A0A077Z0L1_TRITR Loading...

Rho guanine nucleotide exchange factor protein t ag

AlphaFold DB , UniProt , Accession A0A077Z0L1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 580 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	30.1	Very low	25	Very low	238 Å²	238	173.3 Å²	173.3	100%	1.172	88%	0.881	S	S	*	*				0	93.3	0	-70.4	175.2	173	0	0	108.7
2	F	21.8	Very low	24.8	Very low	203 Å²	203	164.8 Å²	164.8	89%	0.89	87%	0.87	S	S	*	*			trans	-139.6	125.7	172.7	-94.5	-81.3	0	0	0	109
3	T	23.8	Very low	24.8	Very low	138 Å²	138	160.6 Å²	160.6	85%	0.847	86%	0.862	S	S	*	*			trans	-80.6	123.4	176	31.4	0	0	0	0	109.7
4	T	25.5	Very low	24.7	Very low	127 Å²	127	155.2 Å²	155.2	78%	0.779	85%	0.851	S	S	*	*			trans	-117.7	106.3	174.1	-21.9	0	0	0	0	109.6	Y6	T4-Y6 PolarHBondContact O-N 2.78Å
5	S	25.8	Very low	24.6	Very low	108 Å²	108	158 Å²	158	76%	0.755	85%	0.851	S	S	*	*			trans	-76.8	107.9	-177.4	-53.9	0	0	0	0	111.2	L7	S5-L7 PolarHBondContact O-N 2.9Å
6	Y	23.7	Very low	24.7	Very low	233 Å²	233	158.6 Å²	158.6	91%	0.914	85%	0.847	S	S	*	*			trans	-72.8	93.2	170.3	-102.9	-94.5	0	0	0	110.8	T4 G8	T4-Y6 PolarHBondContact O-N 2.78Å; Y6-G8 PolarHBondContact O-N 3.01Å
7	L	26.7	Very low	24.6	Very low	159 Å²	159	154.9 Å²	154.9	83%	0.832	84%	0.837	S	S	*	*			trans	-84	99.7	164.9	-92.4	163.1	0	0	0	109.5	S5 F9	S5-L7 PolarHBondContact O-N 2.9Å; L7-F9 PolarHBondContact O-N 3.47Å
8	G	25.4	Very low	24.6	Very low	70 Å²	70	153.1 Å²	153.1	72%	0.722	83%	0.832	S	S	*	*			trans	-68.9	113	179.2	0	0	0	0	0	112.7	Y6 R10	Y6-G8 PolarHBondContact O-N 3.01Å; G8-R10 PolarHBondContact O-N 2.78Å
9	F	23.7	Very low	24.5	Very low	216 Å²	216	149.7 Å²	149.7	95%	0.947	83%	0.827	S	S	*	*			trans	-59.4	120.7	166.9	-92.7	-102.6	0	0	0	110.6	L7	L7-F9 PolarHBondContact O-N 3.47Å
10	R	23.6	Very low	24.5	Very low	241 Å²	241	147.6 Å²	147.6	91%	0.909	82%	0.822	S	S	*	*			trans	-145.7	54.7	169.9	-143.2	-179.9	-166.9	-165	4.3	113.9	G8	G8-R10 PolarHBondContact O-N 2.78Å
11	N	25.2	Very low	24.4	Very low	173 Å²	173	147.8 Å²	147.8	93%	0.925	82%	0.82	S	S	*	*			trans	-119	92.4	164.7	-88.2	-27.1	0	0	0	109.7
12	G	22.7	Very low	24.3	Very low	72 Å²	72	143.9 Å²	143.9	74%	0.742	80%	0.802	S	S	*	*			trans	-142.2	73.9	177.8	0	0	0	0	0	110.3	A14	G12-A14 VanDerWaalsContact C-N 3.3Å; G12-A14 PolarHBondContact O-N 3.33Å
13	S	24.8	Very low	24.4	Very low	110 Å²	110	144.4 Å²	144.4	77%	0.769	80%	0.798	S	S	*	*			trans	-76.2	82.2	173.3	44.6	0	0	0	0	110.2	F15	S13-F15 PolarHBondContact O-N 3.18Å
14	A	23.4	Very low	24.5	Very low	85 Å²	85	143.6 Å²	143.6	70%	0.702	80%	0.795	S	S	*	*			trans	-63.6	96.7	169.9	0	0	0	0	0	109.9	G12 Q16	G12-A14 VanDerWaalsContact C-N 3.3Å; G12-A14 PolarHBondContact O-N 3.33Å; A14-Q16 PolarHBondContact O-N 2.84Å
15	F	23.6	Very low	24.6	Very low	197 Å²	197	143.2 Å²	143.2	86%	0.864	80%	0.798	S	S	*	*			trans	-67.3	79.3	166.5	-102.2	-89.3	0	0	0	109.4	S13 S17	S13-F15 PolarHBondContact O-N 3.18Å; F15-S17 PolarHBondContact O-N 2.91Å
16	Q	24.9	Very low	24.4	Very low	167 Å²	167	146.5 Å²	146.5	78%	0.78	80%	0.801	S	S	*	*			trans	-66.5	114.1	168.4	-76.7	-174.2	-24	0	0	108.8	A14 T18	A14-Q16 PolarHBondContact O-N 2.84Å; Q16-T18 PolarHBondContact O-N 3.35Å; Q16-T18 VanDerWaalsContact O-N 3.08Å
17	S	22.8	Very low	24.4	Very low	97 Å²	97	142.8 Å²	142.8	68%	0.678	80%	0.797	S	S	*	*			trans	-68	102.8	172.8	-68.7	0	0	0	0	109.6	F15 A19	F15-S17 PolarHBondContact O-N 2.91Å; S17-A19 PolarHBondContact O-N 3.04Å
18	T	26.1	Very low	24.4	Very low	122 Å²	122	143.4 Å²	143.4	75%	0.748	80%	0.8	S	S	*	*			trans	-75.9	92.8	173.2	-50.5	0	0	0	0	109.8	Q16 C20	Q16-T18 PolarHBondContact O-N 3.35Å; Q16-T18 VanDerWaalsContact O-N 3.08Å; T18-C20 PolarHBondContact O-N 2.83Å
19	A	22	Very low	24.2	Very low	89 Å²	89	148.7 Å²	148.7	74%	0.736	81%	0.806	S	S	*	*			trans	-71.1	92.7	170.1	0	0	0	0	0	110	S17 I21	S17-A19 PolarHBondContact O-N 3.04Å; A19-I21 PolarHBondContact O-N 3.22Å
20	C	25.3	Very low	24.2	Very low	106 Å²	106	144 Å²	144	72%	0.716	80%	0.8	S	S	*	*			trans	-73.3	111.3	170.4	-81	0	0	0	0	110.4	T18 I22	T18-C20 PolarHBondContact O-N 2.83Å; C20-I22 PolarHBondContact O-N 3.37Å
21	I	22.2	Very low	24.1	Very low	153 Å²	153	138.1 Å²	138.1	79%	0.785	80%	0.796	S	S	*	*			trans	-74.7	108.3	171.7	-62.6	169	0	0	0	108.1	A19 R23	A19-I21 PolarHBondContact O-N 3.22Å; I21-R23 PolarHBondContact O-N 3.46Å
22	I	27.7	Very low	24	Very low	156 Å²	156	136.7 Å²	136.7	80%	0.8	79%	0.793	S	S	*	*			trans	-83.5	109.7	167.1	-60.2	176.9	0	0	0	107.6	C20	C20-I22 PolarHBondContact O-N 3.37Å
23	R	23	Very low	24	Very low	214 Å²	214	137.6 Å²	137.6	81%	0.808	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-77.6	136.9	159.9	-68.8	-179.1	177.2	174.1	-2.3	108	I21	I21-R23 PolarHBondContact O-N 3.46Å
24	P	25.7	Very low	24	Very low	121 Å²	121	137.2 Å²	137.2	79%	0.786	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-66	134.6	157.8	-1.3	17.6	0	0	0	107.8
25	S	27.3	Very low	24.1	Very low	119 Å²	119	142 Å²	142	83%	0.832	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-80.7	137.5	159.1	-63.3	0	0	0	0	108.3
26	E	23	Very low	24	Very low	176 Å²	176	143.7 Å²	143.7	82%	0.822	80%	0.802	S	S	*	*			trans	-70	175.5	163.4	-67.7	165.9	153.8	0	0	109.3
27	D	22.4	Very low	23.9	Very low	156 Å²	156	144.8 Å²	144.8	83%	0.834	80%	0.804	S	S	*	*			trans	74.2	82.6	-178.7	-49.7	-26.8	0	0	0	117.5
28	L	27.2	Very low	24.1	Very low	172 Å²	172	151.7 Å²	151.7	90%	0.901	82%	0.817	S	S	*	*				-161.7	119.3	107.4	-134.2	75.7	0	0	0	112.2
29	E	21.2	Very low	23.9	Very low	181 Å²	181	149.6 Å²	149.6	85%	0.846	82%	0.819	S	S	*	*			trans	-76.9	176.9	167.6	-63.3	-174	122.4	0	0	111.9
30	S	23.4	Very low	24.1	Very low	117 Å²	117	153.7 Å²	153.7	82%	0.818	83%	0.828	S	S	*	*			trans	72.4	91	169.8	74.2	0	0	0	0	117.7
31	S	22.2	Very low	24	Very low	118 Å²	118	154.2 Å²	154.2	83%	0.825	83%	0.833	S	S	*	*				170.8	95.5	108.7	-170.6	0	0	0	0	110.8
32	V	22.1	Very low	24	Very low	143 Å²	143	158.2 Å²	158.2	87%	0.867	84%	0.838	S	S	*	*			trans	-135.6	97.8	167	-178.2	0	0	0	0	108.5
33	A	23	Very low	24	Very low	91 Å²	91	162.2 Å²	162.2	75%	0.752	85%	0.845	S	S	*	*			trans	-83.8	138.9	165.8	0	0	0	0	0	109.7
34	P	26.1	Very low	23.9	Very low	102 Å²	102	163 Å²	163	66%	0.662	85%	0.848	S	S	*	*			trans	-96	126.4	-163.7	34.4	-33.9	0	0	0	114.3	R36	P34-R36 VanDerWaalsContact C-N 3.25Å; P34-R36 PolarHBondContact O-N 3.37Å
35	L	24	Very low	23.9	Very low	186 Å²	186	164.4 Å²	164.4	97%	0.974	85%	0.849	S	S	*	*			trans	-75	77.7	160	-75.7	172.7	0	0	0	110.6
36	R	21.8	Very low	23.8	Very low	232 Å²	232	166.1 Å²	166.1	88%	0.875	85%	0.847	S	S	*	*			trans	-96.5	90.6	165.7	-88.1	-171.2	175	178.4	1.2	110.6	P34	P34-R36 VanDerWaalsContact C-N 3.25Å; P34-R36 PolarHBondContact O-N 3.37Å
37	K	23.8	Very low	23.9	Very low	190 Å²	190	163.5 Å²	163.5	83%	0.826	85%	0.845	S	S	*	*			trans	-162.5	88.9	156.1	-114.7	179.4	-176.8	-179.4	0	110
38	Y	25.9	Very low	24.1	Very low	242 Å²	242	163.5 Å²	163.5	95%	0.949	85%	0.845	S	S	*	*			trans	-174.6	126.2	134.5	-88.2	-57.7	0	0	0	107.3
39	G	22.7	Very low	24	Very low	77 Å²	77	164 Å²	164	79%	0.794	84%	0.842	S	S	*	*			trans	-94.9	113.5	-167.8	0	0	0	0	0	113
40	L	27	Very low	24.2	Very low	176 Å²	176	161.4 Å²	161.4	92%	0.921	83%	0.829	S	S	*	*			trans	-131.5	92.5	153.7	-79.3	176	0	0	0	108.9	R42	L40-R42 PolarHBondContact O-N 3.25Å
41	S	22.1	Very low	24.6	Very low	117 Å²	117	161 Å²	161	82%	0.818	82%	0.822	S	S	*	*			trans	-83.5	101	175.5	60.2	0	0	0	0	110.7
42	R	23.3	Very low	24.9	Very low	236 Å²	236	159.6 Å²	159.6	89%	0.891	81%	0.813	S	S	*	*			trans	-169.7	94.8	155.5	-105	171.8	-145.3	-153.8	6.7	108.8	L40	L40-R42 PolarHBondContact O-N 3.25Å
43	Y	26.5	Very low	25.2	Very low	241 Å²	241	158.8 Å²	158.8	95%	0.945	80%	0.799	S	S	*	*			trans	168.5	100.2	146.1	-91.3	-62	0	0	0	107.1
44	R	22.1	Very low	25.6	Very low	230 Å²	230	160.6 Å²	160.6	87%	0.868	79%	0.79	S	S	*	*			trans	-84.6	145.7	174.4	-87	-178.2	171.2	174.5	-3.7	109.9
45	N	24.5	Very low	25.8	Very low	150 Å²	150	161 Å²	161	80%	0.802	79%	0.786	S	S	*	*			trans	66.1	88	154.5	-55.1	-7.5	0	0	0	118.5
46	I	26.4	Very low	26	Very low	156 Å²	156	156.6 Å²	156.6	80%	0.8	77%	0.77	S	S	*	*			trans	-134.2	130.6	145	-57	-179.4	0	0	0	107.8	L48	I46-L48 PolarHBondContact O-N 2.93Å
47	P	24.4	Very low	26.4	Very low	121 Å²	121	151.4 Å²	151.4	79%	0.786	76%	0.756	S	S	*	*			trans	-76.6	118.9	-176	-9.6	25.4	0	0	0	112.7	H49	P47-H49 PolarHBondContact O-N 3.16Å; P47-H49 VanDerWaalsContact O-N 3.14Å
48	L	26.1	Very low	26.9	Very low	156 Å²	156	147.5 Å²	147.5	82%	0.817	74%	0.744	S	S	*	*			trans	-82.7	78.1	173.7	-75.5	168.1	0	0	0	111.3	I46	I46-L48 PolarHBondContact O-N 2.93Å
49	H	24.9	Very low	27.3	Very low	183 Å²	183	141 Å²	141	85%	0.847	73%	0.729	S	S	*	*	S	Bend	trans	-146.9	14	173.1	-119.8	-79.8	0	0	0	116.7	P47	P47-H49 PolarHBondContact O-N 3.16Å; P47-H49 VanDerWaalsContact O-N 3.14Å
50	H	25.4	Very low	27.8	Very low	125 Å²	125	140.3 Å²	140.3	58%	0.579	71%	0.712	S	S	*	*	S	Bend	trans	-133.3	8.3	-169.7	-132.3	-39.1	0	0	0	117.3
51	T	31.4	Very low	28.3	Very low	108 Å²	108	135.8 Å²	135.8	66%	0.663	69%	0.686	S	S	*	*	H	α-helix	trans	-89.8	-27.8	-168.6	36.4	0	0	0	0	115.9
52	S	29.6	Very low	29.1	Very low	90 Å²	90	136.4 Å²	136.4	63%	0.629	68%	0.68	S	S	*	*	H	α-helix	trans	-69.2	-48.7	-177	53	0	0	0	0	113.2	K54 L55 C56	S52-K54 PolarHBondContact O-N 2.82Å; S52-L55 PolarHBondContact O-N 3.1Å; S52-C56 PolarHBondContact O-N 3.4Å
53	Q	28.8	Very low	29.5	Very low	125 Å²	125	126.9 Å²	126.9	58%	0.584	66%	0.655	S	S	*	*	H	α-helix	trans	-62.1	-39	-179.1	-79.3	-177.5	-19.4	0	0	113.6	L55 C56 Q57	Q53-L55 VanDerWaalsContact C-N 3.3Å; Q53-L55 PolarHBondContact O-N 2.8Å; Q53-C56 PolarHBondContact O-N 2.98Å; Q53-Q57 WeakPolarHBondContact O-CG 3.21Å; Q53-Q57 PolarHBondContact O-N 2.74Å
54	K	29.9	Very low	30.1	Very low	130 Å²	130	120.9 Å²	120.9	57%	0.565	63%	0.633	S	S	*	*	H	α-helix	trans	-65.8	-31.9	178.7	-78.3	-174.8	175.2	178.8	0	112.5	S52 N58	S52-K54 PolarHBondContact O-N 2.82Å; K54-N58 WeakPolarHBondContact O-CB 3.27Å; K54-N58 PolarHBondContact O-N 3.03Å; K54-N58 VanDerWaalsContact O-N 3.08Å; K54-N58 PolarHBondContact O-ND2 2.94Å
55	L	30.4	Very low	31	Very low	110 Å²	110	116.4 Å²	116.4	58%	0.576	62%	0.621	S	S	*	*	H	α-helix	trans	-67.3	-46.4	176.6	-143.1	92.7	0	0	0	111.1	S52 Q53 N58 V59	S52-L55 PolarHBondContact O-N 3.1Å; Q53-L55 VanDerWaalsContact C-N 3.3Å; Q53-L55 PolarHBondContact O-N 2.8Å; L55-N58 PolarHBondContact O-N 2.95Å; L55-V59 WeakPolarHBondContact O-CG2 3.3Å; L55-V59 PolarHBondContact O-N 3.05Å; L55-V59 VanDerWaalsContact O-N 3.14Å
56	C	28.9	Very low	31.6	Very low	93 Å²	93	113.6 Å²	113.6	63%	0.628	60%	0.601	S	S	*	*	H	α-helix	trans	-65.2	-39.7	177.9	-63.2	0	0	0	0	112.8	S52 Q53 V59 S60	S52-C56 PolarHBondContact O-N 3.4Å; Q53-C56 PolarHBondContact O-N 2.98Å; C56-V59 PolarHBondContact O-N 2.96Å; C56-S60 PolarHBondContact O-N 3.32Å
57	Q	30.5	Very low	32	Very low	124 Å²	124	109.6 Å²	109.6	58%	0.579	58%	0.581	S	S	*	*	H	α-helix	trans	-62.1	-42.8	174	-76.4	178.2	-19.1	0	0	111.9	Q53 V59 S60 E61	Q53-Q57 WeakPolarHBondContact O-CG 3.21Å; Q53-Q57 PolarHBondContact O-N 2.74Å; Q57-V59 PolarHBondContact O-N 2.66Å; Q57-S60 PolarHBondContact O-N 3.17Å; Q57-E61 PolarHBondContact O-N 3.17Å
58	N	33.6	Very low	32.6	Very low	108 Å²	108	106.2 Å²	106.2	58%	0.578	56%	0.564	S	S	*	*	H	α-helix	trans	-63.6	-39.1	178.4	-74.8	-18.7	0	0	0	112.7	K54 L55 L62	K54-N58 WeakPolarHBondContact O-CB 3.27Å; K54-N58 PolarHBondContact O-N 3.03Å; K54-N58 VanDerWaalsContact O-N 3.08Å; K54-N58 PolarHBondContact O-ND2 2.94Å; L55-N58 PolarHBondContact O-N 2.95Å; N58-L62 WeakPolarHBondContact O-CB 3.31Å; N58-L62 PolarHBondContact O-N 2.95Å
59	V	34	Very low	33.2	Very low	106 Å²	106	102.8 Å²	102.8	64%	0.642	55%	0.546	S	S	*	.	H	α-helix	trans	-67.1	-40.1	175.1	175.7	0	0	0	0	111.3	L55 C56 Q57 L62 G63	L55-V59 WeakPolarHBondContact O-CG2 3.3Å; L55-V59 PolarHBondContact O-N 3.05Å; L55-V59 VanDerWaalsContact O-N 3.14Å; C56-V59 PolarHBondContact O-N 2.96Å; Q57-V59 PolarHBondContact O-N 2.66Å; V59-L62 PolarHBondContact O-N 3.45Å; V59-G63 PolarHBondContact O-N 3.03Å
60	S	33.6	Very low	33.8	Very low	62 Å²	62	102.6 Å²	102.6	43%	0.434	54%	0.538	S	S	.	.	H	α-helix	trans	-62.3	-45.9	174.9	-171.3	0	0	0	0	112.2	C56 Q57 G63 K64	C56-S60 PolarHBondContact O-N 3.32Å; Q57-S60 PolarHBondContact O-N 3.17Å; S60-G63 PolarHBondContact O-N 3.3Å; S60-K64 WeakPolarHBondContact O-CG 3.5Å; S60-K64 PolarHBondContact O-N 2.86Å
61	E	37.9	Very low	34.3	Very low	81 Å²	81	101.6 Å²	101.6	38%	0.379	54%	0.535	S	S	.	.	H	α-helix	trans	-65.8	-35.8	176.7	-78.1	-58.7	126.3	0	0	113	Q57 K64 K65	Q57-E61 PolarHBondContact O-N 3.17Å; E61-K64 PolarHBondContact O-N 3Å; E61-K64 WeakPolarHBondContact OE1-CD 3.37Å; E61-K64 WeakPolarHBondContact OE1-CE 3.24Å; E61-K64 IonicContact OE1-NZ 3.16Å; E61-K64 PolarHBondContact OE1-NZ 2.84Å; E61-K65 WeakPolarHBondContact O-CB 3.14Å; E61-K65 WeakPolarHBondContact O-CG 3.44Å; E61-K65 PolarHBondContact O-N 3.22Å
62	L	38	Very low	34.5	Very low	130 Å²	130	105 Å²	105	68%	0.681	54%	0.536	S	S	*	.	H	α-helix	trans	-62	-44.9	172.7	-132	79.4	0	0	0	111.2	N58 V59 K65 F66	N58-L62 WeakPolarHBondContact O-CB 3.31Å; N58-L62 PolarHBondContact O-N 2.95Å; V59-L62 PolarHBondContact O-N 3.45Å; L62-K65 PolarHBondContact O-N 3.15Å; L62-F66 WeakPolarHBondContact O-CB 3.13Å; L62-F66 PolarHBondContact O-N 3.05Å
63	G	33.5	Very low	34.9	Very low	36 Å²	36	104.1 Å²	104.1	37%	0.371	53%	0.53	S	S	.	.	H	α-helix	trans	-61.4	-43.5	176.6	0	0	0	0	0	113	V59 S60 F66 N67	V59-G63 PolarHBondContact O-N 3.03Å; S60-G63 PolarHBondContact O-N 3.3Å; G63-F66 PolarHBondContact O-N 3.12Å; G63-N67 PolarHBondContact O-N 3.17Å
64	K	38.2	Very low	35	Very low	114 Å²	114	105.2 Å²	105.2	50%	0.496	53%	0.533	S	S	.	.	H	α-helix	trans	-61.6	-46.3	174.7	-68	175.1	-159.4	169.7	0	112	S60 E61 F66 N67 A68	S60-K64 WeakPolarHBondContact O-CG 3.5Å; S60-K64 PolarHBondContact O-N 2.86Å; E61-K64 PolarHBondContact O-N 3Å; E61-K64 WeakPolarHBondContact OE1-CD 3.37Å; E61-K64 WeakPolarHBondContact OE1-CE 3.24Å; E61-K64 IonicContact OE1-NZ 3.16Å; E61-K64 PolarHBondContact OE1-NZ 2.84Å; K64-F66 VanDerWaalsContact C-N 3.34Å; K64-F66 PolarHBondContact O-N 3.07Å; K64-N67 PolarHBondContact O-N 3.2Å; K64-A68 WeakPolarHBondContact O-CB 3.29Å; K64-A68 PolarHBondContact O-N 3.28Å
65	K	40.4	Very low	35.3	Very low	137 Å²	137	104.6 Å²	104.6	60%	0.596	53%	0.532	S	S	*	.	H	α-helix	trans	-63.8	-38.1	177.9	-74.5	177.1	-179.3	177	0	112.3	E61 L62 A68 L69	E61-K65 WeakPolarHBondContact O-CB 3.14Å; E61-K65 WeakPolarHBondContact O-CG 3.44Å; E61-K65 PolarHBondContact O-N 3.22Å; L62-K65 PolarHBondContact O-N 3.15Å; K65-A68 PolarHBondContact O-N 3.18Å; K65-L69 WeakPolarHBondContact O-CG 3.26Å; K65-L69 PolarHBondContact O-N 3.34Å
66	F	37.8	Very low	35.8	Very low	90 Å²	90	107.8 Å²	107.8	40%	0.395	54%	0.541	S	S	.	.	H	α-helix	trans	-66	-42.7	176.1	-163.6	-97.8	0	0	0	112.1	L62 G63 K64 L69 R70 I221	L62-F66 WeakPolarHBondContact O-CB 3.13Å; L62-F66 PolarHBondContact O-N 3.05Å; G63-F66 PolarHBondContact O-N 3.12Å; K64-F66 VanDerWaalsContact C-N 3.34Å; K64-F66 PolarHBondContact O-N 3.07Å; F66-L69 PolarHBondContact O-N 3.18Å; F66-R70 PolarHBondContact O-N 2.8Å; F66-I221 HydrophobicContact CD2-CD1 4.18Å; F66-I221 HydrophobicContact CE2-CD1 3.96Å; F66-I221 HydrophobicContact CE2-CG2 4.16Å
67	N	34.4	Very low	36.2	Very low	72 Å²	72	110.6 Å²	110.6	39%	0.385	55%	0.545	S	S	.	.	H	α-helix	trans	-64.4	-40.8	173.6	-80.3	-18.2	0	0	0	112.5	G63 K64 L69 R70 I71	G63-N67 PolarHBondContact O-N 3.17Å; K64-N67 PolarHBondContact O-N 3.2Å; N67-L69 PolarHBondContact O-N 3.35Å; N67-R70 PolarHBondContact O-N 3.46Å; N67-I71 WeakPolarHBondContact O-CG1 3.44Å; N67-I71 PolarHBondContact O-N 3.45Å
68	A	37.3	Very low	36.5	Very low	50 Å²	50	109.7 Å²	109.7	41%	0.413	55%	0.548	S	S	.	.	H	α-helix	trans	-63.1	-38.3	176.2	0	0	0	0	0	113	K64 K65 R72	K64-A68 WeakPolarHBondContact O-CB 3.29Å; K64-A68 PolarHBondContact O-N 3.28Å; K65-A68 PolarHBondContact O-N 3.18Å; A68-R72 PolarHBondContact O-N 3.08Å; A68-R72 VanDerWaalsContact O-N 3.16Å
69	L	38.6	Very low	36.6	Very low	84 Å²	84	113.5 Å²	113.5	44%	0.44	56%	0.559	S	S	.	*	H	α-helix	trans	-66.9	-39.2	173.4	-74.2	168.5	0	0	0	112.1	K65 F66 N67 R72 S73 I221	K65-L69 WeakPolarHBondContact O-CG 3.26Å; K65-L69 PolarHBondContact O-N 3.34Å; F66-L69 PolarHBondContact O-N 3.18Å; N67-L69 PolarHBondContact O-N 3.35Å; L69-R72 PolarHBondContact O-N 2.72Å; L69-S73 PolarHBondContact O-N 2.87Å; L69-I221 HydrophobicContact CD1-CD1 4.45Å
70	R	36.9	Very low	36.5	Very low	180 Å²	180	111.3 Å²	111.3	68%	0.679	56%	0.558	S	S	*	*	H	α-helix	trans	-63.3	-41.3	176.4	-169.4	173.8	-177.1	155.3	1	112.1	F66 N67 S73 F74	F66-R70 PolarHBondContact O-N 2.8Å; N67-R70 PolarHBondContact O-N 3.46Å; R70-S73 PolarHBondContact O-N 3Å; R70-F74 PolarHBondContact O-N 3.45Å; R70-F74 VanDerWaalsContact O-N 3.16Å
71	I	36.5	Very low	36.3	Very low	103 Å²	103	116.5 Å²	116.5	53%	0.528	58%	0.575	S	S	.	*	H	α-helix	trans	-62.8	-49.9	175.7	-67.5	165.2	0	0	0	110.6	N67 S73 F74 E75	N67-I71 WeakPolarHBondContact O-CG1 3.44Å; N67-I71 PolarHBondContact O-N 3.45Å; I71-S73 VanDerWaalsContact C-N 3.3Å; I71-S73 PolarHBondContact O-N 3.3Å; I71-F74 WeakPolarHBondContact O-CB 3.48Å; I71-F74 PolarHBondContact O-N 2.93Å; I71-E75 HydrophobicContact CG2-CG 4.49Å; I71-E75 PolarHBondContact O-N 3.4Å
72	R	36.5	Very low	35.8	Very low	180 Å²	180	120.4 Å²	120.4	68%	0.679	60%	0.599	S	S	*	*	H	α-helix	trans	-61.4	-34.1	178	-75.1	-177.7	174.9	-178.8	-1	113.8	A68 L69 F74 K76	A68-R72 PolarHBondContact O-N 3.08Å; A68-R72 VanDerWaalsContact O-N 3.16Å; L69-R72 PolarHBondContact O-N 2.72Å; R72-F74 VanDerWaalsContact C-N 3.3Å; R72-K76 PolarHBondContact O-N 3.28Å; R72-K76 VanDerWaalsContact O-N 3.12Å
73	S	36.9	Very low	35.3	Very low	71 Å²	71	121.8 Å²	121.8	50%	0.497	61%	0.607	S	S	.	*	H	α-helix	trans	-69.6	-29.9	174.8	-164.3	0	0	0	0	112.4	L69 R70 I71 H77	L69-S73 PolarHBondContact O-N 2.87Å; R70-S73 PolarHBondContact O-N 3Å; I71-S73 VanDerWaalsContact C-N 3.3Å; I71-S73 PolarHBondContact O-N 3.3Å; S73-H77 PolarHBondContact O-N 3.32Å
74	F	31.9	Very low	35	Very low	149 Å²	149	125.7 Å²	125.7	65%	0.654	62%	0.623	S	S	*	*	H	α-helix	trans	-76	-43.6	175.7	-154.4	-96.3	0	0	0	111.1	R70 I71 R72 K76 H77 V78	R70-F74 PolarHBondContact O-N 3.45Å; R70-F74 VanDerWaalsContact O-N 3.16Å; I71-F74 WeakPolarHBondContact O-CB 3.48Å; I71-F74 PolarHBondContact O-N 2.93Å; R72-F74 VanDerWaalsContact C-N 3.3Å; F74-K76 VanDerWaalsContact C-N 3.28Å; F74-K76 PolarHBondContact O-N 3.5Å; F74-H77 PolarHBondContact O-N 3.25Å; F74-H77 VanDerWaalsContact O-N 3.07Å; F74-V78 HydrophobicContact CD1-CG2 3.97Å; F74-V78 HydrophobicContact CE1-CG2 3.92Å; F74-V78 WeakPolarHBondContact O-CG2 3.48Å; F74-V78 PolarHBondContact O-N 3.07Å
75	E	35.7	Very low	34.3	Very low	117 Å²	117	126.3 Å²	126.3	55%	0.547	64%	0.637	S	S	.	*	H	α-helix	trans	-59.1	-36	174	-69.7	178.6	145	0	0	112.9	I71 K79	I71-E75 HydrophobicContact CG2-CG 4.49Å; I71-E75 PolarHBondContact O-N 3.4Å; E75-K79 PolarHBondContact O-N 2.94Å
76	K	40.9	Very low	33.6	Very low	176 Å²	176	131 Å²	131	77%	0.765	65%	0.65	S	S	*	*	H	α-helix	trans	-67.3	-34	173.4	-94.5	-167.2	171.7	-170.5	0	113.7	R72 F74	R72-K76 PolarHBondContact O-N 3.28Å; R72-K76 VanDerWaalsContact O-N 3.12Å; F74-K76 VanDerWaalsContact C-N 3.28Å; F74-K76 PolarHBondContact O-N 3.5Å
77	H	37.8	Very low	33.1	Very low	153 Å²	153	138.4 Å²	138.4	71%	0.708	68%	0.676	S	S	*	*	H	α-helix	trans	-77.6	-32.7	175.9	-86.4	-50.2	0	0	0	112.7	S73 F74 K79 G80	S73-H77 PolarHBondContact O-N 3.32Å; F74-H77 PolarHBondContact O-N 3.25Å; F74-H77 VanDerWaalsContact O-N 3.07Å; H77-K79 VanDerWaalsContact C-N 3.29Å; H77-K79 PolarHBondContact O-N 3.14Å; H77-G80 PolarHBondContact O-N 3.1Å
78	V	35.8	Very low	32.4	Very low	105 Å²	105	145.8 Å²	145.8	64%	0.636	70%	0.698	S	S	*	*	H	α-helix	trans	-73.7	-18.1	177	176	0	0	0	0	112.9	F74	F74-V78 HydrophobicContact CD1-CG2 3.97Å; F74-V78 HydrophobicContact CE1-CG2 3.92Å; F74-V78 WeakPolarHBondContact O-CG2 3.48Å; F74-V78 PolarHBondContact O-N 3.07Å
79	K	35.3	Very low	31.7	Very low	188 Å²	188	154.3 Å²	154.3	82%	0.817	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.6	18.1	172.6	-69.1	-174.4	173.6	-178.1	0	113.9	E75 H77	E75-K79 PolarHBondContact O-N 2.94Å; H77-K79 VanDerWaalsContact C-N 3.29Å; H77-K79 PolarHBondContact O-N 3.14Å
80	G	32.1	Very low	30.9	Very low	60 Å²	60	154.9 Å²	154.9	62%	0.619	73%	0.731	S	S	*	*	S	Bend	trans	-96.8	-11	-175.3	0	0	0	0	0	115.9	H77	H77-G80 PolarHBondContact O-N 3.1Å
81	E	29.9	Very low	30.2	Very low	170 Å²	170	151.9 Å²	151.9	79%	0.794	74%	0.736	S	S	*	*	S	Bend	trans	-111.8	138	174.4	-68.1	179.9	142.4	0	0	108.8
82	N	26.7	Very low	29.5	Very low	163 Å²	163	153.4 Å²	153.4	87%	0.872	75%	0.75	S	S	*	*	S	Bend	trans	74.1	76	-167.3	-45.2	-38.8	0	0	0	115.3
83	D	28.8	Very low	28.8	Very low	159 Å²	159	149.1 Å²	149.1	85%	0.85	75%	0.747	S	S	*	*				-164.7	146.3	100.6	-135.7	-23.8	0	0	0	112.7
84	V	26	Very low	28.1	Very low	119 Å²	119	152.3 Å²	152.3	72%	0.721	76%	0.759	S	S	*	*			trans	-128.8	136.4	176.4	-179.7	0	0	0	0	109
85	T	25.1	Very low	27.7	Very low	126 Å²	126	153.7 Å²	153.7	77%	0.773	77%	0.765	S	S	*	*			trans	97.2	148.4	173.5	77.9	0	0	0	0	119
86	R	25.8	Very low	27.1	Very low	235 Å²	235	153.7 Å²	153.7	89%	0.887	77%	0.768	S	S	*	*			trans	63.4	110.3	168.6	-75.7	177.3	162.9	-179.1	-3.2	117
87	R	26.1	Very low	26.3	Very low	246 Å²	246	152.4 Å²	152.4	93%	0.928	77%	0.769	S	S	*	*				-156.8	159.9	53.1	-81.2	178.3	168.4	165.2	-3.3	113.3
88	R	20.5	Very low	25.9	Very low	227 Å²	227	150.4 Å²	150.4	86%	0.857	77%	0.77	S	S	*	*			trans	-102.3	166.7	172.1	-74	174.2	151	178.4	-7.8	111.3
89	R	22.9	Very low	25.3	Very low	229 Å²	229	157 Å²	157	86%	0.864	78%	0.783	S	S	*	*			trans	77.4	148.4	162.2	-56.1	-178.4	179.1	171.9	-2.1	116.1
90	S	21.3	Very low	24.8	Very low	96 Å²	96	152.2 Å²	152.2	67%	0.671	78%	0.779	S	S	*	*			cis	-172.9	-178.3	-21.9	53.9	0	0	0	0	109.2
91	C	21.6	Very low	24.5	Very low	117 Å²	117	158.9 Å²	158.9	79%	0.791	79%	0.794	S	S	*	*			trans	83.2	143.9	167.6	-51.8	0	0	0	0	117
92	V	21.5	Very low	24.2	Very low	136 Å²	136	155 Å²	155	82%	0.824	79%	0.79	S	S	*	*			cis	-160.7	164.1	-30	118.9	0	0	0	0	107.5
93	S	23	Very low	24	Very low	89 Å²	89	154.9 Å²	154.9	62%	0.622	79%	0.79	S	S	*	*			trans	-71.1	170.7	-176.8	49.8	0	0	0	0	116
94	L	21.3	Very low	24	Very low	139 Å²	139	155.1 Å²	155.1	73%	0.728	79%	0.786	S	S	*	*			trans	-153.8	137.8	142	-114.4	154	0	0	0	111.6
95	F	23.4	Very low	23.9	Very low	178 Å²	178	156 Å²	156	78%	0.781	78%	0.782	S	S	*	*			trans	81.5	64.2	177.9	-57.9	-70.8	0	0	0	119
96	D	24.3	Very low	23.9	Very low	116 Å²	116	158 Å²	158	62%	0.62	78%	0.78	S	S	*	*				28.4	144.2	88	-62.9	-25.8	0	0	0	118.6
97	L	24	Very low	23.9	Very low	150 Å²	150	152.7 Å²	152.7	79%	0.785	77%	0.774	S	S	*	*			cis	-162.7	-174.9	5.5	-112.9	171.9	0	0	0	110.3
98	P	29.2	Very low	23.8	Very low	111 Å²	111	146.9 Å²	146.9	72%	0.721	77%	0.77	S	S	*	*				-132.2	-160	-122	49	-31.3	0	0	0	117.1
99	R	23.1	Very low	24.1	Very low	243 Å²	243	140.6 Å²	140.6	92%	0.917	76%	0.761	S	S	*	*			trans	-67.7	150.1	168.4	-80.6	174.6	163	169.2	-7	114.3
100	A	24.9	Very low	24.2	Very low	88 Å²	88	135.2 Å²	135.2	73%	0.727	75%	0.753	S	S	*	*			trans	-150	115	143.3	0	0	0	0	0	106.4
101	E	25.3	Very low	24.5	Very low	199 Å²	199	141.4 Å²	141.4	93%	0.93	76%	0.762	S	S	*	*				99.9	163	86.7	-84.8	-172.9	173.4	0	0	111.8
102	A	24.2	Very low	24.8	Very low	88 Å²	88	141.9 Å²	141.9	73%	0.727	76%	0.761	S	S	*	*			trans	-133.1	161.5	-157.8	0	0	0	0	0	114.6
103	D	22.7	Very low	24.8	Very low	161 Å²	161	146.5 Å²	146.5	86%	0.861	76%	0.764	S	S	*	*			trans	86	151.7	156.6	-73.9	-38.8	0	0	0	123.1
104	E	26.9	Very low	25.1	Very low	165 Å²	165	151.6 Å²	151.6	77%	0.771	78%	0.778	S	S	*	*			trans	85.3	89	165	-55.2	-146	129.8	0	0	123
105	Q	25.1	Very low	25.2	Very low	136 Å²	136	154.8 Å²	154.8	64%	0.636	78%	0.78	S	S	*	*				57.7	127.8	114.3	-69.4	-170.8	43.1	0	0	124
106	K	25.5	Very low	25.3	Very low	170 Å²	170	154.2 Å²	154.2	74%	0.739	79%	0.785	S	S	*	*			trans	74	142.9	145.6	-65.9	165.6	177.9	153.2	0	117.2
107	T	25	Very low	25.3	Very low	122 Å²	122	155.8 Å²	155.8	75%	0.748	79%	0.788	S	S	*	*			cis	-161.8	168.5	4	4	0	0	0	0	112.7
108	C	24.6	Very low	25.2	Very low	125 Å²	125	154.5 Å²	154.5	85%	0.845	78%	0.782	S	S	*	*			trans	76.1	141.2	157.9	-82.1	0	0	0	0	119.3
109	S	25.8	Very low	25.1	Very low	95 Å²	95	157.7 Å²	157.7	66%	0.664	79%	0.787	S	S	*	*			cis	-164	160	-8	75	0	0	0	0	112.6
110	V	26.1	Very low	25	Very low	116 Å²	116	154.5 Å²	154.5	70%	0.703	78%	0.78	S	S	*	*			trans	57.8	118.8	144.2	173.3	0	0	0	0	116.3
111	R	26.8	Very low	24.9	Very low	226 Å²	226	155.7 Å²	155.7	85%	0.853	78%	0.778	S	S	*	*			cis	-169.9	165.1	44.9	-129.4	161.3	-157.8	162.2	3.8	106.3
112	T	27.9	Very low	24.8	Very low	126 Å²	126	151.7 Å²	151.7	77%	0.773	77%	0.772	S	S	*	*			cis	-148	175.9	4	-36.8	0	0	0	0	108.1
113	R	22	Very low	24.7	Very low	234 Å²	234	152.3 Å²	152.3	88%	0.883	77%	0.771	S	S	*	*			trans	-108.5	152.2	159.3	-74.1	171.9	166.9	164.9	-4.7	109.5
114	Q	28.6	Very low	24.8	Very low	196 Å²	196	150.4 Å²	150.4	92%	0.916	77%	0.765	S	S	*	*			trans	-143.6	142.9	132.8	-125.8	176.1	9.1	0	0	111.9
115	R	23.2	Very low	24.7	Very low	206 Å²	206	149.3 Å²	149.3	78%	0.777	77%	0.765	S	S	*	*			trans	-125.2	136	-175.4	-172.3	-172.1	-163.9	169.6	3	104.1
116	N	26.5	Very low	24.6	Very low	166 Å²	166	147.5 Å²	147.5	89%	0.888	77%	0.773	S	S	*	*			trans	-146.4	145.2	157.9	-100.9	-13.7	0	0	0	109.5
117	Q	24.1	Very low	24.6	Very low	148 Å²	148	144.6 Å²	144.6	69%	0.692	77%	0.769	S	S	*	*			trans	-140.4	146.6	-170.6	-118.8	-176.9	-6	0	0	108.1
118	L	22.8	Very low	24.7	Very low	123 Å²	123	145.6 Å²	145.6	64%	0.644	77%	0.769	S	S	*	*			trans	69.6	121.2	153.3	-61.1	162.6	0	0	0	119.5
119	H	25.3	Very low	24.6	Very low	178 Å²	178	148.3 Å²	148.3	82%	0.824	77%	0.77	S	S	*	*				176	118.5	114.7	-89.5	-75.2	0	0	0	106.2
120	F	21.7	Very low	24.5	Very low	177 Å²	177	151.5 Å²	151.5	78%	0.776	77%	0.774	S	S	*	*				51.1	128	74.7	-86.9	-63.1	0	0	0	112.6
121	T	22.9	Very low	24.4	Very low	113 Å²	113	152 Å²	152	69%	0.693	78%	0.777	S	S	*	*			cis	-159	157.5	24.2	23.3	0	0	0	0	113.3
122	S	23.3	Very low	24.2	Very low	115 Å²	115	145.1 Å²	145.1	80%	0.804	77%	0.769	S	S	*	*			trans	68	156.9	153.5	77.4	0	0	0	0	118
123	S	22.9	Very low	24.2	Very low	101 Å²	101	144.6 Å²	144.6	71%	0.706	77%	0.77	S	S	*	*			cis	-154.6	155.5	9.6	-156.2	0	0	0	0	111.9
124	V	24.4	Very low	24.4	Very low	120 Å²	120	138.3 Å²	138.3	73%	0.727	76%	0.758	S	S	*	*			trans	39.4	111.4	152.6	177.3	0	0	0	0	118.5
125	D	24.5	Very low	24.3	Very low	143 Å²	143	134 Å²	134	77%	0.765	75%	0.746	S	S	*	*				-151.9	134.5	106.8	-124.6	-23.9	0	0	0	112.4
126	A	23.4	Very low	24.7	Very low	98 Å²	98	126.8 Å²	126.8	81%	0.81	72%	0.723	S	S	*	*			trans	-120.6	90.3	-178.9	0	0	0	0	0	109.1
127	T	25.4	Very low	25	Very low	108 Å²	108	126.8 Å²	126.8	66%	0.663	72%	0.715	S	S	*	*			trans	-130.6	115.5	-178.8	46.2	0	0	0	0	112.9
128	L	26.1	Very low	25.3	Very low	143 Å²	143	129.9 Å²	129.9	75%	0.749	72%	0.721	S	S	*	*			trans	55.9	96.6	161.5	-69.5	102.6	0	0	0	118.7	H130	L128-H130 PolarHBondContact O-N 2.98Å
129	E	22.4	Very low	25.9	Very low	182 Å²	182	130.4 Å²	130.4	85%	0.85	72%	0.724	S	S	*	*			trans	-63.3	82.9	148.1	-66.6	-170.8	144.2	0	0	111.2
130	H	24.4	Very low	26.4	Very low	163 Å²	163	125.4 Å²	125.4	76%	0.755	70%	0.701	S	S	*	*			trans	-92.8	84.8	149.3	-94.3	-54.9	0	0	0	108.7	L128 A132	L128-H130 PolarHBondContact O-N 2.98Å; H130-A132 PolarHBondContact O-N 3.37Å
131	T	23.9	Very low	26.9	Very low	126 Å²	126	120.7 Å²	120.7	77%	0.773	69%	0.687	S	S	*	*			trans	-68.6	73.6	164.9	40.5	0	0	0	0	109.5	S133	T131-S133 PolarHBondContact O-N 3Å
132	A	23.5	Very low	27.3	Very low	82 Å²	82	117.3 Å²	117.3	68%	0.678	66%	0.663	S	S	*	*			trans	-53.6	114	170.3	0	0	0	0	0	108.1	H130 V134	H130-A132 PolarHBondContact O-N 3.37Å; A132-V134 VanDerWaalsContact C-N 3.27Å; A132-V134 PolarHBondContact O-N 3.06Å
133	S	26	Very low	27.9	Very low	114 Å²	114	116.3 Å²	116.3	80%	0.797	66%	0.656	S	S	*	*			trans	-70.9	82.2	-174.3	56.5	0	0	0	0	110.3	T131 P135	T131-S133 PolarHBondContact O-N 3Å; S133-P135 VanDerWaalsContact O-CD 3.27Å; S133-P135 WeakPolarHBondContact O-CD 3.31Å; S133-P135 VanDerWaalsContact O-N 3.17Å
134	V	27	Very low	28.1	Very low	103 Å²	103	120.8 Å²	120.8	62%	0.624	67%	0.665	S	S	*	*			trans	-62.6	115	174.4	-178.5	0	0	0	0	107.6	A132 L136	A132-V134 VanDerWaalsContact C-N 3.27Å; A132-V134 PolarHBondContact O-N 3.06Å; V134-L136 PolarHBondContact O-N 3.3Å
135	P	27.2	Very low	28.3	Very low	104 Å²	104	117 Å²	117	68%	0.675	65%	0.651	S	S	*	*			trans	-65.5	138.4	177.1	27.6	-33.2	0	0	0	109	S133 K137	S133-P135 VanDerWaalsContact O-CD 3.27Å; S133-P135 WeakPolarHBondContact O-CD 3.31Å; S133-P135 VanDerWaalsContact O-N 3.17Å; P135-K137 PolarHBondContact O-N 3.45Å
136	L	32	Very low	28.5	Very low	55 Å²	55	115.9 Å²	115.9	29%	0.288	65%	0.649	S	S	.	*			trans	-49.5	108.9	168	-79.2	167.2	0	0	0	108.7	V134 R138 F179 M248	V134-L136 PolarHBondContact O-N 3.3Å; L136-R138 PolarHBondContact O-N 3.36Å; L136-F179 HydrophobicContact CD1-CD1 4.39Å; L136-F179 HydrophobicContact CD1-CD2 3.8Å; L136-F179 HydrophobicContact CD1-CE2 3.97Å; L136-F179 HydrophobicContact CD1-CG 4.03Å; L136-F179 HydrophobicContact CD1-CZ 4.34Å; L136-F179 HydrophobicContact CD2-CD2 4.11Å; L136-F179 HydrophobicContact CD2-CE2 3.46Å; L136-F179 VanDerWaalsContact CD2-CE2 3.46Å; L136-F179 HydrophobicContact CD2-CZ 3.76Å; L136-F179 HydrophobicContact CG-CD1 4.38Å; L136-F179 HydrophobicContact CG-CD2 4Å; L136-F179 HydrophobicContact CG-CE1 4.03Å; L136-F179 HydrophobicContact CG-CE2 3.64Å; L136-F179 HydrophobicContact CG-CG 4.37Å; L136-F179 HydrophobicContact CG-CZ 3.66Å; L136-M248 HydrophobicContact CD1-SD 4.28Å
137	K	31.3	Very low	29.2	Very low	167 Å²	167	114 Å²	114	73%	0.726	63%	0.627	S	S	*	*			trans	-60.8	130.5	172.6	-72.1	-177.8	177.4	178	0	106.9	P135 N139 Q140	P135-K137 PolarHBondContact O-N 3.45Å; K137-N139 PolarHBondContact O-N 3.02Å; K137-Q140 PolarHBondContact O-N 3.16Å
138	R	31.2	Very low	29.7	Very low	213 Å²	213	116 Å²	116	80%	0.804	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50.5	-19.1	-179.5	-83.7	-179	168.8	142.8	-2.9	114.7	L136	L136-R138 PolarHBondContact O-N 3.36Å
139	N	34.8	Very low	30.4	Very low	134 Å²	134	113.6 Å²	113.6	72%	0.717	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.2	26.2	-171.2	-47.4	6.3	0	0	0	112.5	K137 T141	K137-N139 PolarHBondContact O-N 3.02Å; N139-T141 PolarHBondContact O-N 2.86Å
140	Q	36.8	Very low	31	Very low	72 Å²	72	107.1 Å²	107.1	34%	0.336	59%	0.593	S	S	.	*			trans	-70.1	100.1	172.2	-84.4	-167.8	-10.7	0	0	110.2	K137	K137-Q140 PolarHBondContact O-N 3.16Å
141	T	32.3	Very low	31.5	Very low	79 Å²	79	101.3 Å²	101.3	49%	0.485	57%	0.57	S	S	.	*	P	Polyproline II helix	trans	-89	158.9	173.7	59.9	0	0	0	0	111.2	N139 K244	N139-T141 PolarHBondContact O-N 2.86Å; T141-K244 WeakPolarHBondContact CA-O 3.39Å; T141-K244 VanDerWaalsContact CB-O 3.3Å; T141-K244 WeakPolarHBondContact CB-O 3.38Å
142	F	31.3	Very low	32.1	Very low	42 Å²	42	98.4 Å²	98.4	18%	0.184	56%	0.555	C	S	.	*	P	Polyproline II helix	trans	-59.2	146.3	163.8	-75.6	-122.9	0	0	0	109.3	D170 V171 V243 K244 I247	F142-D170 HydrophobicContact CD1-CB 3.35Å; F142-D170 WeakPolarHBondContact CD1-OD2 3.5Å; F142-D170 HydrophobicContact CE1-CB 3.37Å; F142-D170 HydrophobicContact CG-CB 4.26Å; F142-D170 HydrophobicContact CZ-CB 4.27Å; F142-V171 HydrophobicContact CZ-CG2 4.25Å; F142-V243 HydrophobicContact CE2-CG1 3.66Å; F142-V243 VanDerWaalsContact CE2-O 3.3Å; F142-V243 WeakPolarHBondContact CE2-O 3.27Å; F142-V243 HydrophobicContact CZ-CG1 3.82Å; F142-K244 PolarHBondContact N-O 2.92Å; F142-K244 VanDerWaalsContact N-O 3.16Å; F142-I247 HydrophobicContact CE2-CG1 4.17Å
143	S	35	Very low	32.7	Very low	94 Å²	94	97.3 Å²	97.3	66%	0.657	54%	0.537	S	S	*	.	P	Polyproline II helix	trans	-58	150.9	-178.7	50.3	0	0	0	0	112	G145	S143-G145 PolarHBondContact O-N 3.11Å
144	E	27.3	Very low	33.2	Very low	194 Å²	194	95.1 Å²	95.1	91%	0.907	51%	0.513	S	S	*	.			trans	-72.1	59.4	-173.4	-65	-172	136.5	0	0	114
145	G	29.1	Very low	33.5	Very low	41 Å²	41	94.6 Å²	94.6	42%	0.423	51%	0.511	S	S	.	.			trans	-75.9	131.3	155.1	0	0	0	0	0	109.9	S143 V147	S143-G145 PolarHBondContact O-N 3.11Å; G145-V147 PolarHBondContact O-N 3.45Å
146	V	28.8	Very low	33.6	Very low	120 Å²	120	93.3 Å²	93.3	73%	0.727	50%	0.503	S	S	*	.			trans	-72	78.3	176.5	-178.4	0	0	0	0	110.1	N148	V146-N148 HydrophobicContact CG1-CB 4.22Å; V146-N148 VanDerWaalsContact CG1-CG 3.41Å; V146-N148 WeakPolarHBondContact CG1-ND2 3.41Å; V146-N148 WeakPolarHBondContact CG1-OD1 3.3Å; V146-N148 PolarHBondContact O-N 3.03Å
147	V	36.4	Very low	33.5	Very low	57 Å²	57	100.6 Å²	100.6	35%	0.345	53%	0.533	S	S	.	.			trans	-78.9	75.1	170.1	-173.8	0	0	0	0	108.7	G145 D149 I153	G145-V147 PolarHBondContact O-N 3.45Å; V147-D149 VanDerWaalsContact C-N 3.3Å; V147-I153 HydrophobicContact CG1-CD1 3.85Å; V147-I153 HydrophobicContact CG1-CG1 4.15Å; V147-I153 HydrophobicContact CG2-CD1 4.5Å
148	N	36.6	Very low	33.3	Very low	151 Å²	151	100.5 Å²	100.5	81%	0.807	53%	0.529	S	S	*	.			trans	-79.5	-10.6	175.8	-84.8	-4.7	0	0	0	113.5	V146	V146-N148 HydrophobicContact CG1-CB 4.22Å; V146-N148 VanDerWaalsContact CG1-CG 3.41Å; V146-N148 WeakPolarHBondContact CG1-ND2 3.41Å; V146-N148 WeakPolarHBondContact CG1-OD1 3.3Å; V146-N148 PolarHBondContact O-N 3.03Å
149	D	40.1	Very low	33	Very low	93 Å²	93	94.3 Å²	94.3	50%	0.497	53%	0.532	S	S	.	.			trans	-128.6	123.1	178	-169.5	-1.7	0	0	0	111.1	V147 S151 S152	V147-D149 VanDerWaalsContact C-N 3.3Å; D149-S151 PolarHBondContact O-N 3.31Å; D149-S151 WeakPolarHBondContact OD1-CB 3.46Å; D149-S151 PolarHBondContact OD1-N 2.91Å; D149-S151 PolarHBondContact OD1-OG 2.72Å; D149-S151 WeakPolarHBondContact OD2-CB 3.2Å; D149-S151 PolarHBondContact OD2-OG 3.12Å; D149-S152 PolarHBondContact O-N 3.49Å; D149-S152 PolarHBondContact O-OG 2.93Å; D149-S152 VanDerWaalsContact O-OG 3.1Å
150	L	36.6	Very low	32.9	Very low	46 Å²	46	91.4 Å²	91.4	24%	0.241	52%	0.521	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-30.2	172.5	-72.1	166.9	0	0	0	111.3	S152 F154 F233 F240	L150-S152 PolarHBondContact O-N 3.15Å; L150-F154 HydrophobicContact CB-CD2 4.36Å; L150-F154 HydrophobicContact CB-CE2 4.03Å; L150-F154 HydrophobicContact CD2-CE2 4.09Å; L150-F154 WeakPolarHBondContact O-CD2 3.34Å; L150-F154 VanDerWaalsContact O-CE2 3.3Å; L150-F154 WeakPolarHBondContact O-CE2 3.47Å; L150-F233 HydrophobicContact CD1-CE2 3.59Å; L150-F233 HydrophobicContact CD1-CZ 3.67Å; L150-F240 HydrophobicContact CD2-CD1 4.09Å; L150-F240 HydrophobicContact CD2-CE1 4.33Å; L150-F240 HydrophobicContact CD2-CG 4.36Å
151	S	35	Very low	33	Very low	41 Å²	41	95.6 Å²	95.6	29%	0.287	55%	0.546	S	S	.	.	H	α-helix	trans	-56.2	-32.6	180	80.3	0	0	0	0	113.4	D149 I153 F154 T155	D149-S151 PolarHBondContact O-N 3.31Å; D149-S151 WeakPolarHBondContact OD1-CB 3.46Å; D149-S151 PolarHBondContact OD1-N 2.91Å; D149-S151 PolarHBondContact OD1-OG 2.72Å; D149-S151 WeakPolarHBondContact OD2-CB 3.2Å; D149-S151 PolarHBondContact OD2-OG 3.12Å; S151-I153 PolarHBondContact O-N 3.18Å; S151-F154 PolarHBondContact O-N 2.73Å; S151-T155 VanDerWaalsContact O-CB 3.32Å; S151-T155 WeakPolarHBondContact O-CB 3.33Å; S151-T155 VanDerWaalsContact O-CG2 3.28Å; S151-T155 WeakPolarHBondContact O-CG2 3.12Å; S151-T155 PolarHBondContact O-N 2.88Å; S151-T155 PolarHBondContact O-OG1 3.12Å
152	S	35.5	Very low	33.3	Very low	64 Å²	64	101.4 Å²	101.4	45%	0.448	56%	0.559	S	S	.	*	H	α-helix	trans	-72	-31.1	-170.9	70	0	0	0	0	113.9	D149 L150	D149-S152 PolarHBondContact O-N 3.49Å; D149-S152 PolarHBondContact O-OG 2.93Å; D149-S152 VanDerWaalsContact O-OG 3.1Å; L150-S152 PolarHBondContact O-N 3.15Å
153	I	35.5	Very low	34	Very low	60 Å²	60	101.3 Å²	101.3	31%	0.308	57%	0.567	S	S	.	*	H	α-helix	trans	-79	-28.2	175.2	-66.1	177.3	0	0	0	110.7	V147 S151 C156 F240	V147-I153 HydrophobicContact CG1-CD1 3.85Å; V147-I153 HydrophobicContact CG1-CG1 4.15Å; V147-I153 HydrophobicContact CG2-CD1 4.5Å; S151-I153 PolarHBondContact O-N 3.18Å; I153-C156 WeakPolarHBondContact O-CB 3.34Å; I153-F240 HydrophobicContact CD1-CE2 3.56Å; I153-F240 HydrophobicContact CD1-CZ 3.92Å
154	F	36.7	Very low	34.8	Very low	67 Å²	67	99.5 Å²	99.5	29%	0.294	55%	0.549	S	S	.	.	H	α-helix	trans	-96.7	-14.9	-176.2	-50.8	-48.6	0	0	0	114.2	L150 S151 C156 I201	L150-F154 HydrophobicContact CB-CD2 4.36Å; L150-F154 HydrophobicContact CB-CE2 4.03Å; L150-F154 HydrophobicContact CD2-CE2 4.09Å; L150-F154 WeakPolarHBondContact O-CD2 3.34Å; L150-F154 VanDerWaalsContact O-CE2 3.3Å; L150-F154 WeakPolarHBondContact O-CE2 3.47Å; S151-F154 PolarHBondContact O-N 2.73Å; F154-C156 PolarHBondContact O-N 3.3Å; F154-I201 HydrophobicContact CD1-CD1 3.88Å; F154-I201 HydrophobicContact CD2-CD1 4.15Å; F154-I201 HydrophobicContact CD2-CG2 3.9Å; F154-I201 HydrophobicContact CE1-CD1 3.42Å; F154-I201 VanDerWaalsContact CE1-CD1 3.42Å; F154-I201 HydrophobicContact CE2-CD1 3.73Å; F154-I201 HydrophobicContact CE2-CG2 4.39Å; F154-I201 HydrophobicContact CG-CD1 4.26Å; F154-I201 HydrophobicContact CG-CG2 4.12Å; F154-I201 HydrophobicContact CZ-CD1 3.37Å
155	T	33.1	Very low	36.1	Very low	93 Å²	93	90.5 Å²	90.5	57%	0.571	51%	0.507	S	S	*	.			trans	-85.1	16.4	167.8	51.3	0	0	0	0	113	S151 K157	S151-T155 VanDerWaalsContact O-CB 3.32Å; S151-T155 WeakPolarHBondContact O-CB 3.33Å; S151-T155 VanDerWaalsContact O-CG2 3.28Å; S151-T155 WeakPolarHBondContact O-CG2 3.12Å; S151-T155 PolarHBondContact O-N 2.88Å; S151-T155 PolarHBondContact O-OG1 3.12Å; T155-K157 VanDerWaalsContact C-N 3.33Å; T155-K157 PolarHBondContact O-N 3.16Å
156	C	30.8	Very low	37.4	Very low	76 Å²	76	89.5 Å²	89.5	51%	0.514	49%	0.493	S	S	.	.			trans	-58.9	91.1	175.6	-151.7	0	0	0	0	110.3	I153 F154 Y158	I153-C156 WeakPolarHBondContact O-CB 3.34Å; F154-C156 PolarHBondContact O-N 3.3Å; C156-Y158 PolarHBondContact O-N 2.92Å; C156-Y158 WeakPolarHBondContact SG-CD2 3.4Å
157	K	29.4	Very low	38.7	Very low	209 Å²	209	87.6 Å²	87.6	91%	0.909	48%	0.482	S	S	*	.			trans	-69	43.3	172.5	-74.5	-171.9	175.4	-178.1	0	111.8	T155 G159	T155-K157 VanDerWaalsContact C-N 3.33Å; T155-K157 PolarHBondContact O-N 3.16Å; K157-G159 PolarHBondContact O-N 3.32Å
158	Y	27.6	Very low	39.6	Very low	164 Å²	164	87 Å²	87	64%	0.643	48%	0.477	S	S	*	.			trans	-83.9	91.2	160.6	-83.2	-97.2	0	0	0	106.9	C156 S160	C156-Y158 PolarHBondContact O-N 2.92Å; C156-Y158 WeakPolarHBondContact SG-CD2 3.4Å; Y158-S160 PolarHBondContact O-N 2.94Å
159	G	25	Very low	40.3	Very low	84 Å²	84	86.7 Å²	86.7	87%	0.866	47%	0.468	S	S	*	.			trans	-65.1	92.9	179.9	0	0	0	0	0	111.7	K157	K157-G159 PolarHBondContact O-N 3.32Å
160	S	31.3	Very low	40.7	Very low	72 Å²	72	85.3 Å²	85.3	50%	0.503	46%	0.461	S	S	.	.	S	Bend	trans	-179.8	142.7	158.9	-171.9	0	0	0	0	109.4	Y158 R162	Y158-S160 PolarHBondContact O-N 2.94Å; S160-R162 PolarHBondContact O-N 2.88Å
161	D	38.4	Very low	41.4	Very low	161 Å²	161	83.1 Å²	83.1	86%	0.861	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	17.2	171.5	-79	-46	0	0	0	114.6
162	R	40.7	Very low	42.5	Very low	200 Å²	200	85.1 Å²	85.1	76%	0.755	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.5	12.5	-168.8	-62.2	-172.5	177.7	-170.9	0.6	115.3	S160 L164	S160-R162 PolarHBondContact O-N 2.88Å; R162-L164 PolarHBondContact O-N 3.01Å
163	A	44.9	Very low	43.4	Very low	41 Å²	41	89 Å²	89	34%	0.339	48%	0.475	S	S	.	.			trans	-66.1	98	173.2	0	0	0	0	0	111.2
164	L	51.5	Low	44.3	Very low	55 Å²	55	87.3 Å²	87.3	29%	0.288	47%	0.469	S	S	.	.			trans	-74.1	151.3	175.6	-67.4	175.7	0	0	0	110.2	R162 S166 T167 E191	R162-L164 PolarHBondContact O-N 3.01Å; L164-S166 PolarHBondContact O-N 3.5Å; L164-T167 HydrophobicContact CB-CG2 3.91Å; L164-T167 HydrophobicContact CD1-CG2 4.42Å; L164-T167 PolarHBondContact N-OG1 3.24Å; L164-T167 PolarHBondContact O-N 2.93Å; L164-T167 PolarHBondContact O-OG1 3.19Å; L164-E191 WeakPolarHBondContact CA-OE1 3.28Å; L164-E191 WeakPolarHBondContact CB-OE1 3.27Å; L164-E191 VanDerWaalsContact CD2-CD 3.44Å; L164-E191 HydrophobicContact CD2-CG 4.42Å; L164-E191 VanDerWaalsContact CD2-OE1 3.32Å; L164-E191 WeakPolarHBondContact CD2-OE1 3.36Å; L164-E191 WeakPolarHBondContact CD2-OE2 3.46Å
165	W	55.3	Low	45.2	Very low	5 Å²	5	85.5 Å²	85.5	2%	0.019	47%	0.469	C	S	.	.	G	3₁₀ helix	trans	-60.7	-37.6	175.5	169.1	84.6	0	0	0	110.7	T167 L168 V171 L177 L182 Q187 C190 E191 Y194 I247	W165-T167 PolarHBondContact O-N 3.23Å; W165-L168 WeakPolarHBondContact O-CB 3.42Å; W165-L168 PolarHBondContact O-N 3.19Å; W165-V171 HydrophobicContact CD2-CG1 4.25Å; W165-V171 HydrophobicContact CD2-CG2 4.48Å; W165-V171 HydrophobicContact CE3-CG1 4.2Å; W165-V171 HydrophobicContact CH2-CG1 3.87Å; W165-V171 HydrophobicContact CZ2-CG1 3.93Å; W165-V171 HydrophobicContact CZ2-CG2 4.26Å; W165-V171 HydrophobicContact CZ3-CG1 4Å; W165-L177 HydrophobicContact CZ3-CD2 4.27Å; W165-L182 HydrophobicContact CH2-CD2 4.21Å; W165-L182 HydrophobicContact CZ3-CD2 4.17Å; W165-Q187 HydrophobicContact CE3-CG 4.34Å; W165-Q187 HydrophobicContact CZ3-CG 4.19Å; W165-C190 HydrophobicContact CD2-CB 3.76Å; W165-C190 HydrophobicContact CE3-CB 3.94Å; W165-C190 HydrophobicContact CG-CB 4.27Å; W165-C190 HydrophobicContact CH2-CB 4.23Å; W165-C190 HydrophobicContact CZ2-CB 4.05Å; W165-C190 HydrophobicContact CZ3-CB 4.18Å; W165-E191 HydrophobicContact CB-CB 4.08Å; W165-E191 PolarHBondContact N-OE1 3.27Å; W165-Y194 HydrophobicContact CB-CD1 4.35Å; W165-Y194 HydrophobicContact CB-CG 4.37Å; W165-I247 HydrophobicContact CH2-CG2 4.12Å; W165-I247 HydrophobicContact CZ2-CG2 3.65Å
166	S	55.8	Low	46	Very low	20 Å²	20	81.2 Å²	81.2	14%	0.14	44%	0.443	C	S	.	.	G	3₁₀ helix	trans	-68.8	-6.6	173.7	56.3	0	0	0	0	114.8	L164 L177	L164-S166 PolarHBondContact O-N 3.5Å; S166-L177 VanDerWaalsContact O-CD1 3.24Å; S166-L177 WeakPolarHBondContact O-CD1 3.46Å
167	T	57.3	Low	47	Very low	81 Å²	81	80.5 Å²	80.5	50%	0.497	43%	0.434	S	S	.	.	G	3₁₀ helix	trans	-102.1	1.2	175.2	59.3	0	0	0	0	113.6	L164 W165 K169	L164-T167 HydrophobicContact CB-CG2 3.91Å; L164-T167 HydrophobicContact CD1-CG2 4.42Å; L164-T167 PolarHBondContact N-OG1 3.24Å; L164-T167 PolarHBondContact O-N 2.93Å; L164-T167 PolarHBondContact O-OG1 3.19Å; W165-T167 PolarHBondContact O-N 3.23Å; T167-K169 PolarHBondContact O-N 3.37Å
168	L	54.2	Low	47.7	Very low	44 Å²	44	74 Å²	74	23%	0.23	43%	0.426	C	S	.	.	S	Bend	trans	-67.5	124.2	169	-67.8	171.7	0	0	0	109.2	W165 D170 V171 T172 Y194	W165-L168 WeakPolarHBondContact O-CB 3.42Å; W165-L168 PolarHBondContact O-N 3.19Å; L168-D170 PolarHBondContact O-N 2.9Å; L168-D170 VanDerWaalsContact O-N 3.1Å; L168-V171 HydrophobicContact CB-CB 4.17Å; L168-V171 HydrophobicContact CB-CG2 3.86Å; L168-V171 HydrophobicContact CD1-CG2 4.2Å; L168-V171 WeakPolarHBondContact O-CA 3.39Å; L168-V171 WeakPolarHBondContact O-CB 3.24Å; L168-V171 PolarHBondContact O-N 3.48Å; L168-T172 PolarHBondContact O-N 2.94Å; L168-T172 PolarHBondContact O-OG1 3.34Å; L168-Y194 HydrophobicContact CD1-CD2 4.49Å; L168-Y194 HydrophobicContact CD1-CE1 4.48Å; L168-Y194 HydrophobicContact CD1-CE2 4.07Å
169	K	51.3	Low	48.7	Very low	144 Å²	144	70 Å²	70	63%	0.626	41%	0.412	S	S	*	.	H	α-helix	trans	-48.2	-43.8	-177.8	-82.6	-175.3	173.7	-180	0	112.4	T167 V171 T172 L173	T167-K169 PolarHBondContact O-N 3.37Å; K169-V171 PolarHBondContact O-N 3.03Å; K169-T172 WeakPolarHBondContact O-CB 3.24Å; K169-T172 PolarHBondContact O-N 3.39Å; K169-L173 WeakPolarHBondContact O-CB 3.42Å; K169-L173 WeakPolarHBondContact O-CG 3.21Å; K169-L173 PolarHBondContact O-N 3.04Å
170	D	48.6	Very low	49.4	Very low	64 Å²	64	72 Å²	72	34%	0.342	41%	0.413	S	S	.	.	H	α-helix	trans	-70.2	-32.5	-177.1	-45.8	-51.9	0	0	0	112.5	F142 L168 L173 S174	F142-D170 HydrophobicContact CD1-CB 3.35Å; F142-D170 WeakPolarHBondContact CD1-OD2 3.5Å; F142-D170 HydrophobicContact CE1-CB 3.37Å; F142-D170 HydrophobicContact CG-CB 4.26Å; F142-D170 HydrophobicContact CZ-CB 4.27Å; L168-D170 PolarHBondContact O-N 2.9Å; L168-D170 VanDerWaalsContact O-N 3.1Å; D170-L173 PolarHBondContact O-N 2.95Å; D170-S174 VanDerWaalsContact O-CB 3.31Å; D170-S174 WeakPolarHBondContact O-CB 3.16Å; D170-S174 PolarHBondContact O-N 3.4Å
171	V	51.1	Low	49.9	Very low	0 Å²	0	77.8 Å²	77.8	0%	0	43%	0.429	C	S	.	.	H	α-helix	trans	-69	-40.4	172.4	178	0	0	0	0	110	F142 W165 L168 K169 S174 L177	F142-V171 HydrophobicContact CZ-CG2 4.25Å; W165-V171 HydrophobicContact CD2-CG1 4.25Å; W165-V171 HydrophobicContact CD2-CG2 4.48Å; W165-V171 HydrophobicContact CE3-CG1 4.2Å; W165-V171 HydrophobicContact CH2-CG1 3.87Å; W165-V171 HydrophobicContact CZ2-CG1 3.93Å; W165-V171 HydrophobicContact CZ2-CG2 4.26Å; W165-V171 HydrophobicContact CZ3-CG1 4Å; L168-V171 HydrophobicContact CB-CB 4.17Å; L168-V171 HydrophobicContact CB-CG2 3.86Å; L168-V171 HydrophobicContact CD1-CG2 4.2Å; L168-V171 WeakPolarHBondContact O-CA 3.39Å; L168-V171 WeakPolarHBondContact O-CB 3.24Å; L168-V171 PolarHBondContact O-N 3.48Å; K169-V171 PolarHBondContact O-N 3.03Å; V171-S174 PolarHBondContact O-OG 3.41Å; V171-L177 HydrophobicContact CG1-CD1 4.36Å; V171-L177 HydrophobicContact CG1-CD2 4.47Å; V171-L177 HydrophobicContact CG1-CG 4.24Å
172	T	58.1	Low	50.2	Low	84 Å²	84	71.3 Å²	71.3	52%	0.515	39%	0.394	S	S	.	.	H	α-helix	trans	-64.1	-44.2	173.1	-41.7	0	0	0	0	111.8	L168 K169 G175	L168-T172 PolarHBondContact O-N 2.94Å; L168-T172 PolarHBondContact O-OG1 3.34Å; K169-T172 WeakPolarHBondContact O-CB 3.24Å; K169-T172 PolarHBondContact O-N 3.39Å; T172-G175 PolarHBondContact O-N 3.49Å
173	L	54.3	Low	50.8	Low	144 Å²	144	64.2 Å²	64.2	75%	0.754	38%	0.376	S	S	*	.	H	α-helix	trans	-70.4	-29.1	-179.8	-72.8	166.2	0	0	0	113.4	K169 D170 G175	K169-L173 WeakPolarHBondContact O-CB 3.42Å; K169-L173 WeakPolarHBondContact O-CG 3.21Å; K169-L173 PolarHBondContact O-N 3.04Å; D170-L173 PolarHBondContact O-N 2.95Å; L173-G175 PolarHBondContact O-N 3.32Å
174	S	55	Low	51.2	Low	25 Å²	25	65 Å²	65	18%	0.175	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-14.6	175.3	72.4	0	0	0	0	114.2	D170 V171 A176 I247	D170-S174 VanDerWaalsContact O-CB 3.31Å; D170-S174 WeakPolarHBondContact O-CB 3.16Å; D170-S174 PolarHBondContact O-N 3.4Å; V171-S174 PolarHBondContact O-OG 3.41Å; S174-A176 PolarHBondContact O-N 3.01Å; S174-A176 VanDerWaalsContact OG-CB 3.26Å; S174-A176 WeakPolarHBondContact OG-CB 3.18Å; S174-A176 PolarHBondContact OG-N 3.45Å; S174-I247 WeakPolarHBondContact OG-CD1 3.41Å
175	G	54.2	Low	51.1	Low	30 Å²	30	63.2 Å²	63.2	31%	0.309	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.1	0.6	-172.8	0	0	0	0	0	114.5	T172 L173 L177 G178 F179	T172-G175 PolarHBondContact O-N 3.49Å; L173-G175 PolarHBondContact O-N 3.32Å; G175-L177 PolarHBondContact O-N 2.87Å; G175-G178 PolarHBondContact O-N 2.93Å; G175-F179 WeakPolarHBondContact O-CD2 3.46Å
176	A	50.7	Low	50.8	Low	3 Å²	3	66 Å²	66	3%	0.025	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-26.6	-176.6	0	0	0	0	0	114.4	S174 I247	S174-A176 PolarHBondContact O-N 3.01Å; S174-A176 VanDerWaalsContact OG-CB 3.26Å; S174-A176 WeakPolarHBondContact OG-CB 3.18Å; S174-A176 PolarHBondContact OG-N 3.45Å; A176-I247 HydrophobicContact CB-CG2 3.87Å
177	L	51.9	Low	50.8	Low	60 Å²	60	67.9 Å²	67.9	31%	0.314	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-20.1	177.3	-60.8	168.5	0	0	0	113.9	W165 S166 V171 G175	W165-L177 HydrophobicContact CZ3-CD2 4.27Å; S166-L177 VanDerWaalsContact O-CD1 3.24Å; S166-L177 WeakPolarHBondContact O-CD1 3.46Å; V171-L177 HydrophobicContact CG1-CD1 4.36Å; V171-L177 HydrophobicContact CG1-CD2 4.47Å; V171-L177 HydrophobicContact CG1-CG 4.24Å; G175-L177 PolarHBondContact O-N 2.87Å
178	G	44.3	Very low	50.5	Low	72 Å²	72	72.5 Å²	72.5	74%	0.742	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-13.4	179.5	0	0	0	0	0	113.9	G175 S180	G175-G178 PolarHBondContact O-N 2.93Å; G178-S180 PolarHBondContact O-N 2.89Å
179	F	47.6	Very low	50.3	Low	82 Å²	82	71.7 Å²	71.7	36%	0.36	40%	0.399	S	S	.	.			trans	-76.4	112.6	176.7	-70.6	-87.3	0	0	0	110.6	L136 G175 K181 L182	L136-F179 HydrophobicContact CD1-CD1 4.39Å; L136-F179 HydrophobicContact CD1-CD2 3.8Å; L136-F179 HydrophobicContact CD1-CE2 3.97Å; L136-F179 HydrophobicContact CD1-CG 4.03Å; L136-F179 HydrophobicContact CD1-CZ 4.34Å; L136-F179 HydrophobicContact CD2-CD2 4.11Å; L136-F179 HydrophobicContact CD2-CE2 3.46Å; L136-F179 VanDerWaalsContact CD2-CE2 3.46Å; L136-F179 HydrophobicContact CD2-CZ 3.76Å; L136-F179 HydrophobicContact CG-CD1 4.38Å; L136-F179 HydrophobicContact CG-CD2 4Å; L136-F179 HydrophobicContact CG-CE1 4.03Å; L136-F179 HydrophobicContact CG-CE2 3.64Å; L136-F179 HydrophobicContact CG-CG 4.37Å; L136-F179 HydrophobicContact CG-CZ 3.66Å; G175-F179 WeakPolarHBondContact O-CD2 3.46Å; F179-K181 PolarHBondContact O-N 3.19Å; F179-L182 PolarHBondContact O-N 3.1Å
180	S	41.6	Very low	50.3	Low	126 Å²	126	65.2 Å²	65.2	88%	0.881	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	0	174.8	60.9	0	0	0	0	115.6	G178	G178-S180 PolarHBondContact O-N 2.89Å
181	K	41.2	Very low	50.6	Low	192 Å²	192	63.4 Å²	63.4	84%	0.835	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.2	-7.6	177.3	-68.9	-175.4	176.1	179.5	0	114.4	F179 S183	F179-K181 PolarHBondContact O-N 3.19Å; K181-S183 PolarHBondContact O-N 3.45Å; K181-S183 VanDerWaalsContact O-N 3.1Å
182	L	44.8	Very low	50.6	Low	25 Å²	25	66 Å²	66	13%	0.131	38%	0.382	C	S	.	.	S	Bend	trans	-77.6	96.5	168.1	-158.2	77.5	0	0	0	107.8	W165 F179 A184 K186 Q187 M248	W165-L182 HydrophobicContact CH2-CD2 4.21Å; W165-L182 HydrophobicContact CZ3-CD2 4.17Å; F179-L182 PolarHBondContact O-N 3.1Å; L182-A184 PolarHBondContact O-N 2.92Å; L182-K186 HydrophobicContact CD1-CB 4.15Å; L182-K186 HydrophobicContact CD1-CD 4.44Å; L182-K186 HydrophobicContact CG-CB 4.26Å; L182-Q187 HydrophobicContact CD2-CB 4.16Å; L182-M248 HydrophobicContact CD1-CE 3.63Å; L182-M248 HydrophobicContact CD1-SD 3.64Å
183	S	53.2	Low	50.2	Low	52 Å²	52	62.5 Å²	62.5	36%	0.364	36%	0.362	S	S	.	.			trans	-55.9	143.5	178.9	65.6	0	0	0	0	110.2	K181 A185 K186 Q187	K181-S183 PolarHBondContact O-N 3.45Å; K181-S183 VanDerWaalsContact O-N 3.1Å; S183-A185 CarbonylContact O-C 3.6Å; S183-A185 PolarHBondContact O-N 3.17Å; S183-K186 PolarHBondContact O-N 3.01Å; S183-K186 PolarHBondContact OG-N 2.59Å; S183-Q187 PolarHBondContact O-N 3.32Å; S183-Q187 VanDerWaalsContact O-N 3.11Å
184	A	54	Low	50	Low	56 Å²	56	57.8 Å²	57.8	46%	0.463	33%	0.334	S	S	.	.	H	α-helix	trans	-54.9	-29.1	177.9	0	0	0	0	0	112	L182 R188	L182-A184 PolarHBondContact O-N 2.92Å; A184-R188 WeakPolarHBondContact O-CB 3.29Å; A184-R188 WeakPolarHBondContact O-CD 3.22Å; A184-R188 WeakPolarHBondContact O-CG 3.46Å; A184-R188 PolarHBondContact O-N 3.4Å
185	A	48	Very low	49.7	Very low	19 Å²	19	62.3 Å²	62.3	16%	0.157	35%	0.347	C	S	.	.	H	α-helix	trans	-54.1	-56.2	166.3	0	0	0	0	0	114	S183 Q187 R188 T189 D331	S183-A185 CarbonylContact O-C 3.6Å; S183-A185 PolarHBondContact O-N 3.17Å; A185-Q187 PolarHBondContact O-N 3Å; A185-R188 PolarHBondContact O-N 3.23Å; A185-T189 WeakPolarHBondContact O-CB 3.42Å; A185-T189 PolarHBondContact O-N 3.13Å; A185-T189 PolarHBondContact O-OG1 3.37Å; A185-D331 HydrophobicContact CB-CB 3.74Å; A185-D331 WeakPolarHBondContact CB-OD2 3.48Å
186	K	49.7	Very low	49.4	Very low	63 Å²	63	61.4 Å²	61.4	27%	0.274	34%	0.336	S	S	.	.	H	α-helix	trans	-60.7	-42.9	176.9	-81.8	-173.7	175.6	-176.1	0	111.9	L182 S183 T189 C190	L182-K186 HydrophobicContact CD1-CB 4.15Å; L182-K186 HydrophobicContact CD1-CD 4.44Å; L182-K186 HydrophobicContact CG-CB 4.26Å; S183-K186 PolarHBondContact O-N 3.01Å; S183-K186 PolarHBondContact OG-N 2.59Å; K186-T189 WeakPolarHBondContact O-CB 3.36Å; K186-T189 PolarHBondContact O-N 3.25Å; K186-C190 PolarHBondContact O-N 3.21Å; K186-C190 PolarHBondContact O-SG 3.17Å
187	Q	54.8	Low	49.3	Very low	59 Å²	59	62.5 Å²	62.5	28%	0.276	34%	0.34	S	S	.	.	H	α-helix	trans	-61.4	-48.9	177.6	-173.8	176.6	-11.2	0	0	111.8	W165 L182 S183 A185 T189 C190 E191	W165-Q187 HydrophobicContact CE3-CG 4.34Å; W165-Q187 HydrophobicContact CZ3-CG 4.19Å; L182-Q187 HydrophobicContact CD2-CB 4.16Å; S183-Q187 PolarHBondContact O-N 3.32Å; S183-Q187 VanDerWaalsContact O-N 3.11Å; A185-Q187 PolarHBondContact O-N 3Å; Q187-T189 PolarHBondContact O-N 3.28Å; Q187-C190 PolarHBondContact O-N 2.96Å; Q187-E191 WeakPolarHBondContact O-CB 3.33Å; Q187-E191 PolarHBondContact O-N 3.29Å
188	R	52.7	Low	49.1	Very low	179 Å²	179	64.5 Å²	64.5	68%	0.675	35%	0.346	S	S	*	.	H	α-helix	trans	-58.3	-34.7	174.3	-73.5	168.1	-173.3	172.7	3.2	112.4	A184 A185 A192	A184-R188 WeakPolarHBondContact O-CB 3.29Å; A184-R188 WeakPolarHBondContact O-CD 3.22Å; A184-R188 WeakPolarHBondContact O-CG 3.46Å; A184-R188 PolarHBondContact O-N 3.4Å; A185-R188 PolarHBondContact O-N 3.23Å; R188-A192 VanDerWaalsContact O-CB 3.28Å; R188-A192 WeakPolarHBondContact O-CB 3.31Å; R188-A192 PolarHBondContact O-N 2.83Å
189	T	49.9	Very low	49.4	Very low	26 Å²	26	66.9 Å²	66.9	16%	0.16	34%	0.338	C	S	.	.	H	α-helix	trans	-69.9	-48.4	178	-72.3	0	0	0	0	113	A185 K186 Q187 E191 A192 S193 V328	A185-T189 WeakPolarHBondContact O-CB 3.42Å; A185-T189 PolarHBondContact O-N 3.13Å; A185-T189 PolarHBondContact O-OG1 3.37Å; K186-T189 WeakPolarHBondContact O-CB 3.36Å; K186-T189 PolarHBondContact O-N 3.25Å; Q187-T189 PolarHBondContact O-N 3.28Å; T189-E191 PolarHBondContact O-N 3.05Å; T189-A192 PolarHBondContact O-N 3.5Å; T189-S193 VanDerWaalsContact O-CB 3.31Å; T189-S193 WeakPolarHBondContact O-CB 3.19Å; T189-S193 PolarHBondContact O-N 3.03Å; T189-S193 PolarHBondContact O-OG 2.93Å; T189-V328 HydrophobicContact CG2-CB 4.02Å; T189-V328 HydrophobicContact CG2-CG1 3.62Å; T189-V328 HydrophobicContact CG2-CG2 3.3Å
190	C	51.5	Low	49.5	Very low	8 Å²	8	63.5 Å²	63.5	5%	0.054	32%	0.323	C	S	.	.	H	α-helix	trans	-57.6	-40.5	175.7	-60.8	0	0	0	0	109.9	W165 K186 Q187 S193 Y194 L249	W165-C190 HydrophobicContact CD2-CB 3.76Å; W165-C190 HydrophobicContact CE3-CB 3.94Å; W165-C190 HydrophobicContact CG-CB 4.27Å; W165-C190 HydrophobicContact CH2-CB 4.23Å; W165-C190 HydrophobicContact CZ2-CB 4.05Å; W165-C190 HydrophobicContact CZ3-CB 4.18Å; K186-C190 PolarHBondContact O-N 3.21Å; K186-C190 PolarHBondContact O-SG 3.17Å; Q187-C190 PolarHBondContact O-N 2.96Å; C190-S193 PolarHBondContact O-N 2.87Å; C190-Y194 WeakPolarHBondContact O-CB 3.17Å; C190-Y194 PolarHBondContact O-N 3.39Å; C190-L249 HydrophobicContact CB-CD1 3.91Å
191	E	53.4	Low	49.6	Very low	27 Å²	27	58.6 Å²	58.6	13%	0.126	29%	0.287	C	S	.	.	H	α-helix	trans	-70.3	-43.2	179.1	175.8	143.6	-84.1	0	0	115.1	L164 W165 Q187 T189 S193 Y194 R195	L164-E191 WeakPolarHBondContact CA-OE1 3.28Å; L164-E191 WeakPolarHBondContact CB-OE1 3.27Å; L164-E191 VanDerWaalsContact CD2-CD 3.44Å; L164-E191 HydrophobicContact CD2-CG 4.42Å; L164-E191 VanDerWaalsContact CD2-OE1 3.32Å; L164-E191 WeakPolarHBondContact CD2-OE1 3.36Å; L164-E191 WeakPolarHBondContact CD2-OE2 3.46Å; W165-E191 HydrophobicContact CB-CB 4.08Å; W165-E191 PolarHBondContact N-OE1 3.27Å; Q187-E191 WeakPolarHBondContact O-CB 3.33Å; Q187-E191 PolarHBondContact O-N 3.29Å; T189-E191 PolarHBondContact O-N 3.05Å; E191-S193 VanDerWaalsContact C-N 3.31Å; E191-Y194 PolarHBondContact O-N 3.32Å; E191-R195 PolarHBondContact O-N 3.04Å
192	A	51.5	Low	49.8	Very low	53 Å²	53	52 Å²	52	44%	0.438	26%	0.264	S	S	.	.	H	α-helix	trans	-64.2	-39.6	172.9	0	0	0	0	0	111	R188 T189 S196	R188-A192 VanDerWaalsContact O-CB 3.28Å; R188-A192 WeakPolarHBondContact O-CB 3.31Å; R188-A192 PolarHBondContact O-N 2.83Å; T189-A192 PolarHBondContact O-N 3.5Å; A192-S196 WeakPolarHBondContact O-CB 3.35Å; A192-S196 PolarHBondContact O-N 2.91Å
193	S	50.3	Low	49.8	Very low	12 Å²	12	51.6 Å²	51.6	8%	0.084	26%	0.263	C	S	.	.	H	α-helix	trans	-62.1	-50.8	174	-60.8	0	0	0	0	110.9	T189 C190 E191 R195 S196 W197	T189-S193 VanDerWaalsContact O-CB 3.31Å; T189-S193 WeakPolarHBondContact O-CB 3.19Å; T189-S193 PolarHBondContact O-N 3.03Å; T189-S193 PolarHBondContact O-OG 2.93Å; C190-S193 PolarHBondContact O-N 2.87Å; E191-S193 VanDerWaalsContact C-N 3.31Å; S193-R195 PolarHBondContact O-N 3.01Å; S193-S196 CarbonylContact O-C 3.46Å; S193-S196 WeakPolarHBondContact O-CA 3.3Å; S193-S196 WeakPolarHBondContact O-CB 2.89Å; S193-S196 PolarHBondContact O-N 3.04Å; S193-S196 VanDerWaalsContact O-N 3.13Å; S193-W197 VanDerWaalsContact O-CG 3.26Å; S193-W197 PolarHBondContact O-N 3.35Å; S193-W197 PolarHBondContact O-NE1 2.93Å
194	Y	48.9	Very low	49.4	Very low	45 Å²	45	49.5 Å²	49.5	18%	0.176	25%	0.248	C	C	.	.	H	α-helix	trans	-58.2	-49.5	179.6	-179.9	-107.3	0	0	0	113.1	W165 L168 C190 E191 S196 W197 K198	W165-Y194 HydrophobicContact CB-CD1 4.35Å; W165-Y194 HydrophobicContact CB-CG 4.37Å; L168-Y194 HydrophobicContact CD1-CD2 4.49Å; L168-Y194 HydrophobicContact CD1-CE1 4.48Å; L168-Y194 HydrophobicContact CD1-CE2 4.07Å; C190-Y194 WeakPolarHBondContact O-CB 3.17Å; C190-Y194 PolarHBondContact O-N 3.39Å; E191-Y194 PolarHBondContact O-N 3.32Å; Y194-S196 VanDerWaalsContact C-N 3.3Å; Y194-S196 PolarHBondContact O-N 2.85Å; Y194-W197 PolarHBondContact O-N 3.29Å; Y194-K198 PolarHBondContact O-N 2.84Å
195	R	49.8	Very low	48.8	Very low	120 Å²	120	51.5 Å²	51.5	45%	0.453	25%	0.248	S	C	.	.	H	α-helix	trans	-55.6	-47.4	173.2	-77.3	-167.3	-178.2	91	-7.8	111.5	E191 S193 W197 K198 E199	E191-R195 PolarHBondContact O-N 3.04Å; S193-R195 PolarHBondContact O-N 3.01Å; R195-W197 PolarHBondContact O-N 2.83Å; R195-K198 PolarHBondContact O-N 2.85Å; R195-E199 PolarHBondContact O-N 3.05Å; R195-E199 VanDerWaalsContact O-N 3.15Å
196	S	48.3	Very low	48.6	Very low	11 Å²	11	51.2 Å²	51.2	8%	0.077	24%	0.243	C	C	.	.	H	α-helix	trans	-64.7	-17	178.6	173.4	0	0	0	0	113.7	A192 S193 Y194 K200 R317	A192-S196 WeakPolarHBondContact O-CB 3.35Å; A192-S196 PolarHBondContact O-N 2.91Å; S193-S196 CarbonylContact O-C 3.46Å; S193-S196 WeakPolarHBondContact O-CA 3.3Å; S193-S196 WeakPolarHBondContact O-CB 2.89Å; S193-S196 PolarHBondContact O-N 3.04Å; S193-S196 VanDerWaalsContact O-N 3.13Å; Y194-S196 VanDerWaalsContact C-N 3.3Å; Y194-S196 PolarHBondContact O-N 2.85Å; S196-K200 WeakPolarHBondContact O-CG 3.23Å; S196-R317 VanDerWaalsContact OG-CZ 3.24Å; S196-R317 PolarHBondContact OG-NH1 3.31Å; S196-R317 PolarHBondContact OG-NH2 2.9Å
197	W	48.4	Very low	48.3	Very low	25 Å²	25	50.9 Å²	50.9	10%	0.095	24%	0.24	C	C	.	.	H	α-helix	trans	-90.8	-39.6	175	-62	6.4	0	0	0	111.2	S193 Y194 R195 E199 K200 I201 L236 L239 V243 L249 I252	S193-W197 VanDerWaalsContact O-CG 3.26Å; S193-W197 PolarHBondContact O-N 3.35Å; S193-W197 PolarHBondContact O-NE1 2.93Å; Y194-W197 PolarHBondContact O-N 3.29Å; R195-W197 PolarHBondContact O-N 2.83Å; W197-E199 VanDerWaalsContact C-N 3.28Å; W197-E199 PolarHBondContact O-N 3.02Å; W197-K200 WeakPolarHBondContact O-CB 3.44Å; W197-K200 PolarHBondContact O-N 2.94Å; W197-K200 VanDerWaalsContact O-N 3.14Å; W197-I201 WeakPolarHBondContact O-CD1 3.38Å; W197-I201 WeakPolarHBondContact O-CG1 3.16Å; W197-I201 PolarHBondContact O-N 2.94Å; W197-L236 HydrophobicContact CB-CD2 4.12Å; W197-L239 HydrophobicContact CD2-CB 4.1Å; W197-L239 HydrophobicContact CD2-CD1 4.17Å; W197-L239 HydrophobicContact CE3-CB 3.91Å; W197-L239 HydrophobicContact CH2-CB 3.52Å; W197-L239 HydrophobicContact CH2-CD2 4.08Å; W197-L239 HydrophobicContact CH2-CG 4.25Å; W197-L239 WeakPolarHBondContact CH2-O 3.39Å; W197-L239 HydrophobicContact CZ2-CB 3.72Å; W197-L239 HydrophobicContact CZ2-CD1 3.93Å; W197-L239 HydrophobicContact CZ2-CD2 3.7Å; W197-L239 HydrophobicContact CZ2-CG 3.98Å; W197-L239 VanDerWaalsContact CZ3-C 3.43Å; W197-L239 HydrophobicContact CZ3-CB 3.61Å; W197-L239 WeakPolarHBondContact CZ3-O 3.22Å; W197-V243 HydrophobicContact CE3-CG2 4.45Å; W197-V243 HydrophobicContact CH2-CG2 3.59Å; W197-V243 HydrophobicContact CZ3-CB 4.42Å; W197-V243 HydrophobicContact CZ3-CG2 3.33Å; W197-L249 HydrophobicContact CH2-CD2 4.14Å; W197-I252 HydrophobicContact CH2-CD1 4.03Å; W197-I252 HydrophobicContact CH2-CG1 4.38Å; W197-I252 HydrophobicContact CZ2-CD1 3.58Å; W197-I252 HydrophobicContact CZ2-CG1 4.11Å
198	K	47.6	Very low	47.6	Very low	102 Å²	102	54 Å²	54	44%	0.443	25%	0.253	S	S	.	.	H	α-helix	trans	-53.7	-47.3	172.6	-171.4	-179.2	178.6	-173	0	111	Y194 R195 K200 I201 C202	Y194-K198 PolarHBondContact O-N 2.84Å; R195-K198 PolarHBondContact O-N 2.85Å; K198-K200 PolarHBondContact O-N 3.35Å; K198-I201 PolarHBondContact O-N 3.33Å; K198-C202 PolarHBondContact O-N 3.44Å
199	E	51.1	Low	47.1	Very low	123 Å²	123	47.7 Å²	47.7	58%	0.575	24%	0.236	S	C	*	.	H	α-helix	trans	-59.5	-43.6	176.3	-170	-176.2	-155.1	0	0	112.8	R195 W197 I201 C202 S203	R195-E199 PolarHBondContact O-N 3.05Å; R195-E199 VanDerWaalsContact O-N 3.15Å; W197-E199 VanDerWaalsContact C-N 3.28Å; W197-E199 PolarHBondContact O-N 3.02Å; E199-I201 VanDerWaalsContact C-N 3.32Å; E199-I201 PolarHBondContact O-N 2.7Å; E199-C202 PolarHBondContact O-N 3.13Å; E199-S203 PolarHBondContact O-N 3.48Å
200	K	49.6	Very low	46.5	Very low	11 Å²	11	55 Å²	55	5%	0.048	27%	0.269	C	S	.	.	H	α-helix	trans	-63.2	-33.6	175.4	-75.9	175.2	-171	179.5	0	113	S196 W197 K198 S203 V204 L236	S196-K200 WeakPolarHBondContact O-CG 3.23Å; W197-K200 WeakPolarHBondContact O-CB 3.44Å; W197-K200 PolarHBondContact O-N 2.94Å; W197-K200 VanDerWaalsContact O-N 3.14Å; K198-K200 PolarHBondContact O-N 3.35Å; K200-S203 PolarHBondContact O-N 3.49Å; K200-S203 PolarHBondContact O-OG 3Å; K200-V204 WeakPolarHBondContact O-CG2 3.27Å; K200-V204 PolarHBondContact O-N 2.81Å; K200-L236 HydrophobicContact CB-CD1 4.06Å; K200-L236 HydrophobicContact CB-CD2 3.87Å; K200-L236 HydrophobicContact CB-CG 4.29Å; K200-L236 HydrophobicContact CD-CD2 4.1Å
201	I	43.8	Very low	45.8	Very low	23 Å²	23	66.6 Å²	66.6	12%	0.118	31%	0.311	C	S	.	.	H	α-helix	trans	-70.4	-39.8	-177.7	-69.6	155.8	0	0	0	110.6	F154 W197 K198 E199 S203 V204 Q205 L236	F154-I201 HydrophobicContact CD1-CD1 3.88Å; F154-I201 HydrophobicContact CD2-CD1 4.15Å; F154-I201 HydrophobicContact CD2-CG2 3.9Å; F154-I201 HydrophobicContact CE1-CD1 3.42Å; F154-I201 VanDerWaalsContact CE1-CD1 3.42Å; F154-I201 HydrophobicContact CE2-CD1 3.73Å; F154-I201 HydrophobicContact CE2-CG2 4.39Å; F154-I201 HydrophobicContact CG-CD1 4.26Å; F154-I201 HydrophobicContact CG-CG2 4.12Å; F154-I201 HydrophobicContact CZ-CD1 3.37Å; W197-I201 WeakPolarHBondContact O-CD1 3.38Å; W197-I201 WeakPolarHBondContact O-CG1 3.16Å; W197-I201 PolarHBondContact O-N 2.94Å; K198-I201 PolarHBondContact O-N 3.33Å; E199-I201 VanDerWaalsContact C-N 3.32Å; E199-I201 PolarHBondContact O-N 2.7Å; I201-S203 VanDerWaalsContact C-N 3.32Å; I201-S203 PolarHBondContact O-N 3.24Å; I201-V204 PolarHBondContact O-N 3.45Å; I201-V204 VanDerWaalsContact O-N 3.14Å; I201-Q205 HydrophobicContact CG2-CG 4.49Å; I201-Q205 WeakPolarHBondContact O-CG 3.33Å; I201-Q205 PolarHBondContact O-N 3.15Å; I201-L236 HydrophobicContact CB-CD1 4.42Å; I201-L236 HydrophobicContact CD1-CD2 4.08Å; I201-L236 HydrophobicContact CG1-CD1 3.59Å; I201-L236 HydrophobicContact CG1-CD2 3.64Å; I201-L236 HydrophobicContact CG1-CG 4.12Å
202	C	43.7	Very low	45	Very low	53 Å²	53	68.8 Å²	68.8	36%	0.358	33%	0.334	S	S	.	.	H	α-helix	trans	-57	-44.7	173.9	-65.5	0	0	0	0	111.6	K198 E199 V204 Q205 F206	K198-C202 PolarHBondContact O-N 3.44Å; E199-C202 PolarHBondContact O-N 3.13Å; C202-V204 VanDerWaalsContact C-N 3.32Å; C202-V204 PolarHBondContact O-N 3.47Å; C202-Q205 PolarHBondContact O-N 3.03Å; C202-F206 PolarHBondContact O-N 2.66Å
203	S	46.2	Very low	44.3	Very low	17 Å²	17	68.5 Å²	68.5	12%	0.119	33%	0.332	C	S	.	.	H	α-helix	trans	-67.9	-28.9	177.3	69.4	0	0	0	0	113.5	E199 K200 I201	E199-S203 PolarHBondContact O-N 3.48Å; K200-S203 PolarHBondContact O-N 3.49Å; K200-S203 PolarHBondContact O-OG 3Å; I201-S203 VanDerWaalsContact C-N 3.32Å; I201-S203 PolarHBondContact O-N 3.24Å
204	V	45	Very low	43.6	Very low	8 Å²	8	75.8 Å²	75.8	5%	0.048	37%	0.37	C	S	.	.	H	α-helix	trans	-76.2	-31.1	174.4	173.5	0	0	0	0	112.9	K200 I201 C202 F206 W207 K208 L232 F233 L236	K200-V204 WeakPolarHBondContact O-CG2 3.27Å; K200-V204 PolarHBondContact O-N 2.81Å; I201-V204 PolarHBondContact O-N 3.45Å; I201-V204 VanDerWaalsContact O-N 3.14Å; C202-V204 VanDerWaalsContact C-N 3.32Å; C202-V204 PolarHBondContact O-N 3.47Å; V204-F206 VanDerWaalsContact C-N 3.32Å; V204-W207 PolarHBondContact O-N 3.47Å; V204-K208 PolarHBondContact O-N 3.19Å; V204-L232 HydrophobicContact CG2-CB 3.51Å; V204-L232 HydrophobicContact CG2-CD1 4.33Å; V204-F233 HydrophobicContact CG1-CB 4.06Å; V204-F233 HydrophobicContact CG1-CD2 4.1Å; V204-L236 HydrophobicContact CB-CD1 4.41Å; V204-L236 HydrophobicContact CG2-CD1 3.93Å
205	Q	41.7	Very low	43.1	Very low	97 Å²	97	77.4 Å²	77.4	45%	0.453	40%	0.4	S	S	.	.	H	α-helix	trans	-61.9	-40.3	171.6	-72.9	-74.3	1.1	0	0	111.2	I201 C202 W207 K208 S209	I201-Q205 HydrophobicContact CG2-CG 4.49Å; I201-Q205 WeakPolarHBondContact O-CG 3.33Å; I201-Q205 PolarHBondContact O-N 3.15Å; C202-Q205 PolarHBondContact O-N 3.03Å; Q205-W207 VanDerWaalsContact C-N 3.34Å; Q205-W207 PolarHBondContact O-N 2.99Å; Q205-K208 WeakPolarHBondContact O-CA 3.35Å; Q205-K208 WeakPolarHBondContact O-CB 3.43Å; Q205-K208 PolarHBondContact O-N 3.05Å; Q205-S209 PolarHBondContact O-N 3.37Å
206	F	43.6	Very low	42.6	Very low	14 Å²	14	74.7 Å²	74.7	6%	0.061	40%	0.397	C	S	.	.	H	α-helix	trans	-56.8	-44.1	172.6	-176.4	-89	0	0	0	112.5	C202 V204 K208 S209 I296 E301 L302 F310	C202-F206 PolarHBondContact O-N 2.66Å; V204-F206 VanDerWaalsContact C-N 3.32Å; F206-K208 PolarHBondContact O-N 3.21Å; F206-S209 PolarHBondContact O-N 3.03Å; F206-S209 PolarHBondContact O-OG 3.04Å; F206-I296 HydrophobicContact CZ-CG2 4.44Å; F206-E301 HydrophobicContact CB-CB 4.23Å; F206-E301 HydrophobicContact CD2-CB 3.7Å; F206-E301 HydrophobicContact CG-CB 4.47Å; F206-L302 HydrophobicContact CD2-CD1 4.33Å; F206-L302 HydrophobicContact CD2-CG 3.94Å; F206-L302 HydrophobicContact CE2-CD1 3.4Å; F206-L302 VanDerWaalsContact CE2-CD1 3.4Å; F206-L302 HydrophobicContact CE2-CD2 4.48Å; F206-L302 HydrophobicContact CE2-CG 3.5Å; F206-L302 VanDerWaalsContact CE2-CG 3.5Å; F206-L302 HydrophobicContact CZ-CD1 3.73Å; F206-L302 HydrophobicContact CZ-CG 4.08Å; F206-F310 HydrophobicContact CB-CE2 4.31Å; F206-F310 HydrophobicContact CB-CZ 3.84Å; F206-F310 HydrophobicContact CD1-CD1 4.33Å; F206-F310 AromaticContact CD1-CE1 3.35Å; F206-F310 HydrophobicContact CD1-CE1 3.35Å; F206-F310 HydrophobicContact CD1-CE2 4.33Å; F206-F310 AromaticContact CD1-CZ 3.35Å; F206-F310 HydrophobicContact CD1-CZ 3.35Å; F206-F310 HydrophobicContact CE1-CD1 4.25Å; F206-F310 AromaticContact CE1-CE1 3.62Å; F206-F310 HydrophobicContact CE1-CE1 3.62Å; F206-F310 HydrophobicContact CE1-CZ 4.08Å; F206-F310 HydrophobicContact CG-CE1 4.09Å; F206-F310 HydrophobicContact CG-CE2 4.26Å; F206-F310 AromaticContact CG-CZ 3.66Å; F206-F310 HydrophobicContact CG-CZ 3.66Å
207	W	42.9	Very low	42.3	Very low	55 Å²	55	78.9 Å²	78.9	21%	0.208	42%	0.422	C	S	.	.	H	α-helix	trans	-70.6	-12.7	176.9	-61.2	113.6	0	0	0	113.9	V204 Q205 C223 P225 F310 L311	V204-W207 PolarHBondContact O-N 3.47Å; Q205-W207 VanDerWaalsContact C-N 3.34Å; Q205-W207 PolarHBondContact O-N 2.99Å; W207-C223 HydrophobicContact CZ3-CB 3.74Å; W207-C223 WeakPolarHBondContact CZ3-O 3.24Å; W207-P225 HydrophobicContact CH2-CG 4.13Å; W207-P225 HydrophobicContact CZ2-CG 4.38Å; W207-P225 HydrophobicContact CZ3-CG 4.36Å; W207-F310 AromaticContact CE2-CE1 3.77Å; W207-F310 HydrophobicContact CH2-CE1 4.01Å; W207-F310 HydrophobicContact CZ2-CD1 4.34Å; W207-F310 AromaticContact CZ2-CE1 3.5Å; W207-F310 HydrophobicContact CZ2-CE1 3.5Å; W207-F310 HydrophobicContact CZ2-CZ 4.2Å; W207-F310 AromaticContact NE1-CZ 3.91Å; W207-L311 HydrophobicContact CH2-CD2 4.05Å
208	K	39.2	Very low	41.8	Very low	126 Å²	126	80.4 Å²	80.4	55%	0.548	44%	0.437	S	S	.	.	H	α-helix	trans	-94.4	-9.2	176.7	-91.5	-168.7	174.8	-172.7	0	114.3	V204 Q205 F206 E210	V204-K208 PolarHBondContact O-N 3.19Å; Q205-K208 WeakPolarHBondContact O-CA 3.35Å; Q205-K208 WeakPolarHBondContact O-CB 3.43Å; Q205-K208 PolarHBondContact O-N 3.05Å; F206-K208 PolarHBondContact O-N 3.21Å; K208-E210 PolarHBondContact O-N 3.46Å
209	S	41.8	Very low	41.4	Very low	46 Å²	46	77.5 Å²	77.5	32%	0.322	42%	0.424	S	S	.	.			trans	-76.3	66.6	-178	63.4	0	0	0	0	112.7	Q205 F206 R211	Q205-S209 PolarHBondContact O-N 3.37Å; F206-S209 PolarHBondContact O-N 3.03Å; F206-S209 PolarHBondContact O-OG 3.04Å; S209-R211 PolarHBondContact O-N 2.96Å
210	E	39.1	Very low	40.7	Very low	180 Å²	180	75.4 Å²	75.4	84%	0.841	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-5.1	178.8	-167.3	164.6	-146.9	0	0	113.9	K208	K208-E210 PolarHBondContact O-N 3.46Å
211	R	36	Very low	40.4	Very low	250 Å²	250	78.9 Å²	78.9	94%	0.943	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.8	4.4	-172.8	-68.7	-173.9	177.5	-177.6	-0.8	115.9	S209	S209-R211 PolarHBondContact O-N 2.96Å
212	A	36.1	Very low	40.2	Very low	73 Å²	73	79.2 Å²	79.2	60%	0.603	44%	0.436	S	S	*	.	S	Bend	trans	-116.3	38.6	-172.9	0	0	0	0	0	114.8
213	A	37.6	Very low	40.1	Very low	47 Å²	47	77.5 Å²	77.5	39%	0.388	42%	0.424	S	S	.	.			trans	-158.2	77.6	170.2	0	0	0	0	0	113.8	G215 F219	A213-G215 PolarHBondContact O-N 3.25Å; A213-F219 HydrophobicContact CB-CD1 4.26Å
214	D	35.4	Very low	40.1	Very low	166 Å²	166	82.9 Å²	82.9	89%	0.888	44%	0.442	S	S	*	.	S	Bend	trans	-59.4	132.5	160.1	-82	-39	0	0	0	110.7	T216	D214-T216 VanDerWaalsContact C-N 3.32Å; D214-T216 PolarHBondContact O-N 3.23Å
215	G	38.7	Very low	40.4	Very low	78 Å²	78	83.6 Å²	83.6	80%	0.804	45%	0.447	S	S	*	.	S	Bend	trans	74.5	-14.2	159.5	0	0	0	0	0	119.5	A213 T217	A213-G215 PolarHBondContact O-N 3.25Å; G215-T217 PolarHBondContact O-N 3.41Å
216	T	38.4	Very low	40.8	Very low	64 Å²	64	84.5 Å²	84.5	39%	0.393	45%	0.454	S	S	.	.			trans	-102.3	81.6	-170.5	-45	0	0	0	0	113.6	D214 S218 F219 F289	D214-T216 VanDerWaalsContact C-N 3.32Å; D214-T216 PolarHBondContact O-N 3.23Å; T216-S218 PolarHBondContact O-N 3.39Å; T216-F219 PolarHBondContact O-N 2.93Å; T216-F289 HydrophobicContact CG2-CE2 3.77Å; T216-F289 HydrophobicContact CG2-CZ 4.2Å
217	T	42.6	Very low	41.3	Very low	99 Å²	99	85.3 Å²	85.3	61%	0.607	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.1	-25.3	179	34	0	0	0	0	115.2	G215	G215-T217 PolarHBondContact O-N 3.41Å
218	S	38.8	Very low	42	Very low	57 Å²	57	82.7 Å²	82.7	40%	0.399	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-35.3	177	-53.6	0	0	0	0	113.8	T216 N220 I221 F222	T216-S218 PolarHBondContact O-N 3.39Å; S218-N220 VanDerWaalsContact C-N 3.35Å; S218-N220 PolarHBondContact O-N 3.4Å; S218-I221 PolarHBondContact O-N 2.83Å; S218-I221 VanDerWaalsContact O-N 3.1Å; S218-F222 WeakPolarHBondContact O-CD2 3.16Å
219	F	37.5	Very low	42.7	Very low	41 Å²	41	77.4 Å²	77.4	18%	0.18	44%	0.437	C	S	.	.	H	α-helix	trans	-66.2	-39	-175.9	-176.1	-112.4	0	0	0	112	A213 T216 I221 F222 C223 I296	A213-F219 HydrophobicContact CB-CD1 4.26Å; T216-F219 PolarHBondContact O-N 2.93Å; F219-I221 PolarHBondContact O-N 3.19Å; F219-F222 PolarHBondContact O-N 3.42Å; F219-C223 HydrophobicContact CE1-CB 4.33Å; F219-C223 HydrophobicContact CE2-CB 4.44Å; F219-C223 WeakPolarHBondContact CE2-SG 3.46Å; F219-C223 HydrophobicContact CZ-CB 4.2Å; F219-C223 VanDerWaalsContact CZ-SG 3.58Å; F219-C223 PolarHBondContact O-N 3.1Å; F219-C223 VanDerWaalsContact O-N 3.1Å; F219-I296 HydrophobicContact CD2-CD1 3.72Å; F219-I296 HydrophobicContact CE2-CD1 3.54Å; F219-I296 HydrophobicContact CE2-CG1 4.3Å; F219-I296 HydrophobicContact CE2-CG2 4.22Å; F219-I296 HydrophobicContact CZ-CD1 4.26Å; F219-I296 HydrophobicContact CZ-CG2 4.34Å
220	N	37.9	Very low	43.5	Very low	79 Å²	79	81.6 Å²	81.6	42%	0.422	45%	0.452	S	S	.	.	H	α-helix	trans	-61.1	-12.9	174.1	-100.1	-53.4	0	0	0	114.2	S218 R224	S218-N220 VanDerWaalsContact C-N 3.35Å; S218-N220 PolarHBondContact O-N 3.4Å; N220-R224 VanDerWaalsContact O-CB 3.28Å; N220-R224 WeakPolarHBondContact O-CB 3.44Å; N220-R224 VanDerWaalsContact O-CD 3.23Å; N220-R224 WeakPolarHBondContact O-CD 3.23Å; N220-R224 WeakPolarHBondContact O-CG 3.48Å; N220-R224 PolarHBondContact OD1-NE 3.37Å
221	I	41.5	Very low	44.5	Very low	83 Å²	83	73.2 Å²	73.2	43%	0.426	41%	0.413	S	S	.	.	H	α-helix	trans	-91.7	-35.1	177.9	-57.6	174.6	0	0	0	111.2	F66 L69 S218 F219	F66-I221 HydrophobicContact CD2-CD1 4.18Å; F66-I221 HydrophobicContact CE2-CD1 3.96Å; F66-I221 HydrophobicContact CE2-CG2 4.16Å; L69-I221 HydrophobicContact CD1-CD1 4.45Å; S218-I221 PolarHBondContact O-N 2.83Å; S218-I221 VanDerWaalsContact O-N 3.1Å; F219-I221 PolarHBondContact O-N 3.19Å
222	F	41	Very low	45.6	Very low	31 Å²	31	61.7 Å²	61.7	14%	0.136	37%	0.37	C	S	.	.	H	α-helix	trans	-76.4	-38.1	176.6	-78.2	-97.9	0	0	0	112.4	S218 F219 T280 L281 L284	S218-F222 WeakPolarHBondContact O-CD2 3.16Å; F219-F222 PolarHBondContact O-N 3.42Å; F222-T280 HydrophobicContact CE1-CG2 4.05Å; F222-T280 HydrophobicContact CZ-CG2 3.48Å; F222-T280 VanDerWaalsContact CZ-CG2 3.48Å; F222-L281 HydrophobicContact CE1-CB 4.38Å; F222-L284 HydrophobicContact CD2-CD1 4.28Å; F222-L284 HydrophobicContact CE1-CD1 4.1Å; F222-L284 HydrophobicContact CE2-CD1 3.42Å; F222-L284 VanDerWaalsContact CE2-CD1 3.42Å; F222-L284 HydrophobicContact CZ-CD1 3.29Å; F222-L284 HydrophobicContact CZ-CG 4.09Å
223	C	41	Very low	46.7	Very low	17 Å²	17	61.1 Å²	61.1	12%	0.115	35%	0.354	C	S	.	.	S	Bend	trans	-99.9	27.1	-171.7	-72.7	0	0	0	0	113.7	W207 F219 P225	W207-C223 HydrophobicContact CZ3-CB 3.74Å; W207-C223 WeakPolarHBondContact CZ3-O 3.24Å; F219-C223 HydrophobicContact CE1-CB 4.33Å; F219-C223 HydrophobicContact CE2-CB 4.44Å; F219-C223 WeakPolarHBondContact CE2-SG 3.46Å; F219-C223 HydrophobicContact CZ-CB 4.2Å; F219-C223 VanDerWaalsContact CZ-SG 3.58Å; F219-C223 PolarHBondContact O-N 3.1Å; F219-C223 VanDerWaalsContact O-N 3.1Å; C223-P225 VanDerWaalsContact C-CD 3.46Å
224	R	46.5	Very low	48	Very low	129 Å²	129	65.5 Å²	65.5	49%	0.487	36%	0.36	S	S	.	.			trans	-123.2	73.2	176.7	-82.2	-170.2	176.3	-148.7	-7.3	114.4	N220 L226	N220-R224 VanDerWaalsContact O-CB 3.28Å; N220-R224 WeakPolarHBondContact O-CB 3.44Å; N220-R224 VanDerWaalsContact O-CD 3.23Å; N220-R224 WeakPolarHBondContact O-CD 3.23Å; N220-R224 WeakPolarHBondContact O-CG 3.48Å; N220-R224 PolarHBondContact OD1-NE 3.37Å; R224-L226 HydrophobicContact CB-CG 4.11Å; R224-L226 HydrophobicContact CG-CD2 4.42Å; R224-L226 HydrophobicContact CG-CG 4.15Å; R224-L226 PolarHBondContact O-N 3Å; R224-L226 VanDerWaalsContact O-N 3.12Å
225	P	51.5	Low	49.3	Very low	24 Å²	24	57.6 Å²	57.6	16%	0.156	32%	0.318	C	S	.	.			trans	-77.1	76.5	143.2	36.9	-31	0	0	0	108	W207 C223 G227 L228 Y270	W207-P225 HydrophobicContact CH2-CG 4.13Å; W207-P225 HydrophobicContact CZ2-CG 4.38Å; W207-P225 HydrophobicContact CZ3-CG 4.36Å; C223-P225 VanDerWaalsContact C-CD 3.46Å; P225-G227 CarbonylContact O-C 3.54Å; P225-G227 PolarHBondContact O-N 2.8Å; P225-L228 HydrophobicContact CB-CB 3.67Å; P225-L228 HydrophobicContact CB-CD2 4.18Å; P225-L228 HydrophobicContact CG-CB 3.93Å; P225-L228 HydrophobicContact CG-CD2 4.05Å; P225-L228 PolarHBondContact O-N 2.7Å; P225-Y270 HydrophobicContact CB-CD2 3.63Å; P225-Y270 HydrophobicContact CB-CE2 3.94Å; P225-Y270 HydrophobicContact CG-CD2 4.13Å; P225-Y270 HydrophobicContact CG-CE2 3.92Å
226	L	49.4	Very low	50.2	Low	116 Å²	116	54.6 Å²	54.6	61%	0.607	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.8	-26.9	-173.8	-87.3	159.3	0	0	0	114.1	R224	R224-L226 HydrophobicContact CB-CG 4.11Å; R224-L226 HydrophobicContact CG-CD2 4.42Å; R224-L226 HydrophobicContact CG-CG 4.15Å; R224-L226 PolarHBondContact O-N 3Å; R224-L226 VanDerWaalsContact O-N 3.12Å
227	G	54.5	Low	51.2	Low	31 Å²	31	54.3 Å²	54.3	32%	0.32	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-43.7	170.7	0	0	0	0	0	114.4	P225 G229 H230 C231	P225-G227 CarbonylContact O-C 3.54Å; P225-G227 PolarHBondContact O-N 2.8Å; G227-G229 PolarHBondContact O-N 3.23Å; G227-H230 CarbonylContact O-C 3.5Å; G227-H230 WeakPolarHBondContact O-CA 3.42Å; G227-H230 WeakPolarHBondContact O-CB 3.31Å; G227-H230 PolarHBondContact O-N 3.4Å; G227-H230 VanDerWaalsContact O-N 3.1Å; G227-C231 PolarHBondContact O-N 3.01Å; G227-C231 PolarHBondContact O-SG 3.17Å
228	L	58.5	Low	52.1	Low	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-66.1	-39.4	-161.2	-174.7	72.2	0	0	0	113.9	P225 H230 C231 L232 T266 Y267 Y270 P314	P225-L228 HydrophobicContact CB-CB 3.67Å; P225-L228 HydrophobicContact CB-CD2 4.18Å; P225-L228 HydrophobicContact CG-CB 3.93Å; P225-L228 HydrophobicContact CG-CD2 4.05Å; P225-L228 PolarHBondContact O-N 2.7Å; L228-H230 VanDerWaalsContact C-N 3.34Å; L228-C231 WeakPolarHBondContact O-CB 3.28Å; L228-C231 PolarHBondContact O-N 3.08Å; L228-L232 HydrophobicContact CG-CD1 4.33Å; L228-L232 WeakPolarHBondContact O-CG 3.39Å; L228-L232 PolarHBondContact O-N 3.47Å; L228-T266 HydrophobicContact CB-CG2 4.08Å; L228-T266 HydrophobicContact CD1-CG2 4.42Å; L228-Y267 HydrophobicContact CD1-CD1 3.71Å; L228-Y267 HydrophobicContact CD1-CD2 4.4Å; L228-Y267 HydrophobicContact CD1-CE1 3.57Å; L228-Y267 HydrophobicContact CD1-CE2 4.3Å; L228-Y267 HydrophobicContact CD1-CG 4.18Å; L228-Y270 HydrophobicContact CD2-CD1 3.99Å; L228-Y270 HydrophobicContact CD2-CD2 3.94Å; L228-Y270 HydrophobicContact CD2-CE1 4.19Å; L228-Y270 HydrophobicContact CD2-CE2 4.14Å; L228-Y270 HydrophobicContact CD2-CG 3.84Å; L228-P314 HydrophobicContact CD2-CB 3.65Å; L228-P314 HydrophobicContact CD2-CG 3.66Å
229	G	53.3	Low	53.2	Low	14 Å²	14	48.8 Å²	48.8	14%	0.144	25%	0.247	C	C	.	.	H	α-helix	trans	-60.7	-43.8	173.7	0	0	0	0	0	111.8	G227 F233	G227-G229 PolarHBondContact O-N 3.23Å; G229-F233 WeakPolarHBondContact O-CB 3.46Å; G229-F233 PolarHBondContact O-N 3.13Å
230	H	58.5	Low	54.2	Low	135 Å²	135	48.7 Å²	48.7	63%	0.625	25%	0.247	S	C	*	.	H	α-helix	trans	-65.7	-36.6	172.7	-79	-87.6	0	0	0	112.6	G227 L228 F233 R234	G227-H230 CarbonylContact O-C 3.5Å; G227-H230 WeakPolarHBondContact O-CA 3.42Å; G227-H230 WeakPolarHBondContact O-CB 3.31Å; G227-H230 PolarHBondContact O-N 3.4Å; G227-H230 VanDerWaalsContact O-N 3.1Å; L228-H230 VanDerWaalsContact C-N 3.34Å; H230-F233 PolarHBondContact O-N 2.75Å; H230-R234 WeakPolarHBondContact O-CG 3.32Å; H230-R234 PolarHBondContact O-N 3.43Å
231	C	59.7	Low	55.3	Low	4 Å²	4	48.6 Å²	48.6	3%	0.027	25%	0.246	C	C	.	.	H	α-helix	trans	-60.1	-53	176.1	-63.3	0	0	0	0	111	G227 L228 F233 R234 L235 H259 Q263 T266	G227-C231 PolarHBondContact O-N 3.01Å; G227-C231 PolarHBondContact O-SG 3.17Å; L228-C231 WeakPolarHBondContact O-CB 3.28Å; L228-C231 PolarHBondContact O-N 3.08Å; C231-F233 VanDerWaalsContact C-N 3.32Å; C231-F233 PolarHBondContact O-N 3.27Å; C231-R234 PolarHBondContact O-N 3.46Å; C231-L235 PolarHBondContact O-N 3.26Å; C231-H259 PolarHBondContact O-CE1 3.28Å; C231-Q263 HydrophobicContact CB-CB 4.35Å; C231-Q263 HydrophobicContact CB-CG 4Å; C231-Q263 VanDerWaalsContact SG-CD 3.59Å; C231-Q263 PolarHBondContact SG-OE1 2.93Å; C231-T266 VanDerWaalsContact SG-CG2 3.54Å
232	L	59.5	Low	56.2	Low	8 Å²	8	44.8 Å²	44.8	4%	0.042	23%	0.226	C	C	.	.	H	α-helix	trans	-61.7	-41.1	179	-71.5	168.3	0	0	0	111.1	V204 L228 L235 L236 Y267	V204-L232 HydrophobicContact CG2-CB 3.51Å; V204-L232 HydrophobicContact CG2-CD1 4.33Å; L228-L232 HydrophobicContact CG-CD1 4.33Å; L228-L232 WeakPolarHBondContact O-CG 3.39Å; L228-L232 PolarHBondContact O-N 3.47Å; L232-L235 PolarHBondContact O-N 2.88Å; L232-L236 WeakPolarHBondContact O-CB 3.2Å; L232-L236 WeakPolarHBondContact O-CD1 3.32Å; L232-L236 VanDerWaalsContact O-CG 3.27Å; L232-L236 WeakPolarHBondContact O-CG 3.46Å; L232-L236 PolarHBondContact O-N 3.03Å; L232-Y267 WeakPolarHBondContact CD2-OH 3.38Å
233	F	58.5	Low	56.8	Low	61 Å²	61	44.2 Å²	44.2	27%	0.268	23%	0.225	S	C	.	.	H	α-helix	trans	-61.7	-44.5	174.2	-174.9	-99	0	0	0	112.8	L150 V204 G229 H230 C231 L235 L236 N237	L150-F233 HydrophobicContact CD1-CE2 3.59Å; L150-F233 HydrophobicContact CD1-CZ 3.67Å; V204-F233 HydrophobicContact CG1-CB 4.06Å; V204-F233 HydrophobicContact CG1-CD2 4.1Å; G229-F233 WeakPolarHBondContact O-CB 3.46Å; G229-F233 PolarHBondContact O-N 3.13Å; H230-F233 PolarHBondContact O-N 2.75Å; C231-F233 VanDerWaalsContact C-N 3.32Å; C231-F233 PolarHBondContact O-N 3.27Å; F233-L235 PolarHBondContact O-N 3.15Å; F233-L236 PolarHBondContact O-N 3.43Å; F233-N237 WeakPolarHBondContact O-CB 3.34Å; F233-N237 PolarHBondContact O-N 3.26Å
234	R	64.4	Low	57.5	Low	138 Å²	138	46.9 Å²	46.9	52%	0.521	24%	0.235	S	C	.	.	H	α-helix	trans	-62	-43.1	176.6	-73.3	-176.1	86	-124.8	1.9	111.8	H230 C231 N237 A238	H230-R234 WeakPolarHBondContact O-CG 3.32Å; H230-R234 PolarHBondContact O-N 3.43Å; C231-R234 PolarHBondContact O-N 3.46Å; R234-N237 PolarHBondContact O-N 3.14Å; R234-A238 WeakPolarHBondContact O-CB 3.08Å; R234-A238 PolarHBondContact O-N 3.01Å
235	L	62.9	Low	57.9	Low	1 Å²	1	44.5 Å²	44.5	1%	0.005	23%	0.232	C	C	.	.	H	α-helix	trans	-59.3	-50.2	174.6	179	59.9	0	0	0	111.1	C231 L232 F233 N237 A238 L239 I255 L256 H259 Y321	C231-L235 PolarHBondContact O-N 3.26Å; L232-L235 PolarHBondContact O-N 2.88Å; F233-L235 PolarHBondContact O-N 3.15Å; L235-N237 VanDerWaalsContact C-N 3.32Å; L235-N237 PolarHBondContact O-N 3.23Å; L235-A238 PolarHBondContact O-N 3.37Å; L235-L239 HydrophobicContact CD1-CD1 3.59Å; L235-L239 HydrophobicContact CD1-CD2 4.48Å; L235-L239 HydrophobicContact CD1-CG 3.86Å; L235-L239 HydrophobicContact CD2-CD1 4.34Å; L235-L239 HydrophobicContact CG-CD1 3.62Å; L235-L239 HydrophobicContact CG-CG 4.27Å; L235-L239 VanDerWaalsContact O-CB 3.28Å; L235-L239 WeakPolarHBondContact O-CB 3.21Å; L235-L239 WeakPolarHBondContact O-CG 3.4Å; L235-L239 PolarHBondContact O-N 3Å; L235-I255 HydrophobicContact CD1-CG2 4.38Å; L235-L256 HydrophobicContact CD1-CD1 4.36Å; L235-H259 HydrophobicContact CD1-CB 3.74Å; L235-Y321 VanDerWaalsContact CD2-OH 3.27Å; L235-Y321 WeakPolarHBondContact CD2-OH 3.4Å
236	L	58.7	Low	57.9	Low	14 Å²	14	44.2 Å²	44.2	7%	0.073	23%	0.23	C	C	.	.	H	α-helix	trans	-59.9	-40.9	-179.6	-77.5	166.5	0	0	0	112.7	W197 K200 I201 V204 L232 F233 F240	W197-L236 HydrophobicContact CB-CD2 4.12Å; K200-L236 HydrophobicContact CB-CD1 4.06Å; K200-L236 HydrophobicContact CB-CD2 3.87Å; K200-L236 HydrophobicContact CB-CG 4.29Å; K200-L236 HydrophobicContact CD-CD2 4.1Å; I201-L236 HydrophobicContact CB-CD1 4.42Å; I201-L236 HydrophobicContact CD1-CD2 4.08Å; I201-L236 HydrophobicContact CG1-CD1 3.59Å; I201-L236 HydrophobicContact CG1-CD2 3.64Å; I201-L236 HydrophobicContact CG1-CG 4.12Å; V204-L236 HydrophobicContact CB-CD1 4.41Å; V204-L236 HydrophobicContact CG2-CD1 3.93Å; L232-L236 WeakPolarHBondContact O-CB 3.2Å; L232-L236 WeakPolarHBondContact O-CD1 3.32Å; L232-L236 VanDerWaalsContact O-CG 3.27Å; L232-L236 WeakPolarHBondContact O-CG 3.46Å; L232-L236 PolarHBondContact O-N 3.03Å; F233-L236 PolarHBondContact O-N 3.43Å; L236-F240 VanDerWaalsContact O-CB 3.27Å; L236-F240 WeakPolarHBondContact O-CB 3.27Å; L236-F240 PolarHBondContact O-N 3.46Å
237	N	60.1	Low	58	Low	59 Å²	59	39.2 Å²	39.2	32%	0.316	20%	0.204	S	C	.	.	H	α-helix	trans	-70	-41.3	178.8	-164	44.6	0	0	0	112.3	F233 R234 L235 F240 L241	F233-N237 WeakPolarHBondContact O-CB 3.34Å; F233-N237 PolarHBondContact O-N 3.26Å; R234-N237 PolarHBondContact O-N 3.14Å; L235-N237 VanDerWaalsContact C-N 3.32Å; L235-N237 PolarHBondContact O-N 3.23Å; N237-F240 PolarHBondContact O-N 3Å; N237-L241 WeakPolarHBondContact O-CG 3.35Å; N237-L241 PolarHBondContact O-N 3.32Å
238	A	61.4	Low	57.9	Low	36 Å²	36	40.5 Å²	40.5	30%	0.298	20%	0.202	S	C	.	.	H	α-helix	trans	-63.7	-44	175.7	0	0	0	0	0	111.7	R234 L235 L241 S242 I255	R234-A238 WeakPolarHBondContact O-CB 3.08Å; R234-A238 PolarHBondContact O-N 3.01Å; L235-A238 PolarHBondContact O-N 3.37Å; A238-L241 PolarHBondContact O-N 3.31Å; A238-S242 PolarHBondContact O-N 3.47Å; A238-I255 HydrophobicContact CB-CG2 3.62Å
239	L	60.4	Low	58.1	Low	4 Å²	4	41 Å²	41	2%	0.021	21%	0.205	C	C	.	.	H	α-helix	trans	-64	-39.5	175.4	-72	177.8	0	0	0	112.3	W197 L235 S242 V243 I252 I255	W197-L239 HydrophobicContact CD2-CB 4.1Å; W197-L239 HydrophobicContact CD2-CD1 4.17Å; W197-L239 HydrophobicContact CE3-CB 3.91Å; W197-L239 HydrophobicContact CH2-CB 3.52Å; W197-L239 HydrophobicContact CH2-CD2 4.08Å; W197-L239 HydrophobicContact CH2-CG 4.25Å; W197-L239 WeakPolarHBondContact CH2-O 3.39Å; W197-L239 HydrophobicContact CZ2-CB 3.72Å; W197-L239 HydrophobicContact CZ2-CD1 3.93Å; W197-L239 HydrophobicContact CZ2-CD2 3.7Å; W197-L239 HydrophobicContact CZ2-CG 3.98Å; W197-L239 VanDerWaalsContact CZ3-C 3.43Å; W197-L239 HydrophobicContact CZ3-CB 3.61Å; W197-L239 WeakPolarHBondContact CZ3-O 3.22Å; L235-L239 HydrophobicContact CD1-CD1 3.59Å; L235-L239 HydrophobicContact CD1-CD2 4.48Å; L235-L239 HydrophobicContact CD1-CG 3.86Å; L235-L239 HydrophobicContact CD2-CD1 4.34Å; L235-L239 HydrophobicContact CG-CD1 3.62Å; L235-L239 HydrophobicContact CG-CG 4.27Å; L235-L239 VanDerWaalsContact O-CB 3.28Å; L235-L239 WeakPolarHBondContact O-CB 3.21Å; L235-L239 WeakPolarHBondContact O-CG 3.4Å; L235-L239 PolarHBondContact O-N 3Å; L239-S242 WeakPolarHBondContact O-CB 3.47Å; L239-S242 PolarHBondContact O-N 3.25Å; L239-V243 PolarHBondContact O-N 2.81Å; L239-I252 HydrophobicContact CD2-CG1 4.22Å; L239-I255 HydrophobicContact CD2-CB 4.25Å; L239-I255 HydrophobicContact CD2-CG2 3.7Å; L239-I255 HydrophobicContact CG-CG2 4.02Å
240	F	59.1	Low	58.4	Low	39 Å²	39	43.4 Å²	43.4	17%	0.171	22%	0.215	C	C	.	.	H	α-helix	trans	-60.9	-46	172.7	170.7	-107.2	0	0	0	112.3	L150 I153 L236 N237 S242 V243 K244	L150-F240 HydrophobicContact CD2-CD1 4.09Å; L150-F240 HydrophobicContact CD2-CE1 4.33Å; L150-F240 HydrophobicContact CD2-CG 4.36Å; I153-F240 HydrophobicContact CD1-CE2 3.56Å; I153-F240 HydrophobicContact CD1-CZ 3.92Å; L236-F240 VanDerWaalsContact O-CB 3.27Å; L236-F240 WeakPolarHBondContact O-CB 3.27Å; L236-F240 PolarHBondContact O-N 3.46Å; N237-F240 PolarHBondContact O-N 3Å; F240-S242 VanDerWaalsContact C-N 3.28Å; F240-S242 PolarHBondContact O-N 3.37Å; F240-V243 PolarHBondContact O-N 3Å; F240-K244 PolarHBondContact O-N 3.04Å
241	L	60.5	Low	58.7	Low	77 Å²	77	41.4 Å²	41.4	40%	0.403	21%	0.206	S	C	.	.	H	α-helix	trans	-62.2	-36.8	176.4	-69.5	165.4	0	0	0	111.5	N237 A238 K244 N245	N237-L241 WeakPolarHBondContact O-CG 3.35Å; N237-L241 PolarHBondContact O-N 3.32Å; A238-L241 PolarHBondContact O-N 3.31Å; L241-K244 PolarHBondContact O-N 3.13Å; L241-N245 VanDerWaalsContact O-CB 3.31Å; L241-N245 WeakPolarHBondContact O-CB 3.46Å; L241-N245 PolarHBondContact O-N 2.97Å; L241-N245 PolarHBondContact O-ND2 2.81Å; L241-N245 PolarHBondContact O-OD1 3.2Å
242	S	60.5	Low	59.2	Low	2 Å²	2	42.1 Å²	42.1	1%	0.014	21%	0.209	C	C	.	.	H	α-helix	trans	-61.8	-46.6	173.6	-164.1	0	0	0	0	112.6	A238 L239 F240 K244 N245 C246 I255	A238-S242 PolarHBondContact O-N 3.47Å; L239-S242 WeakPolarHBondContact O-CB 3.47Å; L239-S242 PolarHBondContact O-N 3.25Å; F240-S242 VanDerWaalsContact C-N 3.28Å; F240-S242 PolarHBondContact O-N 3.37Å; S242-K244 VanDerWaalsContact C-N 3.34Å; S242-K244 PolarHBondContact O-N 3.04Å; S242-N245 PolarHBondContact O-N 3.25Å; S242-C246 PolarHBondContact O-N 3.29Å; S242-I255 VanDerWaalsContact CB-CD1 3.43Å
243	V	54.4	Low	59.6	Low	20 Å²	20	42.4 Å²	42.4	12%	0.121	21%	0.21	C	C	.	.	H	α-helix	trans	-59.6	-43.8	172.4	169.2	0	0	0	0	111.6	F142 W197 L239 F240 N245 L249	F142-V243 HydrophobicContact CE2-CG1 3.66Å; F142-V243 VanDerWaalsContact CE2-O 3.3Å; F142-V243 WeakPolarHBondContact CE2-O 3.27Å; F142-V243 HydrophobicContact CZ-CG1 3.82Å; W197-V243 HydrophobicContact CE3-CG2 4.45Å; W197-V243 HydrophobicContact CH2-CG2 3.59Å; W197-V243 HydrophobicContact CZ3-CB 4.42Å; W197-V243 HydrophobicContact CZ3-CG2 3.33Å; L239-V243 PolarHBondContact O-N 2.81Å; F240-V243 PolarHBondContact O-N 3Å; V243-N245 VanDerWaalsContact C-N 3.26Å; V243-N245 PolarHBondContact O-N 3.21Å; V243-L249 HydrophobicContact CB-CD2 4.24Å; V243-L249 HydrophobicContact CG2-CD1 4.47Å; V243-L249 HydrophobicContact CG2-CD2 3.34Å; V243-L249 HydrophobicContact CG2-CG 4.39Å
244	K	56.2	Low	60.3	Low	73 Å²	73	45.6 Å²	45.6	32%	0.317	23%	0.226	S	C	.	.	H	α-helix	trans	-62.2	-35.7	179.9	-171.8	179.4	179.7	-177.7	0	111.8	T141 F142 F240 L241 S242	T141-K244 WeakPolarHBondContact CA-O 3.39Å; T141-K244 VanDerWaalsContact CB-O 3.3Å; T141-K244 WeakPolarHBondContact CB-O 3.38Å; F142-K244 PolarHBondContact N-O 2.92Å; F142-K244 VanDerWaalsContact N-O 3.16Å; F240-K244 PolarHBondContact O-N 3.04Å; L241-K244 PolarHBondContact O-N 3.13Å; S242-K244 VanDerWaalsContact C-N 3.34Å; S242-K244 PolarHBondContact O-N 3.04Å
245	N	53.4	Low	60.8	Low	79 Å²	79	40.5 Å²	40.5	42%	0.422	21%	0.208	S	C	.	.	H	α-helix	trans	-88.8	-33.4	-175.3	-67	-10	0	0	0	113.9	L241 S242 V243	L241-N245 VanDerWaalsContact O-CB 3.31Å; L241-N245 WeakPolarHBondContact O-CB 3.46Å; L241-N245 PolarHBondContact O-N 2.97Å; L241-N245 PolarHBondContact O-ND2 2.81Å; L241-N245 PolarHBondContact O-OD1 3.2Å; S242-N245 PolarHBondContact O-N 3.25Å; V243-N245 VanDerWaalsContact C-N 3.26Å; V243-N245 PolarHBondContact O-N 3.21Å
246	C	51.8	Low	61.2	Low	17 Å²	17	41.2 Å²	41.2	12%	0.115	21%	0.212	C	C	.	.			trans	-148.7	110.9	-177.4	-165.2	0	0	0	0	112.3	S242 M248 L249	S242-C246 PolarHBondContact O-N 3.29Å; C246-M248 PolarHBondContact O-N 3.15Å; C246-L249 PolarHBondContact O-N 3.14Å; C246-L249 VanDerWaalsContact O-N 3.08Å
247	I	52.7	Low	62	Low	11 Å²	11	41.4 Å²	41.4	6%	0.056	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-26.9	178.1	-57.9	177.3	0	0	0	112.2	F142 W165 S174 A176 L249	F142-I247 HydrophobicContact CE2-CG1 4.17Å; W165-I247 HydrophobicContact CH2-CG2 4.12Å; W165-I247 HydrophobicContact CZ2-CG2 3.65Å; S174-I247 WeakPolarHBondContact OG-CD1 3.41Å; A176-I247 HydrophobicContact CB-CG2 3.87Å; I247-L249 VanDerWaalsContact C-N 3.29Å; I247-L249 PolarHBondContact O-N 2.97Å
248	M	52.2	Low	63	Low	58 Å²	58	43.4 Å²	43.4	29%	0.286	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-11.2	179.4	-62.6	-64.4	-68.1	0	0	114	L136 L182 C246 D250	L136-M248 HydrophobicContact CD1-SD 4.28Å; L182-M248 HydrophobicContact CD1-CE 3.63Å; L182-M248 HydrophobicContact CD1-SD 3.64Å; C246-M248 PolarHBondContact O-N 3.15Å; M248-D250 VanDerWaalsContact C-N 3.25Å; M248-D250 PolarHBondContact O-N 3.15Å
249	L	62.3	Low	63.8	Low	11 Å²	11	42.2 Å²	42.2	6%	0.058	21%	0.214	C	C	.	.			trans	59.1	27.7	173.6	-68.5	169.2	0	0	0	115.8	C190 W197 V243 C246 I247 E251 I252	C190-L249 HydrophobicContact CB-CD1 3.91Å; W197-L249 HydrophobicContact CH2-CD2 4.14Å; V243-L249 HydrophobicContact CB-CD2 4.24Å; V243-L249 HydrophobicContact CG2-CD1 4.47Å; V243-L249 HydrophobicContact CG2-CD2 3.34Å; V243-L249 HydrophobicContact CG2-CG 4.39Å; C246-L249 PolarHBondContact O-N 3.14Å; C246-L249 VanDerWaalsContact O-N 3.08Å; I247-L249 VanDerWaalsContact C-N 3.29Å; I247-L249 PolarHBondContact O-N 2.97Å; L249-E251 PolarHBondContact O-N 3.44Å; L249-I252 HydrophobicContact CB-CD1 3.61Å; L249-I252 HydrophobicContact CB-CG1 3.93Å; L249-I252 HydrophobicContact CD1-CD1 3.83Å; L249-I252 HydrophobicContact CD2-CD1 3.72Å; L249-I252 HydrophobicContact CD2-CG1 3.94Å; L249-I252 HydrophobicContact CG-CD1 3.91Å; L249-I252 HydrophobicContact CG-CG1 4.43Å; L249-I252 WeakPolarHBondContact O-CB 3.41Å; L249-I252 PolarHBondContact O-N 2.88Å; L249-I252 VanDerWaalsContact O-N 3.15Å
250	D	58.5	Low	64.6	Low	65 Å²	65	42 Å²	42	35%	0.348	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-33.4	-175	-75.1	-46.1	0	0	0	113.3	M248 R338	M248-D250 VanDerWaalsContact C-N 3.25Å; M248-D250 PolarHBondContact O-N 3.15Å; D250-R338 IonicContact OD1-NH1 3.22Å; D250-R338 PolarHBondContact OD1-NH1 3.05Å
251	E	66.4	Low	65.7	Low	93 Å²	93	42.6 Å²	42.6	44%	0.435	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-6	-178.3	-61	176.9	165.4	0	0	115.1	L249 F253 E254 I255	L249-E251 PolarHBondContact O-N 3.44Å; E251-F253 PolarHBondContact O-N 3.07Å; E251-E254 PolarHBondContact O-N 2.99Å; E251-E254 VanDerWaalsContact O-N 3.12Å; E251-I255 HydrophobicContact CB-CD1 4.08Å; E251-I255 WeakPolarHBondContact O-CG1 3.48Å; E251-I255 PolarHBondContact O-N 3.19Å
252	I	68.6	Low	66.8	Low	19 Å²	19	43.8 Å²	43.8	10%	0.097	23%	0.229	C	C	.	.	H	α-helix	trans	-51.9	-39.5	-175.2	-84.2	-174.3	0	0	0	112.4	W197 L239 L249 L256	W197-I252 HydrophobicContact CH2-CD1 4.03Å; W197-I252 HydrophobicContact CH2-CG1 4.38Å; W197-I252 HydrophobicContact CZ2-CD1 3.58Å; W197-I252 HydrophobicContact CZ2-CG1 4.11Å; L239-I252 HydrophobicContact CD2-CG1 4.22Å; L249-I252 HydrophobicContact CB-CD1 3.61Å; L249-I252 HydrophobicContact CB-CG1 3.93Å; L249-I252 HydrophobicContact CD1-CD1 3.83Å; L249-I252 HydrophobicContact CD2-CD1 3.72Å; L249-I252 HydrophobicContact CD2-CG1 3.94Å; L249-I252 HydrophobicContact CG-CD1 3.91Å; L249-I252 HydrophobicContact CG-CG1 4.43Å; L249-I252 WeakPolarHBondContact O-CB 3.41Å; L249-I252 PolarHBondContact O-N 2.88Å; L249-I252 VanDerWaalsContact O-N 3.15Å; I252-L256 WeakPolarHBondContact O-CB 3.43Å; I252-L256 PolarHBondContact O-N 3.46Å
253	F	69.8	Low	67.5	Low	13 Å²	13	44.9 Å²	44.9	6%	0.057	23%	0.234	C	C	.	.	H	α-helix	trans	-73.3	-33.6	-173.8	-64.3	-88.5	0	0	0	112.8	E251 A257 I325 V328 R338 S341	E251-F253 PolarHBondContact O-N 3.07Å; F253-A257 WeakPolarHBondContact O-CB 3.32Å; F253-A257 PolarHBondContact O-N 3.48Å; F253-I325 HydrophobicContact CD1-CG2 3.92Å; F253-I325 HydrophobicContact CE1-CG2 3.83Å; F253-V328 HydrophobicContact CE1-CB 4.2Å; F253-V328 HydrophobicContact CE1-CG2 4.44Å; F253-V328 HydrophobicContact CE2-CG1 4.3Å; F253-V328 HydrophobicContact CZ-CB 3.65Å; F253-V328 HydrophobicContact CZ-CG1 3.61Å; F253-V328 HydrophobicContact CZ-CG2 3.93Å; F253-R338 HydrophobicContact CB-CB 4.03Å; F253-R338 HydrophobicContact CB-CG 3.71Å; F253-R338 HydrophobicContact CD1-CB 4.07Å; F253-R338 HydrophobicContact CD1-CG 4.44Å; F253-R338 HydrophobicContact CD2-CB 4.31Å; F253-R338 HydrophobicContact CD2-CG 3.85Å; F253-R338 HydrophobicContact CG-CB 3.86Å; F253-R338 HydrophobicContact CG-CG 3.73Å; F253-S341 PolarHBondContact O-OG 3.13Å
254	E	72.9	Confident	68.7	Low	129 Å²	129	45.2 Å²	45.2	60%	0.603	23%	0.234	S	C	*	.	H	α-helix	trans	-72.9	-47.1	175.5	-60.5	-173.3	171.1	0	0	109.4	E251 L256 A257 D258	E251-E254 PolarHBondContact O-N 2.99Å; E251-E254 VanDerWaalsContact O-N 3.12Å; E254-L256 VanDerWaalsContact C-N 3.3Å; E254-L256 PolarHBondContact O-N 3.41Å; E254-A257 PolarHBondContact O-N 3.02Å; E254-D258 WeakPolarHBondContact O-CB 3.39Å; E254-D258 PolarHBondContact O-N 3.18Å
255	I	74	Confident	69.8	Low	31 Å²	31	45.1 Å²	45.1	16%	0.159	24%	0.243	C	C	.	.	H	α-helix	trans	-59.4	-41.3	175.2	-66.3	166	0	0	0	111.6	L235 A238 L239 S242 E251 H259	L235-I255 HydrophobicContact CD1-CG2 4.38Å; A238-I255 HydrophobicContact CB-CG2 3.62Å; L239-I255 HydrophobicContact CD2-CB 4.25Å; L239-I255 HydrophobicContact CD2-CG2 3.7Å; L239-I255 HydrophobicContact CG-CG2 4.02Å; S242-I255 VanDerWaalsContact CB-CD1 3.43Å; E251-I255 HydrophobicContact CB-CD1 4.08Å; E251-I255 WeakPolarHBondContact O-CG1 3.48Å; E251-I255 PolarHBondContact O-N 3.19Å; I255-H259 VanDerWaalsContact O-CB 3.31Å; I255-H259 WeakPolarHBondContact O-CB 3.42Å; I255-H259 PolarHBondContact O-N 2.91Å
256	L	72.5	Confident	70.9	Confident	16 Å²	16	42.7 Å²	42.7	8%	0.084	23%	0.231	C	C	.	.	H	α-helix	trans	-69.2	-43.7	176.9	-174.4	59.9	0	0	0	111	L235 I252 E254 H259 L260 Y321 I325	L235-L256 HydrophobicContact CD1-CD1 4.36Å; I252-L256 WeakPolarHBondContact O-CB 3.43Å; I252-L256 PolarHBondContact O-N 3.46Å; E254-L256 VanDerWaalsContact C-N 3.3Å; E254-L256 PolarHBondContact O-N 3.41Å; L256-H259 PolarHBondContact O-N 3.14Å; L256-L260 HydrophobicContact CD1-CD1 4.19Å; L256-L260 HydrophobicContact CD1-CD2 4.48Å; L256-L260 HydrophobicContact CD1-CG 4.2Å; L256-L260 HydrophobicContact CG-CD1 3.91Å; L256-L260 HydrophobicContact CG-CG 4.37Å; L256-L260 WeakPolarHBondContact O-CG 3.28Å; L256-L260 PolarHBondContact O-N 3.47Å; L256-Y321 HydrophobicContact CD1-CD1 3.85Å; L256-Y321 HydrophobicContact CD1-CE1 3.78Å; L256-Y321 HydrophobicContact CD1-CG 4.47Å; L256-Y321 HydrophobicContact CD2-CD1 4.33Å; L256-I325 HydrophobicContact CD2-CD1 3.65Å; L256-I325 HydrophobicContact CD2-CG1 3.62Å; L256-I325 HydrophobicContact CG-CD1 4.49Å
257	A	75.2	Confident	72.1	Confident	17 Å²	17	41.9 Å²	41.9	14%	0.14	23%	0.225	C	C	.	.	H	α-helix	trans	-59.2	-51.5	175.8	0	0	0	0	0	111.7	F253 E254 H259 L260 A261 L344	F253-A257 WeakPolarHBondContact O-CB 3.32Å; F253-A257 PolarHBondContact O-N 3.48Å; E254-A257 PolarHBondContact O-N 3.02Å; A257-H259 VanDerWaalsContact C-N 3.28Å; A257-H259 PolarHBondContact O-N 3.47Å; A257-L260 PolarHBondContact O-N 3.37Å; A257-L260 VanDerWaalsContact O-N 3.16Å; A257-A261 WeakPolarHBondContact O-CB 3.22Å; A257-A261 PolarHBondContact O-N 3.35Å; A257-L344 HydrophobicContact CB-CD2 3.83Å; A257-L344 VanDerWaalsContact O-CD2 3.24Å; A257-L344 WeakPolarHBondContact O-CD2 3.47Å
258	D	80.1	Confident	73.3	Confident	101 Å²	101	42 Å²	42	54%	0.54	23%	0.226	S	C	.	.	H	α-helix	trans	-56.9	-41.3	176.9	-92.3	5.5	0	0	0	112.2	E254 Q262	E254-D258 WeakPolarHBondContact O-CB 3.39Å; E254-D258 PolarHBondContact O-N 3.18Å; D258-Q262 VanDerWaalsContact O-CB 3.29Å; D258-Q262 WeakPolarHBondContact O-CB 3.46Å; D258-Q262 WeakPolarHBondContact O-CG 3.23Å; D258-Q262 PolarHBondContact O-N 3.14Å
259	H	78.1	Confident	74.4	Confident	11 Å²	11	43.5 Å²	43.5	5%	0.051	24%	0.236	C	C	.	.	H	α-helix	trans	-64.6	-47.5	176	176.2	74.4	0	0	0	112.6	C231 L235 I255 L256 A257 A261 Q262 Q263 Y267	C231-H259 PolarHBondContact O-CE1 3.28Å; L235-H259 HydrophobicContact CD1-CB 3.74Å; I255-H259 VanDerWaalsContact O-CB 3.31Å; I255-H259 WeakPolarHBondContact O-CB 3.42Å; I255-H259 PolarHBondContact O-N 2.91Å; L256-H259 PolarHBondContact O-N 3.14Å; A257-H259 VanDerWaalsContact C-N 3.28Å; A257-H259 PolarHBondContact O-N 3.47Å; H259-A261 VanDerWaalsContact C-N 3.33Å; H259-A261 PolarHBondContact O-N 3.47Å; H259-Q262 PolarHBondContact O-N 3.31Å; H259-Q263 WeakPolarHBondContact O-CB 3.49Å; H259-Q263 WeakPolarHBondContact O-CG 3.42Å; H259-Q263 PolarHBondContact O-N 2.82Å; H259-Y267 AromaticContact NE2-CE2 3.71Å
260	L	77.8	Confident	75	Confident	1 Å²	1	43.2 Å²	43.2	1%	0.005	23%	0.234	C	C	.	.	H	α-helix	trans	-63.8	-39.9	-179.8	-64.1	168.6	0	0	0	110.8	L256 A257 E264 Y321 L344 A345 M348	L256-L260 HydrophobicContact CD1-CD1 4.19Å; L256-L260 HydrophobicContact CD1-CD2 4.48Å; L256-L260 HydrophobicContact CD1-CG 4.2Å; L256-L260 HydrophobicContact CG-CD1 3.91Å; L256-L260 HydrophobicContact CG-CG 4.37Å; L256-L260 WeakPolarHBondContact O-CG 3.28Å; L256-L260 PolarHBondContact O-N 3.47Å; A257-L260 PolarHBondContact O-N 3.37Å; A257-L260 VanDerWaalsContact O-N 3.16Å; L260-E264 PolarHBondContact O-N 3.4Å; L260-E264 VanDerWaalsContact O-N 3.15Å; L260-Y321 HydrophobicContact CD2-CD2 3.47Å; L260-Y321 VanDerWaalsContact CD2-CD2 3.47Å; L260-Y321 HydrophobicContact CD2-CE2 3.72Å; L260-Y321 HydrophobicContact CD2-CG 4.13Å; L260-L344 HydrophobicContact CB-CD2 4.38Å; L260-L344 HydrophobicContact CB-CG 4.18Å; L260-A345 HydrophobicContact CD1-CB 3.81Å; L260-M348 HydrophobicContact CB-SD 3.79Å; L260-M348 HydrophobicContact CD2-CE 4.15Å; L260-M348 HydrophobicContact CD2-SD 3.32Å; L260-M348 WeakPolarHBondContact CD2-SD 3.22Å; L260-M348 HydrophobicContact CG-SD 4.1Å
261	A	82.5	Confident	76	Confident	51 Å²	51	40.2 Å²	40.2	42%	0.421	22%	0.218	S	C	.	.	H	α-helix	trans	-64.7	-47.9	174.1	0	0	0	0	0	112.5	A257 H259 Q263 L344	A257-A261 WeakPolarHBondContact O-CB 3.22Å; A257-A261 PolarHBondContact O-N 3.35Å; H259-A261 VanDerWaalsContact C-N 3.33Å; H259-A261 PolarHBondContact O-N 3.47Å; A261-Q263 PolarHBondContact O-N 3.38Å; A261-L344 HydrophobicContact CB-CD2 4.18Å
262	Q	82.3	Confident	76.3	Confident	101 Å²	101	36.5 Å²	36.5	47%	0.472	20%	0.202	S	C	.	.	H	α-helix	trans	-71	-29.5	-177.9	-72.3	177	27.3	0	0	113.5	D258 H259	D258-Q262 VanDerWaalsContact O-CB 3.29Å; D258-Q262 WeakPolarHBondContact O-CB 3.46Å; D258-Q262 WeakPolarHBondContact O-CG 3.23Å; D258-Q262 PolarHBondContact O-N 3.14Å; H259-Q262 PolarHBondContact O-N 3.31Å
263	Q	76	Confident	76.6	Confident	25 Å²	25	37.6 Å²	37.6	12%	0.117	21%	0.211	C	C	.	.	H	α-helix	trans	-110.2	8.8	-171.9	-52.4	-49.8	-37.9	0	0	114.3	C231 H259 A261 S265 T266 Y267	C231-Q263 HydrophobicContact CB-CB 4.35Å; C231-Q263 HydrophobicContact CB-CG 4Å; C231-Q263 VanDerWaalsContact SG-CD 3.59Å; C231-Q263 PolarHBondContact SG-OE1 2.93Å; H259-Q263 WeakPolarHBondContact O-CB 3.49Å; H259-Q263 WeakPolarHBondContact O-CG 3.42Å; H259-Q263 PolarHBondContact O-N 2.82Å; A261-Q263 PolarHBondContact O-N 3.38Å; Q263-S265 VanDerWaalsContact C-N 3.28Å; Q263-S265 PolarHBondContact O-N 2.8Å; Q263-T266 PolarHBondContact O-N 3.46Å; Q263-T266 PolarHBondContact OE1-OG1 3.26Å; Q263-Y267 HydrophobicContact CB-CD2 4.21Å; Q263-Y267 HydrophobicContact CB-CE2 4.33Å; Q263-Y267 WeakPolarHBondContact O-CD2 3.25Å; Q263-Y267 PolarHBondContact O-N 3.3Å
264	E	80.7	Confident	76.9	Confident	28 Å²	28	37.1 Å²	37.1	13%	0.131	21%	0.21	C	C	.	.	H	α-helix	trans	-45.7	-50.7	176.7	-164.4	-170.2	102.2	0	0	111.8	L260 T266 Y267 V268 R347 K351	L260-E264 PolarHBondContact O-N 3.4Å; L260-E264 VanDerWaalsContact O-N 3.15Å; E264-T266 PolarHBondContact O-N 3.14Å; E264-Y267 PolarHBondContact O-N 3.42Å; E264-V268 WeakPolarHBondContact O-CB 3.47Å; E264-V268 WeakPolarHBondContact O-CG2 3.46Å; E264-V268 PolarHBondContact O-N 3.32Å; E264-R347 IonicContact OE2-CZ 3.91Å; E264-R347 IonicContact OE2-NH1 3.45Å; E264-R347 PolarHBondContact OE2-NH1 2.81Å; E264-R347 IonicContact OE2-NH2 2.66Å; E264-R347 PolarHBondContact OE2-NH2 3.47Å; E264-K351 HydrophobicContact CG-CD 4.29Å; E264-K351 VanDerWaalsContact OE1-CD 3.25Å; E264-K351 WeakPolarHBondContact OE1-CD 3.42Å; E264-K351 WeakPolarHBondContact OE1-CE 3.42Å; E264-K351 IonicContact OE1-NZ 2.73Å; E264-K351 PolarHBondContact OE1-NZ 2.84Å
265	S	78.6	Confident	77.1	Confident	71 Å²	71	32.9 Å²	32.9	50%	0.497	19%	0.194	S	C	.	.	H	α-helix	trans	-64.9	-36.9	-179.4	58.6	0	0	0	0	113.6	Q263 N269	Q263-S265 VanDerWaalsContact C-N 3.28Å; Q263-S265 PolarHBondContact O-N 2.8Å; S265-N269 VanDerWaalsContact O-CB 3.32Å; S265-N269 WeakPolarHBondContact O-CB 3.37Å; S265-N269 PolarHBondContact O-N 3.12Å; S265-N269 PolarHBondContact O-ND2 3Å; S265-N269 VanDerWaalsContact O-ND2 3.14Å
266	T	76.7	Confident	77	Confident	28 Å²	28	37.6 Å²	37.6	17%	0.172	21%	0.211	C	C	.	.	H	α-helix	trans	-67.1	-43.2	-179.6	-55.3	0	0	0	0	111.4	L228 C231 Q263 E264 Y270	L228-T266 HydrophobicContact CB-CG2 4.08Å; L228-T266 HydrophobicContact CD1-CG2 4.42Å; C231-T266 VanDerWaalsContact SG-CG2 3.54Å; Q263-T266 PolarHBondContact O-N 3.46Å; Q263-T266 PolarHBondContact OE1-OG1 3.26Å; E264-T266 PolarHBondContact O-N 3.14Å; T266-Y270 PolarHBondContact O-N 3.43Å; T266-Y270 VanDerWaalsContact O-N 3.07Å
267	Y	75.4	Confident	77	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-70.4	-41.3	176.5	-80	-81.8	0	0	0	112.3	L228 L232 H259 Q263 E264 N269 Y270 C271 V318 M348	L228-Y267 HydrophobicContact CD1-CD1 3.71Å; L228-Y267 HydrophobicContact CD1-CD2 4.4Å; L228-Y267 HydrophobicContact CD1-CE1 3.57Å; L228-Y267 HydrophobicContact CD1-CE2 4.3Å; L228-Y267 HydrophobicContact CD1-CG 4.18Å; L232-Y267 WeakPolarHBondContact CD2-OH 3.38Å; H259-Y267 AromaticContact NE2-CE2 3.71Å; Q263-Y267 HydrophobicContact CB-CD2 4.21Å; Q263-Y267 HydrophobicContact CB-CE2 4.33Å; Q263-Y267 WeakPolarHBondContact O-CD2 3.25Å; Q263-Y267 PolarHBondContact O-N 3.3Å; E264-Y267 PolarHBondContact O-N 3.42Å; Y267-N269 VanDerWaalsContact C-N 3.35Å; Y267-N269 PolarHBondContact O-N 3.21Å; Y267-Y270 PolarHBondContact O-N 2.91Å; Y267-Y270 VanDerWaalsContact O-N 3.15Å; Y267-C271 WeakPolarHBondContact O-CB 3.31Å; Y267-C271 PolarHBondContact O-N 3.06Å; Y267-C271 PolarHBondContact O-SG 2.68Å; Y267-V318 HydrophobicContact CD1-CG2 3.14Å; Y267-V318 HydrophobicContact CE1-CG2 3.37Å; Y267-V318 HydrophobicContact CG-CG2 3.75Å; Y267-M348 VanDerWaalsContact CB-CE 3.45Å; Y267-M348 HydrophobicContact CD1-CE 4.37Å; Y267-M348 HydrophobicContact CD2-CE 3.1Å; Y267-M348 HydrophobicContact CE2-CE 3.8Å; Y267-M348 HydrophobicContact CG-CE 3.41Å; Y267-M348 VanDerWaalsContact CG-CE 3.41Å
268	V	78.3	Confident	77.2	Confident	14 Å²	14	38.1 Å²	38.1	9%	0.085	21%	0.21	C	C	.	.	H	α-helix	trans	-58.2	-45.8	175.2	166.9	0	0	0	0	111.4	E264 Y270 C271 S272 K351 T355	E264-V268 WeakPolarHBondContact O-CB 3.47Å; E264-V268 WeakPolarHBondContact O-CG2 3.46Å; E264-V268 PolarHBondContact O-N 3.32Å; V268-Y270 VanDerWaalsContact C-N 3.32Å; V268-Y270 PolarHBondContact O-N 3.26Å; V268-C271 PolarHBondContact O-N 2.96Å; V268-S272 PolarHBondContact O-N 2.95Å; V268-S272 PolarHBondContact O-OG 3.13Å; V268-K351 HydrophobicContact CG2-CB 4.44Å; V268-K351 HydrophobicContact CG2-CD 4.31Å; V268-K351 HydrophobicContact CG2-CG 4.01Å; V268-T355 HydrophobicContact CG1-CG2 3.82Å; V268-T355 WeakPolarHBondContact CG1-OG1 3.4Å
269	N	75.1	Confident	77.1	Confident	89 Å²	89	36.5 Å²	36.5	48%	0.476	20%	0.198	S	C	.	.	H	α-helix	trans	-67.7	-29.2	176.9	-70.4	-23.9	0	0	0	113.4	S265 Y267 S272 S273	S265-N269 VanDerWaalsContact O-CB 3.32Å; S265-N269 WeakPolarHBondContact O-CB 3.37Å; S265-N269 PolarHBondContact O-N 3.12Å; S265-N269 PolarHBondContact O-ND2 3Å; S265-N269 VanDerWaalsContact O-ND2 3.14Å; Y267-N269 VanDerWaalsContact C-N 3.35Å; Y267-N269 PolarHBondContact O-N 3.21Å; N269-S272 PolarHBondContact O-OG 2.69Å; N269-S272 VanDerWaalsContact O-OG 3.09Å; N269-S273 PolarHBondContact O-OG 3.26Å
270	Y	75.5	Confident	76.9	Confident	4 Å²	4	37.5 Å²	37.5	2%	0.016	21%	0.205	C	C	.	.	H	α-helix	trans	-71.2	-50.6	173.4	-172.9	-108.6	0	0	0	111.2	P225 L228 T266 Y267 V268 S272 S273 L274 L311 P314	P225-Y270 HydrophobicContact CB-CD2 3.63Å; P225-Y270 HydrophobicContact CB-CE2 3.94Å; P225-Y270 HydrophobicContact CG-CD2 4.13Å; P225-Y270 HydrophobicContact CG-CE2 3.92Å; L228-Y270 HydrophobicContact CD2-CD1 3.99Å; L228-Y270 HydrophobicContact CD2-CD2 3.94Å; L228-Y270 HydrophobicContact CD2-CE1 4.19Å; L228-Y270 HydrophobicContact CD2-CE2 4.14Å; L228-Y270 HydrophobicContact CD2-CG 3.84Å; T266-Y270 PolarHBondContact O-N 3.43Å; T266-Y270 VanDerWaalsContact O-N 3.07Å; Y267-Y270 PolarHBondContact O-N 2.91Å; Y267-Y270 VanDerWaalsContact O-N 3.15Å; V268-Y270 VanDerWaalsContact C-N 3.32Å; V268-Y270 PolarHBondContact O-N 3.26Å; Y270-S272 VanDerWaalsContact C-N 3.34Å; Y270-S272 PolarHBondContact O-N 2.81Å; Y270-S273 PolarHBondContact O-N 3.21Å; Y270-S273 PolarHBondContact O-OG 3.4Å; Y270-L274 HydrophobicContact CE1-CD1 4.36Å; Y270-L274 PolarHBondContact O-N 3.29Å; Y270-L274 VanDerWaalsContact O-N 3.07Å; Y270-L311 WeakPolarHBondContact OH-CA 3.4Å; Y270-L311 WeakPolarHBondContact OH-CD2 3.5Å; Y270-L311 PolarHBondContact OH-O 2.96Å; Y270-P314 HydrophobicContact CD1-CB 3.84Å; Y270-P314 HydrophobicContact CD1-CG 4.25Å; Y270-P314 HydrophobicContact CE1-CB 3.61Å; Y270-P314 HydrophobicContact CE1-CG 3.56Å
271	C	78.8	Confident	76.8	Confident	2 Å²	2	37.6 Å²	37.6	1%	0.014	21%	0.205	C	C	.	.	H	α-helix	trans	-57.8	-43.1	178.1	-77.3	0	0	0	0	112.3	Y267 V268 S273 L274 C352 I356	Y267-C271 WeakPolarHBondContact O-CB 3.31Å; Y267-C271 PolarHBondContact O-N 3.06Å; Y267-C271 PolarHBondContact O-SG 2.68Å; V268-C271 PolarHBondContact O-N 2.96Å; C271-S273 VanDerWaalsContact C-N 3.3Å; C271-S273 PolarHBondContact O-N 3.32Å; C271-L274 WeakPolarHBondContact O-CB 3.17Å; C271-L274 PolarHBondContact O-N 3.02Å; C271-C352 HydrophobicContact CB-CB 4.16Å; C271-I356 HydrophobicContact CB-CD1 3.88Å; C271-I356 HydrophobicContact CB-CG1 3.94Å; C271-I356 WeakPolarHBondContact O-CG1 3.44Å
272	S	74.6	Confident	76.9	Confident	16 Å²	16	42.1 Å²	42.1	11%	0.112	21%	0.211	C	C	.	.	H	α-helix	trans	-63.6	-31.9	178.5	67	0	0	0	0	114.2	V268 N269 Y270	V268-S272 PolarHBondContact O-N 2.95Å; V268-S272 PolarHBondContact O-OG 3.13Å; N269-S272 PolarHBondContact O-OG 2.69Å; N269-S272 VanDerWaalsContact O-OG 3.09Å; Y270-S272 VanDerWaalsContact C-N 3.34Å; Y270-S272 PolarHBondContact O-N 2.81Å
273	S	72.9	Confident	76.6	Confident	41 Å²	41	41.4 Å²	41.4	29%	0.287	21%	0.211	S	C	.	.	H	α-helix	trans	-92.3	-8.2	-179.6	59.4	0	0	0	0	113.7	N269 Y270 C271 Y276 Q277	N269-S273 PolarHBondContact O-OG 3.26Å; Y270-S273 PolarHBondContact O-N 3.21Å; Y270-S273 PolarHBondContact O-OG 3.4Å; C271-S273 VanDerWaalsContact C-N 3.3Å; C271-S273 PolarHBondContact O-N 3.32Å; S273-Y276 WeakPolarHBondContact O-CB 3.36Å; S273-Y276 PolarHBondContact O-N 2.68Å; S273-Q277 WeakPolarHBondContact O-CG 3.45Å; S273-Q277 PolarHBondContact O-N 3.09Å; S273-Q277 PolarHBondContact OG-NE2 3.25Å; S273-Q277 VanDerWaalsContact OG-NE2 3.11Å
274	L	76.4	Confident	76.5	Confident	4 Å²	4	41.6 Å²	41.6	2%	0.021	21%	0.213	C	C	.	.	H	α-helix	trans	-64.6	-44.5	-174.6	-175.4	54.8	0	0	0	112.7	Y270 C271 Y276 Q277 Q278 L311 M312 M315	Y270-L274 HydrophobicContact CE1-CD1 4.36Å; Y270-L274 PolarHBondContact O-N 3.29Å; Y270-L274 VanDerWaalsContact O-N 3.07Å; C271-L274 WeakPolarHBondContact O-CB 3.17Å; C271-L274 PolarHBondContact O-N 3.02Å; L274-Y276 VanDerWaalsContact C-N 3.27Å; L274-Y276 PolarHBondContact O-N 2.93Å; L274-Q277 PolarHBondContact O-N 2.88Å; L274-Q277 VanDerWaalsContact O-N 3.16Å; L274-Q278 HydrophobicContact CD1-CG 4.2Å; L274-Q278 WeakPolarHBondContact O-CG 3.49Å; L274-Q278 PolarHBondContact O-N 3.42Å; L274-L311 HydrophobicContact CD1-CB 4.23Å; L274-L311 VanDerWaalsContact CD1-O 3.27Å; L274-L311 WeakPolarHBondContact CD1-O 3.48Å; L274-M312 HydrophobicContact CD1-SD 4.01Å; L274-M312 HydrophobicContact CD2-CE 3.86Å; L274-M312 HydrophobicContact CD2-SD 3.71Å; L274-M312 HydrophobicContact CG-SD 3.91Å; L274-M315 HydrophobicContact CD2-CB 3.8Å; L274-M315 HydrophobicContact CD2-CG 4.37Å; L274-M315 HydrophobicContact CD2-SD 3.72Å
275	S	76.9	Confident	76.3	Confident	39 Å²	39	44.2 Å²	44.2	27%	0.273	22%	0.221	S	C	.	.	H	α-helix	trans	-60.1	-37.8	177	-64.1	0	0	0	0	112	K279 E360	S275-K279 WeakPolarHBondContact O-CB 3.33Å; S275-K279 WeakPolarHBondContact O-CG 3.3Å; S275-K279 PolarHBondContact O-N 2.99Å; S275-E360 PolarHBondContact OG-OE1 2.87Å
276	Y	73.4	Confident	76.2	Confident	131 Å²	131	49.3 Å²	49.3	51%	0.514	23%	0.234	S	C	.	.	H	α-helix	trans	-66.2	-47.9	172.6	176.8	-95.4	0	0	0	112	S273 L274 Q278 K279 T280	S273-Y276 WeakPolarHBondContact O-CB 3.36Å; S273-Y276 PolarHBondContact O-N 2.68Å; L274-Y276 VanDerWaalsContact C-N 3.27Å; L274-Y276 PolarHBondContact O-N 2.93Å; Y276-Q278 VanDerWaalsContact C-N 3.3Å; Y276-Q278 PolarHBondContact O-N 3.34Å; Y276-K279 PolarHBondContact O-N 3.11Å; Y276-T280 PolarHBondContact O-N 3.32Å; Y276-T280 PolarHBondContact O-OG1 2.95Å
277	Q	71.9	Confident	76.1	Confident	22 Å²	22	53.6 Å²	53.6	10%	0.103	25%	0.253	C	S	.	.	H	α-helix	trans	-55.9	-44.8	176.3	-68.8	168.1	31.7	0	0	111.3	S273 L274 T280 L281	S273-Q277 WeakPolarHBondContact O-CG 3.45Å; S273-Q277 PolarHBondContact O-N 3.09Å; S273-Q277 PolarHBondContact OG-NE2 3.25Å; S273-Q277 VanDerWaalsContact OG-NE2 3.11Å; L274-Q277 PolarHBondContact O-N 2.88Å; L274-Q277 VanDerWaalsContact O-N 3.16Å; Q277-T280 PolarHBondContact O-N 3.3Å; Q277-L281 VanDerWaalsContact O-CB 3.27Å; Q277-L281 WeakPolarHBondContact O-CB 3.32Å; Q277-L281 PolarHBondContact O-N 3.46Å
278	Q	79.5	Confident	75.9	Confident	21 Å²	21	60.8 Å²	60.8	10%	0.098	29%	0.286	C	S	.	.	H	α-helix	trans	-68.6	-36.8	178.5	-65.7	-69.2	-8.4	0	0	113	L274 Y276 R282 S308 M312	L274-Q278 HydrophobicContact CD1-CG 4.2Å; L274-Q278 WeakPolarHBondContact O-CG 3.49Å; L274-Q278 PolarHBondContact O-N 3.42Å; Y276-Q278 VanDerWaalsContact C-N 3.3Å; Y276-Q278 PolarHBondContact O-N 3.34Å; Q278-R282 WeakPolarHBondContact O-CG 3.32Å; Q278-R282 PolarHBondContact O-N 2.92Å; Q278-R282 PolarHBondContact O-NE 3.34Å; Q278-S308 PolarHBondContact NE2-O 3.37Å; Q278-S308 PolarHBondContact OE1-OG 2.92Å; Q278-M312 HydrophobicContact CG-SD 4.19Å; Q278-M312 PolarHBondContact NE2-SD 3.28Å; Q278-M312 VanDerWaalsContact NE2-SD 3.39Å
279	K	78.1	Confident	75.7	Confident	67 Å²	67	62.3 Å²	62.3	29%	0.291	29%	0.292	S	S	.	.	H	α-helix	trans	-63.2	-49.4	171.3	-79.7	174.2	170.1	-178.1	0	110.8	S275 Y276 L281 R282 N283 E363	S275-K279 WeakPolarHBondContact O-CB 3.33Å; S275-K279 WeakPolarHBondContact O-CG 3.3Å; S275-K279 PolarHBondContact O-N 2.99Å; Y276-K279 PolarHBondContact O-N 3.11Å; K279-L281 PolarHBondContact O-N 3.49Å; K279-R282 PolarHBondContact O-N 3.06Å; K279-N283 PolarHBondContact O-N 3.25Å; K279-N283 VanDerWaalsContact O-N 3.1Å; K279-E363 IonicContact NZ-OE1 2.89Å; K279-E363 PolarHBondContact NZ-OE1 3.34Å; K279-E363 IonicContact NZ-OE2 3.8Å; K279-E363 PolarHBondContact NZ-OE2 3.41Å
280	T	73.4	Confident	75.6	Confident	32 Å²	32	59.9 Å²	59.9	20%	0.196	28%	0.282	C	S	.	.	H	α-helix	trans	-70.4	-34.1	-176.8	-42.9	0	0	0	0	111.9	F222 Y276 Q277 N283 L284	F222-T280 HydrophobicContact CE1-CG2 4.05Å; F222-T280 HydrophobicContact CZ-CG2 3.48Å; F222-T280 VanDerWaalsContact CZ-CG2 3.48Å; Y276-T280 PolarHBondContact O-N 3.32Å; Y276-T280 PolarHBondContact O-OG1 2.95Å; Q277-T280 PolarHBondContact O-N 3.3Å; T280-N283 PolarHBondContact O-N 3.11Å; T280-L284 PolarHBondContact O-N 3.2Å
281	L	76.9	Confident	75.5	Confident	4 Å²	4	66.7 Å²	66.7	2%	0.021	31%	0.311	C	S	.	.	H	α-helix	trans	-63.3	-42.7	172.4	179.2	62.2	0	0	0	111.9	F222 Q277 K279 N283 L284 R285 I293 L307 L311	F222-L281 HydrophobicContact CE1-CB 4.38Å; Q277-L281 VanDerWaalsContact O-CB 3.27Å; Q277-L281 WeakPolarHBondContact O-CB 3.32Å; Q277-L281 PolarHBondContact O-N 3.46Å; K279-L281 PolarHBondContact O-N 3.49Å; L281-N283 VanDerWaalsContact C-N 3.27Å; L281-N283 PolarHBondContact O-N 3.45Å; L281-L284 PolarHBondContact O-N 3.09Å; L281-R285 PolarHBondContact O-N 2.8Å; L281-I293 HydrophobicContact CD1-CD1 3.73Å; L281-I293 HydrophobicContact CD1-CG1 4.3Å; L281-L307 HydrophobicContact CD1-CD2 3.97Å; L281-L307 HydrophobicContact CD2-CB 4.32Å; L281-L307 HydrophobicContact CD2-CG 4.27Å; L281-L311 HydrophobicContact CD2-CD1 4.35Å
282	R	83	Confident	75.1	Confident	145 Å²	145	68.3 Å²	68.3	55%	0.547	32%	0.324	S	S	.	.	H	α-helix	trans	-60.6	-36.4	173.4	-79.1	-176.9	-70.9	165	-6.7	112.3	Q278 K279	Q278-R282 WeakPolarHBondContact O-CG 3.32Å; Q278-R282 PolarHBondContact O-N 2.92Å; Q278-R282 PolarHBondContact O-NE 3.34Å; K279-R282 PolarHBondContact O-N 3.06Å
283	N	77.1	Confident	74.8	Confident	87 Å²	87	67.6 Å²	67.6	47%	0.465	32%	0.319	S	S	.	.	H	α-helix	trans	-72.2	-41.5	176.5	-71	-18	0	0	0	112.3	K279 T280 L281 R285 K286	K279-N283 PolarHBondContact O-N 3.25Å; K279-N283 VanDerWaalsContact O-N 3.1Å; T280-N283 PolarHBondContact O-N 3.11Å; L281-N283 VanDerWaalsContact C-N 3.27Å; L281-N283 PolarHBondContact O-N 3.45Å; N283-R285 VanDerWaalsContact C-N 3.32Å; N283-R285 PolarHBondContact O-N 2.86Å; N283-K286 WeakPolarHBondContact O-CB 3.47Å; N283-K286 PolarHBondContact O-N 3.35Å; N283-K286 VanDerWaalsContact O-N 3.08Å
284	L	73.3	Confident	75	Confident	29 Å²	29	71.7 Å²	71.7	15%	0.152	33%	0.332	C	S	.	.	H	α-helix	trans	-63.3	-34.4	175.8	-73.8	-175.8	0	0	0	113.2	F222 T280 L281 K286 Q287 F289 I293	F222-L284 HydrophobicContact CD2-CD1 4.28Å; F222-L284 HydrophobicContact CE1-CD1 4.1Å; F222-L284 HydrophobicContact CE2-CD1 3.42Å; F222-L284 VanDerWaalsContact CE2-CD1 3.42Å; F222-L284 HydrophobicContact CZ-CD1 3.29Å; F222-L284 HydrophobicContact CZ-CG 4.09Å; T280-L284 PolarHBondContact O-N 3.2Å; L281-L284 PolarHBondContact O-N 3.09Å; L284-K286 PolarHBondContact O-N 2.97Å; L284-Q287 PolarHBondContact O-N 3.4Å; L284-Q287 VanDerWaalsContact O-N 3.07Å; L284-F289 HydrophobicContact CB-CB 4.3Å; L284-F289 HydrophobicContact CB-CD1 4.18Å; L284-F289 HydrophobicContact CD1-CD1 3.84Å; L284-F289 HydrophobicContact CD1-CE1 4.24Å; L284-F289 HydrophobicContact CD1-CG 4.47Å; L284-F289 HydrophobicContact CD2-CB 4.28Å; L284-F289 HydrophobicContact CD2-CG 4.48Å; L284-F289 HydrophobicContact CG-CD1 4.45Å; L284-I293 HydrophobicContact CB-CD1 4.03Å
285	R	77.2	Confident	74.8	Confident	83 Å²	83	75.8 Å²	75.8	31%	0.313	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-18.7	173.4	-76.9	-173.6	176.3	158.2	-3.4	114	L281 N283 C290 I293 E297	L281-R285 PolarHBondContact O-N 2.8Å; N283-R285 VanDerWaalsContact C-N 3.32Å; N283-R285 PolarHBondContact O-N 2.86Å; R285-C290 WeakPolarHBondContact O-CB 3.44Å; R285-I293 HydrophobicContact CG-CD1 3.62Å; R285-I293 HydrophobicContact CG-CG2 4.48Å; R285-E297 IonicContact CZ-OE1 3.98Å; R285-E297 IonicContact NH2-OE1 3.25Å; R285-E297 PolarHBondContact NH2-OE1 3.35Å; R285-E297 IonicContact NH2-OE2 2.66Å
286	K	76.6	Confident	74.3	Confident	177 Å²	177	75.4 Å²	75.4	77%	0.77	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-1.8	174.8	-62.5	178.1	179.5	-179	0	113.4	N283 L284	N283-K286 WeakPolarHBondContact O-CB 3.47Å; N283-K286 PolarHBondContact O-N 3.35Å; N283-K286 VanDerWaalsContact O-N 3.08Å; L284-K286 PolarHBondContact O-N 2.97Å
287	Q	73.7	Confident	74.2	Confident	119 Å²	119	70.8 Å²	70.8	56%	0.556	34%	0.337	S	S	*	.	S	Bend	trans	-116.3	177.3	-178	-63.1	176.9	-6.9	0	0	109.9	L284 F289 C290	L284-Q287 PolarHBondContact O-N 3.4Å; L284-Q287 VanDerWaalsContact O-N 3.07Å; Q287-F289 PolarHBondContact O-N 3.45Å; Q287-C290 WeakPolarHBondContact O-CB 3.45Å; Q287-C290 PolarHBondContact O-N 3.07Å
288	E	71.6	Confident	74.1	Confident	150 Å²	150	77.5 Å²	77.5	70%	0.701	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	-24.2	177.2	-70.3	-54	129.7	0	0	114.1	C290 K291	E288-C290 PolarHBondContact O-N 3.16Å; E288-C290 VanDerWaalsContact O-N 3.09Å; E288-K291 PolarHBondContact O-N 3.31Å; E288-K291 IonicContact OE2-NZ 3.94Å; E288-K291 PolarHBondContact OE2-NZ 3.39Å
289	F	73.1	Confident	73.3	Confident	47 Å²	47	79.2 Å²	79.2	21%	0.206	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-12.2	177.2	-151.3	-102.8	0	0	0	114.5	T216 L284 Q287 K291 A292 I293	T216-F289 HydrophobicContact CG2-CE2 3.77Å; T216-F289 HydrophobicContact CG2-CZ 4.2Å; L284-F289 HydrophobicContact CB-CB 4.3Å; L284-F289 HydrophobicContact CB-CD1 4.18Å; L284-F289 HydrophobicContact CD1-CD1 3.84Å; L284-F289 HydrophobicContact CD1-CE1 4.24Å; L284-F289 HydrophobicContact CD1-CG 4.47Å; L284-F289 HydrophobicContact CD2-CB 4.28Å; L284-F289 HydrophobicContact CD2-CG 4.48Å; L284-F289 HydrophobicContact CG-CD1 4.45Å; Q287-F289 PolarHBondContact O-N 3.45Å; F289-K291 PolarHBondContact O-N 2.93Å; F289-A292 HydrophobicContact CD1-CB 4.37Å; F289-A292 HydrophobicContact CD2-CB 4.09Å; F289-A292 HydrophobicContact CE1-CB 4.15Å; F289-A292 HydrophobicContact CE2-CB 3.86Å; F289-A292 HydrophobicContact CG-CB 4.34Å; F289-A292 HydrophobicContact CZ-CB 3.88Å; F289-A292 PolarHBondContact O-N 3.42Å; F289-A292 VanDerWaalsContact O-N 3.11Å; F289-I293 HydrophobicContact CD1-CD1 3.86Å; F289-I293 HydrophobicContact CD1-CG1 3.66Å; F289-I293 HydrophobicContact CE1-CD1 4.5Å; F289-I293 HydrophobicContact CE1-CG1 3.92Å; F289-I293 PolarHBondContact O-N 3.1Å
290	C	74.3	Confident	72.5	Confident	38 Å²	38	84.5 Å²	84.5	26%	0.257	40%	0.404	S	S	.	.	H	α-helix	trans	-53.9	-36.7	174.6	-171	0	0	0	0	113.1	R285 Q287 E288 K294	R285-C290 WeakPolarHBondContact O-CB 3.44Å; Q287-C290 WeakPolarHBondContact O-CB 3.45Å; Q287-C290 PolarHBondContact O-N 3.07Å; E288-C290 PolarHBondContact O-N 3.16Å; E288-C290 VanDerWaalsContact O-N 3.09Å; C290-K294 WeakPolarHBondContact O-CG 3.5Å; C290-K294 PolarHBondContact O-N 3.27Å; C290-K294 VanDerWaalsContact O-N 3.1Å
291	K	72	Confident	71.6	Confident	147 Å²	147	86.6 Å²	86.6	64%	0.639	41%	0.412	S	S	*	.	H	α-helix	trans	-64.4	-46.6	176.3	-67.4	168.1	-174.3	150.1	0	111.4	E288 F289 I293 K294 C295	E288-K291 PolarHBondContact O-N 3.31Å; E288-K291 IonicContact OE2-NZ 3.94Å; E288-K291 PolarHBondContact OE2-NZ 3.39Å; F289-K291 PolarHBondContact O-N 2.93Å; K291-I293 PolarHBondContact O-N 3.38Å; K291-K294 PolarHBondContact O-N 2.92Å; K291-C295 PolarHBondContact O-N 3.39Å; K291-C295 PolarHBondContact O-SG 3.11Å; K291-C295 VanDerWaalsContact O-SG 3.36Å
292	A	70.2	Confident	70.6	Confident	35 Å²	35	86.5 Å²	86.5	29%	0.289	41%	0.411	S	S	.	.	H	α-helix	trans	-62.2	-44	178.5	0	0	0	0	0	112	F289 K294 C295 I296	F289-A292 HydrophobicContact CD1-CB 4.37Å; F289-A292 HydrophobicContact CD2-CB 4.09Å; F289-A292 HydrophobicContact CE1-CB 4.15Å; F289-A292 HydrophobicContact CE2-CB 3.86Å; F289-A292 HydrophobicContact CG-CB 4.34Å; F289-A292 HydrophobicContact CZ-CB 3.88Å; F289-A292 PolarHBondContact O-N 3.42Å; F289-A292 VanDerWaalsContact O-N 3.11Å; A292-K294 VanDerWaalsContact C-N 3.33Å; A292-K294 PolarHBondContact O-N 3.26Å; A292-C295 PolarHBondContact O-N 3.06Å; A292-C295 VanDerWaalsContact O-N 3.15Å; A292-I296 WeakPolarHBondContact O-CD1 3.47Å; A292-I296 WeakPolarHBondContact O-CG1 3.48Å; A292-I296 PolarHBondContact O-N 3.4Å
293	I	70.2	Confident	69.7	Low	2 Å²	2	85.3 Å²	85.3	1%	0.01	41%	0.412	C	S	.	.	H	α-helix	trans	-58.2	-45.6	175.5	-65.1	166.6	0	0	0	110.7	L281 L284 R285 F289 K291 C295 I296 E297	L281-I293 HydrophobicContact CD1-CD1 3.73Å; L281-I293 HydrophobicContact CD1-CG1 4.3Å; L284-I293 HydrophobicContact CB-CD1 4.03Å; R285-I293 HydrophobicContact CG-CD1 3.62Å; R285-I293 HydrophobicContact CG-CG2 4.48Å; F289-I293 HydrophobicContact CD1-CD1 3.86Å; F289-I293 HydrophobicContact CD1-CG1 3.66Å; F289-I293 HydrophobicContact CE1-CD1 4.5Å; F289-I293 HydrophobicContact CE1-CG1 3.92Å; F289-I293 PolarHBondContact O-N 3.1Å; K291-I293 PolarHBondContact O-N 3.38Å; I293-C295 VanDerWaalsContact C-N 3.3Å; I293-C295 PolarHBondContact O-N 3.02Å; I293-I296 PolarHBondContact O-N 3Å; I293-E297 HydrophobicContact CG2-CG 4.23Å; I293-E297 WeakPolarHBondContact O-CG 3.49Å; I293-E297 PolarHBondContact O-N 3.44Å
294	K	75.9	Confident	69.2	Low	127 Å²	127	88 Å²	88	55%	0.552	43%	0.426	S	S	*	.	H	α-helix	trans	-65.9	-27.9	177.9	-74.2	-178.2	179.4	-175.4	0	113.9	C290 K291 A292 K298	C290-K294 WeakPolarHBondContact O-CG 3.5Å; C290-K294 PolarHBondContact O-N 3.27Å; C290-K294 VanDerWaalsContact O-N 3.1Å; K291-K294 PolarHBondContact O-N 2.92Å; A292-K294 VanDerWaalsContact C-N 3.33Å; A292-K294 PolarHBondContact O-N 3.26Å; K294-K298 WeakPolarHBondContact O-CG 3.47Å
295	C	71.5	Confident	68.9	Low	89 Å²	89	89.4 Å²	89.4	60%	0.601	43%	0.432	S	S	*	.	H	α-helix	trans	-70.4	-43.9	172.2	-66.4	0	0	0	0	110.9	K291 A292 I293 K298	K291-C295 PolarHBondContact O-N 3.39Å; K291-C295 PolarHBondContact O-SG 3.11Å; K291-C295 VanDerWaalsContact O-SG 3.36Å; A292-C295 PolarHBondContact O-N 3.06Å; A292-C295 VanDerWaalsContact O-N 3.15Å; I293-C295 VanDerWaalsContact C-N 3.3Å; I293-C295 PolarHBondContact O-N 3.02Å; C295-K298 PolarHBondContact O-N 2.98Å
296	I	67.5	Low	68.9	Low	31 Å²	31	87.7 Å²	87.7	16%	0.159	43%	0.433	C	S	.	.	H	α-helix	trans	-63.4	-42.7	176.7	-66.1	154.5	0	0	0	111	F206 F219 A292 I293 K298 T299 L302	F206-I296 HydrophobicContact CZ-CG2 4.44Å; F219-I296 HydrophobicContact CD2-CD1 3.72Å; F219-I296 HydrophobicContact CE2-CD1 3.54Å; F219-I296 HydrophobicContact CE2-CG1 4.3Å; F219-I296 HydrophobicContact CE2-CG2 4.22Å; F219-I296 HydrophobicContact CZ-CD1 4.26Å; F219-I296 HydrophobicContact CZ-CG2 4.34Å; A292-I296 WeakPolarHBondContact O-CD1 3.47Å; A292-I296 WeakPolarHBondContact O-CG1 3.48Å; A292-I296 PolarHBondContact O-N 3.4Å; I293-I296 PolarHBondContact O-N 3Å; I296-K298 PolarHBondContact O-N 3.1Å; I296-K298 VanDerWaalsContact O-N 3.09Å; I296-T299 PolarHBondContact O-N 3.06Å; I296-T299 VanDerWaalsContact O-N 3.16Å; I296-T299 PolarHBondContact O-OG1 3.47Å; I296-L302 HydrophobicContact CG2-CD1 3.55Å; I296-L302 WeakPolarHBondContact O-CD1 3.23Å
297	E	71.7	Confident	68.7	Low	34 Å²	34	79.6 Å²	79.6	16%	0.159	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-10.2	177.9	-70.6	176.3	157.2	0	0	114.2	R285 I293 S306 L307	R285-E297 IonicContact CZ-OE1 3.98Å; R285-E297 IonicContact NH2-OE1 3.25Å; R285-E297 PolarHBondContact NH2-OE1 3.35Å; R285-E297 IonicContact NH2-OE2 2.66Å; I293-E297 HydrophobicContact CG2-CG 4.23Å; I293-E297 WeakPolarHBondContact O-CG 3.49Å; I293-E297 PolarHBondContact O-N 3.44Å; E297-S306 WeakPolarHBondContact OE1-CA 3.33Å; E297-S306 WeakPolarHBondContact OE1-CB 3.34Å; E297-L307 HydrophobicContact CG-CB 4.14Å; E297-L307 PolarHBondContact OE1-N 2.94Å
298	K	68.7	Low	68.9	Low	164 Å²	164	75.4 Å²	75.4	71%	0.713	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.3	-8.5	175.8	-75.1	177.4	176.2	-167.9	0	114.4	K294 C295 I296	K294-K298 WeakPolarHBondContact O-CG 3.47Å; C295-K298 PolarHBondContact O-N 2.98Å; I296-K298 PolarHBondContact O-N 3.1Å; I296-K298 VanDerWaalsContact O-N 3.09Å
299	T	63.6	Low	69.2	Low	56 Å²	56	70.5 Å²	70.5	34%	0.344	36%	0.364	S	S	.	.	S	Bend	trans	-71.6	142.9	179.1	-14.9	0	0	0	0	110.5	I296 E301 L302	I296-T299 PolarHBondContact O-N 3.06Å; I296-T299 VanDerWaalsContact O-N 3.16Å; I296-T299 PolarHBondContact O-OG1 3.47Å; T299-E301 WeakPolarHBondContact CB-OE2 3.36Å; T299-E301 WeakPolarHBondContact CG2-OE2 3.45Å; T299-E301 PolarHBondContact O-N 2.94Å; T299-E301 VanDerWaalsContact O-N 3.15Å; T299-L302 PolarHBondContact O-N 3.34Å
300	E	60.1	Low	69.1	Low	179 Å²	179	68.6 Å²	68.6	84%	0.836	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-59	-31.2	-172.6	-65.7	-170	160.7	0	0	112.8	L302 Q303	E300-L302 PolarHBondContact O-N 2.95Å; E300-Q303 PolarHBondContact O-N 3.4Å
301	E	55.5	Low	69	Low	76 Å²	76	66.8 Å²	66.8	36%	0.355	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-67.1	-19.9	-179.6	-52.6	94.9	144.9	0	0	113.1	F206 T299	F206-E301 HydrophobicContact CB-CB 4.23Å; F206-E301 HydrophobicContact CD2-CB 3.7Å; F206-E301 HydrophobicContact CG-CB 4.47Å; T299-E301 WeakPolarHBondContact CB-OE2 3.36Å; T299-E301 WeakPolarHBondContact CG2-OE2 3.45Å; T299-E301 PolarHBondContact O-N 2.94Å; T299-E301 VanDerWaalsContact O-N 3.15Å
302	L	55.7	Low	69.2	Low	2 Å²	2	62.4 Å²	62.4	1%	0.01	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-90	-8	171.2	-96.7	157.4	0	0	0	113.3	F206 I296 T299 E300 N304 Q305 F310	F206-L302 HydrophobicContact CD2-CD1 4.33Å; F206-L302 HydrophobicContact CD2-CG 3.94Å; F206-L302 HydrophobicContact CE2-CD1 3.4Å; F206-L302 VanDerWaalsContact CE2-CD1 3.4Å; F206-L302 HydrophobicContact CE2-CD2 4.48Å; F206-L302 HydrophobicContact CE2-CG 3.5Å; F206-L302 VanDerWaalsContact CE2-CG 3.5Å; F206-L302 HydrophobicContact CZ-CD1 3.73Å; F206-L302 HydrophobicContact CZ-CG 4.08Å; I296-L302 HydrophobicContact CG2-CD1 3.55Å; I296-L302 WeakPolarHBondContact O-CD1 3.23Å; T299-L302 PolarHBondContact O-N 3.34Å; E300-L302 PolarHBondContact O-N 2.95Å; L302-N304 PolarHBondContact O-N 3.03Å; L302-Q305 VanDerWaalsContact O-CB 3.28Å; L302-Q305 WeakPolarHBondContact O-CB 3.42Å; L302-Q305 WeakPolarHBondContact O-CG 3.2Å; L302-Q305 PolarHBondContact O-N 3.41Å; L302-F310 HydrophobicContact CD2-CB 3.5Å; L302-F310 HydrophobicContact CD2-CD1 4.26Å; L302-F310 HydrophobicContact CD2-CD2 3.77Å; L302-F310 HydrophobicContact CD2-CG 3.58Å
303	Q	63.8	Low	69.3	Low	120 Å²	120	63 Å²	63	56%	0.561	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.6	39.2	178.6	-59.6	-175	-21.2	0	0	113.7	E300 Q305	E300-Q303 PolarHBondContact O-N 3.4Å; Q303-Q305 PolarHBondContact O-N 2.72Å; Q303-Q305 VanDerWaalsContact O-N 3.14Å
304	N	66.2	Low	69.3	Low	143 Å²	143	63.3 Å²	63.3	77%	0.765	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.5	15.2	-173.3	-55.7	-64.9	0	0	0	115.1	L302	L302-N304 PolarHBondContact O-N 3.03Å
305	Q	67.5	Low	69.2	Low	59 Å²	59	60 Å²	60	28%	0.276	31%	0.312	S	S	.	.			trans	-75.9	142.8	170.8	-60.4	-168.1	31	0	0	110.5	L302 Q303 S309	L302-Q305 VanDerWaalsContact O-CB 3.28Å; L302-Q305 WeakPolarHBondContact O-CB 3.42Å; L302-Q305 WeakPolarHBondContact O-CG 3.2Å; L302-Q305 PolarHBondContact O-N 3.41Å; Q303-Q305 PolarHBondContact O-N 2.72Å; Q303-Q305 VanDerWaalsContact O-N 3.14Å; Q305-S309 PolarHBondContact OE1-OG 3.04Å
306	S	78.1	Confident	69.4	Low	47 Å²	47	60.3 Å²	60.3	33%	0.329	31%	0.305	S	S	.	.			trans	-65.6	145.9	171.2	81.5	0	0	0	0	111	E297 S308 S309 F310	E297-S306 WeakPolarHBondContact OE1-CA 3.33Å; E297-S306 WeakPolarHBondContact OE1-CB 3.34Å; S306-S308 PolarHBondContact O-N 2.97Å; S306-S308 VanDerWaalsContact O-N 3.12Å; S306-S309 WeakPolarHBondContact O-CA 3.37Å; S306-S309 WeakPolarHBondContact O-CB 3.24Å; S306-S309 PolarHBondContact O-N 2.62Å; S306-S309 PolarHBondContact OG-N 2.97Å; S306-F310 PolarHBondContact O-N 3.11Å
307	L	71.1	Confident	69.7	Low	6 Å²	6	60.1 Å²	60.1	3%	0.031	30%	0.302	C	S	.	.	H	α-helix	trans	-59	-30.2	-178.9	-177	59.4	0	0	0	112.1	L281 E297 F310 L311	L281-L307 HydrophobicContact CD1-CD2 3.97Å; L281-L307 HydrophobicContact CD2-CB 4.32Å; L281-L307 HydrophobicContact CD2-CG 4.27Å; E297-L307 HydrophobicContact CG-CB 4.14Å; E297-L307 PolarHBondContact OE1-N 2.94Å; L307-F310 PolarHBondContact O-N 2.7Å; L307-L311 HydrophobicContact CG-CD1 4.4Å; L307-L311 VanDerWaalsContact O-CG 3.32Å; L307-L311 WeakPolarHBondContact O-CG 3.4Å; L307-L311 PolarHBondContact O-N 3.22Å; L307-L311 VanDerWaalsContact O-N 3.09Å
308	S	78	Confident	69.7	Low	32 Å²	32	58.6 Å²	58.6	22%	0.224	30%	0.295	C	S	.	.	H	α-helix	trans	-62.8	-44.6	172.6	178.5	0	0	0	0	112	Q278 S306 M312	Q278-S308 PolarHBondContact NE2-O 3.37Å; Q278-S308 PolarHBondContact OE1-OG 2.92Å; S306-S308 PolarHBondContact O-N 2.97Å; S306-S308 VanDerWaalsContact O-N 3.12Å; S308-M312 WeakPolarHBondContact O-CG 3.41Å; S308-M312 PolarHBondContact O-N 3.13Å
309	S	77.5	Confident	70.3	Confident	47 Å²	47	53.9 Å²	53.9	33%	0.329	28%	0.28	S	S	.	.	H	α-helix	trans	-64.5	-45.5	176.1	-174.8	0	0	0	0	111.3	Q305 S306 L311 M312 Q313	Q305-S309 PolarHBondContact OE1-OG 3.04Å; S306-S309 WeakPolarHBondContact O-CA 3.37Å; S306-S309 WeakPolarHBondContact O-CB 3.24Å; S306-S309 PolarHBondContact O-N 2.62Å; S306-S309 PolarHBondContact OG-N 2.97Å; S309-L311 VanDerWaalsContact C-N 3.35Å; S309-L311 PolarHBondContact O-N 3.05Å; S309-M312 WeakPolarHBondContact O-CB 3.34Å; S309-M312 PolarHBondContact O-N 3.24Å; S309-Q313 PolarHBondContact O-N 3.28Å
310	F	71.9	Confident	70.9	Confident	6 Å²	6	58 Å²	58	3%	0.026	29%	0.289	C	S	.	.	H	α-helix	trans	-57.6	-45.1	179	-176.1	-100.2	0	0	0	112.5	F206 W207 L302 S306 L307 M312 Q313	F206-F310 HydrophobicContact CB-CE2 4.31Å; F206-F310 HydrophobicContact CB-CZ 3.84Å; F206-F310 HydrophobicContact CD1-CD1 4.33Å; F206-F310 AromaticContact CD1-CE1 3.35Å; F206-F310 HydrophobicContact CD1-CE1 3.35Å; F206-F310 HydrophobicContact CD1-CE2 4.33Å; F206-F310 AromaticContact CD1-CZ 3.35Å; F206-F310 HydrophobicContact CD1-CZ 3.35Å; F206-F310 HydrophobicContact CE1-CD1 4.25Å; F206-F310 AromaticContact CE1-CE1 3.62Å; F206-F310 HydrophobicContact CE1-CE1 3.62Å; F206-F310 HydrophobicContact CE1-CZ 4.08Å; F206-F310 HydrophobicContact CG-CE1 4.09Å; F206-F310 HydrophobicContact CG-CE2 4.26Å; F206-F310 AromaticContact CG-CZ 3.66Å; F206-F310 HydrophobicContact CG-CZ 3.66Å; W207-F310 AromaticContact CE2-CE1 3.77Å; W207-F310 HydrophobicContact CH2-CE1 4.01Å; W207-F310 HydrophobicContact CZ2-CD1 4.34Å; W207-F310 AromaticContact CZ2-CE1 3.5Å; W207-F310 HydrophobicContact CZ2-CE1 3.5Å; W207-F310 HydrophobicContact CZ2-CZ 4.2Å; W207-F310 AromaticContact NE1-CZ 3.91Å; L302-F310 HydrophobicContact CD2-CB 3.5Å; L302-F310 HydrophobicContact CD2-CD1 4.26Å; L302-F310 HydrophobicContact CD2-CD2 3.77Å; L302-F310 HydrophobicContact CD2-CG 3.58Å; S306-F310 PolarHBondContact O-N 3.11Å; L307-F310 PolarHBondContact O-N 2.7Å; F310-M312 PolarHBondContact O-N 2.95Å; F310-Q313 WeakPolarHBondContact O-CB 3.35Å; F310-Q313 WeakPolarHBondContact O-CG 3.44Å; F310-Q313 PolarHBondContact O-N 2.97Å; F310-Q313 VanDerWaalsContact O-N 3.1Å
311	L	72.1	Confident	71.6	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-66.2	-19.4	175.7	-67.1	171	0	0	0	113.6	W207 Y270 L274 L281 L307 S309	W207-L311 HydrophobicContact CH2-CD2 4.05Å; Y270-L311 WeakPolarHBondContact OH-CA 3.4Å; Y270-L311 WeakPolarHBondContact OH-CD2 3.5Å; Y270-L311 PolarHBondContact OH-O 2.96Å; L274-L311 HydrophobicContact CD1-CB 4.23Å; L274-L311 VanDerWaalsContact CD1-O 3.27Å; L274-L311 WeakPolarHBondContact CD1-O 3.48Å; L281-L311 HydrophobicContact CD2-CD1 4.35Å; L307-L311 HydrophobicContact CG-CD1 4.4Å; L307-L311 VanDerWaalsContact O-CG 3.32Å; L307-L311 WeakPolarHBondContact O-CG 3.4Å; L307-L311 PolarHBondContact O-N 3.22Å; L307-L311 VanDerWaalsContact O-N 3.09Å; S309-L311 VanDerWaalsContact C-N 3.35Å; S309-L311 PolarHBondContact O-N 3.05Å
312	M	76.3	Confident	72.5	Confident	56 Å²	56	46.3 Å²	46.3	28%	0.276	24%	0.235	S	C	.	.	H	α-helix	trans	-80	-22.4	172.7	-64.7	-55.7	-60.2	0	0	113	L274 Q278 S308 S309 F310 P314 M315 Q316	L274-M312 HydrophobicContact CD1-SD 4.01Å; L274-M312 HydrophobicContact CD2-CE 3.86Å; L274-M312 HydrophobicContact CD2-SD 3.71Å; L274-M312 HydrophobicContact CG-SD 3.91Å; Q278-M312 HydrophobicContact CG-SD 4.19Å; Q278-M312 PolarHBondContact NE2-SD 3.28Å; Q278-M312 VanDerWaalsContact NE2-SD 3.39Å; S308-M312 WeakPolarHBondContact O-CG 3.41Å; S308-M312 PolarHBondContact O-N 3.13Å; S309-M312 WeakPolarHBondContact O-CB 3.34Å; S309-M312 PolarHBondContact O-N 3.24Å; F310-M312 PolarHBondContact O-N 2.95Å; M312-P314 VanDerWaalsContact C-CD 3.49Å; M312-M315 HydrophobicContact CE-SD 3.86Å; M312-M315 PolarHBondContact O-N 3.34Å; M312-M315 VanDerWaalsContact O-N 3.11Å; M312-Q316 WeakPolarHBondContact O-CG 3.28Å; M312-Q316 PolarHBondContact O-N 3.42Å
313	Q	72	Confident	73.5	Confident	47 Å²	47	51.7 Å²	51.7	22%	0.22	26%	0.263	C	S	.	.	H	α-helix	trans	-54.2	-40.8	-173.5	-66.2	-178	2	0	0	113.9	S309 F310 M315 Q316 R317	S309-Q313 PolarHBondContact O-N 3.28Å; F310-Q313 WeakPolarHBondContact O-CB 3.35Å; F310-Q313 WeakPolarHBondContact O-CG 3.44Å; F310-Q313 PolarHBondContact O-N 2.97Å; F310-Q313 VanDerWaalsContact O-N 3.1Å; Q313-M315 PolarHBondContact O-N 2.98Å; Q313-Q316 CarbonylContact O-C 3.59Å; Q313-Q316 PolarHBondContact O-N 3.28Å; Q313-R317 VanDerWaalsContact O-CB 3.3Å; Q313-R317 WeakPolarHBondContact O-CB 3.2Å; Q313-R317 PolarHBondContact O-N 2.91Å
314	P	70.7	Confident	73.8	Confident	9 Å²	9	48.4 Å²	48.4	6%	0.058	25%	0.249	C	C	.	.	H	α-helix	trans	-68.3	-33.2	179.8	-21.2	34.3	0	0	0	113.9	L228 Y270 M312 R317 V318	L228-P314 HydrophobicContact CD2-CB 3.65Å; L228-P314 HydrophobicContact CD2-CG 3.66Å; Y270-P314 HydrophobicContact CD1-CB 3.84Å; Y270-P314 HydrophobicContact CD1-CG 4.25Å; Y270-P314 HydrophobicContact CE1-CB 3.61Å; Y270-P314 HydrophobicContact CE1-CG 3.56Å; M312-P314 VanDerWaalsContact C-CD 3.49Å; P314-R317 WeakPolarHBondContact O-CB 3.18Å; P314-R317 PolarHBondContact O-N 3.06Å; P314-V318 WeakPolarHBondContact O-CG2 2.99Å; P314-V318 PolarHBondContact O-N 3.16Å
315	M	73.7	Confident	73.9	Confident	57 Å²	57	41.8 Å²	41.8	28%	0.281	21%	0.213	S	C	.	.	H	α-helix	trans	-68	-45.9	173.2	-179.8	-179.5	173.9	0	0	110.5	L274 M312 Q313 R317 V318 T319 I356	L274-M315 HydrophobicContact CD2-CB 3.8Å; L274-M315 HydrophobicContact CD2-CG 4.37Å; L274-M315 HydrophobicContact CD2-SD 3.72Å; M312-M315 HydrophobicContact CE-SD 3.86Å; M312-M315 PolarHBondContact O-N 3.34Å; M312-M315 VanDerWaalsContact O-N 3.11Å; Q313-M315 PolarHBondContact O-N 2.98Å; M315-R317 PolarHBondContact O-N 3.2Å; M315-V318 PolarHBondContact O-N 3.1Å; M315-T319 PolarHBondContact O-N 3.39Å; M315-I356 HydrophobicContact CE-CD1 3.54Å; M315-I356 HydrophobicContact SD-CD1 4Å
316	Q	76.2	Confident	74	Confident	96 Å²	96	41.6 Å²	41.6	45%	0.449	21%	0.214	S	C	.	.	H	α-helix	trans	-59.2	-29.7	172.4	-64.5	171	-10.1	0	0	112.3	M312 Q313 T319 R320	M312-Q316 WeakPolarHBondContact O-CG 3.28Å; M312-Q316 PolarHBondContact O-N 3.42Å; Q313-Q316 CarbonylContact O-C 3.59Å; Q313-Q316 PolarHBondContact O-N 3.28Å; Q316-T319 PolarHBondContact O-OG1 3.36Å; Q316-T319 VanDerWaalsContact O-OG1 3.11Å; Q316-R320 VanDerWaalsContact O-CG 3.24Å; Q316-R320 WeakPolarHBondContact O-CG 3.4Å; Q316-R320 PolarHBondContact O-N 3.26Å
317	R	72.7	Confident	73.6	Confident	26 Å²	26	41 Å²	41	10%	0.098	21%	0.212	C	C	.	.	H	α-helix	trans	-70.3	-41.7	178.8	-168	67.4	-125.8	-170.2	-8.5	112.1	S196 Q313 P314 M315 R320 Y321 M324	S196-R317 VanDerWaalsContact OG-CZ 3.24Å; S196-R317 PolarHBondContact OG-NH1 3.31Å; S196-R317 PolarHBondContact OG-NH2 2.9Å; Q313-R317 VanDerWaalsContact O-CB 3.3Å; Q313-R317 WeakPolarHBondContact O-CB 3.2Å; Q313-R317 PolarHBondContact O-N 2.91Å; P314-R317 WeakPolarHBondContact O-CB 3.18Å; P314-R317 PolarHBondContact O-N 3.06Å; M315-R317 PolarHBondContact O-N 3.2Å; R317-R320 PolarHBondContact O-N 2.87Å; R317-Y321 HydrophobicContact CG-CE2 4.31Å; R317-Y321 WeakPolarHBondContact O-CD2 3.42Å; R317-Y321 PolarHBondContact O-N 2.99Å; R317-M324 PolarHBondContact NH2-SD 3.33Å
318	V	72.6	Confident	73.3	Confident	3 Å²	3	41.7 Å²	41.7	2%	0.018	22%	0.216	C	C	.	.	H	α-helix	trans	-65.5	-45.3	179.4	177.6	0	0	0	0	110.7	Y267 P314 M315 R320 Y321 P322 M348 V349	Y267-V318 HydrophobicContact CD1-CG2 3.14Å; Y267-V318 HydrophobicContact CE1-CG2 3.37Å; Y267-V318 HydrophobicContact CG-CG2 3.75Å; P314-V318 WeakPolarHBondContact O-CG2 2.99Å; P314-V318 PolarHBondContact O-N 3.16Å; M315-V318 PolarHBondContact O-N 3.1Å; V318-R320 PolarHBondContact O-N 3.36Å; V318-Y321 PolarHBondContact O-N 2.87Å; V318-Y321 VanDerWaalsContact O-N 3.13Å; V318-P322 WeakPolarHBondContact O-CD 3.48Å; V318-M348 HydrophobicContact CG1-CE 4.47Å; V318-M348 HydrophobicContact CG1-CG 4.18Å; V318-M348 HydrophobicContact CG2-CE 4.28Å; V318-V349 HydrophobicContact CG1-CG2 3.82Å; V318-V349 WeakPolarHBondContact O-CG2 3.48Å
319	T	80.1	Confident	72.7	Confident	64 Å²	64	41.4 Å²	41.4	39%	0.393	21%	0.212	S	C	.	.	H	α-helix	trans	-66.8	-20.4	178.7	59.1	0	0	0	0	113.9	M315 Q316 V349	M315-T319 PolarHBondContact O-N 3.39Å; Q316-T319 PolarHBondContact O-OG1 3.36Å; Q316-T319 VanDerWaalsContact O-OG1 3.11Å; T319-V349 HydrophobicContact CG2-CG1 4.22Å
320	R	77	Confident	72.2	Confident	142 Å²	142	48.4 Å²	48.4	54%	0.536	23%	0.231	S	C	.	.	H	α-helix	trans	-84.8	-13.5	174.4	-69.8	178.5	89.1	151.5	8.8	114.1	Q316 R317 V318 M324	Q316-R320 VanDerWaalsContact O-CG 3.24Å; Q316-R320 WeakPolarHBondContact O-CG 3.4Å; Q316-R320 PolarHBondContact O-N 3.26Å; R317-R320 PolarHBondContact O-N 2.87Å; V318-R320 PolarHBondContact O-N 3.36Å; R320-M324 WeakPolarHBondContact O-CB 3.17Å; R320-M324 VanDerWaalsContact O-CG 3.31Å; R320-M324 WeakPolarHBondContact O-CG 3.4Å; R320-M324 PolarHBondContact O-N 3.49Å
321	Y	74.1	Confident	71.8	Confident	4 Å²	4	52.1 Å²	52.1	2%	0.016	25%	0.251	C	S	.	.	H	α-helix	trans	-63.1	-49.1	179.4	-71.5	-51.2	0	0	0	113.3	L235 L256 L260 R317 V318 L323 M324 I325	L235-Y321 VanDerWaalsContact CD2-OH 3.27Å; L235-Y321 WeakPolarHBondContact CD2-OH 3.4Å; L256-Y321 HydrophobicContact CD1-CD1 3.85Å; L256-Y321 HydrophobicContact CD1-CE1 3.78Å; L256-Y321 HydrophobicContact CD1-CG 4.47Å; L256-Y321 HydrophobicContact CD2-CD1 4.33Å; L260-Y321 HydrophobicContact CD2-CD2 3.47Å; L260-Y321 VanDerWaalsContact CD2-CD2 3.47Å; L260-Y321 HydrophobicContact CD2-CE2 3.72Å; L260-Y321 HydrophobicContact CD2-CG 4.13Å; R317-Y321 HydrophobicContact CG-CE2 4.31Å; R317-Y321 WeakPolarHBondContact O-CD2 3.42Å; R317-Y321 PolarHBondContact O-N 2.99Å; V318-Y321 PolarHBondContact O-N 2.87Å; V318-Y321 VanDerWaalsContact O-N 3.13Å; Y321-L323 PolarHBondContact O-N 3.05Å; Y321-M324 PolarHBondContact O-N 3.39Å; Y321-I325 WeakPolarHBondContact O-CD1 3.5Å; Y321-I325 VanDerWaalsContact O-CG1 3.23Å; Y321-I325 WeakPolarHBondContact O-CG1 3.08Å; Y321-I325 PolarHBondContact O-N 2.95Å
322	P	75.3	Confident	71.4	Confident	7 Å²	7	53.7 Å²	53.7	5%	0.045	26%	0.26	C	S	.	.	H	α-helix	trans	-55.9	-51.4	175.7	-23.6	33.2	0	0	0	111.9	V318 M324 I325 D326 A345 N346 V349	V318-P322 WeakPolarHBondContact O-CD 3.48Å; P322-M324 PolarHBondContact O-N 3.49Å; P322-M324 VanDerWaalsContact O-N 3.15Å; P322-I325 PolarHBondContact O-N 3.09Å; P322-D326 WeakPolarHBondContact O-CB 3.4Å; P322-D326 PolarHBondContact O-N 3.14Å; P322-A345 HydrophobicContact CB-CB 4.48Å; P322-A345 HydrophobicContact CG-CB 3.85Å; P322-N346 VanDerWaalsContact CB-OD1 3.23Å; P322-N346 WeakPolarHBondContact CB-OD1 3.47Å; P322-N346 VanDerWaalsContact CG-OD1 3.22Å; P322-N346 WeakPolarHBondContact CG-OD1 3.48Å; P322-V349 HydrophobicContact CG-CG2 3.94Å
323	L	76.3	Confident	70.9	Confident	115 Å²	115	57.7 Å²	57.7	60%	0.602	28%	0.282	S	S	*	.	H	α-helix	trans	-56.4	-35.4	-179.8	-57.8	178.8	0	0	0	113.5	Y321 A327	Y321-L323 PolarHBondContact O-N 3.05Å; L323-A327 VanDerWaalsContact O-CB 3.22Å; L323-A327 WeakPolarHBondContact O-CB 3.25Å; L323-A327 PolarHBondContact O-N 3.26Å; L323-A327 VanDerWaalsContact O-N 3.17Å
324	M	69.3	Low	70.5	Confident	51 Å²	51	64.1 Å²	64.1	25%	0.251	31%	0.312	S	S	.	.	H	α-helix	trans	-74.6	-40.1	176.5	-75.9	-177.5	68.9	0	0	112.5	R317 R320 Y321 P322 A327 V328	R317-M324 PolarHBondContact NH2-SD 3.33Å; R320-M324 WeakPolarHBondContact O-CB 3.17Å; R320-M324 VanDerWaalsContact O-CG 3.31Å; R320-M324 WeakPolarHBondContact O-CG 3.4Å; R320-M324 PolarHBondContact O-N 3.49Å; Y321-M324 PolarHBondContact O-N 3.39Å; P322-M324 PolarHBondContact O-N 3.49Å; P322-M324 VanDerWaalsContact O-N 3.15Å; M324-A327 PolarHBondContact O-N 3.02Å; M324-V328 WeakPolarHBondContact O-CG2 3.48Å; M324-V328 PolarHBondContact O-N 3.05Å
325	I	70	Confident	70	Confident	3 Å²	3	73.6 Å²	73.6	2%	0.015	35%	0.352	C	S	.	.	H	α-helix	trans	-68.4	-48.1	178.9	-60.5	163.5	0	0	0	109.5	F253 L256 Y321 P322 A327 V328 L329 V342 A345	F253-I325 HydrophobicContact CD1-CG2 3.92Å; F253-I325 HydrophobicContact CE1-CG2 3.83Å; L256-I325 HydrophobicContact CD2-CD1 3.65Å; L256-I325 HydrophobicContact CD2-CG1 3.62Å; L256-I325 HydrophobicContact CG-CD1 4.49Å; Y321-I325 WeakPolarHBondContact O-CD1 3.5Å; Y321-I325 VanDerWaalsContact O-CG1 3.23Å; Y321-I325 WeakPolarHBondContact O-CG1 3.08Å; Y321-I325 PolarHBondContact O-N 2.95Å; P322-I325 PolarHBondContact O-N 3.09Å; I325-A327 PolarHBondContact O-N 2.86Å; I325-V328 PolarHBondContact O-N 3.19Å; I325-L329 HydrophobicContact CG2-CD1 3.77Å; I325-L329 HydrophobicContact CG2-CG 4.36Å; I325-L329 PolarHBondContact O-N 3.2Å; I325-V342 HydrophobicContact CB-CG2 4.01Å; I325-V342 HydrophobicContact CG2-CB 4.41Å; I325-V342 HydrophobicContact CG2-CG2 3.31Å; I325-A345 HydrophobicContact CD1-CB 3.68Å
326	D	69.8	Low	69.7	Low	55 Å²	55	72.8 Å²	72.8	29%	0.294	35%	0.349	S	S	.	.	H	α-helix	trans	-55.5	-39.7	175	-66.2	-21.7	0	0	0	111.6	P322 V328 L329 R330 V342	P322-D326 WeakPolarHBondContact O-CB 3.4Å; P322-D326 PolarHBondContact O-N 3.14Å; D326-V328 PolarHBondContact O-N 2.96Å; D326-L329 PolarHBondContact O-N 3.05Å; D326-R330 WeakPolarHBondContact O-CG 3.45Å; D326-R330 PolarHBondContact O-N 3.15Å; D326-V342 VanDerWaalsContact OD1-CG1 3.23Å; D326-V342 WeakPolarHBondContact OD1-CG1 3.33Å; D326-V342 VanDerWaalsContact OD1-CG2 3.27Å; D326-V342 WeakPolarHBondContact OD1-CG2 3.46Å
327	A	68.4	Low	68.9	Low	35 Å²	35	78.7 Å²	78.7	29%	0.289	37%	0.368	S	S	.	.	H	α-helix	trans	-63.2	-28.5	179.4	0	0	0	0	0	113.5	L323 M324 I325	L323-A327 VanDerWaalsContact O-CB 3.22Å; L323-A327 WeakPolarHBondContact O-CB 3.25Å; L323-A327 PolarHBondContact O-N 3.26Å; L323-A327 VanDerWaalsContact O-N 3.17Å; M324-A327 PolarHBondContact O-N 3.02Å; I325-A327 PolarHBondContact O-N 2.86Å
328	V	65.2	Low	68.6	Low	20 Å²	20	79.6 Å²	79.6	12%	0.121	37%	0.371	C	S	.	.	H	α-helix	trans	-86	-39.8	173.7	-168.5	0	0	0	0	112.1	T189 F253 M324 I325 D326 R330 D331 L332	T189-V328 HydrophobicContact CG2-CB 4.02Å; T189-V328 HydrophobicContact CG2-CG1 3.62Å; T189-V328 HydrophobicContact CG2-CG2 3.3Å; F253-V328 HydrophobicContact CE1-CB 4.2Å; F253-V328 HydrophobicContact CE1-CG2 4.44Å; F253-V328 HydrophobicContact CE2-CG1 4.3Å; F253-V328 HydrophobicContact CZ-CB 3.65Å; F253-V328 HydrophobicContact CZ-CG1 3.61Å; F253-V328 HydrophobicContact CZ-CG2 3.93Å; M324-V328 WeakPolarHBondContact O-CG2 3.48Å; M324-V328 PolarHBondContact O-N 3.05Å; I325-V328 PolarHBondContact O-N 3.19Å; D326-V328 PolarHBondContact O-N 2.96Å; V328-R330 PolarHBondContact O-N 3.01Å; V328-D331 PolarHBondContact O-N 3.44Å; V328-L332 HydrophobicContact CG1-CD1 4.05Å
329	L	65.8	Low	68.3	Low	26 Å²	26	82.8 Å²	82.8	14%	0.136	39%	0.387	C	S	.	.	H	α-helix	trans	-65	-24.9	-175.7	-75.9	170.5	0	0	0	113.1	I325 D326 D331 L332 R338 I339 V342	I325-L329 HydrophobicContact CG2-CD1 3.77Å; I325-L329 HydrophobicContact CG2-CG 4.36Å; I325-L329 PolarHBondContact O-N 3.2Å; D326-L329 PolarHBondContact O-N 3.05Å; L329-D331 PolarHBondContact O-N 3.16Å; L329-D331 VanDerWaalsContact O-N 3.13Å; L329-L332 HydrophobicContact CD2-CB 4.5Å; L329-L332 HydrophobicContact CD2-CD1 4.02Å; L329-L332 PolarHBondContact O-N 3.06Å; L329-R338 HydrophobicContact CD2-CB 3.89Å; L329-I339 HydrophobicContact CD1-CG1 4.24Å; L329-I339 HydrophobicContact CD2-CG1 4.02Å; L329-V342 HydrophobicContact CD1-CG2 3.23Å
330	R	67.2	Low	67.9	Low	195 Å²	195	85.2 Å²	85.2	74%	0.736	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-20.7	170.6	-75.6	-172.9	-61.6	-128.1	3.2	114.4	D326 V328	D326-R330 WeakPolarHBondContact O-CG 3.45Å; D326-R330 PolarHBondContact O-N 3.15Å; V328-R330 PolarHBondContact O-N 3.01Å
331	D	62.9	Low	67.7	Low	83 Å²	83	78.8 Å²	78.8	44%	0.444	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107	17.1	179.4	-57.7	-51.9	0	0	0	112.3	A185 V328 L329	A185-D331 HydrophobicContact CB-CB 3.74Å; A185-D331 WeakPolarHBondContact CB-OD2 3.48Å; V328-D331 PolarHBondContact O-N 3.44Å; L329-D331 PolarHBondContact O-N 3.16Å; L329-D331 VanDerWaalsContact O-N 3.13Å
332	L	62.8	Low	67.8	Low	33 Å²	33	79.6 Å²	79.6	17%	0.173	38%	0.38	C	S	.	.	S	Bend	trans	-130	155.6	-178.3	-64	175.2	0	0	0	111.1	V328 L329	V328-L332 HydrophobicContact CG1-CD1 4.05Å; L329-L332 HydrophobicContact CD2-CB 4.5Å; L329-L332 HydrophobicContact CD2-CD1 4.02Å; L329-L332 PolarHBondContact O-N 3.06Å
333	D	66	Low	68.1	Low	140 Å²	140	82.8 Å²	82.8	75%	0.749	40%	0.402	S	S	*	.			trans	-67.1	143.1	-179	-75.1	-51.7	0	0	0	112.8	K335 D336	D333-K335 PolarHBondContact O-N 3.22Å; D333-D336 VanDerWaalsContact O-CB 3.24Å; D333-D336 WeakPolarHBondContact O-CB 3.09Å; D333-D336 PolarHBondContact O-N 3.02Å
334	E	64.2	Low	68.5	Low	183 Å²	183	78.6 Å²	78.6	86%	0.855	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-11.8	-179.1	-64.5	-171.7	149	0	0	115.4	I339	E334-I339 WeakPolarHBondContact O-CD1 3.44Å
335	K	60.6	Low	69	Low	207 Å²	207	76.2 Å²	76.2	90%	0.9	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	6.6	178.2	-65.3	-177.1	-178.5	174.6	0	113.3	D333	D333-K335 PolarHBondContact O-N 3.22Å
336	D	66.7	Low	69.7	Low	40 Å²	40	79.3 Å²	79.3	21%	0.214	39%	0.385	C	S	.	.			trans	-75.5	130.8	-175.6	-157.8	-52.6	0	0	0	112.3	D333 R338 I339	D333-D336 VanDerWaalsContact O-CB 3.24Å; D333-D336 WeakPolarHBondContact O-CB 3.09Å; D333-D336 PolarHBondContact O-N 3.02Å; D336-R338 PolarHBondContact O-N 3.41Å; D336-R338 VanDerWaalsContact OD1-CB 3.29Å; D336-R338 WeakPolarHBondContact OD1-CB 3.29Å; D336-R338 WeakPolarHBondContact OD1-CG 3.5Å; D336-R338 IonicContact OD1-CZ 2.7Å; D336-R338 PolarHBondContact OD1-N 3Å; D336-R338 IonicContact OD1-NE 2.96Å; D336-R338 PolarHBondContact OD1-NE 3Å; D336-R338 IonicContact OD2-CZ 3.65Å; D336-R338 IonicContact OD2-NE 2.95Å; D336-R338 PolarHBondContact OD2-NE 3.43Å; D336-R338 IonicContact OD2-NH2 3.58Å; D336-R338 PolarHBondContact OD2-NH2 3.4Å; D336-I339 WeakPolarHBondContact O-CG1 3.44Å; D336-I339 PolarHBondContact O-N 3.45Å; D336-I339 VanDerWaalsContact O-N 3.17Å
337	R	60.9	Low	70.6	Confident	221 Å²	221	82.5 Å²	82.5	83%	0.834	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-59.7	-19.2	177.9	-66.2	-177.7	177.8	-179.8	-0.9	112.9	I339 D340	R337-I339 PolarHBondContact O-N 2.99Å; R337-D340 PolarHBondContact O-N 2.99Å
338	R	65.6	Low	71.3	Confident	44 Å²	44	80.9 Å²	80.9	17%	0.166	38%	0.38	C	S	.	.	G	3₁₀ helix	trans	-63.6	-13.8	176.9	-66.7	-179.9	-86	-158.3	3.3	114.2	D250 F253 L329 D336 D340 S341	D250-R338 IonicContact OD1-NH1 3.22Å; D250-R338 PolarHBondContact OD1-NH1 3.05Å; F253-R338 HydrophobicContact CB-CB 4.03Å; F253-R338 HydrophobicContact CB-CG 3.71Å; F253-R338 HydrophobicContact CD1-CB 4.07Å; F253-R338 HydrophobicContact CD1-CG 4.44Å; F253-R338 HydrophobicContact CD2-CB 4.31Å; F253-R338 HydrophobicContact CD2-CG 3.85Å; F253-R338 HydrophobicContact CG-CB 3.86Å; F253-R338 HydrophobicContact CG-CG 3.73Å; L329-R338 HydrophobicContact CD2-CB 3.89Å; D336-R338 PolarHBondContact O-N 3.41Å; D336-R338 VanDerWaalsContact OD1-CB 3.29Å; D336-R338 WeakPolarHBondContact OD1-CB 3.29Å; D336-R338 WeakPolarHBondContact OD1-CG 3.5Å; D336-R338 IonicContact OD1-CZ 2.7Å; D336-R338 PolarHBondContact OD1-N 3Å; D336-R338 IonicContact OD1-NE 2.96Å; D336-R338 PolarHBondContact OD1-NE 3Å; D336-R338 IonicContact OD2-CZ 3.65Å; D336-R338 IonicContact OD2-NE 2.95Å; D336-R338 PolarHBondContact OD2-NE 3.43Å; D336-R338 IonicContact OD2-NH2 3.58Å; D336-R338 PolarHBondContact OD2-NH2 3.4Å; R338-D340 VanDerWaalsContact C-N 3.3Å; R338-D340 PolarHBondContact O-N 3.43Å; R338-S341 WeakPolarHBondContact O-CB 3.45Å; R338-S341 PolarHBondContact O-N 3.16Å
339	I	65.4	Low	72.3	Confident	71 Å²	71	81.5 Å²	81.5	36%	0.364	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-64.1	-33.2	175.5	-65.4	168.3	0	0	0	111.9	L329 E334 D336 R337 S341 V342	L329-I339 HydrophobicContact CD1-CG1 4.24Å; L329-I339 HydrophobicContact CD2-CG1 4.02Å; E334-I339 WeakPolarHBondContact O-CD1 3.44Å; D336-I339 WeakPolarHBondContact O-CG1 3.44Å; D336-I339 PolarHBondContact O-N 3.45Å; D336-I339 VanDerWaalsContact O-N 3.17Å; R337-I339 PolarHBondContact O-N 2.99Å; I339-S341 PolarHBondContact O-N 2.79Å; I339-S341 VanDerWaalsContact O-N 3.16Å; I339-V342 WeakPolarHBondContact O-CB 3.43Å; I339-V342 PolarHBondContact O-N 3.24Å
340	D	72.8	Confident	73.4	Confident	115 Å²	115	83 Å²	83	62%	0.615	40%	0.396	S	S	*	.	H	α-helix	trans	-59	-31.7	179.4	-73.9	-18.9	0	0	0	112.1	R337 R338 V342 S343 L344	R337-D340 PolarHBondContact O-N 2.99Å; R338-D340 VanDerWaalsContact C-N 3.3Å; R338-D340 PolarHBondContact O-N 3.43Å; D340-V342 VanDerWaalsContact C-N 3.27Å; D340-V342 PolarHBondContact O-N 3.16Å; D340-S343 PolarHBondContact O-N 2.98Å; D340-S343 VanDerWaalsContact O-N 3.15Å; D340-S343 PolarHBondContact O-OG 2.97Å; D340-L344 PolarHBondContact O-N 3.01Å; D340-L344 VanDerWaalsContact O-N 3.12Å
341	S	72.6	Confident	74.3	Confident	7 Å²	7	77.7 Å²	77.7	5%	0.049	38%	0.379	C	S	.	.	H	α-helix	trans	-61.2	-31.4	176.8	-53.7	0	0	0	0	113.1	F253 R338 I339 A345	F253-S341 PolarHBondContact O-OG 3.13Å; R338-S341 WeakPolarHBondContact O-CB 3.45Å; R338-S341 PolarHBondContact O-N 3.16Å; I339-S341 PolarHBondContact O-N 2.79Å; I339-S341 VanDerWaalsContact O-N 3.16Å; S341-A345 WeakPolarHBondContact O-CB 3.47Å; S341-A345 PolarHBondContact O-N 2.79Å
342	V	76.9	Confident	75.3	Confident	20 Å²	20	74 Å²	74	12%	0.121	36%	0.359	C	S	.	.	H	α-helix	trans	-66.2	-48.6	173.2	176.1	0	0	0	0	110.4	I325 D326 L329 I339 D340 L344 A345 N346	I325-V342 HydrophobicContact CB-CG2 4.01Å; I325-V342 HydrophobicContact CG2-CB 4.41Å; I325-V342 HydrophobicContact CG2-CG2 3.31Å; D326-V342 VanDerWaalsContact OD1-CG1 3.23Å; D326-V342 WeakPolarHBondContact OD1-CG1 3.33Å; D326-V342 VanDerWaalsContact OD1-CG2 3.27Å; D326-V342 WeakPolarHBondContact OD1-CG2 3.46Å; L329-V342 HydrophobicContact CD1-CG2 3.23Å; I339-V342 WeakPolarHBondContact O-CB 3.43Å; I339-V342 PolarHBondContact O-N 3.24Å; D340-V342 VanDerWaalsContact C-N 3.27Å; D340-V342 PolarHBondContact O-N 3.16Å; V342-L344 PolarHBondContact O-N 3.11Å; V342-A345 PolarHBondContact O-N 2.66Å; V342-N346 VanDerWaalsContact CG1-ND2 3.33Å; V342-N346 WeakPolarHBondContact CG1-ND2 3.44Å; V342-N346 WeakPolarHBondContact O-CB 3.27Å; V342-N346 PolarHBondContact O-N 2.93Å; V342-N346 PolarHBondContact O-ND2 3.23Å
343	S	81.5	Confident	76.4	Confident	74 Å²	74	75.7 Å²	75.7	52%	0.517	37%	0.368	S	S	.	.	H	α-helix	trans	-58.3	-39.5	-178.2	81.1	0	0	0	0	110.8	D340 R347	D340-S343 PolarHBondContact O-N 2.98Å; D340-S343 VanDerWaalsContact O-N 3.15Å; D340-S343 PolarHBondContact O-OG 2.97Å; S343-R347 VanDerWaalsContact O-CB 3.24Å; S343-R347 WeakPolarHBondContact O-CB 3.35Å; S343-R347 PolarHBondContact O-N 2.92Å
344	L	84.1	Confident	77.4	Confident	27 Å²	27	74.4 Å²	74.4	14%	0.141	36%	0.358	C	S	.	.	H	α-helix	trans	-69.4	-43.6	177.5	-179.6	54.7	0	0	0	112.6	A257 L260 A261 D340 V342 R347 M348	A257-L344 HydrophobicContact CB-CD2 3.83Å; A257-L344 VanDerWaalsContact O-CD2 3.24Å; A257-L344 WeakPolarHBondContact O-CD2 3.47Å; L260-L344 HydrophobicContact CB-CD2 4.38Å; L260-L344 HydrophobicContact CB-CG 4.18Å; A261-L344 HydrophobicContact CB-CD2 4.18Å; D340-L344 PolarHBondContact O-N 3.01Å; D340-L344 VanDerWaalsContact O-N 3.12Å; V342-L344 PolarHBondContact O-N 3.11Å; L344-R347 PolarHBondContact O-N 3.2Å; L344-M348 WeakPolarHBondContact O-CB 3.32Å; L344-M348 PolarHBondContact O-N 3.5Å
345	A	79.4	Confident	78.2	Confident	1 Å²	1	67 Å²	67	1%	0.008	33%	0.325	C	S	.	.	H	α-helix	trans	-63.1	-43.9	175.5	0	0	0	0	0	111.9	L260 P322 I325 S341 V342 M348 V349	L260-A345 HydrophobicContact CD1-CB 3.81Å; P322-A345 HydrophobicContact CB-CB 4.48Å; P322-A345 HydrophobicContact CG-CB 3.85Å; I325-A345 HydrophobicContact CD1-CB 3.68Å; S341-A345 WeakPolarHBondContact O-CB 3.47Å; S341-A345 PolarHBondContact O-N 2.79Å; V342-A345 PolarHBondContact O-N 2.66Å; A345-M348 PolarHBondContact O-N 2.92Å; A345-V349 WeakPolarHBondContact O-CG2 3.5Å; A345-V349 PolarHBondContact O-N 3.33Å
346	N	85.6	Confident	79.2	Confident	68 Å²	68	57.9 Å²	57.9	36%	0.364	29%	0.286	S	S	.	.	H	α-helix	trans	-63.2	-46.5	175.5	-81.1	-37.8	0	0	0	111.5	P322 V342 M348 V349 S350	P322-N346 VanDerWaalsContact CB-OD1 3.23Å; P322-N346 WeakPolarHBondContact CB-OD1 3.47Å; P322-N346 VanDerWaalsContact CG-OD1 3.22Å; P322-N346 WeakPolarHBondContact CG-OD1 3.48Å; V342-N346 VanDerWaalsContact CG1-ND2 3.33Å; V342-N346 WeakPolarHBondContact CG1-ND2 3.44Å; V342-N346 WeakPolarHBondContact O-CB 3.27Å; V342-N346 PolarHBondContact O-N 2.93Å; V342-N346 PolarHBondContact O-ND2 3.23Å; N346-M348 PolarHBondContact O-N 3.39Å; N346-V349 PolarHBondContact O-N 2.82Å; N346-V349 VanDerWaalsContact O-N 3.14Å; N346-S350 PolarHBondContact O-N 2.9Å; N346-S350 PolarHBondContact O-OG 2.84Å; N346-S350 VanDerWaalsContact O-OG 3.13Å
347	R	88.1	Confident	80.1	Confident	123 Å²	123	60.9 Å²	60.9	46%	0.464	30%	0.297	S	S	.	.	H	α-helix	trans	-54.9	-40.5	175.4	-173.4	176.5	72.3	81.4	11.1	112	E264 S343 L344 K351	E264-R347 IonicContact OE2-CZ 3.91Å; E264-R347 IonicContact OE2-NH1 3.45Å; E264-R347 PolarHBondContact OE2-NH1 2.81Å; E264-R347 IonicContact OE2-NH2 2.66Å; E264-R347 PolarHBondContact OE2-NH2 3.47Å; S343-R347 VanDerWaalsContact O-CB 3.24Å; S343-R347 WeakPolarHBondContact O-CB 3.35Å; S343-R347 PolarHBondContact O-N 2.92Å; L344-R347 PolarHBondContact O-N 3.2Å; R347-K351 WeakPolarHBondContact O-CB 3.13Å; R347-K351 PolarHBondContact O-N 3.03Å
348	M	84	Confident	81.1	Confident	1 Å²	1	52 Å²	52	1%	0.005	27%	0.269	C	S	.	.	H	α-helix	trans	-69.1	-43.7	177.1	-174.5	177.1	176.8	0	0	112.6	L260 Y267 V318 L344 A345 N346 K351 C352	L260-M348 HydrophobicContact CB-SD 3.79Å; L260-M348 HydrophobicContact CD2-CE 4.15Å; L260-M348 HydrophobicContact CD2-SD 3.32Å; L260-M348 WeakPolarHBondContact CD2-SD 3.22Å; L260-M348 HydrophobicContact CG-SD 4.1Å; Y267-M348 VanDerWaalsContact CB-CE 3.45Å; Y267-M348 HydrophobicContact CD1-CE 4.37Å; Y267-M348 HydrophobicContact CD2-CE 3.1Å; Y267-M348 HydrophobicContact CE2-CE 3.8Å; Y267-M348 HydrophobicContact CG-CE 3.41Å; Y267-M348 VanDerWaalsContact CG-CE 3.41Å; V318-M348 HydrophobicContact CG1-CE 4.47Å; V318-M348 HydrophobicContact CG1-CG 4.18Å; V318-M348 HydrophobicContact CG2-CE 4.28Å; L344-M348 WeakPolarHBondContact O-CB 3.32Å; L344-M348 PolarHBondContact O-N 3.5Å; A345-M348 PolarHBondContact O-N 2.92Å; N346-M348 PolarHBondContact O-N 3.39Å; M348-K351 PolarHBondContact O-N 2.84Å; M348-C352 PolarHBondContact O-N 2.86Å; M348-C352 PolarHBondContact O-SG 3.13Å
349	V	85.4	Confident	81.9	Confident	33 Å²	33	54.3 Å²	54.3	20%	0.2	28%	0.28	C	S	.	.	H	α-helix	trans	-58.1	-50.3	173.4	171.1	0	0	0	0	110.7	V318 T319 P322 A345 N346 K351 C352 D353	V318-V349 HydrophobicContact CG1-CG2 3.82Å; V318-V349 WeakPolarHBondContact O-CG2 3.48Å; T319-V349 HydrophobicContact CG2-CG1 4.22Å; P322-V349 HydrophobicContact CG-CG2 3.94Å; A345-V349 WeakPolarHBondContact O-CG2 3.5Å; A345-V349 PolarHBondContact O-N 3.33Å; N346-V349 PolarHBondContact O-N 2.82Å; N346-V349 VanDerWaalsContact O-N 3.14Å; V349-K351 VanDerWaalsContact C-N 3.3Å; V349-K351 PolarHBondContact O-N 3.26Å; V349-C352 PolarHBondContact O-N 3.13Å; V349-D353 PolarHBondContact O-N 2.78Å
350	S	88.5	Confident	82.7	Confident	58 Å²	58	55.2 Å²	55.2	41%	0.406	28%	0.283	S	S	.	.	H	α-helix	trans	-58.9	-40.5	178	-58.7	0	0	0	0	112.2	N346 D353 Q354	N346-S350 PolarHBondContact O-N 2.9Å; N346-S350 PolarHBondContact O-OG 2.84Å; N346-S350 VanDerWaalsContact O-OG 3.13Å; S350-D353 PolarHBondContact O-N 3.03Å; S350-Q354 WeakPolarHBondContact O-CB 3.35Å; S350-Q354 WeakPolarHBondContact O-CG 3.21Å; S350-Q354 PolarHBondContact O-N 3.47Å
351	K	87.1	Confident	83.3	Confident	83 Å²	83	52.8 Å²	52.8	36%	0.361	27%	0.265	S	S	.	.	H	α-helix	trans	-68.9	-38.5	178.9	-166.8	170.4	-176.3	172.1	0	112.6	E264 V268 R347 M348 V349 T355	E264-K351 HydrophobicContact CG-CD 4.29Å; E264-K351 VanDerWaalsContact OE1-CD 3.25Å; E264-K351 WeakPolarHBondContact OE1-CD 3.42Å; E264-K351 WeakPolarHBondContact OE1-CE 3.42Å; E264-K351 IonicContact OE1-NZ 2.73Å; E264-K351 PolarHBondContact OE1-NZ 2.84Å; V268-K351 HydrophobicContact CG2-CB 4.44Å; V268-K351 HydrophobicContact CG2-CD 4.31Å; V268-K351 HydrophobicContact CG2-CG 4.01Å; R347-K351 WeakPolarHBondContact O-CB 3.13Å; R347-K351 PolarHBondContact O-N 3.03Å; M348-K351 PolarHBondContact O-N 2.84Å; V349-K351 VanDerWaalsContact C-N 3.3Å; V349-K351 PolarHBondContact O-N 3.26Å; K351-T355 WeakPolarHBondContact O-CB 3.38Å; K351-T355 PolarHBondContact O-N 3.3Å; K351-T355 PolarHBondContact O-OG1 2.98Å
352	C	83.1	Confident	83.8	Confident	6 Å²	6	55.8 Å²	55.8	4%	0.041	28%	0.279	C	S	.	.	H	α-helix	trans	-62.1	-47.3	172.2	-72.9	0	0	0	0	111.5	C271 M348 V349 T355 I356	C271-C352 HydrophobicContact CB-CB 4.16Å; M348-C352 PolarHBondContact O-N 2.86Å; M348-C352 PolarHBondContact O-SG 3.13Å; V349-C352 PolarHBondContact O-N 3.13Å; C352-T355 PolarHBondContact O-N 3.44Å; C352-I356 WeakPolarHBondContact O-CG1 3.29Å; C352-I356 PolarHBondContact O-N 3.15Å
353	D	86.7	Confident	84.1	Confident	67 Å²	67	57.5 Å²	57.5	36%	0.358	29%	0.286	S	S	.	.	H	α-helix	trans	-61.8	-48.1	178.1	173.7	67.8	0	0	0	112.6	V349 S350 T355 I356 K357	V349-D353 PolarHBondContact O-N 2.78Å; S350-D353 PolarHBondContact O-N 3.03Å; D353-T355 VanDerWaalsContact C-N 3.26Å; D353-T355 PolarHBondContact O-N 3.24Å; D353-I356 PolarHBondContact O-N 3.03Å; D353-K357 VanDerWaalsContact CG-NZ 3.25Å; D353-K357 WeakPolarHBondContact O-CB 3.4Å; D353-K357 WeakPolarHBondContact O-CG 3.09Å; D353-K357 PolarHBondContact O-N 3.44Å; D353-K357 WeakPolarHBondContact OD1-CE 3.33Å; D353-K357 IonicContact OD1-NZ 2.68Å; D353-K357 PolarHBondContact OD1-NZ 2.85Å; D353-K357 WeakPolarHBondContact OD2-CE 3.14Å; D353-K357 IonicContact OD2-NZ 3.75Å; D353-K357 PolarHBondContact OD2-NZ 3.49Å
354	Q	86.6	Confident	84.4	Confident	114 Å²	114	58.1 Å²	58.1	53%	0.533	28%	0.28	S	S	.	.	H	α-helix	trans	-56.9	-40.1	173.6	-74.9	169.1	-0	0	0	112.1	S350 C358	S350-Q354 WeakPolarHBondContact O-CB 3.35Å; S350-Q354 WeakPolarHBondContact O-CG 3.21Å; S350-Q354 PolarHBondContact O-N 3.47Å; Q354-C358 WeakPolarHBondContact O-CB 3.44Å; Q354-C358 PolarHBondContact O-N 3.04Å
355	T	81.3	Confident	84.7	Confident	27 Å²	27	56.9 Å²	56.9	17%	0.166	27%	0.274	C	S	.	.	H	α-helix	trans	-69.7	-45	179.2	-53.1	0	0	0	0	111.2	V268 K351 C352 D353 K357 C358 F359	V268-T355 HydrophobicContact CG1-CG2 3.82Å; V268-T355 WeakPolarHBondContact CG1-OG1 3.4Å; K351-T355 WeakPolarHBondContact O-CB 3.38Å; K351-T355 PolarHBondContact O-N 3.3Å; K351-T355 PolarHBondContact O-OG1 2.98Å; C352-T355 PolarHBondContact O-N 3.44Å; D353-T355 VanDerWaalsContact C-N 3.26Å; D353-T355 PolarHBondContact O-N 3.24Å; T355-K357 PolarHBondContact O-N 3.43Å; T355-C358 WeakPolarHBondContact O-CB 3.45Å; T355-C358 PolarHBondContact O-N 3.27Å; T355-C358 VanDerWaalsContact O-N 3.09Å; T355-F359 HydrophobicContact CG2-CD2 3.86Å; T355-F359 HydrophobicContact CG2-CE2 3.88Å; T355-F359 WeakPolarHBondContact O-CD2 3.38Å; T355-F359 PolarHBondContact O-N 3.47Å
356	I	81.9	Confident	85.1	Confident	15 Å²	15	60.7 Å²	60.7	8%	0.077	29%	0.294	C	S	.	.	H	α-helix	trans	-55.1	-53	174.5	-68.8	162.2	0	0	0	109.8	C271 M315 C352 D353 C358 F359 E360	C271-I356 HydrophobicContact CB-CD1 3.88Å; C271-I356 HydrophobicContact CB-CG1 3.94Å; C271-I356 WeakPolarHBondContact O-CG1 3.44Å; M315-I356 HydrophobicContact CE-CD1 3.54Å; M315-I356 HydrophobicContact SD-CD1 4Å; C352-I356 WeakPolarHBondContact O-CG1 3.29Å; C352-I356 PolarHBondContact O-N 3.15Å; D353-I356 PolarHBondContact O-N 3.03Å; I356-C358 PolarHBondContact O-N 2.91Å; I356-F359 PolarHBondContact O-N 2.66Å; I356-E360 HydrophobicContact CG2-CG 4.34Å; I356-E360 WeakPolarHBondContact O-CG 3.4Å; I356-E360 PolarHBondContact O-N 3.28Å
357	K	84	Confident	85.3	Confident	103 Å²	103	63.2 Å²	63.2	45%	0.448	30%	0.303	S	S	.	.	H	α-helix	trans	-60.8	-28	177.5	-71	169.2	177.4	165.7	0	113.5	D353 T355 R361	D353-K357 VanDerWaalsContact CG-NZ 3.25Å; D353-K357 WeakPolarHBondContact O-CB 3.4Å; D353-K357 WeakPolarHBondContact O-CG 3.09Å; D353-K357 PolarHBondContact O-N 3.44Å; D353-K357 WeakPolarHBondContact OD1-CE 3.33Å; D353-K357 IonicContact OD1-NZ 2.68Å; D353-K357 PolarHBondContact OD1-NZ 2.85Å; D353-K357 WeakPolarHBondContact OD2-CE 3.14Å; D353-K357 IonicContact OD2-NZ 3.75Å; D353-K357 PolarHBondContact OD2-NZ 3.49Å; T355-K357 PolarHBondContact O-N 3.43Å; K357-R361 WeakPolarHBondContact O-CB 3.37Å; K357-R361 VanDerWaalsContact O-CG 3.25Å; K357-R361 WeakPolarHBondContact O-CG 3.46Å; K357-R361 PolarHBondContact O-N 3Å; K357-R361 PolarHBondContact O-NE 2.9Å
358	C	83.3	Confident	85.4	Confident	35 Å²	35	58.3 Å²	58.3	24%	0.236	29%	0.286	C	S	.	.	H	α-helix	trans	-72.9	-42.9	173.5	-165.2	0	0	0	0	112	Q354 T355 I356 M362	Q354-C358 WeakPolarHBondContact O-CB 3.44Å; Q354-C358 PolarHBondContact O-N 3.04Å; T355-C358 WeakPolarHBondContact O-CB 3.45Å; T355-C358 PolarHBondContact O-N 3.27Å; T355-C358 VanDerWaalsContact O-N 3.09Å; I356-C358 PolarHBondContact O-N 2.91Å; C358-M362 VanDerWaalsContact O-CB 3.29Å; C358-M362 WeakPolarHBondContact O-CB 3.36Å; C358-M362 PolarHBondContact O-N 2.7Å
359	F	80.8	Confident	85.7	Confident	93 Å²	93	59.8 Å²	59.8	41%	0.408	29%	0.293	S	S	.	.	H	α-helix	trans	-69.3	-37.9	177.8	-88.1	-99.9	0	0	0	112.3	T355 I356 M362 E363	T355-F359 HydrophobicContact CG2-CD2 3.86Å; T355-F359 HydrophobicContact CG2-CE2 3.88Å; T355-F359 WeakPolarHBondContact O-CD2 3.38Å; T355-F359 PolarHBondContact O-N 3.47Å; I356-F359 PolarHBondContact O-N 2.66Å; F359-M362 HydrophobicContact CD1-CE 3.66Å; F359-M362 HydrophobicContact CE1-CE 3.69Å; F359-M362 HydrophobicContact CG-CE 4.15Å; F359-M362 HydrophobicContact CZ-CE 4.19Å; F359-M362 PolarHBondContact O-N 2.98Å; F359-E363 WeakPolarHBondContact O-CB 3.45Å; F359-E363 PolarHBondContact O-N 2.68Å
360	E	83	Confident	85.9	Confident	89 Å²	89	64.4 Å²	64.4	42%	0.416	32%	0.317	S	S	.	.	H	α-helix	trans	-64.6	-45.9	175.8	-70.1	176.2	158.5	0	0	111.8	S275 I356 M362 E363 E364	S275-E360 PolarHBondContact OG-OE1 2.87Å; I356-E360 HydrophobicContact CG2-CG 4.34Å; I356-E360 WeakPolarHBondContact O-CG 3.4Å; I356-E360 PolarHBondContact O-N 3.28Å; E360-M362 VanDerWaalsContact C-N 3.32Å; E360-M362 PolarHBondContact O-N 2.87Å; E360-E363 PolarHBondContact O-N 2.98Å; E360-E364 PolarHBondContact O-N 2.65Å
361	R	84.7	Confident	86.1	Confident	65 Å²	65	62.9 Å²	62.9	25%	0.245	31%	0.306	C	S	.	.	H	α-helix	trans	-59.1	-41.5	171.3	-75.4	-179.7	-67.2	143	0.1	112.4	K357 E364 L365 C390	K357-R361 WeakPolarHBondContact O-CB 3.37Å; K357-R361 VanDerWaalsContact O-CG 3.25Å; K357-R361 WeakPolarHBondContact O-CG 3.46Å; K357-R361 PolarHBondContact O-N 3Å; K357-R361 PolarHBondContact O-NE 2.9Å; R361-E364 PolarHBondContact O-N 3.37Å; R361-L365 WeakPolarHBondContact O-CG 3.45Å; R361-L365 PolarHBondContact O-N 3.17Å; R361-C390 VanDerWaalsContact CD-SG 3.6Å; R361-C390 PolarHBondContact NH1-SG 3.06Å
362	M	84.1	Confident	86.3	Confident	69 Å²	69	59.3 Å²	59.3	34%	0.34	29%	0.291	S	S	.	.	H	α-helix	trans	-67.1	-37.7	179.5	-175.7	168.5	59.5	0	0	112	C358 F359 E360 L365 L366 V385	C358-M362 VanDerWaalsContact O-CB 3.29Å; C358-M362 WeakPolarHBondContact O-CB 3.36Å; C358-M362 PolarHBondContact O-N 2.7Å; F359-M362 HydrophobicContact CD1-CE 3.66Å; F359-M362 HydrophobicContact CE1-CE 3.69Å; F359-M362 HydrophobicContact CG-CE 4.15Å; F359-M362 HydrophobicContact CZ-CE 4.19Å; F359-M362 PolarHBondContact O-N 2.98Å; E360-M362 VanDerWaalsContact C-N 3.32Å; E360-M362 PolarHBondContact O-N 2.87Å; M362-L365 PolarHBondContact O-N 2.86Å; M362-L366 HydrophobicContact CG-CD1 4.25Å; M362-L366 WeakPolarHBondContact O-CB 3.48Å; M362-L366 WeakPolarHBondContact O-CD1 3.33Å; M362-L366 VanDerWaalsContact O-CG 3.29Å; M362-L366 WeakPolarHBondContact O-CG 3.49Å; M362-L366 PolarHBondContact O-N 2.67Å; M362-V385 HydrophobicContact CG-CG1 3.76Å; M362-V385 HydrophobicContact SD-CG1 4.35Å
363	E	83.3	Confident	86.7	Confident	57 Å²	57	61.4 Å²	61.4	27%	0.266	30%	0.303	S	S	.	.	H	α-helix	trans	-65.3	-44.9	175.1	-166.1	177.8	-166.1	0	0	111.3	K279 F359 E360 L365 L366 E367	K279-E363 IonicContact NZ-OE1 2.89Å; K279-E363 PolarHBondContact NZ-OE1 3.34Å; K279-E363 IonicContact NZ-OE2 3.8Å; K279-E363 PolarHBondContact NZ-OE2 3.41Å; F359-E363 WeakPolarHBondContact O-CB 3.45Å; F359-E363 PolarHBondContact O-N 2.68Å; E360-E363 PolarHBondContact O-N 2.98Å; E363-L365 PolarHBondContact O-N 3.12Å; E363-L366 WeakPolarHBondContact O-CB 3.5Å; E363-L366 PolarHBondContact O-N 3.08Å; E363-L366 VanDerWaalsContact O-N 3.15Å; E363-E367 WeakPolarHBondContact O-CG 3.29Å; E363-E367 PolarHBondContact O-N 3.21Å
364	E	87.6	Confident	86.9	Confident	87 Å²	87	59.7 Å²	59.7	41%	0.407	29%	0.292	S	S	.	.	H	α-helix	trans	-59.8	-43.3	174.9	-177.1	177.9	-135.6	0	0	112.3	E360 R361 L366 E367 L368 F391	E360-E364 PolarHBondContact O-N 2.65Å; R361-E364 PolarHBondContact O-N 3.37Å; E364-L366 VanDerWaalsContact C-N 3.34Å; E364-L366 PolarHBondContact O-N 3.21Å; E364-E367 PolarHBondContact O-N 3.38Å; E364-L368 WeakPolarHBondContact O-CB 3.35Å; E364-L368 PolarHBondContact O-N 3.21Å; E364-F391 VanDerWaalsContact CD-CD1 3.47Å; E364-F391 HydrophobicContact CG-CD1 4.34Å; E364-F391 VanDerWaalsContact OE1-CD1 3.29Å; E364-F391 WeakPolarHBondContact OE1-CD1 3.35Å
365	L	90.9	Very high	86.9	Confident	1 Å²	1	59.8 Å²	59.8	1%	0.005	29%	0.291	C	S	.	.	H	α-helix	trans	-65.7	-33.9	175.2	-69.8	179.7	0	0	0	112.8	R361 M362 E363 E369 L384 V385 R389 F391 F420	R361-L365 WeakPolarHBondContact O-CG 3.45Å; R361-L365 PolarHBondContact O-N 3.17Å; M362-L365 PolarHBondContact O-N 2.86Å; E363-L365 PolarHBondContact O-N 3.12Å; L365-E369 WeakPolarHBondContact O-CB 3.45Å; L365-E369 PolarHBondContact O-N 2.83Å; L365-L384 HydrophobicContact CD2-CG 4.44Å; L365-V385 HydrophobicContact CB-CG2 4.07Å; L365-R389 HydrophobicContact CD1-CB 4.07Å; L365-R389 HydrophobicContact CD1-CG 4.21Å; L365-R389 WeakPolarHBondContact CD1-O 3.47Å; L365-F391 HydrophobicContact CD2-CB 4.14Å; L365-F420 HydrophobicContact CD2-CD1 3.94Å; L365-F420 HydrophobicContact CD2-CE1 3.6Å
366	L	88.3	Confident	86.6	Confident	81 Å²	81	65.2 Å²	65.2	42%	0.424	33%	0.33	S	S	.	.	H	α-helix	trans	-68.8	-45.1	174.9	-78.9	163.7	0	0	0	111.7	M362 E363 E364 L368 E369 N370 V385	M362-L366 HydrophobicContact CG-CD1 4.25Å; M362-L366 WeakPolarHBondContact O-CB 3.48Å; M362-L366 WeakPolarHBondContact O-CD1 3.33Å; M362-L366 VanDerWaalsContact O-CG 3.29Å; M362-L366 WeakPolarHBondContact O-CG 3.49Å; M362-L366 PolarHBondContact O-N 2.67Å; E363-L366 WeakPolarHBondContact O-CB 3.5Å; E363-L366 PolarHBondContact O-N 3.08Å; E363-L366 VanDerWaalsContact O-N 3.15Å; E364-L366 VanDerWaalsContact C-N 3.34Å; E364-L366 PolarHBondContact O-N 3.21Å; L366-L368 VanDerWaalsContact C-N 3.31Å; L366-L368 PolarHBondContact O-N 2.89Å; L366-E369 PolarHBondContact O-N 3.42Å; L366-N370 VanDerWaalsContact O-CG 3.31Å; L366-N370 PolarHBondContact O-N 3.15Å; L366-N370 PolarHBondContact O-ND2 3.06Å; L366-V385 HydrophobicContact CD2-CG2 3.71Å; L366-V385 HydrophobicContact CG-CG2 3.76Å
367	E	88	Confident	86.4	Confident	121 Å²	121	70 Å²	70	57%	0.565	37%	0.365	S	S	*	.	H	α-helix	trans	-59.3	-44.2	174.2	-72	-176.4	-176.2	0	0	110.8	E363 E364 N370 S371	E363-E367 WeakPolarHBondContact O-CG 3.29Å; E363-E367 PolarHBondContact O-N 3.21Å; E364-E367 PolarHBondContact O-N 3.38Å; E367-N370 PolarHBondContact O-N 2.89Å; E367-S371 PolarHBondContact O-N 3.09Å
368	L	91.4	Very high	86.3	Confident	19 Å²	19	67.9 Å²	67.9	10%	0.099	36%	0.363	C	S	.	.	H	α-helix	trans	-64.1	-45.7	175.4	-178.7	54	0	0	0	112.3	E364 L366 N370 S371 L372 L384 F391 F418 F420	E364-L368 WeakPolarHBondContact O-CB 3.35Å; E364-L368 PolarHBondContact O-N 3.21Å; L366-L368 VanDerWaalsContact C-N 3.31Å; L366-L368 PolarHBondContact O-N 2.89Å; L368-N370 VanDerWaalsContact C-N 3.27Å; L368-N370 PolarHBondContact O-N 3.19Å; L368-S371 PolarHBondContact O-N 2.83Å; L368-S371 PolarHBondContact O-OG 3.5Å; L368-L372 HydrophobicContact CD1-CD1 4.21Å; L368-L372 HydrophobicContact CD1-CG 4.3Å; L368-L372 HydrophobicContact CG-CD1 4Å; L368-L372 WeakPolarHBondContact O-CG 3.47Å; L368-L372 PolarHBondContact O-N 3.05Å; L368-L384 HydrophobicContact CB-CD2 4.3Å; L368-L384 HydrophobicContact CD2-CD2 4.07Å; L368-L384 HydrophobicContact CG-CD2 3.88Å; L368-F391 HydrophobicContact CD2-CD2 4.32Å; L368-F418 HydrophobicContact CD1-CD1 3.8Å; L368-F418 HydrophobicContact CD1-CE1 3.27Å; L368-F418 HydrophobicContact CD1-CZ 3.74Å; L368-F418 HydrophobicContact CD2-CD1 3.75Å; L368-F418 HydrophobicContact CD2-CE1 4.07Å; L368-F418 HydrophobicContact CG-CD1 4.45Å; L368-F418 HydrophobicContact CG-CE1 4.34Å; L368-F420 HydrophobicContact CD2-CE1 3.83Å; L368-F420 HydrophobicContact CD2-CZ 3.68Å
369	E	90.7	Very high	86.3	Confident	33 Å²	33	66.3 Å²	66.3	15%	0.154	35%	0.352	C	S	.	.	H	α-helix	trans	-59.8	-36.4	178.7	-175.1	162.9	174.4	0	0	112.5	L365 L366 S371 L372 R381 L384 V385	L365-E369 WeakPolarHBondContact O-CB 3.45Å; L365-E369 PolarHBondContact O-N 2.83Å; L366-E369 PolarHBondContact O-N 3.42Å; E369-S371 VanDerWaalsContact C-N 3.27Å; E369-S371 PolarHBondContact O-N 3.06Å; E369-L372 PolarHBondContact O-N 3.01Å; E369-R381 VanDerWaalsContact CG-NH2 3.27Å; E369-R381 IonicContact OE1-CZ 2.62Å; E369-R381 IonicContact OE1-NE 2.69Å; E369-R381 IonicContact OE1-NH2 3.81Å; E369-R381 PolarHBondContact OE1-NH2 3.44Å; E369-L384 HydrophobicContact CB-CB 4.17Å; E369-L384 HydrophobicContact CB-CD2 4.16Å; E369-L384 HydrophobicContact CG-CB 4.27Å; E369-L384 WeakPolarHBondContact OE2-CB 3.36Å; E369-L384 PolarHBondContact OE2-N 3.12Å; E369-V385 PolarHBondContact OE2-N 3.32Å
370	N	89.4	Confident	86.5	Confident	130 Å²	130	71.3 Å²	71.3	70%	0.695	37%	0.368	S	S	*	.	H	α-helix	trans	-68	-24.2	175.3	-71.6	-42.7	0	0	0	113.4	L366 E367 L368	L366-N370 VanDerWaalsContact O-CG 3.31Å; L366-N370 PolarHBondContact O-N 3.15Å; L366-N370 PolarHBondContact O-ND2 3.06Å; E367-N370 PolarHBondContact O-N 2.89Å; L368-N370 VanDerWaalsContact C-N 3.27Å; L368-N370 PolarHBondContact O-N 3.19Å
371	S	91.4	Very high	86.7	Confident	26 Å²	26	73.8 Å²	73.8	18%	0.182	37%	0.374	C	S	.	.	H	α-helix	trans	-86.7	-9.1	176.1	76.9	0	0	0	0	114.2	E367 L368 E369 Q434 F435	E367-S371 PolarHBondContact O-N 3.09Å; L368-S371 PolarHBondContact O-N 2.83Å; L368-S371 PolarHBondContact O-OG 3.5Å; E369-S371 VanDerWaalsContact C-N 3.27Å; E369-S371 PolarHBondContact O-N 3.06Å; S371-Q434 WeakPolarHBondContact O-CA 3.36Å; S371-F435 PolarHBondContact O-N 3.49Å
372	L	93	Very high	86.7	Confident	7 Å²	7	72.2 Å²	72.2	4%	0.037	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	126	-172.7	-73.5	164.4	0	0	0	113	L368 E369 Y374 L384 M425 T427 F435 V437	L368-L372 HydrophobicContact CD1-CD1 4.21Å; L368-L372 HydrophobicContact CD1-CG 4.3Å; L368-L372 HydrophobicContact CG-CD1 4Å; L368-L372 WeakPolarHBondContact O-CG 3.47Å; L368-L372 PolarHBondContact O-N 3.05Å; E369-L372 PolarHBondContact O-N 3.01Å; L372-Y374 HydrophobicContact CB-CE2 4.23Å; L372-L384 HydrophobicContact CD1-CD2 3.56Å; L372-M425 HydrophobicContact CD1-CE 4.04Å; L372-M425 HydrophobicContact CD1-SD 3.97Å; L372-M425 HydrophobicContact CD2-SD 3.74Å; L372-T427 HydrophobicContact CD2-CG2 3.9Å; L372-F435 WeakPolarHBondContact CA-O 3.38Å; L372-F435 HydrophobicContact CD2-CB 3.7Å; L372-V437 HydrophobicContact CB-CG2 4.3Å; L372-V437 HydrophobicContact CD2-CG2 3.76Å
373	T	91.5	Very high	86.8	Confident	50 Å²	50	73.6 Å²	73.6	31%	0.307	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	119.9	177.9	-50.2	0	0	0	0	110.7	Q434 F435 V436 V437	T373-Q434 PolarHBondContact OG1-OE1 3.16Å; T373-F435 PolarHBondContact N-O 3.33Å; T373-V436 WeakPolarHBondContact O-CA 3.36Å; T373-V437 PolarHBondContact O-N 3.08Å
374	Y	90.1	Very high	87	Confident	32 Å²	32	70.9 Å²	70.9	13%	0.125	37%	0.37	C	S	.	.			trans	-94.7	135.4	174.9	-67.7	-98.8	0	0	0	109.8	L372 P379 R381 F382 V437	L372-Y374 HydrophobicContact CB-CE2 4.23Å; Y374-P379 HydrophobicContact CD1-CG 4.35Å; Y374-R381 HydrophobicContact CD1-CB 4.07Å; Y374-R381 HydrophobicContact CD1-CG 4.44Å; Y374-R381 HydrophobicContact CD2-CB 4.24Å; Y374-R381 HydrophobicContact CD2-CG 3.89Å; Y374-R381 HydrophobicContact CE1-CB 4.38Å; Y374-R381 HydrophobicContact CE1-CG 4.43Å; Y374-R381 HydrophobicContact CE2-CG 3.88Å; Y374-R381 HydrophobicContact CG-CB 4Å; Y374-R381 HydrophobicContact CG-CG 4.18Å; Y374-F382 HydrophobicContact CE1-CD1 4.28Å; Y374-F382 HydrophobicContact CE1-CE1 4.19Å; Y374-F382 WeakPolarHBondContact OH-CE1 3.27Å; Y374-V437 HydrophobicContact CD1-CB 4.15Å; Y374-V437 HydrophobicContact CD1-CG2 4.11Å; Y374-V437 HydrophobicContact CD2-CG2 4.32Å; Y374-V437 HydrophobicContact CE1-CB 4.12Å; Y374-V437 HydrophobicContact CE1-CG1 4.16Å; Y374-V437 HydrophobicContact CE1-CG2 3.86Å; Y374-V437 HydrophobicContact CE2-CG2 4.09Å; Y374-V437 HydrophobicContact CG-CG2 4.33Å
375	K	86.4	Confident	86.9	Confident	116 Å²	116	68.6 Å²	68.6	50%	0.504	36%	0.362	S	S	.	.			trans	-84	138.7	173	-67.4	-163.8	173	-145.4	0	110.3	S377 S378 V436	K375-S377 PolarHBondContact O-N 2.94Å; K375-S378 PolarHBondContact O-N 3.3Å; K375-V436 HydrophobicContact CD-CG1 4.35Å; K375-V436 HydrophobicContact CG-CG1 4.04Å
376	S	75.8	Confident	86.6	Confident	141 Å²	141	71.4 Å²	71.4	99%	0.986	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-23.9	-174.7	-40.1	0	0	0	0	115.2
377	S	76.8	Confident	86	Confident	116 Å²	116	75.1 Å²	75.1	81%	0.811	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-35.4	-178.2	51.5	0	0	0	0	114.5	K375	K375-S377 PolarHBondContact O-N 2.94Å
378	S	81.8	Confident	85.5	Confident	57 Å²	57	77 Å²	77	40%	0.399	40%	0.404	S	S	.	.	S	Bend	trans	178.7	144.1	179.7	167.8	0	0	0	0	109.6	K375 H481	K375-S378 PolarHBondContact O-N 3.3Å; S378-H481 PolarHBondContact OG-NE2 3.41Å
379	P	84.1	Confident	85.4	Confident	3 Å²	3	77.3 Å²	77.3	2%	0.019	40%	0.403	C	S	.	.	S	Bend	cis	-82.2	162.8	-4	34.8	-36.1	0	0	0	112.6	Y374 V437 Y440 H481	Y374-P379 HydrophobicContact CD1-CG 4.35Å; P379-V437 WeakPolarHBondContact CD-O 3.28Å; P379-V437 HydrophobicContact CG-CB 4.1Å; P379-V437 HydrophobicContact CG-CG1 3.7Å; P379-Y440 HydrophobicContact CB-CD1 4.23Å; P379-Y440 HydrophobicContact CB-CE1 3.73Å; P379-Y440 HydrophobicContact CG-CD1 4.32Å; P379-Y440 HydrophobicContact CG-CE1 4.13Å; P379-H481 HydrophobicContact CB-CB 4.06Å; P379-H481 VanDerWaalsContact CB-CD2 3.46Å; P379-H481 WeakPolarHBondContact CB-CD2 3.37Å
380	R	85.3	Confident	85.2	Confident	198 Å²	198	76.4 Å²	76.4	75%	0.747	40%	0.4	S	S	*	.	P	Polyproline II helix	trans	-63	142.1	173.6	-80	-173.3	-78.7	-114.5	1	110.5	Y440	R380-Y440 WeakPolarHBondContact O-CE1 3.43Å; R380-Y440 PolarHBondContact O-OH 3Å; R380-Y440 VanDerWaalsContact O-OH 3.13Å
381	R	86.6	Confident	85.3	Confident	140 Å²	140	72.3 Å²	72.3	53%	0.528	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-70	139.6	170.8	-172.1	175.3	-173.7	114.7	5.1	109.5	E369 Y374	E369-R381 VanDerWaalsContact CG-NH2 3.27Å; E369-R381 IonicContact OE1-CZ 2.62Å; E369-R381 IonicContact OE1-NE 2.69Å; E369-R381 IonicContact OE1-NH2 3.81Å; E369-R381 PolarHBondContact OE1-NH2 3.44Å; Y374-R381 HydrophobicContact CD1-CB 4.07Å; Y374-R381 HydrophobicContact CD1-CG 4.44Å; Y374-R381 HydrophobicContact CD2-CB 4.24Å; Y374-R381 HydrophobicContact CD2-CG 3.89Å; Y374-R381 HydrophobicContact CE1-CB 4.38Å; Y374-R381 HydrophobicContact CE1-CG 4.43Å; Y374-R381 HydrophobicContact CE2-CG 3.88Å; Y374-R381 HydrophobicContact CG-CB 4Å; Y374-R381 HydrophobicContact CG-CG 4.18Å
382	F	85.2	Confident	85.3	Confident	32 Å²	32	74 Å²	74	14%	0.14	38%	0.383	C	S	.	.			trans	-132.2	158.5	172.3	68	-83.8	0	0	0	108.1	Y374 L384 M423 M425 Y440	Y374-F382 HydrophobicContact CE1-CD1 4.28Å; Y374-F382 HydrophobicContact CE1-CE1 4.19Å; Y374-F382 WeakPolarHBondContact OH-CE1 3.27Å; F382-L384 HydrophobicContact CE2-CD1 3.93Å; F382-L384 HydrophobicContact CZ-CD1 4.02Å; F382-L384 PolarHBondContact O-N 3.42Å; F382-M423 HydrophobicContact CE1-SD 4.31Å; F382-M423 HydrophobicContact CE2-CE 3.68Å; F382-M423 HydrophobicContact CE2-SD 3.76Å; F382-M423 HydrophobicContact CZ-CE 3.49Å; F382-M423 VanDerWaalsContact CZ-CE 3.49Å; F382-M423 HydrophobicContact CZ-SD 3.51Å; F382-M423 VanDerWaalsContact CZ-SD 3.51Å; F382-M425 HydrophobicContact CE1-CE 4.05Å; F382-M425 HydrophobicContact CZ-CE 3.6Å; F382-Y440 HydrophobicContact CD1-CD1 4.04Å; F382-Y440 AromaticContact CD1-CE1 3.5Å; F382-Y440 HydrophobicContact CD1-CE1 3.5Å; F382-Y440 VanDerWaalsContact CD1-CE1 3.5Å; F382-Y440 HydrophobicContact CD1-CE2 4.15Å; F382-Y440 AromaticContact CD1-CZ 3.57Å; F382-Y440 AromaticContact CE1-CD1 3.54Å; F382-Y440 HydrophobicContact CE1-CD1 3.54Å; F382-Y440 HydrophobicContact CE1-CD2 4.34Å; F382-Y440 AromaticContact CE1-CE1 3.51Å; F382-Y440 HydrophobicContact CE1-CE1 3.51Å; F382-Y440 HydrophobicContact CE1-CE2 4.33Å; F382-Y440 AromaticContact CE1-CG 3.97Å; F382-Y440 HydrophobicContact CE1-CG 3.97Å; F382-Y440 AromaticContact CE1-CZ 3.94Å
383	P	85.5	Confident	85.3	Confident	98 Å²	98	75.9 Å²	75.9	64%	0.636	39%	0.392	S	S	*	.			trans	-67	117.6	175.8	26.8	-33.2	0	0	0	109.8	R389	P383-R389 PolarHBondContact O-NH1 2.71Å
384	L	88.3	Confident	85.5	Confident	0 Å²	0	78.1 Å²	78.1	0%	0	40%	0.398	C	S	.	.			trans	-76.7	-42	178.2	-174.4	65.1	0	0	0	110.3	L365 L368 E369 L372 F382 S386 R389 F420 M423 M425	L365-L384 HydrophobicContact CD2-CG 4.44Å; L368-L384 HydrophobicContact CB-CD2 4.3Å; L368-L384 HydrophobicContact CD2-CD2 4.07Å; L368-L384 HydrophobicContact CG-CD2 3.88Å; E369-L384 HydrophobicContact CB-CB 4.17Å; E369-L384 HydrophobicContact CB-CD2 4.16Å; E369-L384 HydrophobicContact CG-CB 4.27Å; E369-L384 WeakPolarHBondContact OE2-CB 3.36Å; E369-L384 PolarHBondContact OE2-N 3.12Å; L372-L384 HydrophobicContact CD1-CD2 3.56Å; F382-L384 HydrophobicContact CE2-CD1 3.93Å; F382-L384 HydrophobicContact CZ-CD1 4.02Å; F382-L384 PolarHBondContact O-N 3.42Å; L384-S386 PolarHBondContact O-N 3.23Å; L384-R389 WeakPolarHBondContact O-CD 3.36Å; L384-R389 PolarHBondContact O-NH1 2.97Å; L384-F420 HydrophobicContact CD1-CE1 3.99Å; L384-F420 HydrophobicContact CD1-CE2 4.18Å; L384-F420 HydrophobicContact CD1-CZ 3.71Å; L384-F420 HydrophobicContact CD2-CZ 4.31Å; L384-M423 HydrophobicContact CD1-CE 3.87Å; L384-M425 HydrophobicContact CD1-CE 3.84Å
385	V	85.8	Confident	85.7	Confident	40 Å²	40	79 Å²	79	24%	0.242	41%	0.405	C	S	.	.			trans	-68	120.8	175.7	-174.9	0	0	0	0	110.3	M362 L365 L366 E369	M362-V385 HydrophobicContact CG-CG1 3.76Å; M362-V385 HydrophobicContact SD-CG1 4.35Å; L365-V385 HydrophobicContact CB-CG2 4.07Å; L366-V385 HydrophobicContact CD2-CG2 3.71Å; L366-V385 HydrophobicContact CG-CG2 3.76Å; E369-V385 PolarHBondContact OE2-N 3.32Å
386	S	83.9	Confident	86.1	Confident	60 Å²	60	77.4 Å²	77.4	42%	0.42	41%	0.408	S	S	.	.			trans	-151.9	144.3	176.9	-177.9	0	0	0	0	109.8	L384 K388 R389	L384-S386 PolarHBondContact O-N 3.23Å; S386-K388 VanDerWaalsContact C-N 3.27Å; S386-K388 PolarHBondContact O-N 3.28Å; S386-R389 PolarHBondContact O-N 2.82Å; S386-R389 VanDerWaalsContact O-N 3.13Å
387	E	75.6	Confident	86.9	Confident	158 Å²	158	70.9 Å²	70.9	74%	0.738	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-35.9	-174.4	-174.4	179.9	-163.3	0	0	114
388	K	78.4	Confident	87.5	Confident	162 Å²	162	67.3 Å²	67.3	70%	0.704	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-7.2	-177.6	-60.7	-175.2	-178.1	-179.6	0	113.8	S386 S421	S386-K388 VanDerWaalsContact C-N 3.27Å; S386-K388 PolarHBondContact O-N 3.28Å; K388-S421 PolarHBondContact O-OG 3.34Å
389	R	87.9	Confident	87.9	Confident	25 Å²	25	66 Å²	66	9%	0.094	32%	0.321	C	S	.	.			trans	-83	126.3	-178.2	-171.9	166.4	-66.7	134.5	-0.5	109.8	L365 P383 L384 S386 F420 D422	L365-R389 HydrophobicContact CD1-CB 4.07Å; L365-R389 HydrophobicContact CD1-CG 4.21Å; L365-R389 WeakPolarHBondContact CD1-O 3.47Å; P383-R389 PolarHBondContact O-NH1 2.71Å; L384-R389 WeakPolarHBondContact O-CD 3.36Å; L384-R389 PolarHBondContact O-NH1 2.97Å; S386-R389 PolarHBondContact O-N 2.82Å; S386-R389 VanDerWaalsContact O-N 3.13Å; R389-F420 HydrophobicContact CG-CB 3.95Å; R389-F420 HydrophobicContact CG-CD1 3.89Å; R389-F420 HydrophobicContact CG-CG 4.18Å; R389-D422 WeakPolarHBondContact CG-OD1 3.21Å; R389-D422 IonicContact CZ-OD1 3.44Å; R389-D422 IonicContact CZ-OD2 2.67Å; R389-D422 VanDerWaalsContact CZ-OD2 3.31Å; R389-D422 IonicContact NE-OD1 3.65Å; R389-D422 PolarHBondContact NE-OD1 3.31Å; R389-D422 IonicContact NE-OD2 2.82Å; R389-D422 PolarHBondContact NE-OD2 3.32Å; R389-D422 VanDerWaalsContact NE-OD2 3.11Å; R389-D422 IonicContact NH2-OD1 3.12Å; R389-D422 IonicContact NH2-OD2 2.64Å; R389-D422 PolarHBondContact NH2-OD2 3.48Å
390	C	86.7	Confident	87.9	Confident	13 Å²	13	66.2 Å²	66.2	9%	0.088	32%	0.321	C	S	.	.			trans	-110	136.6	167	-58.9	0	0	0	0	107.9	R361 L392 F420 S421	R361-C390 VanDerWaalsContact CD-SG 3.6Å; R361-C390 PolarHBondContact NH1-SG 3.06Å; C390-L392 HydrophobicContact CB-CD2 4.26Å; C390-F420 CarbonylContact O-C 3.54Å; C390-F420 WeakPolarHBondContact O-CA 3.35Å; C390-F420 WeakPolarHBondContact O-CB 3.22Å; C390-S421 PolarHBondContact N-OG 2.72Å; C390-S421 PolarHBondContact O-N 3.28Å
391	F	91.5	Very high	87.5	Confident	44 Å²	44	61.1 Å²	61.1	19%	0.193	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	141.1	159.1	172.1	-108	0	0	0	108.7	E364 L365 L368 M393 K394 F418 F420	E364-F391 VanDerWaalsContact CD-CD1 3.47Å; E364-F391 HydrophobicContact CG-CD1 4.34Å; E364-F391 VanDerWaalsContact OE1-CD1 3.29Å; E364-F391 WeakPolarHBondContact OE1-CD1 3.35Å; L365-F391 HydrophobicContact CD2-CB 4.14Å; L368-F391 HydrophobicContact CD2-CD2 4.32Å; F391-M393 VanDerWaalsContact CE2-C 3.47Å; F391-M393 WeakPolarHBondContact CE2-O 3.32Å; F391-M393 VanDerWaalsContact CZ-C 3.42Å; F391-K394 HydrophobicContact CE2-CB 3.84Å; F391-K394 HydrophobicContact CZ-CB 3.5Å; F391-K394 VanDerWaalsContact CZ-CB 3.5Å; F391-F418 HydrophobicContact CE2-CB 4.43Å; F391-F418 AromaticContact CE2-CD1 3.82Å; F391-F418 HydrophobicContact CE2-CD1 3.82Å; F391-F420 HydrophobicContact CB-CD1 4.14Å; F391-F420 HydrophobicContact CB-CE1 4.19Å; F391-F420 HydrophobicContact CD2-CD1 4.3Å; F391-F420 AromaticContact CD2-CE1 3.99Å; F391-F420 HydrophobicContact CD2-CE1 3.99Å
392	L	91.7	Very high	86.5	Confident	61 Å²	61	56.9 Å²	56.9	32%	0.319	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	-47.1	-174.8	-63.5	-178.9	0	0	0	113	C390 L419	C390-L392 HydrophobicContact CB-CD2 4.26Å; L392-L419 HydrophobicContact CB-CG 4.42Å; L392-L419 WeakPolarHBondContact CB-O 3.42Å; L392-L419 HydrophobicContact CD1-CG 4.37Å; L392-L419 PolarHBondContact N-O 2.95Å
393	M	93.8	Very high	85.2	Confident	47 Å²	47	57.6 Å²	57.6	23%	0.232	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.1	155.9	178.7	52.8	175.3	55.2	0	0	112.1	F391 L419 W501 A504	F391-M393 VanDerWaalsContact CE2-C 3.47Å; F391-M393 WeakPolarHBondContact CE2-O 3.32Å; F391-M393 VanDerWaalsContact CZ-C 3.42Å; M393-L419 HydrophobicContact CG-CB 3.74Å; M393-L419 HydrophobicContact CG-CD2 3.93Å; M393-L419 HydrophobicContact CG-CG 4.39Å; M393-L419 PolarHBondContact N-O 3.32Å; M393-L419 PolarHBondContact O-N 2.87Å; M393-L419 HydrophobicContact SD-CD2 4.05Å; M393-W501 HydrophobicContact CB-CZ2 4.17Å; M393-W501 HydrophobicContact CG-CH2 4.06Å; M393-W501 HydrophobicContact CG-CZ2 3.66Å; M393-W501 HydrophobicContact SD-CD2 3.75Å; M393-W501 HydrophobicContact SD-CE3 4.37Å; M393-W501 HydrophobicContact SD-CG 3.99Å; M393-W501 HydrophobicContact SD-CH2 4.45Å; M393-W501 HydrophobicContact SD-CZ2 3.85Å; M393-A504 HydrophobicContact CE-CB 3.57Å; M393-A504 HydrophobicContact SD-CB 3.67Å
394	K	94.4	Very high	83.6	Confident	98 Å²	98	61 Å²	61	43%	0.426	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	129.3	176.9	167.7	-154.8	-179	-177.4	0	109.2	F391 V416 L417 F418	F391-K394 HydrophobicContact CE2-CB 3.84Å; F391-K394 HydrophobicContact CZ-CB 3.5Å; F391-K394 VanDerWaalsContact CZ-CB 3.5Å; K394-V416 HydrophobicContact CD-CG1 4.34Å; K394-V416 HydrophobicContact CG-CG1 3.64Å; K394-L417 VanDerWaalsContact CA-O 3.24Å; K394-L417 WeakPolarHBondContact CA-O 3.44Å; K394-F418 HydrophobicContact CB-CD1 3.88Å; K394-F418 HydrophobicContact CB-CE1 4.06Å; K394-F418 HydrophobicContact CD-CD1 4.17Å; K394-F418 HydrophobicContact CD-CE1 3.47Å; K394-F418 VanDerWaalsContact CD-CE1 3.47Å; K394-F418 HydrophobicContact CD-CZ 3.92Å; K394-F418 HydrophobicContact CG-CD1 3.8Å; K394-F418 HydrophobicContact CG-CE1 3.54Å; K394-F418 HydrophobicContact CG-CG 4.41Å; K394-F418 HydrophobicContact CG-CZ 3.95Å
395	D	95.6	Very high	81.9	Confident	50 Å²	50	67.3 Å²	67.3	27%	0.267	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	158.5	179.5	-89.1	-70.3	0	0	0	112.6	F397 V416 L417 Q497 W501	D395-F397 HydrophobicContact CB-CD2 4.17Å; D395-F397 HydrophobicContact CB-CE2 3.52Å; D395-F397 HydrophobicContact CB-CZ 4.14Å; D395-V416 WeakPolarHBondContact O-CA 3.48Å; D395-L417 PolarHBondContact N-O 2.87Å; D395-L417 PolarHBondContact O-N 2.82Å; D395-Q497 HydrophobicContact CB-CG 4.47Å; D395-Q497 VanDerWaalsContact CG-NE2 3.31Å; D395-Q497 PolarHBondContact OD1-NE2 2.91Å; D395-W501 HydrophobicContact CB-CZ2 3.75Å; D395-W501 PolarHBondContact OD2-NE1 3.22Å
396	S	94.1	Very high	80.1	Confident	83 Å²	83	72.4 Å²	72.4	58%	0.58	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.2	130.7	175.6	-58.5	0	0	0	0	110.3	C415 Q497	S396-C415 WeakPolarHBondContact CA-O 3.31Å; S396-Q497 PolarHBondContact O-NE2 2.91Å
397	F	92.8	Very high	78.8	Confident	3 Å²	3	72.9 Å²	72.9	1%	0.013	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	162	178.7	-70.6	-82.8	0	0	0	110.8	D395 C415 L417 F473 F490 T492 Q497 W501	D395-F397 HydrophobicContact CB-CD2 4.17Å; D395-F397 HydrophobicContact CB-CE2 3.52Å; D395-F397 HydrophobicContact CB-CZ 4.14Å; F397-C415 PolarHBondContact N-O 2.66Å; F397-C415 PolarHBondContact O-N 3.41Å; F397-C415 VanDerWaalsContact O-O 3.09Å; F397-C415 PolarHBondContact O-SG 2.81Å; F397-C415 VanDerWaalsContact O-SG 3.32Å; F397-L417 HydrophobicContact CD2-CB 4.29Å; F397-L417 HydrophobicContact CD2-CD1 3.58Å; F397-L417 HydrophobicContact CD2-CG 3.8Å; F397-L417 HydrophobicContact CE2-CD1 3.88Å; F397-L417 HydrophobicContact CE2-CG 4.37Å; F397-L417 HydrophobicContact CG-CD1 4.33Å; F397-F473 AromaticContact CD1-CE1 3.9Å; F397-F473 HydrophobicContact CD1-CE1 3.9Å; F397-F473 HydrophobicContact CD1-CZ 4.36Å; F397-F473 AromaticContact CE1-CE1 3.59Å; F397-F473 HydrophobicContact CE1-CE1 3.59Å; F397-F473 HydrophobicContact CE1-CZ 4.04Å; F397-F473 HydrophobicContact CZ-CE1 4.15Å; F397-F473 HydrophobicContact CZ-CZ 4.17Å; F397-F490 HydrophobicContact CB-CB 4.49Å; F397-F490 HydrophobicContact CB-CD1 4.34Å; F397-T492 HydrophobicContact CD1-CG2 4.37Å; F397-T492 HydrophobicContact CE1-CG2 4.01Å; F397-Q497 HydrophobicContact CE1-CG 4.21Å; F397-Q497 HydrophobicContact CZ-CG 3.94Å; F397-W501 AromaticContact CE2-CD2 3.73Å; F397-W501 HydrophobicContact CE2-CD2 3.73Å; F397-W501 AromaticContact CE2-CE2 3.72Å; F397-W501 HydrophobicContact CE2-CE3 4.26Å; F397-W501 AromaticContact CE2-CG 3.96Å; F397-W501 HydrophobicContact CE2-CG 3.96Å; F397-W501 HydrophobicContact CE2-CZ2 4.25Å; F397-W501 AromaticContact CE2-NE1 3.87Å; F397-W501 HydrophobicContact CZ-CB 4.2Å; F397-W501 AromaticContact CZ-CD1 3.63Å; F397-W501 AromaticContact CZ-CD2 3.91Å; F397-W501 HydrophobicContact CZ-CD2 3.91Å; F397-W501 AromaticContact CZ-CG 3.61Å; F397-W501 HydrophobicContact CZ-CG 3.61Å; F397-W501 AromaticContact CZ-NE1 3.89Å
398	H	89.7	Confident	77.8	Confident	42 Å²	42	67.4 Å²	67.4	19%	0.194	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	121.2	164	-61	-81.7	0	0	0	109.2	W412 N414 L469 F490 A491	H398-W412 HydrophobicContact CB-CB 4.41Å; H398-W412 HydrophobicContact CB-CD2 4.48Å; H398-W412 HydrophobicContact CB-CE3 3.89Å; H398-W412 VanDerWaalsContact O-CZ3 3.31Å; H398-W412 WeakPolarHBondContact O-CZ3 3.18Å; H398-N414 PolarHBondContact CE1-OD1 2.88Å; H398-N414 PolarHBondContact ND1-OD1 2.89Å; H398-L469 HydrophobicContact CB-CD1 3.97Å; H398-L469 HydrophobicContact CB-CD2 4.22Å; H398-L469 VanDerWaalsContact CD2-CD2 3.43Å; H398-L469 WeakPolarHBondContact CD2-CD2 3.49Å; H398-F490 CarbonylContact O-C 3.51Å; H398-F490 WeakPolarHBondContact O-CA 3.34Å; H398-A491 HydrophobicContact CB-CB 4.42Å; H398-A491 PolarHBondContact N-O 2.82Å; H398-A491 PolarHBondContact O-N 2.88Å
399	M	89.1	Confident	77.1	Confident	30 Å²	30	66.3 Å²	66.3	15%	0.148	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	135.1	174.4	-178.6	-159.5	-60.9	0	0	110.6	W412 T413 C415 I426 I488 A489 F490	M399-W412 VanDerWaalsContact C-CE3 3.45Å; M399-W412 WeakPolarHBondContact O-CA 3.43Å; M399-T413 HydrophobicContact CB-CG2 4.33Å; M399-T413 PolarHBondContact N-O 2.83Å; M399-T413 PolarHBondContact O-N 2.95Å; M399-C415 HydrophobicContact CB-CB 4.21Å; M399-C415 HydrophobicContact CE-CB 3.85Å; M399-I426 HydrophobicContact CE-CG2 3.16Å; M399-I488 HydrophobicContact CG-CG2 3.71Å; M399-I488 HydrophobicContact SD-CG2 4.38Å; M399-A489 WeakPolarHBondContact CA-O 3.45Å; M399-F490 HydrophobicContact CB-CD1 4.2Å; M399-F490 HydrophobicContact CB-CE1 4.13Å; M399-F490 HydrophobicContact CE-CE1 4.06Å; M399-F490 HydrophobicContact CG-CD1 4.42Å; M399-F490 HydrophobicContact CG-CE1 4.05Å
400	L	83.9	Confident	76.2	Confident	6 Å²	6	66.9 Å²	66.9	3%	0.031	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	120.5	171.7	-168.7	66	0	0	0	110.7	F410 G411 W412 L458 A489 Y532 L535	L400-F410 HydrophobicContact CD1-CB 3.56Å; L400-F410 HydrophobicContact CD1-CG 4.32Å; L400-F410 HydrophobicContact CD2-CD1 4.18Å; L400-F410 HydrophobicContact CD2-CG 4.48Å; L400-F410 HydrophobicContact CG-CB 4.07Å; L400-F410 HydrophobicContact CG-CD1 4.12Å; L400-F410 HydrophobicContact CG-CG 4.39Å; L400-G411 WeakPolarHBondContact CA-O 3.42Å; L400-W412 HydrophobicContact CB-CE3 3.97Å; L400-W412 HydrophobicContact CB-CH2 3.91Å; L400-W412 HydrophobicContact CB-CZ2 4.49Å; L400-W412 HydrophobicContact CB-CZ3 3.63Å; L400-W412 HydrophobicContact CD1-CD2 4Å; L400-W412 HydrophobicContact CD1-CE3 4.27Å; L400-W412 HydrophobicContact CD1-CH2 4.19Å; L400-W412 HydrophobicContact CD1-CZ2 3.91Å; L400-W412 HydrophobicContact CD1-CZ3 4.36Å; L400-W412 HydrophobicContact CG-CH2 4.47Å; L400-L458 HydrophobicContact CD1-CD1 3.5Å; L400-A489 HydrophobicContact CB-CB 3.75Å; L400-A489 HydrophobicContact CD2-CB 3.91Å; L400-A489 PolarHBondContact N-O 3.36Å; L400-Y532 HydrophobicContact CD2-CD1 3.67Å; L400-Y532 HydrophobicContact CD2-CE1 3.43Å; L400-Y532 VanDerWaalsContact CD2-CE1 3.43Å; L400-Y532 HydrophobicContact CG-CE1 4.32Å; L400-L535 HydrophobicContact CD2-CD1 3.86Å
401	Y	77	Confident	75.6	Confident	92 Å²	92	66.8 Å²	66.8	36%	0.361	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	151.5	173.4	71.3	-84.4	0	0	0	110.8	L403 F410 G411 T413	Y401-L403 HydrophobicContact CD2-CD1 4.41Å; Y401-L403 HydrophobicContact CE2-CD1 3.69Å; Y401-L403 HydrophobicContact CE2-CG 3.9Å; Y401-F410 CarbonylContact O-C 3.55Å; Y401-F410 WeakPolarHBondContact O-CA 3.1Å; Y401-F410 WeakPolarHBondContact O-CB 3.43Å; Y401-G411 VanDerWaalsContact CD1-C 3.46Å; Y401-G411 WeakPolarHBondContact CD1-O 3.31Å; Y401-G411 WeakPolarHBondContact CE1-O 3.42Å; Y401-G411 PolarHBondContact N-O 2.92Å; Y401-G411 PolarHBondContact O-N 2.64Å; Y401-T413 HydrophobicContact CD1-CG2 3.81Å; Y401-T413 HydrophobicContact CE1-CG2 4.36Å
402	T	65.2	Low	75.1	Confident	51 Å²	51	67 Å²	67	31%	0.313	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	130.1	167.3	41.4	0	0	0	0	110	F410 R531	T402-F410 HydrophobicContact CG2-CD1 3.57Å; T402-F410 HydrophobicContact CG2-CE1 3.47Å; T402-F410 VanDerWaalsContact CG2-CE1 3.47Å; T402-F410 HydrophobicContact CG2-CZ 4.35Å; T402-R531 VanDerWaalsContact CG2-NH2 3.31Å; T402-R531 PolarHBondContact OG1-NH2 3.48Å
403	L	58.5	Low	74.8	Confident	47 Å²	47	66.2 Å²	66.2	25%	0.246	35%	0.35	C	S	.	.			trans	-69.9	138.5	164.4	-77.7	79.5	0	0	0	108.5	Y401 R405 R409 F410	Y401-L403 HydrophobicContact CD2-CD1 4.41Å; Y401-L403 HydrophobicContact CE2-CD1 3.69Å; Y401-L403 HydrophobicContact CE2-CG 3.9Å; L403-R405 HydrophobicContact CB-CG 4.49Å; L403-R405 PolarHBondContact O-N 3.12Å; L403-R409 WeakPolarHBondContact CB-O 3.47Å; L403-R409 WeakPolarHBondContact CD1-O 3.44Å; L403-R409 PolarHBondContact N-O 2.73Å; L403-F410 WeakPolarHBondContact CD1-O 3.49Å
404	N	51.1	Low	74.6	Confident	168 Å²	168	69 Å²	69	90%	0.898	37%	0.366	S	S	*	.	S	Bend	trans	-73	63.5	168.5	-70	-0	0	0	0	110.2
405	R	52.6	Low	74.6	Confident	133 Å²	133	64.6 Å²	64.6	50%	0.502	35%	0.347	S	S	.	.	S	Bend	trans	-129.4	141.8	173.3	-72.7	-173.4	172.3	161.7	-2.1	108.5	L403 S407 G408	L403-R405 HydrophobicContact CB-CG 4.49Å; L403-R405 PolarHBondContact O-N 3.12Å; R405-S407 PolarHBondContact O-N 2.89Å; R405-G408 PolarHBondContact O-N 2.94Å
406	P	49.2	Very low	74.6	Confident	148 Å²	148	62.6 Å²	62.6	96%	0.961	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-17.4	-174.2	22.7	-33.9	0	0	0	114.3	G408	P406-G408 PolarHBondContact O-N 3.47Å
407	S	56.7	Low	74.7	Confident	69 Å²	69	58.6 Å²	58.6	48%	0.483	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	0.4	174.2	51.2	0	0	0	0	115.1	R405 R409	R405-S407 PolarHBondContact O-N 2.89Å; S407-R409 PolarHBondContact O-N 3.47Å; S407-R409 PolarHBondContact OG-NE 2.84Å
408	G	55	Low	74.8	Confident	43 Å²	43	58.6 Å²	58.6	44%	0.443	31%	0.309	S	S	.	.			trans	62.4	14	175.4	0	0	0	0	0	115.2	R405 P406	R405-G408 PolarHBondContact O-N 2.94Å; P406-G408 PolarHBondContact O-N 3.47Å
409	R	62.5	Low	75.1	Confident	140 Å²	140	56.6 Å²	56.6	53%	0.528	30%	0.3	S	S	.	.			trans	-63.2	138	-178.4	-62.4	-176.4	-155.6	177.3	5.6	110.4	L403 S407	L403-R409 WeakPolarHBondContact CB-O 3.47Å; L403-R409 WeakPolarHBondContact CD1-O 3.44Å; L403-R409 PolarHBondContact N-O 2.73Å; S407-R409 PolarHBondContact O-N 3.47Å; S407-R409 PolarHBondContact OG-NE 2.84Å
410	F	68.8	Low	75.3	Confident	36 Å²	36	55.2 Å²	55.2	16%	0.158	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	171.4	172.2	-51.9	-99.8	0	0	0	110.6	L400 Y401 T402 L403 L458 Y532 L535	L400-F410 HydrophobicContact CD1-CB 3.56Å; L400-F410 HydrophobicContact CD1-CG 4.32Å; L400-F410 HydrophobicContact CD2-CD1 4.18Å; L400-F410 HydrophobicContact CD2-CG 4.48Å; L400-F410 HydrophobicContact CG-CB 4.07Å; L400-F410 HydrophobicContact CG-CD1 4.12Å; L400-F410 HydrophobicContact CG-CG 4.39Å; Y401-F410 CarbonylContact O-C 3.55Å; Y401-F410 WeakPolarHBondContact O-CA 3.1Å; Y401-F410 WeakPolarHBondContact O-CB 3.43Å; T402-F410 HydrophobicContact CG2-CD1 3.57Å; T402-F410 HydrophobicContact CG2-CE1 3.47Å; T402-F410 VanDerWaalsContact CG2-CE1 3.47Å; T402-F410 HydrophobicContact CG2-CZ 4.35Å; L403-F410 WeakPolarHBondContact CD1-O 3.49Å; F410-L458 HydrophobicContact CB-CD1 4.01Å; F410-L458 HydrophobicContact CB-CD2 3.72Å; F410-L458 HydrophobicContact CD2-CD2 4.35Å; F410-L458 WeakPolarHBondContact O-CD2 3.5Å; F410-Y532 HydrophobicContact CD1-CE1 4.32Å; F410-Y532 HydrophobicContact CE1-CD1 4.16Å; F410-Y532 AromaticContact CE1-CE1 3.89Å; F410-Y532 HydrophobicContact CE1-CE1 3.89Å; F410-L535 HydrophobicContact CD1-CD1 4.47Å; F410-L535 HydrophobicContact CD2-CD1 3.76Å; F410-L535 HydrophobicContact CD2-CD2 3.82Å; F410-L535 HydrophobicContact CD2-CG 4.29Å; F410-L535 HydrophobicContact CE1-CD1 4.47Å; F410-L535 HydrophobicContact CE2-CD1 3.77Å; F410-L535 HydrophobicContact CE2-CD2 3.85Å; F410-L535 HydrophobicContact CE2-CG 4.07Å; F410-L535 HydrophobicContact CG-CD1 4.13Å; F410-L535 HydrophobicContact CZ-CD1 4.13Å
411	G	73.9	Confident	75.6	Confident	11 Å²	11	55.8 Å²	55.8	11%	0.113	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	163.7	171	0	0	0	0	0	110.3	L400 Y401	L400-G411 WeakPolarHBondContact CA-O 3.42Å; Y401-G411 VanDerWaalsContact CD1-C 3.46Å; Y401-G411 WeakPolarHBondContact CD1-O 3.31Å; Y401-G411 WeakPolarHBondContact CE1-O 3.42Å; Y401-G411 PolarHBondContact N-O 2.92Å; Y401-G411 PolarHBondContact O-N 2.64Å
412	W	81.5	Confident	76.2	Confident	49 Å²	49	54.3 Å²	54.3	19%	0.186	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	135.6	176.6	-66.7	106	0	0	0	110.5	H398 M399 L400 I456 L469 V472 A489 A491	H398-W412 HydrophobicContact CB-CB 4.41Å; H398-W412 HydrophobicContact CB-CD2 4.48Å; H398-W412 HydrophobicContact CB-CE3 3.89Å; H398-W412 VanDerWaalsContact O-CZ3 3.31Å; H398-W412 WeakPolarHBondContact O-CZ3 3.18Å; M399-W412 VanDerWaalsContact C-CE3 3.45Å; M399-W412 WeakPolarHBondContact O-CA 3.43Å; L400-W412 HydrophobicContact CB-CE3 3.97Å; L400-W412 HydrophobicContact CB-CH2 3.91Å; L400-W412 HydrophobicContact CB-CZ2 4.49Å; L400-W412 HydrophobicContact CB-CZ3 3.63Å; L400-W412 HydrophobicContact CD1-CD2 4Å; L400-W412 HydrophobicContact CD1-CE3 4.27Å; L400-W412 HydrophobicContact CD1-CH2 4.19Å; L400-W412 HydrophobicContact CD1-CZ2 3.91Å; L400-W412 HydrophobicContact CD1-CZ3 4.36Å; L400-W412 HydrophobicContact CG-CH2 4.47Å; W412-I456 HydrophobicContact CZ2-CD1 4.19Å; W412-L469 HydrophobicContact CB-CD1 4.41Å; W412-L469 HydrophobicContact CD2-CD1 3.61Å; W412-L469 HydrophobicContact CE3-CD1 4.1Å; W412-L469 HydrophobicContact CG-CD1 3.74Å; W412-L469 HydrophobicContact CZ2-CD1 4.26Å; W412-V472 HydrophobicContact CH2-CG1 4.37Å; W412-A489 HydrophobicContact CH2-CB 4.41Å; W412-A491 HydrophobicContact CE3-CB 4.23Å; W412-A491 HydrophobicContact CH2-CB 3.61Å; W412-A491 HydrophobicContact CZ2-CB 4.32Å; W412-A491 HydrophobicContact CZ3-CB 3.55Å
413	T	85.5	Confident	77.4	Confident	45 Å²	45	52.3 Å²	52.3	28%	0.276	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	142.1	175.2	-160.2	0	0	0	0	110.4	M399 Y401 C415	M399-T413 HydrophobicContact CB-CG2 4.33Å; M399-T413 PolarHBondContact N-O 2.83Å; M399-T413 PolarHBondContact O-N 2.95Å; Y401-T413 HydrophobicContact CD1-CG2 3.81Å; Y401-T413 HydrophobicContact CE1-CG2 4.36Å; T413-C415 PolarHBondContact O-N 2.61Å
414	N	90.2	Very high	79.1	Confident	106 Å²	106	50 Å²	50	57%	0.567	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.6	130.4	-179.8	-57.5	8.8	0	0	0	109.1	H398	H398-N414 PolarHBondContact CE1-OD1 2.88Å; H398-N414 PolarHBondContact ND1-OD1 2.89Å
415	C	93.7	Very high	81.2	Confident	4 Å²	4	42 Å²	42	3%	0.027	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	157.4	173.4	67.1	0	0	0	0	110.1	S396 F397 M399 T413 T427	S396-C415 WeakPolarHBondContact CA-O 3.31Å; F397-C415 PolarHBondContact N-O 2.66Å; F397-C415 PolarHBondContact O-N 3.41Å; F397-C415 VanDerWaalsContact O-O 3.09Å; F397-C415 PolarHBondContact O-SG 2.81Å; F397-C415 VanDerWaalsContact O-SG 3.32Å; M399-C415 HydrophobicContact CB-CB 4.21Å; M399-C415 HydrophobicContact CE-CB 3.85Å; T413-C415 PolarHBondContact O-N 2.61Å; C415-T427 CarbonylContact C-O 3.57Å; C415-T427 WeakPolarHBondContact CA-O 3.29Å; C415-T427 VanDerWaalsContact CB-O 3.25Å; C415-T427 WeakPolarHBondContact CB-O 3.19Å
416	V	95.9	Very high	83.2	Confident	8 Å²	8	36 Å²	36	5%	0.048	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	123.4	169.6	179.3	0	0	0	0	107.6	K394 D395 F418 T427 A429 F435	K394-V416 HydrophobicContact CD-CG1 4.34Å; K394-V416 HydrophobicContact CG-CG1 3.64Å; D395-V416 WeakPolarHBondContact O-CA 3.48Å; V416-F418 HydrophobicContact CB-CE2 4.29Å; V416-F418 HydrophobicContact CG1-CD2 4.25Å; V416-F418 HydrophobicContact CG1-CE2 3.67Å; V416-F418 HydrophobicContact CG1-CZ 3.96Å; V416-T427 PolarHBondContact N-O 2.98Å; V416-T427 PolarHBondContact O-N 2.92Å; V416-T427 PolarHBondContact O-OG1 2.86Å; V416-A429 HydrophobicContact CG2-CB 4.14Å; V416-F435 HydrophobicContact CB-CD1 4.13Å; V416-F435 HydrophobicContact CB-CE1 4.16Å; V416-F435 HydrophobicContact CG1-CD1 4.29Å; V416-F435 HydrophobicContact CG1-CE1 4.07Å; V416-F435 HydrophobicContact CG2-CD1 4.35Å; V416-F435 HydrophobicContact CG2-CE1 4.05Å
417	L	95.9	Very high	85.3	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	142.5	176.4	-60.9	-173.1	0	0	0	109.2	K394 D395 F397 L424 M425 I426 F490 W501	K394-L417 VanDerWaalsContact CA-O 3.24Å; K394-L417 WeakPolarHBondContact CA-O 3.44Å; D395-L417 PolarHBondContact N-O 2.87Å; D395-L417 PolarHBondContact O-N 2.82Å; F397-L417 HydrophobicContact CD2-CB 4.29Å; F397-L417 HydrophobicContact CD2-CD1 3.58Å; F397-L417 HydrophobicContact CD2-CG 3.8Å; F397-L417 HydrophobicContact CE2-CD1 3.88Å; F397-L417 HydrophobicContact CE2-CG 4.37Å; F397-L417 HydrophobicContact CG-CD1 4.33Å; L417-L424 HydrophobicContact CB-CD1 4.47Å; L417-M425 WeakPolarHBondContact CA-O 3.46Å; L417-I426 HydrophobicContact CD2-CB 4.2Å; L417-I426 HydrophobicContact CD2-CG1 3.82Å; L417-I426 HydrophobicContact CD2-CG2 4.12Å; L417-F490 HydrophobicContact CD1-CD1 4.15Å; L417-F490 HydrophobicContact CD1-CD2 4.23Å; L417-F490 HydrophobicContact CD1-CE1 4.09Å; L417-F490 HydrophobicContact CD1-CE2 4.15Å; L417-F490 HydrophobicContact CD1-CG 4.22Å; L417-F490 HydrophobicContact CD1-CZ 4.08Å; L417-F490 HydrophobicContact CD2-CD1 4.48Å; L417-F490 HydrophobicContact CD2-CE1 3.73Å; L417-F490 HydrophobicContact CD2-CZ 3.75Å; L417-F490 HydrophobicContact CG-CE1 4.34Å; L417-W501 HydrophobicContact CB-CE3 4.39Å; L417-W501 HydrophobicContact CB-CH2 3.38Å; L417-W501 HydrophobicContact CB-CZ2 4.19Å; L417-W501 HydrophobicContact CB-CZ3 3.5Å; L417-W501 VanDerWaalsContact CB-CZ3 3.5Å; L417-W501 HydrophobicContact CD1-CE3 4.04Å; L417-W501 HydrophobicContact CD1-CZ3 3.87Å; L417-W501 HydrophobicContact CG-CZ3 4.34Å
418	F	95.7	Very high	87.1	Confident	3 Å²	3	30.4 Å²	30.4	1%	0.013	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	117.5	170.3	-65	-98.8	0	0	0	107.6	L368 F391 K394 V416 F420 M425 T427 F435	L368-F418 HydrophobicContact CD1-CD1 3.8Å; L368-F418 HydrophobicContact CD1-CE1 3.27Å; L368-F418 HydrophobicContact CD1-CZ 3.74Å; L368-F418 HydrophobicContact CD2-CD1 3.75Å; L368-F418 HydrophobicContact CD2-CE1 4.07Å; L368-F418 HydrophobicContact CG-CD1 4.45Å; L368-F418 HydrophobicContact CG-CE1 4.34Å; F391-F418 HydrophobicContact CE2-CB 4.43Å; F391-F418 AromaticContact CE2-CD1 3.82Å; F391-F418 HydrophobicContact CE2-CD1 3.82Å; K394-F418 HydrophobicContact CB-CD1 3.88Å; K394-F418 HydrophobicContact CB-CE1 4.06Å; K394-F418 HydrophobicContact CD-CD1 4.17Å; K394-F418 HydrophobicContact CD-CE1 3.47Å; K394-F418 VanDerWaalsContact CD-CE1 3.47Å; K394-F418 HydrophobicContact CD-CZ 3.92Å; K394-F418 HydrophobicContact CG-CD1 3.8Å; K394-F418 HydrophobicContact CG-CE1 3.54Å; K394-F418 HydrophobicContact CG-CG 4.41Å; K394-F418 HydrophobicContact CG-CZ 3.95Å; V416-F418 HydrophobicContact CB-CE2 4.29Å; V416-F418 HydrophobicContact CG1-CD2 4.25Å; V416-F418 HydrophobicContact CG1-CE2 3.67Å; V416-F418 HydrophobicContact CG1-CZ 3.96Å; F418-F420 HydrophobicContact CB-CE2 3.77Å; F418-F420 HydrophobicContact CB-CZ 3.96Å; F418-M425 HydrophobicContact CB-CB 4.31Å; F418-M425 PolarHBondContact N-O 3.43Å; F418-M425 PolarHBondContact O-N 3.36Å; F418-T427 HydrophobicContact CD2-CG2 3.78Å; F418-T427 HydrophobicContact CE2-CG2 3.79Å; F418-T427 WeakPolarHBondContact CE2-OG1 3.5Å; F418-F435 HydrophobicContact CE2-CB 4.25Å; F418-F435 AromaticContact CE2-CD1 3.92Å; F418-F435 HydrophobicContact CE2-CD1 3.92Å; F418-F435 HydrophobicContact CE2-CD2 4.42Å; F418-F435 HydrophobicContact CE2-CE1 4.49Å; F418-F435 AromaticContact CE2-CG 3.91Å; F418-F435 HydrophobicContact CE2-CG 3.91Å; F418-F435 HydrophobicContact CZ-CB 4.48Å; F418-F435 AromaticContact CZ-CD1 3.9Å; F418-F435 HydrophobicContact CZ-CD1 3.9Å; F418-F435 AromaticContact CZ-CD2 3.84Å; F418-F435 HydrophobicContact CZ-CD2 3.84Å; F418-F435 HydrophobicContact CZ-CE1 4.13Å; F418-F435 HydrophobicContact CZ-CE2 4.07Å; F418-F435 AromaticContact CZ-CG 3.78Å; F418-F435 HydrophobicContact CZ-CG 3.78Å; F418-F435 HydrophobicContact CZ-CZ 4.23Å
419	L	95	Very high	88.8	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	128.4	176	-176.9	58.6	0	0	0	109.6	L392 M393 L424 W501 A504 L505	L392-L419 HydrophobicContact CB-CG 4.42Å; L392-L419 WeakPolarHBondContact CB-O 3.42Å; L392-L419 HydrophobicContact CD1-CG 4.37Å; L392-L419 PolarHBondContact N-O 2.95Å; M393-L419 HydrophobicContact CG-CB 3.74Å; M393-L419 HydrophobicContact CG-CD2 3.93Å; M393-L419 HydrophobicContact CG-CG 4.39Å; M393-L419 PolarHBondContact N-O 3.32Å; M393-L419 PolarHBondContact O-N 2.87Å; M393-L419 HydrophobicContact SD-CD2 4.05Å; L419-L424 HydrophobicContact CD1-CB 4.49Å; L419-L424 HydrophobicContact CD1-CD1 4.45Å; L419-W501 HydrophobicContact CB-CH2 3.89Å; L419-W501 HydrophobicContact CB-CZ3 3.93Å; L419-A504 HydrophobicContact CD2-CB 3.73Å; L419-L505 HydrophobicContact CD1-CD2 3.7Å; L419-L505 HydrophobicContact CD2-CD2 4.28Å
420	F	93.2	Very high	90.1	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	169.1	173.5	-55.1	-86.7	0	0	0	110.3	L365 L368 L384 R389 C390 F391 F418 D422 M423 M425 R443	L365-F420 HydrophobicContact CD2-CD1 3.94Å; L365-F420 HydrophobicContact CD2-CE1 3.6Å; L368-F420 HydrophobicContact CD2-CE1 3.83Å; L368-F420 HydrophobicContact CD2-CZ 3.68Å; L384-F420 HydrophobicContact CD1-CE1 3.99Å; L384-F420 HydrophobicContact CD1-CE2 4.18Å; L384-F420 HydrophobicContact CD1-CZ 3.71Å; L384-F420 HydrophobicContact CD2-CZ 4.31Å; R389-F420 HydrophobicContact CG-CB 3.95Å; R389-F420 HydrophobicContact CG-CD1 3.89Å; R389-F420 HydrophobicContact CG-CG 4.18Å; C390-F420 CarbonylContact O-C 3.54Å; C390-F420 WeakPolarHBondContact O-CA 3.35Å; C390-F420 WeakPolarHBondContact O-CB 3.22Å; F391-F420 HydrophobicContact CB-CD1 4.14Å; F391-F420 HydrophobicContact CB-CE1 4.19Å; F391-F420 HydrophobicContact CD2-CD1 4.3Å; F391-F420 AromaticContact CD2-CE1 3.99Å; F391-F420 HydrophobicContact CD2-CE1 3.99Å; F418-F420 HydrophobicContact CB-CE2 3.77Å; F418-F420 HydrophobicContact CB-CZ 3.96Å; F420-D422 VanDerWaalsContact C-N 3.27Å; F420-D422 PolarHBondContact O-N 2.99Å; F420-M423 WeakPolarHBondContact CA-O 3.29Å; F420-M423 HydrophobicContact CB-CB 4.41Å; F420-M423 WeakPolarHBondContact CB-O 3.5Å; F420-M423 HydrophobicContact CD2-CB 4.44Å; F420-M423 HydrophobicContact CD2-CE 3.43Å; F420-M423 VanDerWaalsContact CD2-CE 3.43Å; F420-M423 WeakPolarHBondContact CD2-O 3.29Å; F420-M423 HydrophobicContact CE2-CE 3.65Å; F420-M423 HydrophobicContact CG-CE 4.12Å; F420-M423 HydrophobicContact CZ-CE 4.48Å; F420-M423 PolarHBondContact N-O 2.95Å; F420-M425 HydrophobicContact CE2-CB 3.89Å; F420-M425 HydrophobicContact CE2-CE 4.25Å; F420-R443 PolarHBondContact O-NH1 3.1Å; F420-R443 VanDerWaalsContact O-NH1 3.13Å
421	S	90.5	Very high	90.8	Very high	18 Å²	18	32.2 Å²	32.2	13%	0.126	18%	0.178	C	C	.	.	S	Bend	trans	-52.7	-45.8	174.1	49.3	0	0	0	0	111.9	K388 C390 R443	K388-S421 PolarHBondContact O-OG 3.34Å; C390-S421 PolarHBondContact N-OG 2.72Å; C390-S421 PolarHBondContact O-N 3.28Å; S421-R443 WeakPolarHBondContact O-CD 3.34Å; S421-R443 PolarHBondContact O-NH1 3.36Å
422	D	88.9	Confident	91.3	Very high	62 Å²	62	39.9 Å²	39.9	33%	0.332	21%	0.21	S	C	.	.	S	Bend	trans	-102.1	-12	-172.5	66.8	-32.6	0	0	0	115.2	R389 F420 E442 R443	R389-D422 WeakPolarHBondContact CG-OD1 3.21Å; R389-D422 IonicContact CZ-OD1 3.44Å; R389-D422 IonicContact CZ-OD2 2.67Å; R389-D422 VanDerWaalsContact CZ-OD2 3.31Å; R389-D422 IonicContact NE-OD1 3.65Å; R389-D422 PolarHBondContact NE-OD1 3.31Å; R389-D422 IonicContact NE-OD2 2.82Å; R389-D422 PolarHBondContact NE-OD2 3.32Å; R389-D422 VanDerWaalsContact NE-OD2 3.11Å; R389-D422 IonicContact NH2-OD1 3.12Å; R389-D422 IonicContact NH2-OD2 2.64Å; R389-D422 PolarHBondContact NH2-OD2 3.48Å; F420-D422 VanDerWaalsContact C-N 3.27Å; F420-D422 PolarHBondContact O-N 2.99Å; D422-E442 CarbonylContact O-C 3.54Å; D422-E442 WeakPolarHBondContact O-CA 3.36Å; D422-R443 PolarHBondContact O-N 2.94Å
423	M	91.3	Very high	91.5	Very high	8 Å²	8	39.9 Å²	39.9	4%	0.039	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	146.2	-162.5	179.1	-176.2	62.9	0	0	113.2	F382 L384 F420 M425 Y440 C441	F382-M423 HydrophobicContact CE1-SD 4.31Å; F382-M423 HydrophobicContact CE2-CE 3.68Å; F382-M423 HydrophobicContact CE2-SD 3.76Å; F382-M423 HydrophobicContact CZ-CE 3.49Å; F382-M423 VanDerWaalsContact CZ-CE 3.49Å; F382-M423 HydrophobicContact CZ-SD 3.51Å; F382-M423 VanDerWaalsContact CZ-SD 3.51Å; L384-M423 HydrophobicContact CD1-CE 3.87Å; F420-M423 WeakPolarHBondContact CA-O 3.29Å; F420-M423 HydrophobicContact CB-CB 4.41Å; F420-M423 WeakPolarHBondContact CB-O 3.5Å; F420-M423 HydrophobicContact CD2-CB 4.44Å; F420-M423 HydrophobicContact CD2-CE 3.43Å; F420-M423 VanDerWaalsContact CD2-CE 3.43Å; F420-M423 WeakPolarHBondContact CD2-O 3.29Å; F420-M423 HydrophobicContact CE2-CE 3.65Å; F420-M423 HydrophobicContact CG-CE 4.12Å; F420-M423 HydrophobicContact CZ-CE 4.48Å; F420-M423 PolarHBondContact N-O 2.95Å; M423-M425 HydrophobicContact CE-CE 4.19Å; M423-Y440 HydrophobicContact SD-CD2 4.32Å; M423-Y440 HydrophobicContact SD-CG 4.37Å; M423-C441 CarbonylContact C-O 3.54Å; M423-C441 WeakPolarHBondContact CA-O 3.2Å; M423-C441 WeakPolarHBondContact CG-O 3.31Å
424	L	93.7	Very high	91.8	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	126.9	164.6	175	62.4	0	0	0	109.3	L417 L419 Y440 C441 V446 L477 W501 L505	L417-L424 HydrophobicContact CB-CD1 4.47Å; L419-L424 HydrophobicContact CD1-CB 4.49Å; L419-L424 HydrophobicContact CD1-CD1 4.45Å; L424-Y440 CarbonylContact O-C 3.44Å; L424-Y440 VanDerWaalsContact O-CA 3.22Å; L424-Y440 WeakPolarHBondContact O-CA 3.43Å; L424-C441 PolarHBondContact N-O 3.11Å; L424-C441 PolarHBondContact O-N 3.09Å; L424-V446 HydrophobicContact CB-CG2 4.13Å; L424-V446 HydrophobicContact CD2-CG1 4.26Å; L424-V446 HydrophobicContact CD2-CG2 4.24Å; L424-L477 HydrophobicContact CD2-CD2 4.32Å; L424-W501 HydrophobicContact CD1-CZ3 3.94Å; L424-L505 HydrophobicContact CD1-CD2 4.44Å; L424-L505 HydrophobicContact CD2-CD2 4.17Å
425	M	94.8	Very high	92	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	139.4	173.2	-175.7	-169.2	-68.2	0	0	111.1	L372 F382 L384 L417 F418 F420 M423 T427 V437	L372-M425 HydrophobicContact CD1-CE 4.04Å; L372-M425 HydrophobicContact CD1-SD 3.97Å; L372-M425 HydrophobicContact CD2-SD 3.74Å; F382-M425 HydrophobicContact CE1-CE 4.05Å; F382-M425 HydrophobicContact CZ-CE 3.6Å; L384-M425 HydrophobicContact CD1-CE 3.84Å; L417-M425 WeakPolarHBondContact CA-O 3.46Å; F418-M425 HydrophobicContact CB-CB 4.31Å; F418-M425 PolarHBondContact N-O 3.43Å; F418-M425 PolarHBondContact O-N 3.36Å; F420-M425 HydrophobicContact CE2-CB 3.89Å; F420-M425 HydrophobicContact CE2-CE 4.25Å; M423-M425 HydrophobicContact CE-CE 4.19Å; M425-T427 HydrophobicContact CG-CG2 3.97Å; M425-T427 HydrophobicContact SD-CG2 3.81Å; M425-V437 HydrophobicContact CG-CG1 4.01Å; M425-V437 HydrophobicContact SD-CG1 4.17Å; M425-V437 HydrophobicContact SD-CG2 4.15Å
426	I	94.7	Very high	92	Very high	5 Å²	5	38.8 Å²	38.8	3%	0.026	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	123.4	-178.4	-57.4	175.2	0	0	0	108.5	M399 L417 K438 G439 L477 I488 F490	M399-I426 HydrophobicContact CE-CG2 3.16Å; L417-I426 HydrophobicContact CD2-CB 4.2Å; L417-I426 HydrophobicContact CD2-CG1 3.82Å; L417-I426 HydrophobicContact CD2-CG2 4.12Å; I426-K438 HydrophobicContact CG2-CB 4.24Å; I426-K438 WeakPolarHBondContact O-CB 3.46Å; I426-K438 PolarHBondContact O-N 3.4Å; I426-G439 PolarHBondContact N-O 3.43Å; I426-G439 PolarHBondContact O-N 3.07Å; I426-L477 HydrophobicContact CD1-CD1 3.96Å; I426-I488 HydrophobicContact CD1-CD1 3.55Å; I426-F490 HydrophobicContact CD1-CZ 3.99Å; I426-F490 HydrophobicContact CG1-CZ 4.35Å
427	T	94.8	Very high	91.9	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	167.8	-177.9	75.2	0	0	0	0	112.3	L372 C415 V416 F418 M425 F435 V436	L372-T427 HydrophobicContact CD2-CG2 3.9Å; C415-T427 CarbonylContact C-O 3.57Å; C415-T427 WeakPolarHBondContact CA-O 3.29Å; C415-T427 VanDerWaalsContact CB-O 3.25Å; C415-T427 WeakPolarHBondContact CB-O 3.19Å; V416-T427 PolarHBondContact N-O 2.98Å; V416-T427 PolarHBondContact O-N 2.92Å; V416-T427 PolarHBondContact O-OG1 2.86Å; F418-T427 HydrophobicContact CD2-CG2 3.78Å; F418-T427 HydrophobicContact CE2-CG2 3.79Å; F418-T427 WeakPolarHBondContact CE2-OG1 3.5Å; M425-T427 HydrophobicContact CG-CG2 3.97Å; M425-T427 HydrophobicContact SD-CG2 3.81Å; T427-F435 HydrophobicContact CG2-CB 4.16Å; T427-V436 CarbonylContact C-O 3.6Å; T427-V436 VanDerWaalsContact CA-O 3.26Å; T427-V436 WeakPolarHBondContact CA-O 3.19Å
428	K	92.8	Very high	91.7	Very high	100 Å²	100	43.6 Å²	43.6	44%	0.435	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	125.4	163.8	-178.6	-179.7	178.3	-173.2	0	108.9	V436 K438	K428-V436 PolarHBondContact N-O 3.27Å; K428-V436 PolarHBondContact O-N 2.93Å; K428-K438 HydrophobicContact CB-CG 4.47Å
429	A	92.4	Very high	91.5	Very high	45 Å²	45	43.8 Å²	43.8	37%	0.372	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64	145.5	172.4	0	0	0	0	0	111.6	V416 Q434 F435	V416-A429 HydrophobicContact CG2-CB 4.14Å; A429-Q434 CarbonylContact C-O 3.58Å; A429-Q434 WeakPolarHBondContact CA-O 3.41Å; A429-F435 HydrophobicContact CB-CD1 4.19Å; A429-F435 HydrophobicContact CB-CE1 4.02Å
430	T	89.7	Confident	91.4	Very high	42 Å²	42	45.6 Å²	45.6	26%	0.258	25%	0.245	S	C	.	.			trans	-107.8	160.5	169.8	70.8	0	0	0	0	110.4	H432 G433 Q434 V436	T430-H432 PolarHBondContact O-N 3.03Å; T430-H432 VanDerWaalsContact O-N 3.11Å; T430-G433 PolarHBondContact O-N 3.4Å; T430-Q434 PolarHBondContact N-O 3.3Å; T430-Q434 PolarHBondContact OG1-N 2.94Å; T430-Q434 PolarHBondContact OG1-O 3.1Å; T430-V436 HydrophobicContact CG2-CG2 3.61Å
431	D	83.4	Confident	91.3	Very high	171 Å²	171	45.7 Å²	45.7	91%	0.914	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-15	-179.3	-45.9	-47.8	0	0	0	112.6	G433	D431-G433 VanDerWaalsContact C-N 3.35Å
432	H	83.9	Confident	91.3	Very high	171 Å²	171	49.2 Å²	49.2	79%	0.792	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	9.4	174	-53.4	-45.9	0	0	0	113.6	T430 Q434	T430-H432 PolarHBondContact O-N 3.03Å; T430-H432 VanDerWaalsContact O-N 3.11Å; H432-Q434 VanDerWaalsContact C-N 3.3Å; H432-Q434 PolarHBondContact O-N 3.07Å
433	G	84.8	Confident	91.3	Very high	50 Å²	50	46.4 Å²	46.4	52%	0.515	25%	0.245	S	C	.	.	S	Bend	trans	75.9	11.4	179.3	0	0	0	0	0	115.3	T430 D431	T430-G433 PolarHBondContact O-N 3.4Å; D431-G433 VanDerWaalsContact C-N 3.35Å
434	Q	91.7	Very high	91	Very high	86 Å²	86	52.3 Å²	52.3	40%	0.402	27%	0.27	S	S	.	.			trans	-91.7	160	173.5	-67.6	-176.7	-27.7	0	0	111.5	S371 T373 A429 T430 H432	S371-Q434 WeakPolarHBondContact O-CA 3.36Å; T373-Q434 PolarHBondContact OG1-OE1 3.16Å; A429-Q434 CarbonylContact C-O 3.58Å; A429-Q434 WeakPolarHBondContact CA-O 3.41Å; T430-Q434 PolarHBondContact N-O 3.3Å; T430-Q434 PolarHBondContact OG1-N 2.94Å; T430-Q434 PolarHBondContact OG1-O 3.1Å; H432-Q434 VanDerWaalsContact C-N 3.3Å; H432-Q434 PolarHBondContact O-N 3.07Å
435	F	94.3	Very high	90.7	Very high	24 Å²	24	54.9 Å²	54.9	11%	0.105	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	111.2	-179.7	-60.3	-77.7	0	0	0	110.2	S371 L372 T373 V416 F418 T427 A429 V437	S371-F435 PolarHBondContact O-N 3.49Å; L372-F435 WeakPolarHBondContact CA-O 3.38Å; L372-F435 HydrophobicContact CD2-CB 3.7Å; T373-F435 PolarHBondContact N-O 3.33Å; V416-F435 HydrophobicContact CB-CD1 4.13Å; V416-F435 HydrophobicContact CB-CE1 4.16Å; V416-F435 HydrophobicContact CG1-CD1 4.29Å; V416-F435 HydrophobicContact CG1-CE1 4.07Å; V416-F435 HydrophobicContact CG2-CD1 4.35Å; V416-F435 HydrophobicContact CG2-CE1 4.05Å; F418-F435 HydrophobicContact CE2-CB 4.25Å; F418-F435 AromaticContact CE2-CD1 3.92Å; F418-F435 HydrophobicContact CE2-CD1 3.92Å; F418-F435 HydrophobicContact CE2-CD2 4.42Å; F418-F435 HydrophobicContact CE2-CE1 4.49Å; F418-F435 AromaticContact CE2-CG 3.91Å; F418-F435 HydrophobicContact CE2-CG 3.91Å; F418-F435 HydrophobicContact CZ-CB 4.48Å; F418-F435 AromaticContact CZ-CD1 3.9Å; F418-F435 HydrophobicContact CZ-CD1 3.9Å; F418-F435 AromaticContact CZ-CD2 3.84Å; F418-F435 HydrophobicContact CZ-CD2 3.84Å; F418-F435 HydrophobicContact CZ-CE1 4.13Å; F418-F435 HydrophobicContact CZ-CE2 4.07Å; F418-F435 AromaticContact CZ-CG 3.78Å; F418-F435 HydrophobicContact CZ-CG 3.78Å; F418-F435 HydrophobicContact CZ-CZ 4.23Å; T427-F435 HydrophobicContact CG2-CB 4.16Å; A429-F435 HydrophobicContact CB-CD1 4.19Å; A429-F435 HydrophobicContact CB-CE1 4.02Å; F435-V437 PolarHBondContact O-N 3.41Å
436	V	93.7	Very high	90.4	Very high	22 Å²	22	55.3 Å²	55.3	13%	0.133	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	114.2	175.9	175.6	0	0	0	0	109.1	T373 K375 T427 K428 T430 K438	T373-V436 WeakPolarHBondContact O-CA 3.36Å; K375-V436 HydrophobicContact CD-CG1 4.35Å; K375-V436 HydrophobicContact CG-CG1 4.04Å; T427-V436 CarbonylContact C-O 3.6Å; T427-V436 VanDerWaalsContact CA-O 3.26Å; T427-V436 WeakPolarHBondContact CA-O 3.19Å; K428-V436 PolarHBondContact N-O 3.27Å; K428-V436 PolarHBondContact O-N 2.93Å; T430-V436 HydrophobicContact CG2-CG2 3.61Å; V436-K438 PolarHBondContact O-N 3.21Å
437	V	94.3	Very high	89.9	Confident	1 Å²	1	57.7 Å²	57.7	1%	0.006	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	129.6	-179.7	-165.7	0	0	0	0	110	L372 T373 Y374 P379 M425 F435 Y440	L372-V437 HydrophobicContact CB-CG2 4.3Å; L372-V437 HydrophobicContact CD2-CG2 3.76Å; T373-V437 PolarHBondContact O-N 3.08Å; Y374-V437 HydrophobicContact CD1-CB 4.15Å; Y374-V437 HydrophobicContact CD1-CG2 4.11Å; Y374-V437 HydrophobicContact CD2-CG2 4.32Å; Y374-V437 HydrophobicContact CE1-CB 4.12Å; Y374-V437 HydrophobicContact CE1-CG1 4.16Å; Y374-V437 HydrophobicContact CE1-CG2 3.86Å; Y374-V437 HydrophobicContact CE2-CG2 4.09Å; Y374-V437 HydrophobicContact CG-CG2 4.33Å; P379-V437 WeakPolarHBondContact CD-O 3.28Å; P379-V437 HydrophobicContact CG-CB 4.1Å; P379-V437 HydrophobicContact CG-CG1 3.7Å; M425-V437 HydrophobicContact CG-CG1 4.01Å; M425-V437 HydrophobicContact SD-CG1 4.17Å; M425-V437 HydrophobicContact SD-CG2 4.15Å; F435-V437 PolarHBondContact O-N 3.41Å; V437-Y440 HydrophobicContact CG1-CD1 4.39Å
438	K	91.3	Very high	89.5	Confident	108 Å²	108	58.6 Å²	58.6	47%	0.47	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	-35.7	179.1	-70.4	-65.3	-170.8	164.1	0	112.4	I426 K428 V436	I426-K438 HydrophobicContact CG2-CB 4.24Å; I426-K438 WeakPolarHBondContact O-CB 3.46Å; I426-K438 PolarHBondContact O-N 3.4Å; K428-K438 HydrophobicContact CB-CG 4.47Å; V436-K438 PolarHBondContact O-N 3.21Å
439	G	91.5	Very high	88.6	Confident	6 Å²	6	54.8 Å²	54.8	6%	0.062	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-177.7	173.7	173.8	0	0	0	0	0	110.9	I426 H481	I426-G439 PolarHBondContact N-O 3.43Å; I426-G439 PolarHBondContact O-N 3.07Å; G439-H481 WeakPolarHBondContact CA-ND1 3.45Å
440	Y	93.1	Very high	87.4	Confident	39 Å²	39	55.4 Å²	55.4	15%	0.153	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	161.3	174.6	52.5	-97.6	0	0	0	109.5	P379 R380 F382 M423 L424 V437 D480 H481	P379-Y440 HydrophobicContact CB-CD1 4.23Å; P379-Y440 HydrophobicContact CB-CE1 3.73Å; P379-Y440 HydrophobicContact CG-CD1 4.32Å; P379-Y440 HydrophobicContact CG-CE1 4.13Å; R380-Y440 WeakPolarHBondContact O-CE1 3.43Å; R380-Y440 PolarHBondContact O-OH 3Å; R380-Y440 VanDerWaalsContact O-OH 3.13Å; F382-Y440 HydrophobicContact CD1-CD1 4.04Å; F382-Y440 AromaticContact CD1-CE1 3.5Å; F382-Y440 HydrophobicContact CD1-CE1 3.5Å; F382-Y440 VanDerWaalsContact CD1-CE1 3.5Å; F382-Y440 HydrophobicContact CD1-CE2 4.15Å; F382-Y440 AromaticContact CD1-CZ 3.57Å; F382-Y440 AromaticContact CE1-CD1 3.54Å; F382-Y440 HydrophobicContact CE1-CD1 3.54Å; F382-Y440 HydrophobicContact CE1-CD2 4.34Å; F382-Y440 AromaticContact CE1-CE1 3.51Å; F382-Y440 HydrophobicContact CE1-CE1 3.51Å; F382-Y440 HydrophobicContact CE1-CE2 4.33Å; F382-Y440 AromaticContact CE1-CG 3.97Å; F382-Y440 HydrophobicContact CE1-CG 3.97Å; F382-Y440 AromaticContact CE1-CZ 3.94Å; M423-Y440 HydrophobicContact SD-CD2 4.32Å; M423-Y440 HydrophobicContact SD-CG 4.37Å; L424-Y440 CarbonylContact O-C 3.44Å; L424-Y440 VanDerWaalsContact O-CA 3.22Å; L424-Y440 WeakPolarHBondContact O-CA 3.43Å; V437-Y440 HydrophobicContact CG1-CD1 4.39Å; Y440-D480 CarbonylContact O-C 3.57Å; Y440-H481 HydrophobicContact CD1-CB 4.06Å; Y440-H481 HydrophobicContact CD2-CB 3.88Å; Y440-H481 HydrophobicContact CE1-CB 3.8Å; Y440-H481 HydrophobicContact CE2-CB 3.6Å; Y440-H481 HydrophobicContact CG-CB 4.1Å; Y440-H481 PolarHBondContact O-N 3.25Å
441	C	91.9	Very high	85.8	Confident	2 Å²	2	54.2 Å²	54.2	1%	0.014	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	138.3	179.4	-178	0	0	0	0	108.4	M423 L424 R443 V446 L477 K479	M423-C441 CarbonylContact C-O 3.54Å; M423-C441 WeakPolarHBondContact CA-O 3.2Å; M423-C441 WeakPolarHBondContact CG-O 3.31Å; L424-C441 PolarHBondContact N-O 3.11Å; L424-C441 PolarHBondContact O-N 3.09Å; C441-R443 PolarHBondContact O-N 3.07Å; C441-V446 HydrophobicContact CB-CG2 4.01Å; C441-L477 HydrophobicContact CB-CB 4.18Å; C441-L477 HydrophobicContact CB-CD1 4.15Å; C441-L477 HydrophobicContact CB-CD2 3.83Å; C441-L477 HydrophobicContact CB-CG 4.26Å; C441-K479 PolarHBondContact SG-O 3.22Å
442	E	89.9	Confident	84.2	Confident	92 Å²	92	53.9 Å²	53.9	43%	0.43	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	137.3	167.2	-65.5	-177.7	-115.3	0	0	109.2	D422 K444 F445	D422-E442 CarbonylContact O-C 3.54Å; D422-E442 WeakPolarHBondContact O-CA 3.36Å; E442-K444 HydrophobicContact CB-CG 4.25Å; E442-K444 PolarHBondContact O-N 2.91Å; E442-K444 IonicContact OE1-NZ 2.66Å; E442-K444 WeakPolarHBondContact OE2-CE 3.22Å; E442-K444 IonicContact OE2-NZ 2.83Å; E442-K444 PolarHBondContact OE2-NZ 2.99Å; E442-F445 HydrophobicContact CB-CD2 3.91Å; E442-F445 HydrophobicContact CB-CE2 4.4Å; E442-F445 PolarHBondContact O-N 2.98Å
443	R	89.3	Confident	82.3	Confident	3 Å²	3	50.4 Å²	50.4	1%	0.011	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-59.3	-34.5	-173.1	-171.6	-176.9	-169	160.6	6.1	112.5	F420 S421 D422 C441 F445 V446 A504 K507	F420-R443 PolarHBondContact O-NH1 3.1Å; F420-R443 VanDerWaalsContact O-NH1 3.13Å; S421-R443 WeakPolarHBondContact O-CD 3.34Å; S421-R443 PolarHBondContact O-NH1 3.36Å; D422-R443 PolarHBondContact O-N 2.94Å; C441-R443 PolarHBondContact O-N 3.07Å; R443-F445 PolarHBondContact O-N 3.26Å; R443-F445 VanDerWaalsContact O-N 3.11Å; R443-V446 PolarHBondContact O-N 3.43Å; R443-A504 PolarHBondContact NH2-O 3.42Å; R443-K507 PolarHBondContact NH2-O 2.83Å
444	K	85.3	Confident	80.2	Confident	131 Å²	131	48.2 Å²	48.2	57%	0.57	25%	0.251	S	S	*	.	G	3₁₀ helix	trans	-62.3	-13.5	174.8	78	-163.2	-167.9	-154.6	0	114.5	E442	E442-K444 HydrophobicContact CB-CG 4.25Å; E442-K444 PolarHBondContact O-N 2.91Å; E442-K444 IonicContact OE1-NZ 2.66Å; E442-K444 WeakPolarHBondContact OE2-CE 3.22Å; E442-K444 IonicContact OE2-NZ 2.83Å; E442-K444 PolarHBondContact OE2-NZ 2.99Å
445	F	87.6	Confident	77.8	Confident	54 Å²	54	47.2 Å²	47.2	24%	0.237	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-111.5	10	174.8	-57	-47.7	0	0	0	112.7	E442 R443 E478 K479	E442-F445 HydrophobicContact CB-CD2 3.91Å; E442-F445 HydrophobicContact CB-CE2 4.4Å; E442-F445 PolarHBondContact O-N 2.98Å; R443-F445 PolarHBondContact O-N 3.26Å; R443-F445 VanDerWaalsContact O-N 3.11Å; F445-E478 HydrophobicContact CB-CB 4.37Å; F445-E478 PolarHBondContact O-N 3.07Å; F445-K479 HydrophobicContact CB-CB 4.27Å; F445-K479 HydrophobicContact CD1-CD 4.47Å; F445-K479 HydrophobicContact CD2-CB 3.91Å; F445-K479 HydrophobicContact CD2-CD 4.06Å; F445-K479 HydrophobicContact CD2-CG 4.37Å; F445-K479 HydrophobicContact CE1-CD 4.31Å; F445-K479 HydrophobicContact CE2-CD 3.9Å; F445-K479 HydrophobicContact CG-CB 4.15Å; F445-K479 HydrophobicContact CG-CD 4.36Å; F445-K479 HydrophobicContact CG-CG 4.41Å; F445-K479 HydrophobicContact CZ-CD 4.03Å
446	V	88.1	Confident	75.7	Confident	10 Å²	10	47.2 Å²	47.2	6%	0.061	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	128.3	170.3	-175.4	0	0	0	0	108.5	L424 C441 R443 V448 L477 L505	L424-V446 HydrophobicContact CB-CG2 4.13Å; L424-V446 HydrophobicContact CD2-CG1 4.26Å; L424-V446 HydrophobicContact CD2-CG2 4.24Å; C441-V446 HydrophobicContact CB-CG2 4.01Å; R443-V446 PolarHBondContact O-N 3.43Å; V446-V448 HydrophobicContact CG1-CG2 4.16Å; V446-L477 HydrophobicContact CG1-CD2 4.28Å; V446-L477 HydrophobicContact CG2-CD2 3.93Å; V446-L505 HydrophobicContact CG1-CD2 4.34Å
447	T	84.5	Confident	73.2	Confident	55 Å²	55	49.3 Å²	49.3	34%	0.337	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	146.2	166	55.8	0	0	0	0	109.2	C475 V476	T447-C475 WeakPolarHBondContact O-CA 3.44Å; T447-V476 PolarHBondContact N-O 2.83Å; T447-V476 PolarHBondContact O-N 3.32Å; T447-V476 PolarHBondContact OG1-O 3.42Å
448	V	85.2	Confident	70.8	Confident	18 Å²	18	51.2 Å²	51.2	11%	0.109	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	151.5	-171.9	-170.7	0	0	0	0	110.2	V446 F473 F474 I502 L505	V446-V448 HydrophobicContact CG1-CG2 4.16Å; V448-F473 HydrophobicContact CG1-CD2 4.02Å; V448-F474 CarbonylContact C-O 3.59Å; V448-F474 VanDerWaalsContact CA-O 3.31Å; V448-F474 WeakPolarHBondContact CA-O 3.49Å; V448-I502 HydrophobicContact CG1-CG1 3.98Å; V448-I502 HydrophobicContact CG1-CG2 4.38Å; V448-L505 HydrophobicContact CG2-CB 3.64Å; V448-L505 HydrophobicContact CG2-CD1 3.74Å; V448-L505 HydrophobicContact CG2-CG 4.29Å
449	S	73.9	Confident	68.3	Low	21 Å²	21	49.9 Å²	49.9	15%	0.147	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	130.4	164.9	-163.5	0	0	0	0	110.4	F473 F474 C526	S449-F473 CarbonylContact O-C 3.55Å; S449-F473 WeakPolarHBondContact O-CA 3.28Å; S449-F474 PolarHBondContact N-O 3.04Å; S449-F474 PolarHBondContact O-N 2.65Å; S449-C526 VanDerWaalsContact CB-CB 3.45Å; S449-C526 WeakPolarHBondContact OG-CB 3.27Å; S449-C526 PolarHBondContact OG-O 2.97Å
450	S	67.9	Low	65.8	Low	57 Å²	57	58.5 Å²	58.5	40%	0.399	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	146.2	158.4	82.4	0	0	0	0	109.2
451	A	56.4	Low	63.2	Low	17 Å²	17	59.9 Å²	59.9	14%	0.14	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	107.4	163.6	0	0	0	0	0	107.3	S453 C454 V472 F474 V528	A451-S453 PolarHBondContact O-N 2.91Å; A451-C454 WeakPolarHBondContact CB-SG 3.22Å; A451-V472 PolarHBondContact N-O 2.91Å; A451-F474 HydrophobicContact CB-CD2 3.99Å; A451-F474 HydrophobicContact CB-CE2 3.72Å; A451-V528 HydrophobicContact CB-CG2 4.42Å
452	Q	48.8	Very low	60.8	Low	165 Å²	165	67.7 Å²	67.7	77%	0.771	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.4	121.8	-177.9	-66	-172.6	-2.3	0	0	109.4
453	S	43.7	Very low	58.3	Low	97 Å²	97	69.6 Å²	69.6	68%	0.678	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.9	58.6	175.5	55.9	0	0	0	0	116.6	A451 F455	A451-S453 PolarHBondContact O-N 2.91Å; S453-F455 VanDerWaalsContact C-N 3.34Å; S453-F455 PolarHBondContact O-N 3.36Å
454	C	41.4	Very low	55.7	Low	5 Å²	5	72.3 Å²	72.3	3%	0.034	40%	0.404	C	S	.	.			trans	-72.4	87.2	163.9	-62.9	0	0	0	0	111.1	A451 I456 V472 I536	A451-C454 WeakPolarHBondContact CB-SG 3.22Å; C454-I456 HydrophobicContact CB-CG1 4.24Å; C454-I456 PolarHBondContact O-N 2.85Å; C454-V472 HydrophobicContact CB-CB 4.18Å; C454-V472 HydrophobicContact CB-CG2 4.21Å; C454-I536 HydrophobicContact CB-CD1 3.86Å; C454-I536 HydrophobicContact CB-CG1 3.78Å; C454-I536 WeakPolarHBondContact SG-CD1 3.43Å; C454-I536 VanDerWaalsContact SG-CG1 3.59Å
455	F	41.6	Very low	53.2	Low	65 Å²	65	74.3 Å²	74.3	29%	0.285	41%	0.413	S	S	.	.			trans	-75	89.4	175.4	-144.2	-78.1	0	0	0	110.4	S453 P457 Y553	S453-F455 VanDerWaalsContact C-N 3.34Å; S453-F455 PolarHBondContact O-N 3.36Å; F455-P457 WeakPolarHBondContact O-CD 3.48Å; F455-Y553 AromaticContact CE1-CD1 3.7Å; F455-Y553 HydrophobicContact CE1-CD1 3.7Å; F455-Y553 HydrophobicContact CE1-CD2 4.41Å; F455-Y553 AromaticContact CE1-CE1 3.81Å; F455-Y553 HydrophobicContact CE1-CE1 3.81Å; F455-Y553 HydrophobicContact CE1-CE2 4.49Å; F455-Y553 HydrophobicContact CE1-CG 4.04Å; F455-Y553 HydrophobicContact CE2-CD1 4.18Å; F455-Y553 AromaticContact CE2-CE1 3.51Å; F455-Y553 HydrophobicContact CE2-CE1 3.51Å; F455-Y553 AromaticContact CE2-CZ 3.91Å; F455-Y553 AromaticContact CZ-CD1 3.49Å; F455-Y553 HydrophobicContact CZ-CD1 3.49Å; F455-Y553 VanDerWaalsContact CZ-CD1 3.49Å; F455-Y553 HydrophobicContact CZ-CD2 4.23Å; F455-Y553 AromaticContact CZ-CE1 3.07Å; F455-Y553 HydrophobicContact CZ-CE1 3.07Å; F455-Y553 AromaticContact CZ-CE2 3.88Å; F455-Y553 HydrophobicContact CZ-CE2 3.88Å; F455-Y553 HydrophobicContact CZ-CG 4.06Å; F455-Y553 AromaticContact CZ-CZ 3.3Å
456	I	50	Low	50.9	Low	24 Å²	24	79.9 Å²	79.9	12%	0.123	44%	0.437	C	S	.	.			trans	-97.9	97.8	178.8	-37.9	179.7	0	0	0	110.3	W412 C454 L458 L535	W412-I456 HydrophobicContact CZ2-CD1 4.19Å; C454-I456 HydrophobicContact CB-CG1 4.24Å; C454-I456 PolarHBondContact O-N 2.85Å; I456-L458 HydrophobicContact CB-CD1 4.27Å; I456-L458 HydrophobicContact CG2-CD1 3.67Å; I456-L458 HydrophobicContact CG2-CG 3.67Å; I456-L458 PolarHBondContact O-N 3.01Å; I456-L535 HydrophobicContact CD1-CB 3.93Å; I456-L535 HydrophobicContact CD1-CD1 4.08Å; I456-L535 HydrophobicContact CG1-CB 4.18Å; I456-L535 HydrophobicContact CG2-CB 3.8Å; I456-L535 HydrophobicContact CG2-CD1 4.3Å; I456-L535 HydrophobicContact CG2-CD2 3.85Å; I456-L535 HydrophobicContact CG2-CG 4.19Å
457	P	40.6	Very low	48.8	Very low	65 Å²	65	81.6 Å²	81.6	42%	0.422	45%	0.449	S	S	.	.			trans	-74.9	69.9	175	33.4	-37.4	0	0	0	110.5	F455 S459	F455-P457 WeakPolarHBondContact O-CD 3.48Å; P457-S459 PolarHBondContact O-N 2.89Å
458	L	44.8	Very low	47.4	Very low	41 Å²	41	81.2 Å²	81.2	22%	0.215	45%	0.449	C	S	.	.			trans	-69.4	103.5	177.2	-85.3	156.4	0	0	0	110.3	L400 F410 I456 K460	L400-L458 HydrophobicContact CD1-CD1 3.5Å; F410-L458 HydrophobicContact CB-CD1 4.01Å; F410-L458 HydrophobicContact CB-CD2 3.72Å; F410-L458 HydrophobicContact CD2-CD2 4.35Å; F410-L458 WeakPolarHBondContact O-CD2 3.5Å; I456-L458 HydrophobicContact CB-CD1 4.27Å; I456-L458 HydrophobicContact CG2-CD1 3.67Å; I456-L458 HydrophobicContact CG2-CG 3.67Å; I456-L458 PolarHBondContact O-N 3.01Å; L458-K460 PolarHBondContact O-N 3.38Å; L458-K460 VanDerWaalsContact O-N 3.15Å
459	S	39.1	Very low	46.3	Very low	80 Å²	80	81 Å²	81	56%	0.559	45%	0.447	S	S	*	.			trans	-45.5	115.2	-178.2	-176.5	0	0	0	0	112.5	P457	P457-S459 PolarHBondContact O-N 2.89Å
460	K	38.8	Very low	46	Very low	187 Å²	187	84.8 Å²	84.8	81%	0.813	46%	0.461	S	S	*	.			trans	35.6	90.2	166.5	-62.8	-176.5	-179.3	-178.6	0	114.6	L458 H462	L458-K460 PolarHBondContact O-N 3.38Å; L458-K460 VanDerWaalsContact O-N 3.15Å; K460-H462 PolarHBondContact O-N 2.88Å
461	S	38.8	Very low	46.7	Very low	69 Å²	69	85.6 Å²	85.6	48%	0.483	46%	0.456	S	S	.	.			trans	-52.9	140	147.6	-179.2	0	0	0	0	108.8	N463 G464	S461-N463 PolarHBondContact O-N 2.88Å; S461-G464 PolarHBondContact O-N 2.96Å; S461-G464 VanDerWaalsContact O-N 3.09Å
462	H	41.1	Very low	47.9	Very low	165 Å²	165	84.9 Å²	84.9	76%	0.764	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-11.5	-175.4	-102.3	-93	0	0	0	114.1	K460	K460-H462 PolarHBondContact O-N 2.88Å
463	N	37.3	Very low	49.7	Very low	132 Å²	132	77 Å²	77	71%	0.706	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.5	17.7	178.7	-70.4	16.3	0	0	0	114.4	S461 F465	S461-N463 PolarHBondContact O-N 2.88Å; N463-F465 WeakPolarHBondContact O-CD2 3.24Å; N463-F465 PolarHBondContact O-N 3.08Å
464	G	34.6	Very low	51.6	Low	61 Å²	61	72.5 Å²	72.5	63%	0.629	38%	0.381	S	S	*	.			trans	73.4	-3.4	164.9	0	0	0	0	0	117.9	S461 F466	S461-G464 PolarHBondContact O-N 2.96Å; S461-G464 VanDerWaalsContact O-N 3.09Å; G464-F466 PolarHBondContact O-N 3.16Å
465	F	34	Very low	53.8	Low	173 Å²	173	72.3 Å²	72.3	76%	0.759	38%	0.38	S	S	*	.			trans	-71.6	110.3	176.2	-80.5	-91.7	0	0	0	112.2	N463 C467	N463-F465 WeakPolarHBondContact O-CD2 3.24Å; N463-F465 PolarHBondContact O-N 3.08Å; F465-C467 PolarHBondContact O-N 2.96Å
466	F	38.6	Very low	55.9	Low	170 Å²	170	69.9 Å²	69.9	75%	0.746	37%	0.37	S	S	*	.			trans	-71.7	81.9	155.1	-73.5	-90.3	0	0	0	108.2	G464 S468	G464-F466 PolarHBondContact O-N 3.16Å; F466-S468 PolarHBondContact O-N 2.74Å; F466-S468 VanDerWaalsContact O-N 3.11Å
467	C	44.5	Very low	57.8	Low	47 Å²	47	69 Å²	69	32%	0.318	37%	0.365	S	S	.	.			trans	-70.5	106.9	176.6	-154.2	0	0	0	0	108.2	F465 L469	F465-C467 PolarHBondContact O-N 2.96Å; C467-L469 HydrophobicContact CB-CD1 4.12Å; C467-L469 HydrophobicContact CB-CG 4.01Å; C467-L469 PolarHBondContact O-N 2.86Å; C467-L469 VanDerWaalsContact SG-CG 3.57Å
468	S	54.9	Low	59.9	Low	46 Å²	46	69.4 Å²	69.4	32%	0.322	36%	0.362	S	S	.	.			trans	-79.1	63.8	-178.9	59.8	0	0	0	0	110.6	F466 K470	F466-S468 PolarHBondContact O-N 2.74Å; F466-S468 VanDerWaalsContact O-N 3.11Å; S468-K470 PolarHBondContact O-N 2.94Å
469	L	61.3	Low	61.9	Low	15 Å²	15	73 Å²	73	8%	0.079	38%	0.375	C	S	.	.			trans	-71.5	92.2	-178.2	-67.7	171.9	0	0	0	109.5	H398 W412 C467 A491	H398-L469 HydrophobicContact CB-CD1 3.97Å; H398-L469 HydrophobicContact CB-CD2 4.22Å; H398-L469 VanDerWaalsContact CD2-CD2 3.43Å; H398-L469 WeakPolarHBondContact CD2-CD2 3.49Å; W412-L469 HydrophobicContact CB-CD1 4.41Å; W412-L469 HydrophobicContact CD2-CD1 3.61Å; W412-L469 HydrophobicContact CE3-CD1 4.1Å; W412-L469 HydrophobicContact CG-CD1 3.74Å; W412-L469 HydrophobicContact CZ2-CD1 4.26Å; C467-L469 HydrophobicContact CB-CD1 4.12Å; C467-L469 HydrophobicContact CB-CG 4.01Å; C467-L469 PolarHBondContact O-N 2.86Å; C467-L469 VanDerWaalsContact SG-CG 3.57Å; L469-A491 HydrophobicContact CB-CB 3.99Å; L469-A491 HydrophobicContact CD1-CB 3.96Å; L469-A491 HydrophobicContact CD2-CB 4.01Å; L469-A491 HydrophobicContact CG-CB 4.19Å
470	K	68.7	Low	64.2	Low	99 Å²	99	70.1 Å²	70.1	43%	0.43	35%	0.354	S	S	.	.			trans	-79.9	-33.3	-174.4	-72.6	174.2	-177.8	178.5	0	112.9	S468	S468-K470 PolarHBondContact O-N 2.94Å
471	Y	81.1	Confident	66.5	Low	75 Å²	75	63.1 Å²	63.1	29%	0.294	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	113.1	-170.9	-54.3	-65.9	0	0	0	109.2	A491 T492 E493 K495	Y471-A491 VanDerWaalsContact O-CA 3.27Å; Y471-A491 WeakPolarHBondContact O-CA 3.4Å; Y471-T492 PolarHBondContact N-O 3.3Å; Y471-T492 PolarHBondContact O-N 3.21Å; Y471-E493 WeakPolarHBondContact CD2-O 3.26Å; Y471-E493 VanDerWaalsContact CE2-O 3.27Å; Y471-E493 WeakPolarHBondContact CE2-O 3.46Å; Y471-K495 HydrophobicContact CD1-CB 4.01Å; Y471-K495 HydrophobicContact CD1-CG 3.91Å; Y471-K495 HydrophobicContact CD2-CB 4.12Å; Y471-K495 VanDerWaalsContact CD2-N 3.34Å; Y471-K495 HydrophobicContact CE1-CB 3.72Å; Y471-K495 HydrophobicContact CE1-CD 4.22Å; Y471-K495 HydrophobicContact CE1-CG 3.76Å; Y471-K495 HydrophobicContact CE2-CB 3.83Å; Y471-K495 HydrophobicContact CG-CB 4.2Å; Y471-K495 HydrophobicContact CG-CG 4.47Å
472	V	83	Confident	68.8	Low	1 Å²	1	62.7 Å²	62.7	1%	0.006	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	132	-175.5	-174.6	0	0	0	0	108.7	W412 A451 C454 F474 A489 F490 A491	W412-V472 HydrophobicContact CH2-CG1 4.37Å; A451-V472 PolarHBondContact N-O 2.91Å; C454-V472 HydrophobicContact CB-CB 4.18Å; C454-V472 HydrophobicContact CB-CG2 4.21Å; V472-F474 HydrophobicContact CG1-CE2 4.13Å; V472-F474 HydrophobicContact CG1-CZ 4.06Å; V472-A489 HydrophobicContact CG1-CB 4.37Å; V472-F490 WeakPolarHBondContact CA-O 3.47Å; V472-A491 HydrophobicContact CG2-CB 3.95Å
473	F	85.3	Confident	70.9	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	149.6	171.3	67.9	-78.2	0	0	0	110.3	F397 V448 S449 F490 M498 W501 I502 L505	F397-F473 AromaticContact CD1-CE1 3.9Å; F397-F473 HydrophobicContact CD1-CE1 3.9Å; F397-F473 HydrophobicContact CD1-CZ 4.36Å; F397-F473 AromaticContact CE1-CE1 3.59Å; F397-F473 HydrophobicContact CE1-CE1 3.59Å; F397-F473 HydrophobicContact CE1-CZ 4.04Å; F397-F473 HydrophobicContact CZ-CE1 4.15Å; F397-F473 HydrophobicContact CZ-CZ 4.17Å; V448-F473 HydrophobicContact CG1-CD2 4.02Å; S449-F473 CarbonylContact O-C 3.55Å; S449-F473 WeakPolarHBondContact O-CA 3.28Å; F473-F490 HydrophobicContact CD1-CB 3.98Å; F473-F490 HydrophobicContact CD2-CB 4.42Å; F473-F490 HydrophobicContact CD2-CD2 4.42Å; F473-F490 HydrophobicContact CE1-CB 3.49Å; F473-F490 VanDerWaalsContact CE1-CB 3.49Å; F473-F490 HydrophobicContact CE1-CG 4.5Å; F473-F490 HydrophobicContact CE2-CB 3.99Å; F473-F490 AromaticContact CE2-CD2 3.79Å; F473-F490 HydrophobicContact CE2-CD2 3.79Å; F473-F490 HydrophobicContact CE2-CG 4.29Å; F473-F490 HydrophobicContact CG-CB 4.43Å; F473-F490 HydrophobicContact CZ-CB 3.5Å; F473-F490 AromaticContact CZ-CD2 3.99Å; F473-F490 HydrophobicContact CZ-CD2 3.99Å; F473-F490 HydrophobicContact CZ-CG 4.05Å; F473-F490 PolarHBondContact N-O 2.91Å; F473-F490 PolarHBondContact O-N 2.76Å; F473-M498 HydrophobicContact CB-CG 4.25Å; F473-M498 HydrophobicContact CB-SD 4.46Å; F473-M498 HydrophobicContact CD1-CG 3.8Å; F473-M498 HydrophobicContact CG-CG 4.32Å; F473-W501 HydrophobicContact CZ-CB 4.35Å; F473-I502 HydrophobicContact CB-CD1 4.14Å; F473-I502 HydrophobicContact CB-CG1 4.28Å; F473-I502 HydrophobicContact CD2-CG1 4.48Å; F473-I502 HydrophobicContact CG-CG1 4.42Å; F473-L505 HydrophobicContact CE2-CD1 4.3Å
474	F	84.6	Confident	73.2	Confident	3 Å²	3	58 Å²	58	1%	0.013	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	127	-179.5	-68.3	-82.2	0	0	0	109.1	V448 S449 A451 V472 I488 A489 P529 Y532 I536	V448-F474 CarbonylContact C-O 3.59Å; V448-F474 VanDerWaalsContact CA-O 3.31Å; V448-F474 WeakPolarHBondContact CA-O 3.49Å; S449-F474 PolarHBondContact N-O 3.04Å; S449-F474 PolarHBondContact O-N 2.65Å; A451-F474 HydrophobicContact CB-CD2 3.99Å; A451-F474 HydrophobicContact CB-CE2 3.72Å; V472-F474 HydrophobicContact CG1-CE2 4.13Å; V472-F474 HydrophobicContact CG1-CZ 4.06Å; F474-I488 WeakPolarHBondContact CA-O 3.48Å; F474-A489 HydrophobicContact CD1-CB 3.69Å; F474-A489 HydrophobicContact CE1-CB 3.33Å; F474-A489 HydrophobicContact CZ-CB 4.08Å; F474-P529 HydrophobicContact CB-CG 4.11Å; F474-P529 HydrophobicContact CD1-CG 4.04Å; F474-P529 HydrophobicContact CG-CG 4.16Å; F474-Y532 AromaticContact CD1-CD2 3.49Å; F474-Y532 HydrophobicContact CD1-CD2 3.49Å; F474-Y532 VanDerWaalsContact CD1-CD2 3.49Å; F474-Y532 AromaticContact CD1-CE2 3.88Å; F474-Y532 HydrophobicContact CD1-CE2 3.88Å; F474-Y532 HydrophobicContact CD1-CG 4.26Å; F474-Y532 HydrophobicContact CE1-CD1 4.48Å; F474-Y532 AromaticContact CE1-CD2 3.3Å; F474-Y532 HydrophobicContact CE1-CD2 3.3Å; F474-Y532 AromaticContact CE1-CE2 3.94Å; F474-Y532 HydrophobicContact CE1-CE2 3.94Å; F474-Y532 AromaticContact CE1-CG 3.61Å; F474-Y532 HydrophobicContact CE1-CG 3.61Å; F474-Y532 HydrophobicContact CZ-CD2 4.48Å; F474-Y532 HydrophobicContact CZ-CG 4.5Å; F474-I536 HydrophobicContact CE1-CD1 4.42Å; F474-I536 HydrophobicContact CE2-CD1 3.68Å; F474-I536 HydrophobicContact CZ-CD1 3.36Å
475	C	87.5	Confident	75.7	Confident	1 Å²	1	61.5 Å²	61.5	1%	0.007	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	125	167	-69.1	0	0	0	0	108.5	T447 I488 F490	T447-C475 WeakPolarHBondContact O-CA 3.44Å; C475-I488 PolarHBondContact N-O 2.93Å; C475-I488 PolarHBondContact O-N 3.29Å; C475-I488 VanDerWaalsContact O-O 3.13Å; C475-F490 HydrophobicContact CB-CD2 4.14Å; C475-F490 HydrophobicContact CB-CE2 3.82Å
476	V	85.5	Confident	78.1	Confident	14 Å²	14	55 Å²	55	9%	0.085	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	114.2	166.8	-178.5	0	0	0	0	107.7	T447 E478 R485 E487 P529	T447-V476 PolarHBondContact N-O 2.83Å; T447-V476 PolarHBondContact O-N 3.32Å; T447-V476 PolarHBondContact OG1-O 3.42Å; V476-E478 HydrophobicContact CG1-CG 4.42Å; V476-E478 VanDerWaalsContact CG1-OE1 3.31Å; V476-E478 WeakPolarHBondContact CG1-OE1 3.36Å; V476-E478 PolarHBondContact O-N 2.96Å; V476-R485 HydrophobicContact CG1-CG 4.27Å; V476-E487 HydrophobicContact CG1-CG 4.3Å; V476-E487 HydrophobicContact CG2-CG 4.18Å; V476-P529 HydrophobicContact CG2-CG 4.24Å
477	L	89.1	Confident	80.3	Confident	5 Å²	5	48.6 Å²	48.6	3%	0.026	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	102.3	169.9	-45.9	-177.1	0	0	0	106.5	L424 I426 C441 V446 K479 D480 R485 S486 I488	L424-L477 HydrophobicContact CD2-CD2 4.32Å; I426-L477 HydrophobicContact CD1-CD1 3.96Å; C441-L477 HydrophobicContact CB-CB 4.18Å; C441-L477 HydrophobicContact CB-CD1 4.15Å; C441-L477 HydrophobicContact CB-CD2 3.83Å; C441-L477 HydrophobicContact CB-CG 4.26Å; V446-L477 HydrophobicContact CG1-CD2 4.28Å; V446-L477 HydrophobicContact CG2-CD2 3.93Å; L477-K479 PolarHBondContact O-N 2.88Å; L477-D480 HydrophobicContact CB-CB 4.47Å; L477-D480 HydrophobicContact CD1-CB 4.34Å; L477-R485 CarbonylContact O-C 3.49Å; L477-R485 VanDerWaalsContact O-CA 3.31Å; L477-R485 WeakPolarHBondContact O-CA 3.37Å; L477-S486 PolarHBondContact N-O 3.41Å; L477-S486 PolarHBondContact O-N 3.42Å; L477-I488 HydrophobicContact CD1-CD1 3.63Å; L477-I488 HydrophobicContact CG-CD1 4.16Å
478	E	85.8	Confident	82.3	Confident	73 Å²	73	47.5 Å²	47.5	34%	0.341	24%	0.242	S	C	.	.	S	Bend	trans	-67.2	-27.4	179.6	-70.4	-64.6	156.2	0	0	111.6	F445 V476 R485	F445-E478 HydrophobicContact CB-CB 4.37Å; F445-E478 PolarHBondContact O-N 3.07Å; V476-E478 HydrophobicContact CG1-CG 4.42Å; V476-E478 VanDerWaalsContact CG1-OE1 3.31Å; V476-E478 WeakPolarHBondContact CG1-OE1 3.36Å; V476-E478 PolarHBondContact O-N 2.96Å; E478-R485 VanDerWaalsContact CD-NE 3.26Å; E478-R485 IonicContact OE1-CZ 2.7Å; E478-R485 IonicContact OE1-NE 3.86Å; E478-R485 PolarHBondContact OE1-NE 3.31Å; E478-R485 IonicContact OE1-NH2 3.8Å; E478-R485 PolarHBondContact OE1-NH2 2.87Å; E478-R485 VanDerWaalsContact OE1-NH2 3.12Å; E478-R485 WeakPolarHBondContact OE2-CD 3.45Å; E478-R485 IonicContact OE2-NE 2.73Å; E478-R485 PolarHBondContact OE2-NE 2.87Å
479	K	86.4	Confident	83.8	Confident	116 Å²	116	45.3 Å²	45.3	50%	0.504	23%	0.227	S	C	.	.	S	Bend	trans	-141.2	95.9	170.8	-65.9	-176.9	-179.3	178.4	0	111	C441 F445 L477	C441-K479 PolarHBondContact SG-O 3.22Å; F445-K479 HydrophobicContact CB-CB 4.27Å; F445-K479 HydrophobicContact CD1-CD 4.47Å; F445-K479 HydrophobicContact CD2-CB 3.91Å; F445-K479 HydrophobicContact CD2-CD 4.06Å; F445-K479 HydrophobicContact CD2-CG 4.37Å; F445-K479 HydrophobicContact CE1-CD 4.31Å; F445-K479 HydrophobicContact CE2-CD 3.9Å; F445-K479 HydrophobicContact CG-CB 4.15Å; F445-K479 HydrophobicContact CG-CD 4.36Å; F445-K479 HydrophobicContact CG-CG 4.41Å; F445-K479 HydrophobicContact CZ-CD 4.03Å; L477-K479 PolarHBondContact O-N 2.88Å
480	D	87.9	Confident	85.1	Confident	20 Å²	20	44.6 Å²	44.6	11%	0.107	22%	0.223	C	C	.	.	B	Isolated β-bridge	trans	-70.1	179.1	169.4	70.9	25	0	0	0	112.7	Y440 L477 S482 G483 K484 S486	Y440-D480 CarbonylContact O-C 3.57Å; L477-D480 HydrophobicContact CB-CB 4.47Å; L477-D480 HydrophobicContact CD1-CB 4.34Å; D480-S482 PolarHBondContact O-N 3.28Å; D480-S482 VanDerWaalsContact OD1-CA 3.29Å; D480-S482 WeakPolarHBondContact OD1-CA 3.4Å; D480-S482 WeakPolarHBondContact OD1-CB 3.42Å; D480-S482 PolarHBondContact OD1-N 3.36Å; D480-S482 PolarHBondContact OD1-OG 3.34Å; D480-G483 PolarHBondContact O-N 3.42Å; D480-G483 PolarHBondContact OD1-N 3.18Å; D480-K484 PolarHBondContact N-O 2.92Å; D480-K484 PolarHBondContact OD1-N 2.74Å; D480-S486 WeakPolarHBondContact OD2-CB 3.39Å; D480-S486 PolarHBondContact OD2-OG 3.23Å
481	H	86.5	Confident	86	Confident	41 Å²	41	39.9 Å²	39.9	19%	0.19	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-12.4	178.6	66.5	-93.8	0	0	0	115	S378 P379 G439 Y440	S378-H481 PolarHBondContact OG-NE2 3.41Å; P379-H481 HydrophobicContact CB-CB 4.06Å; P379-H481 VanDerWaalsContact CB-CD2 3.46Å; P379-H481 WeakPolarHBondContact CB-CD2 3.37Å; G439-H481 WeakPolarHBondContact CA-ND1 3.45Å; Y440-H481 HydrophobicContact CD1-CB 4.06Å; Y440-H481 HydrophobicContact CD2-CB 3.88Å; Y440-H481 HydrophobicContact CE1-CB 3.8Å; Y440-H481 HydrophobicContact CE2-CB 3.6Å; Y440-H481 HydrophobicContact CG-CB 4.1Å; Y440-H481 PolarHBondContact O-N 3.25Å
482	S	86.4	Confident	86.4	Confident	60 Å²	60	36.8 Å²	36.8	42%	0.42	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.4	2.5	174.5	76.7	0	0	0	0	113.2	D480 K484	D480-S482 PolarHBondContact O-N 3.28Å; D480-S482 VanDerWaalsContact OD1-CA 3.29Å; D480-S482 WeakPolarHBondContact OD1-CA 3.4Å; D480-S482 WeakPolarHBondContact OD1-CB 3.42Å; D480-S482 PolarHBondContact OD1-N 3.36Å; D480-S482 PolarHBondContact OD1-OG 3.34Å; S482-K484 VanDerWaalsContact C-N 3.3Å; S482-K484 WeakPolarHBondContact OG-CG 3.28Å
483	G	85.2	Confident	86.4	Confident	58 Å²	58	42.6 Å²	42.6	60%	0.598	22%	0.218	S	C	*	.	S	Bend	trans	76.8	13.5	-175.7	0	0	0	0	0	113.9	D480	D480-G483 PolarHBondContact O-N 3.42Å; D480-G483 PolarHBondContact OD1-N 3.18Å
484	K	86.5	Confident	86.6	Confident	140 Å²	140	47.5 Å²	47.5	61%	0.609	24%	0.242	S	C	*	.			trans	-101.6	151.8	-176.7	-64.8	-178.5	-176.4	-178	0	111.3	D480 S482	D480-K484 PolarHBondContact N-O 2.92Å; D480-K484 PolarHBondContact OD1-N 2.74Å; S482-K484 VanDerWaalsContact C-N 3.3Å; S482-K484 WeakPolarHBondContact OG-CG 3.28Å
485	R	86.3	Confident	86.6	Confident	134 Å²	134	52.3 Å²	52.3	51%	0.506	26%	0.262	S	S	.	.			trans	-78.1	118	171	-174.9	173.1	-172.2	-86	-3.7	109.5	V476 L477 E478 E487	V476-R485 HydrophobicContact CG1-CG 4.27Å; L477-R485 CarbonylContact O-C 3.49Å; L477-R485 VanDerWaalsContact O-CA 3.31Å; L477-R485 WeakPolarHBondContact O-CA 3.37Å; E478-R485 VanDerWaalsContact CD-NE 3.26Å; E478-R485 IonicContact OE1-CZ 2.7Å; E478-R485 IonicContact OE1-NE 3.86Å; E478-R485 PolarHBondContact OE1-NE 3.31Å; E478-R485 IonicContact OE1-NH2 3.8Å; E478-R485 PolarHBondContact OE1-NH2 2.87Å; E478-R485 VanDerWaalsContact OE1-NH2 3.12Å; E478-R485 WeakPolarHBondContact OE2-CD 3.45Å; E478-R485 IonicContact OE2-NE 2.73Å; E478-R485 PolarHBondContact OE2-NE 2.87Å; R485-E487 IonicContact CZ-OE1 2.92Å; R485-E487 IonicContact NH1-OE1 3.11Å; R485-E487 PolarHBondContact NH1-OE1 2.83Å; R485-E487 IonicContact NH2-OE1 2.86Å
486	S	84.9	Confident	86.8	Confident	37 Å²	37	60 Å²	60	26%	0.259	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	113.2	-174.1	-82.3	0	0	0	0	110.8	L477 D480	L477-S486 PolarHBondContact N-O 3.41Å; L477-S486 PolarHBondContact O-N 3.42Å; D480-S486 WeakPolarHBondContact OD2-CB 3.39Å; D480-S486 PolarHBondContact OD2-OG 3.23Å
487	E	84.4	Confident	87.1	Confident	36 Å²	36	60.4 Å²	60.4	17%	0.168	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	128.7	174.2	-54.8	179.3	162.2	0	0	109.1	V476 R485 P529 Y532	V476-E487 HydrophobicContact CG1-CG 4.3Å; V476-E487 HydrophobicContact CG2-CG 4.18Å; R485-E487 IonicContact CZ-OE1 2.92Å; R485-E487 IonicContact NH1-OE1 3.11Å; R485-E487 PolarHBondContact NH1-OE1 2.83Å; R485-E487 IonicContact NH2-OE1 2.86Å; E487-P529 HydrophobicContact CB-CB 4.28Å; E487-P529 VanDerWaalsContact CD-CB 3.44Å; E487-P529 HydrophobicContact CG-CB 4.18Å; E487-P529 VanDerWaalsContact OE2-CB 3.22Å; E487-P529 WeakPolarHBondContact OE2-CB 3.5Å; E487-Y532 HydrophobicContact CB-CE2 4.01Å; E487-Y532 PolarHBondContact O-OH 3.12Å
488	I	87	Confident	87.1	Confident	23 Å²	23	60.7 Å²	60.7	12%	0.118	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	139.8	-176	-51.8	-179.7	0	0	0	109.4	M399 I426 F474 C475 L477 F490	M399-I488 HydrophobicContact CG-CG2 3.71Å; M399-I488 HydrophobicContact SD-CG2 4.38Å; I426-I488 HydrophobicContact CD1-CD1 3.55Å; F474-I488 WeakPolarHBondContact CA-O 3.48Å; C475-I488 PolarHBondContact N-O 2.93Å; C475-I488 PolarHBondContact O-N 3.29Å; C475-I488 VanDerWaalsContact O-O 3.13Å; L477-I488 HydrophobicContact CD1-CD1 3.63Å; L477-I488 HydrophobicContact CG-CD1 4.16Å; I488-F490 HydrophobicContact CB-CE2 4.31Å; I488-F490 HydrophobicContact CB-CZ 4.34Å; I488-F490 HydrophobicContact CG2-CD1 4.36Å; I488-F490 HydrophobicContact CG2-CD2 4.4Å; I488-F490 HydrophobicContact CG2-CE1 3.81Å; I488-F490 HydrophobicContact CG2-CE2 3.88Å; I488-F490 HydrophobicContact CG2-CZ 3.56Å
489	A	86.3	Confident	87.2	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	131.7	169.7	0	0	0	0	0	110.2	M399 L400 W412 V472 F474 Y532	M399-A489 WeakPolarHBondContact CA-O 3.45Å; L400-A489 HydrophobicContact CB-CB 3.75Å; L400-A489 HydrophobicContact CD2-CB 3.91Å; L400-A489 PolarHBondContact N-O 3.36Å; W412-A489 HydrophobicContact CH2-CB 4.41Å; V472-A489 HydrophobicContact CG1-CB 4.37Å; F474-A489 HydrophobicContact CD1-CB 3.69Å; F474-A489 HydrophobicContact CE1-CB 3.33Å; F474-A489 HydrophobicContact CZ-CB 4.08Å; A489-Y532 HydrophobicContact CB-CE2 4.47Å
490	F	89.4	Confident	87.5	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	142.7	173.7	-64.6	-65.3	0	0	0	109.8	F397 H398 M399 L417 I426 V472 F473 C475 I488	F397-F490 HydrophobicContact CB-CB 4.49Å; F397-F490 HydrophobicContact CB-CD1 4.34Å; H398-F490 CarbonylContact O-C 3.51Å; H398-F490 WeakPolarHBondContact O-CA 3.34Å; M399-F490 HydrophobicContact CB-CD1 4.2Å; M399-F490 HydrophobicContact CB-CE1 4.13Å; M399-F490 HydrophobicContact CE-CE1 4.06Å; M399-F490 HydrophobicContact CG-CD1 4.42Å; M399-F490 HydrophobicContact CG-CE1 4.05Å; L417-F490 HydrophobicContact CD1-CD1 4.15Å; L417-F490 HydrophobicContact CD1-CD2 4.23Å; L417-F490 HydrophobicContact CD1-CE1 4.09Å; L417-F490 HydrophobicContact CD1-CE2 4.15Å; L417-F490 HydrophobicContact CD1-CG 4.22Å; L417-F490 HydrophobicContact CD1-CZ 4.08Å; L417-F490 HydrophobicContact CD2-CD1 4.48Å; L417-F490 HydrophobicContact CD2-CE1 3.73Å; L417-F490 HydrophobicContact CD2-CZ 3.75Å; L417-F490 HydrophobicContact CG-CE1 4.34Å; I426-F490 HydrophobicContact CD1-CZ 3.99Å; I426-F490 HydrophobicContact CG1-CZ 4.35Å; V472-F490 WeakPolarHBondContact CA-O 3.47Å; F473-F490 HydrophobicContact CD1-CB 3.98Å; F473-F490 HydrophobicContact CD2-CB 4.42Å; F473-F490 HydrophobicContact CD2-CD2 4.42Å; F473-F490 HydrophobicContact CE1-CB 3.49Å; F473-F490 VanDerWaalsContact CE1-CB 3.49Å; F473-F490 HydrophobicContact CE1-CG 4.5Å; F473-F490 HydrophobicContact CE2-CB 3.99Å; F473-F490 AromaticContact CE2-CD2 3.79Å; F473-F490 HydrophobicContact CE2-CD2 3.79Å; F473-F490 HydrophobicContact CE2-CG 4.29Å; F473-F490 HydrophobicContact CG-CB 4.43Å; F473-F490 HydrophobicContact CZ-CB 3.5Å; F473-F490 AromaticContact CZ-CD2 3.99Å; F473-F490 HydrophobicContact CZ-CD2 3.99Å; F473-F490 HydrophobicContact CZ-CG 4.05Å; F473-F490 PolarHBondContact N-O 2.91Å; F473-F490 PolarHBondContact O-N 2.76Å; C475-F490 HydrophobicContact CB-CD2 4.14Å; C475-F490 HydrophobicContact CB-CE2 3.82Å; I488-F490 HydrophobicContact CB-CE2 4.31Å; I488-F490 HydrophobicContact CB-CZ 4.34Å; I488-F490 HydrophobicContact CG2-CD1 4.36Å; I488-F490 HydrophobicContact CG2-CD2 4.4Å; I488-F490 HydrophobicContact CG2-CE1 3.81Å; I488-F490 HydrophobicContact CG2-CE2 3.88Å; I488-F490 HydrophobicContact CG2-CZ 3.56Å
491	A	87.7	Confident	87.7	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	146.2	-177.4	0	0	0	0	0	112.4	H398 W412 L469 Y471 V472	H398-A491 HydrophobicContact CB-CB 4.42Å; H398-A491 PolarHBondContact N-O 2.82Å; H398-A491 PolarHBondContact O-N 2.88Å; W412-A491 HydrophobicContact CE3-CB 4.23Å; W412-A491 HydrophobicContact CH2-CB 3.61Å; W412-A491 HydrophobicContact CZ2-CB 4.32Å; W412-A491 HydrophobicContact CZ3-CB 3.55Å; L469-A491 HydrophobicContact CB-CB 3.99Å; L469-A491 HydrophobicContact CD1-CB 3.96Å; L469-A491 HydrophobicContact CD2-CB 4.01Å; L469-A491 HydrophobicContact CG-CB 4.19Å; Y471-A491 VanDerWaalsContact O-CA 3.27Å; Y471-A491 WeakPolarHBondContact O-CA 3.4Å; V472-A491 HydrophobicContact CG2-CB 3.95Å
492	T	88.2	Confident	87.8	Confident	10 Å²	10	57 Å²	57	6%	0.061	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	161.9	178.6	178.8	0	0	0	0	111.3	F397 Y471 E494 Q497 M498	F397-T492 HydrophobicContact CD1-CG2 4.37Å; F397-T492 HydrophobicContact CE1-CG2 4.01Å; Y471-T492 PolarHBondContact N-O 3.3Å; Y471-T492 PolarHBondContact O-N 3.21Å; T492-E494 VanDerWaalsContact CG2-O 3.28Å; T492-E494 WeakPolarHBondContact CG2-O 3.25Å; T492-E494 PolarHBondContact OG1-N 3.4Å; T492-E494 VanDerWaalsContact OG1-N 3.12Å; T492-Q497 PolarHBondContact OG1-OE1 3.3Å; T492-M498 HydrophobicContact CG2-CB 3.86Å
493	E	84.6	Confident	87.9	Confident	123 Å²	123	57.6 Å²	57.6	58%	0.575	28%	0.278	S	S	*	.	S	Bend	trans	-86.6	-18.7	171.9	-57.5	-169.7	162	0	0	112.1	Y471	Y471-E493 WeakPolarHBondContact CD2-O 3.26Å; Y471-E493 VanDerWaalsContact CE2-O 3.27Å; Y471-E493 WeakPolarHBondContact CE2-O 3.46Å
494	E	87.5	Confident	88.1	Confident	104 Å²	104	55.5 Å²	55.5	49%	0.486	26%	0.255	S	S	.	.			trans	-107	118.7	-177	-171.9	178.8	179.1	0	0	112.5	T492 R496 Q497 M498	T492-E494 VanDerWaalsContact CG2-O 3.28Å; T492-E494 WeakPolarHBondContact CG2-O 3.25Å; T492-E494 PolarHBondContact OG1-N 3.4Å; T492-E494 VanDerWaalsContact OG1-N 3.12Å; E494-R496 VanDerWaalsContact C-N 3.33Å; E494-R496 HydrophobicContact CG-CB 4.07Å; E494-R496 PolarHBondContact O-N 3.5Å; E494-R496 WeakPolarHBondContact OE1-CB 3.46Å; E494-Q497 HydrophobicContact CB-CB 4.1Å; E494-Q497 HydrophobicContact CG-CB 4.4Å; E494-Q497 PolarHBondContact O-N 3.32Å; E494-M498 PolarHBondContact O-N 2.85Å
495	K	85.5	Confident	88.2	Confident	104 Å²	104	49 Å²	49	45%	0.452	23%	0.227	S	C	.	.	H	α-helix	trans	-58.9	-44	178	-165.8	-170.1	170.3	-168.8	0	112.1	Y471 Q497 M498 D499	Y471-K495 HydrophobicContact CD1-CB 4.01Å; Y471-K495 HydrophobicContact CD1-CG 3.91Å; Y471-K495 HydrophobicContact CD2-CB 4.12Å; Y471-K495 VanDerWaalsContact CD2-N 3.34Å; Y471-K495 HydrophobicContact CE1-CB 3.72Å; Y471-K495 HydrophobicContact CE1-CD 4.22Å; Y471-K495 HydrophobicContact CE1-CG 3.76Å; Y471-K495 HydrophobicContact CE2-CB 3.83Å; Y471-K495 HydrophobicContact CG-CB 4.2Å; Y471-K495 HydrophobicContact CG-CG 4.47Å; K495-Q497 VanDerWaalsContact C-N 3.3Å; K495-Q497 PolarHBondContact O-N 2.94Å; K495-M498 HydrophobicContact CG-CE 4.48Å; K495-M498 WeakPolarHBondContact O-CB 3.21Å; K495-M498 PolarHBondContact O-N 2.78Å; K495-M498 VanDerWaalsContact O-N 3.12Å; K495-D499 VanDerWaalsContact CE-OD2 3.22Å; K495-D499 WeakPolarHBondContact CE-OD2 3.36Å; K495-D499 IonicContact NZ-OD2 2.68Å; K495-D499 PolarHBondContact O-N 2.83Å
496	R	90.9	Very high	88	Confident	163 Å²	163	46.5 Å²	46.5	62%	0.615	22%	0.221	S	C	*	.	H	α-helix	trans	-58.8	-41.2	-179.1	-179.8	-174.8	-178.3	165.6	4.5	112	E494 D499 Q500	E494-R496 VanDerWaalsContact C-N 3.33Å; E494-R496 HydrophobicContact CG-CB 4.07Å; E494-R496 PolarHBondContact O-N 3.5Å; E494-R496 WeakPolarHBondContact OE1-CB 3.46Å; R496-D499 PolarHBondContact O-N 2.83Å; R496-Q500 HydrophobicContact CG-CG 4.32Å; R496-Q500 VanDerWaalsContact O-CB 3.28Å; R496-Q500 WeakPolarHBondContact O-CB 3.47Å; R496-Q500 VanDerWaalsContact O-CG 3.22Å; R496-Q500 WeakPolarHBondContact O-CG 3.22Å; R496-Q500 PolarHBondContact O-N 3.25Å
497	Q	92.2	Very high	87.6	Confident	22 Å²	22	48.4 Å²	48.4	10%	0.103	23%	0.225	C	C	.	.	H	α-helix	trans	-64	-42.3	176.8	-165.8	-165.1	43.7	0	0	110.9	D395 S396 F397 T492 E494 K495 W501	D395-Q497 HydrophobicContact CB-CG 4.47Å; D395-Q497 VanDerWaalsContact CG-NE2 3.31Å; D395-Q497 PolarHBondContact OD1-NE2 2.91Å; S396-Q497 PolarHBondContact O-NE2 2.91Å; F397-Q497 HydrophobicContact CE1-CG 4.21Å; F397-Q497 HydrophobicContact CZ-CG 3.94Å; T492-Q497 PolarHBondContact OG1-OE1 3.3Å; E494-Q497 HydrophobicContact CB-CB 4.1Å; E494-Q497 HydrophobicContact CG-CB 4.4Å; E494-Q497 PolarHBondContact O-N 3.32Å; K495-Q497 VanDerWaalsContact C-N 3.3Å; K495-Q497 PolarHBondContact O-N 2.94Å; Q497-W501 WeakPolarHBondContact O-CB 3.5Å; Q497-W501 VanDerWaalsContact O-CD1 3.25Å; Q497-W501 PolarHBondContact O-N 3.4Å; Q497-W501 VanDerWaalsContact O-N 3.08Å
498	M	88.9	Confident	86.6	Confident	10 Å²	10	48.6 Å²	48.6	5%	0.049	23%	0.229	C	C	.	.	H	α-helix	trans	-60.5	-53	173.1	-176.6	-169	73.5	0	0	111.6	F473 T492 E494 K495 Q500 W501 I502	F473-M498 HydrophobicContact CB-CG 4.25Å; F473-M498 HydrophobicContact CB-SD 4.46Å; F473-M498 HydrophobicContact CD1-CG 3.8Å; F473-M498 HydrophobicContact CG-CG 4.32Å; T492-M498 HydrophobicContact CG2-CB 3.86Å; E494-M498 PolarHBondContact O-N 2.85Å; K495-M498 HydrophobicContact CG-CE 4.48Å; K495-M498 WeakPolarHBondContact O-CB 3.21Å; K495-M498 PolarHBondContact O-N 2.78Å; K495-M498 VanDerWaalsContact O-N 3.12Å; M498-Q500 VanDerWaalsContact C-N 3.31Å; M498-Q500 PolarHBondContact O-N 3.24Å; M498-W501 PolarHBondContact O-N 3.29Å; M498-W501 VanDerWaalsContact O-N 3.16Å; M498-I502 HydrophobicContact CE-CD1 4.24Å; M498-I502 HydrophobicContact CG-CD1 3.69Å; M498-I502 HydrophobicContact CG-CG1 4.42Å; M498-I502 WeakPolarHBondContact O-CG1 3.29Å; M498-I502 PolarHBondContact O-N 3.28Å; M498-I502 HydrophobicContact SD-CD1 4.25Å
499	D	89	Confident	85	Confident	68 Å²	68	50.5 Å²	50.5	36%	0.364	24%	0.239	S	C	.	.	H	α-helix	trans	-60.4	-41.5	-176.9	-64.9	-17.7	0	0	0	110.9	K495 R496 D503	K495-D499 VanDerWaalsContact CE-OD2 3.22Å; K495-D499 WeakPolarHBondContact CE-OD2 3.36Å; K495-D499 IonicContact NZ-OD2 2.68Å; K495-D499 PolarHBondContact O-N 2.83Å; R496-D499 PolarHBondContact O-N 2.83Å; D499-D503 WeakPolarHBondContact O-CB 3.27Å; D499-D503 PolarHBondContact O-N 3.38Å
500	Q	92.3	Very high	83.4	Confident	88 Å²	88	54.4 Å²	54.4	41%	0.411	26%	0.26	S	S	.	.	H	α-helix	trans	-64.3	-38.8	175.5	-76.4	177.7	-25.7	0	0	113.2	R496 M498 A504	R496-Q500 HydrophobicContact CG-CG 4.32Å; R496-Q500 VanDerWaalsContact O-CB 3.28Å; R496-Q500 WeakPolarHBondContact O-CB 3.47Å; R496-Q500 VanDerWaalsContact O-CG 3.22Å; R496-Q500 WeakPolarHBondContact O-CG 3.22Å; R496-Q500 PolarHBondContact O-N 3.25Å; M498-Q500 VanDerWaalsContact C-N 3.31Å; M498-Q500 PolarHBondContact O-N 3.24Å; Q500-A504 WeakPolarHBondContact O-CB 3.4Å; Q500-A504 PolarHBondContact O-N 2.93Å
501	W	92.2	Very high	81.4	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-74.4	-34.7	178.6	-88.9	72.3	0	0	0	113.1	M393 D395 F397 L417 L419 L424 F473 Q497 M498 L505	M393-W501 HydrophobicContact CB-CZ2 4.17Å; M393-W501 HydrophobicContact CG-CH2 4.06Å; M393-W501 HydrophobicContact CG-CZ2 3.66Å; M393-W501 HydrophobicContact SD-CD2 3.75Å; M393-W501 HydrophobicContact SD-CE3 4.37Å; M393-W501 HydrophobicContact SD-CG 3.99Å; M393-W501 HydrophobicContact SD-CH2 4.45Å; M393-W501 HydrophobicContact SD-CZ2 3.85Å; D395-W501 HydrophobicContact CB-CZ2 3.75Å; D395-W501 PolarHBondContact OD2-NE1 3.22Å; F397-W501 AromaticContact CE2-CD2 3.73Å; F397-W501 HydrophobicContact CE2-CD2 3.73Å; F397-W501 AromaticContact CE2-CE2 3.72Å; F397-W501 HydrophobicContact CE2-CE3 4.26Å; F397-W501 AromaticContact CE2-CG 3.96Å; F397-W501 HydrophobicContact CE2-CG 3.96Å; F397-W501 HydrophobicContact CE2-CZ2 4.25Å; F397-W501 AromaticContact CE2-NE1 3.87Å; F397-W501 HydrophobicContact CZ-CB 4.2Å; F397-W501 AromaticContact CZ-CD1 3.63Å; F397-W501 AromaticContact CZ-CD2 3.91Å; F397-W501 HydrophobicContact CZ-CD2 3.91Å; F397-W501 AromaticContact CZ-CG 3.61Å; F397-W501 HydrophobicContact CZ-CG 3.61Å; F397-W501 AromaticContact CZ-NE1 3.89Å; L417-W501 HydrophobicContact CB-CE3 4.39Å; L417-W501 HydrophobicContact CB-CH2 3.38Å; L417-W501 HydrophobicContact CB-CZ2 4.19Å; L417-W501 HydrophobicContact CB-CZ3 3.5Å; L417-W501 VanDerWaalsContact CB-CZ3 3.5Å; L417-W501 HydrophobicContact CD1-CE3 4.04Å; L417-W501 HydrophobicContact CD1-CZ3 3.87Å; L417-W501 HydrophobicContact CG-CZ3 4.34Å; L419-W501 HydrophobicContact CB-CH2 3.89Å; L419-W501 HydrophobicContact CB-CZ3 3.93Å; L424-W501 HydrophobicContact CD1-CZ3 3.94Å; F473-W501 HydrophobicContact CZ-CB 4.35Å; Q497-W501 WeakPolarHBondContact O-CB 3.5Å; Q497-W501 VanDerWaalsContact O-CD1 3.25Å; Q497-W501 PolarHBondContact O-N 3.4Å; Q497-W501 VanDerWaalsContact O-N 3.08Å; M498-W501 PolarHBondContact O-N 3.29Å; M498-W501 VanDerWaalsContact O-N 3.16Å; W501-L505 HydrophobicContact CE3-CD1 4.44Å; W501-L505 VanDerWaalsContact O-CB 3.29Å; W501-L505 WeakPolarHBondContact O-CB 3.27Å; W501-L505 WeakPolarHBondContact O-CD1 3.47Å; W501-L505 WeakPolarHBondContact O-CG 3.28Å; W501-L505 PolarHBondContact O-N 3.3Å
502	I	88.6	Confident	79.5	Confident	17 Å²	17	64.3 Å²	64.3	9%	0.087	32%	0.317	C	S	.	.	H	α-helix	trans	-63.8	-53	172.1	-65.8	164.4	0	0	0	109.4	V448 F473 M498 A504 L505 E506	V448-I502 HydrophobicContact CG1-CG1 3.98Å; V448-I502 HydrophobicContact CG1-CG2 4.38Å; F473-I502 HydrophobicContact CB-CD1 4.14Å; F473-I502 HydrophobicContact CB-CG1 4.28Å; F473-I502 HydrophobicContact CD2-CG1 4.48Å; F473-I502 HydrophobicContact CG-CG1 4.42Å; M498-I502 HydrophobicContact CE-CD1 4.24Å; M498-I502 HydrophobicContact CG-CD1 3.69Å; M498-I502 HydrophobicContact CG-CG1 4.42Å; M498-I502 WeakPolarHBondContact O-CG1 3.29Å; M498-I502 PolarHBondContact O-N 3.28Å; M498-I502 HydrophobicContact SD-CD1 4.25Å; I502-A504 VanDerWaalsContact C-N 3.3Å; I502-A504 PolarHBondContact O-N 2.99Å; I502-L505 PolarHBondContact O-N 3.01Å; I502-E506 HydrophobicContact CG2-CG 4.4Å; I502-E506 WeakPolarHBondContact CG2-OE1 3.47Å; I502-E506 WeakPolarHBondContact O-CG 3.31Å; I502-E506 PolarHBondContact O-N 2.9Å
503	D	88.2	Confident	77.4	Confident	72 Å²	72	66.5 Å²	66.5	39%	0.385	34%	0.342	S	S	.	.	H	α-helix	trans	-57.5	-43.9	-179.9	-166.7	68.2	0	0	0	111.7	D499 K507	D499-D503 WeakPolarHBondContact O-CB 3.27Å; D499-D503 PolarHBondContact O-N 3.38Å; D503-K507 VanDerWaalsContact O-CB 3.29Å; D503-K507 WeakPolarHBondContact O-CB 3.34Å; D503-K507 WeakPolarHBondContact O-CD 3.44Å; D503-K507 WeakPolarHBondContact O-CG 3Å; D503-K507 PolarHBondContact O-N 3.12Å; D503-K507 VanDerWaalsContact O-N 3.13Å; D503-K507 WeakPolarHBondContact OD1-CE 3.47Å; D503-K507 IonicContact OD1-NZ 3.31Å; D503-K507 PolarHBondContact OD1-NZ 2.91Å; D503-K507 WeakPolarHBondContact OD2-CD 3.21Å; D503-K507 IonicContact OD2-NZ 3.05Å; D503-K507 PolarHBondContact OD2-NZ 2.59Å
504	A	89.9	Confident	75.3	Confident	14 Å²	14	65.9 Å²	65.9	12%	0.116	34%	0.339	C	S	.	.	H	α-helix	trans	-64.8	-42.4	175.1	0	0	0	0	0	112.4	M393 L419 R443 Q500 I502	M393-A504 HydrophobicContact CE-CB 3.57Å; M393-A504 HydrophobicContact SD-CB 3.67Å; L419-A504 HydrophobicContact CD2-CB 3.73Å; R443-A504 PolarHBondContact NH2-O 3.42Å; Q500-A504 WeakPolarHBondContact O-CB 3.4Å; Q500-A504 PolarHBondContact O-N 2.93Å; I502-A504 VanDerWaalsContact C-N 3.3Å; I502-A504 PolarHBondContact O-N 2.99Å
505	L	88.3	Confident	73.3	Confident	3 Å²	3	64.5 Å²	64.5	2%	0.016	34%	0.337	C	S	.	.	H	α-helix	trans	-67.9	-36.1	-179.6	-75.4	167.9	0	0	0	112.6	L419 L424 V446 V448 F473 W501 I502 L518	L419-L505 HydrophobicContact CD1-CD2 3.7Å; L419-L505 HydrophobicContact CD2-CD2 4.28Å; L424-L505 HydrophobicContact CD1-CD2 4.44Å; L424-L505 HydrophobicContact CD2-CD2 4.17Å; V446-L505 HydrophobicContact CG1-CD2 4.34Å; V448-L505 HydrophobicContact CG2-CB 3.64Å; V448-L505 HydrophobicContact CG2-CD1 3.74Å; V448-L505 HydrophobicContact CG2-CG 4.29Å; F473-L505 HydrophobicContact CE2-CD1 4.3Å; W501-L505 HydrophobicContact CE3-CD1 4.44Å; W501-L505 VanDerWaalsContact O-CB 3.29Å; W501-L505 WeakPolarHBondContact O-CB 3.27Å; W501-L505 WeakPolarHBondContact O-CD1 3.47Å; W501-L505 WeakPolarHBondContact O-CG 3.28Å; W501-L505 PolarHBondContact O-N 3.3Å; I502-L505 PolarHBondContact O-N 3.01Å; L505-L518 WeakPolarHBondContact O-CD1 3.04Å
506	E	82.2	Confident	71.5	Confident	82 Å²	82	64.6 Å²	64.6	38%	0.383	34%	0.336	S	S	.	.	H	α-helix	trans	-73.7	-29.2	178.7	-69.8	178.2	175.4	0	0	113.7	I502 L518	I502-E506 HydrophobicContact CG2-CG 4.4Å; I502-E506 WeakPolarHBondContact CG2-OE1 3.47Å; I502-E506 WeakPolarHBondContact O-CG 3.31Å; I502-E506 PolarHBondContact O-N 2.9Å; E506-L518 PolarHBondContact O-N 3.26Å; E506-L518 VanDerWaalsContact O-N 3.16Å
507	K	75.4	Confident	69.4	Low	78 Å²	78	61.5 Å²	61.5	34%	0.339	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	117.4	-177.5	-72.4	167.8	175.8	172.3	0	112.3	R443 D503 N509 T515	R443-K507 PolarHBondContact NH2-O 2.83Å; D503-K507 VanDerWaalsContact O-CB 3.29Å; D503-K507 WeakPolarHBondContact O-CB 3.34Å; D503-K507 WeakPolarHBondContact O-CD 3.44Å; D503-K507 WeakPolarHBondContact O-CG 3Å; D503-K507 PolarHBondContact O-N 3.12Å; D503-K507 VanDerWaalsContact O-N 3.13Å; D503-K507 WeakPolarHBondContact OD1-CE 3.47Å; D503-K507 IonicContact OD1-NZ 3.31Å; D503-K507 PolarHBondContact OD1-NZ 2.91Å; D503-K507 WeakPolarHBondContact OD2-CD 3.21Å; D503-K507 IonicContact OD2-NZ 3.05Å; D503-K507 PolarHBondContact OD2-NZ 2.59Å; K507-N509 PolarHBondContact O-N 2.79Å; K507-T515 HydrophobicContact CB-CG2 3.65Å; K507-T515 HydrophobicContact CD-CG2 3.78Å; K507-T515 HydrophobicContact CG-CG2 3.79Å
508	T	63.5	Low	67.6	Low	40 Å²	40	62.2 Å²	62.2	25%	0.245	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	119.3	167.5	35.5	0	0	0	0	110.6	Y516 L518	T508-Y516 PolarHBondContact N-O 2.8Å; T508-Y516 PolarHBondContact O-N 2.84Å; T508-Y516 PolarHBondContact OG1-O 3.11Å; T508-L518 HydrophobicContact CG2-CD1 4.4Å; T508-L518 HydrophobicContact CG2-CD2 3.77Å; T508-L518 HydrophobicContact CG2-CG 3.9Å
509	N	54.6	Low	65.1	Low	62 Å²	62	66.5 Å²	66.5	33%	0.332	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	119.6	169.1	-71	-23.7	0	0	0	109.2	K507 T515	K507-N509 PolarHBondContact O-N 2.79Å; N509-T515 PolarHBondContact OD1-OG1 3.43Å
510	D	52.3	Low	62.6	Low	82 Å²	82	71.7 Å²	71.7	44%	0.439	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-68.3	160.6	168.8	-114.5	-29.3	0	0	0	110.8	N512 G513 Q514	D510-N512 PolarHBondContact O-N 2.93Å; D510-G513 PolarHBondContact O-N 2.83Å; D510-Q514 PolarHBondContact N-O 2.86Å
511	P	48.3	Very low	60	Low	74 Å²	74	72 Å²	72	48%	0.481	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-19.9	175.9	-25.6	35.2	0	0	0	114.6
512	N	45.9	Very low	57.5	Low	135 Å²	135	78.2 Å²	78.2	72%	0.722	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	4.9	178.2	-65.6	-20.4	0	0	0	113.8	D510 Q514	D510-N512 PolarHBondContact O-N 2.93Å; N512-Q514 VanDerWaalsContact C-N 3.27Å; N512-Q514 PolarHBondContact O-N 2.91Å
513	G	45.4	Very low	54.8	Low	56 Å²	56	84.9 Å²	84.9	58%	0.577	47%	0.465	S	S	*	.	S	Bend	trans	76.1	8.4	179.1	0	0	0	0	0	115.1	D510	D510-G513 PolarHBondContact O-N 2.83Å
514	Q	39.8	Very low	52.2	Low	109 Å²	109	86.5 Å²	86.5	51%	0.509	47%	0.474	S	S	.	.			trans	-77.5	129.5	167.6	-80.2	174.1	-33.1	0	0	109.8	D510 N512 Y516	D510-Q514 PolarHBondContact N-O 2.86Å; N512-Q514 VanDerWaalsContact C-N 3.27Å; N512-Q514 PolarHBondContact O-N 2.91Å; Q514-Y516 HydrophobicContact CB-CE2 3.72Å; Q514-Y516 PolarHBondContact OE1-OH 2.98Å; Q514-Y516 VanDerWaalsContact OE1-OH 3.13Å
515	T	46.8	Very low	49.6	Very low	75 Å²	75	95 Å²	95	46%	0.46	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	113.9	-176.4	-56.1	0	0	0	0	108.9	K507 N509	K507-T515 HydrophobicContact CB-CG2 3.65Å; K507-T515 HydrophobicContact CD-CG2 3.78Å; K507-T515 HydrophobicContact CG-CG2 3.79Å; N509-T515 PolarHBondContact OD1-OG1 3.43Å
516	Y	47.2	Very low	47.4	Very low	107 Å²	107	97.7 Å²	97.7	42%	0.42	53%	0.526	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	135.6	174.7	-61.4	-74.5	0	0	0	109.7	T508 Q514 L518	T508-Y516 PolarHBondContact N-O 2.8Å; T508-Y516 PolarHBondContact O-N 2.84Å; T508-Y516 PolarHBondContact OG1-O 3.11Å; Q514-Y516 HydrophobicContact CB-CE2 3.72Å; Q514-Y516 PolarHBondContact OE1-OH 2.98Å; Q514-Y516 VanDerWaalsContact OE1-OH 3.13Å; Y516-L518 PolarHBondContact O-N 3.41Å
517	P	47.2	Very low	45.8	Very low	97 Å²	97	98.6 Å²	98.6	63%	0.63	54%	0.538	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-57.7	136.2	166.1	-17	29.6	0	0	0	108.6	A519	P517-A519 PolarHBondContact O-N 2.74Å
518	L	52.9	Low	44.8	Very low	38 Å²	38	96.1 Å²	96.1	20%	0.199	53%	0.529	C	S	.	.			trans	-56.9	118	161.5	-82.5	160.8	0	0	0	107.1	L505 E506 T508 Y516 Y520 T521	L505-L518 WeakPolarHBondContact O-CD1 3.04Å; E506-L518 PolarHBondContact O-N 3.26Å; E506-L518 VanDerWaalsContact O-N 3.16Å; T508-L518 HydrophobicContact CG2-CD1 4.4Å; T508-L518 HydrophobicContact CG2-CD2 3.77Å; T508-L518 HydrophobicContact CG2-CG 3.9Å; Y516-L518 PolarHBondContact O-N 3.41Å; L518-Y520 PolarHBondContact O-N 3Å; L518-T521 PolarHBondContact O-N 3.42Å
519	A	37.5	Very low	44.5	Very low	100 Å²	100	94.9 Å²	94.9	83%	0.826	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	15	-174.7	0	0	0	0	0	114.6	P517	P517-A519 PolarHBondContact O-N 2.74Å
520	Y	35.9	Very low	44.9	Very low	176 Å²	176	102.9 Å²	102.9	69%	0.69	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.7	45.9	177.8	-110.8	-89.3	0	0	0	111.1	L518 K522	L518-Y520 PolarHBondContact O-N 3Å; Y520-K522 HydrophobicContact CD1-CB 4.26Å; Y520-K522 HydrophobicContact CD1-CD 4.14Å; Y520-K522 HydrophobicContact CD1-CG 4.14Å; Y520-K522 HydrophobicContact CE1-CD 4.02Å; Y520-K522 HydrophobicContact CE1-CG 4.15Å; Y520-K522 PolarHBondContact O-N 3.07Å
521	T	38.9	Very low	45.5	Very low	96 Å²	96	104.5 Å²	104.5	59%	0.589	55%	0.547	S	S	*	.			trans	-62.1	76.6	143.9	42.5	0	0	0	0	108.2	L518 N523	L518-T521 PolarHBondContact O-N 3.42Å; T521-N523 PolarHBondContact O-N 2.96Å
522	K	39.1	Very low	46.2	Very low	130 Å²	130	101.2 Å²	101.2	57%	0.565	53%	0.525	S	S	*	.			trans	-60.9	115.1	174.7	-144.5	171.1	-173.4	170.8	0	105.6	Y520 N524	Y520-K522 HydrophobicContact CD1-CB 4.26Å; Y520-K522 HydrophobicContact CD1-CD 4.14Å; Y520-K522 HydrophobicContact CD1-CG 4.14Å; Y520-K522 HydrophobicContact CE1-CD 4.02Å; Y520-K522 HydrophobicContact CE1-CG 4.15Å; Y520-K522 PolarHBondContact O-N 3.07Å; K522-N524 PolarHBondContact O-N 2.97Å
523	N	31.8	Very low	46.9	Very low	157 Å²	157	99.9 Å²	99.9	84%	0.84	51%	0.513	S	S	*	.			trans	-63.3	23.4	-179	-81.7	-16.1	0	0	0	114.6	T521 F525	T521-N523 PolarHBondContact O-N 2.96Å; N523-F525 PolarHBondContact O-N 2.88Å
524	N	34.2	Very low	47.5	Very low	106 Å²	106	105.5 Å²	105.5	57%	0.567	52%	0.521	S	S	*	.	S	Bend	trans	-63	119.8	156.6	-64.7	-4.7	0	0	0	106.8	K522 C526	K522-N524 PolarHBondContact O-N 2.97Å; N524-C526 VanDerWaalsContact C-N 3.27Å; N524-C526 PolarHBondContact O-N 2.8Å
525	F	34.9	Very low	48.1	Very low	193 Å²	193	101.4 Å²	101.4	85%	0.846	50%	0.503	S	S	*	.			trans	-47.5	104.4	147.6	-68.2	-97.1	0	0	0	106.1	N523 T527	N523-F525 PolarHBondContact O-N 2.88Å; F525-T527 PolarHBondContact O-N 3Å; F525-T527 PolarHBondContact O-OG1 3Å; F525-T527 VanDerWaalsContact O-OG1 3.04Å
526	C	41.7	Very low	48.4	Very low	58 Å²	58	99.7 Å²	99.7	39%	0.392	49%	0.491	S	S	.	.			trans	-69.4	81.7	-174.2	-81.8	0	0	0	0	108.5	S449 N524 V528	S449-C526 VanDerWaalsContact CB-CB 3.45Å; S449-C526 WeakPolarHBondContact OG-CB 3.27Å; S449-C526 PolarHBondContact OG-O 2.97Å; N524-C526 VanDerWaalsContact C-N 3.27Å; N524-C526 PolarHBondContact O-N 2.8Å; C526-V528 PolarHBondContact O-N 3.31Å
527	T	47.6	Very low	48.2	Very low	102 Å²	102	98.5 Å²	98.5	63%	0.626	49%	0.489	S	S	*	.			trans	-61.5	134.5	-177	-25.1	0	0	0	0	106.5	F525	F525-T527 PolarHBondContact O-N 3Å; F525-T527 PolarHBondContact O-OG1 3Å; F525-T527 VanDerWaalsContact O-OG1 3.04Å
528	V	54.3	Low	48	Very low	26 Å²	26	100.8 Å²	100.8	16%	0.158	49%	0.491	C	S	.	.			trans	-34.3	118.8	172.1	173.2	0	0	0	0	109.2	A451 C526 R530 I536	A451-V528 HydrophobicContact CB-CG2 4.42Å; C526-V528 PolarHBondContact O-N 3.31Å; V528-R530 PolarHBondContact O-N 3.05Å; V528-I536 HydrophobicContact CB-CD1 4.29Å; V528-I536 HydrophobicContact CG1-CB 4.19Å; V528-I536 HydrophobicContact CG1-CD1 3.34Å; V528-I536 HydrophobicContact CG1-CG1 4.23Å; V528-I536 HydrophobicContact CG2-CB 4.33Å; V528-I536 HydrophobicContact CG2-CD1 3.92Å; V528-I536 HydrophobicContact CG2-CG2 3.86Å
529	P	58.1	Low	47.7	Very low	13 Å²	13	101.8 Å²	101.8	8%	0.084	50%	0.5	C	S	.	.			trans	-54	141.3	-170.4	-25.1	30.7	0	0	0	110.5	F474 V476 E487 R531 Y532 K533	F474-P529 HydrophobicContact CB-CG 4.11Å; F474-P529 HydrophobicContact CD1-CG 4.04Å; F474-P529 HydrophobicContact CG-CG 4.16Å; V476-P529 HydrophobicContact CG2-CG 4.24Å; E487-P529 HydrophobicContact CB-CB 4.28Å; E487-P529 VanDerWaalsContact CD-CB 3.44Å; E487-P529 HydrophobicContact CG-CB 4.18Å; E487-P529 VanDerWaalsContact OE2-CB 3.22Å; E487-P529 WeakPolarHBondContact OE2-CB 3.5Å; P529-R531 PolarHBondContact O-N 2.97Å; P529-Y532 HydrophobicContact CB-CD2 3.97Å; P529-Y532 HydrophobicContact CG-CD2 4.07Å; P529-Y532 WeakPolarHBondContact O-CA 3.35Å; P529-Y532 PolarHBondContact O-N 2.98Å; P529-K533 PolarHBondContact O-N 3.16Å
530	R	63.5	Low	47.9	Very low	230 Å²	230	102 Å²	102	87%	0.868	50%	0.496	S	S	*	.	H	α-helix	trans	-51.4	-34	-166.9	-75.4	-174.9	177.3	-178.7	-1	113	V528 Y532 K533	V528-R530 PolarHBondContact O-N 3.05Å; R530-Y532 VanDerWaalsContact C-N 3.26Å; R530-Y532 PolarHBondContact O-N 3.3Å; R530-K533 PolarHBondContact O-N 2.83Å
531	R	64.5	Low	48.4	Very low	117 Å²	117	96.5 Å²	96.5	44%	0.442	48%	0.482	S	S	.	.	H	α-helix	trans	-57.6	-33.9	174.9	-170	-178.4	-169.3	-174.5	6.9	114.1	T402 P529	T402-R531 VanDerWaalsContact CG2-NH2 3.31Å; T402-R531 PolarHBondContact OG1-NH2 3.48Å; P529-R531 PolarHBondContact O-N 2.97Å
532	Y	62.1	Low	48.8	Very low	4 Å²	4	93.5 Å²	93.5	2%	0.016	46%	0.461	C	S	.	.	H	α-helix	trans	-104.1	-6.2	-175.4	-55.2	-54.6	0	0	0	113.5	L400 F410 F474 E487 A489 P529 R530 K534 L535	L400-Y532 HydrophobicContact CD2-CD1 3.67Å; L400-Y532 HydrophobicContact CD2-CE1 3.43Å; L400-Y532 VanDerWaalsContact CD2-CE1 3.43Å; L400-Y532 HydrophobicContact CG-CE1 4.32Å; F410-Y532 HydrophobicContact CD1-CE1 4.32Å; F410-Y532 HydrophobicContact CE1-CD1 4.16Å; F410-Y532 AromaticContact CE1-CE1 3.89Å; F410-Y532 HydrophobicContact CE1-CE1 3.89Å; F474-Y532 AromaticContact CD1-CD2 3.49Å; F474-Y532 HydrophobicContact CD1-CD2 3.49Å; F474-Y532 VanDerWaalsContact CD1-CD2 3.49Å; F474-Y532 AromaticContact CD1-CE2 3.88Å; F474-Y532 HydrophobicContact CD1-CE2 3.88Å; F474-Y532 HydrophobicContact CD1-CG 4.26Å; F474-Y532 HydrophobicContact CE1-CD1 4.48Å; F474-Y532 AromaticContact CE1-CD2 3.3Å; F474-Y532 HydrophobicContact CE1-CD2 3.3Å; F474-Y532 AromaticContact CE1-CE2 3.94Å; F474-Y532 HydrophobicContact CE1-CE2 3.94Å; F474-Y532 AromaticContact CE1-CG 3.61Å; F474-Y532 HydrophobicContact CE1-CG 3.61Å; F474-Y532 HydrophobicContact CZ-CD2 4.48Å; F474-Y532 HydrophobicContact CZ-CG 4.5Å; E487-Y532 HydrophobicContact CB-CE2 4.01Å; E487-Y532 PolarHBondContact O-OH 3.12Å; A489-Y532 HydrophobicContact CB-CE2 4.47Å; P529-Y532 HydrophobicContact CB-CD2 3.97Å; P529-Y532 HydrophobicContact CG-CD2 4.07Å; P529-Y532 WeakPolarHBondContact O-CA 3.35Å; P529-Y532 PolarHBondContact O-N 2.98Å; R530-Y532 VanDerWaalsContact C-N 3.26Å; R530-Y532 PolarHBondContact O-N 3.3Å; Y532-K534 VanDerWaalsContact C-N 3.28Å; Y532-K534 PolarHBondContact O-N 3.49Å; Y532-L535 HydrophobicContact CD1-CD1 3.93Å; Y532-L535 WeakPolarHBondContact O-CA 3.21Å; Y532-L535 VanDerWaalsContact O-CB 3.29Å; Y532-L535 WeakPolarHBondContact O-CB 3.43Å; Y532-L535 PolarHBondContact O-N 3.45Å
533	K	62.2	Low	49.8	Very low	107 Å²	107	91.6 Å²	91.6	47%	0.465	46%	0.46	S	S	.	.	H	α-helix	trans	-56.4	-42.9	-179.2	-149.5	176.4	-175.4	-172.5	0	111.9	P529 R530 L535 I536 E537	P529-K533 PolarHBondContact O-N 3.16Å; R530-K533 PolarHBondContact O-N 2.83Å; K533-L535 PolarHBondContact O-N 2.7Å; K533-I536 PolarHBondContact O-N 2.99Å; K533-E537 PolarHBondContact O-N 3.11Å
534	K	56.7	Low	50.9	Low	174 Å²	174	92.5 Å²	92.5	76%	0.757	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-11	173.2	-65	-169.8	175.8	-170.2	0	115.8	Y532	Y532-K534 VanDerWaalsContact C-N 3.28Å; Y532-K534 PolarHBondContact O-N 3.49Å
535	L	54.2	Low	52.1	Low	24 Å²	24	89.8 Å²	89.8	13%	0.126	46%	0.456	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.8	-10.5	177.9	-60.7	178.6	0	0	0	112.5	L400 F410 I456 Y532 K533	L400-L535 HydrophobicContact CD2-CD1 3.86Å; F410-L535 HydrophobicContact CD1-CD1 4.47Å; F410-L535 HydrophobicContact CD2-CD1 3.76Å; F410-L535 HydrophobicContact CD2-CD2 3.82Å; F410-L535 HydrophobicContact CD2-CG 4.29Å; F410-L535 HydrophobicContact CE1-CD1 4.47Å; F410-L535 HydrophobicContact CE2-CD1 3.77Å; F410-L535 HydrophobicContact CE2-CD2 3.85Å; F410-L535 HydrophobicContact CE2-CG 4.07Å; F410-L535 HydrophobicContact CG-CD1 4.13Å; F410-L535 HydrophobicContact CZ-CD1 4.13Å; I456-L535 HydrophobicContact CD1-CB 3.93Å; I456-L535 HydrophobicContact CD1-CD1 4.08Å; I456-L535 HydrophobicContact CG1-CB 4.18Å; I456-L535 HydrophobicContact CG2-CB 3.8Å; I456-L535 HydrophobicContact CG2-CD1 4.3Å; I456-L535 HydrophobicContact CG2-CD2 3.85Å; I456-L535 HydrophobicContact CG2-CG 4.19Å; Y532-L535 HydrophobicContact CD1-CD1 3.93Å; Y532-L535 WeakPolarHBondContact O-CA 3.21Å; Y532-L535 VanDerWaalsContact O-CB 3.29Å; Y532-L535 WeakPolarHBondContact O-CB 3.43Å; Y532-L535 PolarHBondContact O-N 3.45Å; K533-L535 PolarHBondContact O-N 2.7Å
536	I	51.4	Low	52.9	Low	39 Å²	39	84.6 Å²	84.6	20%	0.2	44%	0.435	C	S	.	.	T	Hydrogen-bonded Turn	trans	-131	-7.7	-164.7	-62.6	167.7	0	0	0	112.1	C454 F474 V528 K533 E538	C454-I536 HydrophobicContact CB-CD1 3.86Å; C454-I536 HydrophobicContact CB-CG1 3.78Å; C454-I536 WeakPolarHBondContact SG-CD1 3.43Å; C454-I536 VanDerWaalsContact SG-CG1 3.59Å; F474-I536 HydrophobicContact CE1-CD1 4.42Å; F474-I536 HydrophobicContact CE2-CD1 3.68Å; F474-I536 HydrophobicContact CZ-CD1 3.36Å; V528-I536 HydrophobicContact CB-CD1 4.29Å; V528-I536 HydrophobicContact CG1-CB 4.19Å; V528-I536 HydrophobicContact CG1-CD1 3.34Å; V528-I536 HydrophobicContact CG1-CG1 4.23Å; V528-I536 HydrophobicContact CG2-CB 4.33Å; V528-I536 HydrophobicContact CG2-CD1 3.92Å; V528-I536 HydrophobicContact CG2-CG2 3.86Å; K533-I536 PolarHBondContact O-N 2.99Å; I536-E538 PolarHBondContact O-N 3.4Å
537	E	43.8	Very low	53.6	Low	82 Å²	82	84.1 Å²	84.1	38%	0.383	43%	0.427	S	S	.	.	S	Bend	trans	-50.7	138.6	167.7	-75.2	167.3	-154.1	0	0	111.2	K533 S541	K533-E537 PolarHBondContact O-N 3.11Å; E537-S541 WeakPolarHBondContact CB-OG 3.42Å; E537-S541 WeakPolarHBondContact OE2-CB 3.45Å; E537-S541 PolarHBondContact OE2-OG 3.26Å
538	E	42.9	Very low	54.1	Low	145 Å²	145	81.9 Å²	81.9	68%	0.678	42%	0.419	S	S	*	.			trans	-57.3	157.6	-177.9	-69.9	-177.1	160	0	0	111.7	I536 S540 S541	I536-E538 PolarHBondContact O-N 3.4Å; E538-S540 PolarHBondContact O-N 3.03Å; E538-S541 PolarHBondContact O-N 3.15Å
539	P	45.7	Very low	54	Low	59 Å²	59	85.6 Å²	85.6	38%	0.383	44%	0.437	S	S	.	.	G	3₁₀ helix	trans	-57.2	-13.2	-176	19.4	-32.1	0	0	0	115.4	S541 Y542 M547	P539-S541 VanDerWaalsContact C-N 3.32Å; P539-S541 PolarHBondContact O-N 3.5Å; P539-Y542 HydrophobicContact CB-CD2 3.99Å; P539-Y542 HydrophobicContact CB-CE2 4.14Å; P539-Y542 PolarHBondContact O-N 3.35Å; P539-M547 HydrophobicContact CB-SD 3.77Å
540	S	43.3	Very low	53.8	Low	105 Å²	105	88.3 Å²	88.3	73%	0.734	45%	0.446	S	S	*	.	G	3₁₀ helix	trans	-64.4	-22.5	171.7	49.7	0	0	0	0	115.3	E538	E538-S540 PolarHBondContact O-N 3.03Å
541	S	45.1	Very low	53.6	Low	59 Å²	59	81.7 Å²	81.7	41%	0.413	43%	0.425	S	S	.	.	G	3₁₀ helix	trans	-99.3	-3.8	177.1	87	0	0	0	0	114.7	E537 E538 P539 T543	E537-S541 WeakPolarHBondContact CB-OG 3.42Å; E537-S541 WeakPolarHBondContact OE2-CB 3.45Å; E537-S541 PolarHBondContact OE2-OG 3.26Å; E538-S541 PolarHBondContact O-N 3.15Å; P539-S541 VanDerWaalsContact C-N 3.32Å; P539-S541 PolarHBondContact O-N 3.5Å; S541-T543 PolarHBondContact O-N 3.27Å
542	Y	48.3	Very low	53.4	Low	34 Å²	34	85.1 Å²	85.1	13%	0.133	44%	0.438	C	S	.	.	S	Bend	trans	-68.8	132.5	179.2	-75.5	-32.1	0	0	0	112.1	P539 Q546 M547 Y550	P539-Y542 HydrophobicContact CB-CD2 3.99Å; P539-Y542 HydrophobicContact CB-CE2 4.14Å; P539-Y542 PolarHBondContact O-N 3.35Å; Y542-Q546 HydrophobicContact CD1-CB 3.99Å; Y542-Q546 HydrophobicContact CG-CB 3.91Å; Y542-M547 HydrophobicContact CD2-SD 4Å; Y542-Y550 HydrophobicContact CE2-CD2 4.42Å
543	T	58.7	Low	52.8	Low	90 Å²	90	87.5 Å²	87.5	55%	0.552	45%	0.448	S	S	*	.			trans	-56.7	153.6	166	60	0	0	0	0	110.4	S541 G545 Q546 M547	S541-T543 PolarHBondContact O-N 3.27Å; T543-G545 PolarHBondContact O-N 3.28Å; T543-G545 VanDerWaalsContact O-N 3.08Å; T543-Q546 CarbonylContact O-C 3.57Å; T543-Q546 WeakPolarHBondContact O-CA 3.36Å; T543-Q546 WeakPolarHBondContact O-CB 3.33Å; T543-Q546 PolarHBondContact O-N 2.92Å; T543-Q546 WeakPolarHBondContact OG1-CG 3.37Å; T543-Q546 PolarHBondContact OG1-OE1 3.38Å; T543-M547 PolarHBondContact O-N 3.23Å
544	E	56.4	Low	52.4	Low	176 Å²	176	84.8 Å²	84.8	82%	0.822	44%	0.438	S	S	*	.	H	α-helix	trans	-52.8	-38	-174.4	-161.8	174.2	-147.3	0	0	113.2	M547 A548	E544-M547 PolarHBondContact O-N 2.86Å; E544-A548 WeakPolarHBondContact O-CB 3.4Å; E544-A548 PolarHBondContact O-N 2.8Å
545	G	58.3	Low	52.6	Low	49 Å²	49	85.1 Å²	85.1	51%	0.505	43%	0.434	S	S	.	.	H	α-helix	trans	-69.3	-30.7	173.5	0	0	0	0	0	115	T543 L549	T543-G545 PolarHBondContact O-N 3.28Å; T543-G545 VanDerWaalsContact O-N 3.08Å; G545-L549 PolarHBondContact O-N 3.08Å
546	Q	51.2	Low	52.7	Low	84 Å²	84	90.6 Å²	90.6	39%	0.393	46%	0.457	S	S	.	.	H	α-helix	trans	-72.9	-40.4	171.1	-71.8	168.4	-62.7	0	0	111	Y542 T543 A548 L549 Y550	Y542-Q546 HydrophobicContact CD1-CB 3.99Å; Y542-Q546 HydrophobicContact CG-CB 3.91Å; T543-Q546 CarbonylContact O-C 3.57Å; T543-Q546 WeakPolarHBondContact O-CA 3.36Å; T543-Q546 WeakPolarHBondContact O-CB 3.33Å; T543-Q546 PolarHBondContact O-N 2.92Å; T543-Q546 WeakPolarHBondContact OG1-CG 3.37Å; T543-Q546 PolarHBondContact OG1-OE1 3.38Å; Q546-A548 PolarHBondContact O-N 3.23Å; Q546-L549 WeakPolarHBondContact O-CB 3.45Å; Q546-L549 PolarHBondContact O-N 3.35Å; Q546-Y550 PolarHBondContact O-N 2.87Å
547	M	56.4	Low	52.6	Low	48 Å²	48	92.4 Å²	92.4	24%	0.236	46%	0.464	C	S	.	.	H	α-helix	trans	-60.5	-43.2	172.8	-88.7	-54.5	-66.1	0	0	112.3	P539 Y542 T543 E544 L549 Y550 Q551	P539-M547 HydrophobicContact CB-SD 3.77Å; Y542-M547 HydrophobicContact CD2-SD 4Å; T543-M547 PolarHBondContact O-N 3.23Å; E544-M547 PolarHBondContact O-N 2.86Å; M547-L549 VanDerWaalsContact C-N 3.28Å; M547-L549 PolarHBondContact O-N 3.19Å; M547-Y550 PolarHBondContact O-N 3.07Å; M547-Q551 HydrophobicContact CE-CG 4.22Å; M547-Q551 WeakPolarHBondContact O-CB 3.45Å; M547-Q551 WeakPolarHBondContact O-CG 3.38Å; M547-Q551 PolarHBondContact O-N 2.92Å
548	A	59.3	Low	53.1	Low	54 Å²	54	92 Å²	92	45%	0.446	47%	0.465	S	S	.	.	H	α-helix	trans	-61	-35.5	175.4	0	0	0	0	0	112.7	E544 Q546 R552	E544-A548 WeakPolarHBondContact O-CB 3.4Å; E544-A548 PolarHBondContact O-N 2.8Å; Q546-A548 PolarHBondContact O-N 3.23Å; A548-R552 WeakPolarHBondContact O-CB 3.48Å; A548-R552 PolarHBondContact O-N 2.92Å
549	L	52.9	Low	54.1	Low	104 Å²	104	94 Å²	94	55%	0.545	47%	0.466	S	S	.	.	H	α-helix	trans	-69.5	-44.5	173.4	-85.3	166	0	0	0	112.3	G545 Q546 M547 R552 Y553	G545-L549 PolarHBondContact O-N 3.08Å; Q546-L549 WeakPolarHBondContact O-CB 3.45Å; Q546-L549 PolarHBondContact O-N 3.35Å; M547-L549 VanDerWaalsContact C-N 3.28Å; M547-L549 PolarHBondContact O-N 3.19Å; L549-R552 PolarHBondContact O-N 3.49Å; L549-Y553 PolarHBondContact O-N 2.78Å
550	Y	53	Low	54.6	Low	71 Å²	71	98 Å²	98	28%	0.278	48%	0.477	S	S	.	.	H	α-helix	trans	-59.1	-50.9	175.8	179	-94.7	0	0	0	111.2	Y542 Q546 M547 R552 Y553 D554	Y542-Y550 HydrophobicContact CE2-CD2 4.42Å; Q546-Y550 PolarHBondContact O-N 2.87Å; M547-Y550 PolarHBondContact O-N 3.07Å; Y550-R552 VanDerWaalsContact C-N 3.33Å; Y550-R552 PolarHBondContact O-N 2.96Å; Y550-Y553 WeakPolarHBondContact O-CB 3.41Å; Y550-Y553 PolarHBondContact O-N 3.46Å; Y550-Y553 VanDerWaalsContact O-N 3.07Å; Y550-D554 PolarHBondContact O-N 3.36Å
551	Q	58.5	Low	55	Low	90 Å²	90	96.3 Å²	96.3	42%	0.421	46%	0.46	S	S	.	.	H	α-helix	trans	-61.2	-37.7	176.8	-69.1	-179.8	8.4	0	0	112.7	M547 Y553 D554 R555	M547-Q551 HydrophobicContact CE-CG 4.22Å; M547-Q551 WeakPolarHBondContact O-CB 3.45Å; M547-Q551 WeakPolarHBondContact O-CG 3.38Å; M547-Q551 PolarHBondContact O-N 2.92Å; Q551-Y553 VanDerWaalsContact C-N 3.34Å; Q551-D554 PolarHBondContact O-N 2.91Å; Q551-R555 WeakPolarHBondContact O-CB 3.47Å; Q551-R555 VanDerWaalsContact O-CG 3.27Å; Q551-R555 WeakPolarHBondContact O-CG 3.48Å; Q551-R555 PolarHBondContact O-N 2.86Å
552	R	60.1	Low	55.8	Low	189 Å²	189	99.4 Å²	99.4	71%	0.713	47%	0.471	S	S	*	.	H	α-helix	trans	-64.6	-37.6	173.4	-103.4	-177.7	170.6	173.7	-0.2	112.5	A548 L549 Y550 K556	A548-R552 WeakPolarHBondContact O-CB 3.48Å; A548-R552 PolarHBondContact O-N 2.92Å; L549-R552 PolarHBondContact O-N 3.49Å; Y550-R552 VanDerWaalsContact C-N 3.33Å; Y550-R552 PolarHBondContact O-N 2.96Å; R552-K556 WeakPolarHBondContact O-CG 3.36Å; R552-K556 PolarHBondContact O-N 3.32Å
553	Y	51	Low	56.6	Low	55 Å²	55	102.2 Å²	102.2	22%	0.216	49%	0.488	C	S	.	.	H	α-helix	trans	-67.4	-49	174.2	175.4	-90.8	0	0	0	110.7	F455 L549 Y550 Q551 R555 K556 K557	F455-Y553 AromaticContact CE1-CD1 3.7Å; F455-Y553 HydrophobicContact CE1-CD1 3.7Å; F455-Y553 HydrophobicContact CE1-CD2 4.41Å; F455-Y553 AromaticContact CE1-CE1 3.81Å; F455-Y553 HydrophobicContact CE1-CE1 3.81Å; F455-Y553 HydrophobicContact CE1-CE2 4.49Å; F455-Y553 HydrophobicContact CE1-CG 4.04Å; F455-Y553 HydrophobicContact CE2-CD1 4.18Å; F455-Y553 AromaticContact CE2-CE1 3.51Å; F455-Y553 HydrophobicContact CE2-CE1 3.51Å; F455-Y553 AromaticContact CE2-CZ 3.91Å; F455-Y553 AromaticContact CZ-CD1 3.49Å; F455-Y553 HydrophobicContact CZ-CD1 3.49Å; F455-Y553 VanDerWaalsContact CZ-CD1 3.49Å; F455-Y553 HydrophobicContact CZ-CD2 4.23Å; F455-Y553 AromaticContact CZ-CE1 3.07Å; F455-Y553 HydrophobicContact CZ-CE1 3.07Å; F455-Y553 AromaticContact CZ-CE2 3.88Å; F455-Y553 HydrophobicContact CZ-CE2 3.88Å; F455-Y553 HydrophobicContact CZ-CG 4.06Å; F455-Y553 AromaticContact CZ-CZ 3.3Å; L549-Y553 PolarHBondContact O-N 2.78Å; Y550-Y553 WeakPolarHBondContact O-CB 3.41Å; Y550-Y553 PolarHBondContact O-N 3.46Å; Y550-Y553 VanDerWaalsContact O-N 3.07Å; Q551-Y553 VanDerWaalsContact C-N 3.34Å; Y553-R555 PolarHBondContact O-N 2.93Å; Y553-K556 CarbonylContact O-C 3.39Å; Y553-K556 WeakPolarHBondContact O-CA 3.49Å; Y553-K556 WeakPolarHBondContact O-CB 3.45Å; Y553-K556 PolarHBondContact O-N 3.39Å; Y553-K557 HydrophobicContact CD1-CB 4.41Å; Y553-K557 HydrophobicContact CE1-CB 3.81Å; Y553-K557 HydrophobicContact CE1-CD 4Å; Y553-K557 HydrophobicContact CE1-CG 4.3Å; Y553-K557 PolarHBondContact O-N 3.48Å
554	D	53.3	Low	56.8	Low	50 Å²	50	100.8 Å²	100.8	27%	0.267	48%	0.48	S	S	.	.	H	α-helix	trans	-64.4	-39.1	-175.6	-167.3	53	0	0	0	112.2	Y550 Q551 K556 K557 N558	Y550-D554 PolarHBondContact O-N 3.36Å; Q551-D554 PolarHBondContact O-N 2.91Å; D554-K556 VanDerWaalsContact C-N 3.3Å; D554-K556 PolarHBondContact O-N 3.24Å; D554-K557 PolarHBondContact O-N 2.81Å; D554-N558 WeakPolarHBondContact O-CB 3.46Å; D554-N558 PolarHBondContact O-N 2.8Å; D554-N558 PolarHBondContact O-ND2 3.48Å; D554-N558 PolarHBondContact OD2-ND2 2.92Å
555	R	60.6	Low	57.1	Low	180 Å²	180	94.7 Å²	94.7	68%	0.679	46%	0.459	S	S	*	.	H	α-helix	trans	-59.3	-37.4	168.8	-69.7	178.1	-162.1	-171.1	8.7	112.8	Q551 Y553 R559	Q551-R555 WeakPolarHBondContact O-CB 3.47Å; Q551-R555 VanDerWaalsContact O-CG 3.27Å; Q551-R555 WeakPolarHBondContact O-CG 3.48Å; Q551-R555 PolarHBondContact O-N 2.86Å; Y553-R555 PolarHBondContact O-N 2.93Å; R555-R559 WeakPolarHBondContact O-CB 3.36Å; R555-R559 PolarHBondContact O-N 3.24Å
556	K	56.8	Low	57.5	Low	140 Å²	140	95.2 Å²	95.2	61%	0.609	46%	0.455	S	S	*	.	H	α-helix	trans	-71.6	-40.8	174.9	-81.2	-172.9	176	-170.7	0	112.2	R552 Y553 D554 R559 F560	R552-K556 WeakPolarHBondContact O-CG 3.36Å; R552-K556 PolarHBondContact O-N 3.32Å; Y553-K556 CarbonylContact O-C 3.39Å; Y553-K556 WeakPolarHBondContact O-CA 3.49Å; Y553-K556 WeakPolarHBondContact O-CB 3.45Å; Y553-K556 PolarHBondContact O-N 3.39Å; D554-K556 VanDerWaalsContact C-N 3.3Å; D554-K556 PolarHBondContact O-N 3.24Å; K556-R559 PolarHBondContact O-N 3.45Å; K556-F560 WeakPolarHBondContact O-CB 3.39Å; K556-F560 PolarHBondContact O-N 2.9Å
557	K	49.1	Very low	58.4	Low	76 Å²	76	98.7 Å²	98.7	33%	0.33	47%	0.469	S	S	.	.	H	α-helix	trans	-60.5	-55.2	176.4	178.2	-167.7	161.3	-152.1	0	110.1	Y553 D554 R559 F560 D561	Y553-K557 HydrophobicContact CD1-CB 4.41Å; Y553-K557 HydrophobicContact CE1-CB 3.81Å; Y553-K557 HydrophobicContact CE1-CD 4Å; Y553-K557 HydrophobicContact CE1-CG 4.3Å; Y553-K557 PolarHBondContact O-N 3.48Å; D554-K557 PolarHBondContact O-N 2.81Å; K557-R559 VanDerWaalsContact C-N 3.25Å; K557-R559 PolarHBondContact O-N 2.85Å; K557-F560 CarbonylContact O-C 3.59Å; K557-F560 WeakPolarHBondContact O-CA 3.27Å; K557-F560 WeakPolarHBondContact O-CB 3.39Å; K557-F560 PolarHBondContact O-N 3.21Å; K557-D561 WeakPolarHBondContact CE-OD2 3.17Å; K557-D561 WeakPolarHBondContact CG-OD2 3.23Å; K557-D561 PolarHBondContact O-N 3.09Å
558	N	54.3	Low	58.8	Low	75 Å²	75	102.6 Å²	102.6	40%	0.401	49%	0.487	S	S	.	.	H	α-helix	trans	-56.4	-40	177.1	-71	-34.6	0	0	0	111.6	D554 F560 L562	D554-N558 WeakPolarHBondContact O-CB 3.46Å; D554-N558 PolarHBondContact O-N 2.8Å; D554-N558 PolarHBondContact O-ND2 3.48Å; D554-N558 PolarHBondContact OD2-ND2 2.92Å; N558-F560 PolarHBondContact O-N 2.92Å; N558-L562 VanDerWaalsContact O-CB 3.23Å; N558-L562 WeakPolarHBondContact O-CB 3.23Å; N558-L562 WeakPolarHBondContact O-CD1 3.48Å; N558-L562 WeakPolarHBondContact O-CG 3.41Å; N558-L562 PolarHBondContact O-N 3.01Å
559	R	63.6	Low	59.3	Low	186 Å²	186	104.4 Å²	104.4	70%	0.702	49%	0.492	S	S	*	.	H	α-helix	trans	-64.5	-36.4	173.5	-168.4	176.3	-175	-178.8	2.4	113.2	R555 K556 K557 L563	R555-R559 WeakPolarHBondContact O-CB 3.36Å; R555-R559 PolarHBondContact O-N 3.24Å; K556-R559 PolarHBondContact O-N 3.45Å; K557-R559 VanDerWaalsContact C-N 3.25Å; K557-R559 PolarHBondContact O-N 2.85Å; R559-L563 HydrophobicContact CG-CD1 4.33Å; R559-L563 WeakPolarHBondContact O-CB 3.44Å; R559-L563 WeakPolarHBondContact O-CD1 3.47Å; R559-L563 VanDerWaalsContact O-CG 3.26Å; R559-L563 WeakPolarHBondContact O-CG 3.39Å; R559-L563 PolarHBondContact O-N 2.98Å
560	F	55.2	Low	60.1	Low	143 Å²	143	103.5 Å²	103.5	63%	0.627	49%	0.487	S	S	*	.	H	α-helix	trans	-75.9	-39.3	179	-159.2	-84.1	0	0	0	112.5	K556 K557 N558 L563 T564	K556-F560 WeakPolarHBondContact O-CB 3.39Å; K556-F560 PolarHBondContact O-N 2.9Å; K557-F560 CarbonylContact O-C 3.59Å; K557-F560 WeakPolarHBondContact O-CA 3.27Å; K557-F560 WeakPolarHBondContact O-CB 3.39Å; K557-F560 PolarHBondContact O-N 3.21Å; N558-F560 PolarHBondContact O-N 2.92Å; F560-L563 PolarHBondContact O-N 3.31Å; F560-T564 WeakPolarHBondContact O-CB 3.44Å; F560-T564 PolarHBondContact O-N 3.14Å; F560-T564 PolarHBondContact O-OG1 3.05Å
561	D	53.1	Low	60.7	Low	69 Å²	69	102.6 Å²	102.6	37%	0.369	49%	0.491	S	S	.	.	H	α-helix	trans	-66.7	-42	175	-67.4	-21.6	0	0	0	109.9	K557 L563 T564 A565	K557-D561 WeakPolarHBondContact CE-OD2 3.17Å; K557-D561 WeakPolarHBondContact CG-OD2 3.23Å; K557-D561 PolarHBondContact O-N 3.09Å; D561-L563 PolarHBondContact O-N 3.39Å; D561-T564 PolarHBondContact O-N 3.18Å; D561-A565 WeakPolarHBondContact O-CB 3.39Å; D561-A565 PolarHBondContact O-N 2.9Å
562	L	62.4	Low	61.1	Low	125 Å²	125	101.3 Å²	101.3	65%	0.654	49%	0.49	S	S	*	.	H	α-helix	trans	-60.8	-41.3	170.5	-76.5	166.6	0	0	0	113	N558 T564 S566	N558-L562 VanDerWaalsContact O-CB 3.23Å; N558-L562 WeakPolarHBondContact O-CB 3.23Å; N558-L562 WeakPolarHBondContact O-CD1 3.48Å; N558-L562 WeakPolarHBondContact O-CG 3.41Å; N558-L562 PolarHBondContact O-N 3.01Å; L562-T564 VanDerWaalsContact C-N 3.34Å; L562-S566 VanDerWaalsContact O-CB 3.23Å; L562-S566 WeakPolarHBondContact O-CB 3.38Å; L562-S566 PolarHBondContact O-N 3.17Å
563	L	63.8	Low	61.4	Low	92 Å²	92	100.3 Å²	100.3	48%	0.482	49%	0.486	S	S	.	.	H	α-helix	trans	-65.8	-36.8	175.2	-82.3	164.1	0	0	0	112.2	R559 F560 D561 K567	R559-L563 HydrophobicContact CG-CD1 4.33Å; R559-L563 WeakPolarHBondContact O-CB 3.44Å; R559-L563 WeakPolarHBondContact O-CD1 3.47Å; R559-L563 VanDerWaalsContact O-CG 3.26Å; R559-L563 WeakPolarHBondContact O-CG 3.39Å; R559-L563 PolarHBondContact O-N 2.98Å; F560-L563 PolarHBondContact O-N 3.31Å; D561-L563 PolarHBondContact O-N 3.39Å; L563-K567 WeakPolarHBondContact O-CG 3.36Å; L563-K567 PolarHBondContact O-N 2.89Å; L563-K567 VanDerWaalsContact O-N 3.08Å
564	T	63.2	Low	62.1	Low	61 Å²	61	106.8 Å²	106.8	37%	0.374	51%	0.51	S	S	.	.	H	α-helix	trans	-69.6	-47.4	177.1	-54.9	0	0	0	0	110.9	F560 D561 L562 S566 K567 Q568	F560-T564 WeakPolarHBondContact O-CB 3.44Å; F560-T564 PolarHBondContact O-N 3.14Å; F560-T564 PolarHBondContact O-OG1 3.05Å; D561-T564 PolarHBondContact O-N 3.18Å; L562-T564 VanDerWaalsContact C-N 3.34Å; T564-S566 PolarHBondContact O-N 2.92Å; T564-K567 WeakPolarHBondContact O-CB 3.4Å; T564-K567 PolarHBondContact O-N 3.31Å; T564-K567 VanDerWaalsContact O-N 3.16Å; T564-Q568 PolarHBondContact O-N 2.79Å
565	A	63.6	Low	62.6	Low	47 Å²	47	110.2 Å²	110.2	39%	0.388	53%	0.525	S	S	.	.	H	α-helix	trans	-59.7	-44.3	174.9	0	0	0	0	0	111.9	D561 K567 Q568 V569	D561-A565 WeakPolarHBondContact O-CB 3.39Å; D561-A565 PolarHBondContact O-N 2.9Å; A565-K567 VanDerWaalsContact C-N 3.32Å; A565-K567 PolarHBondContact O-N 3.06Å; A565-Q568 PolarHBondContact O-N 3.28Å; A565-V569 WeakPolarHBondContact O-CG2 3.23Å; A565-V569 PolarHBondContact O-N 3.01Å
566	S	66.9	Low	62.8	Low	61 Å²	61	110.6 Å²	110.6	43%	0.427	53%	0.526	S	S	.	.	H	α-helix	trans	-59.8	-39.7	175	-179.9	0	0	0	0	112.3	L562 T564 N570	L562-S566 VanDerWaalsContact O-CB 3.23Å; L562-S566 WeakPolarHBondContact O-CB 3.38Å; L562-S566 PolarHBondContact O-N 3.17Å; T564-S566 PolarHBondContact O-N 2.92Å; S566-N570 WeakPolarHBondContact O-CB 3.26Å; S566-N570 PolarHBondContact O-N 3.47Å; S566-N570 PolarHBondContact O-ND2 3.37Å
567	K	69.8	Low	63.4	Low	157 Å²	157	109 Å²	109	68%	0.683	52%	0.524	S	S	*	.	H	α-helix	trans	-65.1	-41.6	173.9	-76.5	176.9	177.6	-176.2	0	112.6	L563 T564 A565 N570 S571	L563-K567 WeakPolarHBondContact O-CG 3.36Å; L563-K567 PolarHBondContact O-N 2.89Å; L563-K567 VanDerWaalsContact O-N 3.08Å; T564-K567 WeakPolarHBondContact O-CB 3.4Å; T564-K567 PolarHBondContact O-N 3.31Å; T564-K567 VanDerWaalsContact O-N 3.16Å; A565-K567 VanDerWaalsContact C-N 3.32Å; A565-K567 PolarHBondContact O-N 3.06Å; K567-N570 PolarHBondContact O-N 3.33Å; K567-S571 PolarHBondContact O-N 3.04Å
568	Q	63.7	Low	64.1	Low	130 Å²	130	112.3 Å²	112.3	61%	0.607	55%	0.545	S	S	*	.	H	α-helix	trans	-65.3	-41.8	176.2	-101.1	173.5	-41.8	0	0	113	T564 A565 N570 S571 T572	T564-Q568 PolarHBondContact O-N 2.79Å; A565-Q568 PolarHBondContact O-N 3.28Å; Q568-N570 VanDerWaalsContact C-N 3.31Å; Q568-N570 PolarHBondContact O-N 3Å; Q568-S571 PolarHBondContact O-N 3.16Å; Q568-S571 PolarHBondContact O-OG 3.08Å; Q568-T572 PolarHBondContact O-N 3Å; Q568-T572 PolarHBondContact O-OG1 3.37Å
569	V	71.3	Confident	64.2	Low	91 Å²	91	117.3 Å²	117.3	55%	0.552	57%	0.565	S	S	*	*	H	α-helix	trans	-63.9	-38.2	174.2	173.5	0	0	0	0	110.9	A565 T572 R573	A565-V569 WeakPolarHBondContact O-CG2 3.23Å; A565-V569 PolarHBondContact O-N 3.01Å; V569-T572 WeakPolarHBondContact CA-OG1 3.49Å; V569-T572 PolarHBondContact O-OG1 2.89Å; V569-R573 VanDerWaalsContact O-CB 3.23Å; V569-R573 WeakPolarHBondContact O-CB 3.37Å; V569-R573 PolarHBondContact O-N 2.85Å
570	N	69.5	Low	63.8	Low	85 Å²	85	119.5 Å²	119.5	46%	0.455	58%	0.58	S	S	.	*	H	α-helix	trans	-72.9	-32.1	176.6	-75.7	-50.5	0	0	0	113.7	S566 K567 Q568 R574	S566-N570 WeakPolarHBondContact O-CB 3.26Å; S566-N570 PolarHBondContact O-N 3.47Å; S566-N570 PolarHBondContact O-ND2 3.37Å; K567-N570 PolarHBondContact O-N 3.33Å; Q568-N570 VanDerWaalsContact C-N 3.31Å; Q568-N570 PolarHBondContact O-N 3Å; N570-R574 WeakPolarHBondContact O-CG 3.36Å; N570-R574 PolarHBondContact O-N 3.07Å
571	S	64.5	Low	64.3	Low	52 Å²	52	118.4 Å²	118.4	36%	0.364	58%	0.578	S	S	.	*	H	α-helix	trans	-70.1	-48.8	173.7	76.7	0	0	0	0	111.1	K567 Q568 R573 R574 E575	K567-S571 PolarHBondContact O-N 3.04Å; Q568-S571 PolarHBondContact O-N 3.16Å; Q568-S571 PolarHBondContact O-OG 3.08Å; S571-R573 VanDerWaalsContact C-N 3.28Å; S571-R573 PolarHBondContact O-N 3.01Å; S571-R574 CarbonylContact O-C 3.54Å; S571-R574 WeakPolarHBondContact O-CA 3.4Å; S571-R574 WeakPolarHBondContact O-CB 3.46Å; S571-R574 PolarHBondContact O-N 2.87Å; S571-E575 WeakPolarHBondContact O-CG 3.49Å; S571-E575 PolarHBondContact O-N 3.02Å
572	T	66.7	Low	64.8	Low	64 Å²	64	120.9 Å²	120.9	39%	0.393	59%	0.589	S	S	.	*	H	α-helix	trans	-62.8	-32.2	177	49.3	0	0	0	0	113	Q568 V569 R576	Q568-T572 PolarHBondContact O-N 3Å; Q568-T572 PolarHBondContact O-OG1 3.37Å; V569-T572 WeakPolarHBondContact CA-OG1 3.49Å; V569-T572 PolarHBondContact O-OG1 2.89Å; T572-R576 WeakPolarHBondContact O-CG 3.47Å; T572-R576 PolarHBondContact O-N 3.16Å
573	R	67.2	Low	65	Low	167 Å²	167	120.7 Å²	120.7	63%	0.63	59%	0.585	S	S	*	*	H	α-helix	trans	-70.3	-35.9	171	-168.5	175	-175	178.5	1.9	112.6	V569 S571 N577	V569-R573 VanDerWaalsContact O-CB 3.23Å; V569-R573 WeakPolarHBondContact O-CB 3.37Å; V569-R573 PolarHBondContact O-N 2.85Å; S571-R573 VanDerWaalsContact C-N 3.28Å; S571-R573 PolarHBondContact O-N 3.01Å; R573-N577 WeakPolarHBondContact O-CB 3.45Å; R573-N577 PolarHBondContact O-N 3.14Å; R573-N577 VanDerWaalsContact O-N 3.14Å
574	R	64.9	Low	65	Low	192 Å²	192	122.4 Å²	122.4	73%	0.725	59%	0.591	S	S	*	*	H	α-helix	trans	-66	-43.9	172.2	-83.9	-179.6	169.4	178.9	-3.9	111.9	N570 S571 N577 L578	N570-R574 WeakPolarHBondContact O-CG 3.36Å; N570-R574 PolarHBondContact O-N 3.07Å; S571-R574 CarbonylContact O-C 3.54Å; S571-R574 WeakPolarHBondContact O-CA 3.4Å; S571-R574 WeakPolarHBondContact O-CB 3.46Å; S571-R574 PolarHBondContact O-N 2.87Å; R574-N577 CarbonylContact O-C 3.56Å; R574-N577 PolarHBondContact O-N 3.31Å; R574-N577 VanDerWaalsContact O-N 3.17Å; R574-L578 PolarHBondContact O-N 3.06Å
575	E	65	Low	65.2	Low	121 Å²	121	126.3 Å²	126.3	57%	0.565	61%	0.605	S	S	*	*	H	α-helix	trans	-60.6	-46.1	176.3	-72.3	164.8	176.1	0	0	111.5	S571 N577 L578 H579	S571-E575 WeakPolarHBondContact O-CG 3.49Å; S571-E575 PolarHBondContact O-N 3.02Å; E575-N577 VanDerWaalsContact C-N 3.27Å; E575-N577 PolarHBondContact O-N 3.17Å; E575-L578 PolarHBondContact O-N 3.14Å; E575-H579 PolarHBondContact O-N 3.01Å; E575-H579 VanDerWaalsContact O-N 3.14Å
576	R	64.6	Low	65.3	Low	189 Å²	189	131.5 Å²	131.5	71%	0.713	62%	0.619	S	S	*	*	H	α-helix	trans	-62.7	-29.7	174.6	-73.9	-179.5	-173.8	180	3.4	114.1	T572	T572-R576 WeakPolarHBondContact O-CG 3.47Å; T572-R576 PolarHBondContact O-N 3.16Å
577	N	68.9	Low	65.1	Low	106 Å²	106	136.6 Å²	136.6	57%	0.567	63%	0.633	S	S	*	*	H	α-helix	trans	-84.4	-8.6	175.5	-75.8	6.4	0	0	0	113.5	R573 R574 E575	R573-N577 WeakPolarHBondContact O-CB 3.45Å; R573-N577 PolarHBondContact O-N 3.14Å; R573-N577 VanDerWaalsContact O-N 3.14Å; R574-N577 CarbonylContact O-C 3.56Å; R574-N577 PolarHBondContact O-N 3.31Å; R574-N577 VanDerWaalsContact O-N 3.17Å; E575-N577 VanDerWaalsContact C-N 3.27Å; E575-N577 PolarHBondContact O-N 3.17Å
578	L	64.6	Low	64.8	Low	145 Å²	145	135 Å²	135	76%	0.759	63%	0.629	S	S	*	*	H	α-helix	trans	-96.5	-8.7	169.6	-78.4	161.1	0	0	0	112.2	R574 E575	R574-L578 PolarHBondContact O-N 3.06Å; E575-L578 PolarHBondContact O-N 3.14Å
579	H	55.6	Low	64.9	Low	181 Å²	181	135.4 Å²	135.4	84%	0.838	63%	0.631	S	S	*	*			trans	-106.7	3.6	177.4	-126.9	44.3	0	0	0	113	E575	E575-H579 PolarHBondContact O-N 3.01Å; E575-H579 VanDerWaalsContact O-N 3.14Å
580	K	55.8	Low	64.3	Low	232 Å²	232	139.5 Å²	139.5	100%	1.009	64%	0.638	S	S	*	*			trans	-115	0	168.2	-75.7	-172.4	172.4	-165.5	0	108.4

Retrieved 580 of 580 residues in 205 ms (Link to these results)

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