A0A077ZDV5_TRITR Loading...

Serine/threonine-protein kinase RIO1

AlphaFold DB , UniProt , Accession A0A077ZDV5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 505 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	40.1	Very low	42.9	Very low	239 Å²	239	176.2 Å²	176.2	100%	1.177	89%	0.894	S	S	*	*				0	138.5	0	-72.1	-176.2	170	0	0	106.9
2	I	54.1	Low	42.6	Very low	184 Å²	184	171.2 Å²	171.2	94%	0.944	89%	0.887	S	S	*	*			trans	89.8	100.3	-157.8	-48.6	168.9	0	0	0	111.6
3	S	44.7	Very low	41.8	Very low	109 Å²	109	164.5 Å²	164.5	76%	0.762	89%	0.886	S	S	*	*			trans	-116.5	139.2	179.7	-167.9	0	0	0	0	107.9
4	P	50.8	Low	41.6	Very low	123 Å²	123	159.4 Å²	159.4	80%	0.799	88%	0.878	S	S	*	*	P	Polyproline II helix	trans	-89.4	127.6	178.9	32.7	-27.6	0	0	0	111
5	R	46.7	Very low	41.1	Very low	240 Å²	240	159.7 Å²	159.7	91%	0.906	88%	0.878	S	S	*	*	P	Polyproline II helix	trans	-76.4	126.3	172.4	-92.4	-175.5	177.5	-162.3	-0.5	110.7
6	K	37.6	Very low	40.8	Very low	204 Å²	204	159.8 Å²	159.8	89%	0.887	88%	0.875	S	S	*	*	P	Polyproline II helix	trans	-79	138.6	157.1	-82.8	178.1	168.9	-177.9	0	109.4
7	M	46.7	Very low	40.3	Very low	168 Å²	168	157.9 Å²	157.9	83%	0.828	87%	0.87	S	S	*	*			trans	-135.8	105.6	150.9	-64.9	-167.5	90.5	0	0	105
8	Q	42.3	Very low	40.3	Very low	189 Å²	189	156.1 Å²	156.1	88%	0.883	86%	0.864	S	S	*	*				61.5	102.6	83.4	-100.6	179.1	-18	0	0	113.9
9	D	35.6	Very low	40	Very low	165 Å²	165	157.6 Å²	157.6	88%	0.882	86%	0.864	S	S	*	*			trans	-52.7	138.5	167.1	-75.6	-46.3	0	0	0	112.3
10	Q	39	Very low	39.7	Very low	196 Å²	196	156.6 Å²	156.6	92%	0.916	86%	0.862	S	S	*	*			trans	-134.5	123.1	148	-73.6	-166.8	3.7	0	0	109.5
11	S	34.5	Very low	39.7	Very low	121 Å²	121	157 Å²	157	85%	0.846	86%	0.864	S	S	*	*			trans	-77.9	128.6	176.6	51.1	0	0	0	0	112.2
12	S	39.2	Very low	39.4	Very low	116 Å²	116	150.3 Å²	150.3	81%	0.811	84%	0.84	S	S	*	*			trans	-160.4	112.3	154.3	54	0	0	0	0	105.2
13	G	32.6	Very low	38.9	Very low	85 Å²	85	147.4 Å²	147.4	88%	0.876	84%	0.836	S	S	*	*				89.4	68.5	58.5	0	0	0	0	0	108.7
14	A	38.7	Very low	38.5	Very low	93 Å²	93	149.7 Å²	149.7	77%	0.769	84%	0.84	S	S	*	*			trans	-148.3	99.9	170.1	0	0	0	0	0	109.3
15	N	33.7	Very low	37.8	Very low	164 Å²	164	153.1 Å²	153.1	88%	0.877	85%	0.845	S	S	*	*			trans	-65.7	127.6	165.2	-75	-30.9	0	0	0	108.4
16	L	36.6	Very low	37.2	Very low	161 Å²	161	147.6 Å²	147.6	84%	0.843	84%	0.838	S	S	*	*			trans	-113	103.9	161.8	-132.4	88.1	0	0	0	108.4
17	T	32.6	Very low	37.2	Very low	128 Å²	128	144.9 Å²	144.9	79%	0.785	84%	0.839	S	S	*	*			trans	-60.6	130.5	164	6.6	0	0	0	0	109.4
18	V	39.8	Very low	36.5	Very low	125 Å²	125	145.1 Å²	145.1	76%	0.758	84%	0.838	S	S	*	*			trans	-117.2	111.9	160.5	177.1	0	0	0	0	106.1
19	E	34.6	Very low	36.2	Very low	184 Å²	184	143.7 Å²	143.7	86%	0.86	84%	0.836	S	S	*	*			trans	-66.1	129.1	173.2	-66.8	-179.8	154.1	0	0	109.4
20	T	34.1	Very low	36.4	Very low	137 Å²	137	142.3 Å²	142.3	84%	0.84	83%	0.834	S	S	*	*			trans	-106	111.2	164.8	49.9	0	0	0	0	107
21	D	40.6	Very low	36.5	Very low	167 Å²	167	138.9 Å²	138.9	89%	0.893	83%	0.829	S	S	*	*			trans	-98.5	130.2	170.4	-132.2	-4.3	0	0	0	109.5
22	S	33.8	Very low	36.3	Very low	98 Å²	98	142 Å²	142	69%	0.685	83%	0.83	S	S	*	*			trans	-88.2	138.5	-176.8	47.3	0	0	0	0	111.3
23	S	43	Very low	36.2	Very low	122 Å²	122	141.1 Å²	141.1	85%	0.853	83%	0.83	S	S	*	*			trans	-156.6	123.1	150.2	-52.6	0	0	0	0	109.9
24	D	35.7	Very low	36.1	Very low	157 Å²	157	142.3 Å²	142.3	84%	0.84	82%	0.82	S	S	*	*			trans	-63	145.6	173.9	-57.9	-66	0	0	0	112.7
25	E	37.3	Very low	35.9	Very low	196 Å²	196	144.3 Å²	144.3	92%	0.916	82%	0.822	S	S	*	*				-172.4	145.9	112.7	-114.3	-177.2	165.5	0	0	112.8
26	V	34.1	Very low	35.9	Very low	124 Å²	124	141.9 Å²	141.9	75%	0.752	81%	0.814	S	S	*	*			trans	-81.6	142.8	-170.3	172.7	0	0	0	0	111
27	T	36.6	Very low	35.7	Very low	147 Å²	147	139.4 Å²	139.4	90%	0.902	81%	0.809	S	S	*	*			trans	-167.9	134.9	135.9	16.7	0	0	0	0	112
28	E	33.1	Very low	35.9	Very low	173 Å²	173	139.2 Å²	139.2	81%	0.808	81%	0.808	S	S	*	*			trans	-72.3	146	-175.9	-62.9	169.1	141.1	0	0	112.5
29	D	34.3	Very low	35.6	Very low	158 Å²	158	144.6 Å²	144.6	85%	0.845	82%	0.815	S	S	*	*				163.9	106.8	126.3	-93.5	-24.8	0	0	0	110.8
30	T	41.2	Very low	35.6	Very low	136 Å²	136	144.8 Å²	144.8	83%	0.834	81%	0.813	S	S	*	*			trans	-138.4	134.7	152.5	43.2	0	0	0	0	110
31	P	40.4	Very low	35.7	Very low	125 Å²	125	143 Å²	143	81%	0.812	81%	0.806	S	S	*	*			trans	-81.8	141.3	-170.9	31.8	-32.6	0	0	0	112.3	A33	P31-A33 PolarHBondContact O-N 3.34Å
32	E	31	Very low	35.4	Very low	185 Å²	185	146 Å²	146	86%	0.864	81%	0.807	S	S	*	*			trans	-55.9	120	172.4	-68.8	-179.1	136.6	0	0	112.4
33	A	36	Very low	35.4	Very low	98 Å²	98	146.5 Å²	146.5	81%	0.81	81%	0.81	S	S	*	*			trans	-93	96.8	159.1	0	0	0	0	0	109.1	P31 V35	P31-A33 PolarHBondContact O-N 3.34Å; A33-V35 PolarHBondContact O-N 3.14Å
34	V	31.9	Very low	34.9	Very low	111 Å²	111	144.3 Å²	144.3	67%	0.673	81%	0.807	S	S	*	*			trans	-54.9	111.2	173.2	175.2	0	0	0	0	110.6	T36	V34-T36 HydrophobicContact CG1-CG2 3.9Å
35	V	34.2	Very low	34.7	Very low	134 Å²	134	141.5 Å²	141.5	81%	0.812	80%	0.799	S	S	*	*			trans	-108	92.9	160.6	-179.4	0	0	0	0	108.3	A33 S37	A33-V35 PolarHBondContact O-N 3.14Å; V35-S37 PolarHBondContact O-N 3.14Å
36	T	32.4	Very low	34.7	Very low	114 Å²	114	138.3 Å²	138.3	70%	0.699	79%	0.793	S	S	*	*			trans	-62.7	90.4	166.4	31.7	0	0	0	0	110.1	V34 T38	V34-T36 HydrophobicContact CG1-CG2 3.9Å; T36-T38 PolarHBondContact O-N 3.27Å
37	S	33	Very low	34.9	Very low	108 Å²	108	142.6 Å²	142.6	76%	0.755	80%	0.797	S	S	*	*			trans	-81.6	96.3	162	-170	0	0	0	0	108.7	V35 R39	V35-S37 PolarHBondContact O-N 3.14Å; S37-R39 PolarHBondContact O-N 3.03Å
38	T	36.1	Very low	34.9	Very low	125 Å²	125	140.9 Å²	140.9	77%	0.767	79%	0.791	S	S	*	*			trans	-61.2	96.1	166.5	40.2	0	0	0	0	109.1	T36 K40	T36-T38 PolarHBondContact O-N 3.27Å; T38-K40 VanDerWaalsContact C-N 3.32Å; T38-K40 PolarHBondContact O-N 3.25Å
39	R	34.5	Very low	34.9	Very low	237 Å²	237	138.1 Å²	138.1	89%	0.894	79%	0.791	S	S	*	*			trans	-64.6	96.9	161.9	-117	-178.7	178.9	-178.1	0.6	107	S37 S41	S37-R39 PolarHBondContact O-N 3.03Å; R39-S41 PolarHBondContact O-N 3.4Å
40	K	34.5	Very low	35.1	Very low	189 Å²	189	135.8 Å²	135.8	82%	0.822	79%	0.787	S	S	*	*			trans	-60.3	93.5	158.6	-94	179.7	175.6	174.3	0	107.5	T38 Y42	T38-K40 VanDerWaalsContact C-N 3.32Å; T38-K40 PolarHBondContact O-N 3.25Å; K40-Y42 PolarHBondContact O-N 3.39Å
41	S	36	Very low	35.2	Very low	100 Å²	100	134.3 Å²	134.3	70%	0.699	78%	0.78	S	S	*	*			trans	-61.6	109.6	156.7	37.8	0	0	0	0	107.2	R39 S43	R39-S41 PolarHBondContact O-N 3.4Å; S41-S43 PolarHBondContact O-N 3.29Å
42	Y	35.2	Very low	35	Very low	229 Å²	229	136.3 Å²	136.3	90%	0.898	78%	0.782	S	S	*	*			trans	-69.3	89	160.7	-100.9	-91.8	0	0	0	107.4	K40 G44	K40-Y42 PolarHBondContact O-N 3.39Å; Y42-G44 PolarHBondContact O-N 2.94Å; Y42-G44 VanDerWaalsContact O-N 3.12Å
43	S	32.8	Very low	35.4	Very low	108 Å²	108	133.9 Å²	133.9	76%	0.755	77%	0.774	S	S	*	*			trans	-75.7	79.7	162.6	46.7	0	0	0	0	108.8	S41 S45	S41-S43 PolarHBondContact O-N 3.29Å; S43-S45 VanDerWaalsContact C-N 3.25Å; S43-S45 PolarHBondContact O-N 2.9Å; S43-S45 VanDerWaalsContact O-N 3.1Å
44	G	32.5	Very low	35.4	Very low	76 Å²	76	139.7 Å²	139.7	78%	0.784	78%	0.775	S	S	*	*			trans	-79.5	72.1	166.9	0	0	0	0	0	111	Y42	Y42-G44 PolarHBondContact O-N 2.94Å; Y42-G44 VanDerWaalsContact O-N 3.12Å
45	S	32.2	Very low	35.9	Very low	98 Å²	98	144.7 Å²	144.7	69%	0.685	78%	0.782	S	S	*	*			trans	-86.9	98.7	164.8	159.4	0	0	0	0	108.5	S43	S43-S45 VanDerWaalsContact C-N 3.25Å; S43-S45 PolarHBondContact O-N 2.9Å; S43-S45 VanDerWaalsContact O-N 3.1Å
46	V	37.8	Very low	36.1	Very low	130 Å²	130	143.4 Å²	143.4	79%	0.788	78%	0.779	S	S	*	*			trans	-141.6	101.5	161.3	-174.5	0	0	0	0	109.6
47	Y	36.7	Very low	36.6	Very low	214 Å²	214	142.8 Å²	142.8	84%	0.839	78%	0.775	S	S	*	*			trans	18.8	115.2	138.6	-73.7	-92.8	0	0	0	118.2
48	S	37.3	Very low	37	Very low	110 Å²	110	146.8 Å²	146.8	77%	0.769	78%	0.779	S	S	*	*			trans	-163.8	98.5	140.5	168.2	0	0	0	0	109.4	S50	S48-S50 PolarHBondContact O-N 3.32Å
49	S	33.4	Very low	37.6	Very low	116 Å²	116	147 Å²	147	81%	0.811	78%	0.775	S	S	*	*			trans	-23.9	109.5	166.8	-43.7	0	0	0	0	114.2
50	S	38.3	Very low	38.3	Very low	108 Å²	108	144 Å²	144	76%	0.755	78%	0.777	S	S	*	*			trans	-103.7	125.5	157.5	-67.2	0	0	0	0	107.4	S48	S48-S50 PolarHBondContact O-N 3.32Å
51	P	43.1	Very low	39.4	Very low	105 Å²	105	138.7 Å²	138.7	68%	0.682	78%	0.775	S	S	*	*			trans	-64.9	147.4	-177.1	28.5	-32.5	0	0	0	109.2	L53	P51-L53 PolarHBondContact O-N 3.43Å
52	I	36.3	Very low	40.5	Very low	167 Å²	167	136.7 Å²	136.7	86%	0.856	76%	0.759	S	S	*	*			trans	-57.4	86.4	162	-62.5	165	0	0	0	106.8	R54	I52-R54 VanDerWaalsContact C-N 3.35Å; I52-R54 PolarHBondContact O-N 3.05Å; I52-R54 VanDerWaalsContact O-N 3.11Å
53	L	39.3	Very low	42	Very low	134 Å²	134	130.4 Å²	130.4	70%	0.702	74%	0.741	S	S	*	*			trans	-75	95.9	166	-97.5	159.3	0	0	0	106	P51 R55	P51-L53 PolarHBondContact O-N 3.43Å; L53-R55 PolarHBondContact O-N 3.31Å
54	R	36.2	Very low	44	Very low	221 Å²	221	130.4 Å²	130.4	83%	0.834	74%	0.738	S	S	*	*			trans	-50.7	96.7	150.6	-73.8	-173.6	175.8	-155.6	0.3	107.2	I52 S56	I52-R54 VanDerWaalsContact C-N 3.35Å; I52-R54 PolarHBondContact O-N 3.05Å; I52-R54 VanDerWaalsContact O-N 3.11Å; R54-S56 VanDerWaalsContact C-N 3.34Å; R54-S56 PolarHBondContact O-N 3.09Å
55	R	41.4	Very low	46.1	Very low	215 Å²	215	129.2 Å²	129.2	81%	0.811	72%	0.717	S	S	*	*			trans	-98.7	65.8	174.1	-152.1	170.4	-165.4	161	4.1	109.3	L53 V57	L53-R55 PolarHBondContact O-N 3.31Å; R55-V57 VanDerWaalsContact C-N 3.26Å; R55-V57 PolarHBondContact O-N 2.85Å
56	S	38.8	Very low	48.5	Very low	107 Å²	107	128.8 Å²	128.8	75%	0.748	71%	0.707	S	S	*	*			trans	-90.3	59.2	158.8	60.6	0	0	0	0	109	R54	R54-S56 VanDerWaalsContact C-N 3.34Å; R54-S56 PolarHBondContact O-N 3.09Å
57	V	42.5	Very low	50.6	Low	102 Å²	102	128.3 Å²	128.3	62%	0.618	70%	0.696	S	S	*	*	S	Bend	trans	-162.5	125.4	169.7	-129.4	0	0	0	0	109.6	R55	R55-V57 VanDerWaalsContact C-N 3.26Å; R55-V57 PolarHBondContact O-N 2.85Å
58	F	41.6	Very low	52.9	Low	192 Å²	192	120.6 Å²	120.6	84%	0.842	67%	0.673	S	S	*	*	S	Bend	trans	76	72.1	174.5	-79.4	-91	0	0	0	118.7
59	L	48.4	Very low	55.3	Low	130 Å²	130	121.9 Å²	121.9	68%	0.681	67%	0.665	S	S	*	*			trans	-143.2	21.4	140.8	-114.5	127.9	0	0	0	113	G61 V62	L59-G61 PolarHBondContact O-N 3.1Å; L59-V62 HydrophobicContact CD2-CB 3.67Å; L59-V62 HydrophobicContact CD2-CG1 4.37Å; L59-V62 HydrophobicContact CD2-CG2 3.37Å; L59-V62 HydrophobicContact CG-CB 4.47Å; L59-V62 HydrophobicContact CG-CG2 3.68Å
60	D	49.9	Very low	57.9	Low	174 Å²	174	120.4 Å²	120.4	93%	0.93	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.7	92.6	164.4	-70	-27.7	0	0	0	107.9
61	G	57.2	Low	60.4	Low	76 Å²	76	121 Å²	121	78%	0.784	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	136.1	1.9	178.4	0	0	0	0	0	115.9	L59 N63	L59-G61 PolarHBondContact O-N 3.1Å; G61-N63 PolarHBondContact O-N 2.89Å; G61-N63 VanDerWaalsContact O-N 3.13Å
62	V	60.2	Low	62.7	Low	59 Å²	59	123 Å²	123	36%	0.358	63%	0.634	S	S	.	*			trans	-74	109.9	168.6	-179.5	0	0	0	0	108.2	L59 L66	L59-V62 HydrophobicContact CD2-CB 3.67Å; L59-V62 HydrophobicContact CD2-CG1 4.37Å; L59-V62 HydrophobicContact CD2-CG2 3.37Å; L59-V62 HydrophobicContact CG-CB 4.47Å; L59-V62 HydrophobicContact CG-CG2 3.68Å; V62-L66 HydrophobicContact CG1-CB 4.02Å; V62-L66 HydrophobicContact CG1-CD2 3.73Å
63	N	66.1	Low	65.3	Low	97 Å²	97	119.1 Å²	119.1	52%	0.519	62%	0.618	S	S	.	*			trans	-47	127.3	178.3	-167.6	-45.1	0	0	0	109.5	G61 S65 L66 H67	G61-N63 PolarHBondContact O-N 2.89Å; G61-N63 VanDerWaalsContact O-N 3.13Å; N63-S65 PolarHBondContact O-N 2.95Å; N63-S65 WeakPolarHBondContact OD1-CB 3.46Å; N63-S65 PolarHBondContact OD1-N 2.86Å; N63-S65 VanDerWaalsContact OD1-N 3.15Å; N63-S65 PolarHBondContact OD1-OG 3.41Å; N63-L66 WeakPolarHBondContact O-CB 3.33Å; N63-L66 PolarHBondContact O-N 3.08Å; N63-H67 PolarHBondContact O-N 3.12Å
64	P	74.5	Confident	67.8	Low	107 Å²	107	117.4 Å²	117.4	70%	0.695	61%	0.609	S	S	*	*	H	α-helix	trans	-52	-26.4	179.6	-24.7	30.2	0	0	0	113.1	S68	P64-S68 WeakPolarHBondContact O-CB 3.3Å; P64-S68 PolarHBondContact O-N 3.18Å; P64-S68 VanDerWaalsContact O-N 3.13Å; P64-S68 PolarHBondContact O-OG 3.32Å
65	S	78	Confident	70.5	Confident	51 Å²	51	110.5 Å²	110.5	36%	0.357	59%	0.589	S	S	.	*	H	α-helix	trans	-67.2	-31.2	173.6	70.6	0	0	0	0	114.1	N63 S68 K69	N63-S65 PolarHBondContact O-N 2.95Å; N63-S65 WeakPolarHBondContact OD1-CB 3.46Å; N63-S65 PolarHBondContact OD1-N 2.86Å; N63-S65 VanDerWaalsContact OD1-N 3.15Å; N63-S65 PolarHBondContact OD1-OG 3.41Å; S65-S68 WeakPolarHBondContact CA-OG 3.41Å; S65-S68 PolarHBondContact O-OG 3.32Å; S65-K69 WeakPolarHBondContact O-CB 3.44Å; S65-K69 WeakPolarHBondContact O-CD 3.48Å; S65-K69 WeakPolarHBondContact O-CG 3.45Å; S65-K69 PolarHBondContact O-N 3.17Å
66	L	80.9	Confident	72.9	Confident	90 Å²	90	104.8 Å²	104.8	47%	0.471	58%	0.578	S	S	.	*	H	α-helix	trans	-76.9	-44	177.7	-162.9	100.1	0	0	0	111	V62 N63 S68 K69 I70	V62-L66 HydrophobicContact CG1-CB 4.02Å; V62-L66 HydrophobicContact CG1-CD2 3.73Å; N63-L66 WeakPolarHBondContact O-CB 3.33Å; N63-L66 PolarHBondContact O-N 3.08Å; L66-S68 PolarHBondContact O-N 3.47Å; L66-K69 WeakPolarHBondContact O-CB 3.45Å; L66-K69 PolarHBondContact O-N 2.88Å; L66-I70 HydrophobicContact CD2-CD1 3.9Å; L66-I70 HydrophobicContact CG-CD1 4.21Å; L66-I70 WeakPolarHBondContact O-CG1 3.47Å; L66-I70 PolarHBondContact O-N 3.07Å
67	H	81.9	Confident	75.4	Confident	120 Å²	120	106.6 Å²	106.6	56%	0.556	57%	0.569	S	S	*	*	H	α-helix	trans	-61.2	-44.4	176.7	-177.4	-91.7	0	0	0	111.6	N63 K69 I70 K71	N63-H67 PolarHBondContact O-N 3.12Å; H67-K69 VanDerWaalsContact C-N 3.33Å; H67-K69 PolarHBondContact O-N 2.98Å; H67-I70 PolarHBondContact O-N 3.36Å; H67-K71 WeakPolarHBondContact O-CB 3.37Å; H67-K71 PolarHBondContact O-N 3.3Å
68	S	85.4	Confident	77.7	Confident	51 Å²	51	107.4 Å²	107.4	36%	0.357	57%	0.566	S	S	.	*	H	α-helix	trans	-64.4	-35	175.3	57.2	0	0	0	0	113.1	P64 S65 L66 K72	P64-S68 WeakPolarHBondContact O-CB 3.3Å; P64-S68 PolarHBondContact O-N 3.18Å; P64-S68 VanDerWaalsContact O-N 3.13Å; P64-S68 PolarHBondContact O-OG 3.32Å; S65-S68 WeakPolarHBondContact CA-OG 3.41Å; S65-S68 PolarHBondContact O-OG 3.32Å; L66-S68 PolarHBondContact O-N 3.47Å; S68-K72 WeakPolarHBondContact O-CB 3.45Å; S68-K72 VanDerWaalsContact O-CG 3.26Å; S68-K72 WeakPolarHBondContact O-CG 3.28Å; S68-K72 PolarHBondContact O-N 3.19Å
69	K	87.5	Confident	80.1	Confident	138 Å²	138	104.7 Å²	104.7	60%	0.6	55%	0.554	S	S	*	*	H	α-helix	trans	-65.2	-46.7	172.1	-78.4	171.9	-176.2	177.4	0	112	S65 L66 H67 K72 T73	S65-K69 WeakPolarHBondContact O-CB 3.44Å; S65-K69 WeakPolarHBondContact O-CD 3.48Å; S65-K69 WeakPolarHBondContact O-CG 3.45Å; S65-K69 PolarHBondContact O-N 3.17Å; L66-K69 WeakPolarHBondContact O-CB 3.45Å; L66-K69 PolarHBondContact O-N 2.88Å; H67-K69 VanDerWaalsContact C-N 3.33Å; H67-K69 PolarHBondContact O-N 2.98Å; K69-K72 PolarHBondContact O-N 3.47Å; K69-T73 WeakPolarHBondContact O-CG2 3.18Å; K69-T73 PolarHBondContact O-N 3.45Å; K69-T73 PolarHBondContact O-OG1 3.01Å
70	I	89.5	Confident	82	Confident	84 Å²	84	100.5 Å²	100.5	43%	0.431	54%	0.539	S	S	.	.	H	α-helix	trans	-62.2	-46.2	178.8	-67.1	167	0	0	0	110.7	L66 H67 K72 T73 L74	L66-I70 HydrophobicContact CD2-CD1 3.9Å; L66-I70 HydrophobicContact CG-CD1 4.21Å; L66-I70 WeakPolarHBondContact O-CG1 3.47Å; L66-I70 PolarHBondContact O-N 3.07Å; H67-I70 PolarHBondContact O-N 3.36Å; I70-K72 PolarHBondContact O-N 3.14Å; I70-T73 VanDerWaalsContact CA-OG1 3.31Å; I70-T73 WeakPolarHBondContact CA-OG1 3.34Å; I70-T73 PolarHBondContact O-N 3.32Å; I70-T73 VanDerWaalsContact O-N 3.16Å; I70-T73 PolarHBondContact O-OG1 3.4Å; I70-L74 HydrophobicContact CG2-CD1 4.15Å; I70-L74 WeakPolarHBondContact O-CG 3.32Å; I70-L74 PolarHBondContact O-N 2.91Å
71	K	90.3	Very high	83.8	Confident	122 Å²	122	95.6 Å²	95.6	53%	0.53	51%	0.51	S	S	.	.	H	α-helix	trans	-57.9	-49.1	175.7	-175.4	176.6	178	178.9	0	111.4	H67 T73 L74 D75	H67-K71 WeakPolarHBondContact O-CB 3.37Å; H67-K71 PolarHBondContact O-N 3.3Å; K71-T73 VanDerWaalsContact C-N 3.3Å; K71-T73 PolarHBondContact O-N 2.85Å; K71-L74 PolarHBondContact O-N 3.49Å; K71-L74 VanDerWaalsContact O-N 3.12Å; K71-D75 PolarHBondContact O-N 2.87Å
72	K	90.6	Very high	85.2	Confident	145 Å²	145	97.1 Å²	97.1	63%	0.63	50%	0.497	S	S	*	.	H	α-helix	trans	-57	-42.1	175.3	-76.1	176.4	-179	-176.2	0	112.3	S68 K69 I70 T76	S68-K72 WeakPolarHBondContact O-CB 3.45Å; S68-K72 VanDerWaalsContact O-CG 3.26Å; S68-K72 WeakPolarHBondContact O-CG 3.28Å; S68-K72 PolarHBondContact O-N 3.19Å; K69-K72 PolarHBondContact O-N 3.47Å; I70-K72 PolarHBondContact O-N 3.14Å; K72-T76 VanDerWaalsContact O-CG2 3.3Å; K72-T76 WeakPolarHBondContact O-CG2 3.31Å; K72-T76 PolarHBondContact O-N 2.91Å; K72-T76 PolarHBondContact O-OG1 3.2Å; K72-T76 VanDerWaalsContact O-OG1 3.06Å
73	T	90.7	Very high	86.4	Confident	86 Å²	86	99 Å²	99	53%	0.528	51%	0.505	S	S	.	.	H	α-helix	trans	-65.9	-37.6	177.5	50.2	0	0	0	0	112.8	K69 I70 K71 T76 Y77	K69-T73 WeakPolarHBondContact O-CG2 3.18Å; K69-T73 PolarHBondContact O-N 3.45Å; K69-T73 PolarHBondContact O-OG1 3.01Å; I70-T73 VanDerWaalsContact CA-OG1 3.31Å; I70-T73 WeakPolarHBondContact CA-OG1 3.34Å; I70-T73 PolarHBondContact O-N 3.32Å; I70-T73 VanDerWaalsContact O-N 3.16Å; I70-T73 PolarHBondContact O-OG1 3.4Å; K71-T73 VanDerWaalsContact C-N 3.3Å; K71-T73 PolarHBondContact O-N 2.85Å; T73-T76 WeakPolarHBondContact CA-OG1 3.4Å; T73-T76 PolarHBondContact O-OG1 3.34Å; T73-Y77 WeakPolarHBondContact O-CB 3.47Å; T73-Y77 PolarHBondContact O-N 3.43Å; T73-Y77 VanDerWaalsContact O-N 3.08Å
74	L	91.8	Very high	87.2	Confident	98 Å²	98	101.2 Å²	101.2	51%	0.513	51%	0.51	S	S	.	.	H	α-helix	trans	-68	-48.3	175	-71.2	173.6	0	0	0	111.3	I70 K71 T76 Y77 E78	I70-L74 HydrophobicContact CG2-CD1 4.15Å; I70-L74 WeakPolarHBondContact O-CG 3.32Å; I70-L74 PolarHBondContact O-N 2.91Å; K71-L74 PolarHBondContact O-N 3.49Å; K71-L74 VanDerWaalsContact O-N 3.12Å; L74-T76 VanDerWaalsContact C-N 3.27Å; L74-T76 PolarHBondContact O-N 3.43Å; L74-Y77 WeakPolarHBondContact O-CA 3.44Å; L74-Y77 WeakPolarHBondContact O-CB 3.48Å; L74-Y77 PolarHBondContact O-N 3Å; L74-E78 PolarHBondContact O-N 3.45Å
75	D	92.3	Very high	87.5	Confident	77 Å²	77	105.4 Å²	105.4	41%	0.412	51%	0.512	S	S	.	.	H	α-helix	trans	-57.5	-41.2	177.2	-62.5	-13.2	0	0	0	111	K71 Y77 K79	K71-D75 PolarHBondContact O-N 2.87Å; D75-Y77 VanDerWaalsContact C-N 3.34Å; D75-Y77 PolarHBondContact O-N 2.98Å; D75-K79 WeakPolarHBondContact O-CB 3.42Å; D75-K79 PolarHBondContact O-N 3.21Å
76	T	92.2	Very high	87.6	Confident	94 Å²	94	112.5 Å²	112.5	58%	0.577	53%	0.532	S	S	*	.	H	α-helix	trans	-66.5	-34.1	175	53.2	0	0	0	0	113.2	K72 T73 L74 A80	K72-T76 VanDerWaalsContact O-CG2 3.3Å; K72-T76 WeakPolarHBondContact O-CG2 3.31Å; K72-T76 PolarHBondContact O-N 2.91Å; K72-T76 PolarHBondContact O-OG1 3.2Å; K72-T76 VanDerWaalsContact O-OG1 3.06Å; T73-T76 WeakPolarHBondContact CA-OG1 3.4Å; T73-T76 PolarHBondContact O-OG1 3.34Å; L74-T76 VanDerWaalsContact C-N 3.27Å; L74-T76 PolarHBondContact O-N 3.43Å; T76-A80 WeakPolarHBondContact O-CB 3.23Å; T76-A80 PolarHBondContact O-N 3.04Å
77	Y	91.6	Very high	87.5	Confident	146 Å²	146	117.9 Å²	117.9	57%	0.573	55%	0.546	S	S	*	.	H	α-helix	trans	-72	-42.8	177.5	179.4	-95.8	0	0	0	111.3	T73 L74 D75 A80 Q81	T73-Y77 WeakPolarHBondContact O-CB 3.47Å; T73-Y77 PolarHBondContact O-N 3.43Å; T73-Y77 VanDerWaalsContact O-N 3.08Å; L74-Y77 WeakPolarHBondContact O-CA 3.44Å; L74-Y77 WeakPolarHBondContact O-CB 3.48Å; L74-Y77 PolarHBondContact O-N 3Å; D75-Y77 VanDerWaalsContact C-N 3.34Å; D75-Y77 PolarHBondContact O-N 2.98Å; Y77-A80 PolarHBondContact O-N 3.38Å; Y77-Q81 HydrophobicContact CD1-CG 4.26Å; Y77-Q81 HydrophobicContact CE1-CG 3.87Å; Y77-Q81 WeakPolarHBondContact O-CG 3.38Å; Y77-Q81 PolarHBondContact O-N 3.32Å; Y77-Q81 PolarHBondContact OH-NE2 3.13Å; Y77-Q81 VanDerWaalsContact OH-NE2 3.15Å
78	E	91.2	Very high	87.5	Confident	118 Å²	118	117.2 Å²	117.2	55%	0.551	56%	0.562	S	S	*	*	H	α-helix	trans	-61	-47.7	174.9	-71.9	-177.1	168.8	0	0	111.1	L74 A80 Q81 E82	L74-E78 PolarHBondContact O-N 3.45Å; E78-A80 VanDerWaalsContact C-N 3.32Å; E78-A80 PolarHBondContact O-N 3.43Å; E78-Q81 CarbonylContact O-C 3.6Å; E78-Q81 WeakPolarHBondContact O-CA 3.19Å; E78-Q81 WeakPolarHBondContact O-CB 3.43Å; E78-Q81 PolarHBondContact O-N 3.3Å; E78-E82 PolarHBondContact O-N 3.3Å
79	K	90.9	Very high	87.4	Confident	135 Å²	135	120.7 Å²	120.7	59%	0.587	57%	0.57	S	S	*	*	H	α-helix	trans	-57.7	-43.5	174.8	-171.1	172.1	-177.4	173.4	0	112.3	D75 Q81 E82 D83	D75-K79 WeakPolarHBondContact O-CB 3.42Å; D75-K79 PolarHBondContact O-N 3.21Å; K79-Q81 VanDerWaalsContact C-N 3.25Å; K79-Q81 PolarHBondContact O-N 3.24Å; K79-E82 PolarHBondContact O-N 3.09Å; K79-D83 VanDerWaalsContact O-CG 3.29Å; K79-D83 PolarHBondContact O-N 3.12Å
80	A	88.7	Confident	87.4	Confident	43 Å²	43	118.7 Å²	118.7	36%	0.355	57%	0.566	S	S	.	*	H	α-helix	trans	-67	-23.5	176.1	0	0	0	0	0	113.7	T76 Y77 E78 K84	T76-A80 WeakPolarHBondContact O-CB 3.23Å; T76-A80 PolarHBondContact O-N 3.04Å; Y77-A80 PolarHBondContact O-N 3.38Å; E78-A80 VanDerWaalsContact C-N 3.32Å; E78-A80 PolarHBondContact O-N 3.43Å; A80-K84 WeakPolarHBondContact O-CD 3.39Å; A80-K84 VanDerWaalsContact O-CG 3.29Å; A80-K84 WeakPolarHBondContact O-CG 3.35Å
81	Q	87.6	Confident	87.1	Confident	70 Å²	70	124 Å²	124	33%	0.327	59%	0.586	S	S	.	*	H	α-helix	trans	-81.2	-37.4	172.6	-70.1	-67.4	-19.3	0	0	111.7	Y77 E78 K79 K84 R85	Y77-Q81 HydrophobicContact CD1-CG 4.26Å; Y77-Q81 HydrophobicContact CE1-CG 3.87Å; Y77-Q81 WeakPolarHBondContact O-CG 3.38Å; Y77-Q81 PolarHBondContact O-N 3.32Å; Y77-Q81 PolarHBondContact OH-NE2 3.13Å; Y77-Q81 VanDerWaalsContact OH-NE2 3.15Å; E78-Q81 CarbonylContact O-C 3.6Å; E78-Q81 WeakPolarHBondContact O-CA 3.19Å; E78-Q81 WeakPolarHBondContact O-CB 3.43Å; E78-Q81 PolarHBondContact O-N 3.3Å; K79-Q81 VanDerWaalsContact C-N 3.25Å; K79-Q81 PolarHBondContact O-N 3.24Å; Q81-K84 WeakPolarHBondContact O-CB 3.37Å; Q81-K84 PolarHBondContact O-N 3.19Å; Q81-R85 PolarHBondContact O-N 3.22Å
82	E	87.6	Confident	86.9	Confident	108 Å²	108	123 Å²	123	51%	0.505	59%	0.59	S	S	.	*	H	α-helix	trans	-63.3	-43.9	172.7	-71.5	-178.9	165.2	0	0	111.7	E78 K79 K84 R85 Y86	E78-E82 PolarHBondContact O-N 3.3Å; K79-E82 PolarHBondContact O-N 3.09Å; E82-K84 PolarHBondContact O-N 3.04Å; E82-R85 VanDerWaalsContact O-CB 3.29Å; E82-R85 WeakPolarHBondContact O-CB 3.43Å; E82-R85 PolarHBondContact O-N 3.32Å; E82-Y86 WeakPolarHBondContact O-CD2 3.46Å
83	D	85.5	Confident	86.6	Confident	99 Å²	99	119.5 Å²	119.5	53%	0.529	58%	0.578	S	S	.	*	H	α-helix	trans	-59	-32.7	175.2	-70.6	-19.6	0	0	0	111.9	K79 R85	K79-D83 VanDerWaalsContact O-CG 3.29Å; K79-D83 PolarHBondContact O-N 3.12Å; D83-R85 VanDerWaalsContact C-N 3.32Å
84	K	82	Confident	86.2	Confident	143 Å²	143	120.1 Å²	120.1	62%	0.622	58%	0.575	S	S	*	*	H	α-helix	trans	-74.5	-17.8	174.6	-72	171.6	-172.1	175	0	113.8	A80 Q81 E82 Y86	A80-K84 WeakPolarHBondContact O-CD 3.39Å; A80-K84 VanDerWaalsContact O-CG 3.29Å; A80-K84 WeakPolarHBondContact O-CG 3.35Å; Q81-K84 WeakPolarHBondContact O-CB 3.37Å; Q81-K84 PolarHBondContact O-N 3.19Å; E82-K84 PolarHBondContact O-N 3.04Å; K84-Y86 VanDerWaalsContact C-N 3.34Å
85	R	81.6	Confident	85.9	Confident	196 Å²	196	118 Å²	118	74%	0.74	57%	0.572	S	S	*	*	H	α-helix	trans	-72.2	-32.1	175.9	-67.7	-179.9	176.7	-178.5	0.4	111.3	Q81 E82 D83 R87	Q81-R85 PolarHBondContact O-N 3.22Å; E82-R85 VanDerWaalsContact O-CB 3.29Å; E82-R85 WeakPolarHBondContact O-CB 3.43Å; E82-R85 PolarHBondContact O-N 3.32Å; D83-R85 VanDerWaalsContact C-N 3.32Å; R85-R87 PolarHBondContact O-N 3.49Å
86	Y	79.8	Confident	85.5	Confident	199 Å²	199	116.1 Å²	116.1	78%	0.78	56%	0.563	S	S	*	*	S	Bend	trans	-69.9	100.5	169.8	-65.1	-79.7	0	0	0	109.2	E82 K84	E82-Y86 WeakPolarHBondContact O-CD2 3.46Å; K84-Y86 VanDerWaalsContact C-N 3.34Å
87	R	79.1	Confident	85.3	Confident	204 Å²	204	115.2 Å²	115.2	77%	0.77	56%	0.557	S	S	*	*			trans	-78.1	129.6	179.3	-64.9	-177.8	178.5	-178.3	-2	108.9	R85 K89	R85-R87 PolarHBondContact O-N 3.49Å; R87-K89 PolarHBondContact O-N 2.92Å
88	A	81.7	Confident	85	Confident	106 Å²	106	113.2 Å²	113.2	88%	0.876	55%	0.553	S	S	*	*	S	Bend	trans	-76.7	-8	172.7	0	0	0	0	0	113.4
89	K	84.2	Confident	84.7	Confident	123 Å²	123	109.2 Å²	109.2	54%	0.535	54%	0.538	S	S	.	.			trans	-126.6	130	-178.4	-62.9	-178.6	-175.9	177.2	0	108.9	R87 S429	R87-K89 PolarHBondContact O-N 2.92Å; K89-S429 PolarHBondContact NZ-OG 3.44Å
90	D	85.7	Confident	84.7	Confident	97 Å²	97	102.8 Å²	102.8	52%	0.519	51%	0.51	S	S	.	.			trans	-115.9	160.8	178.5	-76.1	-30.6	0	0	0	111.6	V92 D93	D90-V92 HydrophobicContact CB-CG2 3.78Å; D90-V92 PolarHBondContact O-N 3.02Å; D90-D93 PolarHBondContact N-OD2 3.4Å; D90-D93 WeakPolarHBondContact O-CB 3.27Å; D90-D93 PolarHBondContact O-N 3.35Å; D90-D93 VanDerWaalsContact O-N 3.11Å
91	K	85.1	Confident	84.8	Confident	194 Å²	194	101.8 Å²	101.8	84%	0.843	50%	0.499	S	S	*	.	G	3₁₀ helix	trans	-61.1	-28.9	177.8	-69.3	-176.6	178.1	-178.9	0	112.3	D93 H94 A95	K91-D93 PolarHBondContact O-N 3.26Å; K91-H94 PolarHBondContact O-N 2.86Å; K91-H94 VanDerWaalsContact O-N 3.14Å; K91-A95 PolarHBondContact O-N 2.87Å
92	V	84.7	Confident	85	Confident	101 Å²	101	98.6 Å²	98.6	61%	0.612	48%	0.484	S	S	*	.	G	3₁₀ helix	trans	-63.7	-25.8	178	-61.6	0	0	0	0	112.4	D90 H94 A95	D90-V92 HydrophobicContact CB-CG2 3.78Å; D90-V92 PolarHBondContact O-N 3.02Å; V92-H94 PolarHBondContact O-N 3.25Å; V92-H94 VanDerWaalsContact O-N 3.09Å; V92-A95 WeakPolarHBondContact O-CB 3.37Å; V92-A95 PolarHBondContact O-N 3.41Å; V92-A95 VanDerWaalsContact O-N 3.08Å
93	D	83.9	Confident	85.2	Confident	72 Å²	72	95.9 Å²	95.9	39%	0.385	48%	0.476	S	S	.	.	G	3₁₀ helix	trans	-67.6	-10.5	176.8	-57.9	-29.3	0	0	0	112.8	D90 K91 P103	D90-D93 PolarHBondContact N-OD2 3.4Å; D90-D93 WeakPolarHBondContact O-CB 3.27Å; D90-D93 PolarHBondContact O-N 3.35Å; D90-D93 VanDerWaalsContact O-N 3.11Å; K91-D93 PolarHBondContact O-N 3.26Å; D93-P103 WeakPolarHBondContact O-CG 3.33Å
94	H	82.6	Confident	85.5	Confident	99 Å²	99	96.3 Å²	96.3	46%	0.458	47%	0.47	S	S	.	.	G	3₁₀ helix	trans	-118.1	-0.6	177.2	-60.9	-34.7	0	0	0	112.9	K91 V92 T96	K91-H94 PolarHBondContact O-N 2.86Å; K91-H94 VanDerWaalsContact O-N 3.14Å; V92-H94 PolarHBondContact O-N 3.25Å; V92-H94 VanDerWaalsContact O-N 3.09Å; H94-T96 PolarHBondContact O-N 3.38Å; H94-T96 PolarHBondContact O-OG1 3.07Å
95	A	86.1	Confident	86.1	Confident	55 Å²	55	89.5 Å²	89.5	46%	0.455	44%	0.44	S	S	.	.			trans	-63.2	129.5	177.8	0	0	0	0	0	109.8	K91 V92 P103	K91-A95 PolarHBondContact O-N 2.87Å; V92-A95 WeakPolarHBondContact O-CB 3.37Å; V92-A95 PolarHBondContact O-N 3.41Å; V92-A95 VanDerWaalsContact O-N 3.08Å; A95-P103 WeakPolarHBondContact O-CD 3.11Å
96	T	84.8	Confident	86.6	Confident	37 Å²	37	84.1 Å²	84.1	23%	0.227	42%	0.422	C	S	.	.			trans	-107.8	122.3	-176.7	-51.5	0	0	0	0	109.1	H94 S99	H94-T96 PolarHBondContact O-N 3.38Å; H94-T96 PolarHBondContact O-OG1 3.07Å; T96-S99 WeakPolarHBondContact CG2-O 3.17Å
97	V	87	Confident	87.3	Confident	74 Å²	74	78.1 Å²	78.1	45%	0.448	41%	0.406	S	S	.	.	B	Isolated β-bridge	trans	-89.8	142.9	173	179.7	0	0	0	0	108.7	S99 V100 L101	V97-S99 PolarHBondContact O-N 3.08Å; V97-V100 PolarHBondContact O-N 3.42Å; V97-L101 HydrophobicContact CB-CB 4.32Å; V97-L101 PolarHBondContact N-O 3.49Å; V97-L101 WeakPolarHBondContact O-CB 3.49Å; V97-L101 PolarHBondContact O-N 2.75Å
98	E	84.7	Confident	88	Confident	105 Å²	105	69.9 Å²	69.9	49%	0.491	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	53	28	-179.9	-67.6	176.2	-174.1	0	0	114.9	V100 N132 Y134	E98-V100 PolarHBondContact O-N 3.43Å; E98-N132 PolarHBondContact O-ND2 3.34Å; E98-Y134 WeakPolarHBondContact OE2-CE1 3.27Å; E98-Y134 VanDerWaalsContact OE2-CZ 3.3Å; E98-Y134 PolarHBondContact OE2-OH 3.2Å
99	S	86.2	Confident	88.6	Confident	33 Å²	33	65.4 Å²	65.4	23%	0.231	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.2	-13.1	-176.2	78.3	0	0	0	0	117.6	T96 V97 Q149	T96-S99 WeakPolarHBondContact CG2-O 3.17Å; V97-S99 PolarHBondContact O-N 3.08Å; S99-Q149 PolarHBondContact OG-NE2 3.26Å
100	V	90.4	Very high	89.1	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123.8	-25	-177	-58.6	0	0	0	0	115	V97 E98 D102 N132 Y134 V147 Q149	V97-V100 PolarHBondContact O-N 3.42Å; E98-V100 PolarHBondContact O-N 3.43Å; V100-D102 PolarHBondContact O-N 2.68Å; V100-N132 HydrophobicContact CG1-CB 4.24Å; V100-N132 HydrophobicContact CG2-CB 4.11Å; V100-Y134 HydrophobicContact CG2-CE2 4.04Å; V100-Y134 VanDerWaalsContact CG2-OH 3.3Å; V100-Y134 WeakPolarHBondContact CG2-OH 3.49Å; V100-V147 HydrophobicContact CB-CB 4.36Å; V100-V147 HydrophobicContact CB-CG1 3.82Å; V100-V147 HydrophobicContact CG2-CB 4.12Å; V100-V147 HydrophobicContact CG2-CG1 3.89Å; V100-Q149 HydrophobicContact CG1-CB 4.32Å; V100-Q149 HydrophobicContact CG1-CG 3.45Å; V100-Q149 VanDerWaalsContact CG1-CG 3.45Å
101	L	91	Very high	89.5	Confident	23 Å²	23	68.7 Å²	68.7	12%	0.12	35%	0.35	C	S	.	.	B	Isolated β-bridge	trans	-93.6	77.7	-170.7	-58.6	178.5	0	0	0	112.1	V97 T105 L109	V97-L101 HydrophobicContact CB-CB 4.32Å; V97-L101 PolarHBondContact N-O 3.49Å; V97-L101 WeakPolarHBondContact O-CB 3.49Å; V97-L101 PolarHBondContact O-N 2.75Å; L101-T105 HydrophobicContact CD2-CG2 4.25Å; L101-L109 HydrophobicContact CD2-CD1 3.78Å
102	D	91.9	Very high	89.9	Confident	3 Å²	3	59.7 Å²	59.7	2%	0.016	31%	0.311	C	S	.	.			trans	-80.1	161.3	166	73.8	-29.6	0	0	0	111.2	V100 R104 T105 K106 R178	V100-D102 PolarHBondContact O-N 2.68Å; D102-R104 PolarHBondContact O-N 2.92Å; D102-T105 PolarHBondContact O-N 3.41Å; D102-T105 WeakPolarHBondContact OD1-CB 3.3Å; D102-T105 PolarHBondContact OD1-N 2.85Å; D102-T105 PolarHBondContact OD1-OG1 3.16Å; D102-K106 PolarHBondContact O-N 2.65Å; D102-R178 IonicContact OD2-NH2 3.23Å
103	P	91.5	Very high	90.4	Very high	51 Å²	51	57.8 Å²	57.8	33%	0.331	30%	0.297	S	S	.	.	H	α-helix	trans	-53.3	-32.3	179.6	-30.3	37.4	0	0	0	113.6	D93 A95 K106 V107	D93-P103 WeakPolarHBondContact O-CG 3.33Å; A95-P103 WeakPolarHBondContact O-CD 3.11Å; P103-K106 PolarHBondContact O-N 3.35Å; P103-V107 WeakPolarHBondContact O-CG2 3.46Å; P103-V107 PolarHBondContact O-N 2.89Å
104	R	91.8	Very high	90.8	Very high	107 Å²	107	58.4 Å²	58.4	40%	0.404	31%	0.311	S	S	.	.	H	α-helix	trans	-67.4	-47	176.1	-168.3	179.8	-169.5	166	5.7	112.2	D102 K106 V107 V108 E431	D102-R104 PolarHBondContact O-N 2.92Å; R104-K106 VanDerWaalsContact C-N 3.31Å; R104-K106 PolarHBondContact O-N 3.23Å; R104-V107 PolarHBondContact O-N 2.74Å; R104-V108 PolarHBondContact O-N 2.85Å; R104-V108 VanDerWaalsContact O-N 3.12Å; R104-E431 IonicContact CZ-OE2 2.74Å; R104-E431 VanDerWaalsContact CZ-OE2 3.27Å; R104-E431 IonicContact NH1-OE1 2.91Å; R104-E431 PolarHBondContact NH1-OE1 3.4Å; R104-E431 IonicContact NH1-OE2 3.67Å; R104-E431 PolarHBondContact NH1-OE2 2.9Å; R104-E431 IonicContact NH2-OE2 3.9Å; R104-E431 PolarHBondContact NH2-OE2 3.38Å
105	T	93.6	Very high	91.2	Very high	1 Å²	1	56.3 Å²	56.3	1%	0.006	31%	0.308	C	S	.	.	H	α-helix	trans	-62.9	-39.7	175.6	-60.6	0	0	0	0	110.8	L101 D102 V107 V108 L109 V147 N211 V212	L101-T105 HydrophobicContact CD2-CG2 4.25Å; D102-T105 PolarHBondContact O-N 3.41Å; D102-T105 WeakPolarHBondContact OD1-CB 3.3Å; D102-T105 PolarHBondContact OD1-N 2.85Å; D102-T105 PolarHBondContact OD1-OG1 3.16Å; T105-V107 VanDerWaalsContact C-N 3.34Å; T105-V107 PolarHBondContact O-N 2.78Å; T105-V108 WeakPolarHBondContact O-CB 3.32Å; T105-V108 PolarHBondContact O-N 2.78Å; T105-L109 HydrophobicContact CG2-CD1 4.34Å; T105-L109 WeakPolarHBondContact O-CG 3.42Å; T105-L109 PolarHBondContact O-N 2.99Å; T105-V147 HydrophobicContact CG2-CG1 3.54Å; T105-N211 PolarHBondContact OG1-ND2 2.95Å; T105-V212 HydrophobicContact CG2-CG2 4.04Å
106	K	93.1	Very high	91.3	Very high	82 Å²	82	58.3 Å²	58.3	36%	0.357	32%	0.318	S	S	.	.	H	α-helix	trans	-57.5	-45.2	173.8	-69.1	-177.6	-179.2	-176.8	0	111.8	D102 P103 R104 V108 L109 F110	D102-K106 PolarHBondContact O-N 2.65Å; P103-K106 PolarHBondContact O-N 3.35Å; R104-K106 VanDerWaalsContact C-N 3.31Å; R104-K106 PolarHBondContact O-N 3.23Å; K106-V108 VanDerWaalsContact C-N 3.29Å; K106-V108 PolarHBondContact O-N 2.88Å; K106-L109 PolarHBondContact O-N 2.91Å; K106-F110 HydrophobicContact CB-CD2 4.42Å; K106-F110 HydrophobicContact CB-CE2 4.29Å; K106-F110 WeakPolarHBondContact O-CD2 3.38Å; K106-F110 PolarHBondContact O-N 3.38Å
107	V	94.2	Very high	91.5	Very high	74 Å²	74	58.5 Å²	58.5	45%	0.448	32%	0.316	S	S	.	.	H	α-helix	trans	-60.3	-38	175	170.9	0	0	0	0	112	P103 R104 T105 K111	P103-V107 WeakPolarHBondContact O-CG2 3.46Å; P103-V107 PolarHBondContact O-N 2.89Å; R104-V107 PolarHBondContact O-N 2.74Å; T105-V107 VanDerWaalsContact C-N 3.34Å; T105-V107 PolarHBondContact O-N 2.78Å; V107-K111 HydrophobicContact CG1-CD 4.35Å; V107-K111 WeakPolarHBondContact O-CG 3.21Å; V107-K111 PolarHBondContact O-N 3.26Å
108	V	94.5	Very high	91.7	Very high	30 Å²	30	55 Å²	55	18%	0.182	30%	0.295	C	S	.	.	H	α-helix	trans	-64.4	-45.3	175.4	174.9	0	0	0	0	111	R104 T105 K106 K111 L112 R209 V212	R104-V108 PolarHBondContact O-N 2.85Å; R104-V108 VanDerWaalsContact O-N 3.12Å; T105-V108 WeakPolarHBondContact O-CB 3.32Å; T105-V108 PolarHBondContact O-N 2.78Å; K106-V108 VanDerWaalsContact C-N 3.29Å; K106-V108 PolarHBondContact O-N 2.88Å; V108-K111 PolarHBondContact O-N 3.24Å; V108-L112 HydrophobicContact CG1-CD1 4.08Å; V108-L112 WeakPolarHBondContact O-CG 3.25Å; V108-L112 PolarHBondContact O-N 2.7Å; V108-R209 HydrophobicContact CG1-CB 3.82Å; V108-V212 HydrophobicContact CB-CG2 4.49Å; V108-V212 HydrophobicContact CG1-CB 4.29Å; V108-V212 HydrophobicContact CG1-CG2 3.9Å
109	L	94.3	Very high	92.2	Very high	12 Å²	12	57.2 Å²	57.2	6%	0.063	30%	0.303	C	S	.	.	H	α-helix	trans	-62.3	-44.2	176.2	-68.2	170.8	0	0	0	111.8	L101 T105 K106 K111 L112 I113 L121 V145 V212	L101-L109 HydrophobicContact CD2-CD1 3.78Å; T105-L109 HydrophobicContact CG2-CD1 4.34Å; T105-L109 WeakPolarHBondContact O-CG 3.42Å; T105-L109 PolarHBondContact O-N 2.99Å; K106-L109 PolarHBondContact O-N 2.91Å; L109-K111 VanDerWaalsContact C-N 3.31Å; L109-K111 PolarHBondContact O-N 2.74Å; L109-L112 HydrophobicContact CD2-CD1 4.48Å; L109-L112 WeakPolarHBondContact O-CB 3.33Å; L109-L112 PolarHBondContact O-N 3.2Å; L109-L112 VanDerWaalsContact O-N 3.12Å; L109-I113 WeakPolarHBondContact O-CG1 3.25Å; L109-I113 PolarHBondContact O-N 2.75Å; L109-L121 HydrophobicContact CD1-CD2 4.26Å; L109-V145 HydrophobicContact CD2-CG1 3.98Å; L109-V212 HydrophobicContact CD2-CG1 3.91Å; L109-V212 HydrophobicContact CD2-CG2 4.26Å
110	F	94	Very high	92.5	Very high	142 Å²	142	58.6 Å²	58.6	62%	0.623	31%	0.31	S	S	*	.	H	α-helix	trans	-59.8	-40.1	174.8	-79	-62	0	0	0	112.4	K106 L112 I113 A114	K106-F110 HydrophobicContact CB-CD2 4.42Å; K106-F110 HydrophobicContact CB-CE2 4.29Å; K106-F110 WeakPolarHBondContact O-CD2 3.38Å; K106-F110 PolarHBondContact O-N 3.38Å; F110-L112 VanDerWaalsContact C-N 3.35Å; F110-I113 PolarHBondContact O-N 2.89Å; F110-A114 VanDerWaalsContact O-CB 3.3Å; F110-A114 WeakPolarHBondContact O-CB 3.28Å; F110-A114 PolarHBondContact O-N 2.71Å
111	K	94.5	Very high	92.7	Very high	147 Å²	147	61.4 Å²	61.4	64%	0.639	33%	0.325	S	S	*	.	H	α-helix	trans	-64.8	-39.1	174.8	-75.5	176.4	-180	-179.3	0	112	V107 V108 L109 A114 S115	V107-K111 HydrophobicContact CG1-CD 4.35Å; V107-K111 WeakPolarHBondContact O-CG 3.21Å; V107-K111 PolarHBondContact O-N 3.26Å; V108-K111 PolarHBondContact O-N 3.24Å; L109-K111 VanDerWaalsContact C-N 3.31Å; L109-K111 PolarHBondContact O-N 2.74Å; K111-A114 PolarHBondContact O-N 3.49Å; K111-S115 WeakPolarHBondContact O-CB 3.47Å; K111-S115 PolarHBondContact O-N 3.23Å; K111-S115 PolarHBondContact O-OG 3.43Å; K111-S115 VanDerWaalsContact O-OG 3.09Å
112	L	93.8	Very high	92.8	Very high	5 Å²	5	64.4 Å²	64.4	3%	0.026	34%	0.338	C	S	.	.	H	α-helix	trans	-64	-42.9	176.4	-74.2	163.6	0	0	0	111.4	V108 L109 F110 S115 C116 H117 I118 R209 V212 I214	V108-L112 HydrophobicContact CG1-CD1 4.08Å; V108-L112 WeakPolarHBondContact O-CG 3.25Å; V108-L112 PolarHBondContact O-N 2.7Å; L109-L112 HydrophobicContact CD2-CD1 4.48Å; L109-L112 WeakPolarHBondContact O-CB 3.33Å; L109-L112 PolarHBondContact O-N 3.2Å; L109-L112 VanDerWaalsContact O-N 3.12Å; F110-L112 VanDerWaalsContact C-N 3.35Å; L112-S115 WeakPolarHBondContact CA-OG 3.21Å; L112-S115 PolarHBondContact O-N 3.08Å; L112-S115 PolarHBondContact O-OG 3.06Å; L112-C116 PolarHBondContact O-N 3.23Å; L112-H117 HydrophobicContact CD2-CB 4.39Å; L112-H117 PolarHBondContact O-N 2.72Å; L112-I118 HydrophobicContact CB-CD1 4.14Å; L112-R209 HydrophobicContact CD2-CG 3.9Å; L112-V212 HydrophobicContact CD1-CB 4.31Å; L112-V212 HydrophobicContact CD1-CG1 3.87Å; L112-I214 HydrophobicContact CD1-CD1 4.02Å; L112-I214 HydrophobicContact CD2-CD1 3.86Å; L112-I214 HydrophobicContact CG-CD1 4.37Å
113	I	94.5	Very high	92.7	Very high	62 Å²	62	66.7 Å²	66.7	32%	0.318	36%	0.362	S	S	.	.	H	α-helix	trans	-62.6	-47.9	173.7	-64.5	164.6	0	0	0	110.8	L109 F110 S115 C116 I118	L109-I113 WeakPolarHBondContact O-CG1 3.25Å; L109-I113 PolarHBondContact O-N 2.75Å; F110-I113 PolarHBondContact O-N 2.89Å; I113-S115 PolarHBondContact O-N 3.48Å; I113-C116 PolarHBondContact O-N 3.25Å; I113-I118 WeakPolarHBondContact CA-O 3.42Å; I113-I118 HydrophobicContact CG1-CB 4.03Å; I113-I118 HydrophobicContact CG1-CG2 4.05Å
114	A	93.3	Very high	92.8	Very high	84 Å²	84	66.9 Å²	66.9	69%	0.694	36%	0.364	S	S	*	.	H	α-helix	trans	-63.6	-26.7	178.7	0	0	0	0	0	113.4	F110 K111 C116	F110-A114 VanDerWaalsContact O-CB 3.3Å; F110-A114 WeakPolarHBondContact O-CB 3.28Å; F110-A114 PolarHBondContact O-N 2.71Å; K111-A114 PolarHBondContact O-N 3.49Å; A114-C116 VanDerWaalsContact C-N 3.26Å; A114-C116 PolarHBondContact O-N 3.23Å
115	S	90.5	Very high	92.8	Very high	56 Å²	56	64.9 Å²	64.9	39%	0.392	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	9	174.4	66.9	0	0	0	0	114.2	K111 L112 I113 H117	K111-S115 WeakPolarHBondContact O-CB 3.47Å; K111-S115 PolarHBondContact O-N 3.23Å; K111-S115 PolarHBondContact O-OG 3.43Å; K111-S115 VanDerWaalsContact O-OG 3.09Å; L112-S115 WeakPolarHBondContact CA-OG 3.21Å; L112-S115 PolarHBondContact O-N 3.08Å; L112-S115 PolarHBondContact O-OG 3.06Å; I113-S115 PolarHBondContact O-N 3.48Å; S115-H117 PolarHBondContact O-N 2.98Å; S115-H117 VanDerWaalsContact O-N 3.13Å; S115-H117 PolarHBondContact O-ND1 3.21Å; S115-H117 PolarHBondContact OG-ND1 2.96Å
116	C	88.1	Confident	92.7	Very high	97 Å²	97	67.6 Å²	67.6	66%	0.655	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.6	13.3	-179.1	-58.8	0	0	0	0	115.3	L112 I113 A114 I118	L112-C116 PolarHBondContact O-N 3.23Å; I113-C116 PolarHBondContact O-N 3.25Å; A114-C116 VanDerWaalsContact C-N 3.26Å; A114-C116 PolarHBondContact O-N 3.23Å; C116-I118 VanDerWaalsContact C-N 3.32Å
117	H	87.9	Confident	92.5	Very high	40 Å²	40	68.6 Å²	68.6	19%	0.185	39%	0.393	C	S	.	.	S	Bend	trans	-69.7	-33.5	172.1	-75	83.5	0	0	0	111.5	L112 S115 M143 I214 E440	L112-H117 HydrophobicContact CD2-CB 4.39Å; L112-H117 PolarHBondContact O-N 2.72Å; S115-H117 PolarHBondContact O-N 2.98Å; S115-H117 VanDerWaalsContact O-N 3.13Å; S115-H117 PolarHBondContact O-ND1 3.21Å; S115-H117 PolarHBondContact OG-ND1 2.96Å; H117-M143 VanDerWaalsContact O-CE 3.22Å; H117-M143 WeakPolarHBondContact O-CE 3.44Å; H117-I214 HydrophobicContact CB-CD1 4.36Å; H117-E440 IonicContact CE1-OE1 2.83Å; H117-E440 PolarHBondContact CE1-OE1 2.81Å; H117-E440 IonicContact NE2-OE1 3.96Å
118	I	92.5	Very high	92	Very high	2 Å²	2	66.7 Å²	66.7	1%	0.01	39%	0.388	C	S	.	.			trans	-127.2	130	178.5	-62.4	166	0	0	0	108.1	L112 I113 C116 A136 M143 V145 I214	L112-I118 HydrophobicContact CB-CD1 4.14Å; I113-I118 WeakPolarHBondContact CA-O 3.42Å; I113-I118 HydrophobicContact CG1-CB 4.03Å; I113-I118 HydrophobicContact CG1-CG2 4.05Å; C116-I118 VanDerWaalsContact C-N 3.32Å; I118-A136 HydrophobicContact CG1-CB 4.48Å; I118-A136 HydrophobicContact CG2-CB 3.89Å; I118-M143 HydrophobicContact CB-CE 4.35Å; I118-M143 HydrophobicContact CG1-CE 3.81Å; I118-V145 HydrophobicContact CD1-CG2 3.8Å; I118-V145 HydrophobicContact CG1-CG2 4.48Å; I118-I214 HydrophobicContact CD1-CD1 3.77Å; I118-I214 HydrophobicContact CD1-CG1 4.45Å; I118-I214 HydrophobicContact CG1-CD1 3.99Å
119	K	93.6	Very high	91.4	Very high	150 Å²	150	73.1 Å²	73.1	65%	0.652	41%	0.414	S	S	*	.	S	Bend	trans	-87.2	-53.6	174.2	-175.5	177.8	179.4	177.6	0	110.9	S137	K119-S137 WeakPolarHBondContact CA-O 3.41Å; K119-S137 WeakPolarHBondContact CB-O 3.46Å; K119-S137 PolarHBondContact N-O 3.3Å
120	T	94	Very high	91.1	Very high	63 Å²	63	73.4 Å²	73.4	39%	0.387	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	132.2	179.3	-44.9	0	0	0	0	109.3	A136 S137	T120-A136 CarbonylContact O-C 3.53Å; T120-A136 VanDerWaalsContact O-CA 3.25Å; T120-A136 WeakPolarHBondContact O-CA 3.23Å; T120-S137 WeakPolarHBondContact CB-OG 3.44Å; T120-S137 PolarHBondContact N-O 3.13Å; T120-S137 PolarHBondContact O-N 3.35Å
121	L	93.6	Very high	91	Very high	59 Å²	59	67 Å²	67	31%	0.309	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	123.2	170.5	-173	69.8	0	0	0	108	L109 A136 V145	L109-L121 HydrophobicContact CD1-CD2 4.26Å; L121-A136 HydrophobicContact CD1-CB 4.01Å; L121-V145 HydrophobicContact CD1-CB 4.28Å; L121-V145 HydrophobicContact CD1-CG2 4.08Å
122	H	93	Very high	91	Very high	85 Å²	85	60.1 Å²	60.1	39%	0.394	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	-155.3	-178.7	-58.5	-75.4	0	0	0	110.5	H135 S137	H122-H135 WeakPolarHBondContact CA-O 3.43Å; H122-H135 HydrophobicContact CB-CB 4.13Å; H122-H135 AromaticContact CD2-CE1 3.3Å; H122-H135 PolarHBondContact CD2-CE1 3.26Å; H122-H135 AromaticContact CD2-CG 3.89Å; H122-H135 AromaticContact CD2-ND1 3.18Å; H122-H135 PolarHBondContact CD2-ND1 3.41Å; H122-H135 AromaticContact CD2-NE2 3.98Å; H122-H135 AromaticContact CG-ND1 3.53Å; H122-H135 PolarHBondContact N-O 3.37Å; H122-H135 AromaticContact NE2-CE1 3.82Å; H122-S137 PolarHBondContact NE2-OG 3.2Å
123	G	90.2	Very high	91.1	Very high	52 Å²	52	61.4 Å²	61.4	54%	0.536	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	174.6	-178.8	0	0	0	0	0	115.1	H135	G123-H135 PolarHBondContact O-N 3.07Å
124	C	93	Very high	91.2	Very high	54 Å²	54	59 Å²	59	37%	0.365	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	127.6	174.9	-173.1	0	0	0	0	110.6	S126 T127 Y134	C124-S126 PolarHBondContact SG-O 3.11Å; C124-T127 VanDerWaalsContact SG-CG2 3.57Å; C124-Y134 HydrophobicContact CB-CD1 3.99Å; C124-Y134 HydrophobicContact CB-CE1 3.88Å
125	I	92.4	Very high	91.3	Very high	66 Å²	66	56.2 Å²	56.2	34%	0.338	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	-49.4	173.6	-62.1	166.4	0	0	0	109.6	V133 H135 L217 A224	I125-V133 HydrophobicContact CD1-CG1 4.24Å; I125-V133 PolarHBondContact N-O 3.46Å; I125-H135 HydrophobicContact CD1-CB 3.82Å; I125-H135 HydrophobicContact CG1-CB 3.87Å; I125-L217 HydrophobicContact CD1-CD1 3.6Å; I125-A224 HydrophobicContact CG2-CB 3.64Å
126	S	91.2	Very high	91.6	Very high	57 Å²	57	53.5 Å²	53.5	40%	0.399	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	136	-174.5	-175.5	0	0	0	0	110.9	C124 N132 V133	C124-S126 PolarHBondContact SG-O 3.11Å; S126-N132 WeakPolarHBondContact O-CA 3.47Å; S126-V133 PolarHBondContact N-O 3.09Å; S126-V133 PolarHBondContact O-N 2.93Å
127	T	90.2	Very high	91.9	Very high	104 Å²	104	50 Å²	50	64%	0.638	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.2	125.4	172.2	54.2	0	0	0	0	109	C124	C124-T127 VanDerWaalsContact SG-CG2 3.57Å
128	G	83.4	Confident	92.1	Very high	34 Å²	34	49.2 Å²	49.2	35%	0.351	28%	0.282	S	S	.	.			trans	-117.3	170.8	-177.3	0	0	0	0	0	112.6	E130 A131 Q149	G128-E130 PolarHBondContact O-N 3.28Å; G128-A131 WeakPolarHBondContact CA-O 3.45Å; G128-A131 PolarHBondContact N-O 3.14Å; G128-Q149 PolarHBondContact O-NE2 2.85Å
129	K	81.6	Confident	91.9	Very high	164 Å²	164	57.2 Å²	57.2	71%	0.713	32%	0.32	S	S	*	.	S	Bend	trans	-67.5	-21.7	174.5	-66	179.6	-177.7	173.1	0	112.9	Q149 T154	K129-Q149 PolarHBondContact O-OE1 3.43Å; K129-T154 PolarHBondContact O-OG1 3.31Å
130	E	87	Confident	91.6	Very high	18 Å²	18	57.8 Å²	57.8	8%	0.084	33%	0.325	C	S	.	.	S	Bend	trans	-120.3	-27.2	-172.9	-58.3	-174.4	166.1	0	0	113.4	G128 Y148 Q149 F155 W184 Q282	G128-E130 PolarHBondContact O-N 3.28Å; E130-Y148 WeakPolarHBondContact O-CA 3.43Å; E130-Q149 PolarHBondContact O-N 3.08Å; E130-F155 HydrophobicContact CG-CB 3.94Å; E130-F155 HydrophobicContact CG-CD1 4.39Å; E130-F155 HydrophobicContact CG-CG 4.22Å; E130-F155 WeakPolarHBondContact OE1-CD1 3.43Å; E130-F155 VanDerWaalsContact OE1-CE1 3.27Å; E130-F155 WeakPolarHBondContact OE1-CE1 3.11Å; E130-F155 VanDerWaalsContact OE1-CG 3.28Å; E130-F155 WeakPolarHBondContact OE1-CG 3.5Å; E130-W184 WeakPolarHBondContact OE2-CZ3 3.44Å; E130-Q282 PolarHBondContact OE1-NE2 3.06Å
131	A	93.2	Very high	91.5	Very high	8 Å²	8	56.5 Å²	56.5	7%	0.066	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	155.5	-175.3	0	0	0	0	0	110.7	G128 K146 V147 Y148	G128-A131 WeakPolarHBondContact CA-O 3.45Å; G128-A131 PolarHBondContact N-O 3.14Å; A131-K146 HydrophobicContact CB-CD 4.42Å; A131-K146 HydrophobicContact CB-CG 3.79Å; A131-V147 CarbonylContact C-O 3.49Å; A131-V147 WeakPolarHBondContact CA-O 3.33Å; A131-V147 WeakPolarHBondContact CB-O 3.41Å; A131-Y148 HydrophobicContact CB-CD1 3.84Å; A131-Y148 HydrophobicContact CB-CE1 4.33Å; A131-Y148 HydrophobicContact CB-CG 4.09Å
132	N	94.8	Very high	91.5	Very high	3 Å²	3	56.5 Å²	56.5	2%	0.016	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	146.4	165	-63.2	-7.4	0	0	0	108.9	E98 V100 S126 Y134 K146 V147	E98-N132 PolarHBondContact O-ND2 3.34Å; V100-N132 HydrophobicContact CG1-CB 4.24Å; V100-N132 HydrophobicContact CG2-CB 4.11Å; S126-N132 WeakPolarHBondContact O-CA 3.47Å; N132-Y134 HydrophobicContact CB-CD2 4.45Å; N132-Y134 HydrophobicContact CB-CE2 3.64Å; N132-Y134 PolarHBondContact ND2-OH 3.4Å; N132-K146 CarbonylContact O-C 3.53Å; N132-K146 WeakPolarHBondContact O-CA 3.32Å; N132-V147 PolarHBondContact N-O 2.97Å; N132-V147 PolarHBondContact O-N 3.18Å
133	V	95.3	Very high	91.6	Very high	32 Å²	32	52.7 Å²	52.7	19%	0.194	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	124.8	177	-174.1	0	0	0	0	108.4	I125 S126 A144 V145 K146	I125-V133 HydrophobicContact CD1-CG1 4.24Å; I125-V133 PolarHBondContact N-O 3.46Å; S126-V133 PolarHBondContact N-O 3.09Å; S126-V133 PolarHBondContact O-N 2.93Å; V133-A144 HydrophobicContact CG1-CB 3.89Å; V133-V145 WeakPolarHBondContact CA-O 3.35Å; V133-K146 HydrophobicContact CG2-CB 4.3Å; V133-K146 HydrophobicContact CG2-CG 4.1Å
134	Y	95.9	Very high	91.9	Very high	10 Å²	10	50.5 Å²	50.5	4%	0.039	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	148.4	179.3	-61.1	-92.6	0	0	0	110.7	E98 V100 C124 N132 A144 V145 V147	E98-Y134 WeakPolarHBondContact OE2-CE1 3.27Å; E98-Y134 VanDerWaalsContact OE2-CZ 3.3Å; E98-Y134 PolarHBondContact OE2-OH 3.2Å; V100-Y134 HydrophobicContact CG2-CE2 4.04Å; V100-Y134 VanDerWaalsContact CG2-OH 3.3Å; V100-Y134 WeakPolarHBondContact CG2-OH 3.49Å; C124-Y134 HydrophobicContact CB-CD1 3.99Å; C124-Y134 HydrophobicContact CB-CE1 3.88Å; N132-Y134 HydrophobicContact CB-CD2 4.45Å; N132-Y134 HydrophobicContact CB-CE2 3.64Å; N132-Y134 PolarHBondContact ND2-OH 3.4Å; Y134-A144 WeakPolarHBondContact O-CA 3.3Å; Y134-V145 PolarHBondContact N-O 2.83Å; Y134-V145 PolarHBondContact O-N 2.95Å; Y134-V147 HydrophobicContact CD2-CG2 3.9Å; Y134-V147 HydrophobicContact CE2-CB 4.17Å; Y134-V147 HydrophobicContact CE2-CG2 3.93Å
135	H	96.4	Very high	92.1	Very high	26 Å²	26	48 Å²	48	12%	0.12	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	138	169.6	172.4	-135.2	0	0	0	109.7	H122 G123 I125 D142	H122-H135 WeakPolarHBondContact CA-O 3.43Å; H122-H135 HydrophobicContact CB-CB 4.13Å; H122-H135 AromaticContact CD2-CE1 3.3Å; H122-H135 PolarHBondContact CD2-CE1 3.26Å; H122-H135 AromaticContact CD2-CG 3.89Å; H122-H135 AromaticContact CD2-ND1 3.18Å; H122-H135 PolarHBondContact CD2-ND1 3.41Å; H122-H135 AromaticContact CD2-NE2 3.98Å; H122-H135 AromaticContact CG-ND1 3.53Å; H122-H135 PolarHBondContact N-O 3.37Å; H122-H135 AromaticContact NE2-CE1 3.82Å; G123-H135 PolarHBondContact O-N 3.07Å; I125-H135 HydrophobicContact CD1-CB 3.82Å; I125-H135 HydrophobicContact CG1-CB 3.87Å; H135-D142 IonicContact CD2-OD1 2.74Å; H135-D142 IonicContact CE1-OD1 2.89Å; H135-D142 IonicContact NE2-OD1 3.97Å; H135-D142 PolarHBondContact NE2-OD1 2.87Å; H135-D142 IonicContact NE2-OD2 3.66Å
136	A	95.6	Very high	92.3	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	145.7	173.4	0	0	0	0	0	110.2	I118 T120 L121 M143 V145	I118-A136 HydrophobicContact CG1-CB 4.48Å; I118-A136 HydrophobicContact CG2-CB 3.89Å; T120-A136 CarbonylContact O-C 3.53Å; T120-A136 VanDerWaalsContact O-CA 3.25Å; T120-A136 WeakPolarHBondContact O-CA 3.23Å; L121-A136 HydrophobicContact CD1-CB 4.01Å; A136-M143 HydrophobicContact CB-CB 4.44Å; A136-M143 HydrophobicContact CB-CE 4.08Å; A136-M143 PolarHBondContact N-O 3.25Å; A136-M143 PolarHBondContact O-N 3.21Å; A136-V145 HydrophobicContact CB-CG2 3.62Å
137	S	94.4	Very high	92.5	Very high	24 Å²	24	42.9 Å²	42.9	17%	0.168	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	143.1	169.6	59.7	0	0	0	0	110.9	K119 T120 H122	K119-S137 WeakPolarHBondContact CA-O 3.41Å; K119-S137 WeakPolarHBondContact CB-O 3.46Å; K119-S137 PolarHBondContact N-O 3.3Å; T120-S137 WeakPolarHBondContact CB-OG 3.44Å; T120-S137 PolarHBondContact N-O 3.13Å; T120-S137 PolarHBondContact O-N 3.35Å; H122-S137 PolarHBondContact NE2-OG 3.2Å
138	S	92.8	Very high	92.7	Very high	22 Å²	22	37.9 Å²	37.9	15%	0.154	20%	0.204	C	C	.	.			trans	-122.6	-176.4	169.2	74.4	0	0	0	0	111.1	E140 G141 M143	S138-E140 VanDerWaalsContact C-N 3.28Å; S138-E140 PolarHBondContact OG-N 3.19Å; S138-G141 PolarHBondContact N-O 3.48Å; S138-G141 PolarHBondContact OG-N 2.96Å; S138-G141 PolarHBondContact OG-O 3.48Å; S138-M143 VanDerWaalsContact CB-CE 3.49Å
139	E	89.3	Confident	93	Very high	171 Å²	171	36.8 Å²	36.8	80%	0.799	19%	0.19	S	C	*	.	S	Bend	trans	-68.2	-27.3	168.6	-61.4	-175.4	173	0	0	112.6
140	E	87.2	Confident	93.4	Very high	162 Å²	162	29.3 Å²	29.3	76%	0.757	16%	0.158	S	C	*	.	S	Bend	trans	-86.3	-10.3	-179.9	-63.6	-171.1	179.3	0	0	113.4	S138 K204	S138-E140 VanDerWaalsContact C-N 3.28Å; S138-E140 PolarHBondContact OG-N 3.19Å; E140-K204 IonicContact OE2-NZ 3.23Å
141	G	90.5	Very high	93	Very high	35 Å²	35	31.4 Å²	31.4	36%	0.361	18%	0.175	S	C	.	.	S	Bend	trans	128.1	-161.5	-176.1	0	0	0	0	0	113.6	S138	S138-G141 PolarHBondContact N-O 3.48Å; S138-G141 PolarHBondContact OG-N 2.96Å; S138-G141 PolarHBondContact OG-O 3.48Å
142	D	94	Very high	92.4	Very high	59 Å²	59	35.1 Å²	35.1	32%	0.316	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	141.4	-177.1	-72.8	-39	0	0	0	113.4	H135 L217 G222	H135-D142 IonicContact CD2-OD1 2.74Å; H135-D142 IonicContact CE1-OD1 2.89Å; H135-D142 IonicContact NE2-OD1 3.97Å; H135-D142 PolarHBondContact NE2-OD1 2.87Å; H135-D142 IonicContact NE2-OD2 3.66Å; D142-L217 HydrophobicContact CB-CB 3.92Å; D142-L217 HydrophobicContact CB-CD2 3.89Å; D142-L217 PolarHBondContact O-N 3.5Å; D142-L217 VanDerWaalsContact O-N 3.11Å; D142-G222 WeakPolarHBondContact OD2-CA 3.46Å; D142-G222 PolarHBondContact OD2-N 3.34Å
143	M	95.5	Very high	91.7	Very high	5 Å²	5	37.2 Å²	37.2	3%	0.025	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	154.2	-177.7	-60.4	179.4	-55.4	0	0	111.3	H117 I118 A136 S138 I206 I214 M215	H117-M143 VanDerWaalsContact O-CE 3.22Å; H117-M143 WeakPolarHBondContact O-CE 3.44Å; I118-M143 HydrophobicContact CB-CE 4.35Å; I118-M143 HydrophobicContact CG1-CE 3.81Å; A136-M143 HydrophobicContact CB-CB 4.44Å; A136-M143 HydrophobicContact CB-CE 4.08Å; A136-M143 PolarHBondContact N-O 3.25Å; A136-M143 PolarHBondContact O-N 3.21Å; S138-M143 VanDerWaalsContact CB-CE 3.49Å; M143-I206 HydrophobicContact CG-CD1 3.75Å; M143-I206 HydrophobicContact SD-CD1 3.53Å; M143-I206 VanDerWaalsContact SD-CD1 3.53Å; M143-I214 HydrophobicContact CB-CG2 4.26Å; M143-I214 HydrophobicContact CE-CG2 4.4Å; M143-I214 HydrophobicContact SD-CG2 3.81Å; M143-M215 CarbonylContact C-O 3.56Å; M143-M215 WeakPolarHBondContact CA-O 3.46Å; M143-M215 WeakPolarHBondContact CB-O 3.29Å
144	A	96.4	Very high	90.7	Very high	7 Å²	7	39.7 Å²	39.7	6%	0.058	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	128	169.5	0	0	0	0	0	109.9	V133 Y134 I214 M215 L217	V133-A144 HydrophobicContact CG1-CB 3.89Å; Y134-A144 WeakPolarHBondContact O-CA 3.3Å; A144-I214 WeakPolarHBondContact O-CA 3.37Å; A144-M215 HydrophobicContact CB-CG 3.96Å; A144-M215 PolarHBondContact N-O 2.96Å; A144-M215 PolarHBondContact O-N 3.17Å; A144-L217 HydrophobicContact CB-CD1 4.07Å
145	V	96.4	Very high	89.4	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	102.2	176.7	-176.5	0	0	0	0	108.7	L109 I118 L121 V133 Y134 A136 V147 V212 I214	L109-V145 HydrophobicContact CD2-CG1 3.98Å; I118-V145 HydrophobicContact CD1-CG2 3.8Å; I118-V145 HydrophobicContact CG1-CG2 4.48Å; L121-V145 HydrophobicContact CD1-CB 4.28Å; L121-V145 HydrophobicContact CD1-CG2 4.08Å; V133-V145 WeakPolarHBondContact CA-O 3.35Å; Y134-V145 PolarHBondContact N-O 2.83Å; Y134-V145 PolarHBondContact O-N 2.95Å; A136-V145 HydrophobicContact CB-CG2 3.62Å; V145-V147 HydrophobicContact CG1-CG2 4.06Å; V145-V212 HydrophobicContact CG1-CG1 3.59Å; V145-I214 HydrophobicContact CG2-CG1 4.42Å
146	K	96.2	Very high	88.1	Confident	16 Å²	16	48.4 Å²	48.4	7%	0.07	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	116.3	176.3	-171.6	171.7	-174.4	-179.3	0	109.7	A131 N132 V133 Y148 E188 F213 M215 D279	A131-K146 HydrophobicContact CB-CD 4.42Å; A131-K146 HydrophobicContact CB-CG 3.79Å; N132-K146 CarbonylContact O-C 3.53Å; N132-K146 WeakPolarHBondContact O-CA 3.32Å; V133-K146 HydrophobicContact CG2-CB 4.3Å; V133-K146 HydrophobicContact CG2-CG 4.1Å; K146-Y148 HydrophobicContact CG-CE2 4.32Å; K146-E188 IonicContact NZ-OE1 3.97Å; K146-E188 PolarHBondContact NZ-OE1 3.33Å; K146-E188 IonicContact NZ-OE2 3.13Å; K146-E188 PolarHBondContact NZ-OE2 2.9Å; K146-F213 HydrophobicContact CB-CB 4.46Å; K146-F213 PolarHBondContact N-O 3.07Å; K146-F213 PolarHBondContact O-N 3.27Å; K146-M215 HydrophobicContact CB-CE 3.84Å; K146-M215 HydrophobicContact CD-CE 4.15Å; K146-D279 IonicContact NZ-OD1 3.94Å; K146-D279 PolarHBondContact NZ-OD1 3.48Å; K146-D279 IonicContact NZ-OD2 2.9Å
147	V	95.9	Very high	87.2	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	115.9	179.6	-174.3	0	0	0	0	108.9	V100 T105 A131 N132 Y134 V145 V212	V100-V147 HydrophobicContact CB-CB 4.36Å; V100-V147 HydrophobicContact CB-CG1 3.82Å; V100-V147 HydrophobicContact CG2-CB 4.12Å; V100-V147 HydrophobicContact CG2-CG1 3.89Å; T105-V147 HydrophobicContact CG2-CG1 3.54Å; A131-V147 CarbonylContact C-O 3.49Å; A131-V147 WeakPolarHBondContact CA-O 3.33Å; A131-V147 WeakPolarHBondContact CB-O 3.41Å; N132-V147 PolarHBondContact N-O 2.97Å; N132-V147 PolarHBondContact O-N 3.18Å; Y134-V147 HydrophobicContact CD2-CG2 3.9Å; Y134-V147 HydrophobicContact CE2-CB 4.17Å; Y134-V147 HydrophobicContact CE2-CG2 3.93Å; V145-V147 HydrophobicContact CG1-CG2 4.06Å; V147-V212 HydrophobicContact CG1-CG2 4.46Å; V147-V212 HydrophobicContact CG2-CG1 4.4Å; V147-V212 HydrophobicContact CG2-CG2 4.42Å
148	Y	94.1	Very high	86.4	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	144.1	-178.6	-61	-99.3	0	0	0	112.2	E130 A131 K146 T150 V181 A185 E188 N211 F213	E130-Y148 WeakPolarHBondContact O-CA 3.43Å; A131-Y148 HydrophobicContact CB-CD1 3.84Å; A131-Y148 HydrophobicContact CB-CE1 4.33Å; A131-Y148 HydrophobicContact CB-CG 4.09Å; K146-Y148 HydrophobicContact CG-CE2 4.32Å; Y148-T150 PolarHBondContact O-N 3.36Å; Y148-V181 HydrophobicContact CG-CG1 4.26Å; Y148-A185 HydrophobicContact CD2-CB 3.65Å; Y148-A185 HydrophobicContact CE2-CB 3.36Å; Y148-E188 VanDerWaalsContact OH-CB 3.3Å; Y148-E188 WeakPolarHBondContact OH-CB 3.49Å; Y148-E188 PolarHBondContact OH-OE2 2.87Å; Y148-N211 WeakPolarHBondContact CD2-O 3.17Å; Y148-N211 PolarHBondContact N-O 2.93Å; Y148-N211 PolarHBondContact O-ND2 3.14Å; Y148-F213 HydrophobicContact CE2-CB 4.25Å
149	Q	91.4	Very high	86	Confident	10 Å²	10	52.2 Å²	52.2	5%	0.047	27%	0.273	C	S	.	.			trans	-64	128.5	172.9	-68.8	175.7	1.3	0	0	110.4	S99 V100 G128 K129 E130 I152 L153 V181	S99-Q149 PolarHBondContact OG-NE2 3.26Å; V100-Q149 HydrophobicContact CG1-CB 4.32Å; V100-Q149 HydrophobicContact CG1-CG 3.45Å; V100-Q149 VanDerWaalsContact CG1-CG 3.45Å; G128-Q149 PolarHBondContact O-NE2 2.85Å; K129-Q149 PolarHBondContact O-OE1 3.43Å; E130-Q149 PolarHBondContact O-N 3.08Å; Q149-I152 PolarHBondContact OE1-O 2.87Å; Q149-L153 WeakPolarHBondContact O-CD2 3.44Å; Q149-V181 VanDerWaalsContact O-CG2 3.27Å; Q149-V181 WeakPolarHBondContact O-CG2 3.37Å
150	T	88.1	Confident	85.8	Confident	7 Å²	7	49 Å²	49	4%	0.043	25%	0.254	C	S	.	.	S	Bend	trans	-108.8	-50.1	-179.3	53.2	0	0	0	0	112.4	Y148 V181 N211	Y148-T150 PolarHBondContact O-N 3.36Å; T150-V181 HydrophobicContact CG2-CB 4.38Å; T150-V181 HydrophobicContact CG2-CG1 4.01Å; T150-N211 HydrophobicContact CG2-CB 3.89Å; T150-N211 WeakPolarHBondContact CG2-ND2 3.5Å
151	S	80.6	Confident	85.7	Confident	62 Å²	62	41.7 Å²	41.7	43%	0.434	22%	0.219	S	C	.	.	S	Bend	trans	-87.7	-40.9	-174.5	-57	0	0	0	0	112.8
152	I	80.4	Confident	85.3	Confident	87 Å²	87	40.4 Å²	40.4	45%	0.446	20%	0.204	S	C	.	.			trans	-102.5	84.9	-177.3	-52.7	177.9	0	0	0	108.1	Q149 T154	Q149-I152 PolarHBondContact OE1-O 2.87Å; I152-T154 HydrophobicContact CG2-CG2 4.42Å; I152-T154 PolarHBondContact O-N 2.97Å
153	L	79.4	Confident	84.6	Confident	46 Å²	46	42.3 Å²	42.3	24%	0.241	21%	0.213	C	C	.	.			trans	-87.8	98.1	179	-64.8	-178.8	0	0	0	110.5	Q149 C177 V181	Q149-L153 WeakPolarHBondContact O-CD2 3.44Å; L153-C177 HydrophobicContact CD1-CB 3.78Å; L153-C177 VanDerWaalsContact CD1-SG 3.56Å; L153-V181 HydrophobicContact CD2-CG2 4.06Å
154	T	74.8	Confident	83.8	Confident	84 Å²	84	43.7 Å²	43.7	52%	0.515	23%	0.229	S	C	.	.			trans	-76	-34.4	173.1	66.2	0	0	0	0	111.7	K129 I152	K129-T154 PolarHBondContact O-OG1 3.31Å; I152-T154 HydrophobicContact CG2-CG2 4.42Å; I152-T154 PolarHBondContact O-N 2.97Å
155	F	68.2	Low	83.3	Confident	46 Å²	46	43.4 Å²	43.4	20%	0.202	23%	0.227	C	C	.	.			trans	-91.4	108.4	-179	-170.2	-105.9	0	0	0	112.4	E130 D157 R158 Y161 W184	E130-F155 HydrophobicContact CG-CB 3.94Å; E130-F155 HydrophobicContact CG-CD1 4.39Å; E130-F155 HydrophobicContact CG-CG 4.22Å; E130-F155 WeakPolarHBondContact OE1-CD1 3.43Å; E130-F155 VanDerWaalsContact OE1-CE1 3.27Å; E130-F155 WeakPolarHBondContact OE1-CE1 3.11Å; E130-F155 VanDerWaalsContact OE1-CG 3.28Å; E130-F155 WeakPolarHBondContact OE1-CG 3.5Å; F155-D157 HydrophobicContact CE2-CB 4.49Å; F155-D157 HydrophobicContact CZ-CB 4.18Å; F155-R158 HydrophobicContact CD1-CG 3.52Å; F155-R158 HydrophobicContact CE1-CG 3.85Å; F155-R158 PolarHBondContact O-NE 3.39Å; F155-R158 VanDerWaalsContact O-NE 3.09Å; F155-Y161 HydrophobicContact CE1-CE2 4.44Å; F155-Y161 HydrophobicContact CZ-CE2 4.16Å; F155-W184 AromaticContact CD1-CH2 3.94Å; F155-W184 HydrophobicContact CD1-CH2 3.94Å; F155-W184 HydrophobicContact CD1-CZ3 4.39Å; F155-W184 AromaticContact CE1-CH2 3.95Å; F155-W184 HydrophobicContact CE1-CH2 3.95Å
156	K	68.6	Low	82.6	Confident	174 Å²	174	49 Å²	49	76%	0.757	25%	0.252	S	S	*	.			trans	-95.6	-23.2	-176.3	-66.2	-178.2	180	177.5	0	114.2	R158	K156-R158 PolarHBondContact O-N 3.41Å
157	D	76.2	Confident	82	Confident	89 Å²	89	50.8 Å²	50.8	48%	0.476	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-86.4	36.4	-171.4	-78	-0.2	0	0	0	114.3	F155 D159 R160	F155-D157 HydrophobicContact CE2-CB 4.49Å; F155-D157 HydrophobicContact CZ-CB 4.18Å; D157-D159 PolarHBondContact O-N 3.16Å; D157-R160 WeakPolarHBondContact O-CG 3.43Å; D157-R160 PolarHBondContact O-NE 3.13Å; D157-R160 IonicContact OD2-CZ 3.85Å; D157-R160 IonicContact OD2-NH2 3.47Å; D157-R160 PolarHBondContact OD2-NH2 3.28Å
158	R	79.3	Confident	81.3	Confident	4 Å²	4	51.4 Å²	51.4	2%	0.015	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-65.3	-30.9	-179.4	-62.3	-160.6	174.7	-157.8	-3.1	112.8	F155 K156 R160 Y161 L162 W184	F155-R158 HydrophobicContact CD1-CG 3.52Å; F155-R158 HydrophobicContact CE1-CG 3.85Å; F155-R158 PolarHBondContact O-NE 3.39Å; F155-R158 VanDerWaalsContact O-NE 3.09Å; K156-R158 PolarHBondContact O-N 3.41Å; R158-R160 VanDerWaalsContact C-N 3.26Å; R158-R160 PolarHBondContact O-N 3.14Å; R158-Y161 PolarHBondContact O-N 2.93Å; R158-L162 HydrophobicContact CB-CD1 4.17Å; R158-L162 WeakPolarHBondContact O-CG 3.1Å; R158-W184 HydrophobicContact CB-CH2 3.71Å; R158-W184 HydrophobicContact CB-CZ2 3.23Å; R158-W184 VanDerWaalsContact CD-CZ2 3.41Å; R158-W184 HydrophobicContact CG-CH2 3.22Å; R158-W184 HydrophobicContact CG-CZ2 3.31Å; R158-W184 HydrophobicContact CG-CZ3 3.96Å
159	D	82.5	Confident	80.4	Confident	33 Å²	33	59.2 Å²	59.2	18%	0.176	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-61.1	-34	-169.7	-69.2	-14.6	0	0	0	112.8	D157 Y161 L162 L163 Y172 R174	D157-D159 PolarHBondContact O-N 3.16Å; D159-Y161 PolarHBondContact O-N 2.87Å; D159-Y161 VanDerWaalsContact O-N 3.15Å; D159-L162 PolarHBondContact O-N 3.11Å; D159-L162 VanDerWaalsContact O-N 3.14Å; D159-L163 HydrophobicContact CB-CD1 3.77Å; D159-L163 HydrophobicContact CB-CG 4.1Å; D159-L163 VanDerWaalsContact O-CB 3.23Å; D159-L163 WeakPolarHBondContact O-CB 3.39Å; D159-L163 VanDerWaalsContact O-CG 3.29Å; D159-L163 WeakPolarHBondContact O-CG 3.39Å; D159-L163 PolarHBondContact O-N 2.88Å; D159-Y172 PolarHBondContact OD1-OH 2.67Å; D159-R174 IonicContact OD1-NH1 3.92Å; D159-R174 IonicContact OD2-CZ 2.72Å; D159-R174 IonicContact OD2-NH1 3.97Å; D159-R174 PolarHBondContact OD2-NH1 3.33Å; D159-R174 IonicContact OD2-NH2 3.03Å; D159-R174 PolarHBondContact OD2-NH2 2.86Å; D159-R174 VanDerWaalsContact OD2-NH2 3.13Å
160	R	86.3	Confident	79.5	Confident	103 Å²	103	68.3 Å²	68.3	39%	0.389	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-62	-24.1	-178.7	75.9	179	78.2	-169.8	1.9	114.1	D157 R158 H288 F294	D157-R160 WeakPolarHBondContact O-CG 3.43Å; D157-R160 PolarHBondContact O-NE 3.13Å; D157-R160 IonicContact OD2-CZ 3.85Å; D157-R160 IonicContact OD2-NH2 3.47Å; D157-R160 PolarHBondContact OD2-NH2 3.28Å; R158-R160 VanDerWaalsContact C-N 3.26Å; R158-R160 PolarHBondContact O-N 3.14Å; R160-H288 PolarHBondContact O-CE1 2.79Å; R160-H288 VanDerWaalsContact O-CE1 3.3Å; R160-F294 HydrophobicContact CG-CZ 4.47Å
161	Y	84.4	Confident	78.5	Confident	9 Å²	9	71 Å²	71	4%	0.035	35%	0.354	C	S	.	.	G	3₁₀ helix	trans	-102.6	-2.9	-177.7	-54	-61.7	0	0	0	113.2	F155 R158 D159 K187 A261 Q282 F294	F155-Y161 HydrophobicContact CE1-CE2 4.44Å; F155-Y161 HydrophobicContact CZ-CE2 4.16Å; R158-Y161 PolarHBondContact O-N 2.93Å; D159-Y161 PolarHBondContact O-N 2.87Å; D159-Y161 VanDerWaalsContact O-N 3.15Å; Y161-K187 PolarHBondContact O-NZ 3.17Å; Y161-A261 HydrophobicContact CD1-CB 4.36Å; Y161-A261 HydrophobicContact CE1-CB 4.2Å; Y161-Q282 HydrophobicContact CD1-CB 4.12Å; Y161-Q282 HydrophobicContact CD2-CB 4.08Å; Y161-Q282 HydrophobicContact CD2-CG 3.88Å; Y161-Q282 HydrophobicContact CE1-CB 4.25Å; Y161-Q282 HydrophobicContact CE2-CB 4.17Å; Y161-Q282 HydrophobicContact CE2-CG 3.85Å; Y161-Q282 HydrophobicContact CG-CB 4.03Å; Y161-Q282 HydrophobicContact CG-CG 4.34Å; Y161-Q282 PolarHBondContact OH-OE1 3.44Å; Y161-F294 HydrophobicContact CD1-CE1 4.42Å; Y161-F294 AromaticContact CD1-CE2 3.98Å; Y161-F294 HydrophobicContact CD1-CE2 3.98Å; Y161-F294 AromaticContact CD1-CZ 3.79Å; Y161-F294 HydrophobicContact CD1-CZ 3.79Å; Y161-F294 AromaticContact CE1-CE1 3.88Å; Y161-F294 HydrophobicContact CE1-CE1 3.88Å; Y161-F294 HydrophobicContact CE1-CE2 4.24Å; Y161-F294 AromaticContact CE1-CZ 3.7Å; Y161-F294 HydrophobicContact CE1-CZ 3.7Å
162	L	82.1	Confident	78.2	Confident	7 Å²	7	70.5 Å²	70.5	4%	0.037	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.6	-39.7	-175.7	-57.3	168.5	0	0	0	111.6	R158 D159 G164 D165 L168 Y172 L180 W184 K187	R158-L162 HydrophobicContact CB-CD1 4.17Å; R158-L162 WeakPolarHBondContact O-CG 3.1Å; D159-L162 PolarHBondContact O-N 3.11Å; D159-L162 VanDerWaalsContact O-N 3.14Å; L162-G164 PolarHBondContact O-N 3.23Å; L162-D165 PolarHBondContact O-N 3.04Å; L162-D165 VanDerWaalsContact O-N 3.15Å; L162-L168 HydrophobicContact CB-CD1 4.46Å; L162-L168 HydrophobicContact CD2-CD1 3.41Å; L162-L168 VanDerWaalsContact CD2-CD1 3.41Å; L162-Y172 HydrophobicContact CB-CE2 4.26Å; L162-Y172 HydrophobicContact CD1-CD2 4.31Å; L162-Y172 HydrophobicContact CD1-CE2 3.62Å; L162-L180 HydrophobicContact CD1-CD1 3.84Å; L162-W184 HydrophobicContact CD1-CZ2 4.17Å; L162-W184 HydrophobicContact CG-CZ2 4.47Å; L162-K187 HydrophobicContact CD2-CD 4.2Å
163	L	80	Confident	78	Confident	99 Å²	99	68.6 Å²	68.6	52%	0.518	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	98.5	177.6	-66.6	179.9	0	0	0	109.3	D159 Y172 H288	D159-L163 HydrophobicContact CB-CD1 3.77Å; D159-L163 HydrophobicContact CB-CG 4.1Å; D159-L163 VanDerWaalsContact O-CB 3.23Å; D159-L163 WeakPolarHBondContact O-CB 3.39Å; D159-L163 VanDerWaalsContact O-CG 3.29Å; D159-L163 WeakPolarHBondContact O-CG 3.39Å; D159-L163 PolarHBondContact O-N 2.88Å; L163-Y172 HydrophobicContact CD2-CE1 4.48Å; L163-H288 PolarHBondContact O-NE2 3.36Å; L163-H288 VanDerWaalsContact O-NE2 3.09Å
164	G	79.4	Confident	77.8	Confident	35 Å²	35	73.1 Å²	73.1	36%	0.361	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	127.9	-20.6	-178.1	0	0	0	0	0	112.7	L162 F166	L162-G164 PolarHBondContact O-N 3.23Å; G164-F166 PolarHBondContact O-N 3.33Å
165	D	85.1	Confident	78	Confident	1 Å²	1	77.5 Å²	77.5	1%	0.005	37%	0.365	C	S	.	.			trans	-69.5	115.2	175.1	-169.1	-35.4	0	0	0	109.6	L162 R167 L168 R169	L162-D165 PolarHBondContact O-N 3.04Å; L162-D165 VanDerWaalsContact O-N 3.15Å; D165-R167 PolarHBondContact O-N 2.9Å; D165-R167 WeakPolarHBondContact OD1-CB 3.38Å; D165-R167 VanDerWaalsContact OD1-CG 3.31Å; D165-R167 WeakPolarHBondContact OD1-CG 3.32Å; D165-R167 IonicContact OD1-CZ 2.75Å; D165-R167 PolarHBondContact OD1-N 2.78Å; D165-R167 IonicContact OD1-NE 3.42Å; D165-R167 PolarHBondContact OD1-NE 2.74Å; D165-R167 IonicContact OD1-NH2 3.77Å; D165-R167 IonicContact OD2-CZ 2.99Å; D165-R167 IonicContact OD2-NE 3.4Å; D165-R167 PolarHBondContact OD2-NE 3.2Å; D165-R167 IonicContact OD2-NH2 2.91Å; D165-R167 PolarHBondContact OD2-NH2 2.88Å; D165-L168 HydrophobicContact CB-CB 4.48Å; D165-L168 HydrophobicContact CB-CD1 4.21Å; D165-L168 HydrophobicContact CB-CG 4.18Å; D165-L168 PolarHBondContact O-N 3.46Å; D165-L168 VanDerWaalsContact O-N 3.12Å; D165-R169 PolarHBondContact O-N 2.92Å
166	F	81.7	Confident	78.8	Confident	118 Å²	118	77.9 Å²	77.9	52%	0.518	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-58.1	-33.8	-178.5	179.3	-136.1	0	0	0	112.7	G164 L168 R169	G164-F166 PolarHBondContact O-N 3.33Å; F166-L168 PolarHBondContact O-N 2.83Å; F166-R169 VanDerWaalsContact CD2-NE 3.25Å; F166-R169 VanDerWaalsContact CG-NH2 3.34Å; F166-R169 PolarHBondContact O-N 3.23Å
167	R	83.5	Confident	79.6	Confident	53 Å²	53	72 Å²	72	20%	0.2	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-65.4	-24.1	-176.8	-54.8	175.5	-68.3	179	-0.6	112.1	D165 N191 E285	D165-R167 PolarHBondContact O-N 2.9Å; D165-R167 WeakPolarHBondContact OD1-CB 3.38Å; D165-R167 VanDerWaalsContact OD1-CG 3.31Å; D165-R167 WeakPolarHBondContact OD1-CG 3.32Å; D165-R167 IonicContact OD1-CZ 2.75Å; D165-R167 PolarHBondContact OD1-N 2.78Å; D165-R167 IonicContact OD1-NE 3.42Å; D165-R167 PolarHBondContact OD1-NE 2.74Å; D165-R167 IonicContact OD1-NH2 3.77Å; D165-R167 IonicContact OD2-CZ 2.99Å; D165-R167 IonicContact OD2-NE 3.4Å; D165-R167 PolarHBondContact OD2-NE 3.2Å; D165-R167 IonicContact OD2-NH2 2.91Å; D165-R167 PolarHBondContact OD2-NH2 2.88Å; R167-N191 PolarHBondContact NH1-OD1 3.43Å; R167-N191 PolarHBondContact NH2-OD1 2.96Å; R167-E285 VanDerWaalsContact CD-OE1 3.27Å; R167-E285 WeakPolarHBondContact CD-OE1 3.37Å; R167-E285 IonicContact CZ-OE1 2.9Å; R167-E285 IonicContact NE-OE1 3.91Å; R167-E285 PolarHBondContact NE-OE1 3.15Å; R167-E285 IonicContact NE-OE2 2.77Å
168	L	80.7	Confident	80.2	Confident	12 Å²	12	70.4 Å²	70.4	6%	0.063	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-109.7	-2.3	-172.4	-48.9	-176.7	0	0	0	113.1	L162 D165 F166 Y170 Y172 L183 K187	L162-L168 HydrophobicContact CB-CD1 4.46Å; L162-L168 HydrophobicContact CD2-CD1 3.41Å; L162-L168 VanDerWaalsContact CD2-CD1 3.41Å; D165-L168 HydrophobicContact CB-CB 4.48Å; D165-L168 HydrophobicContact CB-CD1 4.21Å; D165-L168 HydrophobicContact CB-CG 4.18Å; D165-L168 PolarHBondContact O-N 3.46Å; D165-L168 VanDerWaalsContact O-N 3.12Å; F166-L168 PolarHBondContact O-N 2.83Å; L168-Y170 PolarHBondContact O-N 3.42Å; L168-Y170 VanDerWaalsContact O-N 3.1Å; L168-Y172 VanDerWaalsContact O-CB 3.27Å; L168-Y172 WeakPolarHBondContact O-CB 3.41Å; L168-L183 HydrophobicContact CB-CD2 4.36Å; L168-L183 HydrophobicContact CD1-CD2 4.47Å; L168-L183 HydrophobicContact CD2-CD1 3.67Å; L168-L183 HydrophobicContact CD2-CD2 3.91Å; L168-L183 HydrophobicContact CD2-CG 3.74Å; L168-L183 HydrophobicContact CG-CD2 4.48Å; L168-K187 HydrophobicContact CD1-CD 4.2Å
169	R	75.1	Confident	80.6	Confident	165 Å²	165	74.8 Å²	74.8	62%	0.623	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-31.7	178.3	-75.6	-167.2	-126.9	168.1	15.8	112.8	D165 F166	D165-R169 PolarHBondContact O-N 2.92Å; F166-R169 VanDerWaalsContact CD2-NE 3.25Å; F166-R169 VanDerWaalsContact CG-NH2 3.34Å; F166-R169 PolarHBondContact O-N 3.23Å
170	Y	72.4	Confident	80.9	Confident	201 Å²	201	73.8 Å²	73.8	79%	0.788	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.6	122.6	176.3	-57.3	-74.4	0	0	0	110.2	L168	L168-Y170 PolarHBondContact O-N 3.42Å; L168-Y170 VanDerWaalsContact O-N 3.1Å
171	G	68.9	Low	81.1	Confident	62 Å²	62	68.9 Å²	68.9	64%	0.639	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.5	-4.7	176.6	0	0	0	0	0	115.5	C173	G171-C173 PolarHBondContact O-N 2.78Å; G171-C173 VanDerWaalsContact O-N 3.07Å; G171-C173 PolarHBondContact O-SG 2.83Å; G171-C173 VanDerWaalsContact O-SG 3.4Å
172	Y	73.6	Confident	81.4	Confident	53 Å²	53	70.3 Å²	70.3	21%	0.208	34%	0.344	C	S	.	.			trans	-62.3	110.5	169.4	174.3	-99	0	0	0	110.3	D159 L162 L163 L168 R174 L180	D159-Y172 PolarHBondContact OD1-OH 2.67Å; L162-Y172 HydrophobicContact CB-CE2 4.26Å; L162-Y172 HydrophobicContact CD1-CD2 4.31Å; L162-Y172 HydrophobicContact CD1-CE2 3.62Å; L163-Y172 HydrophobicContact CD2-CE1 4.48Å; L168-Y172 VanDerWaalsContact O-CB 3.27Å; L168-Y172 WeakPolarHBondContact O-CB 3.41Å; Y172-R174 HydrophobicContact CE1-CB 3.79Å; Y172-R174 HydrophobicContact CE1-CG 4.37Å; Y172-L180 HydrophobicContact CD2-CD1 3.85Å; Y172-L180 HydrophobicContact CE2-CD1 3.41Å; Y172-L180 VanDerWaalsContact CE2-CD1 3.41Å
173	C	75.8	Confident	81.8	Confident	46 Å²	46	71.7 Å²	71.7	31%	0.311	35%	0.351	S	S	.	.			trans	-106.9	90.9	179.4	-66.5	0	0	0	0	109.3	G171 H175 N176 K179	G171-C173 PolarHBondContact O-N 2.78Å; G171-C173 VanDerWaalsContact O-N 3.07Å; G171-C173 PolarHBondContact O-SG 2.83Å; G171-C173 VanDerWaalsContact O-SG 3.4Å; C173-H175 PolarHBondContact O-N 2.87Å; C173-N176 HydrophobicContact CB-CB 4.31Å; C173-N176 PolarHBondContact O-N 3.33Å; C173-K179 HydrophobicContact CB-CB 4.22Å; C173-K179 HydrophobicContact CB-CD 4.43Å
174	R	75.4	Confident	82.2	Confident	142 Å²	142	67 Å²	67	54%	0.536	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-37.4	179.5	-169.4	-174.3	174.9	94.3	9.1	113.2	D159 Y172	D159-R174 IonicContact OD1-NH1 3.92Å; D159-R174 IonicContact OD2-CZ 2.72Å; D159-R174 IonicContact OD2-NH1 3.97Å; D159-R174 PolarHBondContact OD2-NH1 3.33Å; D159-R174 IonicContact OD2-NH2 3.03Å; D159-R174 PolarHBondContact OD2-NH2 2.86Å; D159-R174 VanDerWaalsContact OD2-NH2 3.13Å; Y172-R174 HydrophobicContact CE1-CB 3.79Å; Y172-R174 HydrophobicContact CE1-CG 4.37Å
175	H	79	Confident	82.9	Confident	176 Å²	176	65.3 Å²	65.3	82%	0.815	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-24	-172.5	-56.7	-59.8	0	0	0	114.2	C173	C173-H175 PolarHBondContact O-N 2.87Å
176	N	86.1	Confident	83.3	Confident	54 Å²	54	68 Å²	68	29%	0.289	32%	0.323	S	S	.	.			trans	-102.6	96.3	-178.6	-172.8	-35.3	0	0	0	109.7	C173 R178 K179 L180	C173-N176 HydrophobicContact CB-CB 4.31Å; C173-N176 PolarHBondContact O-N 3.33Å; N176-R178 PolarHBondContact O-N 3.02Å; N176-R178 PolarHBondContact OD1-N 3.11Å; N176-R178 VanDerWaalsContact OD1-N 3.11Å; N176-K179 HydrophobicContact CB-CB 4.22Å; N176-K179 HydrophobicContact CB-CD 4.32Å; N176-K179 HydrophobicContact CB-CG 4.29Å; N176-K179 PolarHBondContact O-N 2.9Å; N176-K179 VanDerWaalsContact O-N 3.16Å; N176-K179 PolarHBondContact OD1-N 2.81Å; N176-L180 PolarHBondContact O-N 3.17Å
177	C	85.2	Confident	83.8	Confident	50 Å²	50	62.7 Å²	62.7	34%	0.338	30%	0.3	S	S	.	.	H	α-helix	trans	-52.3	-38.6	-179.3	-59.1	0	0	0	0	112.9	L153 L180 V181	L153-C177 HydrophobicContact CD1-CB 3.78Å; L153-C177 VanDerWaalsContact CD1-SG 3.56Å; C177-L180 WeakPolarHBondContact O-CB 3.49Å; C177-L180 PolarHBondContact O-N 2.61Å; C177-V181 WeakPolarHBondContact O-CB 3.35Å; C177-V181 WeakPolarHBondContact O-CG2 3.43Å; C177-V181 PolarHBondContact O-N 3.15Å
178	R	87.6	Confident	84.4	Confident	56 Å²	56	60.3 Å²	60.3	21%	0.211	29%	0.291	C	S	.	.	H	α-helix	trans	-68.2	-43.5	-179.2	-66.5	179.9	175	175.4	-5.7	112.4	D102 N176 L180 S182 E431	D102-R178 IonicContact OD2-NH2 3.23Å; N176-R178 PolarHBondContact O-N 3.02Å; N176-R178 PolarHBondContact OD1-N 3.11Å; N176-R178 VanDerWaalsContact OD1-N 3.11Å; R178-L180 VanDerWaalsContact C-N 3.33Å; R178-S182 WeakPolarHBondContact O-CB 3.14Å; R178-S182 PolarHBondContact O-N 2.9Å; R178-S182 PolarHBondContact O-OG 3.45Å; R178-E431 IonicContact CZ-OE1 2.96Å; R178-E431 IonicContact NH1-OE1 3.27Å; R178-E431 PolarHBondContact NH1-OE1 3.09Å
179	K	88	Confident	85.1	Confident	95 Å²	95	60.3 Å²	60.3	41%	0.413	29%	0.29	S	S	.	.	H	α-helix	trans	-64.7	-41.5	175.3	-69.8	-173.8	179	-175.7	0	110.7	C173 N176 L183	C173-K179 HydrophobicContact CB-CB 4.22Å; C173-K179 HydrophobicContact CB-CD 4.43Å; N176-K179 HydrophobicContact CB-CB 4.22Å; N176-K179 HydrophobicContact CB-CD 4.32Å; N176-K179 HydrophobicContact CB-CG 4.29Å; N176-K179 PolarHBondContact O-N 2.9Å; N176-K179 VanDerWaalsContact O-N 3.16Å; N176-K179 PolarHBondContact OD1-N 2.81Å; K179-L183 WeakPolarHBondContact O-CB 3.38Å; K179-L183 PolarHBondContact O-N 2.95Å
180	L	88.2	Confident	86.1	Confident	12 Å²	12	58.7 Å²	58.7	6%	0.063	28%	0.284	C	S	.	.	H	α-helix	trans	-60.8	-49.7	176.1	178.2	64.3	0	0	0	112.1	L162 Y172 N176 C177 R178 S182 L183 W184	L162-L180 HydrophobicContact CD1-CD1 3.84Å; Y172-L180 HydrophobicContact CD2-CD1 3.85Å; Y172-L180 HydrophobicContact CE2-CD1 3.41Å; Y172-L180 VanDerWaalsContact CE2-CD1 3.41Å; N176-L180 PolarHBondContact O-N 3.17Å; C177-L180 WeakPolarHBondContact O-CB 3.49Å; C177-L180 PolarHBondContact O-N 2.61Å; R178-L180 VanDerWaalsContact C-N 3.33Å; L180-S182 PolarHBondContact O-N 3.25Å; L180-L183 WeakPolarHBondContact O-CB 3.43Å; L180-L183 PolarHBondContact O-N 3.11Å; L180-W184 PolarHBondContact O-N 2.96Å
181	V	90.1	Very high	87.3	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-66.6	-37.9	-179.2	172.4	0	0	0	0	111.5	Y148 Q149 T150 L153 C177 L183 W184 A185 N211	Y148-V181 HydrophobicContact CG-CG1 4.26Å; Q149-V181 VanDerWaalsContact O-CG2 3.27Å; Q149-V181 WeakPolarHBondContact O-CG2 3.37Å; T150-V181 HydrophobicContact CG2-CB 4.38Å; T150-V181 HydrophobicContact CG2-CG1 4.01Å; L153-V181 HydrophobicContact CD2-CG2 4.06Å; C177-V181 WeakPolarHBondContact O-CB 3.35Å; C177-V181 WeakPolarHBondContact O-CG2 3.43Å; C177-V181 PolarHBondContact O-N 3.15Å; V181-L183 VanDerWaalsContact C-N 3.28Å; V181-L183 PolarHBondContact O-N 2.71Å; V181-W184 WeakPolarHBondContact O-CB 3.08Å; V181-W184 PolarHBondContact O-N 2.86Å; V181-A185 PolarHBondContact O-N 3.3Å; V181-N211 HydrophobicContact CG1-CB 3.75Å
182	S	91.1	Very high	88.6	Confident	40 Å²	40	46.2 Å²	46.2	28%	0.28	22%	0.216	S	C	.	.	H	α-helix	trans	-63.5	-37.6	173.9	-57	0	0	0	0	111.8	R178 L180 W184 L186 G210	R178-S182 WeakPolarHBondContact O-CB 3.14Å; R178-S182 PolarHBondContact O-N 2.9Å; R178-S182 PolarHBondContact O-OG 3.45Å; L180-S182 PolarHBondContact O-N 3.25Å; S182-W184 VanDerWaalsContact C-N 3.33Å; S182-L186 WeakPolarHBondContact O-CB 3.39Å; S182-L186 PolarHBondContact O-N 2.97Å; S182-G210 WeakPolarHBondContact CA-O 3.44Å
183	L	90.1	Very high	89.7	Confident	35 Å²	35	45 Å²	45	18%	0.183	22%	0.215	C	C	.	.	H	α-helix	trans	-66.9	-36.3	175.4	-170.8	64.5	0	0	0	111.7	L168 K179 L180 V181 L186 K187	L168-L183 HydrophobicContact CB-CD2 4.36Å; L168-L183 HydrophobicContact CD1-CD2 4.47Å; L168-L183 HydrophobicContact CD2-CD1 3.67Å; L168-L183 HydrophobicContact CD2-CD2 3.91Å; L168-L183 HydrophobicContact CD2-CG 3.74Å; L168-L183 HydrophobicContact CG-CD2 4.48Å; K179-L183 WeakPolarHBondContact O-CB 3.38Å; K179-L183 PolarHBondContact O-N 2.95Å; L180-L183 WeakPolarHBondContact O-CB 3.43Å; L180-L183 PolarHBondContact O-N 3.11Å; V181-L183 VanDerWaalsContact C-N 3.28Å; V181-L183 PolarHBondContact O-N 2.71Å; L183-L186 PolarHBondContact O-N 3.36Å; L183-K187 WeakPolarHBondContact O-CB 3.41Å; L183-K187 PolarHBondContact O-N 3.47Å
184	W	90.2	Very high	90.7	Very high	1 Å²	1	46.4 Å²	46.4	0%	0.004	21%	0.214	C	C	.	.	H	α-helix	trans	-63.3	-50.6	173.3	-89.1	27.3	0	0	0	113	E130 F155 R158 L162 L180 V181 S182 L186 K187 E188	E130-W184 WeakPolarHBondContact OE2-CZ3 3.44Å; F155-W184 AromaticContact CD1-CH2 3.94Å; F155-W184 HydrophobicContact CD1-CH2 3.94Å; F155-W184 HydrophobicContact CD1-CZ3 4.39Å; F155-W184 AromaticContact CE1-CH2 3.95Å; F155-W184 HydrophobicContact CE1-CH2 3.95Å; R158-W184 HydrophobicContact CB-CH2 3.71Å; R158-W184 HydrophobicContact CB-CZ2 3.23Å; R158-W184 VanDerWaalsContact CD-CZ2 3.41Å; R158-W184 HydrophobicContact CG-CH2 3.22Å; R158-W184 HydrophobicContact CG-CZ2 3.31Å; R158-W184 HydrophobicContact CG-CZ3 3.96Å; L162-W184 HydrophobicContact CD1-CZ2 4.17Å; L162-W184 HydrophobicContact CG-CZ2 4.47Å; L180-W184 PolarHBondContact O-N 2.96Å; V181-W184 WeakPolarHBondContact O-CB 3.08Å; V181-W184 PolarHBondContact O-N 2.86Å; S182-W184 VanDerWaalsContact C-N 3.33Å; W184-L186 VanDerWaalsContact C-N 3.25Å; W184-L186 PolarHBondContact O-N 3.45Å; W184-K187 WeakPolarHBondContact O-CA 3.49Å; W184-K187 WeakPolarHBondContact O-CB 3.45Å; W184-K187 PolarHBondContact O-N 3.39Å; W184-E188 PolarHBondContact O-N 3.29Å
185	A	93.4	Very high	91.7	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-57.6	-42.3	175.9	0	0	0	0	0	111.3	Y148 V181 K187 E188 Y189 G210	Y148-A185 HydrophobicContact CD2-CB 3.65Å; Y148-A185 HydrophobicContact CE2-CB 3.36Å; V181-A185 PolarHBondContact O-N 3.3Å; A185-K187 PolarHBondContact O-N 3.48Å; A185-E188 PolarHBondContact O-N 3.33Å; A185-Y189 WeakPolarHBondContact O-CB 3.29Å; A185-Y189 PolarHBondContact O-N 3.49Å; A185-G210 WeakPolarHBondContact CB-O 3.28Å
186	L	93.1	Very high	92.6	Very high	58 Å²	58	37.1 Å²	37.1	30%	0.304	17%	0.173	S	C	.	.	H	α-helix	trans	-65.8	-36.9	175.6	-176.7	62.8	0	0	0	112.5	S182 L183 W184 Y189 R190	S182-L186 WeakPolarHBondContact O-CB 3.39Å; S182-L186 PolarHBondContact O-N 2.97Å; L183-L186 PolarHBondContact O-N 3.36Å; W184-L186 VanDerWaalsContact C-N 3.25Å; W184-L186 PolarHBondContact O-N 3.45Å; L186-Y189 HydrophobicContact CD1-CD1 4.37Å; L186-R190 HydrophobicContact CD1-CG 4.26Å; L186-R190 HydrophobicContact CG-CG 4.49Å; L186-R190 WeakPolarHBondContact O-CB 3.42Å; L186-R190 WeakPolarHBondContact O-CG 3.34Å; L186-R190 PolarHBondContact O-N 3.28Å
187	K	92.9	Very high	93.1	Very high	6 Å²	6	43 Å²	43	3%	0.026	20%	0.196	C	C	.	.	H	α-helix	trans	-61.7	-49.5	175.2	-175.8	-169.9	174.3	-157.7	0	110.1	Y161 L162 L168 L183 W184 A185 R190 N191 S281 Q282 A283	Y161-K187 PolarHBondContact O-NZ 3.17Å; L162-K187 HydrophobicContact CD2-CD 4.2Å; L168-K187 HydrophobicContact CD1-CD 4.2Å; L183-K187 WeakPolarHBondContact O-CB 3.41Å; L183-K187 PolarHBondContact O-N 3.47Å; W184-K187 WeakPolarHBondContact O-CA 3.49Å; W184-K187 WeakPolarHBondContact O-CB 3.45Å; W184-K187 PolarHBondContact O-N 3.39Å; A185-K187 PolarHBondContact O-N 3.48Å; K187-R190 PolarHBondContact O-N 3.21Å; K187-N191 WeakPolarHBondContact O-CB 3.12Å; K187-N191 VanDerWaalsContact O-CG 3.26Å; K187-N191 PolarHBondContact O-N 2.97Å; K187-S281 WeakPolarHBondContact CD-O 3.11Å; K187-S281 WeakPolarHBondContact CE-O 3.38Å; K187-S281 PolarHBondContact NZ-O 3.32Å; K187-Q282 PolarHBondContact NZ-O 3.23Å; K187-A283 WeakPolarHBondContact CE-O 3.2Å; K187-A283 PolarHBondContact NZ-O 3.16Å
188	E	95.4	Very high	93.5	Very high	2 Å²	2	41.8 Å²	41.8	1%	0.009	19%	0.188	C	C	.	.	H	α-helix	trans	-60.5	-49.1	177.8	-171.2	171.2	154	0	0	111.4	K146 Y148 W184 A185 R190 N191 M192 F213 V280 S281	K146-E188 IonicContact NZ-OE1 3.97Å; K146-E188 PolarHBondContact NZ-OE1 3.33Å; K146-E188 IonicContact NZ-OE2 3.13Å; K146-E188 PolarHBondContact NZ-OE2 2.9Å; Y148-E188 VanDerWaalsContact OH-CB 3.3Å; Y148-E188 WeakPolarHBondContact OH-CB 3.49Å; Y148-E188 PolarHBondContact OH-OE2 2.87Å; W184-E188 PolarHBondContact O-N 3.29Å; A185-E188 PolarHBondContact O-N 3.33Å; E188-R190 VanDerWaalsContact C-N 3.31Å; E188-R190 PolarHBondContact O-N 2.98Å; E188-N191 PolarHBondContact O-N 3.17Å; E188-M192 WeakPolarHBondContact O-CB 3.21Å; E188-M192 PolarHBondContact O-N 3.47Å; E188-F213 HydrophobicContact CG-CD1 4.13Å; E188-F213 HydrophobicContact CG-CE1 3.88Å; E188-V280 HydrophobicContact CG-CG2 4.03Å; E188-S281 VanDerWaalsContact OE2-CB 3.3Å; E188-S281 WeakPolarHBondContact OE2-CB 3.33Å
189	Y	96.4	Very high	93.7	Very high	13 Å²	13	42.9 Å²	42.9	5%	0.051	20%	0.204	C	C	.	.	H	α-helix	trans	-53.4	-48.1	176.1	172.9	-102.8	0	0	0	111.9	A185 L186 M192 C193 P205 C208 F213 V439	A185-Y189 WeakPolarHBondContact O-CB 3.29Å; A185-Y189 PolarHBondContact O-N 3.49Å; L186-Y189 HydrophobicContact CD1-CD1 4.37Å; Y189-M192 PolarHBondContact O-N 3.29Å; Y189-C193 WeakPolarHBondContact O-CB 3.27Å; Y189-C193 PolarHBondContact O-N 3.43Å; Y189-C193 PolarHBondContact O-SG 3.19Å; Y189-P205 HydrophobicContact CD2-CB 4.04Å; Y189-P205 HydrophobicContact CE2-CB 4.02Å; Y189-C208 HydrophobicContact CD1-CB 4.17Å; Y189-C208 HydrophobicContact CD2-CB 3.91Å; Y189-C208 HydrophobicContact CG-CB 3.68Å; Y189-F213 AromaticContact CD2-CD2 3.97Å; Y189-F213 HydrophobicContact CD2-CD2 3.97Å; Y189-F213 AromaticContact CD2-CE2 3.68Å; Y189-F213 HydrophobicContact CD2-CE2 3.68Å; Y189-F213 HydrophobicContact CG-CE2 4.48Å; Y189-V439 HydrophobicContact CE1-CB 4.41Å; Y189-V439 HydrophobicContact CE1-CG1 3.99Å
190	R	95.4	Very high	94.1	Very high	130 Å²	130	38.6 Å²	38.6	49%	0.491	19%	0.186	S	C	.	.	H	α-helix	trans	-68.3	-36.6	-179.2	-71.5	177.6	74.1	170.5	2	112.8	L186 K187 E188 R194	L186-R190 HydrophobicContact CD1-CG 4.26Å; L186-R190 HydrophobicContact CG-CG 4.49Å; L186-R190 WeakPolarHBondContact O-CB 3.42Å; L186-R190 WeakPolarHBondContact O-CG 3.34Å; L186-R190 PolarHBondContact O-N 3.28Å; K187-R190 PolarHBondContact O-N 3.21Å; E188-R190 VanDerWaalsContact C-N 3.31Å; E188-R190 PolarHBondContact O-N 2.98Å; R190-R194 WeakPolarHBondContact O-CG 3.49Å; R190-R194 PolarHBondContact O-N 2.67Å
191	N	96.7	Very high	94.5	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-66.4	-47.8	175.2	-73.9	-10.8	0	0	0	109.9	R167 K187 E188 C193 R194 L195 L258 V280 A283	R167-N191 PolarHBondContact NH1-OD1 3.43Å; R167-N191 PolarHBondContact NH2-OD1 2.96Å; K187-N191 WeakPolarHBondContact O-CB 3.12Å; K187-N191 VanDerWaalsContact O-CG 3.26Å; K187-N191 PolarHBondContact O-N 2.97Å; E188-N191 PolarHBondContact O-N 3.17Å; N191-C193 VanDerWaalsContact C-N 3.3Å; N191-C193 PolarHBondContact O-N 3.07Å; N191-R194 WeakPolarHBondContact O-CA 3.26Å; N191-R194 WeakPolarHBondContact O-CB 3.48Å; N191-R194 PolarHBondContact O-N 2.99Å; N191-L195 WeakPolarHBondContact O-CD1 3.27Å; N191-L195 PolarHBondContact O-N 3.36Å; N191-L258 HydrophobicContact CB-CD1 4.12Å; N191-V280 HydrophobicContact CB-CB 4.04Å; N191-V280 HydrophobicContact CB-CG2 3.68Å; N191-V280 PolarHBondContact ND2-O 3.13Å; N191-A283 PolarHBondContact ND2-O 3.25Å
192	M	97.3	Very high	94.9	Very high	1 Å²	1	41.1 Å²	41.1	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-59.1	-40.4	176.4	-161.3	71.4	81.1	0	0	111.6	E188 Y189 R194 L195 Y196 C202 P203 P205 F213 M215 V280	E188-M192 WeakPolarHBondContact O-CB 3.21Å; E188-M192 PolarHBondContact O-N 3.47Å; Y189-M192 PolarHBondContact O-N 3.29Å; M192-R194 PolarHBondContact O-N 3.49Å; M192-L195 PolarHBondContact O-N 3.47Å; M192-Y196 WeakPolarHBondContact O-CB 3.44Å; M192-Y196 PolarHBondContact O-N 2.95Å; M192-C202 HydrophobicContact SD-CB 3.54Å; M192-C202 VanDerWaalsContact SD-CB 3.54Å; M192-C202 VanDerWaalsContact SD-SG 3.61Å; M192-P203 WeakPolarHBondContact CG-O 3.2Å; M192-P205 HydrophobicContact CB-CB 4.17Å; M192-P205 HydrophobicContact CB-CG 4.34Å; M192-P205 HydrophobicContact CG-CB 4.06Å; M192-P205 HydrophobicContact CG-CG 4.13Å; M192-F213 HydrophobicContact CB-CZ 4.23Å; M192-F213 HydrophobicContact CE-CE1 4.46Å; M192-F213 HydrophobicContact CG-CZ 4.33Å; M192-M215 HydrophobicContact CE-SD 4.43Å; M192-V280 HydrophobicContact CB-CG2 4.15Å; M192-V280 HydrophobicContact CE-CG2 3.99Å; M192-V280 HydrophobicContact SD-CG2 4.17Å
193	C	97.1	Very high	95.1	Very high	29 Å²	29	39.4 Å²	39.4	20%	0.196	19%	0.187	C	C	.	.	H	α-helix	trans	-63.7	-24.7	173.1	-70.4	0	0	0	0	114	Y189 N191 K197 P205	Y189-C193 WeakPolarHBondContact O-CB 3.27Å; Y189-C193 PolarHBondContact O-N 3.43Å; Y189-C193 PolarHBondContact O-SG 3.19Å; N191-C193 VanDerWaalsContact C-N 3.3Å; N191-C193 PolarHBondContact O-N 3.07Å; C193-K197 WeakPolarHBondContact O-CD 3.46Å; C193-K197 VanDerWaalsContact O-CG 3.27Å; C193-K197 WeakPolarHBondContact O-CG 3.46Å; C193-P205 HydrophobicContact CB-CG 4.37Å; C193-P205 VanDerWaalsContact SG-CG 3.54Å
194	R	96.3	Very high	95.4	Very high	74 Å²	74	41.7 Å²	41.7	28%	0.279	20%	0.196	S	C	.	.	H	α-helix	trans	-77	-44	173.2	-71.7	169.6	78	160.5	12.9	110.2	R190 N191 M192 K197 S198 C256 L258 E285	R190-R194 WeakPolarHBondContact O-CG 3.49Å; R190-R194 PolarHBondContact O-N 2.67Å; N191-R194 WeakPolarHBondContact O-CA 3.26Å; N191-R194 WeakPolarHBondContact O-CB 3.48Å; N191-R194 PolarHBondContact O-N 2.99Å; M192-R194 PolarHBondContact O-N 3.49Å; R194-K197 PolarHBondContact O-N 2.88Å; R194-S198 PolarHBondContact O-N 2.97Å; R194-C256 PolarHBondContact NE-O 3.02Å; R194-C256 PolarHBondContact NH2-O 3.4Å; R194-L258 HydrophobicContact CB-CD1 4.17Å; R194-E285 IonicContact CZ-OE1 2.82Å; R194-E285 IonicContact NH1-OE1 3.96Å; R194-E285 PolarHBondContact NH1-OE1 3.04Å
195	L	97.2	Very high	95.7	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-61.6	-47.8	176.4	-84.1	69.9	0	0	0	111.2	N191 M192 K197 S198 V200 C202 M252 L258 I277 V280	N191-L195 WeakPolarHBondContact O-CD1 3.27Å; N191-L195 PolarHBondContact O-N 3.36Å; M192-L195 PolarHBondContact O-N 3.47Å; L195-K197 PolarHBondContact O-N 3.04Å; L195-S198 PolarHBondContact O-N 3.39Å; L195-S198 PolarHBondContact O-OG 3.18Å; L195-V200 HydrophobicContact CB-CB 4.44Å; L195-V200 HydrophobicContact CD2-CG1 4Å; L195-V200 HydrophobicContact CG-CB 4.41Å; L195-V200 HydrophobicContact CG-CG1 4.25Å; L195-C202 HydrophobicContact CB-CB 4.36Å; L195-C202 HydrophobicContact CD2-CB 4.37Å; L195-M252 HydrophobicContact CD2-CE 4.36Å; L195-M252 HydrophobicContact CD2-SD 4.45Å; L195-L258 HydrophobicContact CD1-CD1 3.73Å; L195-I277 HydrophobicContact CD2-CB 4.42Å; L195-I277 HydrophobicContact CD2-CG2 4.14Å; L195-V280 HydrophobicContact CD1-CG1 4.48Å; L195-V280 HydrophobicContact CD2-CG1 3.75Å
196	Y	96.8	Very high	95.8	Very high	124 Å²	124	44.6 Å²	44.6	49%	0.486	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-19.2	-179.9	-170.2	-101.8	0	0	0	113.8	M192 K204	M192-Y196 WeakPolarHBondContact O-CB 3.44Å; M192-Y196 PolarHBondContact O-N 2.95Å; Y196-K204 HydrophobicContact CD2-CB 4.33Å; Y196-K204 HydrophobicContact CE1-CG 4.29Å; Y196-K204 HydrophobicContact CE2-CB 3.79Å; Y196-K204 HydrophobicContact CE2-CG 3.98Å
197	K	96	Very high	95.8	Very high	177 Å²	177	41.9 Å²	41.9	77%	0.77	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-14.3	174.8	-73	175.3	-175.9	-178.3	0	113.4	C193 R194 L195	C193-K197 WeakPolarHBondContact O-CD 3.46Å; C193-K197 VanDerWaalsContact O-CG 3.27Å; C193-K197 WeakPolarHBondContact O-CG 3.46Å; R194-K197 PolarHBondContact O-N 2.88Å; L195-K197 PolarHBondContact O-N 3.04Å
198	S	94.3	Very high	95.9	Very high	24 Å²	24	42.2 Å²	42.2	17%	0.168	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.7	-171.5	176.6	75	0	0	0	0	110.4	R194 L195 V200 E251 C256	R194-S198 PolarHBondContact O-N 2.97Å; L195-S198 PolarHBondContact O-N 3.39Å; L195-S198 PolarHBondContact O-OG 3.18Å; S198-V200 PolarHBondContact O-N 3.33Å; S198-V200 WeakPolarHBondContact OG-CG2 3.47Å; S198-V200 PolarHBondContact OG-N 3.49Å; S198-E251 WeakPolarHBondContact CB-OE1 3.49Å; S198-C256 VanDerWaalsContact CB-SG 3.52Å; S198-C256 PolarHBondContact OG-SG 3.42Å
199	S	92.4	Very high	95.8	Very high	79 Å²	79	44.2 Å²	44.2	55%	0.552	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-0	175.4	60.4	0	0	0	0	114.3	L201 E251	S199-L201 PolarHBondContact O-N 3Å; S199-E251 PolarHBondContact N-OE1 2.97Å; S199-E251 VanDerWaalsContact N-OE1 3.15Å; S199-E251 VanDerWaalsContact OG-CG 3.29Å; S199-E251 WeakPolarHBondContact OG-CG 3.43Å; S199-E251 PolarHBondContact OG-OE1 3Å
200	V	96	Very high	95.6	Very high	5 Å²	5	44.8 Å²	44.8	3%	0.03	22%	0.219	C	C	.	.			trans	-74	123.8	179.4	-178.2	0	0	0	0	110.2	L195 S198 C202 F248 E251 M252 I277	L195-V200 HydrophobicContact CB-CB 4.44Å; L195-V200 HydrophobicContact CD2-CG1 4Å; L195-V200 HydrophobicContact CG-CB 4.41Å; L195-V200 HydrophobicContact CG-CG1 4.25Å; S198-V200 PolarHBondContact O-N 3.33Å; S198-V200 WeakPolarHBondContact OG-CG2 3.47Å; S198-V200 PolarHBondContact OG-N 3.49Å; V200-C202 PolarHBondContact O-N 3.47Å; V200-F248 HydrophobicContact CB-CD1 4.28Å; V200-F248 HydrophobicContact CG1-CB 4.31Å; V200-F248 HydrophobicContact CG1-CD1 4.21Å; V200-F248 HydrophobicContact CG1-CD2 4.42Å; V200-F248 HydrophobicContact CG1-CG 4.09Å; V200-F248 HydrophobicContact CG2-CB 4.34Å; V200-F248 HydrophobicContact CG2-CD1 4.14Å; V200-F248 HydrophobicContact CG2-CG 4.45Å; V200-E251 HydrophobicContact CG2-CB 3.87Å; V200-E251 HydrophobicContact CG2-CG 3.67Å; V200-M252 HydrophobicContact CG2-CG 3.88Å; V200-I277 HydrophobicContact CG1-CB 4.23Å; V200-I277 HydrophobicContact CG1-CG1 3.84Å
201	L	97.2	Very high	95.5	Very high	56 Å²	56	39.2 Å²	39.2	29%	0.293	20%	0.198	S	C	.	.			trans	-74.1	121.2	174.9	-63.4	-179.9	0	0	0	110.1	S199 F248 N274 Y276 I277	S199-L201 PolarHBondContact O-N 3Å; L201-F248 HydrophobicContact CB-CE2 4.36Å; L201-F248 HydrophobicContact CB-CZ 3.84Å; L201-F248 HydrophobicContact CD1-CZ 4.17Å; L201-F248 HydrophobicContact CG-CE1 4.48Å; L201-F248 HydrophobicContact CG-CZ 3.86Å; L201-N274 HydrophobicContact CD1-CB 3.85Å; L201-Y276 HydrophobicContact CB-CD1 3.77Å; L201-Y276 HydrophobicContact CB-CE1 3.87Å; L201-Y276 HydrophobicContact CB-CG 4.2Å; L201-Y276 HydrophobicContact CD1-CE2 4.44Å; L201-Y276 WeakPolarHBondContact O-CA 3.34Å; L201-I277 PolarHBondContact O-N 3.26Å
202	C	96.9	Very high	95.5	Very high	9 Å²	9	39.2 Å²	39.2	6%	0.061	20%	0.198	C	C	.	.			trans	-149.1	161.2	176.6	72.6	0	0	0	0	110.2	M192 L195 V200 K204 I277	M192-C202 HydrophobicContact SD-CB 3.54Å; M192-C202 VanDerWaalsContact SD-CB 3.54Å; M192-C202 VanDerWaalsContact SD-SG 3.61Å; L195-C202 HydrophobicContact CB-CB 4.36Å; L195-C202 HydrophobicContact CD2-CB 4.37Å; V200-C202 PolarHBondContact O-N 3.47Å; C202-K204 PolarHBondContact O-N 3.17Å; C202-I277 WeakPolarHBondContact CB-O 3.38Å
203	P	96.5	Very high	95.5	Very high	4 Å²	4	39.1 Å²	39.1	3%	0.026	20%	0.198	C	C	.	.	P	Polyproline II helix	trans	-54.1	138.4	171.4	-24.9	33.8	0	0	0	111.8	M192 P205 M215 L218 I277 I278	M192-P203 WeakPolarHBondContact CG-O 3.2Å; P203-P205 VanDerWaalsContact O-CD 3.26Å; P203-P205 WeakPolarHBondContact O-CD 3.29Å; P203-M215 HydrophobicContact CB-CB 4.05Å; P203-M215 HydrophobicContact CB-CG 3.93Å; P203-M215 HydrophobicContact CB-SD 3.89Å; P203-M215 HydrophobicContact CG-SD 4.17Å; P203-L218 HydrophobicContact CG-CD1 3.85Å; P203-L218 HydrophobicContact CG-CG 4.19Å; P203-I277 WeakPolarHBondContact CD-O 3.46Å; P203-I278 HydrophobicContact CG-CG2 3.85Å
204	K	96.1	Very high	95.4	Very high	84 Å²	84	37.9 Å²	37.9	37%	0.365	19%	0.189	S	C	.	.	P	Polyproline II helix	trans	-65.5	117	176.6	179.5	-175	174.8	-165.5	0	108.8	E140 Y196 C202 I206 M215 S216	E140-K204 IonicContact OE2-NZ 3.23Å; Y196-K204 HydrophobicContact CD2-CB 4.33Å; Y196-K204 HydrophobicContact CE1-CG 4.29Å; Y196-K204 HydrophobicContact CE2-CB 3.79Å; Y196-K204 HydrophobicContact CE2-CG 3.98Å; C202-K204 PolarHBondContact O-N 3.17Å; K204-I206 PolarHBondContact O-N 3.47Å; K204-M215 CarbonylContact O-C 3.58Å; K204-M215 WeakPolarHBondContact O-CA 3.48Å; K204-M215 WeakPolarHBondContact O-CB 3.5Å; K204-S216 PolarHBondContact N-OG 2.89Å; K204-S216 PolarHBondContact O-N 3.31Å
205	P	96.5	Very high	95.5	Very high	17 Å²	17	35 Å²	35	11%	0.11	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	128	176.5	29.6	-32.5	0	0	0	110.1	Y189 M192 C193 P203 F213	Y189-P205 HydrophobicContact CD2-CB 4.04Å; Y189-P205 HydrophobicContact CE2-CB 4.02Å; M192-P205 HydrophobicContact CB-CB 4.17Å; M192-P205 HydrophobicContact CB-CG 4.34Å; M192-P205 HydrophobicContact CG-CB 4.06Å; M192-P205 HydrophobicContact CG-CG 4.13Å; C193-P205 HydrophobicContact CB-CG 4.37Å; C193-P205 VanDerWaalsContact SG-CG 3.54Å; P203-P205 VanDerWaalsContact O-CD 3.26Å; P203-P205 WeakPolarHBondContact O-CD 3.29Å; P205-F213 HydrophobicContact CB-CE2 3.98Å; P205-F213 HydrophobicContact CB-CZ 4.15Å
206	I	94.6	Very high	95.4	Very high	45 Å²	45	36.5 Å²	36.5	23%	0.231	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	-66.4	-175.8	-60.8	173.2	0	0	0	109.8	M143 K204 I214	M143-I206 HydrophobicContact CG-CD1 3.75Å; M143-I206 HydrophobicContact SD-CD1 3.53Å; M143-I206 VanDerWaalsContact SD-CD1 3.53Å; K204-I206 PolarHBondContact O-N 3.47Å; I206-I214 HydrophobicContact CB-CB 4.32Å; I206-I214 HydrophobicContact CB-CG2 4.12Å; I206-I214 HydrophobicContact CD1-CG2 4.1Å; I206-I214 HydrophobicContact CG2-CG2 4.43Å; I206-I214 PolarHBondContact N-O 3.28Å
207	A	93.8	Very high	95.3	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.008	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	153.1	-175.6	0	0	0	0	0	112.2	I214	A207-I214 HydrophobicContact CB-CD1 4.48Å; A207-I214 PolarHBondContact N-O 2.8Å; A207-I214 PolarHBondContact O-N 3.31Å
208	C	95	Very high	95.2	Very high	13 Å²	13	24.3 Å²	24.3	9%	0.088	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	129	172.6	-179	0	0	0	0	110.1	Y189 V212	Y189-C208 HydrophobicContact CD1-CB 4.17Å; Y189-C208 HydrophobicContact CD2-CB 3.91Å; Y189-C208 HydrophobicContact CG-CB 3.68Å; C208-V212 WeakPolarHBondContact CA-O 3.38Å
209	R	93.9	Very high	95.2	Very high	43 Å²	43	24.3 Å²	24.3	16%	0.162	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	111.1	178.4	-67.8	-62	179.8	-106.6	-4.1	110.3	V108 L112 N211 V212 V439 E440	V108-R209 HydrophobicContact CG1-CB 3.82Å; L112-R209 HydrophobicContact CD2-CG 3.9Å; R209-N211 PolarHBondContact O-N 3.35Å; R209-V212 PolarHBondContact N-O 2.86Å; R209-V212 PolarHBondContact O-N 3.46Å; R209-V439 PolarHBondContact NH1-O 3.18Å; R209-V439 VanDerWaalsContact NH1-O 3.16Å; R209-E440 IonicContact CZ-OE1 3.98Å; R209-E440 IonicContact NH2-OE1 2.67Å; R209-E440 PolarHBondContact NH2-OE1 3.26Å
210	G	92.3	Very high	95	Very high	26 Å²	26	26.9 Å²	26.9	27%	0.268	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.1	-119.7	-178.5	0	0	0	0	0	111.1	S182 A185	S182-G210 WeakPolarHBondContact CA-O 3.44Å; A185-G210 WeakPolarHBondContact CB-O 3.28Å
211	N	93.8	Very high	94.6	Very high	12 Å²	12	34.3 Å²	34.3	6%	0.064	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.6	17.3	175.8	64.3	-53	0	0	0	113.5	T105 Y148 T150 V181 R209	T105-N211 PolarHBondContact OG1-ND2 2.95Å; Y148-N211 WeakPolarHBondContact CD2-O 3.17Å; Y148-N211 PolarHBondContact N-O 2.93Å; Y148-N211 PolarHBondContact O-ND2 3.14Å; T150-N211 HydrophobicContact CG2-CB 3.89Å; T150-N211 WeakPolarHBondContact CG2-ND2 3.5Å; V181-N211 HydrophobicContact CG1-CB 3.75Å; R209-N211 PolarHBondContact O-N 3.35Å
212	V	96.3	Very high	94	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	129.2	177.1	-173.8	0	0	0	0	110	T105 V108 L109 L112 V145 V147 C208 R209	T105-V212 HydrophobicContact CG2-CG2 4.04Å; V108-V212 HydrophobicContact CB-CG2 4.49Å; V108-V212 HydrophobicContact CG1-CB 4.29Å; V108-V212 HydrophobicContact CG1-CG2 3.9Å; L109-V212 HydrophobicContact CD2-CG1 3.91Å; L109-V212 HydrophobicContact CD2-CG2 4.26Å; L112-V212 HydrophobicContact CD1-CB 4.31Å; L112-V212 HydrophobicContact CD1-CG1 3.87Å; V145-V212 HydrophobicContact CG1-CG1 3.59Å; V147-V212 HydrophobicContact CG1-CG2 4.46Å; V147-V212 HydrophobicContact CG2-CG1 4.4Å; V147-V212 HydrophobicContact CG2-CG2 4.42Å; C208-V212 WeakPolarHBondContact CA-O 3.38Å; R209-V212 PolarHBondContact N-O 2.86Å; R209-V212 PolarHBondContact O-N 3.46Å
213	F	96.4	Very high	93.8	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	124.6	176.7	171.4	-145.2	0	0	0	109.9	K146 Y148 E188 Y189 M192 P205 M215	K146-F213 HydrophobicContact CB-CB 4.46Å; K146-F213 PolarHBondContact N-O 3.07Å; K146-F213 PolarHBondContact O-N 3.27Å; Y148-F213 HydrophobicContact CE2-CB 4.25Å; E188-F213 HydrophobicContact CG-CD1 4.13Å; E188-F213 HydrophobicContact CG-CE1 3.88Å; Y189-F213 AromaticContact CD2-CD2 3.97Å; Y189-F213 HydrophobicContact CD2-CD2 3.97Å; Y189-F213 AromaticContact CD2-CE2 3.68Å; Y189-F213 HydrophobicContact CD2-CE2 3.68Å; Y189-F213 HydrophobicContact CG-CE2 4.48Å; M192-F213 HydrophobicContact CB-CZ 4.23Å; M192-F213 HydrophobicContact CE-CE1 4.46Å; M192-F213 HydrophobicContact CG-CZ 4.33Å; P205-F213 HydrophobicContact CB-CE2 3.98Å; P205-F213 HydrophobicContact CB-CZ 4.15Å; F213-M215 HydrophobicContact CD1-CE 3.38Å; F213-M215 HydrophobicContact CE1-CE 3.21Å; F213-M215 HydrophobicContact CE1-SD 3.99Å; F213-M215 HydrophobicContact CE2-CB 4.23Å; F213-M215 HydrophobicContact CG-CE 4.17Å; F213-M215 HydrophobicContact CZ-CB 4.01Å; F213-M215 HydrophobicContact CZ-CE 3.86Å; F213-M215 HydrophobicContact CZ-SD 4.22Å
214	I	96.5	Very high	93.7	Very high	2 Å²	2	40 Å²	40	1%	0.01	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	131.4	179.4	-50.6	176.2	0	0	0	109.3	L112 H117 I118 M143 A144 V145 I206 A207	L112-I214 HydrophobicContact CD1-CD1 4.02Å; L112-I214 HydrophobicContact CD2-CD1 3.86Å; L112-I214 HydrophobicContact CG-CD1 4.37Å; H117-I214 HydrophobicContact CB-CD1 4.36Å; I118-I214 HydrophobicContact CD1-CD1 3.77Å; I118-I214 HydrophobicContact CD1-CG1 4.45Å; I118-I214 HydrophobicContact CG1-CD1 3.99Å; M143-I214 HydrophobicContact CB-CG2 4.26Å; M143-I214 HydrophobicContact CE-CG2 4.4Å; M143-I214 HydrophobicContact SD-CG2 3.81Å; A144-I214 WeakPolarHBondContact O-CA 3.37Å; V145-I214 HydrophobicContact CG2-CG1 4.42Å; I206-I214 HydrophobicContact CB-CB 4.32Å; I206-I214 HydrophobicContact CB-CG2 4.12Å; I206-I214 HydrophobicContact CD1-CG2 4.1Å; I206-I214 HydrophobicContact CG2-CG2 4.43Å; I206-I214 PolarHBondContact N-O 3.28Å; A207-I214 HydrophobicContact CB-CD1 4.48Å; A207-I214 PolarHBondContact N-O 2.8Å; A207-I214 PolarHBondContact O-N 3.31Å
215	M	96.4	Very high	93.7	Very high	14 Å²	14	36.6 Å²	36.6	7%	0.069	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	166.9	175	67.9	-164.8	95.5	0	0	111.2	M143 A144 K146 M192 P203 K204 F213	M143-M215 CarbonylContact C-O 3.56Å; M143-M215 WeakPolarHBondContact CA-O 3.46Å; M143-M215 WeakPolarHBondContact CB-O 3.29Å; A144-M215 HydrophobicContact CB-CG 3.96Å; A144-M215 PolarHBondContact N-O 2.96Å; A144-M215 PolarHBondContact O-N 3.17Å; K146-M215 HydrophobicContact CB-CE 3.84Å; K146-M215 HydrophobicContact CD-CE 4.15Å; M192-M215 HydrophobicContact CE-SD 4.43Å; P203-M215 HydrophobicContact CB-CB 4.05Å; P203-M215 HydrophobicContact CB-CG 3.93Å; P203-M215 HydrophobicContact CB-SD 3.89Å; P203-M215 HydrophobicContact CG-SD 4.17Å; K204-M215 CarbonylContact O-C 3.58Å; K204-M215 WeakPolarHBondContact O-CA 3.48Å; K204-M215 WeakPolarHBondContact O-CB 3.5Å; F213-M215 HydrophobicContact CD1-CE 3.38Å; F213-M215 HydrophobicContact CE1-CE 3.21Å; F213-M215 HydrophobicContact CE1-SD 3.99Å; F213-M215 HydrophobicContact CE2-CB 4.23Å; F213-M215 HydrophobicContact CG-CE 4.17Å; F213-M215 HydrophobicContact CZ-CB 4.01Å; F213-M215 HydrophobicContact CZ-CE 3.86Å; F213-M215 HydrophobicContact CZ-SD 4.22Å
216	S	95.6	Very high	93.7	Very high	32 Å²	32	38.7 Å²	38.7	22%	0.224	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	143	172.8	62.3	0	0	0	0	111.2	K204	K204-S216 PolarHBondContact N-OG 2.89Å; K204-S216 PolarHBondContact O-N 3.31Å
217	L	95.6	Very high	93.7	Very high	25 Å²	25	39.4 Å²	39.4	13%	0.131	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-77.4	136.9	169.5	-172.5	65.5	0	0	0	109.1	I125 D142 A144 A224	I125-L217 HydrophobicContact CD1-CD1 3.6Å; D142-L217 HydrophobicContact CB-CB 3.92Å; D142-L217 HydrophobicContact CB-CD2 3.89Å; D142-L217 PolarHBondContact O-N 3.5Å; D142-L217 VanDerWaalsContact O-N 3.11Å; A144-L217 HydrophobicContact CB-CD1 4.07Å; L217-A224 HydrophobicContact CD1-CB 4.15Å
218	L	94.4	Very high	93.8	Very high	19 Å²	19	39.5 Å²	39.5	10%	0.099	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-96.6	124	167.7	-62.1	175.8	0	0	0	107.6	P203 A224 A225 I269 Y276	P203-L218 HydrophobicContact CG-CD1 3.85Å; P203-L218 HydrophobicContact CG-CG 4.19Å; L218-A224 WeakPolarHBondContact O-CA 3.18Å; L218-A225 HydrophobicContact CB-CB 4.4Å; L218-A225 WeakPolarHBondContact O-CB 3.43Å; L218-A225 PolarHBondContact O-N 3.47Å; L218-I269 HydrophobicContact CB-CG2 4.24Å; L218-I269 HydrophobicContact CD1-CB 4.22Å; L218-I269 HydrophobicContact CD1-CD1 4.18Å; L218-I269 HydrophobicContact CD1-CG2 4.08Å; L218-Y276 VanDerWaalsContact CD1-CB 3.41Å; L218-Y276 HydrophobicContact CD1-CD1 3.64Å; L218-Y276 HydrophobicContact CD1-CD2 4.26Å; L218-Y276 HydrophobicContact CD1-CE1 4.47Å; L218-Y276 HydrophobicContact CD1-CG 3.52Å; L218-Y276 HydrophobicContact CD2-CD1 3.77Å; L218-Y276 HydrophobicContact CD2-CE1 3.79Å; L218-Y276 HydrophobicContact CD2-CG 4.26Å; L218-Y276 HydrophobicContact CG-CD1 4.39Å
219	G	92.3	Very high	93.8	Very high	24 Å²	24	43.5 Å²	43.5	25%	0.247	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	140.7	-176.4	-173	0	0	0	0	0	112.5	I223 H271	G219-I223 VanDerWaalsContact CA-O 3.25Å; G219-I223 WeakPolarHBondContact CA-O 3.31Å; G219-H271 WeakPolarHBondContact CA-NE2 3.29Å; G219-H271 PolarHBondContact N-NE2 3.3Å
220	E	89.7	Confident	93.8	Very high	134 Å²	134	46.5 Å²	46.5	63%	0.626	27%	0.266	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126	139.8	-176	-65.8	178.4	-176.2	0	0	109.7	G222 I223	E220-G222 VanDerWaalsContact C-N 3.33Å; E220-G222 PolarHBondContact O-N 3.4Å; E220-I223 PolarHBondContact N-O 3.44Å; E220-I223 WeakPolarHBondContact O-CB 3.5Å; E220-I223 PolarHBondContact O-N 3.05Å
221	D	86.9	Confident	93.9	Very high	161 Å²	161	46 Å²	46	86%	0.861	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.4	44.5	174.1	-61.4	-34.4	0	0	0	115.2	I223	D221-I223 PolarHBondContact O-N 2.73Å
222	G	85.8	Confident	93.8	Very high	22 Å²	22	54.7 Å²	54.7	23%	0.227	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.4	-1.7	-179.1	0	0	0	0	0	115.6	D142 E220	D142-G222 WeakPolarHBondContact OD2-CA 3.46Å; D142-G222 PolarHBondContact OD2-N 3.34Å; E220-G222 VanDerWaalsContact C-N 3.33Å; E220-G222 PolarHBondContact O-N 3.4Å
223	I	91.6	Very high	93.6	Very high	128 Å²	128	56.4 Å²	56.4	66%	0.656	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.5	120.5	175.7	-57.1	176.4	0	0	0	108.8	G219 E220 D221	G219-I223 VanDerWaalsContact CA-O 3.25Å; G219-I223 WeakPolarHBondContact CA-O 3.31Å; E220-I223 PolarHBondContact N-O 3.44Å; E220-I223 WeakPolarHBondContact O-CB 3.5Å; E220-I223 PolarHBondContact O-N 3.05Å; D221-I223 PolarHBondContact O-N 2.73Å
224	A	94.6	Very high	93.4	Very high	38 Å²	38	59 Å²	59	31%	0.314	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	138.2	177.2	0	0	0	0	0	111.6	I125 L217 L218	I125-A224 HydrophobicContact CG2-CB 3.64Å; L217-A224 HydrophobicContact CD1-CB 4.15Å; L218-A224 WeakPolarHBondContact O-CA 3.18Å
225	A	95.7	Very high	93.1	Very high	13 Å²	13	63.5 Å²	63.5	11%	0.107	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-63.4	145.4	174.9	0	0	0	0	0	111.6	L218 I269 H271	L218-A225 HydrophobicContact CB-CB 4.4Å; L218-A225 WeakPolarHBondContact O-CB 3.43Å; L218-A225 PolarHBondContact O-N 3.47Å; A225-I269 HydrophobicContact CB-CG2 3.51Å; A225-H271 HydrophobicContact CB-CB 3.96Å
226	P	95.9	Very high	92.9	Very high	61 Å²	61	70.8 Å²	70.8	40%	0.396	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-69.2	151.6	-175.9	29	-35.4	0	0	0	112.1	A231 Y270	P226-A231 HydrophobicContact CB-CB 4.45Å; P226-A231 HydrophobicContact CG-CB 4.16Å; P226-Y270 PolarHBondContact O-N 3.08Å
227	Q	95.9	Very high	92.8	Very high	60 Å²	60	71.4 Å²	71.4	28%	0.28	38%	0.382	S	S	.	.	B	Isolated β-bridge	trans	-65.6	151.9	165.2	-66	179.9	-11.5	0	0	109.8	K229 D230 A231 Y266 I268	Q227-K229 PolarHBondContact O-N 3.21Å; Q227-K229 VanDerWaalsContact O-N 3.16Å; Q227-D230 PolarHBondContact O-N 2.88Å; Q227-A231 WeakPolarHBondContact O-CB 3.15Å; Q227-A231 PolarHBondContact O-N 3.04Å; Q227-Y266 PolarHBondContact NE2-O 2.84Å; Q227-I268 CarbonylContact C-O 3.44Å; Q227-I268 WeakPolarHBondContact CA-O 3.47Å
228	L	95.8	Very high	92.7	Very high	2 Å²	2	70.5 Å²	70.5	1%	0.01	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-31.7	-178.6	-177.6	61.1	0	0	0	111.9	D230 V233 L241 E265 I268 Y305 F306	L228-D230 VanDerWaalsContact C-N 3.32Å; L228-D230 PolarHBondContact O-N 3.44Å; L228-V233 HydrophobicContact CD1-CG2 4.05Å; L228-L241 HydrophobicContact CD1-CD1 3.79Å; L228-E265 PolarHBondContact N-O 3.23Å; L228-I268 HydrophobicContact CB-CB 4.02Å; L228-I268 HydrophobicContact CB-CG2 4.09Å; L228-I268 WeakPolarHBondContact CB-O 3.27Å; L228-I268 HydrophobicContact CD2-CB 4.21Å; L228-I268 HydrophobicContact CD2-CD1 4.13Å; L228-I268 HydrophobicContact CD2-CG2 4.01Å; L228-I268 PolarHBondContact N-O 3.34Å; L228-Y305 HydrophobicContact CD2-CD1 4.29Å; L228-Y305 HydrophobicContact CD2-CE1 3.66Å; L228-Y305 HydrophobicContact CG-CE1 3.83Å; L228-Y305 PolarHBondContact O-OH 3.25Å; L228-F306 HydrophobicContact CD2-CZ 3.98Å
229	K	94.6	Very high	92.6	Very high	98 Å²	98	71.4 Å²	71.4	43%	0.426	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-45	171.2	178.5	-179.9	167.8	-176.8	0	113.6	Q227 E265 Y266	Q227-K229 PolarHBondContact O-N 3.21Å; Q227-K229 VanDerWaalsContact O-N 3.16Å; K229-E265 HydrophobicContact CB-CB 4.33Å; K229-E265 HydrophobicContact CB-CG 3.78Å; K229-E265 HydrophobicContact CG-CG 4.34Å; K229-E265 PolarHBondContact N-O 3.05Å; K229-Y266 HydrophobicContact CD-CD1 3.84Å; K229-Y266 HydrophobicContact CD-CE1 3.24Å; K229-Y266 HydrophobicContact CD-CE2 4.31Å; K229-Y266 VanDerWaalsContact CD-CZ 3.48Å; K229-Y266 VanDerWaalsContact NZ-CE1 3.32Å; K229-Y266 PolarHBondContact NZ-OH 2.83Å; K229-Y266 VanDerWaalsContact NZ-OH 3.08Å
230	D	95	Very high	92.7	Very high	106 Å²	106	77.7 Å²	77.7	57%	0.567	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	-7	-171.4	-56.8	-40.3	0	0	0	112	Q227 L228	Q227-D230 PolarHBondContact O-N 2.88Å; L228-D230 VanDerWaalsContact C-N 3.32Å; L228-D230 PolarHBondContact O-N 3.44Å
231	A	93.5	Very high	93	Very high	16 Å²	16	71.4 Å²	71.4	13%	0.132	37%	0.373	C	S	.	.	S	Bend	trans	-74.1	136.1	179.3	0	0	0	0	0	111.8	P226 Q227 V233 Y270	P226-A231 HydrophobicContact CB-CB 4.45Å; P226-A231 HydrophobicContact CG-CB 4.16Å; Q227-A231 WeakPolarHBondContact O-CB 3.15Å; Q227-A231 PolarHBondContact O-N 3.04Å; A231-V233 HydrophobicContact CB-CG2 3.86Å; A231-V233 PolarHBondContact O-N 2.96Å; A231-Y270 HydrophobicContact CB-CD1 3.83Å; A231-Y270 HydrophobicContact CB-CG 3.98Å
232	Q	91.4	Very high	93.3	Very high	193 Å²	193	63.7 Å²	63.7	90%	0.902	33%	0.332	S	S	*	.			trans	-82.9	99.6	170.1	-66.5	-176.9	-16.1	0	0	109.2
233	V	92	Very high	93.8	Very high	37 Å²	37	63.6 Å²	63.6	22%	0.224	33%	0.328	C	S	.	.			trans	-112.4	129.8	-176.2	-175.4	0	0	0	0	109.5	L228 A231 E237 A238 L241 Y270	L228-V233 HydrophobicContact CD1-CG2 4.05Å; A231-V233 HydrophobicContact CB-CG2 3.86Å; A231-V233 PolarHBondContact O-N 2.96Å; V233-E237 HydrophobicContact CG1-CB 3.52Å; V233-A238 HydrophobicContact CG1-CB 4Å; V233-L241 HydrophobicContact CG1-CD1 3.7Å; V233-L241 HydrophobicContact CG2-CD1 4.17Å; V233-Y270 HydrophobicContact CG2-CD2 4.34Å; V233-Y270 HydrophobicContact CG2-CE2 4.37Å; V233-Y270 HydrophobicContact CG2-CG 4.4Å
234	S	93	Very high	93.9	Very high	54 Å²	54	59 Å²	59	38%	0.378	30%	0.303	S	S	.	.			trans	-70.1	160.6	173.9	65.2	0	0	0	0	111.9	E236 E237 A238	S234-E236 VanDerWaalsContact C-N 3.26Å; S234-E236 PolarHBondContact O-N 3.05Å; S234-E237 WeakPolarHBondContact CB-OE2 3.48Å; S234-E237 PolarHBondContact N-OE2 3.44Å; S234-E237 VanDerWaalsContact N-OE2 3.09Å; S234-E237 PolarHBondContact O-N 3.26Å; S234-E237 VanDerWaalsContact O-N 3.16Å; S234-E237 WeakPolarHBondContact OG-CB 3.31Å; S234-E237 WeakPolarHBondContact OG-CG 3.4Å; S234-E237 PolarHBondContact OG-N 3.35Å; S234-E237 PolarHBondContact OG-OE2 3.02Å; S234-A238 WeakPolarHBondContact O-CB 3.48Å; S234-A238 PolarHBondContact O-N 3.09Å
235	Q	90.1	Very high	94	Very high	97 Å²	97	57.1 Å²	57.1	45%	0.453	29%	0.288	S	S	.	.	H	α-helix	trans	-58.2	-38.5	-179.4	-165.3	62.5	38.7	0	0	113.3	S239 S309 G310	Q235-S239 PolarHBondContact O-N 2.98Å; Q235-S239 VanDerWaalsContact O-N 3.13Å; Q235-S239 PolarHBondContact O-OG 3.1Å; Q235-S309 PolarHBondContact NE2-O 3.46Å; Q235-S309 PolarHBondContact OE1-O 2.86Å; Q235-G310 PolarHBondContact NE2-O 2.82Å
236	E	91.1	Very high	94	Very high	167 Å²	167	56.5 Å²	56.5	78%	0.78	28%	0.283	S	S	*	.	H	α-helix	trans	-67.4	-44.1	178.1	-63.5	-178.6	-178.3	0	0	111	S234 S239 R240	S234-E236 VanDerWaalsContact C-N 3.26Å; S234-E236 PolarHBondContact O-N 3.05Å; E236-S239 PolarHBondContact O-N 3.2Å; E236-R240 PolarHBondContact O-N 3.4Å
237	E	93.8	Very high	94	Very high	45 Å²	45	55.5 Å²	55.5	21%	0.21	27%	0.274	C	S	.	.	H	α-helix	trans	-65.7	-41.5	175.9	-71.8	166.3	150.3	0	0	111.3	V233 S234 S239 R240 L241 Y270	V233-E237 HydrophobicContact CG1-CB 3.52Å; S234-E237 WeakPolarHBondContact CB-OE2 3.48Å; S234-E237 PolarHBondContact N-OE2 3.44Å; S234-E237 VanDerWaalsContact N-OE2 3.09Å; S234-E237 PolarHBondContact O-N 3.26Å; S234-E237 VanDerWaalsContact O-N 3.16Å; S234-E237 WeakPolarHBondContact OG-CB 3.31Å; S234-E237 WeakPolarHBondContact OG-CG 3.4Å; S234-E237 PolarHBondContact OG-N 3.35Å; S234-E237 PolarHBondContact OG-OE2 3.02Å; E237-S239 VanDerWaalsContact C-N 3.26Å; E237-S239 PolarHBondContact O-N 3.05Å; E237-R240 WeakPolarHBondContact O-CB 3.35Å; E237-R240 PolarHBondContact O-N 3.36Å; E237-R240 VanDerWaalsContact O-N 3.1Å; E237-L241 WeakPolarHBondContact O-CB 2.9Å; E237-L241 VanDerWaalsContact O-CG 3.29Å; E237-L241 WeakPolarHBondContact O-CG 3.11Å; E237-L241 PolarHBondContact O-N 3.2Å; E237-Y270 PolarHBondContact OE1-OH 3.02Å
238	A	93.6	Very high	94.1	Very high	6 Å²	6	53.2 Å²	53.2	5%	0.05	26%	0.263	C	S	.	.	H	α-helix	trans	-59.6	-39	177.4	0	0	0	0	0	111.6	V233 S234 L241 Y242 F306 V311	V233-A238 HydrophobicContact CG1-CB 4Å; S234-A238 WeakPolarHBondContact O-CB 3.48Å; S234-A238 PolarHBondContact O-N 3.09Å; A238-L241 PolarHBondContact O-N 3.12Å; A238-Y242 WeakPolarHBondContact O-CB 3.3Å; A238-Y242 PolarHBondContact O-N 2.92Å; A238-F306 WeakPolarHBondContact O-CE1 3.2Å; A238-V311 HydrophobicContact CB-CG2 3.57Å
239	S	92.8	Very high	94.1	Very high	38 Å²	38	53.3 Å²	53.3	27%	0.266	26%	0.264	S	S	.	.	H	α-helix	trans	-65.7	-39.6	175.9	-56.8	0	0	0	0	112.3	Q235 E236 E237 S243	Q235-S239 PolarHBondContact O-N 2.98Å; Q235-S239 VanDerWaalsContact O-N 3.13Å; Q235-S239 PolarHBondContact O-OG 3.1Å; E236-S239 PolarHBondContact O-N 3.2Å; E237-S239 VanDerWaalsContact C-N 3.26Å; E237-S239 PolarHBondContact O-N 3.05Å; S239-S243 PolarHBondContact O-N 3.15Å; S239-S243 PolarHBondContact O-OG 3.01Å; S239-S243 VanDerWaalsContact O-OG 3.05Å
240	R	93.5	Very high	94.2	Very high	155 Å²	155	49.2 Å²	49.2	59%	0.585	25%	0.246	S	C	*	.	H	α-helix	trans	-67.3	-43.8	174.5	-179.8	178.1	171.4	164.2	-3.5	111.8	E236 E237 S243 Q244	E236-R240 PolarHBondContact O-N 3.4Å; E237-R240 WeakPolarHBondContact O-CB 3.35Å; E237-R240 PolarHBondContact O-N 3.36Å; E237-R240 VanDerWaalsContact O-N 3.1Å; R240-S243 PolarHBondContact O-N 3.05Å; R240-Q244 WeakPolarHBondContact O-CB 3.49Å; R240-Q244 PolarHBondContact O-N 3.42Å
241	L	95.6	Very high	94.2	Very high	2 Å²	2	45.5 Å²	45.5	1%	0.01	23%	0.225	C	C	.	.	H	α-helix	trans	-63.8	-40.5	177.6	-69	175.2	0	0	0	111.2	L228 V233 E237 A238 S243 Q244 V245 Y270 A275 F306	L228-L241 HydrophobicContact CD1-CD1 3.79Å; V233-L241 HydrophobicContact CG1-CD1 3.7Å; V233-L241 HydrophobicContact CG2-CD1 4.17Å; E237-L241 WeakPolarHBondContact O-CB 2.9Å; E237-L241 VanDerWaalsContact O-CG 3.29Å; E237-L241 WeakPolarHBondContact O-CG 3.11Å; E237-L241 PolarHBondContact O-N 3.2Å; A238-L241 PolarHBondContact O-N 3.12Å; L241-S243 VanDerWaalsContact C-N 3.35Å; L241-S243 PolarHBondContact O-N 3.5Å; L241-Q244 PolarHBondContact O-N 3.41Å; L241-V245 VanDerWaalsContact O-CG2 3.28Å; L241-V245 WeakPolarHBondContact O-CG2 3.48Å; L241-V245 PolarHBondContact O-N 3.1Å; L241-Y270 HydrophobicContact CD1-CD2 3.73Å; L241-Y270 HydrophobicContact CD1-CE2 3.83Å; L241-Y270 HydrophobicContact CD2-CD2 4.17Å; L241-Y270 HydrophobicContact CD2-CE2 4.27Å; L241-A275 HydrophobicContact CD2-CB 4.01Å; L241-F306 HydrophobicContact CB-CE1 4.04Å; L241-F306 HydrophobicContact CB-CZ 4.16Å
242	Y	95.2	Very high	94.3	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-56	-50.7	174.6	174.3	-119.3	0	0	0	111.4	A238 Q244 V245 C246 V302 F306 V311 V313 V314 F337 L341	A238-Y242 WeakPolarHBondContact O-CB 3.3Å; A238-Y242 PolarHBondContact O-N 2.92Å; Y242-Q244 VanDerWaalsContact C-N 3.3Å; Y242-Q244 PolarHBondContact O-N 3.19Å; Y242-V245 PolarHBondContact O-N 3.2Å; Y242-C246 WeakPolarHBondContact CE2-SG 3.37Å; Y242-C246 PolarHBondContact O-N 2.88Å; Y242-C246 PolarHBondContact O-SG 2.74Å; Y242-V302 HydrophobicContact CD2-CG1 4.47Å; Y242-V302 HydrophobicContact CE2-CG1 4.45Å; Y242-F306 HydrophobicContact CD2-CB 3.76Å; Y242-F306 HydrophobicContact CD2-CD1 4.4Å; Y242-F306 AromaticContact CD2-CD2 3.43Å; Y242-F306 HydrophobicContact CD2-CD2 3.43Å; Y242-F306 VanDerWaalsContact CD2-CD2 3.43Å; Y242-F306 HydrophobicContact CD2-CE2 4.08Å; Y242-F306 AromaticContact CD2-CG 3.61Å; Y242-F306 HydrophobicContact CD2-CG 3.61Å; Y242-F306 HydrophobicContact CE2-CB 4.39Å; Y242-F306 HydrophobicContact CE2-CD2 4.32Å; Y242-F306 HydrophobicContact CG-CB 4.2Å; Y242-F306 HydrophobicContact CG-CD1 4.43Å; Y242-F306 HydrophobicContact CG-CD2 4.2Å; Y242-F306 HydrophobicContact CG-CG 4.03Å; Y242-V311 HydrophobicContact CD1-CG1 4.21Å; Y242-V311 HydrophobicContact CG-CG1 4.34Å; Y242-V313 HydrophobicContact CD2-CG1 4.37Å; Y242-V313 HydrophobicContact CE1-CB 4.27Å; Y242-V313 HydrophobicContact CE1-CG1 4.22Å; Y242-V313 HydrophobicContact CE2-CB 4.36Å; Y242-V313 HydrophobicContact CE2-CG1 3.97Å; Y242-V314 PolarHBondContact OH-N 3.03Å; Y242-F337 HydrophobicContact CD1-CZ 4.49Å; Y242-F337 HydrophobicContact CE1-CE1 4.32Å; Y242-F337 AromaticContact CE1-CZ 3.89Å; Y242-F337 HydrophobicContact CE1-CZ 3.89Å; Y242-L341 HydrophobicContact CE1-CD1 4.07Å
243	S	94.4	Very high	94.6	Very high	19 Å²	19	37.1 Å²	37.1	13%	0.133	18%	0.182	C	C	.	.	H	α-helix	trans	-60.9	-42	178.6	-54	0	0	0	0	111.3	S239 R240 L241 C246 L247	S239-S243 PolarHBondContact O-N 3.15Å; S239-S243 PolarHBondContact O-OG 3.01Å; S239-S243 VanDerWaalsContact O-OG 3.05Å; R240-S243 PolarHBondContact O-N 3.05Å; L241-S243 VanDerWaalsContact C-N 3.35Å; L241-S243 PolarHBondContact O-N 3.5Å; S243-C246 PolarHBondContact O-N 3.24Å; S243-L247 VanDerWaalsContact O-CG 3.28Å; S243-L247 WeakPolarHBondContact O-CG 3.47Å; S243-L247 PolarHBondContact O-N 3.31Å; S243-L247 VanDerWaalsContact O-N 3.07Å
244	Q	95.6	Very high	94.7	Very high	31 Å²	31	37 Å²	37	15%	0.145	18%	0.179	C	C	.	.	H	α-helix	trans	-63.2	-46.2	176.9	-175.6	174.3	42.9	0	0	112.6	R240 L241 Y242 C246 L247 F248 N274	R240-Q244 WeakPolarHBondContact O-CB 3.49Å; R240-Q244 PolarHBondContact O-N 3.42Å; L241-Q244 PolarHBondContact O-N 3.41Å; Y242-Q244 VanDerWaalsContact C-N 3.3Å; Y242-Q244 PolarHBondContact O-N 3.19Å; Q244-C246 PolarHBondContact O-N 3.5Å; Q244-L247 WeakPolarHBondContact O-CB 3.48Å; Q244-L247 PolarHBondContact O-N 2.82Å; Q244-F248 HydrophobicContact CG-CD2 4.32Å; Q244-F248 HydrophobicContact CG-CE1 4.06Å; Q244-F248 HydrophobicContact CG-CE2 3.66Å; Q244-F248 HydrophobicContact CG-CZ 3.5Å; Q244-F248 WeakPolarHBondContact O-CG 3.21Å; Q244-F248 PolarHBondContact O-N 2.86Å; Q244-N274 PolarHBondContact NE2-OD1 3.4Å
245	V	96.7	Very high	94.7	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-65.3	-39.5	179.2	174	0	0	0	0	110.9	L241 Y242 L247 F248 I249 L263 I268 A275 V302 F306	L241-V245 VanDerWaalsContact O-CG2 3.28Å; L241-V245 WeakPolarHBondContact O-CG2 3.48Å; L241-V245 PolarHBondContact O-N 3.1Å; Y242-V245 PolarHBondContact O-N 3.2Å; V245-L247 VanDerWaalsContact C-N 3.33Å; V245-L247 PolarHBondContact O-N 3.23Å; V245-F248 WeakPolarHBondContact O-CB 3.48Å; V245-F248 PolarHBondContact O-N 3.41Å; V245-F248 VanDerWaalsContact O-N 3.14Å; V245-I249 HydrophobicContact CG1-CD1 4.5Å; V245-I249 WeakPolarHBondContact O-CG1 3.3Å; V245-I249 PolarHBondContact O-N 2.9Å; V245-L263 HydrophobicContact CG1-CD2 4.29Å; V245-I268 HydrophobicContact CG1-CD1 4.11Å; V245-I268 HydrophobicContact CG2-CD1 3.97Å; V245-A275 HydrophobicContact CG2-CB 3.9Å; V245-V302 HydrophobicContact CG1-CG1 3.8Å; V245-V302 HydrophobicContact CG1-CG2 4.01Å; V245-F306 HydrophobicContact CB-CE2 4.37Å; V245-F306 HydrophobicContact CG2-CE2 4.36Å; V245-F306 HydrophobicContact CG2-CZ 4.29Å
246	C	95.6	Very high	95	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-62.7	-40.3	175.4	-66.1	0	0	0	0	112.1	Y242 S243 Q244 F248 I249 R250 L319 F337	Y242-C246 WeakPolarHBondContact CE2-SG 3.37Å; Y242-C246 PolarHBondContact O-N 2.88Å; Y242-C246 PolarHBondContact O-SG 2.74Å; S243-C246 PolarHBondContact O-N 3.24Å; Q244-C246 PolarHBondContact O-N 3.5Å; C246-F248 VanDerWaalsContact C-N 3.34Å; C246-I249 PolarHBondContact O-N 2.94Å; C246-R250 PolarHBondContact O-N 3.46Å; C246-L319 HydrophobicContact CB-CD1 3.73Å; C246-L319 VanDerWaalsContact SG-CD1 3.57Å; C246-F337 HydrophobicContact CB-CD2 4.21Å; C246-F337 HydrophobicContact CB-CE1 4.04Å; C246-F337 HydrophobicContact CB-CE2 3.55Å; C246-F337 HydrophobicContact CB-CZ 3.44Å; C246-F337 VanDerWaalsContact CB-CZ 3.44Å; C246-F337 VanDerWaalsContact SG-CZ 3.57Å
247	L	95.7	Very high	95.2	Very high	39 Å²	39	30.8 Å²	30.8	20%	0.204	15%	0.148	C	C	.	.	H	α-helix	trans	-64	-38.6	172.6	-68.8	169.6	0	0	0	111.8	S243 Q244 V245 R250 E251 F322 D333 K334 F337	S243-L247 VanDerWaalsContact O-CG 3.28Å; S243-L247 WeakPolarHBondContact O-CG 3.47Å; S243-L247 PolarHBondContact O-N 3.31Å; S243-L247 VanDerWaalsContact O-N 3.07Å; Q244-L247 WeakPolarHBondContact O-CB 3.48Å; Q244-L247 PolarHBondContact O-N 2.82Å; V245-L247 VanDerWaalsContact C-N 3.33Å; V245-L247 PolarHBondContact O-N 3.23Å; L247-R250 PolarHBondContact O-N 2.79Å; L247-E251 WeakPolarHBondContact O-CB 3.34Å; L247-E251 PolarHBondContact O-N 2.9Å; L247-F322 HydrophobicContact CD2-CE1 4.45Å; L247-F322 HydrophobicContact CD2-CZ 3.98Å; L247-D333 HydrophobicContact CD2-CB 3.88Å; L247-K334 HydrophobicContact CD1-CB 4.07Å; L247-K334 HydrophobicContact CD1-CG 4.1Å; L247-K334 HydrophobicContact CD2-CB 4.44Å; L247-F337 HydrophobicContact CD2-CB 4.39Å
248	F	97	Very high	95.3	Very high	12 Å²	12	28.7 Å²	28.7	5%	0.053	14%	0.139	C	C	.	.	H	α-helix	trans	-64.2	-41.3	174.5	-65.5	-21.4	0	0	0	112.8	V200 L201 Q244 V245 C246 R250 E251 M252 A275 I277	V200-F248 HydrophobicContact CB-CD1 4.28Å; V200-F248 HydrophobicContact CG1-CB 4.31Å; V200-F248 HydrophobicContact CG1-CD1 4.21Å; V200-F248 HydrophobicContact CG1-CD2 4.42Å; V200-F248 HydrophobicContact CG1-CG 4.09Å; V200-F248 HydrophobicContact CG2-CB 4.34Å; V200-F248 HydrophobicContact CG2-CD1 4.14Å; V200-F248 HydrophobicContact CG2-CG 4.45Å; L201-F248 HydrophobicContact CB-CE2 4.36Å; L201-F248 HydrophobicContact CB-CZ 3.84Å; L201-F248 HydrophobicContact CD1-CZ 4.17Å; L201-F248 HydrophobicContact CG-CE1 4.48Å; L201-F248 HydrophobicContact CG-CZ 3.86Å; Q244-F248 HydrophobicContact CG-CD2 4.32Å; Q244-F248 HydrophobicContact CG-CE1 4.06Å; Q244-F248 HydrophobicContact CG-CE2 3.66Å; Q244-F248 HydrophobicContact CG-CZ 3.5Å; Q244-F248 WeakPolarHBondContact O-CG 3.21Å; Q244-F248 PolarHBondContact O-N 2.86Å; V245-F248 WeakPolarHBondContact O-CB 3.48Å; V245-F248 PolarHBondContact O-N 3.41Å; V245-F248 VanDerWaalsContact O-N 3.14Å; C246-F248 VanDerWaalsContact C-N 3.34Å; F248-R250 VanDerWaalsContact C-N 3.28Å; F248-R250 PolarHBondContact O-N 3.49Å; F248-E251 PolarHBondContact O-N 3.31Å; F248-M252 VanDerWaalsContact O-CB 3.27Å; F248-M252 WeakPolarHBondContact O-CB 3.39Å; F248-M252 WeakPolarHBondContact O-CG 3.47Å; F248-M252 PolarHBondContact O-N 3.23Å; F248-A275 HydrophobicContact CE2-CB 4.17Å; F248-A275 VanDerWaalsContact CE2-O 3.29Å; F248-A275 WeakPolarHBondContact CE2-O 3.23Å; F248-I277 HydrophobicContact CD2-CD1 4.03Å; F248-I277 HydrophobicContact CD2-CG1 3.87Å; F248-I277 HydrophobicContact CE2-CG1 4.5Å
249	I	96.8	Very high	95.5	Very high	5 Å²	5	28.5 Å²	28.5	3%	0.026	14%	0.137	C	C	.	.	H	α-helix	trans	-56.5	-47	175	-67.7	169.6	0	0	0	110.1	V245 C246 M252 Y253 L263 L295 V302 L319 A323	V245-I249 HydrophobicContact CG1-CD1 4.5Å; V245-I249 WeakPolarHBondContact O-CG1 3.3Å; V245-I249 PolarHBondContact O-N 2.9Å; C246-I249 PolarHBondContact O-N 2.94Å; I249-M252 PolarHBondContact O-N 3.29Å; I249-Y253 WeakPolarHBondContact O-CB 3.39Å; I249-Y253 PolarHBondContact O-N 2.82Å; I249-L263 HydrophobicContact CD1-CD2 3.88Å; I249-L263 HydrophobicContact CG1-CD2 3.56Å; I249-L295 HydrophobicContact CG2-CD1 3.68Å; I249-V302 HydrophobicContact CD1-CB 4.44Å; I249-V302 HydrophobicContact CD1-CG1 4.44Å; I249-V302 HydrophobicContact CD1-CG2 4.19Å; I249-L319 HydrophobicContact CD1-CD2 4.45Å; I249-A323 HydrophobicContact CG2-CB 3.9Å
250	R	95.6	Very high	95.7	Very high	11 Å²	11	26.8 Å²	26.8	4%	0.042	13%	0.125	C	C	.	.	H	α-helix	trans	-63.4	-48.7	177.6	180	173.4	171.6	69.9	13	112	C246 L247 F248 M252 Y253 Q254 F322 D325 I328 D333	C246-R250 PolarHBondContact O-N 3.46Å; L247-R250 PolarHBondContact O-N 2.79Å; F248-R250 VanDerWaalsContact C-N 3.28Å; F248-R250 PolarHBondContact O-N 3.49Å; R250-M252 VanDerWaalsContact C-N 3.33Å; R250-M252 PolarHBondContact O-N 2.94Å; R250-Y253 PolarHBondContact O-N 3.3Å; R250-Q254 HydrophobicContact CG-CG 4Å; R250-Q254 WeakPolarHBondContact O-CB 3.2Å; R250-Q254 WeakPolarHBondContact O-CG 3.43Å; R250-Q254 PolarHBondContact O-N 3.03Å; R250-F322 HydrophobicContact CB-CD1 4.23Å; R250-F322 HydrophobicContact CB-CE1 3.71Å; R250-F322 HydrophobicContact CB-CZ 4.32Å; R250-F322 VanDerWaalsContact CD-CE1 3.45Å; R250-F322 HydrophobicContact CG-CE1 4.19Å; R250-F322 HydrophobicContact CG-CZ 4.39Å; R250-F322 PolarHBondContact NH1-O 2.95Å; R250-D325 PolarHBondContact NH1-O 2.96Å; R250-D325 PolarHBondContact NH2-O 3.2Å; R250-I328 PolarHBondContact NH2-O 3.43Å; R250-D333 IonicContact CZ-OD1 3.85Å; R250-D333 IonicContact NE-OD1 2.73Å; R250-D333 PolarHBondContact NE-OD1 3.05Å; R250-D333 IonicContact NH2-OD1 3.32Å; R250-D333 PolarHBondContact NH2-OD1 3.34Å
251	E	94.9	Very high	95.8	Very high	29 Å²	29	19.4 Å²	19.4	14%	0.136	10%	0.097	C	C	.	.	H	α-helix	trans	-61.7	-41.3	179.3	-176.5	75.1	164.8	0	0	111.7	S198 S199 V200 L247 F248 Y253 V255 C256	S198-E251 WeakPolarHBondContact CB-OE1 3.49Å; S199-E251 PolarHBondContact N-OE1 2.97Å; S199-E251 VanDerWaalsContact N-OE1 3.15Å; S199-E251 VanDerWaalsContact OG-CG 3.29Å; S199-E251 WeakPolarHBondContact OG-CG 3.43Å; S199-E251 PolarHBondContact OG-OE1 3Å; V200-E251 HydrophobicContact CG2-CB 3.87Å; V200-E251 HydrophobicContact CG2-CG 3.67Å; L247-E251 WeakPolarHBondContact O-CB 3.34Å; L247-E251 PolarHBondContact O-N 2.9Å; F248-E251 PolarHBondContact O-N 3.31Å; E251-Y253 VanDerWaalsContact C-N 3.34Å; E251-Y253 PolarHBondContact O-N 2.91Å; E251-V255 HydrophobicContact CG-CB 4.33Å; E251-V255 WeakPolarHBondContact O-CA 3.38Å; E251-V255 WeakPolarHBondContact O-CB 3.27Å; E251-V255 PolarHBondContact O-N 2.96Å; E251-V255 WeakPolarHBondContact OE2-CG2 3.48Å; E251-C256 PolarHBondContact O-N 3.4Å
252	M	96.9	Very high	95.7	Very high	5 Å²	5	22.1 Å²	22.1	3%	0.025	11%	0.111	C	C	.	.	I	π-helix	trans	-59.4	-46.4	174.9	-74.3	-178.7	66.9	0	0	110.8	L195 V200 F248 I249 R250 C256 K257 L258 H260 I277	L195-M252 HydrophobicContact CD2-CE 4.36Å; L195-M252 HydrophobicContact CD2-SD 4.45Å; V200-M252 HydrophobicContact CG2-CG 3.88Å; F248-M252 VanDerWaalsContact O-CB 3.27Å; F248-M252 WeakPolarHBondContact O-CB 3.39Å; F248-M252 WeakPolarHBondContact O-CG 3.47Å; F248-M252 PolarHBondContact O-N 3.23Å; I249-M252 PolarHBondContact O-N 3.29Å; R250-M252 VanDerWaalsContact C-N 3.33Å; R250-M252 PolarHBondContact O-N 2.94Å; M252-C256 CarbonylContact O-C 3.54Å; M252-C256 WeakPolarHBondContact O-CA 3.14Å; M252-C256 VanDerWaalsContact O-CB 3.26Å; M252-C256 WeakPolarHBondContact O-CB 3.37Å; M252-C256 PolarHBondContact O-N 3.32Å; M252-K257 PolarHBondContact O-N 3.1Å; M252-L258 CarbonylContact C-O 3.41Å; M252-L258 PolarHBondContact O-N 2.9Å; M252-H260 HydrophobicContact CE-CB 3.76Å; M252-I277 HydrophobicContact SD-CG2 4.47Å
253	Y	96.2	Very high	95.8	Very high	28 Å²	28	22.2 Å²	22.2	11%	0.11	11%	0.112	C	C	.	.	I	π-helix	trans	-71.6	-48.1	-179.4	-170.2	-97.7	0	0	0	112.8	I249 R250 E251 K257 L258 V259 C286 I292 L295 A323 V324	I249-Y253 WeakPolarHBondContact O-CB 3.39Å; I249-Y253 PolarHBondContact O-N 2.82Å; R250-Y253 PolarHBondContact O-N 3.3Å; E251-Y253 VanDerWaalsContact C-N 3.34Å; E251-Y253 PolarHBondContact O-N 2.91Å; Y253-K257 WeakPolarHBondContact O-CA 3.43Å; Y253-K257 WeakPolarHBondContact O-CD 3.35Å; Y253-L258 PolarHBondContact N-O 3.34Å; Y253-V259 HydrophobicContact CD2-CG2 3.83Å; Y253-V259 HydrophobicContact CE2-CG2 4.17Å; Y253-C286 HydrophobicContact CE2-CB 4.23Å; Y253-I292 HydrophobicContact CE2-CD1 4.47Å; Y253-L295 HydrophobicContact CD2-CD2 3.65Å; Y253-L295 HydrophobicContact CE2-CD2 3.73Å; Y253-L295 HydrophobicContact CG-CD2 4.21Å; Y253-A323 WeakPolarHBondContact CD1-O 3.29Å; Y253-V324 HydrophobicContact CE1-CB 4.2Å; Y253-V324 HydrophobicContact CE1-CG1 4.14Å; Y253-V324 HydrophobicContact CE1-CG2 3.97Å
254	Q	94.4	Very high	95.9	Very high	33 Å²	33	22 Å²	22	15%	0.154	11%	0.11	C	C	.	.	I	π-helix	trans	-80.9	-45.5	-171.8	-65.7	-62.1	-13.3	0	0	113.3	R250 K257 A323 V324 D325	R250-Q254 HydrophobicContact CG-CG 4Å; R250-Q254 WeakPolarHBondContact O-CB 3.2Å; R250-Q254 WeakPolarHBondContact O-CG 3.43Å; R250-Q254 PolarHBondContact O-N 3.03Å; Q254-K257 WeakPolarHBondContact O-CD 3.28Å; Q254-K257 WeakPolarHBondContact O-CE 3.44Å; Q254-K257 PolarHBondContact O-NZ 2.89Å; Q254-A323 PolarHBondContact NE2-O 3.04Å; Q254-V324 PolarHBondContact NE2-O 3.03Å; Q254-D325 PolarHBondContact NE2-O 2.86Å
255	V	94.2	Very high	95.9	Very high	83 Å²	83	22.4 Å²	22.4	50%	0.503	11%	0.112	S	C	.	.	I	π-helix	trans	-96.3	-53.1	-174.5	178.6	0	0	0	0	110.3	E251 K257	E251-V255 HydrophobicContact CG-CB 4.33Å; E251-V255 WeakPolarHBondContact O-CA 3.38Å; E251-V255 WeakPolarHBondContact O-CB 3.27Å; E251-V255 PolarHBondContact O-N 2.96Å; E251-V255 WeakPolarHBondContact OE2-CG2 3.48Å; V255-K257 PolarHBondContact O-N 2.84Å
256	C	95.1	Very high	95.8	Very high	5 Å²	5	27.1 Å²	27.1	3%	0.034	13%	0.131	C	C	.	.	I	π-helix	trans	-72.4	-19.9	-178.3	-59.7	0	0	0	0	112.7	R194 S198 E251 M252 L258	R194-C256 PolarHBondContact NE-O 3.02Å; R194-C256 PolarHBondContact NH2-O 3.4Å; S198-C256 VanDerWaalsContact CB-SG 3.52Å; S198-C256 PolarHBondContact OG-SG 3.42Å; E251-C256 PolarHBondContact O-N 3.4Å; M252-C256 CarbonylContact O-C 3.54Å; M252-C256 WeakPolarHBondContact O-CA 3.14Å; M252-C256 VanDerWaalsContact O-CB 3.26Å; M252-C256 WeakPolarHBondContact O-CB 3.37Å; M252-C256 PolarHBondContact O-N 3.32Å; C256-L258 VanDerWaalsContact C-N 3.28Å; C256-L258 HydrophobicContact CB-CB 4.27Å; C256-L258 HydrophobicContact CB-CD1 4.3Å; C256-L258 HydrophobicContact CB-CG 4.35Å; C256-L258 PolarHBondContact O-N 3.17Å
257	K	95.6	Very high	95.8	Very high	100 Å²	100	27.9 Å²	27.9	44%	0.435	14%	0.135	S	C	.	.			trans	53.8	44.1	-170.3	-52.5	-54.5	-169	-168.1	0	112.2	M252 Y253 Q254 V255 C286	M252-K257 PolarHBondContact O-N 3.1Å; Y253-K257 WeakPolarHBondContact O-CA 3.43Å; Y253-K257 WeakPolarHBondContact O-CD 3.35Å; Q254-K257 WeakPolarHBondContact O-CD 3.28Å; Q254-K257 WeakPolarHBondContact O-CE 3.44Å; Q254-K257 PolarHBondContact O-NZ 2.89Å; V255-K257 PolarHBondContact O-N 2.84Å; K257-C286 VanDerWaalsContact CA-SG 3.58Å; K257-C286 PolarHBondContact O-N 3.2Å
258	L	96.5	Very high	95.9	Very high	1 Å²	1	26.1 Å²	26.1	1%	0.005	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	146.4	-179.5	-71.8	175.9	0	0	0	110.9	N191 R194 L195 M252 Y253 C256 V284 E285	N191-L258 HydrophobicContact CB-CD1 4.12Å; R194-L258 HydrophobicContact CB-CD1 4.17Å; L195-L258 HydrophobicContact CD1-CD1 3.73Å; M252-L258 CarbonylContact C-O 3.41Å; M252-L258 PolarHBondContact O-N 2.9Å; Y253-L258 PolarHBondContact N-O 3.34Å; C256-L258 VanDerWaalsContact C-N 3.28Å; C256-L258 HydrophobicContact CB-CB 4.27Å; C256-L258 HydrophobicContact CB-CD1 4.3Å; C256-L258 HydrophobicContact CB-CG 4.35Å; C256-L258 PolarHBondContact O-N 3.17Å; L258-V284 CarbonylContact C-O 3.11Å; L258-V284 WeakPolarHBondContact CA-O 3.35Å; L258-E285 HydrophobicContact CD2-CG 4.27Å
259	V	97	Very high	95.9	Very high	2 Å²	2	26.7 Å²	26.7	1%	0.012	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	132.7	166.4	176.6	0	0	0	0	107	Y253 A261 A283 V284 A291 F294 L295	Y253-V259 HydrophobicContact CD2-CG2 3.83Å; Y253-V259 HydrophobicContact CE2-CG2 4.17Å; V259-A261 VanDerWaalsContact C-N 3.31Å; V259-A261 PolarHBondContact O-N 2.95Å; V259-A283 CarbonylContact O-C 3.58Å; V259-A283 WeakPolarHBondContact O-CA 3.42Å; V259-A283 VanDerWaalsContact O-CB 3.3Å; V259-A283 WeakPolarHBondContact O-CB 3.42Å; V259-V284 HydrophobicContact CB-CG2 4.05Å; V259-V284 PolarHBondContact N-O 3.14Å; V259-V284 PolarHBondContact O-N 2.83Å; V259-A291 HydrophobicContact CG2-CB 4.33Å; V259-F294 HydrophobicContact CG1-CB 3.85Å; V259-L295 HydrophobicContact CG1-CB 3.86Å; V259-L295 HydrophobicContact CG1-CD1 4.47Å; V259-L295 HydrophobicContact CG2-CB 4.14Å
260	H	96.9	Very high	95.9	Very high	3 Å²	3	28 Å²	28	1%	0.014	13%	0.134	C	C	.	.			trans	-64.3	-39.8	-176.7	-166	-64.3	0	0	0	111.8	M252 D262 L263 I278 D279 A283 D298	M252-H260 HydrophobicContact CE-CB 3.76Å; H260-D262 PolarHBondContact ND1-N 3.23Å; H260-D262 PolarHBondContact O-N 3.23Å; H260-L263 HydrophobicContact CB-CB 3.92Å; H260-I278 PolarHBondContact NE2-O 3.13Å; H260-D279 PolarHBondContact CE1-O 2.92Å; H260-A283 WeakPolarHBondContact O-CA 3.34Å; H260-A283 PolarHBondContact O-N 3.37Å; H260-D298 WeakPolarHBondContact CB-OD2 3.22Å; H260-D298 PolarHBondContact N-OD2 3.39Å
261	A	95.4	Very high	95.9	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.137	C	C	.	.	S	Bend	trans	62.8	10.6	-180	0	0	0	0	0	115.1	Y161 V259 F294 R297 D298	Y161-A261 HydrophobicContact CD1-CB 4.36Å; Y161-A261 HydrophobicContact CE1-CB 4.2Å; V259-A261 VanDerWaalsContact C-N 3.31Å; V259-A261 PolarHBondContact O-N 2.95Å; A261-F294 HydrophobicContact CB-CB 3.62Å; A261-F294 HydrophobicContact CB-CD1 4.13Å; A261-F294 HydrophobicContact CB-CD2 3.73Å; A261-F294 HydrophobicContact CB-CE2 4.39Å; A261-F294 HydrophobicContact CB-CG 3.57Å; A261-R297 PolarHBondContact O-NH2 3.49Å; A261-D298 WeakPolarHBondContact CA-OD2 3.38Å; A261-D298 PolarHBondContact N-OD2 3.37Å
262	D	95	Very high	95.8	Very high	58 Å²	58	33.1 Å²	33.1	31%	0.31	16%	0.158	S	C	.	.	S	Bend	trans	-159.6	34.1	172	-159.3	38.6	0	0	0	109.8	H260 S264 N267 D298	H260-D262 PolarHBondContact ND1-N 3.23Å; H260-D262 PolarHBondContact O-N 3.23Å; D262-S264 PolarHBondContact O-N 3.28Å; D262-N267 PolarHBondContact O-ND2 2.89Å; D262-N267 PolarHBondContact OD2-ND2 3.21Å; D262-D298 PolarHBondContact N-OD1 2.89Å; D262-D298 VanDerWaalsContact N-OD1 3.12Å
263	L	96.8	Very high	95.6	Very high	3 Å²	3	38.7 Å²	38.7	2%	0.016	18%	0.182	C	C	.	.			trans	-75.9	117.5	-174.6	-173.8	62.3	0	0	0	109.7	V245 I249 H260 I268 I277 D298 T301 V302	V245-L263 HydrophobicContact CG1-CD2 4.29Å; I249-L263 HydrophobicContact CD1-CD2 3.88Å; I249-L263 HydrophobicContact CG1-CD2 3.56Å; H260-L263 HydrophobicContact CB-CB 3.92Å; L263-I268 HydrophobicContact CD1-CD1 4.12Å; L263-I268 HydrophobicContact CD1-CG1 4.01Å; L263-I277 HydrophobicContact CD1-CD1 3.9Å; L263-D298 HydrophobicContact CB-CB 3.9Å; L263-D298 PolarHBondContact N-OD1 3.37Å; L263-T301 WeakPolarHBondContact O-CB 3.29Å; L263-T301 WeakPolarHBondContact O-CG2 3.42Å; L263-V302 HydrophobicContact CD2-CG2 3.77Å; L263-V302 HydrophobicContact CG-CG2 3.86Å
264	S	95.5	Very high	95.6	Very high	14 Å²	14	39 Å²	39	10%	0.098	19%	0.186	C	C	.	.	S	Bend	trans	-150.2	173.2	179.1	64.8	0	0	0	0	110.1	D262 Y266 N267 I268	D262-S264 PolarHBondContact O-N 3.28Å; S264-Y266 PolarHBondContact O-N 2.91Å; S264-Y266 VanDerWaalsContact O-N 3.09Å; S264-N267 PolarHBondContact O-N 3.33Å; S264-I268 WeakPolarHBondContact O-CG1 3.29Å
265	E	95.2	Very high	95.8	Very high	40 Å²	40	37.5 Å²	37.5	19%	0.187	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-18.4	175.7	68.3	-85.2	-160.1	0	0	114.2	L228 K229 Y305	L228-E265 PolarHBondContact N-O 3.23Å; K229-E265 HydrophobicContact CB-CB 4.33Å; K229-E265 HydrophobicContact CB-CG 3.78Å; K229-E265 HydrophobicContact CG-CG 4.34Å; K229-E265 PolarHBondContact N-O 3.05Å; E265-Y305 HydrophobicContact CB-CD1 4.33Å; E265-Y305 HydrophobicContact CB-CD2 3.43Å; E265-Y305 VanDerWaalsContact CB-CD2 3.43Å; E265-Y305 HydrophobicContact CB-CE1 4.38Å; E265-Y305 HydrophobicContact CB-CE2 3.47Å; E265-Y305 VanDerWaalsContact CB-CE2 3.47Å; E265-Y305 HydrophobicContact CB-CG 3.89Å; E265-Y305 HydrophobicContact CG-CD2 3.63Å; E265-Y305 HydrophobicContact CG-CE2 3.76Å; E265-Y305 HydrophobicContact CG-CG 4.45Å
266	Y	95.2	Very high	95.9	Very high	98 Å²	98	35.2 Å²	35.2	38%	0.384	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-30.1	175.6	-62.3	-91.8	0	0	0	112.5	Q227 K229 S264	Q227-Y266 PolarHBondContact NE2-O 2.84Å; K229-Y266 HydrophobicContact CD-CD1 3.84Å; K229-Y266 HydrophobicContact CD-CE1 3.24Å; K229-Y266 HydrophobicContact CD-CE2 4.31Å; K229-Y266 VanDerWaalsContact CD-CZ 3.48Å; K229-Y266 VanDerWaalsContact NZ-CE1 3.32Å; K229-Y266 PolarHBondContact NZ-OH 2.83Å; K229-Y266 VanDerWaalsContact NZ-OH 3.08Å; S264-Y266 PolarHBondContact O-N 2.91Å; S264-Y266 VanDerWaalsContact O-N 3.09Å
267	N	96.5	Very high	96.1	Very high	16 Å²	16	35 Å²	35	9%	0.086	16%	0.16	C	C	.	.	S	Bend	trans	-101.6	17.2	-175.7	-66.7	-27.3	0	0	0	112.4	D262 S264 I278	D262-N267 PolarHBondContact O-ND2 2.89Å; D262-N267 PolarHBondContact OD2-ND2 3.21Å; S264-N267 PolarHBondContact O-N 3.33Å; N267-I278 VanDerWaalsContact C-CG1 3.48Å; N267-I278 HydrophobicContact CB-CG1 4.49Å; N267-I278 VanDerWaalsContact O-CG1 3.22Å; N267-I278 WeakPolarHBondContact O-CG1 3.45Å; N267-I278 PolarHBondContact O-N 3.17Å
268	I	97.2	Very high	96.1	Very high	2 Å²	2	31.6 Å²	31.6	1%	0.01	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	123.6	174.3	-59.5	168.7	0	0	0	107.7	Q227 L228 V245 L263 S264 A275 Y276 I277	Q227-I268 CarbonylContact C-O 3.44Å; Q227-I268 WeakPolarHBondContact CA-O 3.47Å; L228-I268 HydrophobicContact CB-CB 4.02Å; L228-I268 HydrophobicContact CB-CG2 4.09Å; L228-I268 WeakPolarHBondContact CB-O 3.27Å; L228-I268 HydrophobicContact CD2-CB 4.21Å; L228-I268 HydrophobicContact CD2-CD1 4.13Å; L228-I268 HydrophobicContact CD2-CG2 4.01Å; L228-I268 PolarHBondContact N-O 3.34Å; V245-I268 HydrophobicContact CG1-CD1 4.11Å; V245-I268 HydrophobicContact CG2-CD1 3.97Å; L263-I268 HydrophobicContact CD1-CD1 4.12Å; L263-I268 HydrophobicContact CD1-CG1 4.01Å; S264-I268 WeakPolarHBondContact O-CG1 3.29Å; I268-A275 HydrophobicContact CG2-CB 3.68Å; I268-Y276 CarbonylContact C-O 3.59Å; I268-Y276 WeakPolarHBondContact CA-O 3.49Å; I268-I277 HydrophobicContact CG1-CD1 3.97Å
269	I	96.9	Very high	96.1	Very high	24 Å²	24	33.4 Å²	33.4	12%	0.123	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	135.3	172.3	-68.7	-176.1	0	0	0	109	L218 A225 H271 Y276 I278	L218-I269 HydrophobicContact CB-CG2 4.24Å; L218-I269 HydrophobicContact CD1-CB 4.22Å; L218-I269 HydrophobicContact CD1-CD1 4.18Å; L218-I269 HydrophobicContact CD1-CG2 4.08Å; A225-I269 HydrophobicContact CB-CG2 3.51Å; I269-H271 HydrophobicContact CG2-CB 4.37Å; I269-Y276 PolarHBondContact N-O 3.1Å; I269-Y276 PolarHBondContact O-N 2.81Å; I269-I278 HydrophobicContact CD1-CD1 3.95Å; I269-I278 HydrophobicContact CD1-CG2 3.72Å; I269-I278 HydrophobicContact CG1-CD1 3.85Å; I269-I278 HydrophobicContact CG1-CG1 4.26Å; I269-I278 HydrophobicContact CG1-CG2 4.01Å
270	Y	96.8	Very high	96	Very high	34 Å²	34	33.3 Å²	33.3	13%	0.133	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	112.8	172.4	177.9	-108.5	0	0	0	109.8	P226 A231 V233 E237 L241	P226-Y270 PolarHBondContact O-N 3.08Å; A231-Y270 HydrophobicContact CB-CD1 3.83Å; A231-Y270 HydrophobicContact CB-CG 3.98Å; V233-Y270 HydrophobicContact CG2-CD2 4.34Å; V233-Y270 HydrophobicContact CG2-CE2 4.37Å; V233-Y270 HydrophobicContact CG2-CG 4.4Å; E237-Y270 PolarHBondContact OE1-OH 3.02Å; L241-Y270 HydrophobicContact CD1-CD2 3.73Å; L241-Y270 HydrophobicContact CD1-CE2 3.83Å; L241-Y270 HydrophobicContact CD2-CD2 4.17Å; L241-Y270 HydrophobicContact CD2-CE2 4.27Å
271	H	95.4	Very high	95.8	Very high	24 Å²	24	33.1 Å²	33.1	11%	0.111	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	131.7	-179.4	-172.3	-114.3	0	0	0	110.2	G219 A225 I269 K273 N274 Y276	G219-H271 WeakPolarHBondContact CA-NE2 3.29Å; G219-H271 PolarHBondContact N-NE2 3.3Å; A225-H271 HydrophobicContact CB-CB 3.96Å; I269-H271 HydrophobicContact CG2-CB 4.37Å; H271-K273 VanDerWaalsContact C-N 3.27Å; H271-K273 PolarHBondContact O-N 2.85Å; H271-N274 PolarHBondContact N-O 2.89Å; H271-N274 PolarHBondContact O-N 3.14Å; H271-Y276 HydrophobicContact CB-CD2 3.94Å; H271-Y276 HydrophobicContact CB-CE2 3.89Å
272	E	93.3	Very high	95.6	Very high	122 Å²	122	33.8 Å²	33.8	57%	0.57	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.1	44.5	178.7	-63.1	174.2	177.3	0	0	113.9	N274	E272-N274 PolarHBondContact O-N 3.38Å; E272-N274 PolarHBondContact O-ND2 2.88Å
273	K	93.5	Very high	95.6	Very high	122 Å²	122	31 Å²	31	53%	0.53	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.9	19.3	-178.1	-52.1	-176.7	174.9	-172.8	0	115.2	H271	H271-K273 VanDerWaalsContact C-N 3.27Å; H271-K273 PolarHBondContact O-N 2.85Å
274	N	96.2	Very high	95.6	Very high	35 Å²	35	30.9 Å²	30.9	19%	0.187	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	151.1	177	-65.9	-66.7	0	0	0	111.4	L201 Q244 H271 E272 Y276	L201-N274 HydrophobicContact CD1-CB 3.85Å; Q244-N274 PolarHBondContact NE2-OD1 3.4Å; H271-N274 PolarHBondContact N-O 2.89Å; H271-N274 PolarHBondContact O-N 3.14Å; E272-N274 PolarHBondContact O-N 3.38Å; E272-N274 PolarHBondContact O-ND2 2.88Å; N274-Y276 HydrophobicContact CB-CD2 4.49Å; N274-Y276 HydrophobicContact CB-CE2 4.02Å
275	A	97	Very high	95.5	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.008	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	135.5	168.2	0	0	0	0	0	110.3	L241 V245 F248 I268	L241-A275 HydrophobicContact CD2-CB 4.01Å; V245-A275 HydrophobicContact CG2-CB 3.9Å; F248-A275 HydrophobicContact CE2-CB 4.17Å; F248-A275 VanDerWaalsContact CE2-O 3.29Å; F248-A275 WeakPolarHBondContact CE2-O 3.23Å; I268-A275 HydrophobicContact CG2-CB 3.68Å
276	Y	97.9	Very high	95.3	Very high	35 Å²	35	30.7 Å²	30.7	14%	0.137	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	128.5	170.8	-75.7	-101.2	0	0	0	109.9	L201 L218 I268 I269 H271 N274	L201-Y276 HydrophobicContact CB-CD1 3.77Å; L201-Y276 HydrophobicContact CB-CE1 3.87Å; L201-Y276 HydrophobicContact CB-CG 4.2Å; L201-Y276 HydrophobicContact CD1-CE2 4.44Å; L201-Y276 WeakPolarHBondContact O-CA 3.34Å; L218-Y276 VanDerWaalsContact CD1-CB 3.41Å; L218-Y276 HydrophobicContact CD1-CD1 3.64Å; L218-Y276 HydrophobicContact CD1-CD2 4.26Å; L218-Y276 HydrophobicContact CD1-CE1 4.47Å; L218-Y276 HydrophobicContact CD1-CG 3.52Å; L218-Y276 HydrophobicContact CD2-CD1 3.77Å; L218-Y276 HydrophobicContact CD2-CE1 3.79Å; L218-Y276 HydrophobicContact CD2-CG 4.26Å; L218-Y276 HydrophobicContact CG-CD1 4.39Å; I268-Y276 CarbonylContact C-O 3.59Å; I268-Y276 WeakPolarHBondContact CA-O 3.49Å; I269-Y276 PolarHBondContact N-O 3.1Å; I269-Y276 PolarHBondContact O-N 2.81Å; H271-Y276 HydrophobicContact CB-CD2 3.94Å; H271-Y276 HydrophobicContact CB-CE2 3.89Å; N274-Y276 HydrophobicContact CB-CD2 4.49Å; N274-Y276 HydrophobicContact CB-CE2 4.02Å
277	I	98	Very high	95.1	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	129.8	179.1	-56.6	-54	0	0	0	109.8	L195 V200 L201 C202 P203 F248 M252 L263 I268 V280	L195-I277 HydrophobicContact CD2-CB 4.42Å; L195-I277 HydrophobicContact CD2-CG2 4.14Å; V200-I277 HydrophobicContact CG1-CB 4.23Å; V200-I277 HydrophobicContact CG1-CG1 3.84Å; L201-I277 PolarHBondContact O-N 3.26Å; C202-I277 WeakPolarHBondContact CB-O 3.38Å; P203-I277 WeakPolarHBondContact CD-O 3.46Å; F248-I277 HydrophobicContact CD2-CD1 4.03Å; F248-I277 HydrophobicContact CD2-CG1 3.87Å; F248-I277 HydrophobicContact CE2-CG1 4.5Å; M252-I277 HydrophobicContact SD-CG2 4.47Å; L263-I277 HydrophobicContact CD1-CD1 3.9Å; I268-I277 HydrophobicContact CG1-CD1 3.97Å; I277-V280 HydrophobicContact CG2-CG1 4.23Å
278	I	96.8	Very high	94.8	Very high	29 Å²	29	31.9 Å²	31.9	15%	0.149	16%	0.155	C	C	.	.			trans	-126.8	169.4	176.7	61.1	159.1	0	0	0	111.4	P203 H260 N267 I269	P203-I278 HydrophobicContact CG-CG2 3.85Å; H260-I278 PolarHBondContact NE2-O 3.13Å; N267-I278 VanDerWaalsContact C-CG1 3.48Å; N267-I278 HydrophobicContact CB-CG1 4.49Å; N267-I278 VanDerWaalsContact O-CG1 3.22Å; N267-I278 WeakPolarHBondContact O-CG1 3.45Å; N267-I278 PolarHBondContact O-N 3.17Å; I269-I278 HydrophobicContact CD1-CD1 3.95Å; I269-I278 HydrophobicContact CD1-CG2 3.72Å; I269-I278 HydrophobicContact CG1-CD1 3.85Å; I269-I278 HydrophobicContact CG1-CG1 4.26Å; I269-I278 HydrophobicContact CG1-CG2 4.01Å
279	D	94.8	Very high	94.4	Very high	39 Å²	39	33.7 Å²	33.7	21%	0.209	17%	0.167	C	C	.	.			trans	58.4	54.7	175.3	-153.8	4.5	0	0	0	116.3	K146 H260 S281	K146-D279 IonicContact NZ-OD1 3.94Å; K146-D279 PolarHBondContact NZ-OD1 3.48Å; K146-D279 IonicContact NZ-OD2 2.9Å; H260-D279 PolarHBondContact CE1-O 2.92Å; D279-S281 PolarHBondContact O-N 3.37Å; D279-S281 VanDerWaalsContact O-N 3.14Å; D279-S281 PolarHBondContact OD1-OG 3.38Å
280	V	95.4	Very high	94.1	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84	28.1	175.1	-64.2	0	0	0	0	113.7	E188 N191 M192 L195 I277 A283	E188-V280 HydrophobicContact CG-CG2 4.03Å; N191-V280 HydrophobicContact CB-CB 4.04Å; N191-V280 HydrophobicContact CB-CG2 3.68Å; N191-V280 PolarHBondContact ND2-O 3.13Å; M192-V280 HydrophobicContact CB-CG2 4.15Å; M192-V280 HydrophobicContact CE-CG2 3.99Å; M192-V280 HydrophobicContact SD-CG2 4.17Å; L195-V280 HydrophobicContact CD1-CG1 4.48Å; L195-V280 HydrophobicContact CD2-CG1 3.75Å; I277-V280 HydrophobicContact CG2-CG1 4.23Å; V280-A283 HydrophobicContact CB-CB 4.06Å
281	S	92.3	Very high	94	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-42.2	175.1	55.2	0	0	0	0	111.8	K187 E188 D279	K187-S281 WeakPolarHBondContact CD-O 3.11Å; K187-S281 WeakPolarHBondContact CE-O 3.38Å; K187-S281 PolarHBondContact NZ-O 3.32Å; E188-S281 VanDerWaalsContact OE2-CB 3.3Å; E188-S281 WeakPolarHBondContact OE2-CB 3.33Å; D279-S281 PolarHBondContact O-N 3.37Å; D279-S281 VanDerWaalsContact O-N 3.14Å; D279-S281 PolarHBondContact OD1-OG 3.38Å
282	Q	92.4	Very high	93.9	Very high	13 Å²	13	32.9 Å²	32.9	6%	0.061	17%	0.166	C	C	.	.	S	Bend	trans	-82.3	-16.7	-178.5	-60.9	-173.6	8.5	0	0	112.5	E130 Y161 K187 V284	E130-Q282 PolarHBondContact OE1-NE2 3.06Å; Y161-Q282 HydrophobicContact CD1-CB 4.12Å; Y161-Q282 HydrophobicContact CD2-CB 4.08Å; Y161-Q282 HydrophobicContact CD2-CG 3.88Å; Y161-Q282 HydrophobicContact CE1-CB 4.25Å; Y161-Q282 HydrophobicContact CE2-CB 4.17Å; Y161-Q282 HydrophobicContact CE2-CG 3.85Å; Y161-Q282 HydrophobicContact CG-CB 4.03Å; Y161-Q282 HydrophobicContact CG-CG 4.34Å; Y161-Q282 PolarHBondContact OH-OE1 3.44Å; K187-Q282 PolarHBondContact NZ-O 3.23Å; Q282-V284 WeakPolarHBondContact O-CG1 3.48Å; Q282-V284 PolarHBondContact O-N 3.3Å
283	A	95.5	Very high	93.8	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.151	C	C	.	.			trans	-53.6	132.8	-177.8	0	0	0	0	0	113.6	K187 N191 V259 H260 V280	K187-A283 WeakPolarHBondContact CE-O 3.2Å; K187-A283 PolarHBondContact NZ-O 3.16Å; N191-A283 PolarHBondContact ND2-O 3.25Å; V259-A283 CarbonylContact O-C 3.58Å; V259-A283 WeakPolarHBondContact O-CA 3.42Å; V259-A283 VanDerWaalsContact O-CB 3.3Å; V259-A283 WeakPolarHBondContact O-CB 3.42Å; H260-A283 WeakPolarHBondContact O-CA 3.34Å; H260-A283 PolarHBondContact O-N 3.37Å; V280-A283 HydrophobicContact CB-CB 4.06Å
284	V	94.8	Very high	93.9	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	157.6	-175.5	-60.2	0	0	0	0	111.2	L258 V259 Q282 H288 A291 F294	L258-V284 CarbonylContact C-O 3.11Å; L258-V284 WeakPolarHBondContact CA-O 3.35Å; V259-V284 HydrophobicContact CB-CG2 4.05Å; V259-V284 PolarHBondContact N-O 3.14Å; V259-V284 PolarHBondContact O-N 2.83Å; Q282-V284 WeakPolarHBondContact O-CG1 3.48Å; Q282-V284 PolarHBondContact O-N 3.3Å; V284-H288 HydrophobicContact CB-CB 3.84Å; V284-H288 HydrophobicContact CG2-CB 4.01Å; V284-A291 HydrophobicContact CG2-CB 4.31Å; V284-F294 HydrophobicContact CG1-CD2 4.35Å; V284-F294 HydrophobicContact CG1-CE2 4.23Å; V284-F294 HydrophobicContact CG2-CD2 3.85Å; V284-F294 HydrophobicContact CG2-CE2 4.48Å
285	E	94	Very high	93.9	Very high	30 Å²	30	22.8 Å²	22.8	14%	0.14	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	154.4	171.3	-59.1	-165.9	132.2	0	0	110.8	R167 R194 L258 D287 H288	R167-E285 VanDerWaalsContact CD-OE1 3.27Å; R167-E285 WeakPolarHBondContact CD-OE1 3.37Å; R167-E285 IonicContact CZ-OE1 2.9Å; R167-E285 IonicContact NE-OE1 3.91Å; R167-E285 PolarHBondContact NE-OE1 3.15Å; R167-E285 IonicContact NE-OE2 2.77Å; R194-E285 IonicContact CZ-OE1 2.82Å; R194-E285 IonicContact NH1-OE1 3.96Å; R194-E285 PolarHBondContact NH1-OE1 3.04Å; L258-E285 HydrophobicContact CD2-CG 4.27Å; E285-D287 PolarHBondContact O-N 2.58Å; E285-D287 VanDerWaalsContact O-N 3.11Å; E285-H288 WeakPolarHBondContact O-CB 3.48Å; E285-H288 PolarHBondContact O-N 2.83Å
286	C	92.2	Very high	93.8	Very high	21 Å²	21	22.8 Å²	22.8	14%	0.142	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-24.9	179.1	-59	0	0	0	0	113.4	Y253 K257 H288 A291	Y253-C286 HydrophobicContact CE2-CB 4.23Å; K257-C286 VanDerWaalsContact CA-SG 3.58Å; K257-C286 PolarHBondContact O-N 3.2Å; C286-H288 VanDerWaalsContact C-N 3.27Å; C286-H288 PolarHBondContact O-N 3.46Å; C286-A291 WeakPolarHBondContact O-CB 3.33Å
287	D	89.8	Confident	93.6	Very high	138 Å²	138	24.3 Å²	24.3	74%	0.738	13%	0.126	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-8.2	177.5	-61.7	-24.5	0	0	0	113.3	E285	E285-D287 PolarHBondContact O-N 2.58Å; E285-D287 VanDerWaalsContact O-N 3.11Å
288	H	90.5	Very high	93.5	Very high	1 Å²	1	24.5 Å²	24.5	1%	0.005	13%	0.127	C	C	.	.	S	Bend	trans	-64	137.1	179.5	-175.3	-84.1	0	0	0	110.4	R160 L163 V284 E285 C286 N290 A291 Q368	R160-H288 PolarHBondContact O-CE1 2.79Å; R160-H288 VanDerWaalsContact O-CE1 3.3Å; L163-H288 PolarHBondContact O-NE2 3.36Å; L163-H288 VanDerWaalsContact O-NE2 3.09Å; V284-H288 HydrophobicContact CB-CB 3.84Å; V284-H288 HydrophobicContact CG2-CB 4.01Å; E285-H288 WeakPolarHBondContact O-CB 3.48Å; E285-H288 PolarHBondContact O-N 2.83Å; C286-H288 VanDerWaalsContact C-N 3.27Å; C286-H288 PolarHBondContact O-N 3.46Å; H288-N290 PolarHBondContact ND1-N 3.04Å; H288-N290 PolarHBondContact O-N 3.17Å; H288-A291 HydrophobicContact CB-CB 4.17Å; H288-A291 WeakPolarHBondContact O-CB 3.21Å; H288-A291 PolarHBondContact O-N 3.21Å; H288-Q368 PolarHBondContact O-NE2 3.08Å
289	P	89.6	Confident	93.4	Very high	39 Å²	39	23.1 Å²	23.1	25%	0.253	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-27.8	-172.7	21.1	-34.8	0	0	0	115.3	Q368 N372	P289-Q368 WeakPolarHBondContact O-CG 3.48Å; P289-Q368 PolarHBondContact O-OE1 2.96Å; P289-N372 WeakPolarHBondContact CA-ND2 3.18Å; P289-N372 WeakPolarHBondContact CB-ND2 3.19Å
290	N	90.6	Very high	93.4	Very high	62 Å²	62	22.9 Å²	22.9	33%	0.332	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.1	13.4	179.1	-55.5	-10.6	0	0	0	113	H288 I292 D293 F294	H288-N290 PolarHBondContact ND1-N 3.04Å; H288-N290 PolarHBondContact O-N 3.17Å; N290-I292 VanDerWaalsContact C-N 3.29Å; N290-I292 PolarHBondContact O-N 2.98Å; N290-D293 PolarHBondContact O-N 2.9Å; N290-F294 HydrophobicContact CB-CD2 4.04Å; N290-F294 HydrophobicContact CB-CE2 3.68Å; N290-F294 HydrophobicContact CB-CZ 4.01Å; N290-F294 WeakPolarHBondContact O-CD2 3.43Å; N290-F294 VanDerWaalsContact O-CG 3.31Å; N290-F294 WeakPolarHBondContact O-CG 3.47Å; N290-F294 PolarHBondContact O-N 3.41Å
291	A	93.2	Very high	93.4	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-60.4	-39.9	-174	0	0	0	0	0	112.3	V259 V284 C286 H288 F294 L295	V259-A291 HydrophobicContact CG2-CB 4.33Å; V284-A291 HydrophobicContact CG2-CB 4.31Å; C286-A291 WeakPolarHBondContact O-CB 3.33Å; H288-A291 HydrophobicContact CB-CB 4.17Å; H288-A291 WeakPolarHBondContact O-CB 3.21Å; H288-A291 PolarHBondContact O-N 3.21Å; A291-F294 PolarHBondContact O-N 3.27Å; A291-L295 WeakPolarHBondContact O-CB 3.38Å; A291-L295 PolarHBondContact O-N 3.25Å
292	I	93.4	Very high	93.5	Very high	4 Å²	4	25 Å²	25	2%	0.021	13%	0.131	C	C	.	.	H	α-helix	trans	-69.8	-41.5	-178.3	-63.8	-56.5	0	0	0	111.5	Y253 N290 F294 L295 Y296 F320 Y361 M364 Q368	Y253-I292 HydrophobicContact CE2-CD1 4.47Å; N290-I292 VanDerWaalsContact C-N 3.29Å; N290-I292 PolarHBondContact O-N 2.98Å; I292-F294 VanDerWaalsContact C-N 3.34Å; I292-F294 PolarHBondContact O-N 3.18Å; I292-L295 PolarHBondContact O-N 3.12Å; I292-Y296 PolarHBondContact O-N 3Å; I292-F320 HydrophobicContact CD1-CZ 4.42Å; I292-F320 HydrophobicContact CG2-CE2 4.06Å; I292-F320 HydrophobicContact CG2-CZ 3.7Å; I292-Y361 HydrophobicContact CG2-CD2 3.71Å; I292-Y361 HydrophobicContact CG2-CE2 3.77Å; I292-M364 HydrophobicContact CD1-CE 3.4Å; I292-M364 HydrophobicContact CD1-SD 4.23Å; I292-M364 HydrophobicContact CG1-CB 4.42Å; I292-M364 HydrophobicContact CG1-CE 4.33Å; I292-M364 HydrophobicContact CG2-CB 4.13Å; I292-Q368 VanDerWaalsContact CB-OE1 3.28Å
293	D	92.5	Very high	93.5	Very high	48 Å²	48	24.5 Å²	24.5	26%	0.257	13%	0.129	S	C	.	.	H	α-helix	trans	-60.9	-44.6	174.5	-67.6	-28	0	0	0	111.6	N290 L295 Y296 R297 Y361 L365	N290-D293 PolarHBondContact O-N 2.9Å; D293-L295 PolarHBondContact O-N 3.42Å; D293-Y296 PolarHBondContact O-N 3.3Å; D293-R297 WeakPolarHBondContact O-CB 3.48Å; D293-R297 PolarHBondContact O-N 3.4Å; D293-Y361 PolarHBondContact OD1-OH 2.9Å; D293-L365 WeakPolarHBondContact OD1-CD1 3.4Å
294	F	94.8	Very high	93.4	Very high	14 Å²	14	29.9 Å²	29.9	6%	0.061	15%	0.153	C	C	.	.	H	α-helix	trans	-64	-40.6	177.1	-69.8	-34.6	0	0	0	112.5	R160 Y161 V259 A261 V284 N290 A291 I292 R297 D298	R160-F294 HydrophobicContact CG-CZ 4.47Å; Y161-F294 HydrophobicContact CD1-CE1 4.42Å; Y161-F294 AromaticContact CD1-CE2 3.98Å; Y161-F294 HydrophobicContact CD1-CE2 3.98Å; Y161-F294 AromaticContact CD1-CZ 3.79Å; Y161-F294 HydrophobicContact CD1-CZ 3.79Å; Y161-F294 AromaticContact CE1-CE1 3.88Å; Y161-F294 HydrophobicContact CE1-CE1 3.88Å; Y161-F294 HydrophobicContact CE1-CE2 4.24Å; Y161-F294 AromaticContact CE1-CZ 3.7Å; Y161-F294 HydrophobicContact CE1-CZ 3.7Å; V259-F294 HydrophobicContact CG1-CB 3.85Å; A261-F294 HydrophobicContact CB-CB 3.62Å; A261-F294 HydrophobicContact CB-CD1 4.13Å; A261-F294 HydrophobicContact CB-CD2 3.73Å; A261-F294 HydrophobicContact CB-CE2 4.39Å; A261-F294 HydrophobicContact CB-CG 3.57Å; V284-F294 HydrophobicContact CG1-CD2 4.35Å; V284-F294 HydrophobicContact CG1-CE2 4.23Å; V284-F294 HydrophobicContact CG2-CD2 3.85Å; V284-F294 HydrophobicContact CG2-CE2 4.48Å; N290-F294 HydrophobicContact CB-CD2 4.04Å; N290-F294 HydrophobicContact CB-CE2 3.68Å; N290-F294 HydrophobicContact CB-CZ 4.01Å; N290-F294 WeakPolarHBondContact O-CD2 3.43Å; N290-F294 VanDerWaalsContact O-CG 3.31Å; N290-F294 WeakPolarHBondContact O-CG 3.47Å; N290-F294 PolarHBondContact O-N 3.41Å; A291-F294 PolarHBondContact O-N 3.27Å; I292-F294 VanDerWaalsContact C-N 3.34Å; I292-F294 PolarHBondContact O-N 3.18Å; F294-R297 PolarHBondContact O-N 2.97Å; F294-D298 VanDerWaalsContact O-CG 3.23Å; F294-D298 PolarHBondContact O-N 3.3Å
295	L	96.1	Very high	93.4	Very high	4 Å²	4	31.8 Å²	31.8	2%	0.021	16%	0.16	C	C	.	.	H	α-helix	trans	-64.7	-45.8	177.9	178.9	63.2	0	0	0	111.3	I249 Y253 V259 A291 I292 D293 R297 D298 C299 F320 A323 V324	I249-L295 HydrophobicContact CG2-CD1 3.68Å; Y253-L295 HydrophobicContact CD2-CD2 3.65Å; Y253-L295 HydrophobicContact CE2-CD2 3.73Å; Y253-L295 HydrophobicContact CG-CD2 4.21Å; V259-L295 HydrophobicContact CG1-CB 3.86Å; V259-L295 HydrophobicContact CG1-CD1 4.47Å; V259-L295 HydrophobicContact CG2-CB 4.14Å; A291-L295 WeakPolarHBondContact O-CB 3.38Å; A291-L295 PolarHBondContact O-N 3.25Å; I292-L295 PolarHBondContact O-N 3.12Å; D293-L295 PolarHBondContact O-N 3.42Å; L295-R297 VanDerWaalsContact C-N 3.3Å; L295-R297 PolarHBondContact O-N 3.4Å; L295-D298 WeakPolarHBondContact O-CB 3.41Å; L295-D298 PolarHBondContact O-N 3.04Å; L295-C299 PolarHBondContact O-N 3.04Å; L295-C299 PolarHBondContact O-SG 3.01Å; L295-F320 HydrophobicContact CB-CE2 4.24Å; L295-F320 HydrophobicContact CD2-CD2 4.14Å; L295-F320 HydrophobicContact CD2-CE2 3.78Å; L295-F320 HydrophobicContact CG-CD2 4.09Å; L295-F320 HydrophobicContact CG-CE2 4Å; L295-A323 HydrophobicContact CD1-CB 4.48Å; L295-A323 HydrophobicContact CD2-CB 4.37Å; L295-V324 HydrophobicContact CD2-CG2 3.85Å
296	Y	94.5	Very high	93.4	Very high	1 Å²	1	30.5 Å²	30.5	0%	0.004	15%	0.154	C	C	.	.	H	α-helix	trans	-61.9	-41	178.3	-171.7	-94.1	0	0	0	111.6	I292 D293 C299 L300 V316 D317 F320 E354 A357 Y361	I292-Y296 PolarHBondContact O-N 3Å; D293-Y296 PolarHBondContact O-N 3.3Å; Y296-C299 WeakPolarHBondContact O-CB 3.26Å; Y296-C299 PolarHBondContact O-N 2.75Å; Y296-L300 HydrophobicContact CE1-CD1 4.49Å; Y296-L300 WeakPolarHBondContact O-CB 3.41Å; Y296-L300 PolarHBondContact O-N 3.05Å; Y296-V316 HydrophobicContact CD2-CG1 4.36Å; Y296-V316 HydrophobicContact CE1-CG1 4.31Å; Y296-V316 HydrophobicContact CE2-CG1 3.82Å; Y296-D317 PolarHBondContact OH-OD1 2.63Å; Y296-F320 HydrophobicContact CD2-CB 4.15Å; Y296-F320 AromaticContact CD2-CD2 3.87Å; Y296-F320 HydrophobicContact CD2-CD2 3.87Å; Y296-F320 HydrophobicContact CD2-CG 4Å; Y296-F320 HydrophobicContact CG-CD2 4.45Å; Y296-E354 HydrophobicContact CE1-CG 4.3Å; Y296-A357 HydrophobicContact CE1-CB 4.13Å; Y296-A357 HydrophobicContact CE2-CB 4.06Å; Y296-A357 WeakPolarHBondContact OH-CB 3.39Å; Y296-Y361 VanDerWaalsContact CB-CE2 3.49Å; Y296-Y361 HydrophobicContact CD1-CE2 4.39Å; Y296-Y361 HydrophobicContact CD2-CD1 4.39Å; Y296-Y361 AromaticContact CD2-CD2 3.66Å; Y296-Y361 HydrophobicContact CD2-CD2 3.66Å; Y296-Y361 HydrophobicContact CD2-CE2 4.23Å; Y296-Y361 AromaticContact CD2-CG 3.75Å; Y296-Y361 HydrophobicContact CD2-CG 3.75Å; Y296-Y361 HydrophobicContact CE2-CG 4.17Å; Y296-Y361 AromaticContact CG-CD2 3.71Å; Y296-Y361 HydrophobicContact CG-CD2 3.71Å; Y296-Y361 AromaticContact CG-CE2 3.79Å; Y296-Y361 HydrophobicContact CG-CE2 3.79Å; Y296-Y361 HydrophobicContact CG-CG 4.12Å
297	R	93.9	Very high	93.4	Very high	67 Å²	67	32.1 Å²	32.1	25%	0.253	16%	0.161	S	C	.	.	H	α-helix	trans	-63.3	-41.1	174.6	-174.1	179.8	70.7	172.9	4.7	113	A261 D293 F294 L295 L300 T301	A261-R297 PolarHBondContact O-NH2 3.49Å; D293-R297 WeakPolarHBondContact O-CB 3.48Å; D293-R297 PolarHBondContact O-N 3.4Å; F294-R297 PolarHBondContact O-N 2.97Å; L295-R297 VanDerWaalsContact C-N 3.3Å; L295-R297 PolarHBondContact O-N 3.4Å; R297-L300 PolarHBondContact O-N 3.15Å; R297-T301 WeakPolarHBondContact O-CB 3.48Å; R297-T301 PolarHBondContact O-N 3Å; R297-T301 PolarHBondContact O-OG1 2.94Å
298	D	96.8	Very high	93.4	Very high	4 Å²	4	31.5 Å²	31.5	2%	0.021	16%	0.158	C	C	.	.	H	α-helix	trans	-60.4	-47.1	174.7	-72.3	-16.9	0	0	0	110	H260 A261 D262 L263 F294 L295 L300 T301 V302	H260-D298 WeakPolarHBondContact CB-OD2 3.22Å; H260-D298 PolarHBondContact N-OD2 3.39Å; A261-D298 WeakPolarHBondContact CA-OD2 3.38Å; A261-D298 PolarHBondContact N-OD2 3.37Å; D262-D298 PolarHBondContact N-OD1 2.89Å; D262-D298 VanDerWaalsContact N-OD1 3.12Å; L263-D298 HydrophobicContact CB-CB 3.9Å; L263-D298 PolarHBondContact N-OD1 3.37Å; F294-D298 VanDerWaalsContact O-CG 3.23Å; F294-D298 PolarHBondContact O-N 3.3Å; L295-D298 WeakPolarHBondContact O-CB 3.41Å; L295-D298 PolarHBondContact O-N 3.04Å; D298-L300 PolarHBondContact O-N 3.09Å; D298-T301 PolarHBondContact O-N 3.4Å; D298-V302 WeakPolarHBondContact O-CB 3.43Å; D298-V302 WeakPolarHBondContact O-CG2 3.37Å; D298-V302 PolarHBondContact O-N 3.14Å
299	C	95.1	Very high	93.4	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-58.7	-44.3	175.3	-66.5	0	0	0	0	112.2	L295 Y296 T303 V316 L319	L295-C299 PolarHBondContact O-N 3.04Å; L295-C299 PolarHBondContact O-SG 3.01Å; Y296-C299 WeakPolarHBondContact O-CB 3.26Å; Y296-C299 PolarHBondContact O-N 2.75Å; C299-T303 VanDerWaalsContact O-CB 3.3Å; C299-T303 WeakPolarHBondContact O-CB 3.2Å; C299-T303 PolarHBondContact O-N 3.27Å; C299-T303 PolarHBondContact O-OG1 3.09Å; C299-V316 HydrophobicContact CB-CG1 4.1Å; C299-L319 HydrophobicContact CB-CD2 3.91Å; C299-L319 HydrophobicContact CB-CG 4.15Å
300	L	93.9	Very high	93.4	Very high	34 Å²	34	33.9 Å²	33.9	18%	0.178	18%	0.184	C	C	.	.	H	α-helix	trans	-62	-45.2	178.3	-176.5	149	0	0	0	111.6	Y296 R297 D298 K304 V316 E354	Y296-L300 HydrophobicContact CE1-CD1 4.49Å; Y296-L300 WeakPolarHBondContact O-CB 3.41Å; Y296-L300 PolarHBondContact O-N 3.05Å; R297-L300 PolarHBondContact O-N 3.15Å; D298-L300 PolarHBondContact O-N 3.09Å; L300-K304 WeakPolarHBondContact O-CB 3.47Å; L300-K304 PolarHBondContact O-N 3.36Å; L300-V316 HydrophobicContact CB-CG1 4.18Å; L300-E354 HydrophobicContact CD1-CG 4.5Å
301	T	94.8	Very high	93.3	Very high	40 Å²	40	31.1 Å²	31.1	25%	0.245	17%	0.169	C	C	.	.	H	α-helix	trans	-66.3	-45.4	-177.4	-54.3	0	0	0	0	111.1	L263 R297 D298 K304 Y305	L263-T301 WeakPolarHBondContact O-CB 3.29Å; L263-T301 WeakPolarHBondContact O-CG2 3.42Å; R297-T301 WeakPolarHBondContact O-CB 3.48Å; R297-T301 PolarHBondContact O-N 3Å; R297-T301 PolarHBondContact O-OG1 2.94Å; D298-T301 PolarHBondContact O-N 3.4Å; T301-K304 PolarHBondContact O-N 2.83Å; T301-Y305 PolarHBondContact O-N 3.06Å
302	V	95.3	Very high	93.2	Very high	4 Å²	4	34.2 Å²	34.2	2%	0.024	19%	0.189	C	C	.	.	H	α-helix	trans	-61.7	-51.3	176.3	168.7	0	0	0	0	111	Y242 V245 I249 L263 D298 K304 Y305 F306	Y242-V302 HydrophobicContact CD2-CG1 4.47Å; Y242-V302 HydrophobicContact CE2-CG1 4.45Å; V245-V302 HydrophobicContact CG1-CG1 3.8Å; V245-V302 HydrophobicContact CG1-CG2 4.01Å; I249-V302 HydrophobicContact CD1-CB 4.44Å; I249-V302 HydrophobicContact CD1-CG1 4.44Å; I249-V302 HydrophobicContact CD1-CG2 4.19Å; L263-V302 HydrophobicContact CD2-CG2 3.77Å; L263-V302 HydrophobicContact CG-CG2 3.86Å; D298-V302 WeakPolarHBondContact O-CB 3.43Å; D298-V302 WeakPolarHBondContact O-CG2 3.37Å; D298-V302 PolarHBondContact O-N 3.14Å; V302-K304 VanDerWaalsContact C-N 3.29Å; V302-K304 PolarHBondContact O-N 3.41Å; V302-Y305 PolarHBondContact O-N 3.01Å; V302-F306 HydrophobicContact CG1-CD2 3.83Å; V302-F306 HydrophobicContact CG1-CE2 3.92Å; V302-F306 VanDerWaalsContact O-CD2 3.29Å; V302-F306 WeakPolarHBondContact O-CD2 3.43Å; V302-F306 PolarHBondContact O-N 3.16Å; V302-F306 VanDerWaalsContact O-N 3.13Å
303	T	93.1	Very high	93.1	Very high	4 Å²	4	34.1 Å²	34.1	3%	0.025	19%	0.189	C	C	.	.	H	α-helix	trans	-59.6	-40.8	178.9	-65.8	0	0	0	0	111.6	C299 L307 V313 V316	C299-T303 VanDerWaalsContact O-CB 3.3Å; C299-T303 WeakPolarHBondContact O-CB 3.2Å; C299-T303 PolarHBondContact O-N 3.27Å; C299-T303 PolarHBondContact O-OG1 3.09Å; T303-L307 WeakPolarHBondContact O-CB 3.38Å; T303-L307 PolarHBondContact O-N 2.91Å; T303-V313 HydrophobicContact CG2-CB 4.06Å; T303-V313 HydrophobicContact CG2-CG2 3.79Å; T303-V316 HydrophobicContact CG2-CG2 3.94Å
304	K	93.2	Very high	93	Very high	112 Å²	112	31.9 Å²	31.9	49%	0.487	18%	0.177	S	C	.	.	H	α-helix	trans	-61.2	-45.3	177.1	-178.8	-178.9	177.9	-177.1	0	112.4	L300 T301 V302 N308 I351	L300-K304 WeakPolarHBondContact O-CB 3.47Å; L300-K304 PolarHBondContact O-N 3.36Å; T301-K304 PolarHBondContact O-N 2.83Å; V302-K304 VanDerWaalsContact C-N 3.29Å; V302-K304 PolarHBondContact O-N 3.41Å; K304-N308 PolarHBondContact O-N 3.32Å; K304-N308 VanDerWaalsContact O-N 3.15Å; K304-N308 PolarHBondContact O-ND2 2.82Å; K304-I351 HydrophobicContact CB-CD1 3.95Å; K304-I351 HydrophobicContact CG-CD1 3.97Å
305	Y	94.1	Very high	92.7	Very high	41 Å²	41	33 Å²	33	16%	0.161	19%	0.186	C	C	.	.	H	α-helix	trans	-61.6	-53.5	179.1	173.5	-96.4	0	0	0	111.2	L228 E265 T301 V302 L307 N308 S309	L228-Y305 HydrophobicContact CD2-CD1 4.29Å; L228-Y305 HydrophobicContact CD2-CE1 3.66Å; L228-Y305 HydrophobicContact CG-CE1 3.83Å; L228-Y305 PolarHBondContact O-OH 3.25Å; E265-Y305 HydrophobicContact CB-CD1 4.33Å; E265-Y305 HydrophobicContact CB-CD2 3.43Å; E265-Y305 VanDerWaalsContact CB-CD2 3.43Å; E265-Y305 HydrophobicContact CB-CE1 4.38Å; E265-Y305 HydrophobicContact CB-CE2 3.47Å; E265-Y305 VanDerWaalsContact CB-CE2 3.47Å; E265-Y305 HydrophobicContact CB-CG 3.89Å; E265-Y305 HydrophobicContact CG-CD2 3.63Å; E265-Y305 HydrophobicContact CG-CE2 3.76Å; E265-Y305 HydrophobicContact CG-CG 4.45Å; T301-Y305 PolarHBondContact O-N 3.06Å; V302-Y305 PolarHBondContact O-N 3.01Å; Y305-L307 VanDerWaalsContact C-N 3.32Å; Y305-L307 PolarHBondContact O-N 3.27Å; Y305-N308 WeakPolarHBondContact O-CB 3.41Å; Y305-N308 PolarHBondContact O-N 3.49Å; Y305-N308 VanDerWaalsContact O-N 3.09Å; Y305-S309 PolarHBondContact O-N 2.91Å; Y305-S309 PolarHBondContact O-OG 2.86Å
306	F	94	Very high	92.5	Very high	3 Å²	3	33.5 Å²	33.5	1%	0.013	19%	0.189	C	C	.	.	H	α-helix	trans	-68.6	-29.8	-176.9	-74.4	-73.6	0	0	0	113.4	L228 A238 L241 Y242 V245 V302 S309 G310 V311 V313	L228-F306 HydrophobicContact CD2-CZ 3.98Å; A238-F306 WeakPolarHBondContact O-CE1 3.2Å; L241-F306 HydrophobicContact CB-CE1 4.04Å; L241-F306 HydrophobicContact CB-CZ 4.16Å; Y242-F306 HydrophobicContact CD2-CB 3.76Å; Y242-F306 HydrophobicContact CD2-CD1 4.4Å; Y242-F306 AromaticContact CD2-CD2 3.43Å; Y242-F306 HydrophobicContact CD2-CD2 3.43Å; Y242-F306 VanDerWaalsContact CD2-CD2 3.43Å; Y242-F306 HydrophobicContact CD2-CE2 4.08Å; Y242-F306 AromaticContact CD2-CG 3.61Å; Y242-F306 HydrophobicContact CD2-CG 3.61Å; Y242-F306 HydrophobicContact CE2-CB 4.39Å; Y242-F306 HydrophobicContact CE2-CD2 4.32Å; Y242-F306 HydrophobicContact CG-CB 4.2Å; Y242-F306 HydrophobicContact CG-CD1 4.43Å; Y242-F306 HydrophobicContact CG-CD2 4.2Å; Y242-F306 HydrophobicContact CG-CG 4.03Å; V245-F306 HydrophobicContact CB-CE2 4.37Å; V245-F306 HydrophobicContact CG2-CE2 4.36Å; V245-F306 HydrophobicContact CG2-CZ 4.29Å; V302-F306 HydrophobicContact CG1-CD2 3.83Å; V302-F306 HydrophobicContact CG1-CE2 3.92Å; V302-F306 VanDerWaalsContact O-CD2 3.29Å; V302-F306 WeakPolarHBondContact O-CD2 3.43Å; V302-F306 PolarHBondContact O-N 3.16Å; V302-F306 VanDerWaalsContact O-N 3.13Å; F306-S309 CarbonylContact O-C 3.56Å; F306-S309 PolarHBondContact O-N 2.91Å; F306-G310 PolarHBondContact O-N 2.98Å; F306-V311 HydrophobicContact CB-CB 4.36Å; F306-V311 HydrophobicContact CD1-CG2 4.41Å; F306-V311 WeakPolarHBondContact O-CB 3.41Å; F306-V311 PolarHBondContact O-N 3.03Å; F306-V311 VanDerWaalsContact O-N 3.08Å; F306-V313 HydrophobicContact CB-CG1 3.79Å
307	L	91.7	Very high	92.3	Very high	55 Å²	55	35 Å²	35	29%	0.288	20%	0.196	S	C	.	.	H	α-helix	trans	-62.2	-43.9	170.5	-177.1	67.3	0	0	0	111.3	T303 Y305 S309 G310 V313 I351	T303-L307 WeakPolarHBondContact O-CB 3.38Å; T303-L307 PolarHBondContact O-N 2.91Å; Y305-L307 VanDerWaalsContact C-N 3.32Å; Y305-L307 PolarHBondContact O-N 3.27Å; L307-S309 PolarHBondContact O-N 3.05Å; L307-G310 PolarHBondContact O-N 3.39Å; L307-V313 HydrophobicContact CB-CG1 4.4Å; L307-V313 HydrophobicContact CB-CG2 4.02Å; L307-V313 HydrophobicContact CD1-CG2 3.79Å; L307-V313 HydrophobicContact CG-CG2 4.4Å; L307-I351 HydrophobicContact CD2-CD1 3.83Å; L307-I351 HydrophobicContact CD2-CG1 3.84Å
308	N	90.8	Very high	92.1	Very high	125 Å²	125	36.2 Å²	36.2	67%	0.668	20%	0.201	S	C	*	.	H	α-helix	trans	-66.3	-29.1	176.9	-68.3	-17	0	0	0	112.3	K304 Y305 G310	K304-N308 PolarHBondContact O-N 3.32Å; K304-N308 VanDerWaalsContact O-N 3.15Å; K304-N308 PolarHBondContact O-ND2 2.82Å; Y305-N308 WeakPolarHBondContact O-CB 3.41Å; Y305-N308 PolarHBondContact O-N 3.49Å; Y305-N308 VanDerWaalsContact O-N 3.09Å; N308-G310 PolarHBondContact O-N 2.84Å
309	S	90.2	Very high	91.9	Very high	37 Å²	37	36 Å²	36	26%	0.259	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	6.8	170.9	-53.7	0	0	0	0	113.6	Q235 Y305 F306 L307 V311	Q235-S309 PolarHBondContact NE2-O 3.46Å; Q235-S309 PolarHBondContact OE1-O 2.86Å; Y305-S309 PolarHBondContact O-N 2.91Å; Y305-S309 PolarHBondContact O-OG 2.86Å; F306-S309 CarbonylContact O-C 3.56Å; F306-S309 PolarHBondContact O-N 2.91Å; L307-S309 PolarHBondContact O-N 3.05Å; S309-V311 VanDerWaalsContact C-N 3.29Å; S309-V311 PolarHBondContact O-N 3.18Å
310	G	88.6	Confident	91.8	Very high	52 Å²	52	36.1 Å²	36.1	54%	0.536	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.1	10.3	176.5	0	0	0	0	0	115.3	Q235 F306 L307 N308	Q235-G310 PolarHBondContact NE2-O 2.82Å; F306-G310 PolarHBondContact O-N 2.98Å; L307-G310 PolarHBondContact O-N 3.39Å; N308-G310 PolarHBondContact O-N 2.84Å
311	V	90	Very high	91.7	Very high	4 Å²	4	37.2 Å²	37.2	2%	0.024	21%	0.205	C	C	.	.			trans	-78.3	138	179.3	176.1	0	0	0	0	109.2	A238 Y242 F306 S309 V313	A238-V311 HydrophobicContact CB-CG2 3.57Å; Y242-V311 HydrophobicContact CD1-CG1 4.21Å; Y242-V311 HydrophobicContact CG-CG1 4.34Å; F306-V311 HydrophobicContact CB-CB 4.36Å; F306-V311 HydrophobicContact CD1-CG2 4.41Å; F306-V311 WeakPolarHBondContact O-CB 3.41Å; F306-V311 PolarHBondContact O-N 3.03Å; F306-V311 VanDerWaalsContact O-N 3.08Å; S309-V311 VanDerWaalsContact C-N 3.29Å; S309-V311 PolarHBondContact O-N 3.18Å; V311-V313 PolarHBondContact O-N 2.91Å
312	P	89.3	Confident	91.6	Very high	65 Å²	65	35.4 Å²	35.4	42%	0.422	19%	0.193	S	C	.	.			trans	-64.5	110.2	169.5	26.9	-33.4	0	0	0	109.2	L341	P312-L341 VanDerWaalsContact O-CD1 3.29Å; P312-L341 WeakPolarHBondContact O-CD1 3.5Å
313	V	91.6	Very high	91.5	Very high	3 Å²	3	35.2 Å²	35.2	2%	0.018	19%	0.192	C	C	.	.	P	Polyproline II helix	trans	-100.9	154.6	179.6	-63.1	0	0	0	0	111.7	Y242 T303 F306 L307 V311 G346	Y242-V313 HydrophobicContact CD2-CG1 4.37Å; Y242-V313 HydrophobicContact CE1-CB 4.27Å; Y242-V313 HydrophobicContact CE1-CG1 4.22Å; Y242-V313 HydrophobicContact CE2-CB 4.36Å; Y242-V313 HydrophobicContact CE2-CG1 3.97Å; T303-V313 HydrophobicContact CG2-CB 4.06Å; T303-V313 HydrophobicContact CG2-CG2 3.79Å; F306-V313 HydrophobicContact CB-CG1 3.79Å; L307-V313 HydrophobicContact CB-CG1 4.4Å; L307-V313 HydrophobicContact CB-CG2 4.02Å; L307-V313 HydrophobicContact CD1-CG2 3.79Å; L307-V313 HydrophobicContact CG-CG2 4.4Å; V311-V313 PolarHBondContact O-N 2.91Å; V313-G346 PolarHBondContact O-N 3.22Å
314	V	90.4	Very high	91.5	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.198	C	C	.	.	P	Polyproline II helix	trans	-80.2	145.7	169.1	175.6	0	0	0	0	108.9	Y242 R318 F337 L341	Y242-V314 PolarHBondContact OH-N 3.03Å; V314-R318 HydrophobicContact CG1-CB 3.42Å; V314-R318 VanDerWaalsContact CG1-CB 3.42Å; V314-F337 HydrophobicContact CG2-CZ 4.47Å; V314-L341 HydrophobicContact CG2-CB 4.33Å; V314-L341 HydrophobicContact CG2-CD1 3.84Å
315	P	89.8	Confident	91.4	Very high	39 Å²	39	33 Å²	33	25%	0.253	19%	0.187	S	C	.	.	P	Polyproline II helix	trans	-54	147	174	-26.3	35.3	0	0	0	112.9	D317 R318 L319	P315-D317 VanDerWaalsContact C-N 3.3Å; P315-D317 PolarHBondContact O-N 3.09Å; P315-R318 HydrophobicContact CB-CB 4.46Å; P315-R318 HydrophobicContact CB-CG 4.4Å; P315-R318 WeakPolarHBondContact O-CB 3.35Å; P315-R318 PolarHBondContact O-N 3.4Å; P315-L319 PolarHBondContact O-N 3.49Å
316	V	91.5	Very high	91.2	Very high	13 Å²	13	36.9 Å²	36.9	8%	0.079	22%	0.215	C	C	.	.	H	α-helix	trans	-57	-43.2	-176.3	-178.5	0	0	0	0	111.9	Y296 C299 L300 T303 R318 L319 F320	Y296-V316 HydrophobicContact CD2-CG1 4.36Å; Y296-V316 HydrophobicContact CE1-CG1 4.31Å; Y296-V316 HydrophobicContact CE2-CG1 3.82Å; C299-V316 HydrophobicContact CB-CG1 4.1Å; L300-V316 HydrophobicContact CB-CG1 4.18Å; T303-V316 HydrophobicContact CG2-CG2 3.94Å; V316-R318 PolarHBondContact O-N 3.07Å; V316-L319 PolarHBondContact O-N 2.7Å; V316-F320 WeakPolarHBondContact O-CB 3.49Å; V316-F320 PolarHBondContact O-N 2.73Å
317	D	89.5	Confident	90.9	Very high	32 Å²	32	40.4 Å²	40.4	17%	0.171	24%	0.244	C	C	.	.	H	α-helix	trans	-56.4	-38	178.5	-61.5	-34.4	0	0	0	112.5	Y296 P315 E321 K352 G358	Y296-D317 PolarHBondContact OH-OD1 2.63Å; P315-D317 VanDerWaalsContact C-N 3.3Å; P315-D317 PolarHBondContact O-N 3.09Å; D317-E321 WeakPolarHBondContact O-CB 3.47Å; D317-E321 PolarHBondContact O-N 3.48Å; D317-K352 IonicContact OD2-NZ 2.88Å; D317-G358 WeakPolarHBondContact OD1-CA 3.27Å; D317-G358 PolarHBondContact OD1-N 3.33Å
318	R	89.8	Confident	90.5	Very high	94 Å²	94	39 Å²	39	36%	0.355	24%	0.237	S	C	.	.	H	α-helix	trans	-78.5	-40.3	-179	-71.4	-73.2	-152.3	-153.8	3.7	111.2	V314 P315 V316 F320 E321 F322 W340 E344	V314-R318 HydrophobicContact CG1-CB 3.42Å; V314-R318 VanDerWaalsContact CG1-CB 3.42Å; P315-R318 HydrophobicContact CB-CB 4.46Å; P315-R318 HydrophobicContact CB-CG 4.4Å; P315-R318 WeakPolarHBondContact O-CB 3.35Å; P315-R318 PolarHBondContact O-N 3.4Å; V316-R318 PolarHBondContact O-N 3.07Å; R318-F320 PolarHBondContact O-N 3.44Å; R318-E321 WeakPolarHBondContact CD-OE2 3.3Å; R318-E321 IonicContact CZ-OE2 2.63Å; R318-E321 IonicContact NH1-OE1 3.89Å; R318-E321 IonicContact NH1-OE2 3.89Å; R318-E321 PolarHBondContact NH1-OE2 3.19Å; R318-E321 PolarHBondContact O-N 2.93Å; R318-F322 WeakPolarHBondContact O-CB 3.3Å; R318-F322 PolarHBondContact O-N 3.45Å; R318-W340 HydrophobicContact CB-CE3 4.46Å; R318-W340 HydrophobicContact CB-CZ3 4.48Å; R318-W340 WeakPolarHBondContact O-CZ3 3.49Å; R318-E344 VanDerWaalsContact CD-OE2 3.28Å; R318-E344 WeakPolarHBondContact CD-OE2 3.37Å; R318-E344 WeakPolarHBondContact CG-OE2 3.33Å; R318-E344 IonicContact CZ-OE1 2.65Å; R318-E344 VanDerWaalsContact CZ-OE1 3.32Å; R318-E344 IonicContact NE-OE1 3.78Å; R318-E344 PolarHBondContact NE-OE1 2.68Å; R318-E344 IonicContact NE-OE2 2.78Å; R318-E344 PolarHBondContact NE-OE2 3.24Å; R318-E344 IonicContact NH2-OE1 3.23Å; R318-E344 PolarHBondContact NH2-OE1 3.37Å
319	L	92.3	Very high	90	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-59.8	-39.6	170.8	179.2	58.1	0	0	0	111.5	C246 I249 C299 P315 V316 F322 A323 F337	C246-L319 HydrophobicContact CB-CD1 3.73Å; C246-L319 VanDerWaalsContact SG-CD1 3.57Å; I249-L319 HydrophobicContact CD1-CD2 4.45Å; C299-L319 HydrophobicContact CB-CD2 3.91Å; C299-L319 HydrophobicContact CB-CG 4.15Å; P315-L319 PolarHBondContact O-N 3.49Å; V316-L319 PolarHBondContact O-N 2.7Å; L319-F322 HydrophobicContact CD1-CD1 4.35Å; L319-F322 PolarHBondContact O-N 2.89Å; L319-A323 PolarHBondContact O-N 3.22Å; L319-F337 HydrophobicContact CD1-CE2 4.15Å
320	F	93.5	Very high	89.3	Confident	1 Å²	1	43.5 Å²	43.5	0%	0.004	27%	0.267	C	S	.	.	H	α-helix	trans	-65.1	-46.6	175.6	-179.8	-90.1	0	0	0	111.9	I292 L295 Y296 V316 R318 F322 A323 V324 V360 Y361 M364	I292-F320 HydrophobicContact CD1-CZ 4.42Å; I292-F320 HydrophobicContact CG2-CE2 4.06Å; I292-F320 HydrophobicContact CG2-CZ 3.7Å; L295-F320 HydrophobicContact CB-CE2 4.24Å; L295-F320 HydrophobicContact CD2-CD2 4.14Å; L295-F320 HydrophobicContact CD2-CE2 3.78Å; L295-F320 HydrophobicContact CG-CD2 4.09Å; L295-F320 HydrophobicContact CG-CE2 4Å; Y296-F320 HydrophobicContact CD2-CB 4.15Å; Y296-F320 AromaticContact CD2-CD2 3.87Å; Y296-F320 HydrophobicContact CD2-CD2 3.87Å; Y296-F320 HydrophobicContact CD2-CG 4Å; Y296-F320 HydrophobicContact CG-CD2 4.45Å; V316-F320 WeakPolarHBondContact O-CB 3.49Å; V316-F320 PolarHBondContact O-N 2.73Å; R318-F320 PolarHBondContact O-N 3.44Å; F320-F322 VanDerWaalsContact C-N 3.33Å; F320-F322 PolarHBondContact O-N 2.93Å; F320-A323 PolarHBondContact O-N 3.04Å; F320-A323 VanDerWaalsContact O-N 3.17Å; F320-V324 HydrophobicContact CD1-CG2 4.5Å; F320-V324 HydrophobicContact CE1-CG2 4.03Å; F320-V324 HydrophobicContact CE2-CG2 4.32Å; F320-V324 HydrophobicContact CZ-CG2 3.91Å; F320-V324 WeakPolarHBondContact O-CG2 3.41Å; F320-V324 PolarHBondContact O-N 2.91Å; F320-V324 VanDerWaalsContact O-N 3.13Å; F320-V360 HydrophobicContact CD1-CG1 4.41Å; F320-V360 HydrophobicContact CE1-CG1 4.2Å; F320-Y361 HydrophobicContact CE1-CD2 4.45Å; F320-Y361 HydrophobicContact CE2-CD2 4.07Å; F320-Y361 HydrophobicContact CZ-CD2 4.01Å; F320-M364 HydrophobicContact CE1-SD 3.61Å; F320-M364 HydrophobicContact CZ-SD 3.69Å
321	E	92.2	Very high	88.8	Confident	58 Å²	58	44.6 Å²	44.6	27%	0.271	28%	0.278	S	S	.	.	H	α-helix	trans	-57.2	-46.5	174.4	-171.8	178.9	-172.7	0	0	111	D317 R318 A323 V324 D325 W340	D317-E321 WeakPolarHBondContact O-CB 3.47Å; D317-E321 PolarHBondContact O-N 3.48Å; R318-E321 WeakPolarHBondContact CD-OE2 3.3Å; R318-E321 IonicContact CZ-OE2 2.63Å; R318-E321 IonicContact NH1-OE1 3.89Å; R318-E321 IonicContact NH1-OE2 3.89Å; R318-E321 PolarHBondContact NH1-OE2 3.19Å; R318-E321 PolarHBondContact O-N 2.93Å; E321-A323 VanDerWaalsContact C-N 3.33Å; E321-A323 PolarHBondContact O-N 3.49Å; E321-V324 PolarHBondContact O-N 3.22Å; E321-D325 VanDerWaalsContact O-CB 3.25Å; E321-D325 WeakPolarHBondContact O-CB 3.45Å; E321-D325 PolarHBondContact O-N 3.18Å; E321-W340 HydrophobicContact CB-CH2 4.33Å; E321-W340 HydrophobicContact CB-CZ3 4.28Å; E321-W340 HydrophobicContact CG-CH2 4.07Å; E321-W340 HydrophobicContact CG-CZ3 4.49Å
322	F	92.6	Very high	88.5	Confident	1 Å²	1	46.5 Å²	46.5	0%	0.004	29%	0.292	C	S	.	.	H	α-helix	trans	-58.7	-41	175.4	174.3	-104.5	0	0	0	112.7	L247 R250 R318 L319 F320 I328 F337 W340	L247-F322 HydrophobicContact CD2-CE1 4.45Å; L247-F322 HydrophobicContact CD2-CZ 3.98Å; R250-F322 HydrophobicContact CB-CD1 4.23Å; R250-F322 HydrophobicContact CB-CE1 3.71Å; R250-F322 HydrophobicContact CB-CZ 4.32Å; R250-F322 VanDerWaalsContact CD-CE1 3.45Å; R250-F322 HydrophobicContact CG-CE1 4.19Å; R250-F322 HydrophobicContact CG-CZ 4.39Å; R250-F322 PolarHBondContact NH1-O 2.95Å; R318-F322 WeakPolarHBondContact O-CB 3.3Å; R318-F322 PolarHBondContact O-N 3.45Å; L319-F322 HydrophobicContact CD1-CD1 4.35Å; L319-F322 PolarHBondContact O-N 2.89Å; F320-F322 VanDerWaalsContact C-N 3.33Å; F320-F322 PolarHBondContact O-N 2.93Å; F322-I328 HydrophobicContact CD2-CD1 3.8Å; F322-I328 HydrophobicContact CE2-CD1 3.96Å; F322-F337 AromaticContact CD1-CD2 3.8Å; F322-F337 HydrophobicContact CD1-CD2 3.8Å; F322-F337 HydrophobicContact CD1-CE2 4.32Å; F322-F337 HydrophobicContact CD2-CD2 4.25Å; F322-F337 HydrophobicContact CE1-CB 4.33Å; F322-F337 AromaticContact CE1-CD2 3.68Å; F322-F337 HydrophobicContact CE1-CD2 3.68Å; F322-F337 HydrophobicContact CE1-CE2 4.45Å; F322-F337 HydrophobicContact CE1-CG 4.31Å; F322-F337 HydrophobicContact CE2-CB 3.85Å; F322-F337 HydrophobicContact CE2-CD2 4.15Å; F322-F337 HydrophobicContact CE2-CG 4.5Å; F322-F337 HydrophobicContact CG-CD2 4.08Å; F322-F337 HydrophobicContact CZ-CB 3.68Å; F322-F337 AromaticContact CZ-CD2 3.86Å; F322-F337 HydrophobicContact CZ-CD2 3.86Å; F322-F337 HydrophobicContact CZ-CG 4.15Å; F322-W340 HydrophobicContact CB-CE3 3.93Å; F322-W340 HydrophobicContact CB-CH2 4.07Å; F322-W340 HydrophobicContact CB-CZ3 3.57Å
323	A	93.8	Very high	88.4	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-65.7	-39.6	-180	0	0	0	0	0	112	I249 Y253 Q254 L295 L319 F320 E321	I249-A323 HydrophobicContact CG2-CB 3.9Å; Y253-A323 WeakPolarHBondContact CD1-O 3.29Å; Q254-A323 PolarHBondContact NE2-O 3.04Å; L295-A323 HydrophobicContact CD1-CB 4.48Å; L295-A323 HydrophobicContact CD2-CB 4.37Å; L319-A323 PolarHBondContact O-N 3.22Å; F320-A323 PolarHBondContact O-N 3.04Å; F320-A323 VanDerWaalsContact O-N 3.17Å; E321-A323 VanDerWaalsContact C-N 3.33Å; E321-A323 PolarHBondContact O-N 3.49Å
324	V	93.1	Very high	88.2	Confident	22 Å²	22	50.8 Å²	50.8	13%	0.133	31%	0.305	C	S	.	.	H	α-helix	trans	-88.1	-27.9	-174.2	177.3	0	0	0	0	113.2	Y253 Q254 L295 F320 E321 T326 M364	Y253-V324 HydrophobicContact CE1-CB 4.2Å; Y253-V324 HydrophobicContact CE1-CG1 4.14Å; Y253-V324 HydrophobicContact CE1-CG2 3.97Å; Q254-V324 PolarHBondContact NE2-O 3.03Å; L295-V324 HydrophobicContact CD2-CG2 3.85Å; F320-V324 HydrophobicContact CD1-CG2 4.5Å; F320-V324 HydrophobicContact CE1-CG2 4.03Å; F320-V324 HydrophobicContact CE2-CG2 4.32Å; F320-V324 HydrophobicContact CZ-CG2 3.91Å; F320-V324 WeakPolarHBondContact O-CG2 3.41Å; F320-V324 PolarHBondContact O-N 2.91Å; F320-V324 VanDerWaalsContact O-N 3.13Å; E321-V324 PolarHBondContact O-N 3.22Å; V324-T326 PolarHBondContact O-N 3.42Å; V324-T326 VanDerWaalsContact O-N 3.16Å; V324-M364 HydrophobicContact CB-CE 4.32Å; V324-M364 HydrophobicContact CB-SD 4.13Å; V324-M364 HydrophobicContact CG1-CE 3.37Å; V324-M364 HydrophobicContact CG1-SD 3.52Å; V324-M364 VanDerWaalsContact CG1-SD 3.52Å; V324-M364 HydrophobicContact CG2-CE 3.99Å; V324-M364 HydrophobicContact CG2-SD 3.82Å
325	D	90.9	Very high	88.1	Confident	48 Å²	48	54.9 Å²	54.9	26%	0.257	33%	0.333	S	S	.	.			trans	-57.8	121	-170.6	-174.2	11.8	0	0	0	112.6	R250 Q254 E321 A327 I328	R250-D325 PolarHBondContact NH1-O 2.96Å; R250-D325 PolarHBondContact NH2-O 3.2Å; Q254-D325 PolarHBondContact NE2-O 2.86Å; E321-D325 VanDerWaalsContact O-CB 3.25Å; E321-D325 WeakPolarHBondContact O-CB 3.45Å; E321-D325 PolarHBondContact O-N 3.18Å; D325-A327 VanDerWaalsContact OD1-CB 3.27Å; D325-A327 WeakPolarHBondContact OD1-CB 3.43Å; D325-A327 PolarHBondContact OD1-N 3.49Å; D325-I328 HydrophobicContact CB-CD1 4.28Å
326	T	89.6	Confident	88.1	Confident	122 Å²	122	53.8 Å²	53.8	75%	0.748	33%	0.328	S	S	*	.	S	Bend	trans	-88.4	-8	179	56.2	0	0	0	0	113.2	V324	V324-T326 PolarHBondContact O-N 3.42Å; V324-T326 VanDerWaalsContact O-N 3.16Å
327	A	87.6	Confident	88	Confident	77 Å²	77	53.2 Å²	53.2	64%	0.636	32%	0.324	S	S	*	.			trans	-78.8	-25.4	-176.9	0	0	0	0	0	113.4	D325 E329	D325-A327 VanDerWaalsContact OD1-CB 3.27Å; D325-A327 WeakPolarHBondContact OD1-CB 3.43Å; D325-A327 PolarHBondContact OD1-N 3.49Å; A327-E329 PolarHBondContact O-N 3.49Å
328	I	84.3	Confident	88	Confident	25 Å²	25	54.9 Å²	54.9	13%	0.128	33%	0.333	C	S	.	.	S	Bend	trans	-70.1	122.8	178.5	-60.6	164.5	0	0	0	109.4	R250 F322 D325 S332 D333 A336	R250-I328 PolarHBondContact NH2-O 3.43Å; F322-I328 HydrophobicContact CD2-CD1 3.8Å; F322-I328 HydrophobicContact CE2-CD1 3.96Å; D325-I328 HydrophobicContact CB-CD1 4.28Å; I328-S332 WeakPolarHBondContact CG2-OG 3.49Å; I328-D333 WeakPolarHBondContact CG2-OD1 3.49Å; I328-A336 HydrophobicContact CD1-CB 4.32Å; I328-A336 HydrophobicContact CG1-CB 4.5Å; I328-A336 HydrophobicContact CG2-CB 4.03Å
329	E	80.2	Confident	87.9	Confident	155 Å²	155	54.3 Å²	54.3	72%	0.724	34%	0.335	S	S	*	.	P	Polyproline II helix	trans	-65.8	136.1	-179.7	-64.1	-173.9	166.8	0	0	111.4	A327 G331 S332	A327-E329 PolarHBondContact O-N 3.49Å; E329-G331 PolarHBondContact O-N 3.35Å; E329-S332 PolarHBondContact N-OG 3.14Å; E329-S332 WeakPolarHBondContact O-CB 3.48Å; E329-S332 PolarHBondContact O-N 3.34Å; E329-S332 PolarHBondContact O-OG 2.87Å
330	A	74.7	Confident	87.6	Confident	103 Å²	103	56.7 Å²	56.7	85%	0.851	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	123.4	178.5	0	0	0	0	0	111.1
331	G	77.5	Confident	87.4	Confident	74 Å²	74	58.5 Å²	58.5	76%	0.763	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.8	-13	-177.1	0	0	0	0	0	114.7	E329 D333	E329-G331 PolarHBondContact O-N 3.35Å; G331-D333 VanDerWaalsContact C-N 3.35Å; G331-D333 PolarHBondContact N-OD2 3.34Å
332	S	84.9	Confident	87.1	Confident	44 Å²	44	64.9 Å²	64.9	31%	0.308	38%	0.375	S	S	.	.			trans	-90.6	-1	170.2	72.2	0	0	0	0	113.2	I328 E329 K334 S335 A336	I328-S332 WeakPolarHBondContact CG2-OG 3.49Å; E329-S332 PolarHBondContact N-OG 3.14Å; E329-S332 WeakPolarHBondContact O-CB 3.48Å; E329-S332 PolarHBondContact O-N 3.34Å; E329-S332 PolarHBondContact O-OG 2.87Å; S332-K334 VanDerWaalsContact C-N 3.3Å; S332-K334 PolarHBondContact O-N 3.5Å; S332-S335 PolarHBondContact O-N 2.76Å; S332-S335 VanDerWaalsContact O-N 3.09Å; S332-A336 PolarHBondContact O-N 2.77Å
333	D	86.1	Confident	86.8	Confident	27 Å²	27	70.5 Å²	70.5	14%	0.144	40%	0.399	C	S	.	.	H	α-helix	trans	-57.1	-40.6	-168.9	-54	-61.5	0	0	0	113	L247 R250 I328 G331 F337	L247-D333 HydrophobicContact CD2-CB 3.88Å; R250-D333 IonicContact CZ-OD1 3.85Å; R250-D333 IonicContact NE-OD1 2.73Å; R250-D333 PolarHBondContact NE-OD1 3.05Å; R250-D333 IonicContact NH2-OD1 3.32Å; R250-D333 PolarHBondContact NH2-OD1 3.34Å; I328-D333 WeakPolarHBondContact CG2-OD1 3.49Å; G331-D333 VanDerWaalsContact C-N 3.35Å; G331-D333 PolarHBondContact N-OD2 3.34Å; D333-F337 WeakPolarHBondContact O-CB 3.42Å; D333-F337 PolarHBondContact O-N 2.87Å
334	K	88.2	Confident	86.1	Confident	131 Å²	131	72.4 Å²	72.4	57%	0.57	41%	0.408	S	S	*	.	H	α-helix	trans	-65	-48.7	177.8	-174.8	176.8	179.1	-173.7	0	111.8	L247 S332 A336 F337 D338	L247-K334 HydrophobicContact CD1-CB 4.07Å; L247-K334 HydrophobicContact CD1-CG 4.1Å; L247-K334 HydrophobicContact CD2-CB 4.44Å; S332-K334 VanDerWaalsContact C-N 3.3Å; S332-K334 PolarHBondContact O-N 3.5Å; K334-A336 VanDerWaalsContact C-N 3.33Å; K334-A336 PolarHBondContact O-N 2.9Å; K334-F337 PolarHBondContact O-N 2.78Å; K334-D338 WeakPolarHBondContact O-CB 3.35Å; K334-D338 PolarHBondContact O-N 2.44Å
335	S	89	Confident	85.2	Confident	86 Å²	86	72.5 Å²	72.5	60%	0.601	41%	0.413	S	S	*	.	H	α-helix	trans	-65	-38.3	179.7	-60.3	0	0	0	0	112.1	S332 E339	S332-S335 PolarHBondContact O-N 2.76Å; S332-S335 VanDerWaalsContact O-N 3.09Å; S335-E339 PolarHBondContact O-N 3.38Å; S335-E339 VanDerWaalsContact O-N 3.07Å
336	A	88.1	Confident	84.3	Confident	16 Å²	16	72.3 Å²	72.3	13%	0.132	42%	0.423	C	S	.	.	H	α-helix	trans	-62.7	-47	174.4	0	0	0	0	0	111.3	I328 S332 K334 E339 W340	I328-A336 HydrophobicContact CD1-CB 4.32Å; I328-A336 HydrophobicContact CG1-CB 4.5Å; I328-A336 HydrophobicContact CG2-CB 4.03Å; S332-A336 PolarHBondContact O-N 2.77Å; K334-A336 VanDerWaalsContact C-N 3.33Å; K334-A336 PolarHBondContact O-N 2.9Å; A336-E339 PolarHBondContact O-N 2.82Å; A336-W340 PolarHBondContact O-N 2.99Å; A336-W340 VanDerWaalsContact O-N 3.13Å
337	F	90	Very high	83	Confident	1 Å²	1	73 Å²	73	0%	0.004	42%	0.418	C	S	.	.	H	α-helix	trans	-63.5	-43.7	177.8	-171.2	-101	0	0	0	112.4	Y242 C246 L247 V314 L319 F322 D333 K334 E339 W340 L341	Y242-F337 HydrophobicContact CD1-CZ 4.49Å; Y242-F337 HydrophobicContact CE1-CE1 4.32Å; Y242-F337 AromaticContact CE1-CZ 3.89Å; Y242-F337 HydrophobicContact CE1-CZ 3.89Å; C246-F337 HydrophobicContact CB-CD2 4.21Å; C246-F337 HydrophobicContact CB-CE1 4.04Å; C246-F337 HydrophobicContact CB-CE2 3.55Å; C246-F337 HydrophobicContact CB-CZ 3.44Å; C246-F337 VanDerWaalsContact CB-CZ 3.44Å; C246-F337 VanDerWaalsContact SG-CZ 3.57Å; L247-F337 HydrophobicContact CD2-CB 4.39Å; V314-F337 HydrophobicContact CG2-CZ 4.47Å; L319-F337 HydrophobicContact CD1-CE2 4.15Å; F322-F337 AromaticContact CD1-CD2 3.8Å; F322-F337 HydrophobicContact CD1-CD2 3.8Å; F322-F337 HydrophobicContact CD1-CE2 4.32Å; F322-F337 HydrophobicContact CD2-CD2 4.25Å; F322-F337 HydrophobicContact CE1-CB 4.33Å; F322-F337 AromaticContact CE1-CD2 3.68Å; F322-F337 HydrophobicContact CE1-CD2 3.68Å; F322-F337 HydrophobicContact CE1-CE2 4.45Å; F322-F337 HydrophobicContact CE1-CG 4.31Å; F322-F337 HydrophobicContact CE2-CB 3.85Å; F322-F337 HydrophobicContact CE2-CD2 4.15Å; F322-F337 HydrophobicContact CE2-CG 4.5Å; F322-F337 HydrophobicContact CG-CD2 4.08Å; F322-F337 HydrophobicContact CZ-CB 3.68Å; F322-F337 AromaticContact CZ-CD2 3.86Å; F322-F337 HydrophobicContact CZ-CD2 3.86Å; F322-F337 HydrophobicContact CZ-CG 4.15Å; D333-F337 WeakPolarHBondContact O-CB 3.42Å; D333-F337 PolarHBondContact O-N 2.87Å; K334-F337 PolarHBondContact O-N 2.78Å; F337-E339 VanDerWaalsContact C-N 3.25Å; F337-E339 PolarHBondContact O-N 3.23Å; F337-W340 PolarHBondContact O-N 2.75Å; F337-W340 VanDerWaalsContact O-N 3.11Å; F337-L341 WeakPolarHBondContact O-CB 3.48Å; F337-L341 PolarHBondContact O-N 3.24Å
338	D	89.2	Confident	81.6	Confident	68 Å²	68	70.2 Å²	70.2	36%	0.364	40%	0.396	S	S	.	.	H	α-helix	trans	-60.1	-36.9	177.3	-69.4	-21	0	0	0	111.3	K334 R342	K334-D338 WeakPolarHBondContact O-CB 3.35Å; K334-D338 PolarHBondContact O-N 2.44Å; D338-R342 WeakPolarHBondContact O-CB 3.12Å; D338-R342 PolarHBondContact O-N 3.42Å
339	E	88.7	Confident	80.2	Confident	82 Å²	82	78.6 Å²	78.6	38%	0.383	43%	0.432	S	S	.	.	H	α-helix	trans	-65.8	-41.5	174.6	-173.6	179.1	178.7	0	0	112.3	S335 A336 F337 R342 K343	S335-E339 PolarHBondContact O-N 3.38Å; S335-E339 VanDerWaalsContact O-N 3.07Å; A336-E339 PolarHBondContact O-N 2.82Å; F337-E339 VanDerWaalsContact C-N 3.25Å; F337-E339 PolarHBondContact O-N 3.23Å; E339-R342 PolarHBondContact O-N 3.16Å; E339-K343 HydrophobicContact CG-CD 4.37Å; E339-K343 WeakPolarHBondContact O-CG 3.34Å; E339-K343 PolarHBondContact O-N 3.32Å; E339-K343 VanDerWaalsContact O-N 3.08Å; E339-K343 WeakPolarHBondContact OE1-CE 3.27Å; E339-K343 IonicContact OE1-NZ 3.95Å; E339-K343 PolarHBondContact OE1-NZ 2.93Å
340	W	85.9	Confident	79.2	Confident	49 Å²	49	75 Å²	75	19%	0.186	43%	0.429	C	S	.	.	H	α-helix	trans	-66.9	-43.8	178.2	-72	31.9	0	0	0	110.8	R318 E321 F322 A336 F337 R342 K343 E344	R318-W340 HydrophobicContact CB-CE3 4.46Å; R318-W340 HydrophobicContact CB-CZ3 4.48Å; R318-W340 WeakPolarHBondContact O-CZ3 3.49Å; E321-W340 HydrophobicContact CB-CH2 4.33Å; E321-W340 HydrophobicContact CB-CZ3 4.28Å; E321-W340 HydrophobicContact CG-CH2 4.07Å; E321-W340 HydrophobicContact CG-CZ3 4.49Å; F322-W340 HydrophobicContact CB-CE3 3.93Å; F322-W340 HydrophobicContact CB-CH2 4.07Å; F322-W340 HydrophobicContact CB-CZ3 3.57Å; A336-W340 PolarHBondContact O-N 2.99Å; A336-W340 VanDerWaalsContact O-N 3.13Å; F337-W340 PolarHBondContact O-N 2.75Å; F337-W340 VanDerWaalsContact O-N 3.11Å; W340-R342 VanDerWaalsContact C-N 3.26Å; W340-R342 PolarHBondContact O-N 2.83Å; W340-K343 PolarHBondContact O-N 2.96Å; W340-K343 VanDerWaalsContact O-N 3.14Å; W340-E344 PolarHBondContact O-N 2.97Å
341	L	88	Confident	78.7	Confident	39 Å²	39	73.4 Å²	73.4	20%	0.204	41%	0.405	C	S	.	.	H	α-helix	trans	-58.3	-39.1	174.6	-172.8	64	0	0	0	111.6	Y242 P312 V314 F337 G345	Y242-L341 HydrophobicContact CE1-CD1 4.07Å; P312-L341 VanDerWaalsContact O-CD1 3.29Å; P312-L341 WeakPolarHBondContact O-CD1 3.5Å; V314-L341 HydrophobicContact CG2-CB 4.33Å; V314-L341 HydrophobicContact CG2-CD1 3.84Å; F337-L341 WeakPolarHBondContact O-CB 3.48Å; F337-L341 PolarHBondContact O-N 3.24Å; L341-G345 WeakPolarHBondContact O-CA 2.93Å; L341-G345 PolarHBondContact O-N 3.42Å
342	R	86.9	Confident	78	Confident	192 Å²	192	74.9 Å²	74.9	73%	0.725	39%	0.391	S	S	*	.	H	α-helix	trans	-68.7	-37.5	175.9	-173.9	-177.8	64.5	118.9	-1.1	113.3	D338 E339 W340	D338-R342 WeakPolarHBondContact O-CB 3.12Å; D338-R342 PolarHBondContact O-N 3.42Å; E339-R342 PolarHBondContact O-N 3.16Å; W340-R342 VanDerWaalsContact C-N 3.26Å; W340-R342 PolarHBondContact O-N 2.83Å
343	K	85.9	Confident	76.8	Confident	119 Å²	119	75.6 Å²	75.6	52%	0.517	40%	0.396	S	S	.	.	H	α-helix	trans	-78.2	-40.7	-176.5	-74.7	179.1	-176.1	169.8	0	112.8	E339 W340	E339-K343 HydrophobicContact CG-CD 4.37Å; E339-K343 WeakPolarHBondContact O-CG 3.34Å; E339-K343 PolarHBondContact O-N 3.32Å; E339-K343 VanDerWaalsContact O-N 3.08Å; E339-K343 WeakPolarHBondContact OE1-CE 3.27Å; E339-K343 IonicContact OE1-NZ 3.95Å; E339-K343 PolarHBondContact OE1-NZ 2.93Å; W340-K343 PolarHBondContact O-N 2.96Å; W340-K343 VanDerWaalsContact O-N 3.14Å
344	E	79.6	Confident	75.5	Confident	40 Å²	40	79.4 Å²	79.4	19%	0.187	41%	0.412	C	S	.	.	H	α-helix	trans	-123.8	-7.9	-168	-61.3	-175.4	159.1	0	0	113.2	R318 W340 G346 Q347	R318-E344 VanDerWaalsContact CD-OE2 3.28Å; R318-E344 WeakPolarHBondContact CD-OE2 3.37Å; R318-E344 WeakPolarHBondContact CG-OE2 3.33Å; R318-E344 IonicContact CZ-OE1 2.65Å; R318-E344 VanDerWaalsContact CZ-OE1 3.32Å; R318-E344 IonicContact NE-OE1 3.78Å; R318-E344 PolarHBondContact NE-OE1 2.68Å; R318-E344 IonicContact NE-OE2 2.78Å; R318-E344 PolarHBondContact NE-OE2 3.24Å; R318-E344 IonicContact NH2-OE1 3.23Å; R318-E344 PolarHBondContact NH2-OE1 3.37Å; W340-E344 PolarHBondContact O-N 2.97Å; E344-G346 PolarHBondContact O-N 2.94Å; E344-Q347 WeakPolarHBondContact O-CB 3.28Å; E344-Q347 PolarHBondContact O-N 3.27Å
345	G	74.5	Confident	74	Confident	24 Å²	24	80.3 Å²	80.3	25%	0.247	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	131.7	177.5	0	0	0	0	0	112	L341 Q347	L341-G345 WeakPolarHBondContact O-CA 2.93Å; L341-G345 PolarHBondContact O-N 3.42Å; G345-Q347 VanDerWaalsContact C-N 3.31Å; G345-Q347 PolarHBondContact O-N 3.11Å
346	G	71.3	Confident	72.9	Confident	45 Å²	45	81.7 Å²	81.7	46%	0.464	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.8	-3.2	-179.5	0	0	0	0	0	115.3	V313 E344 G348	V313-G346 PolarHBondContact O-N 3.22Å; E344-G346 PolarHBondContact O-N 2.94Å; G346-G348 VanDerWaalsContact C-N 3.28Å
347	Q	63.4	Low	72.1	Confident	137 Å²	137	81.1 Å²	81.1	64%	0.64	42%	0.416	S	S	*	.			trans	-77.8	-14.9	170.2	-62.9	-176	-4.4	0	0	112.7	E344 G345 K349	E344-Q347 WeakPolarHBondContact O-CB 3.28Å; E344-Q347 PolarHBondContact O-N 3.27Å; G345-Q347 VanDerWaalsContact C-N 3.31Å; G345-Q347 PolarHBondContact O-N 3.11Å; Q347-K349 PolarHBondContact O-N 2.81Å
348	G	56.9	Low	71.5	Confident	17 Å²	17	81.9 Å²	81.9	18%	0.175	42%	0.424	C	S	.	.			trans	-77.3	72.2	-179.6	0	0	0	0	0	113.9	G346	G346-G348 VanDerWaalsContact C-N 3.28Å
349	K	56	Low	71	Confident	201 Å²	201	84.1 Å²	84.1	87%	0.874	44%	0.435	S	S	*	.	S	Bend	trans	-85.2	-16.9	169.6	-74.8	-171.6	179	-179.4	0	114	Q347	Q347-K349 PolarHBondContact O-N 2.81Å
350	A	58.6	Low	70.7	Confident	80 Å²	80	83 Å²	83	66%	0.661	43%	0.433	S	S	*	.	S	Bend	trans	-125.6	112.5	177.3	0	0	0	0	0	109.7	K352	A350-K352 PolarHBondContact O-N 3.35Å; A350-K352 VanDerWaalsContact O-N 3.1Å
351	I	64.5	Low	70.7	Confident	70 Å²	70	81.8 Å²	81.8	36%	0.359	43%	0.429	S	S	.	.			trans	-68.7	105.7	165.4	-61	174.9	0	0	0	105.9	K304 L307	K304-I351 HydrophobicContact CB-CD1 3.95Å; K304-I351 HydrophobicContact CG-CD1 3.97Å; L307-I351 HydrophobicContact CD2-CD1 3.83Å; L307-I351 HydrophobicContact CD2-CG1 3.84Å
352	K	62.9	Low	70.6	Confident	105 Å²	105	84.3 Å²	84.3	46%	0.457	44%	0.44	S	S	.	.			trans	-60.8	138.5	172.7	-68.5	-175	-176.3	174.9	0	109.6	D317 A350 E356	D317-K352 IonicContact OD2-NZ 2.88Å; A350-K352 PolarHBondContact O-N 3.35Å; A350-K352 VanDerWaalsContact O-N 3.1Å; K352-E356 HydrophobicContact CB-CB 3.94Å; K352-E356 HydrophobicContact CD-CB 4.21Å; K352-E356 HydrophobicContact CG-CB 4.37Å
353	S	58.9	Low	70.5	Confident	59 Å²	59	76.2 Å²	76.2	41%	0.413	41%	0.411	S	S	.	.			trans	-66.5	162.1	173.4	75.1	0	0	0	0	110.5	N355 E356	S353-N355 PolarHBondContact O-N 3.01Å; S353-E356 PolarHBondContact O-N 3.2Å
354	E	58.2	Low	70.4	Confident	106 Å²	106	72.1 Å²	72.1	50%	0.495	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	-53.6	-28.2	175.8	-67.2	179.8	168	0	0	112.8	Y296 L300 E356 A357	Y296-E354 HydrophobicContact CE1-CG 4.3Å; L300-E354 HydrophobicContact CD1-CG 4.5Å; E354-E356 PolarHBondContact O-N 3.29Å; E354-A357 WeakPolarHBondContact O-CB 3.43Å; E354-A357 PolarHBondContact O-N 3.13Å
355	N	57.5	Low	70.7	Confident	150 Å²	150	71.4 Å²	71.4	80%	0.802	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	-69.1	-18.6	177.8	-63.8	-20.4	0	0	0	113.4	S353	S353-N355 PolarHBondContact O-N 3.01Å
356	E	65.1	Low	71.1	Confident	116 Å²	116	73.7 Å²	73.7	54%	0.542	40%	0.397	S	S	.	.	G	3₁₀ helix	trans	-107.9	19.3	178.7	-67.1	177.3	-175.7	0	0	111.7	K352 S353 E354	K352-E356 HydrophobicContact CB-CB 3.94Å; K352-E356 HydrophobicContact CD-CB 4.21Å; K352-E356 HydrophobicContact CG-CB 4.37Å; S353-E356 PolarHBondContact O-N 3.2Å; E354-E356 PolarHBondContact O-N 3.29Å
357	A	72	Confident	71.7	Confident	4 Å²	4	73.6 Å²	73.6	3%	0.033	39%	0.385	C	S	.	.			trans	-62.2	145.6	-179.2	0	0	0	0	0	111.9	Y296 E354 Y361 Q362	Y296-A357 HydrophobicContact CE1-CB 4.13Å; Y296-A357 HydrophobicContact CE2-CB 4.06Å; Y296-A357 WeakPolarHBondContact OH-CB 3.39Å; E354-A357 WeakPolarHBondContact O-CB 3.43Å; E354-A357 PolarHBondContact O-N 3.13Å; A357-Y361 HydrophobicContact CB-CD1 3.33Å; A357-Y361 HydrophobicContact CB-CE1 3.81Å; A357-Y361 HydrophobicContact CB-CG 4.21Å; A357-Q362 PolarHBondContact O-NE2 3.38Å
358	G	76.8	Confident	72.6	Confident	17 Å²	17	68 Å²	68	18%	0.175	36%	0.359	C	S	.	.			trans	-61.2	157.9	-175.1	0	0	0	0	0	114.4	D317 V360 Y361 Q362	D317-G358 WeakPolarHBondContact OD1-CA 3.27Å; D317-G358 PolarHBondContact OD1-N 3.33Å; G358-V360 PolarHBondContact O-N 3.19Å; G358-V360 VanDerWaalsContact O-N 3.14Å; G358-Y361 PolarHBondContact O-N 2.97Å; G358-Y361 VanDerWaalsContact O-N 3.11Å; G358-Q362 PolarHBondContact O-N 3.2Å; G358-Q362 VanDerWaalsContact O-N 3.16Å
359	I	80.4	Confident	73.8	Confident	115 Å²	115	73 Å²	73	59%	0.59	38%	0.376	S	S	*	.	H	α-helix	trans	-54.2	-37.6	-177	-60.5	169.8	0	0	0	111.8	Q362 T363	I359-Q362 PolarHBondContact O-N 3.43Å; I359-T363 WeakPolarHBondContact O-CB 3.35Å; I359-T363 PolarHBondContact O-N 3.11Å; I359-T363 PolarHBondContact O-OG1 2.84Å
360	V	81.7	Confident	75	Confident	58 Å²	58	65 Å²	65	35%	0.352	34%	0.342	S	S	.	.	H	α-helix	trans	-62.7	-48.1	-179.8	-178.2	0	0	0	0	111.1	F320 G358 T363 M364	F320-V360 HydrophobicContact CD1-CG1 4.41Å; F320-V360 HydrophobicContact CE1-CG1 4.2Å; G358-V360 PolarHBondContact O-N 3.19Å; G358-V360 VanDerWaalsContact O-N 3.14Å; V360-T363 PolarHBondContact O-N 2.98Å; V360-M364 HydrophobicContact CG1-SD 4.42Å; V360-M364 WeakPolarHBondContact O-CB 3.46Å; V360-M364 WeakPolarHBondContact O-CG 3.38Å; V360-M364 PolarHBondContact O-N 3.2Å
361	Y	85.9	Confident	75.9	Confident	24 Å²	24	68.6 Å²	68.6	9%	0.094	34%	0.339	C	S	.	.	H	α-helix	trans	-60.9	-48.2	176.8	166.4	-103.4	0	0	0	111.1	I292 D293 Y296 F320 A357 G358 T363 M364 L365	I292-Y361 HydrophobicContact CG2-CD2 3.71Å; I292-Y361 HydrophobicContact CG2-CE2 3.77Å; D293-Y361 PolarHBondContact OD1-OH 2.9Å; Y296-Y361 VanDerWaalsContact CB-CE2 3.49Å; Y296-Y361 HydrophobicContact CD1-CE2 4.39Å; Y296-Y361 HydrophobicContact CD2-CD1 4.39Å; Y296-Y361 AromaticContact CD2-CD2 3.66Å; Y296-Y361 HydrophobicContact CD2-CD2 3.66Å; Y296-Y361 HydrophobicContact CD2-CE2 4.23Å; Y296-Y361 AromaticContact CD2-CG 3.75Å; Y296-Y361 HydrophobicContact CD2-CG 3.75Å; Y296-Y361 HydrophobicContact CE2-CG 4.17Å; Y296-Y361 AromaticContact CG-CD2 3.71Å; Y296-Y361 HydrophobicContact CG-CD2 3.71Å; Y296-Y361 AromaticContact CG-CE2 3.79Å; Y296-Y361 HydrophobicContact CG-CE2 3.79Å; Y296-Y361 HydrophobicContact CG-CG 4.12Å; F320-Y361 HydrophobicContact CE1-CD2 4.45Å; F320-Y361 HydrophobicContact CE2-CD2 4.07Å; F320-Y361 HydrophobicContact CZ-CD2 4.01Å; A357-Y361 HydrophobicContact CB-CD1 3.33Å; A357-Y361 HydrophobicContact CB-CE1 3.81Å; A357-Y361 HydrophobicContact CB-CG 4.21Å; G358-Y361 PolarHBondContact O-N 2.97Å; G358-Y361 VanDerWaalsContact O-N 3.11Å; Y361-T363 VanDerWaalsContact C-N 3.34Å; Y361-T363 PolarHBondContact O-N 3.16Å; Y361-M364 PolarHBondContact O-N 3.09Å; Y361-L365 HydrophobicContact CE1-CD2 4.25Å; Y361-L365 VanDerWaalsContact O-CB 3.32Å; Y361-L365 WeakPolarHBondContact O-CB 3.37Å; Y361-L365 PolarHBondContact O-N 3.42Å
362	Q	86	Confident	76.5	Confident	92 Å²	92	69.2 Å²	69.2	43%	0.43	34%	0.343	S	S	.	.	H	α-helix	trans	-60.2	-44.5	179.2	-63.7	-174.8	11.1	0	0	111.8	A357 G358 I359 L365 I366	A357-Q362 PolarHBondContact O-NE2 3.38Å; G358-Q362 PolarHBondContact O-N 3.2Å; G358-Q362 VanDerWaalsContact O-N 3.16Å; I359-Q362 PolarHBondContact O-N 3.43Å; Q362-L365 PolarHBondContact O-N 3.08Å; Q362-I366 WeakPolarHBondContact O-CD1 3.22Å; Q362-I366 VanDerWaalsContact O-CG1 3.23Å; Q362-I366 WeakPolarHBondContact O-CG1 3.46Å; Q362-I366 PolarHBondContact O-N 3.4Å
363	T	83.7	Confident	77.1	Confident	21 Å²	21	69 Å²	69	13%	0.129	35%	0.346	C	S	.	.	H	α-helix	trans	-60.1	-50.5	178	-57.4	0	0	0	0	110.4	I359 V360 Y361 L365 I366 E367 L385	I359-T363 WeakPolarHBondContact O-CB 3.35Å; I359-T363 PolarHBondContact O-N 3.11Å; I359-T363 PolarHBondContact O-OG1 2.84Å; V360-T363 PolarHBondContact O-N 2.98Å; Y361-T363 VanDerWaalsContact C-N 3.34Å; Y361-T363 PolarHBondContact O-N 3.16Å; T363-L365 VanDerWaalsContact C-N 3.34Å; T363-L365 PolarHBondContact O-N 3.09Å; T363-I366 WeakPolarHBondContact O-CB 3.44Å; T363-I366 PolarHBondContact O-N 2.97Å; T363-E367 HydrophobicContact CG2-CG 4.44Å; T363-E367 WeakPolarHBondContact O-CG 3.49Å; T363-E367 PolarHBondContact O-N 2.95Å; T363-L385 HydrophobicContact CG2-CD2 4.27Å
364	M	85.2	Confident	77.3	Confident	34 Å²	34	75.4 Å²	75.4	17%	0.167	37%	0.367	C	S	.	.	H	α-helix	trans	-62.9	-39.1	179.2	-73.1	-171.5	83.5	0	0	113.3	I292 F320 V324 V360 Y361 I366 E367 Q368	I292-M364 HydrophobicContact CD1-CE 3.4Å; I292-M364 HydrophobicContact CD1-SD 4.23Å; I292-M364 HydrophobicContact CG1-CB 4.42Å; I292-M364 HydrophobicContact CG1-CE 4.33Å; I292-M364 HydrophobicContact CG2-CB 4.13Å; F320-M364 HydrophobicContact CE1-SD 3.61Å; F320-M364 HydrophobicContact CZ-SD 3.69Å; V324-M364 HydrophobicContact CB-CE 4.32Å; V324-M364 HydrophobicContact CB-SD 4.13Å; V324-M364 HydrophobicContact CG1-CE 3.37Å; V324-M364 HydrophobicContact CG1-SD 3.52Å; V324-M364 VanDerWaalsContact CG1-SD 3.52Å; V324-M364 HydrophobicContact CG2-CE 3.99Å; V324-M364 HydrophobicContact CG2-SD 3.82Å; V360-M364 HydrophobicContact CG1-SD 4.42Å; V360-M364 WeakPolarHBondContact O-CB 3.46Å; V360-M364 WeakPolarHBondContact O-CG 3.38Å; V360-M364 PolarHBondContact O-N 3.2Å; Y361-M364 PolarHBondContact O-N 3.09Å; M364-I366 VanDerWaalsContact C-N 3.3Å; M364-I366 PolarHBondContact O-N 2.8Å; M364-E367 PolarHBondContact O-N 2.67Å; M364-Q368 WeakPolarHBondContact O-CB 3.25Å; M364-Q368 PolarHBondContact O-N 3.21Å
365	L	85.1	Confident	77.5	Confident	24 Å²	24	78 Å²	78	13%	0.126	38%	0.384	C	S	.	.	H	α-helix	trans	-62.4	-41.3	176	-175.1	60.8	0	0	0	110.8	D293 Y361 Q362 T363 K369	D293-L365 WeakPolarHBondContact OD1-CD1 3.4Å; Y361-L365 HydrophobicContact CE1-CD2 4.25Å; Y361-L365 VanDerWaalsContact O-CB 3.32Å; Y361-L365 WeakPolarHBondContact O-CB 3.37Å; Y361-L365 PolarHBondContact O-N 3.42Å; Q362-L365 PolarHBondContact O-N 3.08Å; T363-L365 VanDerWaalsContact C-N 3.34Å; T363-L365 PolarHBondContact O-N 3.09Å; L365-K369 HydrophobicContact CG-CD 4.31Å; L365-K369 WeakPolarHBondContact O-CB 3.46Å; L365-K369 VanDerWaalsContact O-CG 3.29Å; L365-K369 WeakPolarHBondContact O-CG 3.38Å; L365-K369 PolarHBondContact O-N 2.78Å
366	I	83.4	Confident	77.7	Confident	72 Å²	72	73.1 Å²	73.1	37%	0.369	36%	0.36	S	S	.	.	H	α-helix	trans	-63.6	-48.2	173.2	-66.7	163.2	0	0	0	110.1	Q362 T363 M364 Q368 K369 L370 L385	Q362-I366 WeakPolarHBondContact O-CD1 3.22Å; Q362-I366 VanDerWaalsContact O-CG1 3.23Å; Q362-I366 WeakPolarHBondContact O-CG1 3.46Å; Q362-I366 PolarHBondContact O-N 3.4Å; T363-I366 WeakPolarHBondContact O-CB 3.44Å; T363-I366 PolarHBondContact O-N 2.97Å; M364-I366 VanDerWaalsContact C-N 3.3Å; M364-I366 PolarHBondContact O-N 2.8Å; I366-Q368 VanDerWaalsContact C-N 3.3Å; I366-Q368 PolarHBondContact O-N 2.96Å; I366-K369 PolarHBondContact O-N 2.85Å; I366-L370 HydrophobicContact CG2-CD1 3.79Å; I366-L370 HydrophobicContact CG2-CG 4.17Å; I366-L370 WeakPolarHBondContact O-CB 3.45Å; I366-L370 VanDerWaalsContact O-CG 3.27Å; I366-L370 WeakPolarHBondContact O-CG 3.46Å; I366-L370 PolarHBondContact O-N 2.8Å; I366-L385 HydrophobicContact CG2-CD2 4.4Å
367	E	82.7	Confident	77.6	Confident	44 Å²	44	74.3 Å²	74.3	21%	0.206	37%	0.365	C	S	.	.	H	α-helix	trans	-55.3	-47.3	177.7	-53.4	-152.7	171	0	0	111.4	T363 M364 L370 R371 L385	T363-E367 HydrophobicContact CG2-CG 4.44Å; T363-E367 WeakPolarHBondContact O-CG 3.49Å; T363-E367 PolarHBondContact O-N 2.95Å; M364-E367 PolarHBondContact O-N 2.67Å; E367-L370 PolarHBondContact O-N 2.82Å; E367-R371 VanDerWaalsContact O-CG 3.3Å; E367-R371 WeakPolarHBondContact O-CG 3.07Å; E367-R371 PolarHBondContact O-N 2.82Å; E367-R371 IonicContact OE2-NH2 2.95Å; E367-R371 PolarHBondContact OE2-NH2 3.19Å; E367-L385 HydrophobicContact CB-CD1 4.13Å; E367-L385 VanDerWaalsContact CD-CD1 3.4Å; E367-L385 HydrophobicContact CG-CD1 3.45Å; E367-L385 VanDerWaalsContact CG-CD1 3.45Å; E367-L385 HydrophobicContact CG-CD2 3.6Å; E367-L385 HydrophobicContact CG-CG 4.14Å; E367-L385 WeakPolarHBondContact OE1-CD1 3.25Å
368	Q	83.4	Confident	77.3	Confident	19 Å²	19	80 Å²	80	9%	0.089	39%	0.394	C	S	.	.	H	α-helix	trans	-66	-42.1	-178.2	-178.7	161.9	56.6	0	0	111.4	H288 P289 I292 M364 I366 R371 N372	H288-Q368 PolarHBondContact O-NE2 3.08Å; P289-Q368 WeakPolarHBondContact O-CG 3.48Å; P289-Q368 PolarHBondContact O-OE1 2.96Å; I292-Q368 VanDerWaalsContact CB-OE1 3.28Å; M364-Q368 WeakPolarHBondContact O-CB 3.25Å; M364-Q368 PolarHBondContact O-N 3.21Å; I366-Q368 VanDerWaalsContact C-N 3.3Å; I366-Q368 PolarHBondContact O-N 2.96Å; Q368-R371 PolarHBondContact O-N 3.46Å; Q368-N372 PolarHBondContact O-N 3.48Å; Q368-N372 PolarHBondContact O-ND2 2.98Å
369	K	82	Confident	76.8	Confident	123 Å²	123	82.9 Å²	82.9	54%	0.535	41%	0.412	S	S	.	.	H	α-helix	trans	-62.2	-44.9	174.4	-76.5	174.6	-179.5	173.1	0	111.2	L365 I366 R371 N372 L373	L365-K369 HydrophobicContact CG-CD 4.31Å; L365-K369 WeakPolarHBondContact O-CB 3.46Å; L365-K369 VanDerWaalsContact O-CG 3.29Å; L365-K369 WeakPolarHBondContact O-CG 3.38Å; L365-K369 PolarHBondContact O-N 2.78Å; I366-K369 PolarHBondContact O-N 2.85Å; K369-R371 PolarHBondContact O-N 3.13Å; K369-N372 PolarHBondContact O-N 3Å; K369-L373 WeakPolarHBondContact O-CG 3.42Å; K369-L373 PolarHBondContact O-N 2.78Å
370	L	81.1	Confident	76.2	Confident	31 Å²	31	80.9 Å²	80.9	16%	0.162	40%	0.403	C	S	.	.	H	α-helix	trans	-61.3	-43.7	178.6	-71.8	175.3	0	0	0	112.3	I366 E367 N372 L373 V381 L384	I366-L370 HydrophobicContact CG2-CD1 3.79Å; I366-L370 HydrophobicContact CG2-CG 4.17Å; I366-L370 WeakPolarHBondContact O-CB 3.45Å; I366-L370 VanDerWaalsContact O-CG 3.27Å; I366-L370 WeakPolarHBondContact O-CG 3.46Å; I366-L370 PolarHBondContact O-N 2.8Å; E367-L370 PolarHBondContact O-N 2.82Å; L370-N372 VanDerWaalsContact C-N 3.26Å; L370-N372 PolarHBondContact O-N 3.49Å; L370-L373 HydrophobicContact CD2-CD1 4.16Å; L370-L373 PolarHBondContact O-N 3.32Å; L370-V381 HydrophobicContact CB-CG1 3.94Å; L370-V381 HydrophobicContact CB-CG2 4.09Å; L370-V381 HydrophobicContact CD1-CG1 4.1Å; L370-L384 HydrophobicContact CD1-CB 4.42Å; L370-L384 HydrophobicContact CD1-CD1 4.35Å; L370-L384 HydrophobicContact CD2-CD1 4.27Å
371	R	78.3	Confident	75.6	Confident	156 Å²	156	78.4 Å²	78.4	59%	0.589	39%	0.388	S	S	*	.	H	α-helix	trans	-64	-29.9	176.8	-70.6	175.1	-162.6	-135.8	10.2	113.3	E367 Q368 K369	E367-R371 VanDerWaalsContact O-CG 3.3Å; E367-R371 WeakPolarHBondContact O-CG 3.07Å; E367-R371 PolarHBondContact O-N 2.82Å; E367-R371 IonicContact OE2-NH2 2.95Å; E367-R371 PolarHBondContact OE2-NH2 3.19Å; Q368-R371 PolarHBondContact O-N 3.46Å; K369-R371 PolarHBondContact O-N 3.13Å
372	N	75.8	Confident	74.8	Confident	84 Å²	84	80.5 Å²	80.5	45%	0.449	41%	0.41	S	S	.	.	H	α-helix	trans	-84.9	-12.1	179.8	-73.9	-50.1	0	0	0	113.7	P289 Q368 K369 L370 K374	P289-N372 WeakPolarHBondContact CA-ND2 3.18Å; P289-N372 WeakPolarHBondContact CB-ND2 3.19Å; Q368-N372 PolarHBondContact O-N 3.48Å; Q368-N372 PolarHBondContact O-ND2 2.98Å; K369-N372 PolarHBondContact O-N 3Å; L370-N372 VanDerWaalsContact C-N 3.26Å; L370-N372 PolarHBondContact O-N 3.49Å; N372-K374 PolarHBondContact O-N 3.25Å
373	L	75.4	Confident	74.1	Confident	101 Å²	101	82.4 Å²	82.4	53%	0.529	42%	0.419	S	S	.	.	S	Bend	trans	-69.8	125.9	174.3	-72	171.5	0	0	0	110.1	K369 L370 N375 V376	K369-L373 WeakPolarHBondContact O-CG 3.42Å; K369-L373 PolarHBondContact O-N 2.78Å; L370-L373 HydrophobicContact CD2-CD1 4.16Å; L370-L373 PolarHBondContact O-N 3.32Å; L373-N375 PolarHBondContact O-N 2.77Å; L373-V376 HydrophobicContact CB-CG2 3.81Å; L373-V376 HydrophobicContact CD1-CG2 4.41Å
374	K	63.8	Low	73.4	Confident	192 Å²	192	85 Å²	85	84%	0.835	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	132.2	170.5	-65.3	179.9	-179	175.9	0	108.4	N372	N372-K374 PolarHBondContact O-N 3.25Å
375	N	62.6	Low	72.6	Confident	162 Å²	162	84 Å²	84	87%	0.866	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.9	11.5	176.2	-45.4	-30.3	0	0	0	117.3	L373	L373-N375 PolarHBondContact O-N 2.77Å
376	V	61.9	Low	71.6	Confident	47 Å²	47	84.2 Å²	84.2	29%	0.285	44%	0.435	S	S	.	.			trans	-98	119.2	169.1	-170.5	0	0	0	0	108.7	L373 N380 V381	L373-V376 HydrophobicContact CB-CG2 3.81Å; L373-V376 HydrophobicContact CD1-CG2 4.41Å; V376-N380 HydrophobicContact CG1-CB 4.03Å; V376-V381 HydrophobicContact CB-CG2 4.48Å; V376-V381 HydrophobicContact CG1-CG2 3.52Å
377	H	62.6	Low	70.6	Confident	141 Å²	141	85.3 Å²	85.3	65%	0.653	44%	0.439	S	S	*	.			trans	-75.4	145.4	170.5	-86.8	-70	0	0	0	110	S379 N380 V381	H377-S379 PolarHBondContact O-N 2.84Å; H377-N380 WeakPolarHBondContact O-CB 3.34Å; H377-N380 PolarHBondContact O-N 3.04Å; H377-V381 PolarHBondContact O-N 3.21Å
378	D	66	Low	69.6	Low	122 Å²	122	85.5 Å²	85.5	65%	0.652	44%	0.443	S	S	*	.	H	α-helix	trans	-52.7	-31	179.7	-69.1	-29.9	0	0	0	113.1	N380 V381 A382	D378-N380 VanDerWaalsContact C-N 3.32Å; D378-N380 PolarHBondContact O-N 2.83Å; D378-V381 PolarHBondContact O-N 2.88Å; D378-A382 PolarHBondContact O-N 3.23Å
379	S	65.7	Low	68.5	Low	79 Å²	79	90.4 Å²	90.4	55%	0.552	46%	0.464	S	S	*	.	H	α-helix	trans	-58.8	-42.4	174.2	52.4	0	0	0	0	112.7	H377 V381 A382 E383	H377-S379 PolarHBondContact O-N 2.84Å; S379-V381 VanDerWaalsContact C-N 3.33Å; S379-A382 PolarHBondContact O-N 2.98Å; S379-E383 PolarHBondContact O-N 2.89Å
380	N	68.4	Low	67.1	Low	73 Å²	73	89.7 Å²	89.7	39%	0.39	47%	0.466	S	S	.	.	H	α-helix	trans	-73.4	-32.2	-176.8	-57.5	3.6	0	0	0	110.4	V376 H377 D378 E383 L384	V376-N380 HydrophobicContact CG1-CB 4.03Å; H377-N380 WeakPolarHBondContact O-CB 3.34Å; H377-N380 PolarHBondContact O-N 3.04Å; D378-N380 VanDerWaalsContact C-N 3.32Å; D378-N380 PolarHBondContact O-N 2.83Å; N380-E383 PolarHBondContact O-N 2.94Å; N380-L384 WeakPolarHBondContact O-CB 3.5Å; N380-L384 VanDerWaalsContact O-CG 3.23Å; N380-L384 WeakPolarHBondContact O-CG 3.38Å; N380-L384 PolarHBondContact O-N 2.89Å
381	V	68	Low	65.8	Low	6 Å²	6	96.8 Å²	96.8	4%	0.036	49%	0.49	C	S	.	.	H	α-helix	trans	-64.2	-46.3	175.4	-176.1	0	0	0	0	110.2	L370 V376 H377 D378 S379 E383 L384 L385	L370-V381 HydrophobicContact CB-CG1 3.94Å; L370-V381 HydrophobicContact CB-CG2 4.09Å; L370-V381 HydrophobicContact CD1-CG1 4.1Å; V376-V381 HydrophobicContact CB-CG2 4.48Å; V376-V381 HydrophobicContact CG1-CG2 3.52Å; H377-V381 PolarHBondContact O-N 3.21Å; D378-V381 PolarHBondContact O-N 2.88Å; S379-V381 VanDerWaalsContact C-N 3.33Å; V381-E383 VanDerWaalsContact C-N 3.33Å; V381-E383 PolarHBondContact O-N 3.41Å; V381-L384 PolarHBondContact O-N 2.96Å; V381-L385 HydrophobicContact CG1-CD1 3.66Å; V381-L385 HydrophobicContact CG1-CG 4.34Å; V381-L385 WeakPolarHBondContact O-CB 3.46Å; V381-L385 WeakPolarHBondContact O-CD1 3.33Å; V381-L385 WeakPolarHBondContact O-CG 3.43Å; V381-L385 PolarHBondContact O-N 3.37Å
382	A	70.3	Confident	64.4	Low	68 Å²	68	93.3 Å²	93.3	56%	0.562	48%	0.483	S	S	*	.	H	α-helix	trans	-62.3	-39.4	178.9	0	0	0	0	0	112.6	D378 S379 G386	D378-A382 PolarHBondContact O-N 3.23Å; S379-A382 PolarHBondContact O-N 2.98Å; A382-G386 PolarHBondContact O-N 3.31Å
383	E	71.3	Confident	62.9	Low	131 Å²	131	95 Å²	95	61%	0.612	49%	0.491	S	S	*	.	H	α-helix	trans	-63.6	-51.3	175.9	-173.1	173.7	-166.1	0	0	111.5	S379 N380 V381 L385 G386 E387	S379-E383 PolarHBondContact O-N 2.89Å; N380-E383 PolarHBondContact O-N 2.94Å; V381-E383 VanDerWaalsContact C-N 3.33Å; V381-E383 PolarHBondContact O-N 3.41Å; E383-L385 VanDerWaalsContact C-N 3.28Å; E383-L385 PolarHBondContact O-N 2.91Å; E383-G386 PolarHBondContact O-N 2.95Å; E383-G386 VanDerWaalsContact O-N 3.09Å; E383-E387 PolarHBondContact O-N 3.25Å; E383-E387 VanDerWaalsContact O-N 3.13Å
384	L	67.9	Low	60.8	Low	75 Å²	75	100 Å²	100	39%	0.393	50%	0.503	S	S	.	.	H	α-helix	trans	-58.8	-38.8	177.7	-71.9	170.6	0	0	0	112.4	L370 N380 V381 E387 V388	L370-L384 HydrophobicContact CD1-CB 4.42Å; L370-L384 HydrophobicContact CD1-CD1 4.35Å; L370-L384 HydrophobicContact CD2-CD1 4.27Å; N380-L384 WeakPolarHBondContact O-CB 3.5Å; N380-L384 VanDerWaalsContact O-CG 3.23Å; N380-L384 WeakPolarHBondContact O-CG 3.38Å; N380-L384 PolarHBondContact O-N 2.89Å; V381-L384 PolarHBondContact O-N 2.96Å; L384-E387 PolarHBondContact O-N 3.24Å; L384-V388 WeakPolarHBondContact O-CG2 3.3Å; L384-V388 PolarHBondContact O-N 3.35Å
385	L	67.9	Low	59.4	Low	13 Å²	13	92.3 Å²	92.3	7%	0.068	48%	0.478	C	S	.	.	H	α-helix	trans	-72.6	-31.6	177.7	-68.9	166	0	0	0	113	T363 I366 E367 V381 E383 E387 V388 K389	T363-L385 HydrophobicContact CG2-CD2 4.27Å; I366-L385 HydrophobicContact CG2-CD2 4.4Å; E367-L385 HydrophobicContact CB-CD1 4.13Å; E367-L385 VanDerWaalsContact CD-CD1 3.4Å; E367-L385 HydrophobicContact CG-CD1 3.45Å; E367-L385 VanDerWaalsContact CG-CD1 3.45Å; E367-L385 HydrophobicContact CG-CD2 3.6Å; E367-L385 HydrophobicContact CG-CG 4.14Å; E367-L385 WeakPolarHBondContact OE1-CD1 3.25Å; V381-L385 HydrophobicContact CG1-CD1 3.66Å; V381-L385 HydrophobicContact CG1-CG 4.34Å; V381-L385 WeakPolarHBondContact O-CB 3.46Å; V381-L385 WeakPolarHBondContact O-CD1 3.33Å; V381-L385 WeakPolarHBondContact O-CG 3.43Å; V381-L385 PolarHBondContact O-N 3.37Å; E383-L385 VanDerWaalsContact C-N 3.28Å; E383-L385 PolarHBondContact O-N 2.91Å; L385-E387 VanDerWaalsContact C-N 3.28Å; L385-V388 PolarHBondContact O-N 2.74Å; L385-K389 WeakPolarHBondContact O-CG 3.34Å; L385-K389 PolarHBondContact O-N 3.46Å; L385-K389 VanDerWaalsContact O-N 3.12Å
386	G	66	Low	58.1	Low	29 Å²	29	88.7 Å²	88.7	30%	0.299	47%	0.471	S	S	.	.	H	α-helix	trans	-60.8	-39.3	170.4	0	0	0	0	0	111.8	A382 E383 N390	A382-G386 PolarHBondContact O-N 3.31Å; E383-G386 PolarHBondContact O-N 2.95Å; E383-G386 VanDerWaalsContact O-N 3.09Å; G386-N390 WeakPolarHBondContact O-CB 3.47Å; G386-N390 VanDerWaalsContact O-CG 3.26Å; G386-N390 PolarHBondContact O-N 2.96Å; G386-N390 PolarHBondContact O-ND2 3.49Å
387	E	61.9	Low	56.7	Low	96 Å²	96	93.2 Å²	93.2	45%	0.449	49%	0.493	S	S	.	.	H	α-helix	trans	-66.5	-41.7	176.8	-65.3	-170.8	165.8	0	0	112.9	E383 L384 L385 N390 R391	E383-E387 PolarHBondContact O-N 3.25Å; E383-E387 VanDerWaalsContact O-N 3.13Å; L384-E387 PolarHBondContact O-N 3.24Å; L385-E387 VanDerWaalsContact C-N 3.28Å; E387-N390 PolarHBondContact O-N 3.25Å; E387-R391 WeakPolarHBondContact O-CG 3.43Å; E387-R391 PolarHBondContact O-N 2.87Å
388	V	61.3	Low	55.3	Low	48 Å²	48	94.3 Å²	94.3	29%	0.291	50%	0.499	S	S	.	.	H	α-helix	trans	-62.8	-49.1	178.4	176.7	0	0	0	0	110.6	L384 L385 N390 R391 D392	L384-V388 WeakPolarHBondContact O-CG2 3.3Å; L384-V388 PolarHBondContact O-N 3.35Å; L385-V388 PolarHBondContact O-N 2.74Å; V388-N390 PolarHBondContact O-N 3.12Å; V388-R391 PolarHBondContact O-N 2.78Å; V388-D392 PolarHBondContact O-N 3.34Å
389	K	60.4	Low	53.7	Low	121 Å²	121	95.4 Å²	95.4	53%	0.526	50%	0.503	S	S	.	.	H	α-helix	trans	-59	-34.1	177.7	-70.9	179	-177.7	179.1	0	112.6	L385 I393	L385-K389 WeakPolarHBondContact O-CG 3.34Å; L385-K389 PolarHBondContact O-N 3.46Å; L385-K389 VanDerWaalsContact O-N 3.12Å; K389-I393 WeakPolarHBondContact O-CD1 3.33Å; K389-I393 WeakPolarHBondContact O-CG1 3.5Å
390	N	52.4	Low	51.9	Low	108 Å²	108	94.8 Å²	94.8	58%	0.578	51%	0.509	S	S	*	.	H	α-helix	trans	-79.4	-28.7	-179.8	-74.9	-34.4	0	0	0	113.9	G386 E387 V388	G386-N390 WeakPolarHBondContact O-CB 3.47Å; G386-N390 VanDerWaalsContact O-CG 3.26Å; G386-N390 PolarHBondContact O-N 2.96Å; G386-N390 PolarHBondContact O-ND2 3.49Å; E387-N390 PolarHBondContact O-N 3.25Å; V388-N390 PolarHBondContact O-N 3.12Å
391	R	53	Low	50	Low	180 Å²	180	99.3 Å²	99.3	68%	0.679	53%	0.532	S	S	*	.	H	α-helix	trans	-74.3	-37.8	178.7	-77.6	-176.3	-177.9	174.3	5.5	112.3	E387 V388 I393 R394 G395	E387-R391 WeakPolarHBondContact O-CG 3.43Å; E387-R391 PolarHBondContact O-N 2.87Å; V388-R391 PolarHBondContact O-N 2.78Å; R391-I393 PolarHBondContact O-N 3.19Å; R391-R394 PolarHBondContact O-N 2.55Å; R391-R394 VanDerWaalsContact O-N 3.14Å; R391-G395 PolarHBondContact O-N 3Å
392	D	49	Very low	48.1	Very low	83 Å²	83	104.1 Å²	104.1	44%	0.444	57%	0.566	S	S	.	*	H	α-helix	trans	-75.3	-26.6	-177	-66.2	-23.9	0	0	0	113.1	V388 R394 G395 A396	V388-D392 PolarHBondContact O-N 3.34Å; D392-R394 PolarHBondContact O-N 2.9Å; D392-G395 PolarHBondContact O-N 2.89Å; D392-A396 WeakPolarHBondContact O-CB 3.35Å; D392-A396 PolarHBondContact O-N 3Å
393	I	44.8	Very low	46	Very low	121 Å²	121	105.2 Å²	105.2	62%	0.621	57%	0.57	S	S	*	*	H	α-helix	trans	-65.5	-27.7	170.6	-62.8	168	0	0	0	111.3	K389 R391	K389-I393 WeakPolarHBondContact O-CD1 3.33Å; K389-I393 WeakPolarHBondContact O-CG1 3.5Å; R391-I393 PolarHBondContact O-N 3.19Å
394	R	32.5	Very low	44	Very low	206 Å²	206	108.6 Å²	108.6	78%	0.777	58%	0.583	S	S	*	*	H	α-helix	trans	-86.9	-37.3	174.7	-68.9	-175	-178.9	-167.7	0.2	112.3	R391 D392	R391-R394 PolarHBondContact O-N 2.55Å; R391-R394 VanDerWaalsContact O-N 3.14Å; D392-R394 PolarHBondContact O-N 2.9Å
395	G	33.7	Very low	42.3	Very low	29 Å²	29	111.7 Å²	111.7	30%	0.299	60%	0.6	S	S	.	*	H	α-helix	trans	-70.3	-30.1	179.4	0	0	0	0	0	114.7	R391 D392 N397 E398 I399	R391-G395 PolarHBondContact O-N 3Å; D392-G395 PolarHBondContact O-N 2.89Å; G395-N397 PolarHBondContact O-N 3.37Å; G395-E398 PolarHBondContact O-N 3.06Å; G395-I399 VanDerWaalsContact O-CD1 3.3Å; G395-I399 WeakPolarHBondContact O-CD1 3.35Å
396	A	35.8	Very low	40.6	Very low	87 Å²	87	119.3 Å²	119.3	72%	0.719	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	-14.5	179.6	0	0	0	0	0	114.3	D392	D392-A396 WeakPolarHBondContact O-CB 3.35Å; D392-A396 PolarHBondContact O-N 3Å
397	N	31.4	Very low	39	Very low	142 Å²	142	127 Å²	127	76%	0.759	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.6	-6	177.5	-77	-24.8	0	0	0	113.8	G395	G395-N397 PolarHBondContact O-N 3.37Å
398	E	33.4	Very low	37.6	Very low	163 Å²	163	125.9 Å²	125.9	76%	0.762	68%	0.678	S	S	*	*	S	Bend	trans	-144.3	50.4	-171.8	-70.1	-172.6	161.3	0	0	113.4	G395	G395-E398 PolarHBondContact O-N 3.06Å
399	I	31.7	Very low	36.2	Very low	146 Å²	146	129.6 Å²	129.6	75%	0.749	71%	0.705	S	S	*	*			trans	-136.9	89.2	154.6	-66	92.8	0	0	0	109.4	G395	G395-I399 VanDerWaalsContact O-CD1 3.3Å; G395-I399 WeakPolarHBondContact O-CD1 3.35Å
400	G	29.4	Very low	34.6	Very low	66 Å²	66	129.3 Å²	129.3	68%	0.68	72%	0.719	S	S	*	*			trans	-93.3	135.9	147.9	0	0	0	0	0	108.8
401	L	27.4	Very low	33.7	Very low	167 Å²	167	130.2 Å²	130.2	87%	0.874	73%	0.731	S	S	*	*			trans	22	109.2	158.7	-84.3	73.1	0	0	0	117.5
402	S	28.7	Very low	32.5	Very low	107 Å²	107	127.1 Å²	127.1	75%	0.748	74%	0.737	S	S	*	*				178.7	131	116.7	37.5	0	0	0	0	111.8
403	S	25.9	Very low	31.7	Very low	92 Å²	92	128.7 Å²	128.7	64%	0.643	75%	0.754	S	S	*	*			trans	-32.7	140.9	159.3	48.5	0	0	0	0	114.7
404	F	29.6	Very low	31	Very low	201 Å²	201	127.8 Å²	127.8	88%	0.882	76%	0.758	S	S	*	*			trans	-159.2	136.1	135.6	-92.3	-68.5	0	0	0	110.8
405	D	31.3	Very low	30.8	Very low	140 Å²	140	123.8 Å²	123.8	75%	0.749	76%	0.762	S	S	*	*			trans	-79.1	166.7	-169.9	-61.4	-66.7	0	0	0	115
406	E	33.6	Very low	30.6	Very low	174 Å²	174	125.9 Å²	125.9	81%	0.813	78%	0.783	S	S	*	*			trans	29.4	128	149.1	-65.6	-165.8	144.9	0	0	121.4
407	E	32.7	Very low	30.2	Very low	191 Å²	191	130.7 Å²	130.7	89%	0.893	79%	0.791	S	S	*	*				168.8	146.1	102	-88.4	-158.5	-179.7	0	0	111.4
408	G	32.4	Very low	30.1	Very low	72 Å²	72	135.2 Å²	135.2	74%	0.742	80%	0.798	S	S	*	*			trans	130.5	83.5	146.2	0	0	0	0	0	119.6
409	S	31.8	Very low	29.7	Very low	125 Å²	125	133.5 Å²	133.5	87%	0.874	80%	0.798	S	S	*	*			trans	56.3	114.4	136.2	-78.9	0	0	0	0	122.7
410	S	27	Very low	29.8	Very low	115 Å²	115	131.3 Å²	131.3	80%	0.804	80%	0.796	S	S	*	*			trans	-74.5	163.9	153.1	27.2	0	0	0	0	112.9
411	P	33.6	Very low	29.7	Very low	128 Å²	128	134 Å²	134	83%	0.831	81%	0.805	S	S	*	*			trans	-129.6	143.7	135.2	23.7	-6.3	0	0	0	113.6
412	S	26.9	Very low	30	Very low	115 Å²	115	130.3 Å²	130.3	80%	0.804	79%	0.793	S	S	*	*			trans	-78	150.6	-179.8	47.5	0	0	0	0	113.8
413	S	33.2	Very low	30	Very low	116 Å²	116	133.1 Å²	133.1	81%	0.811	80%	0.799	S	S	*	*			trans	162.6	142.4	150.5	45.2	0	0	0	0	107.3
414	S	30	Very low	30.4	Very low	101 Å²	101	135.3 Å²	135.3	71%	0.706	80%	0.803	S	S	*	*			cis	-165.6	136.3	-3.2	46.4	0	0	0	0	106.8
415	S	28.4	Very low	30.3	Very low	122 Å²	122	132.7 Å²	132.7	85%	0.853	80%	0.803	S	S	*	*			trans	29.6	119.9	146.4	62.9	0	0	0	0	120
416	G	29	Very low	30.3	Very low	73 Å²	73	131.4 Å²	131.4	75%	0.753	80%	0.801	S	S	*	*			trans	-167.4	53.7	162.4	0	0	0	0	0	113.4	R418	G416-R418 PolarHBondContact O-N 2.93Å
417	Q	27.8	Very low	30.1	Very low	189 Å²	189	130 Å²	130	88%	0.883	80%	0.799	S	S	*	*			trans	-55.8	119	164	-88.7	178.2	-34	0	0	109.2
418	R	29.5	Very low	30.1	Very low	237 Å²	237	125.8 Å²	125.8	89%	0.894	79%	0.79	S	S	*	*			trans	-127.7	88.1	155.6	-75.1	-168	178.4	-156.5	0.5	108.9	G416	G416-R418 PolarHBondContact O-N 2.93Å
419	T	25	Very low	29.9	Very low	127 Å²	127	125.4 Å²	125.4	78%	0.779	78%	0.777	S	S	*	*			trans	-61.7	118.5	148.5	49.8	0	0	0	0	108
420	S	32.5	Very low	29.8	Very low	99 Å²	99	125.5 Å²	125.5	69%	0.692	77%	0.772	S	S	*	*			trans	-142.4	82.2	158.1	67.9	0	0	0	0	109.2	S422	S420-S422 PolarHBondContact O-N 3.2Å
421	S	28.1	Very low	30.2	Very low	124 Å²	124	124.6 Å²	124.6	87%	0.867	76%	0.755	S	S	*	*			trans	-57.4	112.8	146	49.6	0	0	0	0	108.1
422	S	33.4	Very low	30.1	Very low	89 Å²	89	126.2 Å²	126.2	62%	0.622	75%	0.752	S	S	*	*			trans	-134	90.1	164.3	63.1	0	0	0	0	108.6	S420 L424	S420-S422 PolarHBondContact O-N 3.2Å; S422-L424 PolarHBondContact O-N 3.4Å
423	D	28.4	Very low	30.3	Very low	166 Å²	166	127.2 Å²	127.2	89%	0.888	74%	0.744	S	S	*	*			trans	-54.1	107.8	149.8	-82.9	-36.9	0	0	0	108
424	L	33.8	Very low	30.4	Very low	138 Å²	138	126.3 Å²	126.3	72%	0.723	74%	0.737	S	S	*	*			trans	-140.4	94.8	165.6	-73.3	178.3	0	0	0	109.3	S422 T426	S422-L424 PolarHBondContact O-N 3.4Å; L424-T426 PolarHBondContact O-N 2.87Å
425	T	28.9	Very low	30.5	Very low	145 Å²	145	128 Å²	128	89%	0.89	73%	0.734	S	S	*	*			trans	-58.1	111.6	149.8	45.7	0	0	0	0	107.6
426	T	31.4	Very low	30.6	Very low	114 Å²	114	125.9 Å²	125.9	70%	0.699	72%	0.724	S	S	*	*			trans	-138.6	96.4	166.1	-53.3	0	0	0	0	108.9	L424 S428	L424-T426 PolarHBondContact O-N 2.87Å; T426-S428 PolarHBondContact O-N 2.85Å
427	D	28.2	Very low	30.8	Very low	144 Å²	144	126.8 Å²	126.8	77%	0.77	72%	0.719	S	S	*	*			trans	-61.6	108.6	162.6	-175	7.3	0	0	0	108.7
428	S	32.6	Very low	31.1	Very low	102 Å²	102	121.7 Å²	121.7	71%	0.713	70%	0.704	S	S	*	*			trans	-137.6	96.7	161.6	-170.1	0	0	0	0	108.2	T426 T430	T426-S428 PolarHBondContact O-N 2.85Å; S428-T430 PolarHBondContact O-N 3.12Å
429	S	29.4	Very low	31.5	Very low	65 Å²	65	113.3 Å²	113.3	46%	0.455	68%	0.679	S	S	.	*			trans	-78	101.4	176.9	46.3	0	0	0	0	110.8	K89	K89-S429 PolarHBondContact NZ-OG 3.44Å
430	T	29.6	Very low	32	Very low	127 Å²	127	112.6 Å²	112.6	78%	0.779	67%	0.667	S	S	*	*			trans	-143.9	89.7	154.1	25	0	0	0	0	107.6	S428 E432	S428-T430 PolarHBondContact O-N 3.12Å; T430-E432 PolarHBondContact O-N 3.26Å
431	E	33.7	Very low	32	Very low	95 Å²	95	110.4 Å²	110.4	44%	0.444	66%	0.66	S	S	.	*			trans	-85.7	103.4	174.4	-70.2	-124.1	-168.5	0	0	108.5	R104 R178 E433	R104-E431 IonicContact CZ-OE2 2.74Å; R104-E431 VanDerWaalsContact CZ-OE2 3.27Å; R104-E431 IonicContact NH1-OE1 2.91Å; R104-E431 PolarHBondContact NH1-OE1 3.4Å; R104-E431 IonicContact NH1-OE2 3.67Å; R104-E431 PolarHBondContact NH1-OE2 2.9Å; R104-E431 IonicContact NH2-OE2 3.9Å; R104-E431 PolarHBondContact NH2-OE2 3.38Å; R178-E431 IonicContact CZ-OE1 2.96Å; R178-E431 IonicContact NH1-OE1 3.27Å; R178-E431 PolarHBondContact NH1-OE1 3.09Å; E431-E433 PolarHBondContact O-N 2.99Å
432	E	32.5	Very low	32.1	Very low	162 Å²	162	112 Å²	112	76%	0.757	65%	0.654	S	S	*	*			trans	-69.9	115.9	159.9	-72	-166	168.4	0	0	108.5	T430 S434	T430-E432 PolarHBondContact O-N 3.26Å; E432-S434 VanDerWaalsContact C-N 3.34Å; E432-S434 PolarHBondContact O-N 3.42Å
433	E	31.4	Very low	31.8	Very low	136 Å²	136	114.7 Å²	114.7	64%	0.636	67%	0.666	S	S	*	*			trans	-70.8	87.3	171.8	-69.3	-142	152.4	0	0	110.4	E431 E435	E431-E433 PolarHBondContact O-N 2.99Å; E433-E435 PolarHBondContact O-N 2.87Å
434	S	34.2	Very low	31.8	Very low	97 Å²	97	113.7 Å²	113.7	68%	0.678	66%	0.656	S	S	*	*			trans	-82.3	100.2	154.4	62	0	0	0	0	107.6	E432 A436	E432-S434 VanDerWaalsContact C-N 3.34Å; E432-S434 PolarHBondContact O-N 3.42Å; S434-A436 PolarHBondContact O-N 2.93Å
435	E	32.4	Very low	31.3	Very low	136 Å²	136	111.1 Å²	111.1	64%	0.636	66%	0.663	S	S	*	*			trans	-51.3	107.9	168.1	-78.8	-169.7	-146.1	0	0	109.2	E433 S437 K505	E433-E435 PolarHBondContact O-N 2.87Å; E435-S437 PolarHBondContact O-N 3.26Å; E435-S437 VanDerWaalsContact O-N 3.14Å; E435-K505 IonicContact OE1-NZ 3.4Å; E435-K505 PolarHBondContact OE1-NZ 2.85Å
436	A	31.1	Very low	31.3	Very low	78 Å²	78	110.4 Å²	110.4	65%	0.645	66%	0.659	S	S	*	*			trans	-59.7	115.6	165.3	0	0	0	0	0	106.3	S434 S438	S434-A436 PolarHBondContact O-N 2.93Å; A436-S438 PolarHBondContact O-N 3.01Å
437	S	33.4	Very low	31.1	Very low	93 Å²	93	113.4 Å²	113.4	65%	0.65	67%	0.665	S	S	*	*			trans	-52	108.4	170.4	59.4	0	0	0	0	107.8	E435 V439	E435-S437 PolarHBondContact O-N 3.26Å; E435-S437 VanDerWaalsContact O-N 3.14Å; S437-V439 PolarHBondContact O-N 2.87Å
438	S	33.9	Very low	31.3	Very low	81 Å²	81	118.3 Å²	118.3	57%	0.566	67%	0.672	S	S	*	*				56.7	13.7	82.8	96.5	0	0	0	0	117.6	A436 E440	A436-S438 PolarHBondContact O-N 3.01Å; S438-E440 PolarHBondContact O-N 2.77Å
439	V	38	Very low	31.3	Very low	62 Å²	62	124.9 Å²	124.9	38%	0.376	68%	0.681	S	S	.	*			trans	-76	99.1	177.4	-171.6	0	0	0	0	106.5	Y189 R209 S437	Y189-V439 HydrophobicContact CE1-CB 4.41Å; Y189-V439 HydrophobicContact CE1-CG1 3.99Å; R209-V439 PolarHBondContact NH1-O 3.18Å; R209-V439 VanDerWaalsContact NH1-O 3.16Å; S437-V439 PolarHBondContact O-N 2.87Å
440	E	36	Very low	31.4	Very low	112 Å²	112	123.8 Å²	123.8	52%	0.523	68%	0.68	S	S	.	*	B	Isolated β-bridge	trans	-99.3	124	162.1	-61.7	-154.6	176.7	0	0	107.4	H117 R209 S438 E442	H117-E440 IonicContact CE1-OE1 2.83Å; H117-E440 PolarHBondContact CE1-OE1 2.81Å; H117-E440 IonicContact NE2-OE1 3.96Å; R209-E440 IonicContact CZ-OE1 3.98Å; R209-E440 IonicContact NH2-OE1 2.67Å; R209-E440 PolarHBondContact NH2-OE1 3.26Å; S438-E440 PolarHBondContact O-N 2.77Å; E440-E442 VanDerWaalsContact C-N 3.26Å; E440-E442 PolarHBondContact O-N 2.81Å; E440-E442 VanDerWaalsContact O-N 3.14Å
441	G	31.2	Very low	31.6	Very low	53 Å²	53	123.7 Å²	123.7	55%	0.546	68%	0.682	S	S	.	*			trans	-83.6	66.2	178.1	0	0	0	0	0	110.9	V443	G441-V443 PolarHBondContact O-N 3.3Å
442	E	29.8	Very low	31.8	Very low	158 Å²	158	123.3 Å²	123.3	74%	0.738	70%	0.695	S	S	*	*			trans	-78.2	108.1	152.9	-86.3	-164.7	149.3	0	0	107.7	E440 Q444	E440-E442 VanDerWaalsContact C-N 3.26Å; E440-E442 PolarHBondContact O-N 2.81Å; E440-E442 VanDerWaalsContact O-N 3.14Å; E442-Q444 PolarHBondContact O-N 3.4Å
443	V	28.7	Very low	32.1	Very low	144 Å²	144	124.5 Å²	124.5	87%	0.873	70%	0.698	S	S	*	*			trans	-71.7	70.9	165	-175.1	0	0	0	0	107.6	G441	G441-V443 PolarHBondContact O-N 3.3Å
444	Q	27.7	Very low	32.5	Very low	145 Å²	145	123.7 Å²	123.7	68%	0.678	70%	0.702	S	S	*	*	S	Bend	trans	-124	126.1	157.5	-76.9	-170.6	6.7	0	0	107.2	E442 T446	E442-Q444 PolarHBondContact O-N 3.4Å; Q444-T446 VanDerWaalsContact C-N 3.33Å; Q444-T446 PolarHBondContact O-N 3.3Å
445	G	23.5	Very low	33.2	Very low	84 Å²	84	123.4 Å²	123.4	87%	0.866	70%	0.696	S	S	*	*			trans	-54.4	90	-172.7	0	0	0	0	0	112.5	E447	G445-E447 VanDerWaalsContact C-N 3.34Å; G445-E447 PolarHBondContact O-N 3.2Å; G445-E447 VanDerWaalsContact O-N 3.11Å
446	T	29.6	Very low	34.2	Very low	131 Å²	131	119.6 Å²	119.6	80%	0.804	68%	0.684	S	S	*	*			trans	-79.7	94.4	163.1	41.6	0	0	0	0	106.5	Q444 R448	Q444-T446 VanDerWaalsContact C-N 3.33Å; Q444-T446 PolarHBondContact O-N 3.3Å; T446-R448 PolarHBondContact O-N 3.29Å
447	E	26.8	Very low	35.4	Very low	176 Å²	176	120.5 Å²	120.5	82%	0.822	68%	0.683	S	S	*	*			trans	-44.3	106.1	165	-70.7	-170.3	152.5	0	0	108.1	G445 R449	G445-E447 VanDerWaalsContact C-N 3.34Å; G445-E447 PolarHBondContact O-N 3.2Å; G445-E447 VanDerWaalsContact O-N 3.11Å; E447-R449 PolarHBondContact O-N 3.33Å
448	R	32.6	Very low	36.9	Very low	247 Å²	247	126.1 Å²	126.1	93%	0.932	69%	0.69	S	S	*	*			trans	-58.2	102.2	162.5	-74.3	-173.9	177.3	-171.3	0.2	104.7	T446 G450	T446-R448 PolarHBondContact O-N 3.29Å; R448-G450 PolarHBondContact O-N 3.35Å
449	R	31.4	Very low	38.2	Very low	240 Å²	240	129.9 Å²	129.9	91%	0.906	70%	0.696	S	S	*	*			trans	-61.9	77.5	163.9	-90.9	-175.6	173.6	-173.8	-0.3	107.3	E447	E447-R449 PolarHBondContact O-N 3.33Å
450	G	32.6	Very low	39.8	Very low	42 Å²	42	135.7 Å²	135.7	43%	0.433	72%	0.724	S	S	.	*			trans	-53.6	160.6	152.8	0	0	0	0	0	108.4	R448 A452	R448-G450 PolarHBondContact O-N 3.35Å; G450-A452 PolarHBondContact O-N 3.07Å
451	P	33.5	Very low	41.6	Very low	125 Å²	125	133.8 Å²	133.8	81%	0.812	74%	0.735	S	S	*	*	S	Bend	trans	-50.1	117.2	-179.1	23.6	-32.5	0	0	0	107.1	K453	P451-K453 VanDerWaalsContact C-N 3.33Å; P451-K453 PolarHBondContact O-N 3.39Å
452	A	36.7	Very low	43.7	Very low	87 Å²	87	133.8 Å²	133.8	72%	0.719	72%	0.721	S	S	*	*			trans	-46.2	103.2	-172.9	0	0	0	0	0	107.6	G450 T454	G450-A452 PolarHBondContact O-N 3.07Å; A452-T454 VanDerWaalsContact C-N 3.25Å; A452-T454 PolarHBondContact O-N 3.03Å; A452-T454 PolarHBondContact O-OG1 2.92Å
453	K	40.7	Very low	46.2	Very low	187 Å²	187	129.9 Å²	129.9	81%	0.813	71%	0.708	S	S	*	*			trans	-57.1	101.6	177.4	-99.4	-179.2	-178.5	178.8	0	103.2	P451 V455	P451-K453 VanDerWaalsContact C-N 3.33Å; P451-K453 PolarHBondContact O-N 3.39Å; K453-V455 HydrophobicContact CB-CB 4.35Å; K453-V455 HydrophobicContact CB-CG2 3.65Å; K453-V455 HydrophobicContact CD-CG2 4.18Å; K453-V455 HydrophobicContact CG-CG2 3.96Å; K453-V455 PolarHBondContact O-N 3.04Å
454	T	39.5	Very low	48.9	Very low	120 Å²	120	127.1 Å²	127.1	74%	0.736	70%	0.695	S	S	*	*			trans	-75.6	60.3	171.2	-27.9	0	0	0	0	105.9	A452 C456	A452-T454 VanDerWaalsContact C-N 3.25Å; A452-T454 PolarHBondContact O-N 3.03Å; A452-T454 PolarHBondContact O-OG1 2.92Å; T454-C456 VanDerWaalsContact C-N 3.29Å; T454-C456 PolarHBondContact O-N 3.47Å
455	V	48.6	Very low	51.7	Low	91 Å²	91	127.4 Å²	127.4	55%	0.552	70%	0.696	S	S	*	*			trans	-94.9	78.5	177.1	179.4	0	0	0	0	103.2	K453 P457	K453-V455 HydrophobicContact CB-CB 4.35Å; K453-V455 HydrophobicContact CB-CG2 3.65Å; K453-V455 HydrophobicContact CD-CG2 4.18Å; K453-V455 HydrophobicContact CG-CG2 3.96Å; K453-V455 PolarHBondContact O-N 3.04Å; V455-P457 VanDerWaalsContact C-N 3.29Å; V455-P457 HydrophobicContact CG1-CB 4.3Å; V455-P457 HydrophobicContact CG1-CG 4.08Å; V455-P457 WeakPolarHBondContact O-CD 3.3Å
456	C	53.1	Low	54.5	Low	55 Å²	55	127.6 Å²	127.6	37%	0.372	68%	0.676	S	S	.	*			trans	-67.2	105.5	139.1	-70.8	0	0	0	0	103.5	T454 R458	T454-C456 VanDerWaalsContact C-N 3.29Å; T454-C456 PolarHBondContact O-N 3.47Å; C456-R458 PolarHBondContact O-N 2.95Å; C456-R458 VanDerWaalsContact O-N 3.12Å
457	P	57	Low	57.1	Low	97 Å²	97	126.3 Å²	126.3	63%	0.63	66%	0.659	S	S	*	*			trans	-56.3	125.6	-178.9	-14.5	27.9	0	0	0	106.8	V455 K459	V455-P457 VanDerWaalsContact C-N 3.29Å; V455-P457 HydrophobicContact CG1-CB 4.3Å; V455-P457 HydrophobicContact CG1-CG 4.08Å; V455-P457 WeakPolarHBondContact O-CD 3.3Å; P457-K459 PolarHBondContact O-N 3.24Å; P457-K459 VanDerWaalsContact O-N 3.07Å
458	R	63.5	Low	60.2	Low	212 Å²	212	125 Å²	125	80%	0.8	65%	0.651	S	S	*	*			trans	-64.7	112.9	168.6	-66.8	-178.5	-141.2	168.4	7.2	105.3	C456 L460	C456-R458 PolarHBondContact O-N 2.95Å; C456-R458 VanDerWaalsContact O-N 3.12Å; R458-L460 PolarHBondContact O-N 2.88Å
459	K	62	Low	62.8	Low	159 Å²	159	119.5 Å²	119.5	69%	0.691	64%	0.637	S	S	*	*			trans	-65.5	125.5	167.2	-69.3	-168.2	176.4	-171.8	0	107.2	P457 G461 E462	P457-K459 PolarHBondContact O-N 3.24Å; P457-K459 VanDerWaalsContact O-N 3.07Å; K459-G461 PolarHBondContact O-N 3.3Å; K459-E462 PolarHBondContact O-N 3.02Å
460	L	70.9	Confident	65.4	Low	184 Å²	184	111.2 Å²	111.2	96%	0.963	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.3	129.4	170.9	-147.9	79.2	0	0	0	107.1	R458	R458-L460 PolarHBondContact O-N 2.88Å
461	G	74.4	Confident	68.2	Low	73 Å²	73	114.7 Å²	114.7	75%	0.753	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	92.1	16.4	-176.3	0	0	0	0	0	116.7	K459 T463	K459-G461 PolarHBondContact O-N 3.3Å; G461-T463 PolarHBondContact O-N 3.05Å
462	E	76.2	Confident	71	Confident	52 Å²	52	115.4 Å²	115.4	24%	0.243	60%	0.599	C	S	.	*			trans	-60.1	118.5	178.4	-156.5	176.2	-145.5	0	0	111.8	K459 M466 K467 R470	K459-E462 PolarHBondContact O-N 3.02Å; E462-M466 HydrophobicContact CG-CB 3.46Å; E462-M466 VanDerWaalsContact CG-CB 3.46Å; E462-K467 HydrophobicContact CG-CB 4.42Å; E462-R470 WeakPolarHBondContact OE1-CD 3.05Å; E462-R470 IonicContact OE1-CZ 2.89Å; E462-R470 IonicContact OE1-NE 3.19Å; E462-R470 PolarHBondContact OE1-NE 2.89Å; E462-R470 IonicContact OE2-CZ 3.1Å; E462-R470 IonicContact OE2-NE 3.67Å; E462-R470 PolarHBondContact OE2-NE 3.37Å; E462-R470 VanDerWaalsContact OE2-NE 3.1Å; E462-R470 IonicContact OE2-NH2 3.47Å; E462-R470 PolarHBondContact OE2-NH2 3.23Å
463	T	82	Confident	73.6	Confident	77 Å²	77	113.9 Å²	113.9	47%	0.472	59%	0.586	S	S	.	*			trans	-63.7	159.7	174.2	67.4	0	0	0	0	111.1	G461 E465 M466 K467	G461-T463 PolarHBondContact O-N 3.05Å; T463-E465 PolarHBondContact O-N 2.89Å; T463-E465 VanDerWaalsContact O-N 3.14Å; T463-M466 HydrophobicContact CG2-SD 4.37Å; T463-M466 PolarHBondContact O-N 3.09Å; T463-M466 VanDerWaalsContact O-N 3.14Å; T463-M466 VanDerWaalsContact OG1-CG 3.3Å; T463-M466 WeakPolarHBondContact OG1-CG 3.21Å; T463-M466 PolarHBondContact OG1-N 3.14Å; T463-K467 PolarHBondContact O-N 2.86Å
464	S	84.8	Confident	76	Confident	86 Å²	86	106.6 Å²	106.6	60%	0.601	56%	0.558	S	S	*	*	H	α-helix	trans	-57.9	-30.4	179.4	-177	0	0	0	0	112.7	K468	S464-K468 WeakPolarHBondContact O-CG 3.42Å; S464-K468 PolarHBondContact O-N 2.57Å
465	E	85.7	Confident	78.6	Confident	150 Å²	150	108.2 Å²	108.2	70%	0.701	56%	0.555	S	S	*	*	H	α-helix	trans	-73.6	-45	176	-65.5	-163.2	146.4	0	0	112.3	T463 K467 K468 M469	T463-E465 PolarHBondContact O-N 2.89Å; T463-E465 VanDerWaalsContact O-N 3.14Å; E465-K467 VanDerWaalsContact C-N 3.27Å; E465-K467 PolarHBondContact O-N 3.08Å; E465-K468 WeakPolarHBondContact O-CB 3.32Å; E465-K468 PolarHBondContact O-N 3.06Å; E465-M469 PolarHBondContact O-N 3.23Å
466	M	83.8	Confident	80.6	Confident	89 Å²	89	109.2 Å²	109.2	44%	0.438	55%	0.553	S	S	.	*	H	α-helix	trans	-57.2	-41.9	175	-71.7	175.2	79.1	0	0	111.4	E462 T463 K468 M469 R470	E462-M466 HydrophobicContact CG-CB 3.46Å; E462-M466 VanDerWaalsContact CG-CB 3.46Å; T463-M466 HydrophobicContact CG2-SD 4.37Å; T463-M466 PolarHBondContact O-N 3.09Å; T463-M466 VanDerWaalsContact O-N 3.14Å; T463-M466 VanDerWaalsContact OG1-CG 3.3Å; T463-M466 WeakPolarHBondContact OG1-CG 3.21Å; T463-M466 PolarHBondContact OG1-N 3.14Å; M466-K468 PolarHBondContact O-N 3.43Å; M466-M469 PolarHBondContact O-N 3.12Å; M466-R470 WeakPolarHBondContact O-CB 3.47Å; M466-R470 PolarHBondContact O-N 3.42Å
467	K	84.4	Confident	82.4	Confident	104 Å²	104	111.7 Å²	111.7	45%	0.452	56%	0.56	S	S	.	*	H	α-helix	trans	-61.6	-39.9	175.3	-176.9	179.3	-179.4	178.4	0	112.6	E462 T463 E465 K471	E462-K467 HydrophobicContact CG-CB 4.42Å; T463-K467 PolarHBondContact O-N 2.86Å; E465-K467 VanDerWaalsContact C-N 3.27Å; E465-K467 PolarHBondContact O-N 3.08Å; K467-K471 WeakPolarHBondContact O-CB 3.29Å; K467-K471 WeakPolarHBondContact O-CG 3.39Å; K467-K471 PolarHBondContact O-N 3.35Å; K467-K471 VanDerWaalsContact O-N 3.09Å
468	K	90	Very high	84.2	Confident	148 Å²	148	111.2 Å²	111.2	64%	0.643	55%	0.55	S	S	*	.	H	α-helix	trans	-66.5	-46	175.7	-75.3	175.3	-178.3	176.1	0	110.7	S464 E465 M466 K471 K472	S464-K468 WeakPolarHBondContact O-CG 3.42Å; S464-K468 PolarHBondContact O-N 2.57Å; E465-K468 WeakPolarHBondContact O-CB 3.32Å; E465-K468 PolarHBondContact O-N 3.06Å; M466-K468 PolarHBondContact O-N 3.43Å; K468-K471 PolarHBondContact O-N 3.11Å; K468-K472 PolarHBondContact O-N 3.31Å
469	M	87.9	Confident	85.6	Confident	131 Å²	131	110 Å²	110	65%	0.645	55%	0.545	S	S	*	.	H	α-helix	trans	-61.1	-45.6	177.4	-73	-65.1	-79.7	0	0	112.1	E465 M466 K471 K472 A473	E465-M469 PolarHBondContact O-N 3.23Å; M466-M469 PolarHBondContact O-N 3.12Å; M469-K471 PolarHBondContact O-N 3.1Å; M469-K472 WeakPolarHBondContact O-CB 3.47Å; M469-K472 PolarHBondContact O-N 2.69Å; M469-A473 WeakPolarHBondContact O-CB 3.39Å; M469-A473 PolarHBondContact O-N 3.15Å
470	R	86.4	Confident	87	Confident	66 Å²	66	106.4 Å²	106.4	25%	0.249	53%	0.534	C	S	.	.	H	α-helix	trans	-60.8	-45.2	175.2	-178.7	175.8	59.3	89.8	-2.5	112.3	E462 M466 K472 A473 V474	E462-R470 WeakPolarHBondContact OE1-CD 3.05Å; E462-R470 IonicContact OE1-CZ 2.89Å; E462-R470 IonicContact OE1-NE 3.19Å; E462-R470 PolarHBondContact OE1-NE 2.89Å; E462-R470 IonicContact OE2-CZ 3.1Å; E462-R470 IonicContact OE2-NE 3.67Å; E462-R470 PolarHBondContact OE2-NE 3.37Å; E462-R470 VanDerWaalsContact OE2-NE 3.1Å; E462-R470 IonicContact OE2-NH2 3.47Å; E462-R470 PolarHBondContact OE2-NH2 3.23Å; M466-R470 WeakPolarHBondContact O-CB 3.47Å; M466-R470 PolarHBondContact O-N 3.42Å; R470-K472 VanDerWaalsContact C-N 3.28Å; R470-K472 PolarHBondContact O-N 3.24Å; R470-A473 PolarHBondContact O-N 2.94Å; R470-V474 HydrophobicContact CG-CG2 4.39Å; R470-V474 WeakPolarHBondContact O-CG2 3.48Å; R470-V474 PolarHBondContact O-N 2.95Å
471	K	91.5	Very high	88	Confident	116 Å²	116	102.4 Å²	102.4	50%	0.504	51%	0.513	S	S	.	.	H	α-helix	trans	-61.2	-38.5	175.9	-78.5	-177.8	177.1	-172.5	0	111.7	K467 K468 M469 K475	K467-K471 WeakPolarHBondContact O-CB 3.29Å; K467-K471 WeakPolarHBondContact O-CG 3.39Å; K467-K471 PolarHBondContact O-N 3.35Å; K467-K471 VanDerWaalsContact O-N 3.09Å; K468-K471 PolarHBondContact O-N 3.11Å; M469-K471 PolarHBondContact O-N 3.1Å; K471-K475 WeakPolarHBondContact O-CB 3.49Å; K471-K475 VanDerWaalsContact O-CG 3.31Å; K471-K475 WeakPolarHBondContact O-CG 3.34Å; K471-K475 PolarHBondContact O-N 2.88Å; K471-K475 VanDerWaalsContact O-N 3.08Å
472	K	92.7	Very high	88.9	Confident	140 Å²	140	106.6 Å²	106.6	61%	0.609	51%	0.506	S	S	*	.	H	α-helix	trans	-64.4	-49.3	175.3	-169.3	179.4	177.8	-175	0	110.7	K468 M469 R470 V474 K475 E476	K468-K472 PolarHBondContact O-N 3.31Å; M469-K472 WeakPolarHBondContact O-CB 3.47Å; M469-K472 PolarHBondContact O-N 2.69Å; R470-K472 VanDerWaalsContact C-N 3.28Å; R470-K472 PolarHBondContact O-N 3.24Å; K472-V474 PolarHBondContact O-N 3.08Å; K472-K475 PolarHBondContact O-N 3.48Å; K472-E476 WeakPolarHBondContact O-CB 3.31Å; K472-E476 PolarHBondContact O-N 3.06Å
473	A	90.5	Very high	89.6	Confident	54 Å²	54	110.8 Å²	110.8	45%	0.446	53%	0.53	S	S	.	.	H	α-helix	trans	-59.7	-44.2	177.3	0	0	0	0	0	112.9	M469 R470 K475 E476 M477	M469-A473 WeakPolarHBondContact O-CB 3.39Å; M469-A473 PolarHBondContact O-N 3.15Å; R470-A473 PolarHBondContact O-N 2.94Å; A473-K475 PolarHBondContact O-N 2.78Å; A473-E476 PolarHBondContact O-N 3Å; A473-M477 WeakPolarHBondContact O-CB 3.47Å; A473-M477 PolarHBondContact O-N 2.94Å
474	V	91.6	Very high	90	Very high	34 Å²	34	112.7 Å²	112.7	21%	0.206	54%	0.542	C	S	.	.	H	α-helix	trans	-63.9	-40.3	176.4	171.8	0	0	0	0	111.4	R470 K472 Q478	R470-V474 HydrophobicContact CG-CG2 4.39Å; R470-V474 WeakPolarHBondContact O-CG2 3.48Å; R470-V474 PolarHBondContact O-N 2.95Å; K472-V474 PolarHBondContact O-N 3.08Å; V474-Q478 HydrophobicContact CG1-CG 4.5Å; V474-Q478 WeakPolarHBondContact O-CB 3.36Å; V474-Q478 VanDerWaalsContact O-CG 3.28Å; V474-Q478 WeakPolarHBondContact O-CG 3.47Å; V474-Q478 PolarHBondContact O-N 2.96Å
475	K	93.6	Very high	90.4	Very high	155 Å²	155	115 Å²	115	67%	0.674	54%	0.541	S	S	*	.	H	α-helix	trans	-65	-41.1	175.9	-77.8	179.4	177.5	-174.3	0	111.8	K471 K472 A473 Q478 R479	K471-K475 WeakPolarHBondContact O-CB 3.49Å; K471-K475 VanDerWaalsContact O-CG 3.31Å; K471-K475 WeakPolarHBondContact O-CG 3.34Å; K471-K475 PolarHBondContact O-N 2.88Å; K471-K475 VanDerWaalsContact O-N 3.08Å; K472-K475 PolarHBondContact O-N 3.48Å; A473-K475 PolarHBondContact O-N 2.78Å; K475-Q478 PolarHBondContact O-N 3.25Å; K475-R479 WeakPolarHBondContact O-CB 3.35Å; K475-R479 PolarHBondContact O-N 3.33Å
476	E	91.4	Very high	90.8	Very high	112 Å²	112	112.8 Å²	112.8	52%	0.523	54%	0.537	S	S	.	.	H	α-helix	trans	-66.1	-45.1	177.2	-173	164	-162.9	0	0	111.6	K472 A473 Q478 R479 N480	K472-E476 WeakPolarHBondContact O-CB 3.31Å; K472-E476 PolarHBondContact O-N 3.06Å; A473-E476 PolarHBondContact O-N 3Å; E476-Q478 PolarHBondContact O-N 2.99Å; E476-R479 WeakPolarHBondContact O-CA 3.45Å; E476-R479 WeakPolarHBondContact O-CB 3.47Å; E476-R479 PolarHBondContact O-N 2.98Å; E476-R479 VanDerWaalsContact O-N 3.07Å; E476-N480 PolarHBondContact O-N 3.22Å
477	M	90.8	Very high	91.3	Very high	106 Å²	106	111.7 Å²	111.7	52%	0.522	54%	0.536	S	S	.	.	H	α-helix	trans	-58.2	-46.3	172.3	-175.2	-172.7	-71.3	0	0	111.8	A473 R479 N480 N481	A473-M477 WeakPolarHBondContact O-CB 3.47Å; A473-M477 PolarHBondContact O-N 2.94Å; M477-R479 VanDerWaalsContact C-N 3.29Å; M477-R479 PolarHBondContact O-N 3.35Å; M477-N480 PolarHBondContact O-N 3.27Å; M477-N481 WeakPolarHBondContact O-CB 3.29Å; M477-N481 VanDerWaalsContact O-CG 3.28Å; M477-N481 PolarHBondContact O-N 3.31Å
478	Q	94.3	Very high	91.8	Very high	88 Å²	88	114.2 Å²	114.2	41%	0.411	55%	0.548	S	S	.	.	H	α-helix	trans	-64.9	-32.1	175.4	-74.1	-178.8	10	0	0	112.6	V474 K475 E476 R482	V474-Q478 HydrophobicContact CG1-CG 4.5Å; V474-Q478 WeakPolarHBondContact O-CB 3.36Å; V474-Q478 VanDerWaalsContact O-CG 3.28Å; V474-Q478 WeakPolarHBondContact O-CG 3.47Å; V474-Q478 PolarHBondContact O-N 2.96Å; K475-Q478 PolarHBondContact O-N 3.25Å; E476-Q478 PolarHBondContact O-N 2.99Å; Q478-R482 WeakPolarHBondContact O-CB 3.42Å; Q478-R482 WeakPolarHBondContact O-CD 3.42Å; Q478-R482 WeakPolarHBondContact O-CG 3.46Å; Q478-R482 PolarHBondContact O-N 3.07Å; Q478-R482 VanDerWaalsContact O-N 3.08Å
479	R	92.9	Very high	92.1	Very high	186 Å²	186	113.7 Å²	113.7	70%	0.702	55%	0.547	S	S	*	.	H	α-helix	trans	-66.5	-48	175	-165.9	-177.2	-137.3	-174.1	3.4	110.4	K475 E476 M477 N481 R482 L483	K475-R479 WeakPolarHBondContact O-CB 3.35Å; K475-R479 PolarHBondContact O-N 3.33Å; E476-R479 WeakPolarHBondContact O-CA 3.45Å; E476-R479 WeakPolarHBondContact O-CB 3.47Å; E476-R479 PolarHBondContact O-N 2.98Å; E476-R479 VanDerWaalsContact O-N 3.07Å; M477-R479 VanDerWaalsContact C-N 3.29Å; M477-R479 PolarHBondContact O-N 3.35Å; R479-N481 PolarHBondContact O-N 2.92Å; R479-R482 WeakPolarHBondContact O-CB 3.47Å; R479-R482 PolarHBondContact O-N 3.26Å; R479-L483 PolarHBondContact O-N 3.22Å
480	N	91.3	Very high	92.5	Very high	84 Å²	84	110.6 Å²	110.6	45%	0.449	54%	0.535	S	S	.	.	H	α-helix	trans	-61.5	-44.2	177.1	-66.9	-14.1	0	0	0	111.4	E476 M477 R482 L483 T484	E476-N480 PolarHBondContact O-N 3.22Å; M477-N480 PolarHBondContact O-N 3.27Å; N480-R482 PolarHBondContact O-N 3.3Å; N480-L483 WeakPolarHBondContact O-CB 3.49Å; N480-L483 PolarHBondContact O-N 3.07Å; N480-L483 VanDerWaalsContact O-N 3.08Å; N480-T484 PolarHBondContact O-N 2.9Å
481	N	92.4	Very high	92.9	Very high	99 Å²	99	114.2 Å²	114.2	53%	0.529	55%	0.553	S	S	.	*	H	α-helix	trans	-62.6	-26.8	174.3	-71.8	-13.7	0	0	0	113.5	M477 R479 K485	M477-N481 WeakPolarHBondContact O-CB 3.29Å; M477-N481 VanDerWaalsContact O-CG 3.28Å; M477-N481 PolarHBondContact O-N 3.31Å; R479-N481 PolarHBondContact O-N 2.92Å; N481-K485 PolarHBondContact O-N 2.88Å
482	R	93.1	Very high	93.1	Very high	161 Å²	161	115.1 Å²	115.1	61%	0.608	56%	0.557	S	S	*	*	H	α-helix	trans	-78.1	-24.5	175.9	-75.4	168.3	-169.9	-164.9	6.1	112.8	Q478 R479 N480 K485	Q478-R482 WeakPolarHBondContact O-CB 3.42Å; Q478-R482 WeakPolarHBondContact O-CD 3.42Å; Q478-R482 WeakPolarHBondContact O-CG 3.46Å; Q478-R482 PolarHBondContact O-N 3.07Å; Q478-R482 VanDerWaalsContact O-N 3.08Å; R479-R482 WeakPolarHBondContact O-CB 3.47Å; R479-R482 PolarHBondContact O-N 3.26Å; N480-R482 PolarHBondContact O-N 3.3Å; R482-K485 HydrophobicContact CB-CD 4.4Å; R482-K485 WeakPolarHBondContact O-CD 3.35Å; R482-K485 VanDerWaalsContact O-CG 3.25Å; R482-K485 WeakPolarHBondContact O-CG 3.43Å
483	L	90.7	Very high	93.2	Very high	140 Å²	140	116.8 Å²	116.8	73%	0.733	56%	0.559	S	S	*	*	H	α-helix	trans	-70.2	-39.6	174.4	-65.4	170.4	0	0	0	110.7	R479 N480	R479-L483 PolarHBondContact O-N 3.22Å; N480-L483 WeakPolarHBondContact O-CB 3.49Å; N480-L483 PolarHBondContact O-N 3.07Å; N480-L483 VanDerWaalsContact O-N 3.08Å
484	T	90.8	Very high	93.4	Very high	118 Å²	118	123 Å²	123	72%	0.724	57%	0.571	S	S	*	*	S	Bend	trans	-92.6	6.1	179.8	57.2	0	0	0	0	114.2	N480	N480-T484 PolarHBondContact O-N 2.9Å
485	K	93.1	Very high	93.5	Very high	135 Å²	135	129.4 Å²	129.4	59%	0.587	60%	0.596	S	S	*	*	S	Bend	trans	-67.6	144.4	-177.3	79.1	-170.4	174.4	-172.5	0	111.7	N481 R482 P487	N481-K485 PolarHBondContact O-N 2.88Å; R482-K485 HydrophobicContact CB-CD 4.4Å; R482-K485 WeakPolarHBondContact O-CD 3.35Å; R482-K485 VanDerWaalsContact O-CG 3.25Å; R482-K485 WeakPolarHBondContact O-CG 3.43Å; K485-P487 WeakPolarHBondContact O-CD 3.46Å
486	V	92.9	Very high	93.4	Very high	103 Å²	103	129.5 Å²	129.5	62%	0.624	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-59	127.4	170.9	179.6	0	0	0	0	110.1	V490	V486-V490 HydrophobicContact CG1-CB 3.95Å; V486-V490 HydrophobicContact CG1-CG1 4Å
487	P	94.9	Very high	93.4	Very high	65 Å²	65	128.9 Å²	128.9	42%	0.422	60%	0.595	S	S	.	*	P	Polyproline II helix	trans	-55.2	140.4	178.4	-27	34.4	0	0	0	112.9	K485 H489 V490 K491	K485-P487 WeakPolarHBondContact O-CD 3.46Å; P487-H489 VanDerWaalsContact CB-CE1 3.49Å; P487-H489 WeakPolarHBondContact CB-CE1 3.38Å; P487-H489 PolarHBondContact O-N 3.19Å; P487-H489 VanDerWaalsContact O-N 3.17Å; P487-V490 HydrophobicContact CB-CG2 4.18Å; P487-V490 HydrophobicContact CG-CG2 4.44Å; P487-V490 PolarHBondContact O-N 3.23Å; P487-K491 PolarHBondContact O-N 2.72Å
488	K	96.1	Very high	93.3	Very high	158 Å²	158	126.6 Å²	126.6	69%	0.687	59%	0.593	S	S	*	*	H	α-helix	trans	-57.6	-35.1	-175.2	-172.3	177.5	-178.4	179.1	0	112.6	K491 K492	K488-K491 PolarHBondContact O-N 3.43Å; K488-K492 WeakPolarHBondContact O-CB 3.49Å; K488-K492 WeakPolarHBondContact O-CG 3.26Å; K488-K492 PolarHBondContact O-N 3.47Å
489	H	96	Very high	93.1	Very high	137 Å²	137	129 Å²	129	63%	0.634	60%	0.602	S	S	*	*	H	α-helix	trans	-67.7	-37.8	179.2	70.6	-95.7	0	0	0	111.9	P487 K492 R493	P487-H489 VanDerWaalsContact CB-CE1 3.49Å; P487-H489 WeakPolarHBondContact CB-CE1 3.38Å; P487-H489 PolarHBondContact O-N 3.19Å; P487-H489 VanDerWaalsContact O-N 3.17Å; H489-K492 PolarHBondContact O-N 2.91Å; H489-R493 WeakPolarHBondContact O-CB 3.2Å; H489-R493 PolarHBondContact O-N 2.77Å
490	V	95.8	Very high	92.9	Very high	66 Å²	66	123.2 Å²	123.2	40%	0.4	59%	0.588	S	S	.	*	H	α-helix	trans	-64.5	-46	174	-178.5	0	0	0	0	110.4	V486 P487 K492 R493 R494	V486-V490 HydrophobicContact CG1-CB 3.95Å; V486-V490 HydrophobicContact CG1-CG1 4Å; P487-V490 HydrophobicContact CB-CG2 4.18Å; P487-V490 HydrophobicContact CG-CG2 4.44Å; P487-V490 PolarHBondContact O-N 3.23Å; V490-K492 PolarHBondContact O-N 2.91Å; V490-R493 PolarHBondContact O-N 3.31Å; V490-R494 WeakPolarHBondContact O-CB 3.41Å; V490-R494 PolarHBondContact O-N 3.04Å
491	K	95	Very high	92.5	Very high	141 Å²	141	123.7 Å²	123.7	61%	0.613	59%	0.59	S	S	*	*	H	α-helix	trans	-59.9	-43.2	176.1	-174.4	176.1	-179.5	175.6	0	112.3	P487 K488 K495	P487-K491 PolarHBondContact O-N 2.72Å; K488-K491 PolarHBondContact O-N 3.43Å; K491-K495 PolarHBondContact O-N 3.2Å; K491-K495 VanDerWaalsContact O-N 3.1Å
492	K	96.1	Very high	91.9	Very high	136 Å²	136	122.5 Å²	122.5	59%	0.591	59%	0.594	S	S	*	*	H	α-helix	trans	-67.3	-43.8	176.6	-79.1	-172.6	172.3	-170.9	0	112.1	K488 H489 V490 R494 K495 K496	K488-K492 WeakPolarHBondContact O-CB 3.49Å; K488-K492 WeakPolarHBondContact O-CG 3.26Å; K488-K492 PolarHBondContact O-N 3.47Å; H489-K492 PolarHBondContact O-N 2.91Å; V490-K492 PolarHBondContact O-N 2.91Å; K492-R494 PolarHBondContact O-N 3.16Å; K492-K495 PolarHBondContact O-N 3.47Å; K492-K496 PolarHBondContact O-N 2.93Å
493	R	94.9	Very high	91.1	Very high	174 Å²	174	124.1 Å²	124.1	66%	0.657	60%	0.6	S	S	*	*	H	α-helix	trans	-59.4	-46.4	175.8	-176.7	175.8	177.4	173.3	-0.3	110.6	H489 V490 K495 K496 M497	H489-R493 WeakPolarHBondContact O-CB 3.2Å; H489-R493 PolarHBondContact O-N 2.77Å; V490-R493 PolarHBondContact O-N 3.31Å; R493-K495 VanDerWaalsContact C-N 3.35Å; R493-K495 PolarHBondContact O-N 2.93Å; R493-K496 PolarHBondContact O-N 3.32Å; R493-K496 VanDerWaalsContact O-N 3.17Å; R493-M497 HydrophobicContact CG-CE 4.42Å; R493-M497 HydrophobicContact CG-CG 4.32Å; R493-M497 HydrophobicContact CG-SD 4.34Å; R493-M497 WeakPolarHBondContact O-CG 3.3Å; R493-M497 PolarHBondContact O-N 3.03Å
494	R	93.7	Very high	90.1	Very high	184 Å²	184	127.6 Å²	127.6	69%	0.694	60%	0.604	S	S	*	*	H	α-helix	trans	-56.8	-45.9	175.1	-166.5	-179.6	76	172.3	7	112.1	V490 K492 M497 A498	V490-R494 WeakPolarHBondContact O-CB 3.41Å; V490-R494 PolarHBondContact O-N 3.04Å; K492-R494 PolarHBondContact O-N 3.16Å; R494-M497 PolarHBondContact O-N 3.29Å; R494-A498 WeakPolarHBondContact O-CB 3.37Å; R494-A498 PolarHBondContact O-N 2.85Å
495	K	93.4	Very high	88.4	Confident	169 Å²	169	129.3 Å²	129.3	74%	0.735	60%	0.601	S	S	*	*	H	α-helix	trans	-64.4	-40	176.7	-170.8	175.7	-178.9	178.3	0	112.3	K491 K492 R493 K499	K491-K495 PolarHBondContact O-N 3.2Å; K491-K495 VanDerWaalsContact O-N 3.1Å; K492-K495 PolarHBondContact O-N 3.47Å; R493-K495 VanDerWaalsContact C-N 3.35Å; R493-K495 PolarHBondContact O-N 2.93Å; K495-K499 PolarHBondContact O-N 3.12Å
496	K	92.9	Very high	88.1	Confident	158 Å²	158	129.1 Å²	129.1	69%	0.687	60%	0.602	S	S	*	*	H	α-helix	trans	-64.6	-48.2	176.7	-169.2	178.3	179.8	-177.5	0	110.7	K492 R493 A498 K499 T500	K492-K496 PolarHBondContact O-N 2.93Å; R493-K496 PolarHBondContact O-N 3.32Å; R493-K496 VanDerWaalsContact O-N 3.17Å; K496-A498 PolarHBondContact O-N 2.97Å; K496-K499 PolarHBondContact O-N 2.98Å; K496-T500 PolarHBondContact O-N 3.33Å; K496-T500 PolarHBondContact O-OG1 3.13Å; K496-T500 VanDerWaalsContact O-OG1 3.04Å
497	M	90.6	Very high	87.9	Confident	98 Å²	98	130.4 Å²	130.4	48%	0.483	60%	0.601	S	S	.	*	H	α-helix	trans	-62.4	-41.9	177.1	-66.2	-161.6	-52	0	0	111.9	R493 R494 K499 T500 N501	R493-M497 HydrophobicContact CG-CE 4.42Å; R493-M497 HydrophobicContact CG-CG 4.32Å; R493-M497 HydrophobicContact CG-SD 4.34Å; R493-M497 WeakPolarHBondContact O-CG 3.3Å; R493-M497 PolarHBondContact O-N 3.03Å; R494-M497 PolarHBondContact O-N 3.29Å; M497-K499 VanDerWaalsContact C-N 3.33Å; M497-K499 PolarHBondContact O-N 3.38Å; M497-T500 PolarHBondContact O-N 2.72Å; M497-N501 WeakPolarHBondContact O-CB 3.46Å; M497-N501 PolarHBondContact O-N 3.22Å; M497-N501 PolarHBondContact O-OD1 2.94Å
498	A	89.6	Confident	87.5	Confident	59 Å²	59	134.1 Å²	134.1	49%	0.488	61%	0.611	S	S	.	*	H	α-helix	trans	-59.3	-42.4	174.3	0	0	0	0	0	112.3	R494 K496 N501 A502	R494-A498 WeakPolarHBondContact O-CB 3.37Å; R494-A498 PolarHBondContact O-N 2.85Å; K496-A498 PolarHBondContact O-N 2.97Å; A498-N501 PolarHBondContact O-N 3.15Å; A498-A502 WeakPolarHBondContact O-CB 3.47Å; A498-A502 PolarHBondContact O-N 2.86Å
499	K	89.8	Confident	87	Confident	137 Å²	137	132.6 Å²	132.6	60%	0.596	61%	0.606	S	S	*	*	H	α-helix	trans	-67.8	-36.3	176.3	-171	174.6	-178.2	177.3	0	112.6	K495 K496 M497 R503	K495-K499 PolarHBondContact O-N 3.12Å; K496-K499 PolarHBondContact O-N 2.98Å; M497-K499 VanDerWaalsContact C-N 3.33Å; M497-K499 PolarHBondContact O-N 3.38Å; K499-R503 PolarHBondContact O-N 3.13Å
500	T	87.9	Confident	86.4	Confident	65 Å²	65	132.4 Å²	132.4	40%	0.399	60%	0.604	S	S	.	*	H	α-helix	trans	-68.1	-41.7	175.7	-54.2	0	0	0	0	111.2	K496 M497 R503 R504	K496-T500 PolarHBondContact O-N 3.33Å; K496-T500 PolarHBondContact O-OG1 3.13Å; K496-T500 VanDerWaalsContact O-OG1 3.04Å; M497-T500 PolarHBondContact O-N 2.72Å; T500-R503 PolarHBondContact O-N 2.94Å; T500-R504 PolarHBondContact O-N 3.41Å
501	N	83.6	Confident	85.8	Confident	94 Å²	94	136.8 Å²	136.8	50%	0.503	62%	0.618	S	S	.	*	H	α-helix	trans	-67.1	-39.2	178.9	-71.4	-1.3	0	0	0	112.1	M497 A498 R503 R504 K505	M497-N501 WeakPolarHBondContact O-CB 3.46Å; M497-N501 PolarHBondContact O-N 3.22Å; M497-N501 PolarHBondContact O-OD1 2.94Å; A498-N501 PolarHBondContact O-N 3.15Å; N501-R503 PolarHBondContact O-N 3.44Å; N501-R504 PolarHBondContact O-N 3.11Å; N501-R504 VanDerWaalsContact O-N 3.08Å; N501-K505 PolarHBondContact O-N 3.47Å; N501-K505 VanDerWaalsContact O-N 3.09Å
502	A	79.9	Confident	85.1	Confident	74 Å²	74	136.5 Å²	136.5	61%	0.612	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	-6.4	175.3	0	0	0	0	0	114.7	A498	A498-A502 WeakPolarHBondContact O-CB 3.47Å; A498-A502 PolarHBondContact O-N 2.86Å
503	R	76.3	Confident	84.3	Confident	195 Å²	195	136.5 Å²	136.5	74%	0.736	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.1	-13.1	171.1	-75.3	-179.7	169.3	-168	-6.7	113	K499 T500 N501	K499-R503 PolarHBondContact O-N 3.13Å; T500-R503 PolarHBondContact O-N 2.94Å; N501-R503 PolarHBondContact O-N 3.44Å
504	R	69.7	Low	83.4	Confident	213 Å²	213	133.4 Å²	133.4	80%	0.804	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.2	-35	179.2	-77.1	-176	170.9	-177.7	-4.7	111.5	T500 N501	T500-R504 PolarHBondContact O-N 3.41Å; N501-R504 PolarHBondContact O-N 3.11Å; N501-R504 VanDerWaalsContact O-N 3.08Å
505	K	53.7	Low	82.5	Confident	155 Å²	155	128.8 Å²	128.8	67%	0.674	61%	0.61	S	S	*	*			trans	-70.2	0	155.2	-63.2	-166.3	176.9	-162.9	0	108.2	E435 N501	E435-K505 IonicContact OE1-NZ 3.4Å; E435-K505 PolarHBondContact OE1-NZ 2.85Å; N501-K505 PolarHBondContact O-N 3.47Å; N501-K505 VanDerWaalsContact O-N 3.09Å

Retrieved 505 of 505 residues in 1402.8 ms (Link to these results)

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