; Q564-C583 PolarHBondContact N-O 3.36Å; Q564-C583 PolarHBondContact O-N 2.82Å
565	A	96.7	Very high	92	Very high	0 Å²	0	30 Å²	30	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	110.5	177.5	0	0	0	0	0	109.7	A554 F580 Q581 L629	A554-A565 HydrophobicContact CB-CB 4.22Å; A554-A565 PolarHBondContact N-O 3.13Å; A554-A565 PolarHBondContact O-N 2.93Å; A565-F580 HydrophobicContact CB-CD1 4.31Å; A565-Q581 CarbonylContact C-O 3.29Å; A565-Q581 WeakPolarHBondContact CA-O 3.49Å; A565-L629 HydrophobicContact CB-CD2 3.79Å
566	A	96.4	Very high	91.6	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	124.5	176.2	0	0	0	0	0	109.2	Y530 L533 F535 T536 M553 F580 Q581	Y530-A566 HydrophobicContact CD2-CB 4.15Å; Y530-A566 HydrophobicContact CE2-CB 3.57Å; L533-A566 HydrophobicContact CD1-CB 3.97Å; F535-A566 HydrophobicContact CE2-CB 3.89Å; F535-A566 HydrophobicContact CZ-CB 4.21Å; T536-A566 HydrophobicContact CG2-CB 3.91Å; M553-A566 HydrophobicContact CE-CB 4.45Å; M553-A566 WeakPolarHBondContact SD-CA 3.5Å; M553-A566 HydrophobicContact SD-CB 3.4Å; M553-A566 WeakPolarHBondContact SD-CB 3.18Å; A566-F580 CarbonylContact O-C 3.57Å; A566-F580 WeakPolarHBondContact O-CA 3.41Å; A566-Q581 HydrophobicContact CB-CB 4.39Å; A566-Q581 PolarHBondContact N-O 2.55Å; A566-Q581 PolarHBondContact O-N 2.95Å
567	V	96.3	Very high	91.3	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	126.8	-171.1	-172.1	0	0	0	0	110.1	W522 Y551 Y552 L569 P578 V579 F580 L622	W522-V567 HydrophobicContact CH2-CB 4.47Å; W522-V567 HydrophobicContact CH2-CG2 4.32Å; W522-V567 HydrophobicContact CZ3-CG2 4.2Å; Y551-V567 WeakPolarHBondContact CA-O 3.34Å; Y552-V567 PolarHBondContact N-O 3.47Å; Y552-V567 PolarHBondContact O-N 2.98Å; V567-L569 HydrophobicContact CG1-CG 4.34Å; V567-P578 HydrophobicContact CG1-CB 3.81Å; V567-V579 WeakPolarHBondContact CA-O 3.41Å; V567-F580 HydrophobicContact CG1-CE1 4.38Å; V567-F580 HydrophobicContact CG1-CE2 4.14Å; V567-F580 HydrophobicContact CG1-CZ 4.07Å; V567-F580 HydrophobicContact CG2-CD1 3.68Å; V567-F580 HydrophobicContact CG2-CE1 3.48Å; V567-F580 VanDerWaalsContact CG2-CE1 3.48Å; V567-F580 HydrophobicContact CG2-CG 4.34Å; V567-F580 HydrophobicContact CG2-CZ 4Å; V567-L622 HydrophobicContact CG1-CD1 4.21Å
568	V	95.1	Very high	91.3	Very high	7 Å²	7	30.9 Å²	30.9	4%	0.042	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	119.7	172.3	-173.5	0	0	0	0	109.3	Y530 I539 N549 Y551 P578 V579	Y530-V568 HydrophobicContact CE1-CG2 3.95Å; Y530-V568 HydrophobicContact CE2-CG2 3.7Å; Y530-V568 WeakPolarHBondContact OH-CG2 3.44Å; I539-V568 HydrophobicContact CG2-CG2 4.18Å; N549-V568 HydrophobicContact CB-CG1 3.87Å; N549-V568 WeakPolarHBondContact ND2-CG1 3.49Å; Y551-V568 HydrophobicContact CD1-CG1 4.37Å; Y551-V568 HydrophobicContact CD1-CG2 3.89Å; Y551-V568 HydrophobicContact CE1-CB 4.37Å; Y551-V568 HydrophobicContact CE1-CG1 3.88Å; Y551-V568 HydrophobicContact CE1-CG2 3.76Å; V568-P578 VanDerWaalsContact O-CA 3.28Å; V568-P578 WeakPolarHBondContact O-CA 3.33Å; V568-V579 PolarHBondContact N-O 3.37Å; V568-V579 PolarHBondContact O-N 3.4Å
569	L	92.2	Very high	91.5	Very high	3 Å²	3	31.6 Å²	31.6	2%	0.016	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	110.6	177.6	-87.7	171.1	0	0	0	110.3	F493 L550 Y552 V567 Y573 P578 L622	F493-L569 HydrophobicContact CZ-CD1 3.94Å; L550-L569 HydrophobicContact CB-CB 4.13Å; L550-L569 PolarHBondContact N-O 2.78Å; L550-L569 PolarHBondContact O-N 3.08Å; Y552-L569 HydrophobicContact CD2-CD1 3.74Å; Y552-L569 HydrophobicContact CD2-CG 4.47Å; Y552-L569 HydrophobicContact CE2-CB 4.25Å; Y552-L569 HydrophobicContact CE2-CD1 3.52Å; Y552-L569 HydrophobicContact CE2-CG 4.39Å; V567-L569 HydrophobicContact CG1-CG 4.34Å; L569-Y573 HydrophobicContact CD2-CD2 3.65Å; L569-Y573 HydrophobicContact CD2-CE2 4.13Å; L569-Y573 HydrophobicContact CD2-CG 4.47Å; L569-P578 HydrophobicContact CD2-CB 3.55Å; L569-P578 HydrophobicContact CD2-CG 3.55Å; L569-P578 HydrophobicContact CG-CB 4.02Å; L569-P578 HydrophobicContact CG-CG 4.46Å; L569-L622 HydrophobicContact CD1-CD2 4.13Å
570	N	88.8	Confident	91.8	Very high	48 Å²	48	28.3 Å²	28.3	26%	0.257	16%	0.163	S	C	.	.			trans	-72.7	141.6	169.5	-175.1	-44.7	0	0	0	109.8	G572 Y573 I576	N570-G572 PolarHBondContact O-N 3.1Å; N570-G572 PolarHBondContact OD1-N 3.43Å; N570-Y573 PolarHBondContact O-N 2.98Å; N570-I576 HydrophobicContact CB-CG2 4.42Å
571	P	87.3	Confident	92.1	Very high	4 Å²	4	24.3 Å²	24.3	3%	0.026	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.3	-25.1	172.1	-31	34.9	0	0	0	115.5	S402 C403 R482 T548 Y573	S402-P571 WeakPolarHBondContact O-CB 3.27Å; C403-P571 HydrophobicContact CB-CB 4.11Å; C403-P571 HydrophobicContact CB-CG 4.34Å; R482-P571 PolarHBondContact NE-O 3.5Å; R482-P571 VanDerWaalsContact NE-O 3.13Å; R482-P571 PolarHBondContact NH2-O 3.4Å; T548-P571 WeakPolarHBondContact O-CD 3.19Å; T548-P571 VanDerWaalsContact O-CG 3.26Å; T548-P571 WeakPolarHBondContact O-CG 3.33Å; P571-Y573 PolarHBondContact O-N 3.15Å; P571-Y573 VanDerWaalsContact O-N 3.11Å
572	G	84.9	Confident	92.3	Very high	11 Å²	11	24.3 Å²	24.3	11%	0.113	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	33.4	173.1	0	0	0	0	0	116	N570 S575 I576	N570-G572 PolarHBondContact O-N 3.1Å; N570-G572 PolarHBondContact OD1-N 3.43Å; G572-S575 PolarHBondContact O-N 3.06Å; G572-I576 PolarHBondContact O-N 3.21Å
573	Y	88.2	Confident	92.4	Very high	8 Å²	8	19.9 Å²	19.9	3%	0.031	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	151.9	-180	-179	-110.7	0	0	0	112.9	L489 L569 N570 P571 S575 P578 H619 L621 L622	L489-Y573 HydrophobicContact CD1-CD1 3.48Å; L489-Y573 VanDerWaalsContact CD1-CD1 3.48Å; L489-Y573 HydrophobicContact CD1-CE1 4.02Å; L489-Y573 HydrophobicContact CD1-CG 3.76Å; L489-Y573 HydrophobicContact CD2-CD1 3.85Å; L489-Y573 HydrophobicContact CD2-CD2 4.45Å; L489-Y573 HydrophobicContact CD2-CE1 3.49Å; L489-Y573 VanDerWaalsContact CD2-CE1 3.49Å; L489-Y573 HydrophobicContact CD2-CE2 4.15Å; L489-Y573 HydrophobicContact CD2-CG 4.31Å; L489-Y573 HydrophobicContact CG-CD1 3.54Å; L489-Y573 HydrophobicContact CG-CE1 3.54Å; L489-Y573 HydrophobicContact CG-CG 4.23Å; L569-Y573 HydrophobicContact CD2-CD2 3.65Å; L569-Y573 HydrophobicContact CD2-CE2 4.13Å; L569-Y573 HydrophobicContact CD2-CG 4.47Å; N570-Y573 PolarHBondContact O-N 2.98Å; P571-Y573 PolarHBondContact O-N 3.15Å; P571-Y573 VanDerWaalsContact O-N 3.11Å; Y573-S575 PolarHBondContact O-N 2.69Å; Y573-S575 VanDerWaalsContact O-N 3.17Å; Y573-P578 HydrophobicContact CD2-CG 4.43Å; Y573-P578 HydrophobicContact CE2-CG 4.08Å; Y573-H619 WeakPolarHBondContact CE1-O 3.34Å; Y573-H619 PolarHBondContact OH-O 3.4Å; Y573-L621 HydrophobicContact CE2-CB 4.45Å; Y573-L621 PolarHBondContact OH-N 3.47Å; Y573-L622 HydrophobicContact CE2-CB 3.99Å; Y573-L622 WeakPolarHBondContact OH-CB 3.2Å; Y573-L622 PolarHBondContact OH-N 2.96Å
574	S	82.9	Confident	92.4	Very high	38 Å²	38	19.9 Å²	19.9	27%	0.266	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.4	-19.7	-166.3	-63.7	0	0	0	0	116.3	S618 H619	S574-S618 PolarHBondContact OG-O 2.92Å; S574-H619 PolarHBondContact OG-ND1 3.44Å
575	S	85.1	Confident	92.3	Very high	94 Å²	94	20.8 Å²	20.8	66%	0.657	13%	0.125	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.9	-41.9	171.6	-54.2	0	0	0	0	111.5	G572 Y573	G572-S575 PolarHBondContact O-N 3.06Å; Y573-S575 PolarHBondContact O-N 2.69Å; Y573-S575 VanDerWaalsContact O-N 3.17Å
576	I	88.3	Confident	91.9	Very high	77 Å²	77	21.3 Å²	21.3	40%	0.395	13%	0.127	S	C	.	.	S	Bend	trans	-109.2	127.4	173.9	-58.4	174.2	0	0	0	107.5	N570 G572	N570-I576 HydrophobicContact CB-CG2 4.42Å; G572-I576 PolarHBondContact O-N 3.21Å
577	P	91.6	Very high	91.3	Very high	21 Å²	21	28.5 Å²	28.5	14%	0.136	16%	0.158	C	C	.	.			trans	-70.6	153.6	180	31	-36.2	0	0	0	111.5	Y609 L621	P577-Y609 HydrophobicContact CB-CD1 4.22Å; P577-Y609 HydrophobicContact CB-CD2 3.64Å; P577-Y609 HydrophobicContact CB-CE2 4.03Å; P577-Y609 HydrophobicContact CB-CG 3.72Å; P577-Y609 HydrophobicContact CG-CD1 3.89Å; P577-Y609 HydrophobicContact CG-CD2 3.92Å; P577-Y609 HydrophobicContact CG-CE1 3.87Å; P577-Y609 HydrophobicContact CG-CE2 3.88Å; P577-Y609 HydrophobicContact CG-CG 3.9Å; P577-L621 HydrophobicContact CB-CD2 3.94Å
578	P	94.2	Very high	90.8	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	18%	0.18	C	C	.	.			trans	-63	144.4	162.1	-0.5	13.1	0	0	0	110.3	V567 V568 L569 Y573 F580 L622 Q625	V567-P578 HydrophobicContact CG1-CB 3.81Å; V568-P578 VanDerWaalsContact O-CA 3.28Å; V568-P578 WeakPolarHBondContact O-CA 3.33Å; L569-P578 HydrophobicContact CD2-CB 3.55Å; L569-P578 HydrophobicContact CD2-CG 3.55Å; L569-P578 HydrophobicContact CG-CB 4.02Å; L569-P578 HydrophobicContact CG-CG 4.46Å; Y573-P578 HydrophobicContact CD2-CG 4.43Å; Y573-P578 HydrophobicContact CE2-CG 4.08Å; P578-F580 HydrophobicContact CB-CE2 3.88Å; P578-F580 HydrophobicContact CG-CE2 4.37Å; P578-L622 HydrophobicContact CB-CD1 4.06Å; P578-L622 HydrophobicContact CG-CB 4.29Å; P578-L622 HydrophobicContact CG-CD1 3.7Å; P578-Q625 PolarHBondContact O-NE2 3.3Å
579	V	94.9	Very high	90.6	Very high	32 Å²	32	35 Å²	35	19%	0.194	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	132.2	176.9	-176.6	0	0	0	0	109.6	I539 V567 V568	I539-V579 HydrophobicContact CD1-CG1 3.69Å; I539-V579 HydrophobicContact CG1-CG1 4.5Å; V567-V579 WeakPolarHBondContact CA-O 3.41Å; V568-V579 PolarHBondContact N-O 3.37Å; V568-V579 PolarHBondContact O-N 3.4Å
580	F	96.2	Very high	90.6	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	139.3	-175.9	-70.3	-111	0	0	0	110.9	A565 A566 V567 P578 L582 V605 N606 L622 Q625 L626 L629	A565-F580 HydrophobicContact CB-CD1 4.31Å; A566-F580 CarbonylContact O-C 3.57Å; A566-F580 WeakPolarHBondContact O-CA 3.41Å; V567-F580 HydrophobicContact CG1-CE1 4.38Å; V567-F580 HydrophobicContact CG1-CE2 4.14Å; V567-F580 HydrophobicContact CG1-CZ 4.07Å; V567-F580 HydrophobicContact CG2-CD1 3.68Å; V567-F580 HydrophobicContact CG2-CE1 3.48Å; V567-F580 VanDerWaalsContact CG2-CE1 3.48Å; V567-F580 HydrophobicContact CG2-CG 4.34Å; V567-F580 HydrophobicContact CG2-CZ 4Å; P578-F580 HydrophobicContact CB-CE2 3.88Å; P578-F580 HydrophobicContact CG-CE2 4.37Å; F580-L582 HydrophobicContact CB-CD1 4.08Å; F580-V605 HydrophobicContact CB-CG1 4.33Å; F580-V605 HydrophobicContact CD1-CG1 4.48Å; F580-V605 HydrophobicContact CD2-CG1 3.58Å; F580-V605 HydrophobicContact CE2-CG1 3.96Å; F580-V605 HydrophobicContact CG-CG1 3.89Å; F580-N606 PolarHBondContact N-OD1 2.85Å; F580-N606 PolarHBondContact O-ND2 2.95Å; F580-L622 HydrophobicContact CE2-CD1 4.34Å; F580-L622 HydrophobicContact CZ-CD1 3.83Å; F580-Q625 HydrophobicContact CE2-CB 3.9Å; F580-Q625 HydrophobicContact CE2-CG 4.41Å; F580-Q625 HydrophobicContact CZ-CB 3.93Å; F580-L626 HydrophobicContact CE1-CD2 3.8Å; F580-L626 HydrophobicContact CE1-CG 4.37Å; F580-L626 HydrophobicContact CZ-CD2 4.32Å; F580-L626 HydrophobicContact CZ-CG 4.42Å; F580-L629 HydrophobicContact CD1-CD2 4.07Å; F580-L629 HydrophobicContact CE1-CD2 4.33Å
581	Q	95.6	Very high	90.8	Very high	7 Å²	7	35 Å²	35	3%	0.033	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	133.8	167.4	-78.6	-69.5	-4.8	0	0	109.3	F535 T536 I539 A565 A566 E602	F535-Q581 HydrophobicContact CD2-CB 4.04Å; F535-Q581 HydrophobicContact CE2-CB 4.19Å; F535-Q581 PolarHBondContact O-OE1 2.96Å; T536-Q581 HydrophobicContact CG2-CB 4.12Å; T536-Q581 HydrophobicContact CG2-CG 4.43Å; I539-Q581 HydrophobicContact CD1-CG 4.13Å; I539-Q581 VanDerWaalsContact CD1-NE2 3.27Å; I539-Q581 HydrophobicContact CG1-CG 3.42Å; I539-Q581 VanDerWaalsContact CG1-CG 3.42Å; A565-Q581 CarbonylContact C-O 3.29Å; A565-Q581 WeakPolarHBondContact CA-O 3.49Å; A566-Q581 HydrophobicContact CB-CB 4.39Å; A566-Q581 PolarHBondContact N-O 2.55Å; A566-Q581 PolarHBondContact O-N 2.95Å; Q581-E602 PolarHBondContact OE1-OE1 3.12Å
582	L	96.7	Very high	90.9	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	134.8	-168.2	-82.8	78.2	0	0	0	111.8	L563 F580 I598 M601 E602 L629	L563-L582 HydrophobicContact CD1-CB 4.2Å; L563-L582 HydrophobicContact CD1-CD2 4.05Å; L563-L582 HydrophobicContact CD1-CG 4.18Å; L563-L582 HydrophobicContact CD2-CD2 4.21Å; F580-L582 HydrophobicContact CB-CD1 4.08Å; L582-I598 HydrophobicContact CB-CG2 3.61Å; L582-I598 HydrophobicContact CD2-CG2 4.48Å; L582-M601 HydrophobicContact CD2-CB 3.96Å; L582-M601 HydrophobicContact CD2-CE 3.94Å; L582-E602 HydrophobicContact CB-CG 4.22Å; L582-E602 HydrophobicContact CD1-CB 4.49Å; L582-E602 HydrophobicContact CD1-CG 3.39Å; L582-E602 HydrophobicContact CG-CG 4.25Å; L582-E602 PolarHBondContact N-OE1 3.31Å; L582-L629 HydrophobicContact CD1-CD1 4.18Å; L582-L629 HydrophobicContact CD2-CD1 3.66Å; L582-L629 HydrophobicContact CG-CD1 4.24Å
583	C	96.4	Very high	91.1	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.007	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	115.4	166.5	-175.8	0	0	0	0	110	F535 Q564	F535-C583 HydrophobicContact CB-CB 4.46Å; F535-C583 HydrophobicContact CD1-CB 3.65Å; F535-C583 HydrophobicContact CD2-CB 3.91Å; F535-C583 HydrophobicContact CE1-CB 3.73Å; F535-C583 HydrophobicContact CE2-CB 4Å; F535-C583 HydrophobicContact CG-CB 3.74Å; F535-C583 HydrophobicContact CZ-CB 3.92Å; Q564-C583 HydrophobicContact CB-CB 4.43Å; Q564-C583 PolarHBondContact N-O 3.36Å; Q564-C583 PolarHBondContact O-N 2.82Å
584	L	95.8	Very high	91.3	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	112.2	179.5	179.3	65.3	0	0	0	109.8	A561 L563 W586 K590 I598 L633 Y636	A561-L584 HydrophobicContact CB-CD1 4.47Å; L563-L584 HydrophobicContact CB-CD1 4.04Å; L563-L584 HydrophobicContact CD1-CB 3.97Å; L563-L584 HydrophobicContact CD1-CD1 4.3Å; L584-W586 HydrophobicContact CD1-CB 4.28Å; L584-W586 HydrophobicContact CD2-CB 4.49Å; L584-W586 HydrophobicContact CD2-CE3 4.45Å; L584-W586 HydrophobicContact CG-CB 4.12Å; L584-W586 PolarHBondContact O-N 3.4Å; L584-K590 HydrophobicContact CB-CB 4.34Å; L584-K590 PolarHBondContact N-O 2.96Å; L584-K590 PolarHBondContact O-N 3.33Å; L584-I598 HydrophobicContact CB-CD1 3.94Å; L584-I598 HydrophobicContact CD2-CD1 4.28Å; L584-L633 HydrophobicContact CD1-CD1 3.86Å; L584-Y636 HydrophobicContact CD2-CD1 3.84Å; L584-Y636 HydrophobicContact CD2-CE1 3.39Å
585	N	93.8	Very high	91.7	Very high	85 Å²	85	44.1 Å²	44.1	46%	0.455	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	91.4	170.8	-168.3	-13	0	0	0	109.2	K562	K562-N585 PolarHBondContact N-O 3.47Å; K562-N585 PolarHBondContact O-N 3.41Å
586	W	88.3	Confident	92.1	Very high	12 Å²	12	42.7 Å²	42.7	5%	0.045	24%	0.236	C	C	.	.	S	Bend	trans	-156.2	120.1	175.4	178.6	59.6	0	0	0	109.4	A561 L584 G588 Y636 L637 E640 E651 F652	A561-W586 HydrophobicContact CB-CB 3.92Å; A561-W586 HydrophobicContact CB-CD2 4.39Å; A561-W586 HydrophobicContact CB-CG 3.8Å; L584-W586 HydrophobicContact CD1-CB 4.28Å; L584-W586 HydrophobicContact CD2-CB 4.49Å; L584-W586 HydrophobicContact CD2-CE3 4.45Å; L584-W586 HydrophobicContact CG-CB 4.12Å; L584-W586 PolarHBondContact O-N 3.4Å; W586-G588 VanDerWaalsContact C-N 3.33Å; W586-G588 CarbonylContact C-O 3.59Å; W586-G588 PolarHBondContact N-O 2.95Å; W586-Y636 HydrophobicContact CE3-CE1 4.21Å; W586-Y636 HydrophobicContact CZ3-CE1 4.06Å; W586-L637 HydrophobicContact CD2-CD2 3.7Å; W586-L637 HydrophobicContact CE3-CD2 3.35Å; W586-L637 HydrophobicContact CG-CD2 4.43Å; W586-L637 HydrophobicContact CH2-CD2 3.82Å; W586-L637 HydrophobicContact CZ2-CD2 4.16Å; W586-L637 HydrophobicContact CZ3-CD2 3.39Å; W586-E640 HydrophobicContact CH2-CB 4.12Å; W586-E640 HydrophobicContact CH2-CG 4.02Å; W586-E640 HydrophobicContact CZ3-CB 4.38Å; W586-E640 HydrophobicContact CZ3-CG 4.18Å; W586-E640 WeakPolarHBondContact CZ3-OE1 3.44Å; W586-E640 VanDerWaalsContact CZ3-OE2 3.27Å; W586-E640 WeakPolarHBondContact CZ3-OE2 3.36Å; W586-E651 PolarHBondContact NE1-OE2 3.18Å; W586-E651 VanDerWaalsContact NE1-OE2 3.14Å; W586-F652 AromaticContact CE2-CE2 3.63Å; W586-F652 HydrophobicContact CH2-CD2 4.27Å; W586-F652 HydrophobicContact CH2-CE2 4.32Å; W586-F652 AromaticContact CZ2-CD2 3.78Å; W586-F652 HydrophobicContact CZ2-CD2 3.78Å; W586-F652 AromaticContact CZ2-CE2 3.52Å; W586-F652 HydrophobicContact CZ2-CE2 3.52Å; W586-F652 AromaticContact NE1-CE2 3.65Å
587	K	83.8	Confident	92.3	Very high	150 Å²	150	40 Å²	40	65%	0.652	22%	0.223	S	C	*	.	S	Bend	trans	54.1	48	-171.2	-58.8	-179.9	177.7	-179.6	0	112.4
588	G	86.8	Confident	92.5	Very high	44 Å²	44	39 Å²	39	45%	0.454	22%	0.216	S	C	.	.	S	Bend	trans	99.7	-172.3	-169.8	0	0	0	0	0	111.9	W586	W586-G588 VanDerWaalsContact C-N 3.33Å; W586-G588 CarbonylContact C-O 3.59Å; W586-G588 PolarHBondContact N-O 2.95Å
589	E	91.5	Very high	92.5	Very high	99 Å²	99	45.5 Å²	45.5	46%	0.463	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	106.8	-178.3	-172.3	164.5	-133.5	0	0	110.3	H534 N594	H534-E589 IonicContact CE1-OE1 3.26Å; H534-E589 PolarHBondContact CE1-OE1 2.92Å; H534-E589 IonicContact NE2-OE1 2.66Å; H534-E589 PolarHBondContact NE2-OE1 3.42Å; H534-E589 VanDerWaalsContact NE2-OE1 3.1Å; H534-E589 IonicContact NE2-OE2 3.01Å; E589-N594 PolarHBondContact O-ND2 3.36Å
590	K	91.3	Very high	92.4	Very high	37 Å²	37	44.9 Å²	44.9	16%	0.161	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	119.7	175.2	-56.6	-171	-170.6	-173.6	0	108.9	L584 N594 I598 Y636 E640	L584-K590 HydrophobicContact CB-CB 4.34Å; L584-K590 PolarHBondContact N-O 2.96Å; L584-K590 PolarHBondContact O-N 3.33Å; K590-N594 WeakPolarHBondContact CA-OD1 3.48Å; K590-I598 HydrophobicContact CB-CG1 4.49Å; K590-Y636 WeakPolarHBondContact CD-OH 3.24Å; K590-Y636 PolarHBondContact NZ-OH 3.29Å; K590-E640 IonicContact NZ-OE1 2.95Å; K590-E640 PolarHBondContact NZ-OE1 3.39Å; K590-E640 IonicContact NZ-OE2 3.83Å; K590-E640 PolarHBondContact NZ-OE2 3.03Å
591	T	92.3	Very high	92.3	Very high	16 Å²	16	44.9 Å²	44.9	10%	0.098	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	171.8	-175.3	-175.5	0	0	0	0	110.2	F535 S593 N594 D595	F535-T591 WeakPolarHBondContact CB-OG1 3.41Å; T591-S593 PolarHBondContact O-N 3.14Å; T591-S593 VanDerWaalsContact O-N 3.15Å; T591-N594 PolarHBondContact N-OD1 2.77Å; T591-N594 PolarHBondContact O-N 3.47Å; T591-N594 VanDerWaalsContact O-N 3.1Å; T591-N594 PolarHBondContact O-OD1 3.46Å; T591-D595 PolarHBondContact O-N 3.34Å; T591-D595 VanDerWaalsContact O-N 3.08Å
592	N	90.3	Very high	92.3	Very high	14 Å²	14	45.1 Å²	45.1	8%	0.075	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.1	-34	178.1	-166.5	-2	0	0	0	113	N594 R599 E602	N592-N594 PolarHBondContact O-N 2.96Å; N592-R599 VanDerWaalsContact OD1-CB 3.26Å; N592-R599 WeakPolarHBondContact OD1-CB 3.38Å; N592-R599 WeakPolarHBondContact OD1-CG 3.31Å; N592-E602 VanDerWaalsContact CG-OE2 3.24Å; N592-E602 PolarHBondContact ND2-OE2 3.28Å
593	S	89.9	Confident	92.2	Very high	112 Å²	112	46.3 Å²	46.3	78%	0.783	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-19.7	-178.5	-47.6	0	0	0	0	114.7	T591	T591-S593 PolarHBondContact O-N 3.14Å; T591-S593 VanDerWaalsContact O-N 3.15Å
594	N	91.6	Very high	92.1	Very high	101 Å²	101	46.8 Å²	46.8	54%	0.54	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122	-10	-172.5	71.7	11.5	0	0	0	114.9	E589 K590 T591 N592	E589-N594 PolarHBondContact O-ND2 3.36Å; K590-N594 WeakPolarHBondContact CA-OD1 3.48Å; T591-N594 PolarHBondContact N-OD1 2.77Å; T591-N594 PolarHBondContact O-N 3.47Å; T591-N594 VanDerWaalsContact O-N 3.1Å; T591-N594 PolarHBondContact O-OD1 3.46Å; N592-N594 PolarHBondContact O-N 2.96Å
595	D	92	Very high	92.1	Very high	24 Å²	24	46.8 Å²	46.8	13%	0.128	25%	0.254	C	S	.	.			trans	-137.7	115.1	175.6	-175.7	-1.5	0	0	0	111.9	T591 N597 I598 R599 Y636	T591-D595 PolarHBondContact O-N 3.34Å; T591-D595 VanDerWaalsContact O-N 3.08Å; D595-N597 PolarHBondContact O-N 2.97Å; D595-N597 WeakPolarHBondContact OD1-CB 3.39Å; D595-N597 PolarHBondContact OD1-N 2.91Å; D595-N597 PolarHBondContact OD1-ND2 2.87Å; D595-N597 VanDerWaalsContact OD1-ND2 3.09Å; D595-I598 HydrophobicContact CB-CG1 3.86Å; D595-I598 WeakPolarHBondContact O-CB 3.24Å; D595-I598 PolarHBondContact O-N 3.28Å; D595-R599 PolarHBondContact O-N 3.46Å; D595-Y636 WeakPolarHBondContact OD2-CE2 3.34Å; D595-Y636 PolarHBondContact OD2-OH 3.05Å
596	D	93.3	Very high	92.1	Very high	65 Å²	65	44 Å²	44	35%	0.348	24%	0.24	S	C	.	.	H	α-helix	trans	-65.8	-20.6	-179.3	-159.6	37.9	0	0	0	112.8	R599 A600 S666	D596-R599 WeakPolarHBondContact O-CB 3.34Å; D596-R599 PolarHBondContact O-N 3.24Å; D596-A600 WeakPolarHBondContact O-CB 3.49Å; D596-A600 PolarHBondContact O-N 2.84Å; D596-S666 WeakPolarHBondContact OD2-CB 3.45Å; D596-S666 PolarHBondContact OD2-OG 3.35Å
597	N	92.8	Very high	92.4	Very high	19 Å²	19	48.8 Å²	48.8	10%	0.102	27%	0.27	C	S	.	.	H	α-helix	trans	-75.1	-29.2	174.4	-63.5	-76.4	0	0	0	112.1	D595 A600 M601 Y636 K669 F671	D595-N597 PolarHBondContact O-N 2.97Å; D595-N597 WeakPolarHBondContact OD1-CB 3.39Å; D595-N597 PolarHBondContact OD1-N 2.91Å; D595-N597 PolarHBondContact OD1-ND2 2.87Å; D595-N597 VanDerWaalsContact OD1-ND2 3.09Å; N597-A600 PolarHBondContact O-N 3.43Å; N597-M601 WeakPolarHBondContact O-CG 3.12Å; N597-M601 PolarHBondContact O-N 3.46Å; N597-Y636 HydrophobicContact CB-CD2 3.97Å; N597-Y636 HydrophobicContact CB-CE2 3.68Å; N597-K669 HydrophobicContact CB-CD 4.49Å; N597-K669 WeakPolarHBondContact OD1-CG 3.3Å; N597-K669 PolarHBondContact OD1-N 2.81Å; N597-F671 HydrophobicContact CB-CE2 4.34Å; N597-F671 HydrophobicContact CB-CZ 4.25Å
598	I	93.9	Very high	92.9	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-65	-47.6	171.3	-60	-60.5	0	0	0	108.9	L582 L584 K590 D595 A600 M601 E602 Y636	L582-I598 HydrophobicContact CB-CG2 3.61Å; L582-I598 HydrophobicContact CD2-CG2 4.48Å; L584-I598 HydrophobicContact CB-CD1 3.94Å; L584-I598 HydrophobicContact CD2-CD1 4.28Å; K590-I598 HydrophobicContact CB-CG1 4.49Å; D595-I598 HydrophobicContact CB-CG1 3.86Å; D595-I598 WeakPolarHBondContact O-CB 3.24Å; D595-I598 PolarHBondContact O-N 3.28Å; I598-A600 VanDerWaalsContact C-N 3.26Å; I598-A600 PolarHBondContact O-N 3.35Å; I598-M601 HydrophobicContact CD1-CE 3.43Å; I598-M601 VanDerWaalsContact CD1-CE 3.43Å; I598-M601 HydrophobicContact CG1-CE 4.5Å; I598-M601 WeakPolarHBondContact O-CB 3.27Å; I598-M601 PolarHBondContact O-N 3.39Å; I598-M601 VanDerWaalsContact O-N 3.12Å; I598-E602 PolarHBondContact O-N 2.92Å; I598-Y636 HydrophobicContact CD1-CE2 4.3Å
599	R	94.2	Very high	93.2	Very high	137 Å²	137	43.6 Å²	43.6	52%	0.517	24%	0.236	S	C	.	.	H	α-helix	trans	-57	-38.6	174	-169.2	178.8	-177.5	93.4	-1	112.6	N592 D595 D596 E602 G603	N592-R599 VanDerWaalsContact OD1-CB 3.26Å; N592-R599 WeakPolarHBondContact OD1-CB 3.38Å; N592-R599 WeakPolarHBondContact OD1-CG 3.31Å; D595-R599 PolarHBondContact O-N 3.46Å; D596-R599 WeakPolarHBondContact O-CB 3.34Å; D596-R599 PolarHBondContact O-N 3.24Å; R599-E602 WeakPolarHBondContact O-CB 3.41Å; R599-E602 PolarHBondContact O-N 2.99Å; R599-G603 PolarHBondContact O-N 3.29Å
600	A	93.9	Very high	93.1	Very high	19 Å²	19	45.9 Å²	45.9	16%	0.157	25%	0.245	C	C	.	.	H	α-helix	trans	-69.7	-38.6	176.4	0	0	0	0	0	113	D596 N597 I598 E602 G603 E604 M668 F671	D596-A600 WeakPolarHBondContact O-CB 3.49Å; D596-A600 PolarHBondContact O-N 2.84Å; N597-A600 PolarHBondContact O-N 3.43Å; I598-A600 VanDerWaalsContact C-N 3.26Å; I598-A600 PolarHBondContact O-N 3.35Å; A600-E602 VanDerWaalsContact C-N 3.33Å; A600-G603 PolarHBondContact O-N 3.21Å; A600-E604 WeakPolarHBondContact O-CG 3.34Å; A600-E604 PolarHBondContact O-N 2.9Å; A600-M668 HydrophobicContact CB-CE 3.73Å; A600-M668 HydrophobicContact CB-SD 3.21Å; A600-M668 WeakPolarHBondContact CB-SD 3.35Å; A600-F671 HydrophobicContact CB-CD2 4.01Å; A600-F671 HydrophobicContact CB-CE2 3.83Å
601	M	94.8	Very high	93.1	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-62.4	-41.7	172.1	-70.4	-169.5	-66.9	0	0	111.5	L582 N597 I598 G603 E604 V605 L632 Y636 F671	L582-M601 HydrophobicContact CD2-CB 3.96Å; L582-M601 HydrophobicContact CD2-CE 3.94Å; N597-M601 WeakPolarHBondContact O-CG 3.12Å; N597-M601 PolarHBondContact O-N 3.46Å; I598-M601 HydrophobicContact CD1-CE 3.43Å; I598-M601 VanDerWaalsContact CD1-CE 3.43Å; I598-M601 HydrophobicContact CG1-CE 4.5Å; I598-M601 WeakPolarHBondContact O-CB 3.27Å; I598-M601 PolarHBondContact O-N 3.39Å; I598-M601 VanDerWaalsContact O-N 3.12Å; M601-G603 VanDerWaalsContact C-N 3.32Å; M601-G603 PolarHBondContact O-N 3.5Å; M601-E604 PolarHBondContact O-N 3.37Å; M601-V605 WeakPolarHBondContact O-CG2 3.39Å; M601-V605 PolarHBondContact O-N 3.15Å; M601-V605 VanDerWaalsContact O-N 3.14Å; M601-L632 HydrophobicContact CB-CD1 4.15Å; M601-L632 HydrophobicContact CG-CB 3.92Å; M601-L632 HydrophobicContact CG-CD1 4.27Å; M601-L632 HydrophobicContact SD-CB 3.76Å; M601-Y636 HydrophobicContact CE-CD2 4Å; M601-Y636 HydrophobicContact CE-CG 4.35Å; M601-Y636 HydrophobicContact SD-CD2 4.44Å; M601-F671 HydrophobicContact CG-CD1 4.43Å; M601-F671 HydrophobicContact CG-CD2 4.48Å; M601-F671 HydrophobicContact CG-CE1 3.92Å; M601-F671 HydrophobicContact CG-CE2 3.98Å; M601-F671 HydrophobicContact CG-CZ 3.67Å; M601-F671 HydrophobicContact SD-CE1 4.33Å; M601-F671 HydrophobicContact SD-CZ 4.34Å
602	E	95.1	Very high	92.9	Very high	12 Å²	12	46.9 Å²	46.9	6%	0.056	25%	0.249	C	C	.	.	H	α-helix	trans	-58.7	-43.3	171.5	-72.5	174	-175.6	0	0	111.6	Q581 L582 N592 I598 R599 A600 E604 V605 N606	Q581-E602 PolarHBondContact OE1-OE1 3.12Å; L582-E602 HydrophobicContact CB-CG 4.22Å; L582-E602 HydrophobicContact CD1-CB 4.49Å; L582-E602 HydrophobicContact CD1-CG 3.39Å; L582-E602 HydrophobicContact CG-CG 4.25Å; L582-E602 PolarHBondContact N-OE1 3.31Å; N592-E602 VanDerWaalsContact CG-OE2 3.24Å; N592-E602 PolarHBondContact ND2-OE2 3.28Å; I598-E602 PolarHBondContact O-N 2.92Å; R599-E602 WeakPolarHBondContact O-CB 3.41Å; R599-E602 PolarHBondContact O-N 2.99Å; A600-E602 VanDerWaalsContact C-N 3.33Å; E602-E604 PolarHBondContact O-N 2.91Å; E602-V605 PolarHBondContact O-N 3.36Å; E602-N606 WeakPolarHBondContact O-CB 3.38Å; E602-N606 PolarHBondContact O-N 3.09Å; E602-N606 PolarHBondContact O-ND2 3.12Å
603	G	94.1	Very high	92.7	Very high	25 Å²	25	49 Å²	49	26%	0.258	26%	0.264	S	S	.	.	I	π-helix	trans	-58.6	-45.5	175.2	0	0	0	0	0	113.2	R599 A600 M601 V605 V607 C608	R599-G603 PolarHBondContact O-N 3.29Å; A600-G603 PolarHBondContact O-N 3.21Å; M601-G603 VanDerWaalsContact C-N 3.32Å; M601-G603 PolarHBondContact O-N 3.5Å; G603-V605 VanDerWaalsContact C-N 3.29Å; G603-V605 PolarHBondContact O-N 3.11Å; G603-V607 WeakPolarHBondContact O-CA 3.49Å; G603-V607 VanDerWaalsContact O-CB 3.29Å; G603-V607 WeakPolarHBondContact O-CB 3.35Å; G603-V607 PolarHBondContact O-N 2.83Å; G603-C608 PolarHBondContact O-N 2.81Å
604	E	94.3	Very high	92	Very high	11 Å²	11	44.4 Å²	44.4	5%	0.051	23%	0.234	C	C	.	.	I	π-helix	trans	-65	-30.2	179	-73.2	-67.8	160.7	0	0	113.3	A600 M601 E602 C608 L632 F671 R683	A600-E604 WeakPolarHBondContact O-CG 3.34Å; A600-E604 PolarHBondContact O-N 2.9Å; M601-E604 PolarHBondContact O-N 3.37Å; E602-E604 PolarHBondContact O-N 2.91Å; E604-C608 WeakPolarHBondContact O-CB 3.21Å; E604-L632 HydrophobicContact CB-CD1 3.88Å; E604-L632 HydrophobicContact CB-CD2 4.5Å; E604-F671 HydrophobicContact CG-CB 3.94Å; E604-R683 WeakPolarHBondContact OE1-CB 3.48Å; E604-R683 WeakPolarHBondContact OE1-CD 3.26Å; E604-R683 WeakPolarHBondContact OE1-CG 3.09Å; E604-R683 IonicContact OE2-NH1 3.78Å
605	V	95.2	Very high	91.4	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.234	C	C	.	.	I	π-helix	trans	-89.7	-46.5	179.7	175.3	0	0	0	0	112.3	F580 M601 E602 G603 Q625 L629 L632	F580-V605 HydrophobicContact CB-CG1 4.33Å; F580-V605 HydrophobicContact CD1-CG1 4.48Å; F580-V605 HydrophobicContact CD2-CG1 3.58Å; F580-V605 HydrophobicContact CE2-CG1 3.96Å; F580-V605 HydrophobicContact CG-CG1 3.89Å; M601-V605 WeakPolarHBondContact O-CG2 3.39Å; M601-V605 PolarHBondContact O-N 3.15Å; M601-V605 VanDerWaalsContact O-N 3.14Å; E602-V605 PolarHBondContact O-N 3.36Å; G603-V605 VanDerWaalsContact C-N 3.29Å; G603-V605 PolarHBondContact O-N 3.11Å; V605-Q625 HydrophobicContact CG1-CB 3.89Å; V605-Q625 HydrophobicContact CG1-CG 3.9Å; V605-Q625 PolarHBondContact O-NE2 3.3Å; V605-L629 HydrophobicContact CG2-CB 4.48Å; V605-L629 HydrophobicContact CG2-CD1 4.1Å; V605-L632 HydrophobicContact CG2-CD1 3.81Å
606	N	94.6	Very high	90.5	Very high	28 Å²	28	53 Å²	53	15%	0.15	27%	0.269	C	S	.	.	I	π-helix	trans	-84.5	-42.2	-172.1	-64.7	-30.4	0	0	0	112.6	F580 E602 Y609	F580-N606 PolarHBondContact N-OD1 2.85Å; F580-N606 PolarHBondContact O-ND2 2.95Å; E602-N606 WeakPolarHBondContact O-CB 3.38Å; E602-N606 PolarHBondContact O-N 3.09Å; E602-N606 PolarHBondContact O-ND2 3.12Å; N606-Y609 VanDerWaalsContact O-CD1 3.23Å; N606-Y609 WeakPolarHBondContact O-CD1 3.5Å
607	V	94.7	Very high	89.3	Confident	111 Å²	111	52.5 Å²	52.5	67%	0.673	27%	0.269	S	S	*	.	I	π-helix	trans	-90.9	-41.8	-174.3	-175.2	0	0	0	0	110.9	G603 Y609	G603-V607 WeakPolarHBondContact O-CA 3.49Å; G603-V607 VanDerWaalsContact O-CB 3.29Å; G603-V607 WeakPolarHBondContact O-CB 3.35Å; G603-V607 PolarHBondContact O-N 2.83Å; V607-Y609 WeakPolarHBondContact O-CD1 3.46Å; V607-Y609 PolarHBondContact O-N 2.56Å
608	C	93.7	Very high	88.8	Confident	26 Å²	26	52.7 Å²	52.7	18%	0.176	27%	0.272	C	S	.	.	S	Bend	trans	-86.9	19.3	-179.9	-63.7	0	0	0	0	114.1	G603 E604 K610 E611	G603-C608 PolarHBondContact O-N 2.81Å; E604-C608 WeakPolarHBondContact O-CB 3.21Å; C608-K610 PolarHBondContact O-N 3.15Å; C608-K610 VanDerWaalsContact O-N 3.08Å; C608-E611 WeakPolarHBondContact O-CB 3.48Å; C608-E611 PolarHBondContact O-N 3.12Å
609	Y	92.6	Very high	88.5	Confident	59 Å²	59	53.8 Å²	53.8	23%	0.231	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-56.7	-26.4	-178.6	75.5	-84.5	0	0	0	114.4	P577 N606 V607 E611 L612 C613 L621	P577-Y609 HydrophobicContact CB-CD1 4.22Å; P577-Y609 HydrophobicContact CB-CD2 3.64Å; P577-Y609 HydrophobicContact CB-CE2 4.03Å; P577-Y609 HydrophobicContact CB-CG 3.72Å; P577-Y609 HydrophobicContact CG-CD1 3.89Å; P577-Y609 HydrophobicContact CG-CD2 3.92Å; P577-Y609 HydrophobicContact CG-CE1 3.87Å; P577-Y609 HydrophobicContact CG-CE2 3.88Å; P577-Y609 HydrophobicContact CG-CG 3.9Å; N606-Y609 VanDerWaalsContact O-CD1 3.23Å; N606-Y609 WeakPolarHBondContact O-CD1 3.5Å; V607-Y609 WeakPolarHBondContact O-CD1 3.46Å; V607-Y609 PolarHBondContact O-N 2.56Å; Y609-E611 PolarHBondContact O-N 3.18Å; Y609-L612 WeakPolarHBondContact O-CA 3.29Å; Y609-L612 WeakPolarHBondContact O-CB 3.48Å; Y609-L612 PolarHBondContact O-N 2.99Å; Y609-C613 PolarHBondContact O-N 3.45Å; Y609-L621 HydrophobicContact CD2-CD1 4.49Å; Y609-L621 HydrophobicContact CD2-CD2 4.09Å; Y609-L621 WeakPolarHBondContact O-CD1 3.46Å
610	K	90.9	Very high	88.3	Confident	148 Å²	148	49.7 Å²	49.7	64%	0.643	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-65.8	-19.3	176.8	-67	-176.1	-179.7	176.8	0	113.5	C608 C613	C608-K610 PolarHBondContact O-N 3.15Å; C608-K610 VanDerWaalsContact O-N 3.08Å; K610-C613 PolarHBondContact O-SG 3.3Å
611	E	90.4	Very high	88.3	Confident	73 Å²	73	49.1 Å²	49.1	34%	0.341	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-76.7	-18	171.8	-62	178.8	173.1	0	0	111.9	L510 C608 Y609 R628 R683	L510-E611 WeakPolarHBondContact CD2-O 3.23Å; C608-E611 WeakPolarHBondContact O-CB 3.48Å; C608-E611 PolarHBondContact O-N 3.12Å; Y609-E611 PolarHBondContact O-N 3.18Å; E611-R628 IonicContact OE2-CZ 3.2Å; E611-R628 IonicContact OE2-NH1 3.95Å; E611-R628 PolarHBondContact OE2-NH1 3.33Å; E611-R628 VanDerWaalsContact OE2-NH1 3.13Å; E611-R628 IonicContact OE2-NH2 2.75Å; E611-R683 VanDerWaalsContact CD-NH1 3.33Å; E611-R683 IonicContact OE1-CZ 2.72Å; E611-R683 IonicContact OE1-NH1 3.07Å; E611-R683 PolarHBondContact OE1-NH1 2.87Å; E611-R683 IonicContact OE1-NH2 2.88Å; E611-R683 PolarHBondContact OE1-NH2 3.46Å; E611-R683 IonicContact OE2-NH1 2.75Å; E611-R683 PolarHBondContact OE2-NH1 2.96Å
612	L	89.3	Confident	88.3	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.258	C	S	.	.	S	Bend	trans	-98.6	-7.4	-178.3	-66	177.9	0	0	0	113.1	L510 F511 Y609 G614 L621 N624 Q625 R628	L510-L612 HydrophobicContact CD1-CD2 4.26Å; F511-L612 HydrophobicContact CE1-CD2 4.13Å; F511-L612 HydrophobicContact CZ-CD2 4.13Å; Y609-L612 WeakPolarHBondContact O-CA 3.29Å; Y609-L612 WeakPolarHBondContact O-CB 3.48Å; Y609-L612 PolarHBondContact O-N 2.99Å; L612-G614 PolarHBondContact O-N 3.35Å; L612-L621 HydrophobicContact CB-CD1 3.92Å; L612-N624 HydrophobicContact CB-CB 4.06Å; L612-N624 HydrophobicContact CD2-CB 4.25Å; L612-N624 PolarHBondContact O-ND2 2.78Å; L612-Q625 HydrophobicContact CD1-CB 4.3Å; L612-Q625 HydrophobicContact CD1-CG 3.6Å; L612-R628 HydrophobicContact CD1-CB 4.07Å; L612-R628 HydrophobicContact CD2-CB 4.32Å; L612-R628 VanDerWaalsContact CD2-NE 3.33Å
613	C	85.1	Confident	88.2	Confident	59 Å²	59	48.5 Å²	48.5	40%	0.399	26%	0.255	S	S	.	.			trans	-74.5	114.3	173.5	66.8	0	0	0	0	109.5	Y609 K610 S618	Y609-C613 PolarHBondContact O-N 3.45Å; K610-C613 PolarHBondContact O-SG 3.3Å; C613-S618 VanDerWaalsContact C-OG 3.31Å; C613-S618 VanDerWaalsContact CA-OG 3.27Å; C613-S618 WeakPolarHBondContact CA-OG 3.38Å; C613-S618 WeakPolarHBondContact CB-OG 3.3Å
614	G	76.4	Confident	88.2	Confident	15 Å²	15	47.3 Å²	47.3	16%	0.155	24%	0.243	C	C	.	.			trans	-68.7	-171	170	0	0	0	0	0	113.1	L612 S618	L612-G614 PolarHBondContact O-N 3.35Å; G614-S618 PolarHBondContact N-OG 3.21Å; G614-S618 WeakPolarHBondContact O-CB 3.24Å; G614-S618 PolarHBondContact O-OG 3.09Å; G614-S618 VanDerWaalsContact O-OG 3.05Å
615	P	77.8	Confident	88.2	Confident	83 Å²	83	46.8 Å²	46.8	54%	0.539	24%	0.24	S	C	.	.	S	Bend	trans	-58.5	155.5	-178.8	26	-34.5	0	0	0	112.5	P617 S618	P615-P617 CarbonylContact O-C 3.2Å; P615-S618 PolarHBondContact O-N 3.49Å
616	W	72.4	Confident	88.3	Confident	223 Å²	223	46.9 Å²	46.9	85%	0.845	24%	0.24	S	C	*	.	S	Bend	trans	-71.7	132.7	179	-172	95.2	0	0	0	111
617	P	69.1	Low	88.3	Confident	55 Å²	55	46.5 Å²	46.5	36%	0.357	24%	0.238	S	C	.	.	S	Bend	cis	-83.3	128.7	-0.6	33.4	-34.3	0	0	0	113.4	P615 H619	P615-P617 CarbonylContact O-C 3.2Å; P617-H619 WeakPolarHBondContact CB-NE2 3.42Å; P617-H619 PolarHBondContact O-N 2.93Å; P617-H619 VanDerWaalsContact O-N 3.09Å
618	S	82.6	Confident	88.3	Confident	23 Å²	23	42.7 Å²	42.7	16%	0.161	21%	0.211	C	C	.	.			trans	-87.4	77.9	-170.9	-155.3	0	0	0	0	112.5	S574 C613 G614 P615	S574-S618 PolarHBondContact OG-O 2.92Å; C613-S618 VanDerWaalsContact C-OG 3.31Å; C613-S618 VanDerWaalsContact CA-OG 3.27Å; C613-S618 WeakPolarHBondContact CA-OG 3.38Å; C613-S618 WeakPolarHBondContact CB-OG 3.3Å; G614-S618 PolarHBondContact N-OG 3.21Å; G614-S618 WeakPolarHBondContact O-CB 3.24Å; G614-S618 PolarHBondContact O-OG 3.09Å; G614-S618 VanDerWaalsContact O-OG 3.05Å; P615-S618 PolarHBondContact O-N 3.49Å
619	H	87.9	Confident	88.4	Confident	23 Å²	23	41.4 Å²	41.4	11%	0.106	20%	0.203	C	C	.	.			trans	-90.7	-5	179.1	-58.8	-51.5	0	0	0	114.1	A488 Q492 Y573 S574 P617	A488-H619 HydrophobicContact CB-CB 3.63Å; Q492-H619 PolarHBondContact NE2-O 3Å; Y573-H619 WeakPolarHBondContact CE1-O 3.34Å; Y573-H619 PolarHBondContact OH-O 3.4Å; S574-H619 PolarHBondContact OG-ND1 3.44Å; P617-H619 WeakPolarHBondContact CB-NE2 3.42Å; P617-H619 PolarHBondContact O-N 2.93Å; P617-H619 VanDerWaalsContact O-N 3.09Å
620	Q	89.3	Confident	88.6	Confident	51 Å²	51	38.7 Å²	38.7	24%	0.238	19%	0.193	C	C	.	.			trans	-94.1	17.5	-176.6	-58	-62	-26.3	0	0	113.9	T504 T623 N624	T504-Q620 HydrophobicContact CG2-CG 3.84Å; Q620-T623 PolarHBondContact O-OG1 3.14Å; Q620-T623 VanDerWaalsContact O-OG1 3.11Å; Q620-T623 PolarHBondContact OE1-OG1 2.93Å; Q620-N624 WeakPolarHBondContact O-CB 3.36Å; Q620-N624 PolarHBondContact O-N 2.79Å; Q620-N624 VanDerWaalsContact O-N 3.15Å; Q620-N624 PolarHBondContact O-ND2 3.3Å
621	L	93.7	Very high	88.7	Confident	6 Å²	6	32 Å²	32	3%	0.031	16%	0.164	C	C	.	.	H	α-helix	trans	-63.9	-45	-174.4	-177.8	62.7	0	0	0	112.6	Y573 P577 Y609 L612 N624 Q625	Y573-L621 HydrophobicContact CE2-CB 4.45Å; Y573-L621 PolarHBondContact OH-N 3.47Å; P577-L621 HydrophobicContact CB-CD2 3.94Å; Y609-L621 HydrophobicContact CD2-CD1 4.49Å; Y609-L621 HydrophobicContact CD2-CD2 4.09Å; Y609-L621 WeakPolarHBondContact O-CD1 3.46Å; L612-L621 HydrophobicContact CB-CD1 3.92Å; L621-N624 PolarHBondContact O-N 3.48Å; L621-Q625 HydrophobicContact CD1-CG 4.48Å; L621-Q625 WeakPolarHBondContact O-CG 3.2Å; L621-Q625 PolarHBondContact O-N 3.24Å
622	L	94.9	Very high	88.9	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-63	-45.4	-177.4	178.2	68.5	0	0	0	112.3	L489 F493 W522 V567 L569 Y573 P578 F580 N624 Q625 L626	L489-L622 HydrophobicContact CD2-CD2 3.99Å; F493-L622 HydrophobicContact CD1-CD2 4.47Å; F493-L622 HydrophobicContact CE1-CD2 3.57Å; F493-L622 HydrophobicContact CZ-CD2 4.38Å; W522-L622 HydrophobicContact CH2-CD2 4.29Å; W522-L622 HydrophobicContact CZ2-CD2 4.41Å; V567-L622 HydrophobicContact CG1-CD1 4.21Å; L569-L622 HydrophobicContact CD1-CD2 4.13Å; Y573-L622 HydrophobicContact CE2-CB 3.99Å; Y573-L622 WeakPolarHBondContact OH-CB 3.2Å; Y573-L622 PolarHBondContact OH-N 2.96Å; P578-L622 HydrophobicContact CB-CD1 4.06Å; P578-L622 HydrophobicContact CG-CB 4.29Å; P578-L622 HydrophobicContact CG-CD1 3.7Å; F580-L622 HydrophobicContact CE2-CD1 4.34Å; F580-L622 HydrophobicContact CZ-CD1 3.83Å; L622-N624 VanDerWaalsContact C-N 3.32Å; L622-Q625 WeakPolarHBondContact O-CB 3.32Å; L622-Q625 PolarHBondContact O-N 2.98Å; L622-L626 HydrophobicContact CG-CD1 4.38Å; L622-L626 PolarHBondContact O-N 2.64Å
623	T	93.8	Very high	89.2	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-68.2	-37.4	-179.3	54.9	0	0	0	0	110.8	Q492 V501 P502 Q620 Q625 L626 Q627	Q492-T623 HydrophobicContact CB-CG2 3.99Å; Q492-T623 HydrophobicContact CG-CG2 3.68Å; V501-T623 WeakPolarHBondContact CG1-O 3.37Å; P502-T623 HydrophobicContact CG-CG2 3.78Å; P502-T623 WeakPolarHBondContact O-CB 3.33Å; P502-T623 PolarHBondContact O-OG1 3.19Å; Q620-T623 PolarHBondContact O-OG1 3.14Å; Q620-T623 VanDerWaalsContact O-OG1 3.11Å; Q620-T623 PolarHBondContact OE1-OG1 2.93Å; T623-Q625 VanDerWaalsContact C-N 3.34Å; T623-Q625 PolarHBondContact O-N 3.3Å; T623-L626 PolarHBondContact O-N 3.2Å; T623-Q627 WeakPolarHBondContact O-CB 3.37Å; T623-Q627 PolarHBondContact O-N 3.45Å
624	N	93.9	Very high	89.6	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-64.5	-36.9	172.1	-73.5	-15.8	0	0	0	112.6	C507 F511 L612 Q620 L621 L622 R628	C507-N624 WeakPolarHBondContact CB-OD1 3.35Å; C507-N624 PolarHBondContact SG-ND2 3.38Å; F511-N624 WeakPolarHBondContact CE1-O 3.36Å; F511-N624 HydrophobicContact CZ-CB 3.94Å; F511-N624 WeakPolarHBondContact CZ-O 3.37Å; L612-N624 HydrophobicContact CB-CB 4.06Å; L612-N624 HydrophobicContact CD2-CB 4.25Å; L612-N624 PolarHBondContact O-ND2 2.78Å; Q620-N624 WeakPolarHBondContact O-CB 3.36Å; Q620-N624 PolarHBondContact O-N 2.79Å; Q620-N624 VanDerWaalsContact O-N 3.15Å; Q620-N624 PolarHBondContact O-ND2 3.3Å; L621-N624 PolarHBondContact O-N 3.48Å; L622-N624 VanDerWaalsContact C-N 3.32Å; N624-R628 WeakPolarHBondContact O-CB 3.44Å; N624-R628 PolarHBondContact O-N 3.29Å
625	Q	95	Very high	90.3	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-67	-45.1	174	-79	177.1	-48.3	0	0	111.9	P578 F580 V605 L612 L621 L622 T623 Q627 R628 L629	P578-Q625 PolarHBondContact O-NE2 3.3Å; F580-Q625 HydrophobicContact CE2-CB 3.9Å; F580-Q625 HydrophobicContact CE2-CG 4.41Å; F580-Q625 HydrophobicContact CZ-CB 3.93Å; V605-Q625 HydrophobicContact CG1-CB 3.89Å; V605-Q625 HydrophobicContact CG1-CG 3.9Å; V605-Q625 PolarHBondContact O-NE2 3.3Å; L612-Q625 HydrophobicContact CD1-CB 4.3Å; L612-Q625 HydrophobicContact CD1-CG 3.6Å; L621-Q625 HydrophobicContact CD1-CG 4.48Å; L621-Q625 WeakPolarHBondContact O-CG 3.2Å; L621-Q625 PolarHBondContact O-N 3.24Å; L622-Q625 WeakPolarHBondContact O-CB 3.32Å; L622-Q625 PolarHBondContact O-N 2.98Å; T623-Q625 VanDerWaalsContact C-N 3.34Å; T623-Q625 PolarHBondContact O-N 3.3Å; Q625-Q627 VanDerWaalsContact C-N 3.33Å; Q625-Q627 PolarHBondContact O-N 3.22Å; Q625-R628 PolarHBondContact O-N 3.31Å; Q625-L629 WeakPolarHBondContact O-CB 3.42Å; Q625-L629 PolarHBondContact O-N 2.77Å
626	L	95.6	Very high	91	Very high	1 Å²	1	21.2 Å²	21.2	1%	0.005	10%	0.096	C	C	.	.	H	α-helix	trans	-61.4	-42.1	174.8	-73.5	170.9	0	0	0	111.7	L496 V501 W522 A554 F580 L622 T623 L629 C630	L496-L626 HydrophobicContact CD1-CD1 3.69Å; L496-L626 HydrophobicContact CD2-CD1 3.75Å; L496-L626 HydrophobicContact CG-CD1 4.41Å; V501-L626 HydrophobicContact CG1-CB 4.29Å; W522-L626 HydrophobicContact CE3-CD1 4.43Å; W522-L626 HydrophobicContact CZ3-CD1 4.11Å; W522-L626 HydrophobicContact CZ3-CD2 4.34Å; A554-L626 HydrophobicContact CB-CD2 4.14Å; F580-L626 HydrophobicContact CE1-CD2 3.8Å; F580-L626 HydrophobicContact CE1-CG 4.37Å; F580-L626 HydrophobicContact CZ-CD2 4.32Å; F580-L626 HydrophobicContact CZ-CG 4.42Å; L622-L626 HydrophobicContact CG-CD1 4.38Å; L622-L626 PolarHBondContact O-N 2.64Å; T623-L626 PolarHBondContact O-N 3.2Å; L626-L629 WeakPolarHBondContact O-CB 3.4Å; L626-L629 PolarHBondContact O-N 3.08Å; L626-C630 PolarHBondContact O-N 3.41Å; L626-C630 PolarHBondContact O-SG 2.94Å; L626-C630 VanDerWaalsContact O-SG 3.35Å
627	Q	95.1	Very high	91.9	Very high	21 Å²	21	10.6 Å²	10.6	10%	0.098	6%	0.056	C	C	.	.	H	α-helix	trans	-65.4	-42.9	176.3	-169.9	65.4	31.8	0	0	111.7	V501 V503 F511 T623 Q625 L629 C630 V631	V501-Q627 HydrophobicContact CG1-CB 4.13Å; V503-Q627 HydrophobicContact CG1-CB 4.04Å; V503-Q627 HydrophobicContact CG1-CG 3.89Å; F511-Q627 HydrophobicContact CB-CG 4.39Å; F511-Q627 HydrophobicContact CD1-CB 4.18Å; F511-Q627 HydrophobicContact CD1-CG 3.68Å; F511-Q627 HydrophobicContact CD2-CB 4.43Å; F511-Q627 HydrophobicContact CD2-CG 3.74Å; F511-Q627 HydrophobicContact CE1-CB 3.8Å; F511-Q627 HydrophobicContact CE1-CG 3.83Å; F511-Q627 HydrophobicContact CE2-CB 4.07Å; F511-Q627 HydrophobicContact CE2-CG 3.88Å; F511-Q627 HydrophobicContact CG-CB 4.49Å; F511-Q627 HydrophobicContact CG-CG 3.64Å; F511-Q627 HydrophobicContact CZ-CB 3.75Å; F511-Q627 HydrophobicContact CZ-CG 3.94Å; T623-Q627 WeakPolarHBondContact O-CB 3.37Å; T623-Q627 PolarHBondContact O-N 3.45Å; Q625-Q627 VanDerWaalsContact C-N 3.33Å; Q625-Q627 PolarHBondContact O-N 3.22Å; Q627-L629 VanDerWaalsContact C-N 3.27Å; Q627-L629 PolarHBondContact O-N 3.31Å; Q627-C630 PolarHBondContact O-N 3.28Å; Q627-V631 WeakPolarHBondContact O-CG2 3.45Å; Q627-V631 PolarHBondContact O-N 2.97Å; Q627-V631 VanDerWaalsContact O-N 3.12Å
628	R	95.2	Very high	92.8	Very high	30 Å²	30	8.2 Å²	8.2	11%	0.113	4%	0.04	C	C	.	.	H	α-helix	trans	-59.3	-43	173.2	-175.7	164.3	-73.7	-173.4	-2.5	109.9	F511 E611 L612 N624 Q625 C630 V631 L632	F511-R628 HydrophobicContact CE1-CB 3.97Å; E611-R628 IonicContact OE2-CZ 3.2Å; E611-R628 IonicContact OE2-NH1 3.95Å; E611-R628 PolarHBondContact OE2-NH1 3.33Å; E611-R628 VanDerWaalsContact OE2-NH1 3.13Å; E611-R628 IonicContact OE2-NH2 2.75Å; L612-R628 HydrophobicContact CD1-CB 4.07Å; L612-R628 HydrophobicContact CD2-CB 4.32Å; L612-R628 VanDerWaalsContact CD2-NE 3.33Å; N624-R628 WeakPolarHBondContact O-CB 3.44Å; N624-R628 PolarHBondContact O-N 3.29Å; Q625-R628 PolarHBondContact O-N 3.31Å; R628-C630 PolarHBondContact O-N 3.43Å; R628-V631 WeakPolarHBondContact O-CB 3.34Å; R628-V631 PolarHBondContact O-N 3.45Å; R628-V631 VanDerWaalsContact O-N 3.12Å; R628-L632 HydrophobicContact CG-CD1 3.96Å; R628-L632 HydrophobicContact CG-CG 4.12Å; R628-L632 VanDerWaalsContact O-CG 3.24Å; R628-L632 WeakPolarHBondContact O-CG 3.36Å; R628-L632 PolarHBondContact O-N 3.35Å
629	L	96.4	Very high	93	Very high	0 Å²	0	7.1 Å²	7.1	0%	0	3%	0.033	C	C	.	.	H	α-helix	trans	-61.4	-42.3	179.2	-166.7	62	0	0	0	112.8	I556 L563 A565 F580 L582 V605 Q625 L626 Q627 V631 L632 L633	I556-L629 HydrophobicContact CD1-CB 4.29Å; I556-L629 HydrophobicContact CD1-CD2 3.76Å; I556-L629 HydrophobicContact CD1-CG 3.98Å; L563-L629 HydrophobicContact CD2-CD1 4.25Å; L563-L629 HydrophobicContact CD2-CD2 4.31Å; L563-L629 HydrophobicContact CD2-CG 4.05Å; A565-L629 HydrophobicContact CB-CD2 3.79Å; F580-L629 HydrophobicContact CD1-CD2 4.07Å; F580-L629 HydrophobicContact CE1-CD2 4.33Å; L582-L629 HydrophobicContact CD1-CD1 4.18Å; L582-L629 HydrophobicContact CD2-CD1 3.66Å; L582-L629 HydrophobicContact CG-CD1 4.24Å; V605-L629 HydrophobicContact CG2-CB 4.48Å; V605-L629 HydrophobicContact CG2-CD1 4.1Å; Q625-L629 WeakPolarHBondContact O-CB 3.42Å; Q625-L629 PolarHBondContact O-N 2.77Å; L626-L629 WeakPolarHBondContact O-CB 3.4Å; L626-L629 PolarHBondContact O-N 3.08Å; Q627-L629 VanDerWaalsContact C-N 3.27Å; Q627-L629 PolarHBondContact O-N 3.31Å; L629-V631 VanDerWaalsContact C-N 3.33Å; L629-V631 PolarHBondContact O-N 3.26Å; L629-L632 PolarHBondContact O-N 2.95Å; L629-L633 PolarHBondContact O-N 2.62Å
630	C	95.1	Very high	92.9	Very high	2 Å²	2	7.6 Å²	7.6	1%	0.014	4%	0.035	C	C	.	.	H	α-helix	trans	-58.3	-44.8	171.7	-67.7	0	0	0	0	111.6	V515 S517 L626 Q627 R628 L632 L633 D634	V515-C630 HydrophobicContact CG2-CB 3.78Å; S517-C630 VanDerWaalsContact OG-C 3.24Å; S517-C630 VanDerWaalsContact OG-CA 3.24Å; S517-C630 WeakPolarHBondContact OG-CA 3.43Å; S517-C630 VanDerWaalsContact OG-CB 3.27Å; S517-C630 WeakPolarHBondContact OG-CB 3.44Å; S517-C630 PolarHBondContact OG-O 2.98Å; L626-C630 PolarHBondContact O-N 3.41Å; L626-C630 PolarHBondContact O-SG 2.94Å; L626-C630 VanDerWaalsContact O-SG 3.35Å; Q627-C630 PolarHBondContact O-N 3.28Å; R628-C630 PolarHBondContact O-N 3.43Å; C630-L632 PolarHBondContact O-N 3.42Å; C630-L633 PolarHBondContact O-N 3.4Å; C630-D634 PolarHBondContact O-N 3.04Å
631	V	94.6	Very high	92.2	Very high	6 Å²	6	9 Å²	9	4%	0.036	5%	0.05	C	C	.	.	H	α-helix	trans	-64.2	-40.7	177.8	174.9	0	0	0	0	111.5	F511 P512 V515 Q627 R628 L629 D634 V635 F680	F511-V631 HydrophobicContact CD1-CG2 4.39Å; P512-V631 HydrophobicContact CG-CG1 3.86Å; P512-V631 HydrophobicContact CG-CG2 3.89Å; V515-V631 HydrophobicContact CG2-CG2 4.47Å; Q627-V631 WeakPolarHBondContact O-CG2 3.45Å; Q627-V631 PolarHBondContact O-N 2.97Å; Q627-V631 VanDerWaalsContact O-N 3.12Å; R628-V631 WeakPolarHBondContact O-CB 3.34Å; R628-V631 PolarHBondContact O-N 3.45Å; R628-V631 VanDerWaalsContact O-N 3.12Å; L629-V631 VanDerWaalsContact C-N 3.33Å; L629-V631 PolarHBondContact O-N 3.26Å; V631-D634 WeakPolarHBondContact O-CB 3.38Å; V631-D634 PolarHBondContact O-N 2.82Å; V631-V635 WeakPolarHBondContact O-CG2 3.27Å; V631-V635 PolarHBondContact O-N 3.12Å; V631-F680 HydrophobicContact CG1-CE1 3.72Å; V631-F680 HydrophobicContact CG1-CZ 3.52Å
632	L	94.4	Very high	91	Very high	2 Å²	2	12.1 Å²	12.1	1%	0.01	7%	0.065	C	C	.	.	H	α-helix	trans	-65.8	-41	177.7	-68.3	174.6	0	0	0	111.7	M601 E604 V605 R628 L629 C630 D634 V635 Y636 F671	M601-L632 HydrophobicContact CB-CD1 4.15Å; M601-L632 HydrophobicContact CG-CB 3.92Å; M601-L632 HydrophobicContact CG-CD1 4.27Å; M601-L632 HydrophobicContact SD-CB 3.76Å; E604-L632 HydrophobicContact CB-CD1 3.88Å; E604-L632 HydrophobicContact CB-CD2 4.5Å; V605-L632 HydrophobicContact CG2-CD1 3.81Å; R628-L632 HydrophobicContact CG-CD1 3.96Å; R628-L632 HydrophobicContact CG-CG 4.12Å; R628-L632 VanDerWaalsContact O-CG 3.24Å; R628-L632 WeakPolarHBondContact O-CG 3.36Å; R628-L632 PolarHBondContact O-N 3.35Å; L629-L632 PolarHBondContact O-N 2.95Å; C630-L632 PolarHBondContact O-N 3.42Å; L632-D634 VanDerWaalsContact C-N 3.31Å; L632-D634 PolarHBondContact O-N 3.35Å; L632-V635 PolarHBondContact O-N 2.88Å; L632-Y636 VanDerWaalsContact O-CB 3.3Å; L632-Y636 WeakPolarHBondContact O-CB 3.49Å; L632-Y636 PolarHBondContact O-N 2.9Å; L632-F671 HydrophobicContact CD2-CB 3.52Å; L632-F671 HydrophobicContact CD2-CD1 3.52Å; L632-F671 HydrophobicContact CD2-CE1 4.44Å; L632-F671 HydrophobicContact CD2-CG 3.72Å
633	L	94.8	Very high	89.4	Confident	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-62.4	-40.4	173.4	-179	62	0	0	0	111.3	I556 L563 L584 L629 C630 Y636 L637	I556-L633 HydrophobicContact CB-CD2 4.29Å; I556-L633 HydrophobicContact CG2-CD2 3.64Å; L563-L633 HydrophobicContact CB-CD1 4.29Å; L563-L633 HydrophobicContact CB-CD2 3.91Å; L563-L633 HydrophobicContact CD2-CB 4.34Å; L563-L633 HydrophobicContact CD2-CD1 4.34Å; L563-L633 HydrophobicContact CD2-CD2 4.2Å; L584-L633 HydrophobicContact CD1-CD1 3.86Å; L629-L633 PolarHBondContact O-N 2.62Å; C630-L633 PolarHBondContact O-N 3.4Å; L633-Y636 PolarHBondContact O-N 2.86Å; L633-L637 HydrophobicContact CD1-CD1 3.94Å; L633-L637 HydrophobicContact CD1-CG 4.04Å; L633-L637 HydrophobicContact CG-CD1 3.99Å; L633-L637 HydrophobicContact CG-CG 4.46Å; L633-L637 WeakPolarHBondContact O-CB 3.45Å; L633-L637 VanDerWaalsContact O-CG 3.31Å; L633-L637 WeakPolarHBondContact O-CG 3.46Å; L633-L637 PolarHBondContact O-N 3.34Å
634	D	92.9	Very high	87.8	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-59.4	-51.1	175.8	-76.8	-15.5	0	0	0	111.1	V516 S517 R558 C630 V631 L632 Y636 L637 E638	V516-D634 PolarHBondContact N-OD2 3.12Å; S517-D634 VanDerWaalsContact CB-OD1 3.3Å; S517-D634 WeakPolarHBondContact CB-OD1 3.35Å; S517-D634 PolarHBondContact N-OD1 3.48Å; S517-D634 PolarHBondContact OG-OD1 3.28Å; S517-D634 VanDerWaalsContact OG-OD1 3.12Å; R558-D634 WeakPolarHBondContact CD-OD1 3.33Å; R558-D634 IonicContact CZ-OD1 2.8Å; R558-D634 IonicContact NE-OD1 3.74Å; R558-D634 VanDerWaalsContact NH1-CB 3.29Å; R558-D634 IonicContact NH1-OD1 3.89Å; R558-D634 PolarHBondContact NH1-OD1 2.84Å; C630-D634 PolarHBondContact O-N 3.04Å; V631-D634 WeakPolarHBondContact O-CB 3.38Å; V631-D634 PolarHBondContact O-N 2.82Å; L632-D634 VanDerWaalsContact C-N 3.31Å; L632-D634 PolarHBondContact O-N 3.35Å; D634-Y636 VanDerWaalsContact C-N 3.34Å; D634-Y636 PolarHBondContact O-N 3Å; D634-L637 PolarHBondContact O-N 3.03Å; D634-E638 WeakPolarHBondContact O-CB 3.5Å; D634-E638 WeakPolarHBondContact O-CG 3.33Å; D634-E638 PolarHBondContact O-N 3.01Å
635	V	92.4	Very high	86	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-61	-44	177.6	173.7	0	0	0	0	111	V631 L632 L637 E638 T639 K656 F671 F680	V631-V635 WeakPolarHBondContact O-CG2 3.27Å; V631-V635 PolarHBondContact O-N 3.12Å; L632-V635 PolarHBondContact O-N 2.88Å; V635-L637 PolarHBondContact O-N 3.18Å; V635-E638 PolarHBondContact O-N 2.62Å; V635-T639 HydrophobicContact CG1-CG2 4.06Å; V635-T639 WeakPolarHBondContact O-CB 3.41Å; V635-T639 WeakPolarHBondContact O-CG2 3.49Å; V635-T639 PolarHBondContact O-N 3.26Å; V635-T639 PolarHBondContact O-OG1 3.31Å; V635-K656 HydrophobicContact CG2-CG 4.32Å; V635-F671 HydrophobicContact CB-CD1 4.4Å; V635-F671 HydrophobicContact CB-CE1 4.5Å; V635-F671 HydrophobicContact CG1-CD1 4.03Å; V635-F671 HydrophobicContact CG1-CE1 4.16Å; V635-F680 HydrophobicContact CG2-CD1 3.72Å; V635-F680 HydrophobicContact CG2-CD2 4.24Å; V635-F680 HydrophobicContact CG2-CE1 3.52Å; V635-F680 HydrophobicContact CG2-CE2 4.07Å; V635-F680 HydrophobicContact CG2-CG 4.08Å; V635-F680 HydrophobicContact CG2-CZ 3.7Å
636	Y	92.5	Very high	84.4	Confident	2 Å²	2	33.1 Å²	33.1	1%	0.008	19%	0.187	C	C	.	.	H	α-helix	trans	-57.1	-49	-179.7	179.5	-82.5	0	0	0	111.3	L584 W586 K590 D595 N597 I598 M601 L632 L633 D634 E640 K669 F671	L584-Y636 HydrophobicContact CD2-CD1 3.84Å; L584-Y636 HydrophobicContact CD2-CE1 3.39Å; W586-Y636 HydrophobicContact CE3-CE1 4.21Å; W586-Y636 HydrophobicContact CZ3-CE1 4.06Å; K590-Y636 WeakPolarHBondContact CD-OH 3.24Å; K590-Y636 PolarHBondContact NZ-OH 3.29Å; D595-Y636 WeakPolarHBondContact OD2-CE2 3.34Å; D595-Y636 PolarHBondContact OD2-OH 3.05Å; N597-Y636 HydrophobicContact CB-CD2 3.97Å; N597-Y636 HydrophobicContact CB-CE2 3.68Å; I598-Y636 HydrophobicContact CD1-CE2 4.3Å; M601-Y636 HydrophobicContact CE-CD2 4Å; M601-Y636 HydrophobicContact CE-CG 4.35Å; M601-Y636 HydrophobicContact SD-CD2 4.44Å; L632-Y636 VanDerWaalsContact O-CB 3.3Å; L632-Y636 WeakPolarHBondContact O-CB 3.49Å; L632-Y636 PolarHBondContact O-N 2.9Å; L633-Y636 PolarHBondContact O-N 2.86Å; D634-Y636 VanDerWaalsContact C-N 3.34Å; D634-Y636 PolarHBondContact O-N 3Å; Y636-E640 WeakPolarHBondContact CE1-OE2 2.92Å; Y636-E640 PolarHBondContact O-N 3.36Å; Y636-K669 HydrophobicContact CD2-CD 4.08Å; Y636-K669 PolarHBondContact O-NZ 3.03Å; Y636-F671 HydrophobicContact CD2-CZ 4.38Å
637	L	90.3	Very high	82.1	Confident	1 Å²	1	42.8 Å²	42.8	1%	0.005	23%	0.232	C	C	.	.	H	α-helix	trans	-73.1	-36.8	-177.3	-67.9	174.9	0	0	0	112.5	R558 A561 W586 L633 D634 V635 F652	R558-L637 HydrophobicContact CB-CD1 4.11Å; A561-L637 HydrophobicContact CB-CD1 3.71Å; A561-L637 HydrophobicContact CB-CD2 3.81Å; A561-L637 HydrophobicContact CB-CG 4.42Å; W586-L637 HydrophobicContact CD2-CD2 3.7Å; W586-L637 HydrophobicContact CE3-CD2 3.35Å; W586-L637 HydrophobicContact CG-CD2 4.43Å; W586-L637 HydrophobicContact CH2-CD2 3.82Å; W586-L637 HydrophobicContact CZ2-CD2 4.16Å; W586-L637 HydrophobicContact CZ3-CD2 3.39Å; L633-L637 HydrophobicContact CD1-CD1 3.94Å; L633-L637 HydrophobicContact CD1-CG 4.04Å; L633-L637 HydrophobicContact CG-CD1 3.99Å; L633-L637 HydrophobicContact CG-CG 4.46Å; L633-L637 WeakPolarHBondContact O-CB 3.45Å; L633-L637 VanDerWaalsContact O-CG 3.31Å; L633-L637 WeakPolarHBondContact O-CG 3.46Å; L633-L637 PolarHBondContact O-N 3.34Å; D634-L637 PolarHBondContact O-N 3.03Å; V635-L637 PolarHBondContact O-N 3.18Å; L637-F652 HydrophobicContact CB-CB 4.33Å; L637-F652 HydrophobicContact CB-CD2 3.95Å; L637-F652 HydrophobicContact CB-CE2 4.44Å; L637-F652 HydrophobicContact CB-CG 3.99Å; L637-F652 HydrophobicContact CD1-CD1 4.44Å; L637-F652 HydrophobicContact CD1-CE1 4.2Å; L637-F652 HydrophobicContact CD1-CE2 4.33Å; L637-F652 HydrophobicContact CD1-CZ 4.14Å; L637-F652 HydrophobicContact CD2-CD2 4.22Å; L637-F652 HydrophobicContact CD2-CE2 3.98Å; L637-F652 HydrophobicContact CD2-CZ 4.5Å; L637-F652 HydrophobicContact CG-CD2 4.47Å; L637-F652 HydrophobicContact CG-CE2 4.48Å
638	E	89.4	Confident	80.2	Confident	4 Å²	4	44.1 Å²	44.1	2%	0.019	25%	0.252	C	S	.	.	H	α-helix	trans	-72.9	-36.9	-179.6	-71.4	177.9	-143.9	0	0	113.1	R558 D634 V635 K650 P653 E655 K656	R558-E638 IonicContact CZ-OE1 3.65Å; R558-E638 IonicContact NH1-OE1 3.93Å; R558-E638 PolarHBondContact NH1-OE1 2.9Å; D634-E638 WeakPolarHBondContact O-CB 3.5Å; D634-E638 WeakPolarHBondContact O-CG 3.33Å; D634-E638 PolarHBondContact O-N 3.01Å; V635-E638 PolarHBondContact O-N 2.62Å; E638-K650 PolarHBondContact O-NZ 2.61Å; E638-P653 WeakPolarHBondContact CG-O 3.39Å; E638-E655 PolarHBondContact OE2-N 2.99Å; E638-K656 WeakPolarHBondContact OE2-CG 3.39Å; E638-K656 PolarHBondContact OE2-N 2.86Å
639	T	86.4	Confident	78.6	Confident	1 Å²	1	48.9 Å²	48.9	1%	0.006	29%	0.287	C	S	.	.	S	Bend	trans	-89	-0.3	-177.9	62.7	0	0	0	0	113.5	V635 S641 L661 K669	V635-T639 HydrophobicContact CG1-CG2 4.06Å; V635-T639 WeakPolarHBondContact O-CB 3.41Å; V635-T639 WeakPolarHBondContact O-CG2 3.49Å; V635-T639 PolarHBondContact O-N 3.26Å; V635-T639 PolarHBondContact O-OG1 3.31Å; T639-S641 PolarHBondContact O-N 2.94Å; T639-L661 WeakPolarHBondContact O-CD2 3.48Å; T639-K669 WeakPolarHBondContact OG1-CD 3.46Å
640	E	84.7	Confident	77.2	Confident	33 Å²	33	52.2 Å²	52.2	15%	0.154	30%	0.301	C	S	.	.	S	Bend	trans	-62.7	129.8	168.9	-166.3	129.6	153.6	0	0	109.6	W586 K590 Y636 H642 K650 K669	W586-E640 HydrophobicContact CH2-CB 4.12Å; W586-E640 HydrophobicContact CH2-CG 4.02Å; W586-E640 HydrophobicContact CZ3-CB 4.38Å; W586-E640 HydrophobicContact CZ3-CG 4.18Å; W586-E640 WeakPolarHBondContact CZ3-OE1 3.44Å; W586-E640 VanDerWaalsContact CZ3-OE2 3.27Å; W586-E640 WeakPolarHBondContact CZ3-OE2 3.36Å; K590-E640 IonicContact NZ-OE1 2.95Å; K590-E640 PolarHBondContact NZ-OE1 3.39Å; K590-E640 IonicContact NZ-OE2 3.83Å; K590-E640 PolarHBondContact NZ-OE2 3.03Å; Y636-E640 WeakPolarHBondContact CE1-OE2 2.92Å; Y636-E640 PolarHBondContact O-N 3.36Å; E640-H642 PolarHBondContact O-N 3.2Å; E640-K650 WeakPolarHBondContact O-CE 3.44Å; E640-K650 PolarHBondContact O-NZ 3.2Å; E640-K669 IonicContact OE2-NZ 3.18Å; E640-K669 PolarHBondContact OE2-NZ 3.4Å
641	S	75.3	Confident	76.2	Confident	79 Å²	79	56.2 Å²	56.2	55%	0.552	32%	0.32	S	S	*	.	P	Polyproline II helix	trans	-64.4	133.3	174.4	48.2	0	0	0	0	109.4	T639	T639-S641 PolarHBondContact O-N 2.94Å
642	H	67.7	Low	75.6	Confident	72 Å²	72	56.5 Å²	56.5	33%	0.333	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-68.2	144.1	172.7	-160.1	-71.8	0	0	0	109.2	E640 D644 V646	E640-H642 PolarHBondContact O-N 3.2Å; H642-D644 PolarHBondContact O-N 3.41Å; H642-V646 PolarHBondContact CE1-O 3.24Å
643	D	63.2	Low	74.8	Confident	97 Å²	97	60.1 Å²	60.1	52%	0.519	34%	0.344	S	S	.	.			trans	-82.7	106.7	165.8	-171.9	-16.8	0	0	0	107.2	S645 V646	D643-S645 PolarHBondContact O-N 3.15Å; D643-S645 WeakPolarHBondContact OD1-CB 3.47Å; D643-S645 PolarHBondContact OD1-N 3.44Å; D643-S645 PolarHBondContact OD1-OG 2.92Å; D643-S645 PolarHBondContact OD2-OG 2.93Å; D643-V646 PolarHBondContact O-N 3.28Å
644	D	58.6	Low	74	Confident	159 Å²	159	64.7 Å²	64.7	85%	0.85	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-4.4	-175.4	-65.3	-31.7	0	0	0	113.1	H642	H642-D644 PolarHBondContact O-N 3.41Å
645	S	57.3	Low	73.3	Confident	92 Å²	92	69.9 Å²	69.9	64%	0.643	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-10.4	176.7	68.5	0	0	0	0	115.4	D643	D643-S645 PolarHBondContact O-N 3.15Å; D643-S645 WeakPolarHBondContact OD1-CB 3.47Å; D643-S645 PolarHBondContact OD1-N 3.44Å; D643-S645 PolarHBondContact OD1-OG 2.92Å; D643-S645 PolarHBondContact OD2-OG 2.93Å
646	V	60	Low	72.8	Confident	94 Å²	94	70.7 Å²	70.7	57%	0.57	39%	0.393	S	S	*	.	S	Bend	trans	-106	110.6	-179.5	-172.3	0	0	0	0	110	H642 D643 G648	H642-V646 PolarHBondContact CE1-O 3.24Å; D643-V646 PolarHBondContact O-N 3.28Å; V646-G648 PolarHBondContact O-N 3.49Å
647	E	48.2	Very low	72.3	Confident	203 Å²	203	76.5 Å²	76.5	95%	0.949	42%	0.422	S	S	*	.			trans	-71.7	112.6	175.3	-76.6	-176.2	161	0	0	111
648	G	55.7	Low	71.9	Confident	49 Å²	49	77.5 Å²	77.5	51%	0.505	43%	0.429	S	S	.	.	S	Bend	trans	169.8	161	174.9	0	0	0	0	0	112.3	V646	V646-G648 PolarHBondContact O-N 3.49Å
649	P	60.6	Low	71.3	Confident	130 Å²	130	83.2 Å²	83.2	84%	0.844	46%	0.459	S	S	*	.			trans	-62.8	138.4	172.3	26	-31.8	0	0	0	110.2	E651	P649-E651 PolarHBondContact O-N 2.89Å; P649-E651 VanDerWaalsContact O-N 3.15Å
650	K	67.6	Low	71.1	Confident	71 Å²	71	90.6 Å²	90.6	31%	0.309	49%	0.486	S	S	.	.			trans	-52.8	121.8	176.6	-169.8	172.7	-168.5	-172.5	0	109.2	E638 E640 F652	E638-K650 PolarHBondContact O-NZ 2.61Å; E640-K650 WeakPolarHBondContact O-CE 3.44Å; E640-K650 PolarHBondContact O-NZ 3.2Å; K650-F652 WeakPolarHBondContact CD-O 3.4Å; K650-F652 WeakPolarHBondContact CG-O 3.37Å; K650-F652 PolarHBondContact O-N 3.4Å
651	E	74.3	Confident	71	Confident	86 Å²	86	92.3 Å²	92.3	40%	0.402	50%	0.496	S	S	.	.	S	Bend	trans	-52.3	-32.3	-178.2	-170	-174.6	177.4	0	0	112.1	T560 W586 P649	T560-E651 VanDerWaalsContact CB-OE1 3.31Å; T560-E651 WeakPolarHBondContact CB-OE1 3.27Å; T560-E651 VanDerWaalsContact CG2-OE1 3.28Å; T560-E651 WeakPolarHBondContact CG2-OE1 3.33Å; T560-E651 PolarHBondContact N-OE1 3.3Å; T560-E651 PolarHBondContact OG1-OE1 3.13Å; W586-E651 PolarHBondContact NE1-OE2 3.18Å; W586-E651 VanDerWaalsContact NE1-OE2 3.14Å; P649-E651 PolarHBondContact O-N 2.89Å; P649-E651 VanDerWaalsContact O-N 3.15Å
652	F	81.7	Confident	71.6	Confident	12 Å²	12	91 Å²	91	5%	0.053	48%	0.481	C	S	.	.	S	Bend	trans	-127.9	102.3	178.3	-57.4	-65.1	0	0	0	111.1	R558 A561 W586 L637 K650	R558-F652 HydrophobicContact CG-CE1 4.31Å; R558-F652 WeakPolarHBondContact O-CE1 3.42Å; R558-F652 WeakPolarHBondContact O-CZ 3.18Å; A561-F652 HydrophobicContact CB-CZ 4.09Å; W586-F652 AromaticContact CE2-CE2 3.63Å; W586-F652 HydrophobicContact CH2-CD2 4.27Å; W586-F652 HydrophobicContact CH2-CE2 4.32Å; W586-F652 AromaticContact CZ2-CD2 3.78Å; W586-F652 HydrophobicContact CZ2-CD2 3.78Å; W586-F652 AromaticContact CZ2-CE2 3.52Å; W586-F652 HydrophobicContact CZ2-CE2 3.52Å; W586-F652 AromaticContact NE1-CE2 3.65Å; L637-F652 HydrophobicContact CB-CB 4.33Å; L637-F652 HydrophobicContact CB-CD2 3.95Å; L637-F652 HydrophobicContact CB-CE2 4.44Å; L637-F652 HydrophobicContact CB-CG 3.99Å; L637-F652 HydrophobicContact CD1-CD1 4.44Å; L637-F652 HydrophobicContact CD1-CE1 4.2Å; L637-F652 HydrophobicContact CD1-CE2 4.33Å; L637-F652 HydrophobicContact CD1-CZ 4.14Å; L637-F652 HydrophobicContact CD2-CD2 4.22Å; L637-F652 HydrophobicContact CD2-CE2 3.98Å; L637-F652 HydrophobicContact CD2-CZ 4.5Å; L637-F652 HydrophobicContact CG-CD2 4.47Å; L637-F652 HydrophobicContact CG-CE2 4.48Å; K650-F652 WeakPolarHBondContact CD-O 3.4Å; K650-F652 WeakPolarHBondContact CG-O 3.37Å; K650-F652 PolarHBondContact O-N 3.4Å
653	P	76.8	Confident	72.6	Confident	78 Å²	78	94.2 Å²	94.2	51%	0.506	49%	0.49	S	S	.	.			trans	-69.2	142.6	179	28.4	-33.6	0	0	0	111.1	E638 E655	E638-P653 WeakPolarHBondContact CG-O 3.39Å; P653-E655 PolarHBondContact O-N 3.01Å
654	Q	78.1	Confident	73.8	Confident	96 Å²	96	91.9 Å²	91.9	45%	0.449	49%	0.489	S	S	.	.			trans	-78	103.2	179.1	-172.2	176.9	2.9	0	0	110.3
655	E	79	Confident	75.2	Confident	109 Å²	109	91.1 Å²	91.1	51%	0.509	49%	0.493	S	S	.	.			trans	-101.4	-28.2	176.8	-64.9	-169.7	175.5	0	0	111.8	E638 P653	E638-E655 PolarHBondContact OE2-N 2.99Å; P653-E655 PolarHBondContact O-N 3.01Å
656	K	81.3	Confident	76.6	Confident	17 Å²	17	89.6 Å²	89.6	7%	0.074	48%	0.482	C	S	.	.	S	Bend	trans	-78.5	128.9	179.4	-56.5	-42.4	-179	-156.3	0	112.2	K514 V635 E638 C658 F680	K514-K656 PolarHBondContact O-NZ 2.86Å; V635-K656 HydrophobicContact CG2-CG 4.32Å; E638-K656 WeakPolarHBondContact OE2-CG 3.39Å; E638-K656 PolarHBondContact OE2-N 2.86Å; K656-C658 PolarHBondContact O-N 2.91Å; K656-F680 HydrophobicContact CB-CD2 3.83Å; K656-F680 HydrophobicContact CB-CE2 3.81Å; K656-F680 HydrophobicContact CD-CE2 4.04Å; K656-F680 HydrophobicContact CG-CD2 4.33Å; K656-F680 HydrophobicContact CG-CE2 3.81Å
657	M	81.3	Confident	77.9	Confident	123 Å²	123	92.4 Å²	92.4	61%	0.606	48%	0.482	S	S	*	.			trans	-70.9	115.4	175.1	-170.3	179.8	-177.8	0	0	110.8	F679 F680	M657-F679 HydrophobicContact CB-CB 4.22Å; M657-F679 HydrophobicContact CG-CB 4.17Å; M657-F679 WeakPolarHBondContact O-CA 3.36Å; M657-F679 HydrophobicContact SD-CB 4.26Å; M657-F680 PolarHBondContact O-N 2.85Å
658	C	82.9	Confident	80	Confident	23 Å²	23	84.7 Å²	84.7	16%	0.155	45%	0.447	C	S	.	.	B	Isolated β-bridge	trans	-122.7	128.2	178.8	-59.8	0	0	0	0	109.6	K656 R660 P670	K656-C658 PolarHBondContact O-N 2.91Å; C658-R660 VanDerWaalsContact C-N 3.35Å; C658-R660 PolarHBondContact O-N 2.85Å; C658-P670 HydrophobicContact CB-CG 3.98Å
659	L	76.1	Confident	81.7	Confident	123 Å²	123	82.7 Å²	82.7	64%	0.644	43%	0.425	S	S	*	.	S	Bend	trans	-68.1	-33.8	-178.4	-67.5	178.8	0	0	0	113.3	F679	L659-F679 HydrophobicContact CD1-CD2 3.79Å; L659-F679 HydrophobicContact CD1-CE2 3.29Å; L659-F679 HydrophobicContact CD1-CZ 4.05Å; L659-F679 HydrophobicContact CD2-CD2 4.31Å; L659-F679 HydrophobicContact CG-CD2 3.65Å; L659-F679 HydrophobicContact CG-CE2 3.73Å
660	R	82.6	Confident	83.2	Confident	156 Å²	156	76.5 Å²	76.5	59%	0.589	38%	0.384	S	S	*	.			trans	-152	141.4	179.6	-178.5	173.3	174.7	161.9	3.5	107.9	C658 F662 H682	C658-R660 VanDerWaalsContact C-N 3.35Å; C658-R660 PolarHBondContact O-N 2.85Å; R660-F662 WeakPolarHBondContact CD-O 3.4Å; R660-F662 WeakPolarHBondContact CG-O 3.48Å; R660-F662 PolarHBondContact NE-O 3.27Å; R660-H682 PolarHBondContact O-CE1 3.35Å
661	L	82.8	Confident	84.4	Confident	69 Å²	69	73.6 Å²	73.6	36%	0.361	37%	0.372	S	S	.	.	S	Bend	trans	-78.7	-36.8	-177.6	-80	114	0	0	0	113.9	T639 P670	T639-L661 WeakPolarHBondContact O-CD2 3.48Å; L661-P670 WeakPolarHBondContact O-CD 2.9Å
662	F	87.9	Confident	85.3	Confident	52 Å²	52	72.8 Å²	72.8	23%	0.228	37%	0.367	C	S	.	.			trans	-138.4	139.7	-176.7	-57.9	-68.2	0	0	0	112.1	R660 R667 M668 K669	R660-F662 WeakPolarHBondContact CD-O 3.4Å; R660-F662 WeakPolarHBondContact CG-O 3.48Å; R660-F662 PolarHBondContact NE-O 3.27Å; F662-R667 HydrophobicContact CB-CB 4.34Å; F662-R667 HydrophobicContact CD1-CB 4.18Å; F662-R667 VanDerWaalsContact CD1-O 3.24Å; F662-R667 WeakPolarHBondContact CD1-O 3.06Å; F662-R667 HydrophobicContact CG-CB 4.44Å; F662-M668 WeakPolarHBondContact CA-O 3.49Å; F662-K669 HydrophobicContact CD1-CG 4.42Å; F662-K669 HydrophobicContact CE1-CG 4.05Å
663	R	88.3	Confident	85.8	Confident	139 Å²	139	74.6 Å²	74.6	53%	0.525	37%	0.374	S	S	.	.	B	Isolated β-bridge	trans	-139.1	148.6	173.1	-179.8	-178.5	-87.8	-178	-5.9	111.3	M668 H682	R663-M668 PolarHBondContact N-O 2.9Å; R663-M668 VanDerWaalsContact N-O 3.17Å; R663-M668 PolarHBondContact O-N 3.29Å; R663-H682 PolarHBondContact N-NE2 3.09Å
664	G	89.3	Confident	86.4	Confident	49 Å²	49	72.8 Å²	72.8	51%	0.505	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.8	174.8	171.8	0	0	0	0	0	114.8	S666 R667	G664-S666 VanDerWaalsContact C-N 3.34Å; G664-S666 PolarHBondContact O-N 3.2Å; G664-R667 PolarHBondContact O-N 3.39Å; G664-R667 VanDerWaalsContact O-N 3.15Å
665	P	86.5	Confident	86.8	Confident	142 Å²	142	72.8 Å²	72.8	92%	0.922	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-35.7	-176.4	-23.9	35	0	0	0	113.9	R667	P665-R667 VanDerWaalsContact C-N 3.25Å; P665-R667 PolarHBondContact O-N 3.42Å
666	S	87.9	Confident	87.1	Confident	60 Å²	60	73.6 Å²	73.6	42%	0.42	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	7.3	177.9	60.6	0	0	0	0	114.4	D596 G664 M668	D596-S666 WeakPolarHBondContact OD2-CB 3.45Å; D596-S666 PolarHBondContact OD2-OG 3.35Å; G664-S666 VanDerWaalsContact C-N 3.34Å; G664-S666 PolarHBondContact O-N 3.2Å; S666-M668 PolarHBondContact O-N 3.22Å
667	R	87.9	Confident	87.4	Confident	153 Å²	153	80 Å²	80	58%	0.577	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.7	54.4	-179.4	-57.3	178.9	63.1	-173.3	-1.7	111.6	F662 G664 P665	F662-R667 HydrophobicContact CB-CB 4.34Å; F662-R667 HydrophobicContact CD1-CB 4.18Å; F662-R667 VanDerWaalsContact CD1-O 3.24Å; F662-R667 WeakPolarHBondContact CD1-O 3.06Å; F662-R667 HydrophobicContact CG-CB 4.44Å; G664-R667 PolarHBondContact O-N 3.39Å; G664-R667 VanDerWaalsContact O-N 3.15Å; P665-R667 VanDerWaalsContact C-N 3.25Å; P665-R667 PolarHBondContact O-N 3.42Å
668	M	90.7	Very high	87.7	Confident	42 Å²	42	75.8 Å²	75.8	21%	0.207	39%	0.393	C	S	.	.	B	Isolated β-bridge	trans	-67.3	140	-176.5	-166.2	55.9	64.5	0	0	111.8	A600 F662 R663 S666 F671 H682	A600-M668 HydrophobicContact CB-CE 3.73Å; A600-M668 HydrophobicContact CB-SD 3.21Å; A600-M668 WeakPolarHBondContact CB-SD 3.35Å; F662-M668 WeakPolarHBondContact CA-O 3.49Å; R663-M668 PolarHBondContact N-O 2.9Å; R663-M668 VanDerWaalsContact N-O 3.17Å; R663-M668 PolarHBondContact O-N 3.29Å; S666-M668 PolarHBondContact O-N 3.22Å; M668-F671 HydrophobicContact SD-CE2 4.3Å; M668-H682 PolarHBondContact O-CD2 3.14Å; M668-H682 PolarHBondContact O-NE2 3.17Å
669	K	92	Very high	88	Confident	7 Å²	7	75.9 Å²	75.9	3%	0.03	39%	0.39	C	S	.	.			trans	-79.3	158.3	173	-71.6	174.7	178	-178.8	0	112.1	N597 Y636 T639 E640 F662 F671	N597-K669 HydrophobicContact CB-CD 4.49Å; N597-K669 WeakPolarHBondContact OD1-CG 3.3Å; N597-K669 PolarHBondContact OD1-N 2.81Å; Y636-K669 HydrophobicContact CD2-CD 4.08Å; Y636-K669 PolarHBondContact O-NZ 3.03Å; T639-K669 WeakPolarHBondContact OG1-CD 3.46Å; E640-K669 IonicContact OE2-NZ 3.18Å; E640-K669 PolarHBondContact OE2-NZ 3.4Å; F662-K669 HydrophobicContact CD1-CG 4.42Å; F662-K669 HydrophobicContact CE1-CG 4.05Å; K669-F671 HydrophobicContact CB-CE1 4.05Å; K669-F671 HydrophobicContact CB-CE2 4.03Å; K669-F671 HydrophobicContact CB-CZ 3.73Å; K669-F671 HydrophobicContact CD-CZ 4.26Å; K669-F671 PolarHBondContact O-N 3.11Å
670	P	92.1	Very high	88.8	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	36%	0.361	C	S	.	.			trans	-83.6	90.8	-177.2	32.6	-35.6	0	0	0	112.5	C658 L661 F680 S681	C658-P670 HydrophobicContact CB-CG 3.98Å; L661-P670 WeakPolarHBondContact O-CD 2.9Å; P670-F680 HydrophobicContact CB-CB 4.3Å; P670-F680 WeakPolarHBondContact O-CB 3.35Å; P670-S681 CarbonylContact C-O 3.24Å; P670-S681 VanDerWaalsContact C-O 3.24Å; P670-S681 WeakPolarHBondContact CA-O 3.47Å
671	F	92.8	Very high	89.2	Confident	10 Å²	10	63.8 Å²	63.8	4%	0.044	34%	0.34	C	S	.	.			trans	-91.6	-10.8	-175	-69.3	-46.7	0	0	0	116.3	N597 A600 M601 E604 L632 V635 Y636 M668 K669 S681	N597-F671 HydrophobicContact CB-CE2 4.34Å; N597-F671 HydrophobicContact CB-CZ 4.25Å; A600-F671 HydrophobicContact CB-CD2 4.01Å; A600-F671 HydrophobicContact CB-CE2 3.83Å; M601-F671 HydrophobicContact CG-CD1 4.43Å; M601-F671 HydrophobicContact CG-CD2 4.48Å; M601-F671 HydrophobicContact CG-CE1 3.92Å; M601-F671 HydrophobicContact CG-CE2 3.98Å; M601-F671 HydrophobicContact CG-CZ 3.67Å; M601-F671 HydrophobicContact SD-CE1 4.33Å; M601-F671 HydrophobicContact SD-CZ 4.34Å; E604-F671 HydrophobicContact CG-CB 3.94Å; L632-F671 HydrophobicContact CD2-CB 3.52Å; L632-F671 HydrophobicContact CD2-CD1 3.52Å; L632-F671 HydrophobicContact CD2-CE1 4.44Å; L632-F671 HydrophobicContact CD2-CG 3.72Å; V635-F671 HydrophobicContact CB-CD1 4.4Å; V635-F671 HydrophobicContact CB-CE1 4.5Å; V635-F671 HydrophobicContact CG1-CD1 4.03Å; V635-F671 HydrophobicContact CG1-CE1 4.16Å; Y636-F671 HydrophobicContact CD2-CZ 4.38Å; M668-F671 HydrophobicContact SD-CE2 4.3Å; K669-F671 HydrophobicContact CB-CE1 4.05Å; K669-F671 HydrophobicContact CB-CE2 4.03Å; K669-F671 HydrophobicContact CB-CZ 3.73Å; K669-F671 HydrophobicContact CD-CZ 4.26Å; K669-F671 PolarHBondContact O-N 3.11Å; F671-S681 PolarHBondContact N-O 2.75Å
672	K	92.6	Very high	89.5	Confident	68 Å²	68	61.4 Å²	61.4	30%	0.296	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	118.1	-176.9	-178.2	179.8	177	178.6	0	112	F680 S681	K672-F680 CarbonylContact O-C 3.6Å; K672-F680 WeakPolarHBondContact O-CA 3.49Å; K672-S681 WeakPolarHBondContact CB-O 3.49Å; K672-S681 PolarHBondContact N-O 3.1Å; K672-S681 PolarHBondContact O-N 3.27Å; K672-S681 PolarHBondContact O-OG 2.81Å
673	Y	92.7	Very high	89.4	Confident	51 Å²	51	66.1 Å²	66.1	20%	0.2	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	133.1	176.9	-178.7	-115.5	0	0	0	112.7	F511 P512 H675 F680	F511-Y673 VanDerWaalsContact C-CE1 3.46Å; F511-Y673 WeakPolarHBondContact O-CE1 3.48Å; P512-Y673 HydrophobicContact CB-CE2 3.94Å; Y673-H675 HydrophobicContact CE1-CB 4.15Å; Y673-F680 HydrophobicContact CD2-CD2 4.39Å; Y673-F680 HydrophobicContact CD2-CE1 4.11Å; Y673-F680 AromaticContact CD2-CE2 3.92Å; Y673-F680 HydrophobicContact CD2-CE2 3.92Å; Y673-F680 AromaticContact CD2-CZ 3.77Å; Y673-F680 HydrophobicContact CD2-CZ 3.77Å; Y673-F680 HydrophobicContact CE2-CE2 4.46Å; Y673-F680 HydrophobicContact CG-CE1 4.42Å; Y673-F680 HydrophobicContact CG-CZ 4.39Å
674	N	90.5	Very high	89.4	Confident	40 Å²	40	62.5 Å²	62.5	21%	0.214	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	102.9	177.4	-65.1	-29.6	0	0	0	110.8	G678 F679 S681	N674-G678 WeakPolarHBondContact O-CA 3.4Å; N674-G678 PolarHBondContact O-N 3.02Å; N674-F679 HydrophobicContact CB-CD1 4.25Å; N674-F679 HydrophobicContact CB-CE1 3.89Å; N674-F679 HydrophobicContact CB-CZ 4.11Å; N674-F679 PolarHBondContact N-O 2.75Å; N674-F679 VanDerWaalsContact ND2-CE2 3.26Å; N674-F679 WeakPolarHBondContact ND2-CE2 3.42Å; N674-F679 WeakPolarHBondContact ND2-CZ 3.43Å; N674-S681 PolarHBondContact ND2-OG 2.95Å
675	H	85.5	Confident	89.4	Confident	96 Å²	96	63.2 Å²	63.2	44%	0.444	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-44.4	-172.3	-178.2	70.8	0	0	0	116	Y509 Y673 Q677	Y509-H675 WeakPolarHBondContact CA-CE1 3.37Å; Y509-H675 WeakPolarHBondContact CA-ND1 3.34Å; Y509-H675 VanDerWaalsContact CB-CE1 3.48Å; Y509-H675 WeakPolarHBondContact CB-CE1 3.4Å; Y509-H675 WeakPolarHBondContact CB-NE2 3.28Å; Y509-H675 VanDerWaalsContact O-CB 3.27Å; Y509-H675 WeakPolarHBondContact O-CB 3.27Å; Y509-H675 PolarHBondContact O-ND1 2.96Å; Y673-H675 HydrophobicContact CE1-CB 4.15Å; H675-Q677 PolarHBondContact O-N 3.22Å; H675-Q677 VanDerWaalsContact O-N 3.14Å
676	P	85.9	Confident	89.6	Confident	125 Å²	125	58.8 Å²	58.8	81%	0.812	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-22.7	-172.9	-23.1	34.7	0	0	0	114.5
677	Q	86.6	Confident	89.7	Confident	151 Å²	151	58.8 Å²	58.8	71%	0.706	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.4	-9.3	-176.3	-66.7	180	2.2	0	0	112.9	H675 F679	H675-Q677 PolarHBondContact O-N 3.22Å; H675-Q677 VanDerWaalsContact O-N 3.14Å; Q677-F679 HydrophobicContact CB-CD1 3.56Å; Q677-F679 HydrophobicContact CB-CE1 3.63Å; Q677-F679 HydrophobicContact CG-CE1 4.4Å
678	G	88.1	Confident	89.8	Confident	36 Å²	36	52.9 Å²	52.9	37%	0.371	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	71	35.5	171.4	0	0	0	0	0	115.8	N674	N674-G678 WeakPolarHBondContact O-CA 3.4Å; N674-G678 PolarHBondContact O-N 3.02Å
679	F	90.3	Very high	89.7	Confident	24 Å²	24	53.6 Å²	53.6	11%	0.105	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	163.3	-179.4	75	-84.4	0	0	0	113.1	M657 L659 N674 Q677	M657-F679 HydrophobicContact CB-CB 4.22Å; M657-F679 HydrophobicContact CG-CB 4.17Å; M657-F679 WeakPolarHBondContact O-CA 3.36Å; M657-F679 HydrophobicContact SD-CB 4.26Å; L659-F679 HydrophobicContact CD1-CD2 3.79Å; L659-F679 HydrophobicContact CD1-CE2 3.29Å; L659-F679 HydrophobicContact CD1-CZ 4.05Å; L659-F679 HydrophobicContact CD2-CD2 4.31Å; L659-F679 HydrophobicContact CG-CD2 3.65Å; L659-F679 HydrophobicContact CG-CE2 3.73Å; N674-F679 HydrophobicContact CB-CD1 4.25Å; N674-F679 HydrophobicContact CB-CE1 3.89Å; N674-F679 HydrophobicContact CB-CZ 4.11Å; N674-F679 PolarHBondContact N-O 2.75Å; N674-F679 VanDerWaalsContact ND2-CE2 3.26Å; N674-F679 WeakPolarHBondContact ND2-CE2 3.42Å; N674-F679 WeakPolarHBondContact ND2-CZ 3.43Å; Q677-F679 HydrophobicContact CB-CD1 3.56Å; Q677-F679 HydrophobicContact CB-CE1 3.63Å; Q677-F679 HydrophobicContact CG-CE1 4.4Å
680	F	91.1	Very high	89.6	Confident	4 Å²	4	56.9 Å²	56.9	2%	0.018	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	134.8	177.3	-72.2	-91.2	0	0	0	112.4	P512 V631 V635 K656 M657 P670 K672 Y673	P512-F680 HydrophobicContact CG-CZ 4.18Å; V631-F680 HydrophobicContact CG1-CE1 3.72Å; V631-F680 HydrophobicContact CG1-CZ 3.52Å; V635-F680 HydrophobicContact CG2-CD1 3.72Å; V635-F680 HydrophobicContact CG2-CD2 4.24Å; V635-F680 HydrophobicContact CG2-CE1 3.52Å; V635-F680 HydrophobicContact CG2-CE2 4.07Å; V635-F680 HydrophobicContact CG2-CG 4.08Å; V635-F680 HydrophobicContact CG2-CZ 3.7Å; K656-F680 HydrophobicContact CB-CD2 3.83Å; K656-F680 HydrophobicContact CB-CE2 3.81Å; K656-F680 HydrophobicContact CD-CE2 4.04Å; K656-F680 HydrophobicContact CG-CD2 4.33Å; K656-F680 HydrophobicContact CG-CE2 3.81Å; M657-F680 PolarHBondContact O-N 2.85Å; P670-F680 HydrophobicContact CB-CB 4.3Å; P670-F680 WeakPolarHBondContact O-CB 3.35Å; K672-F680 CarbonylContact O-C 3.6Å; K672-F680 WeakPolarHBondContact O-CA 3.49Å; Y673-F680 HydrophobicContact CD2-CD2 4.39Å; Y673-F680 HydrophobicContact CD2-CE1 4.11Å; Y673-F680 AromaticContact CD2-CE2 3.92Å; Y673-F680 HydrophobicContact CD2-CE2 3.92Å; Y673-F680 AromaticContact CD2-CZ 3.77Å; Y673-F680 HydrophobicContact CD2-CZ 3.77Å; Y673-F680 HydrophobicContact CE2-CE2 4.46Å; Y673-F680 HydrophobicContact CG-CE1 4.42Å; Y673-F680 HydrophobicContact CG-CZ 4.39Å
681	S	91.4	Very high	89.4	Confident	22 Å²	22	61.3 Å²	61.3	15%	0.154	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	161.3	178	57.5	0	0	0	0	110.5	P670 F671 K672 N674	P670-S681 CarbonylContact C-O 3.24Å; P670-S681 VanDerWaalsContact C-O 3.24Å; P670-S681 WeakPolarHBondContact CA-O 3.47Å; F671-S681 PolarHBondContact N-O 2.75Å; K672-S681 WeakPolarHBondContact CB-O 3.49Å; K672-S681 PolarHBondContact N-O 3.1Å; K672-S681 PolarHBondContact O-N 3.27Å; K672-S681 PolarHBondContact O-OG 2.81Å; N674-S681 PolarHBondContact ND2-OG 2.95Å
682	H	89.9	Confident	89.1	Confident	18 Å²	18	65.6 Å²	65.6	8%	0.083	33%	0.331	C	S	.	.			trans	-73.6	150.1	171	-59	79.6	0	0	0	109	R660 R663 M668	R660-H682 PolarHBondContact O-CE1 3.35Å; R663-H682 PolarHBondContact N-NE2 3.09Å; M668-H682 PolarHBondContact O-CD2 3.14Å; M668-H682 PolarHBondContact O-NE2 3.17Å
683	R	84.8	Confident	88.8	Confident	152 Å²	152	65.4 Å²	65.4	57%	0.574	34%	0.335	S	S	*	.			trans	-58.1	0	173.2	-168.5	70.8	-142	-168.5	-4.1	111.8	E604 E611	E604-R683 WeakPolarHBondContact OE1-CB 3.48Å; E604-R683 WeakPolarHBondContact OE1-CD 3.26Å; E604-R683 WeakPolarHBondContact OE1-CG 3.09Å; E604-R683 IonicContact OE2-NH1 3.78Å; E611-R683 VanDerWaalsContact CD-NH1 3.33Å; E611-R683 IonicContact OE1-CZ 2.72Å; E611-R683 IonicContact OE1-NH1 3.07Å; E611-R683 PolarHBondContact OE1-NH1 2.87Å; E611-R683 IonicContact OE1-NH2 2.88Å; E611-R683 PolarHBondContact OE1-NH2 3.46Å; E611-R683 IonicContact OE2-NH1 2.75Å; E611-R683 PolarHBondContact OE2-NH1 2.96Å

Retrieved 683 of 683 residues in 119.8 ms (Link to these results)

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