A0A077ZQY0_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZQY0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 543 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	34.8	Very low	31.9	Very low	249 Å²	249	180.2 Å²	180.2	100%	1.227	85%	0.854	S	S	*	*				0	144.1	0	-75	-178.4	180	0	0	108.9
2	A	35.7	Very low	31.5	Very low	99 Å²	99	180.2 Å²	180.2	82%	0.818	85%	0.853	S	S	*	*			trans	66.3	86	-177.9	0	0	0	0	0	116.5
3	R	32.5	Very low	31.3	Very low	250 Å²	250	180.2 Å²	180.2	94%	0.943	86%	0.856	S	S	*	*				90.5	116	69.7	-84.5	-173.9	173.1	179.6	-1.4	114.5
4	R	32	Very low	30.8	Very low	243 Å²	243	172 Å²	172	92%	0.917	84%	0.843	S	S	*	*			trans	-35.2	144.7	165.4	-67.8	173.5	171.9	177.1	-3.3	114.7
5	R	32.8	Very low	30.6	Very low	245 Å²	245	173.2 Å²	173.2	93%	0.925	84%	0.842	S	S	*	*			trans	-140.4	113.6	130.4	-76.2	-162.5	177.6	-177.9	-1.1	112.6
6	K	27	Very low	30.4	Very low	187 Å²	187	169.7 Å²	169.7	81%	0.813	83%	0.834	S	S	*	*			trans	-59.1	129.4	153.7	-164.4	-178.8	-172.3	-174.1	0	107.5	V8	K6-V8 HydrophobicContact CG-CG2 4.44Å
7	V	31.5	Very low	30.2	Very low	134 Å²	134	168.1 Å²	168.1	81%	0.812	82%	0.821	S	S	*	*			trans	-119.1	95.7	163.7	-179.8	0	0	0	0	106.4
8	V	32.5	Very low	30	Very low	101 Å²	101	165.3 Å²	165.3	61%	0.612	82%	0.816	S	S	*	*			trans	-83.9	134.9	148.1	174.8	0	0	0	0	104.6	K6	K6-V8 HydrophobicContact CG-CG2 4.44Å
9	D	29.7	Very low	30.1	Very low	135 Å²	135	166.2 Å²	166.2	72%	0.722	82%	0.815	S	S	*	*			trans	178.9	117.1	143.4	-90.6	-12.8	0	0	0	111.7
10	D	29.4	Very low	30	Very low	133 Å²	133	163.7 Å²	163.7	71%	0.711	81%	0.809	S	S	*	*			trans	45.5	88.6	132.6	-65.5	-16	0	0	0	119.7
11	K	33	Very low	30.1	Very low	206 Å²	206	164.9 Å²	164.9	90%	0.896	81%	0.81	S	S	*	*			trans	-132.7	84	134.4	-79.6	-167.4	178.9	174.2	0	111	M13	K11-M13 PolarHBondContact O-N 3.19Å
12	Q	27.3	Very low	30	Very low	180 Å²	180	161.8 Å²	161.8	84%	0.841	79%	0.79	S	S	*	*			trans	-48.6	126.9	146.4	-67.1	177.4	-11.6	0	0	109
13	M	29	Very low	29.9	Very low	181 Å²	181	163.9 Å²	163.9	89%	0.892	79%	0.787	S	S	*	*			trans	-114	92.3	149.1	-90.3	-147.2	-72.6	0	0	107	K11	K11-M13 PolarHBondContact O-N 3.19Å
14	G	24.8	Very low	30	Very low	65 Å²	65	160 Å²	160	67%	0.67	79%	0.785	S	S	*	*			trans	-61.3	130.5	172.4	0	0	0	0	0	110.9
15	F	26.6	Very low	30.2	Very low	190 Å²	190	152.1 Å²	152.1	83%	0.833	77%	0.772	S	S	*	*			trans	-99.9	95.3	148.6	-92	-90.3	0	0	0	106.7	F17	F15-F17 PolarHBondContact O-N 3.49Å
16	V	27.7	Very low	30.6	Very low	117 Å²	117	148.5 Å²	148.5	71%	0.709	77%	0.771	S	S	*	*			trans	-75.9	112.2	163	174.6	0	0	0	0	106.2	T18	V16-T18 HydrophobicContact CG1-CG2 3.99Å; V16-T18 PolarHBondContact O-N 3.09Å
17	F	27.5	Very low	31.1	Very low	142 Å²	142	144.2 Å²	144.2	62%	0.623	77%	0.771	S	S	*	*			trans	-73.4	101.4	152.1	-72.3	-85.4	0	0	0	105.6	F15 F19	F15-F17 PolarHBondContact O-N 3.49Å; F17-F19 HydrophobicContact CB-CD2 4.44Å; F17-F19 HydrophobicContact CB-CE2 4.2Å; F17-F19 PolarHBondContact O-N 3.46Å
18	T	26.3	Very low	31.4	Very low	118 Å²	118	147.2 Å²	147.2	72%	0.724	78%	0.776	S	S	*	*			trans	-66.5	92.7	163.9	19.5	0	0	0	0	106.5	V16 V20	V16-T18 HydrophobicContact CG1-CG2 3.99Å; V16-T18 PolarHBondContact O-N 3.09Å; T18-V20 VanDerWaalsContact C-N 3.31Å; T18-V20 PolarHBondContact O-N 3.21Å
19	F	31.1	Very low	31.8	Very low	183 Å²	183	151.6 Å²	151.6	80%	0.803	79%	0.79	S	S	*	*			trans	-61.6	105.6	151.9	-70.3	-83.1	0	0	0	104.9	F17 K21	F17-F19 HydrophobicContact CB-CD2 4.44Å; F17-F19 HydrophobicContact CB-CE2 4.2Å; F17-F19 PolarHBondContact O-N 3.46Å; F19-K21 PolarHBondContact O-N 3.28Å
20	V	28.5	Very low	32.3	Very low	115 Å²	115	150 Å²	150	70%	0.697	80%	0.795	S	S	*	*			trans	-64.2	94.4	169	-179.7	0	0	0	0	105.5	T18 K22	T18-V20 VanDerWaalsContact C-N 3.31Å; T18-V20 PolarHBondContact O-N 3.21Å; V20-K22 VanDerWaalsContact C-N 3.25Å; V20-K22 HydrophobicContact CG1-CG 3.93Å; V20-K22 PolarHBondContact O-N 3.17Å
21	K	31.9	Very low	32.6	Very low	189 Å²	189	148.8 Å²	148.8	82%	0.822	80%	0.797	S	S	*	*			trans	-58.8	99.5	152.3	-79.1	-171.2	173.5	-168.2	0	105	F19 D23	F19-K21 PolarHBondContact O-N 3.28Å; K21-D23 PolarHBondContact O-N 3.36Å
22	K	33.5	Very low	33	Very low	184 Å²	184	148 Å²	148	80%	0.8	79%	0.793	S	S	*	*			trans	-80.3	100.1	160.7	-99.1	-178.4	178.5	-179.9	0	105.7	V20	V20-K22 VanDerWaalsContact C-N 3.25Å; V20-K22 HydrophobicContact CG1-CG 3.93Å; V20-K22 PolarHBondContact O-N 3.17Å
23	D	34.2	Very low	33.6	Very low	143 Å²	143	148.6 Å²	148.6	77%	0.765	79%	0.793	S	S	*	*			trans	21.1	111.9	153	-58.4	-38.1	0	0	0	117.1	K21 A25	K21-D23 PolarHBondContact O-N 3.36Å; D23-A25 VanDerWaalsContact C-N 3.28Å; D23-A25 PolarHBondContact O-N 3.45Å
24	D	34.4	Very low	34.3	Very low	170 Å²	170	145.8 Å²	145.8	91%	0.909	79%	0.786	S	S	*	*	S	Bend	trans	-55.6	85.9	154	-64.5	-52.2	0	0	0	109.9
25	A	35	Very low	35	Very low	77 Å²	77	151.3 Å²	151.3	64%	0.636	80%	0.801	S	S	*	*			trans	-161.6	114.7	163.8	0	0	0	0	0	110.2	D23	D23-A25 VanDerWaalsContact C-N 3.28Å; D23-A25 PolarHBondContact O-N 3.45Å
26	N	40.8	Very low	36.1	Very low	168 Å²	168	146.4 Å²	146.4	90%	0.898	79%	0.79	S	S	*	*	S	Bend	trans	88.3	77.8	176.5	-55.7	-26.4	0	0	0	117.2
27	A	38.1	Very low	36.9	Very low	98 Å²	98	146.2 Å²	146.2	81%	0.81	79%	0.785	S	S	*	*			trans	-157.9	31.7	145.6	0	0	0	0	0	113.4	Q29	A27-Q29 PolarHBondContact O-N 3.25Å
28	E	38.1	Very low	37.7	Very low	197 Å²	197	144 Å²	144	92%	0.921	79%	0.793	S	S	*	*			trans	-73.6	76.3	154.4	-78.1	-174.9	155.4	0	0	107.9
29	Q	41.4	Very low	38.9	Very low	193 Å²	193	143.3 Å²	143.3	90%	0.902	79%	0.793	S	S	*	*			trans	171.3	74.3	163.4	-100.2	170.1	21.8	0	0	110.2	A27	A27-Q29 PolarHBondContact O-N 3.25Å
30	A	39.4	Very low	39.6	Very low	101 Å²	101	140.6 Å²	140.6	84%	0.835	78%	0.781	S	S	*	*			trans	-163.5	60.4	153.8	0	0	0	0	0	108.7
31	S	36.7	Very low	40.4	Very low	107 Å²	107	138.5 Å²	138.5	75%	0.748	78%	0.775	S	S	*	*			trans	-73.5	137.4	163.1	65.2	0	0	0	0	108.7
32	K	41.4	Very low	40.8	Very low	190 Å²	190	131.8 Å²	131.8	83%	0.826	76%	0.76	S	S	*	*			trans	111.3	117.7	163.8	-63.7	176.9	175.9	177.5	0	115.5
33	K	40.4	Very low	41.8	Very low	192 Å²	192	125.9 Å²	125.9	84%	0.835	74%	0.742	S	S	*	*			trans	88.7	94.3	157.5	-59.9	179.9	177	-175.8	0	116
34	T	42.9	Very low	42.5	Very low	122 Å²	122	125 Å²	125	75%	0.748	73%	0.731	S	S	*	*				162.3	126.5	100.9	33.9	0	0	0	0	110.9	S36	T34-S36 VanDerWaalsContact C-N 3.3Å; T34-S36 PolarHBondContact O-N 3.29Å; T34-S36 VanDerWaalsContact O-N 3.08Å
35	D	39.9	Very low	43.3	Very low	182 Å²	182	124.2 Å²	124.2	97%	0.973	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	38.7	-170.2	-75	-47	0	0	0	115.2
36	S	48.2	Very low	44.8	Very low	86 Å²	86	124 Å²	124	60%	0.601	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.6	-1.2	-173.6	63.1	0	0	0	0	117.6	T34	T34-S36 VanDerWaalsContact C-N 3.3Å; T34-S36 PolarHBondContact O-N 3.29Å; T34-S36 VanDerWaalsContact O-N 3.08Å
37	D	44.4	Very low	46.1	Very low	114 Å²	114	118.4 Å²	118.4	61%	0.61	69%	0.686	S	S	*	*			trans	-108.1	3.5	-172	-86.7	-37.7	0	0	0	116.2	S39	D37-S39 VanDerWaalsContact C-N 3.27Å; D37-S39 PolarHBondContact O-N 2.99Å
38	A	45.2	Very low	47.6	Very low	96 Å²	96	116.1 Å²	116.1	79%	0.793	67%	0.667	S	S	*	*	H	α-helix	trans	-71	-14.9	-177.7	0	0	0	0	0	114.6
39	S	51	Low	49.3	Very low	103 Å²	103	113.6 Å²	113.6	72%	0.72	66%	0.655	S	S	*	*	H	α-helix	trans	-86.8	-16.5	-179.1	75.3	0	0	0	0	114.6	D37	D37-S39 VanDerWaalsContact C-N 3.27Å; D37-S39 PolarHBondContact O-N 2.99Å
40	K	47.5	Very low	51.2	Low	126 Å²	126	109.4 Å²	109.4	55%	0.548	63%	0.634	S	S	.	*	H	α-helix	trans	-89	-29.7	-177.9	-73.6	-175.4	176.5	-177.1	0	113.5	G42 S43	K40-G42 PolarHBondContact O-N 3.19Å; K40-S43 PolarHBondContact O-N 2.82Å; K40-S43 PolarHBondContact O-OG 2.88Å
41	A	44.3	Very low	52.9	Low	70 Å²	70	106.7 Å²	106.7	58%	0.579	61%	0.605	S	S	*	*	H	α-helix	trans	-65.4	-35.9	-179.5	0	0	0	0	0	113.2	S43 F44	A41-S43 VanDerWaalsContact C-N 3.3Å; A41-S43 PolarHBondContact O-N 3.09Å; A41-F44 PolarHBondContact O-N 3.15Å
42	G	40.7	Very low	54.9	Low	49 Å²	49	108.6 Å²	108.6	51%	0.505	60%	0.6	S	S	.	*	H	α-helix	trans	-69	-23.1	177.9	0	0	0	0	0	114.6	K40 F44	K40-G42 PolarHBondContact O-N 3.19Å; G42-F44 VanDerWaalsContact C-N 3.33Å
43	S	53.5	Low	56.9	Low	59 Å²	59	106.4 Å²	106.4	41%	0.413	59%	0.593	S	S	.	*	H	α-helix	trans	-74.6	-25.4	177.4	79.8	0	0	0	0	112.8	K40 A41 N47	K40-S43 PolarHBondContact O-N 2.82Å; K40-S43 PolarHBondContact O-OG 2.88Å; A41-S43 VanDerWaalsContact C-N 3.3Å; A41-S43 PolarHBondContact O-N 3.09Å; S43-N47 WeakPolarHBondContact O-CB 3.33Å; S43-N47 VanDerWaalsContact O-CG 3.24Å; S43-N47 PolarHBondContact O-N 3.06Å; S43-N47 VanDerWaalsContact O-N 3.11Å; S43-N47 PolarHBondContact O-ND2 3.16Å
44	F	48.6	Very low	58.9	Low	124 Å²	124	98 Å²	98	54%	0.544	56%	0.557	S	S	.	*	H	α-helix	trans	-80.5	-41.2	-174.4	-126	-92	0	0	0	112.4	A41 G42 N47 A48	A41-F44 PolarHBondContact O-N 3.15Å; G42-F44 VanDerWaalsContact C-N 3.33Å; F44-N47 PolarHBondContact O-N 3.24Å; F44-A48 WeakPolarHBondContact O-CB 3.46Å; F44-A48 PolarHBondContact O-N 3.16Å
45	E	52.9	Low	60.4	Low	154 Å²	154	96.8 Å²	96.8	72%	0.72	54%	0.543	S	S	*	.	H	α-helix	trans	-65.2	-42.8	173.4	-87.6	-176.4	148.8	0	0	111.9	N47 A48 E49	E45-N47 VanDerWaalsContact C-N 3.34Å; E45-N47 PolarHBondContact O-N 3.3Å; E45-A48 PolarHBondContact O-N 3.42Å; E45-E49 PolarHBondContact O-N 3.47Å
46	S	66.1	Low	62.5	Low	72 Å²	72	94.6 Å²	94.6	50%	0.503	53%	0.525	S	S	.	.	H	α-helix	trans	-60.5	-41.5	175.4	-179.1	0	0	0	0	112.3	K50	S46-K50 VanDerWaalsContact O-CB 3.27Å; S46-K50 WeakPolarHBondContact O-CB 3.1Å; S46-K50 PolarHBondContact O-N 2.91Å
47	N	68.4	Low	64.2	Low	52 Å²	52	93.6 Å²	93.6	28%	0.278	51%	0.51	S	S	.	.	H	α-helix	trans	-69.2	-35.3	176.2	-79.3	-25.1	0	0	0	112.9	S43 F44 E45 L51 I95	S43-N47 WeakPolarHBondContact O-CB 3.33Å; S43-N47 VanDerWaalsContact O-CG 3.24Å; S43-N47 PolarHBondContact O-N 3.06Å; S43-N47 VanDerWaalsContact O-N 3.11Å; S43-N47 PolarHBondContact O-ND2 3.16Å; F44-N47 PolarHBondContact O-N 3.24Å; E45-N47 VanDerWaalsContact C-N 3.34Å; E45-N47 PolarHBondContact O-N 3.3Å; N47-L51 VanDerWaalsContact O-CB 3.27Å; N47-L51 WeakPolarHBondContact O-CB 3.25Å; N47-L51 PolarHBondContact O-N 2.85Å; N47-I95 HydrophobicContact CB-CG2 4.13Å
48	A	68	Low	65.9	Low	49 Å²	49	90.2 Å²	90.2	41%	0.405	49%	0.492	S	S	.	.	H	α-helix	trans	-68.4	-41.1	177.5	0	0	0	0	0	112.5	F44 E45 L51 K52	F44-A48 WeakPolarHBondContact O-CB 3.46Å; F44-A48 PolarHBondContact O-N 3.16Å; E45-A48 PolarHBondContact O-N 3.42Å; A48-L51 PolarHBondContact O-N 3.17Å; A48-K52 WeakPolarHBondContact O-CG 3.39Å; A48-K52 PolarHBondContact O-N 2.99Å
49	E	75.6	Confident	67.3	Low	144 Å²	144	92.3 Å²	92.3	67%	0.673	49%	0.487	S	S	*	.	H	α-helix	trans	-65.2	-45	173.1	-72.7	-168.4	155.1	0	0	111.7	E45 L51 K52 Q53	E45-E49 PolarHBondContact O-N 3.47Å; E49-L51 VanDerWaalsContact C-N 3.3Å; E49-L51 PolarHBondContact O-N 2.97Å; E49-K52 WeakPolarHBondContact O-CB 3.25Å; E49-K52 PolarHBondContact O-N 3.4Å; E49-K52 VanDerWaalsContact O-N 3.16Å; E49-Q53 PolarHBondContact O-N 3.13Å
50	K	79.4	Confident	68.8	Low	106 Å²	106	92 Å²	92	46%	0.461	48%	0.475	S	S	.	.	H	α-helix	trans	-60.6	-39.6	176.2	-166.8	177.6	-178.7	-179.3	0	112	S46 Q53 L54 I95	S46-K50 VanDerWaalsContact O-CB 3.27Å; S46-K50 WeakPolarHBondContact O-CB 3.1Å; S46-K50 PolarHBondContact O-N 2.91Å; K50-Q53 PolarHBondContact O-N 3.45Å; K50-L54 HydrophobicContact CG-CD1 4.35Å; K50-L54 WeakPolarHBondContact O-CG 3.34Å; K50-L54 PolarHBondContact O-N 3.44Å; K50-I95 HydrophobicContact CB-CD1 4.21Å; K50-I95 HydrophobicContact CD-CD1 3.59Å; K50-I95 HydrophobicContact CD-CG1 4.22Å; K50-I95 HydrophobicContact CG-CD1 3.62Å
51	L	76	Confident	70.1	Confident	43 Å²	43	86 Å²	86	23%	0.225	45%	0.448	C	S	.	.	H	α-helix	trans	-64.4	-43.1	175.2	-161.3	91	0	0	0	111.5	N47 A48 E49 Q53 L54 Q55 I92 I95 T96	N47-L51 VanDerWaalsContact O-CB 3.27Å; N47-L51 WeakPolarHBondContact O-CB 3.25Å; N47-L51 PolarHBondContact O-N 2.85Å; A48-L51 PolarHBondContact O-N 3.17Å; E49-L51 VanDerWaalsContact C-N 3.3Å; E49-L51 PolarHBondContact O-N 2.97Å; L51-Q53 VanDerWaalsContact C-N 3.33Å; L51-Q53 PolarHBondContact O-N 2.99Å; L51-L54 PolarHBondContact O-N 2.99Å; L51-Q55 WeakPolarHBondContact O-CB 3.18Å; L51-Q55 VanDerWaalsContact O-CG 3.23Å; L51-Q55 WeakPolarHBondContact O-CG 3.45Å; L51-Q55 PolarHBondContact O-N 2.98Å; L51-I92 HydrophobicContact CD1-CG2 4.28Å; L51-I95 HydrophobicContact CD1-CB 4.37Å; L51-I95 HydrophobicContact CD1-CG2 3.9Å; L51-T96 HydrophobicContact CD1-CG2 3.7Å
52	K	79.5	Confident	71.3	Confident	148 Å²	148	89.8 Å²	89.8	64%	0.643	45%	0.447	S	S	*	.	H	α-helix	trans	-61.2	-41.1	175	-76.5	177.2	-178.3	172.4	0	111.7	A48 E49 Q55 K56	A48-K52 WeakPolarHBondContact O-CG 3.39Å; A48-K52 PolarHBondContact O-N 2.99Å; E49-K52 WeakPolarHBondContact O-CB 3.25Å; E49-K52 PolarHBondContact O-N 3.4Å; E49-K52 VanDerWaalsContact O-N 3.16Å; K52-Q55 PolarHBondContact O-N 3.05Å; K52-K56 PolarHBondContact O-N 2.95Å
53	Q	83.4	Confident	72.9	Confident	143 Å²	143	92 Å²	92	67%	0.668	45%	0.451	S	S	*	.	H	α-helix	trans	-65.4	-45.8	178.1	-170.9	175.7	5	0	0	111.9	E49 K50 L51 Q55 K56 E57	E49-Q53 PolarHBondContact O-N 3.13Å; K50-Q53 PolarHBondContact O-N 3.45Å; L51-Q53 VanDerWaalsContact C-N 3.33Å; L51-Q53 PolarHBondContact O-N 2.99Å; Q53-Q55 VanDerWaalsContact C-N 3.32Å; Q53-Q55 PolarHBondContact O-N 3.25Å; Q53-K56 WeakPolarHBondContact O-CB 3.4Å; Q53-K56 PolarHBondContact O-N 3.46Å; Q53-E57 PolarHBondContact O-N 3Å
54	L	82.3	Confident	74.1	Confident	17 Å²	17	91.7 Å²	91.7	9%	0.089	45%	0.445	C	S	.	.	H	α-helix	trans	-65.9	-34.9	176.9	-70.7	166.9	0	0	0	112.4	K50 L51 K56 E57 L58 T88 I92 I95	K50-L54 HydrophobicContact CG-CD1 4.35Å; K50-L54 WeakPolarHBondContact O-CG 3.34Å; K50-L54 PolarHBondContact O-N 3.44Å; L51-L54 PolarHBondContact O-N 2.99Å; L54-K56 VanDerWaalsContact C-N 3.32Å; L54-E57 PolarHBondContact O-N 3.5Å; L54-L58 WeakPolarHBondContact O-CB 3.38Å; L54-L58 PolarHBondContact O-N 3.32Å; L54-T88 HydrophobicContact CB-CG2 4.16Å; L54-T88 HydrophobicContact CD2-CG2 3.89Å; L54-T88 VanDerWaalsContact O-CG2 3.29Å; L54-T88 WeakPolarHBondContact O-CG2 3.38Å; L54-I92 HydrophobicContact CB-CD1 4.08Å; L54-I92 HydrophobicContact CB-CG1 3.62Å; L54-I92 HydrophobicContact CD1-CG1 3.98Å; L54-I92 HydrophobicContact CG-CG1 4.38Å; L54-I95 HydrophobicContact CD1-CD1 3.2Å
55	Q	72.9	Confident	75.2	Confident	95 Å²	95	86.9 Å²	86.9	44%	0.444	42%	0.424	S	S	.	.	H	α-helix	trans	-63.2	-39.8	172.9	-77.1	175.1	0.4	0	0	111.9	L51 K52 Q53 L58 M59	L51-Q55 WeakPolarHBondContact O-CB 3.18Å; L51-Q55 VanDerWaalsContact O-CG 3.23Å; L51-Q55 WeakPolarHBondContact O-CG 3.45Å; L51-Q55 PolarHBondContact O-N 2.98Å; K52-Q55 PolarHBondContact O-N 3.05Å; Q53-Q55 VanDerWaalsContact C-N 3.32Å; Q53-Q55 PolarHBondContact O-N 3.25Å; Q55-L58 PolarHBondContact O-N 3.38Å; Q55-M59 WeakPolarHBondContact O-CB 3.13Å; Q55-M59 PolarHBondContact O-N 2.87Å
56	K	85.1	Confident	76.1	Confident	137 Å²	137	84.5 Å²	84.5	60%	0.596	42%	0.416	S	S	*	.	H	α-helix	trans	-63.6	-46.9	174.5	-171.9	-176.9	176.3	-170.4	0	111.2	K52 Q53 L54 L58 M59 E60	K52-K56 PolarHBondContact O-N 2.95Å; Q53-K56 WeakPolarHBondContact O-CB 3.4Å; Q53-K56 PolarHBondContact O-N 3.46Å; L54-K56 VanDerWaalsContact C-N 3.32Å; K56-L58 VanDerWaalsContact C-N 3.34Å; K56-L58 PolarHBondContact O-N 3.3Å; K56-M59 PolarHBondContact O-N 3.48Å; K56-E60 WeakPolarHBondContact CE-OE1 3.3Å; K56-E60 WeakPolarHBondContact O-CG 3.46Å; K56-E60 PolarHBondContact O-N 3.44Å
57	E	83.5	Confident	76.8	Confident	64 Å²	64	83.3 Å²	83.3	30%	0.299	40%	0.404	S	S	.	.	H	α-helix	trans	-60.9	-41.2	177.3	-171.8	-175.4	-167	0	0	112.1	Q53 L54 M59 E60 C61 T88	Q53-E57 PolarHBondContact O-N 3Å; L54-E57 PolarHBondContact O-N 3.5Å; E57-M59 VanDerWaalsContact C-N 3.31Å; E57-M59 PolarHBondContact O-N 2.82Å; E57-E60 PolarHBondContact O-N 3.37Å; E57-C61 PolarHBondContact O-N 3.32Å; E57-C61 PolarHBondContact O-SG 3.25Å; E57-T88 HydrophobicContact CB-CG2 4.12Å; E57-T88 HydrophobicContact CG-CG2 4.29Å; E57-T88 PolarHBondContact OE1-OG1 2.72Å; E57-T88 PolarHBondContact OE2-OG1 3.47Å; E57-T88 VanDerWaalsContact OE2-OG1 3.05Å
58	L	80.7	Confident	77	Confident	43 Å²	43	84.9 Å²	84.9	23%	0.225	41%	0.408	C	S	.	.	H	α-helix	trans	-62.8	-40.2	176.5	-163.8	105.5	0	0	0	111.3	L54 Q55 K56 R62 T88 F89 I92	L54-L58 WeakPolarHBondContact O-CB 3.38Å; L54-L58 PolarHBondContact O-N 3.32Å; Q55-L58 PolarHBondContact O-N 3.38Å; K56-L58 VanDerWaalsContact C-N 3.34Å; K56-L58 PolarHBondContact O-N 3.3Å; L58-R62 WeakPolarHBondContact O-CB 3.48Å; L58-R62 PolarHBondContact O-N 3.13Å; L58-T88 HydrophobicContact CB-CG2 4.1Å; L58-T88 HydrophobicContact CD1-CG2 4.13Å; L58-F89 HydrophobicContact CD1-CD2 4.2Å; L58-I92 HydrophobicContact CD1-CD1 4.17Å
59	M	74.9	Confident	77.5	Confident	140 Å²	140	91.6 Å²	91.6	69%	0.69	43%	0.431	S	S	*	.	H	α-helix	trans	-67.7	-41.3	177.4	-165.1	157	-174.6	0	0	111.8	Q55 K56 E57 R62 V63	Q55-M59 WeakPolarHBondContact O-CB 3.13Å; Q55-M59 PolarHBondContact O-N 2.87Å; K56-M59 PolarHBondContact O-N 3.48Å; E57-M59 VanDerWaalsContact C-N 3.31Å; E57-M59 PolarHBondContact O-N 2.82Å; M59-R62 PolarHBondContact O-N 3.46Å; M59-V63 WeakPolarHBondContact O-CG2 3.27Å; M59-V63 PolarHBondContact O-N 2.85Å
60	E	81.2	Confident	77.7	Confident	98 Å²	98	91.3 Å²	91.3	46%	0.458	43%	0.428	S	S	.	.	H	α-helix	trans	-63.1	-45	174.4	-72.8	173.3	-172.7	0	0	111.9	K56 E57 R62 V63 L64	K56-E60 WeakPolarHBondContact CE-OE1 3.3Å; K56-E60 WeakPolarHBondContact O-CG 3.46Å; K56-E60 PolarHBondContact O-N 3.44Å; E57-E60 PolarHBondContact O-N 3.37Å; E60-R62 VanDerWaalsContact C-N 3.31Å; E60-R62 PolarHBondContact O-N 2.95Å; E60-V63 PolarHBondContact O-N 2.96Å; E60-L64 WeakPolarHBondContact O-CG 3.5Å; E60-L64 PolarHBondContact O-N 3.26Å; E60-L64 VanDerWaalsContact O-N 3.1Å
61	C	75.3	Confident	77.8	Confident	0 Å²	0	88.8 Å²	88.8	0%	0	42%	0.416	C	S	.	.	H	α-helix	trans	-57.5	-45.4	174.3	-68.3	0	0	0	0	111.5	E57 V63 L64 E65 R84 H85	E57-C61 PolarHBondContact O-N 3.32Å; E57-C61 PolarHBondContact O-SG 3.25Å; C61-V63 VanDerWaalsContact C-N 3.33Å; C61-V63 PolarHBondContact O-N 3.01Å; C61-L64 PolarHBondContact O-N 3.18Å; C61-E65 WeakPolarHBondContact O-CB 3.42Å; C61-E65 VanDerWaalsContact O-CG 3.32Å; C61-E65 WeakPolarHBondContact O-CG 3.48Å; C61-E65 PolarHBondContact O-N 3.34Å; C61-R84 PolarHBondContact SG-NE 2.83Å; C61-R84 PolarHBondContact SG-NH2 2.68Å; C61-H85 HydrophobicContact CB-CB 4.26Å
62	R	70.3	Confident	77.6	Confident	148 Å²	148	90 Å²	90	56%	0.558	43%	0.426	S	S	*	.	H	α-helix	trans	-65.7	-34.5	-179.3	-166.1	-179.5	-172.2	171.2	11.5	113	L58 M59 E60 N66	L58-R62 WeakPolarHBondContact O-CB 3.48Å; L58-R62 PolarHBondContact O-N 3.13Å; M59-R62 PolarHBondContact O-N 3.46Å; E60-R62 VanDerWaalsContact C-N 3.31Å; E60-R62 PolarHBondContact O-N 2.95Å; R62-N66 PolarHBondContact O-N 3.16Å; R62-N66 PolarHBondContact O-ND2 2.97Å
63	V	74.5	Confident	77	Confident	97 Å²	97	85.8 Å²	85.8	59%	0.588	42%	0.415	S	S	*	.	H	α-helix	trans	-65	-46.8	174	170.7	0	0	0	0	110	M59 E60 C61 N66	M59-V63 WeakPolarHBondContact O-CG2 3.27Å; M59-V63 PolarHBondContact O-N 2.85Å; E60-V63 PolarHBondContact O-N 2.96Å; C61-V63 VanDerWaalsContact C-N 3.33Å; C61-V63 PolarHBondContact O-N 3.01Å; V63-N66 PolarHBondContact O-N 3.26Å; V63-N66 VanDerWaalsContact O-N 3.16Å
64	L	77.6	Confident	76.3	Confident	52 Å²	52	81.3 Å²	81.3	27%	0.272	41%	0.407	S	S	.	.	H	α-helix	trans	-66.7	-37.7	179.4	-65	167.8	0	0	0	112.4	E60 C61 N66 D67 Y71 L81	E60-L64 WeakPolarHBondContact O-CG 3.5Å; E60-L64 PolarHBondContact O-N 3.26Å; E60-L64 VanDerWaalsContact O-N 3.1Å; C61-L64 PolarHBondContact O-N 3.18Å; L64-N66 PolarHBondContact O-N 3.4Å; L64-D67 PolarHBondContact O-N 3.38Å; L64-Y71 HydrophobicContact CB-CD2 4.4Å; L64-Y71 HydrophobicContact CB-CE2 4.03Å; L64-Y71 HydrophobicContact CD2-CE2 3.81Å; L64-Y71 HydrophobicContact CG-CE2 4.46Å; L64-Y71 WeakPolarHBondContact O-CD2 3.02Å; L64-L81 HydrophobicContact CB-CD1 4.27Å; L64-L81 HydrophobicContact CB-CD2 3.62Å; L64-L81 HydrophobicContact CD1-CD2 3.95Å; L64-L81 HydrophobicContact CG-CD2 4.46Å
65	E	72.3	Confident	76.2	Confident	22 Å²	22	82 Å²	82	10%	0.103	41%	0.413	C	S	.	.	H	α-helix	trans	-61.2	-23.1	174.1	-76.7	176.6	179.7	0	0	113.1	C61 R78 F82 H85	C61-E65 WeakPolarHBondContact O-CB 3.42Å; C61-E65 VanDerWaalsContact O-CG 3.32Å; C61-E65 WeakPolarHBondContact O-CG 3.48Å; C61-E65 PolarHBondContact O-N 3.34Å; E65-R78 PolarHBondContact O-NH1 3.09Å; E65-R78 PolarHBondContact O-NH2 2.85Å; E65-F82 WeakPolarHBondContact OE1-CD1 3.45Å; E65-H85 WeakPolarHBondContact OE1-CB 3.5Å; E65-H85 IonicContact OE1-CG 2.85Å; E65-H85 IonicContact OE1-ND1 2.81Å
66	N	71.8	Confident	76.6	Confident	105 Å²	105	85.1 Å²	85.1	56%	0.561	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-7.3	176.6	-69.8	-44.9	0	0	0	113.6	R62 V63 L64 F68	R62-N66 PolarHBondContact O-N 3.16Å; R62-N66 PolarHBondContact O-ND2 2.97Å; V63-N66 PolarHBondContact O-N 3.26Å; V63-N66 VanDerWaalsContact O-N 3.16Å; L64-N66 PolarHBondContact O-N 3.4Å; N66-F68 WeakPolarHBondContact O-CD2 3.34Å; N66-F68 PolarHBondContact O-N 3.02Å
67	D	80.8	Confident	76.4	Confident	46 Å²	46	84.1 Å²	84.1	25%	0.246	43%	0.425	C	S	.	.			trans	-87.9	79.2	175.3	-167.9	-17.5	0	0	0	109.8	L64 E69 K70 Y71	L64-D67 PolarHBondContact O-N 3.38Å; D67-E69 PolarHBondContact O-N 3.34Å; D67-E69 PolarHBondContact OD1-N 3.02Å; D67-K70 PolarHBondContact O-N 3Å; D67-K70 PolarHBondContact OD1-N 3.41Å; D67-K70 VanDerWaalsContact OD2-CD 3.26Å; D67-K70 WeakPolarHBondContact OD2-CD 3.31Å; D67-K70 IonicContact OD2-NZ 3.38Å; D67-Y71 HydrophobicContact CB-CD2 4.39Å; D67-Y71 PolarHBondContact O-N 3.43Å
68	F	72.9	Confident	76.1	Confident	85 Å²	85	81.9 Å²	81.9	37%	0.373	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-21	-178.3	-70.2	-87.2	0	0	0	113.7	N66 R78	N66-F68 WeakPolarHBondContact O-CD2 3.34Å; N66-F68 PolarHBondContact O-N 3.02Å; F68-R78 VanDerWaalsContact CE1-NH1 3.27Å; F68-R78 VanDerWaalsContact CE1-NH2 3.3Å
69	E	78.6	Confident	75.9	Confident	190 Å²	190	84.9 Å²	84.9	89%	0.888	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-41	175.4	-70.1	-177.5	176.8	0	0	110.7	D67	D67-E69 PolarHBondContact O-N 3.34Å; D67-E69 PolarHBondContact OD1-N 3.02Å
70	K	79.1	Confident	76.2	Confident	138 Å²	138	82.9 Å²	82.9	60%	0.6	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-36.9	176.8	-67.6	-173.4	-169.1	161.3	0	113.9	D67 P72	D67-K70 PolarHBondContact O-N 3Å; D67-K70 PolarHBondContact OD1-N 3.41Å; D67-K70 VanDerWaalsContact OD2-CD 3.26Å; D67-K70 WeakPolarHBondContact OD2-CD 3.31Å; D67-K70 IonicContact OD2-NZ 3.38Å; K70-P72 VanDerWaalsContact C-CD 3.45Å; K70-P72 VanDerWaalsContact O-CD 3.24Å; K70-P72 WeakPolarHBondContact O-CD 3.25Å
71	Y	80.6	Confident	76.3	Confident	54 Å²	54	78.7 Å²	78.7	21%	0.212	40%	0.395	C	S	.	.	S	Bend	trans	-120.8	76.8	-175.8	-56.6	-73.7	0	0	0	111.1	L64 D67 E77 R78 L81	L64-Y71 HydrophobicContact CB-CD2 4.4Å; L64-Y71 HydrophobicContact CB-CE2 4.03Å; L64-Y71 HydrophobicContact CD2-CE2 3.81Å; L64-Y71 HydrophobicContact CG-CE2 4.46Å; L64-Y71 WeakPolarHBondContact O-CD2 3.02Å; D67-Y71 HydrophobicContact CB-CD2 4.39Å; D67-Y71 PolarHBondContact O-N 3.43Å; Y71-E77 HydrophobicContact CD1-CB 3.75Å; Y71-E77 HydrophobicContact CE1-CB 4.05Å; Y71-R78 WeakPolarHBondContact O-CD 3.27Å; Y71-R78 PolarHBondContact O-NH1 3.01Å; Y71-L81 HydrophobicContact CD1-CD1 3.4Å; Y71-L81 HydrophobicContact CD2-CD1 3.77Å; Y71-L81 HydrophobicContact CE1-CD1 3.7Å; Y71-L81 HydrophobicContact CE2-CD1 4.05Å; Y71-L81 HydrophobicContact CG-CD1 3.41Å; Y71-L81 VanDerWaalsContact CG-CD1 3.41Å
72	P	72.9	Confident	76.4	Confident	68 Å²	68	82.5 Å²	82.5	44%	0.442	41%	0.412	S	S	.	.			trans	-63.2	147.4	-179.1	20.2	-27.9	0	0	0	112	K70 G74 S75	K70-P72 VanDerWaalsContact C-CD 3.45Å; K70-P72 VanDerWaalsContact O-CD 3.24Å; K70-P72 WeakPolarHBondContact O-CD 3.25Å; P72-G74 PolarHBondContact O-N 3.43Å; P72-S75 WeakPolarHBondContact O-CB 3.41Å; P72-S75 PolarHBondContact O-N 3.37Å; P72-S75 PolarHBondContact O-OG 3.17Å
73	C	65.8	Low	76.9	Confident	59 Å²	59	80.9 Å²	80.9	40%	0.399	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	128.4	177	-80	0	0	0	0	109.4	C359	C73-C359 WeakPolarHBondContact CB-SG 3.29Å; C73-C359 WeakPolarHBondContact SG-CB 3.28Å; C73-C359 CovalentContact SG-SG 2.11Å; C73-C359 PolarHBondContact SG-SG 3.11Å
74	G	69.7	Low	77.2	Confident	50 Å²	50	80.9 Å²	80.9	52%	0.515	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.2	-14.7	176.7	0	0	0	0	0	116.4	P72 K79	P72-G74 PolarHBondContact O-N 3.43Å; G74-K79 WeakPolarHBondContact O-CE 3.5Å
75	S	79.7	Confident	77.3	Confident	30 Å²	30	80.8 Å²	80.8	21%	0.21	40%	0.396	C	S	.	.			trans	-58.1	150.1	173.2	60.2	0	0	0	0	111.9	P72 E77 R78 K79	P72-S75 WeakPolarHBondContact O-CB 3.41Å; P72-S75 PolarHBondContact O-N 3.37Å; P72-S75 PolarHBondContact O-OG 3.17Å; S75-E77 PolarHBondContact O-N 3.23Å; S75-R78 PolarHBondContact O-N 3.16Å; S75-R78 VanDerWaalsContact OG-CB 3.23Å; S75-R78 WeakPolarHBondContact OG-CB 3.01Å; S75-R78 PolarHBondContact OG-N 3Å; S75-K79 WeakPolarHBondContact O-CG 3.27Å; S75-K79 PolarHBondContact O-N 2.74Å; S75-K79 VanDerWaalsContact O-N 3.08Å
76	E	80.9	Confident	77.3	Confident	161 Å²	161	82.5 Å²	82.5	75%	0.752	41%	0.414	S	S	*	.	H	α-helix	trans	-59.8	-38.3	173.8	-68.2	-148.9	135.7	0	0	111.6	R78 K79 E80	E76-R78 VanDerWaalsContact C-N 3.33Å; E76-R78 PolarHBondContact O-N 3.02Å; E76-K79 WeakPolarHBondContact O-CB 3.31Å; E76-K79 PolarHBondContact O-N 3.01Å; E76-K79 VanDerWaalsContact O-N 3.15Å; E76-E80 PolarHBondContact O-N 3.41Å
77	E	81.2	Confident	77.7	Confident	116 Å²	116	83.7 Å²	83.7	54%	0.542	41%	0.414	S	S	.	.	H	α-helix	trans	-59.3	-42.2	176.6	-58.8	-178.2	171.2	0	0	112.1	Y71 S75 E80 L81	Y71-E77 HydrophobicContact CD1-CB 3.75Å; Y71-E77 HydrophobicContact CE1-CB 4.05Å; S75-E77 PolarHBondContact O-N 3.23Å; E77-E80 PolarHBondContact O-N 2.96Å; E77-L81 PolarHBondContact O-N 3.22Å
78	R	76.9	Confident	77.5	Confident	17 Å²	17	81.6 Å²	81.6	6%	0.064	40%	0.403	C	S	.	.	H	α-helix	trans	-69.7	-36.2	175.7	-172.9	138.9	-178.1	150.4	7.8	112.8	E65 F68 Y71 S75 E76 E80 L81 F82	E65-R78 PolarHBondContact O-NH1 3.09Å; E65-R78 PolarHBondContact O-NH2 2.85Å; F68-R78 VanDerWaalsContact CE1-NH1 3.27Å; F68-R78 VanDerWaalsContact CE1-NH2 3.3Å; Y71-R78 WeakPolarHBondContact O-CD 3.27Å; Y71-R78 PolarHBondContact O-NH1 3.01Å; S75-R78 PolarHBondContact O-N 3.16Å; S75-R78 VanDerWaalsContact OG-CB 3.23Å; S75-R78 WeakPolarHBondContact OG-CB 3.01Å; S75-R78 PolarHBondContact OG-N 3Å; E76-R78 VanDerWaalsContact C-N 3.33Å; E76-R78 PolarHBondContact O-N 3.02Å; R78-E80 VanDerWaalsContact C-N 3.28Å; R78-E80 PolarHBondContact O-N 3Å; R78-L81 WeakPolarHBondContact O-CB 3.23Å; R78-L81 PolarHBondContact O-N 3.07Å; R78-F82 HydrophobicContact CG-CD2 4.03Å; R78-F82 HydrophobicContact CG-CE2 3.7Å; R78-F82 WeakPolarHBondContact O-CD2 3.47Å; R78-F82 PolarHBondContact O-N 3.37Å; R78-F82 VanDerWaalsContact O-N 3.09Å
79	K	76.2	Confident	77.6	Confident	107 Å²	107	82.1 Å²	82.1	47%	0.465	41%	0.406	S	S	.	.	H	α-helix	trans	-62.4	-39.3	172.7	-69	174	-171.1	164.6	0	110.9	G74 S75 E76 F82 K83	G74-K79 WeakPolarHBondContact O-CE 3.5Å; S75-K79 WeakPolarHBondContact O-CG 3.27Å; S75-K79 PolarHBondContact O-N 2.74Å; S75-K79 VanDerWaalsContact O-N 3.08Å; E76-K79 WeakPolarHBondContact O-CB 3.31Å; E76-K79 PolarHBondContact O-N 3.01Å; E76-K79 VanDerWaalsContact O-N 3.15Å; K79-F82 PolarHBondContact O-N 2.95Å; K79-K83 WeakPolarHBondContact O-CG 3.32Å; K79-K83 PolarHBondContact O-N 3.38Å
80	E	82.7	Confident	77.2	Confident	97 Å²	97	77.8 Å²	77.8	45%	0.453	39%	0.385	S	S	.	.	H	α-helix	trans	-70.2	-38.9	179	-158.3	59.6	-154.7	0	0	112	E76 E77 R78 F82 K83 R84	E76-E80 PolarHBondContact O-N 3.41Å; E77-E80 PolarHBondContact O-N 2.96Å; R78-E80 VanDerWaalsContact C-N 3.28Å; R78-E80 PolarHBondContact O-N 3Å; E80-F82 VanDerWaalsContact C-N 3.35Å; E80-F82 PolarHBondContact O-N 2.88Å; E80-K83 PolarHBondContact O-N 3.05Å; E80-K83 WeakPolarHBondContact OE2-CD 3.42Å; E80-K83 IonicContact OE2-NZ 2.85Å; E80-K83 PolarHBondContact OE2-NZ 3.25Å; E80-R84 PolarHBondContact O-N 3.24Å
81	L	82.5	Confident	77.1	Confident	10 Å²	10	73.4 Å²	73.4	5%	0.052	37%	0.372	C	S	.	.	H	α-helix	trans	-54.6	-47.6	169.2	-89.7	156.8	0	0	0	112.2	L64 Y71 E77 R78 K83 R84 H85	L64-L81 HydrophobicContact CB-CD1 4.27Å; L64-L81 HydrophobicContact CB-CD2 3.62Å; L64-L81 HydrophobicContact CD1-CD2 3.95Å; L64-L81 HydrophobicContact CG-CD2 4.46Å; Y71-L81 HydrophobicContact CD1-CD1 3.4Å; Y71-L81 HydrophobicContact CD2-CD1 3.77Å; Y71-L81 HydrophobicContact CE1-CD1 3.7Å; Y71-L81 HydrophobicContact CE2-CD1 4.05Å; Y71-L81 HydrophobicContact CG-CD1 3.41Å; Y71-L81 VanDerWaalsContact CG-CD1 3.41Å; E77-L81 PolarHBondContact O-N 3.22Å; R78-L81 WeakPolarHBondContact O-CB 3.23Å; R78-L81 PolarHBondContact O-N 3.07Å; L81-K83 PolarHBondContact O-N 2.82Å; L81-R84 PolarHBondContact O-N 3.02Å; L81-H85 WeakPolarHBondContact O-CB 3.33Å; L81-H85 PolarHBondContact O-N 3.03Å
82	F	76.9	Confident	76.7	Confident	81 Å²	81	72.3 Å²	72.3	36%	0.355	37%	0.37	S	S	.	.	H	α-helix	trans	-64.7	-38.8	177.1	-78.5	-58.5	0	0	0	112.9	E65 R78 K79 E80 R84 H85 A86	E65-F82 WeakPolarHBondContact OE1-CD1 3.45Å; R78-F82 HydrophobicContact CG-CD2 4.03Å; R78-F82 HydrophobicContact CG-CE2 3.7Å; R78-F82 WeakPolarHBondContact O-CD2 3.47Å; R78-F82 PolarHBondContact O-N 3.37Å; R78-F82 VanDerWaalsContact O-N 3.09Å; K79-F82 PolarHBondContact O-N 2.95Å; E80-F82 VanDerWaalsContact C-N 3.35Å; E80-F82 PolarHBondContact O-N 2.88Å; F82-R84 VanDerWaalsContact C-N 3.33Å; F82-H85 PolarHBondContact O-N 3.48Å; F82-A86 WeakPolarHBondContact O-CB 3.36Å; F82-A86 PolarHBondContact O-N 3.38Å
83	K	81.3	Confident	76.3	Confident	113 Å²	113	71.4 Å²	71.4	49%	0.491	37%	0.367	S	S	.	.	H	α-helix	trans	-62.9	-41	174.2	-71.6	-176.4	-155.1	153.3	0	111.4	K79 E80 L81 A86 K87	K79-K83 WeakPolarHBondContact O-CG 3.32Å; K79-K83 PolarHBondContact O-N 3.38Å; E80-K83 PolarHBondContact O-N 3.05Å; E80-K83 WeakPolarHBondContact OE2-CD 3.42Å; E80-K83 IonicContact OE2-NZ 2.85Å; E80-K83 PolarHBondContact OE2-NZ 3.25Å; L81-K83 PolarHBondContact O-N 2.82Å; K83-A86 PolarHBondContact O-N 2.84Å; K83-K87 WeakPolarHBondContact O-CB 3.49Å; K83-K87 WeakPolarHBondContact O-CG 3.34Å; K83-K87 PolarHBondContact O-N 3.34Å
84	R	80.6	Confident	76.5	Confident	97 Å²	97	75 Å²	75	37%	0.366	38%	0.376	S	S	.	.	H	α-helix	trans	-64.1	-48.9	176	-168.4	173.9	65.7	-172.2	4.2	110.8	C61 E80 L81 F82 A86 K87 T88	C61-R84 PolarHBondContact SG-NE 2.83Å; C61-R84 PolarHBondContact SG-NH2 2.68Å; E80-R84 PolarHBondContact O-N 3.24Å; L81-R84 PolarHBondContact O-N 3.02Å; F82-R84 VanDerWaalsContact C-N 3.33Å; R84-A86 VanDerWaalsContact C-N 3.31Å; R84-A86 PolarHBondContact O-N 2.91Å; R84-K87 PolarHBondContact O-N 2.78Å; R84-K87 VanDerWaalsContact O-N 3.15Å; R84-T88 PolarHBondContact O-N 3.01Å; R84-T88 PolarHBondContact O-OG1 3.47Å
85	H	79.3	Confident	76.3	Confident	51 Å²	51	73.6 Å²	73.6	24%	0.236	36%	0.357	C	S	.	.	H	α-helix	trans	-56.3	-43.9	176.1	-175.3	-108.7	0	0	0	112.3	C61 E65 L81 F82 T88 F89	C61-H85 HydrophobicContact CB-CB 4.26Å; E65-H85 WeakPolarHBondContact OE1-CB 3.5Å; E65-H85 IonicContact OE1-CG 2.85Å; E65-H85 IonicContact OE1-ND1 2.81Å; L81-H85 WeakPolarHBondContact O-CB 3.33Å; L81-H85 PolarHBondContact O-N 3.03Å; F82-H85 PolarHBondContact O-N 3.48Å; H85-T88 PolarHBondContact O-N 3.11Å; H85-F89 WeakPolarHBondContact O-CB 3.16Å; H85-F89 PolarHBondContact O-N 2.98Å
86	A	73.3	Confident	75.2	Confident	57 Å²	57	75 Å²	75	47%	0.471	37%	0.365	S	S	.	.	H	α-helix	trans	-63.2	-44.7	175.8	0	0	0	0	0	112.7	F82 K83 R84 F89 E90	F82-A86 WeakPolarHBondContact O-CB 3.36Å; F82-A86 PolarHBondContact O-N 3.38Å; K83-A86 PolarHBondContact O-N 2.84Å; R84-A86 VanDerWaalsContact C-N 3.31Å; R84-A86 PolarHBondContact O-N 2.91Å; A86-F89 PolarHBondContact O-N 3.22Å; A86-E90 WeakPolarHBondContact O-CB 3.3Å; A86-E90 PolarHBondContact O-N 3.37Å
87	K	80.1	Confident	73.6	Confident	130 Å²	130	70.5 Å²	70.5	57%	0.565	35%	0.345	S	S	*	.	H	α-helix	trans	-63.8	-40.6	176.6	-76.5	178.4	177.9	-179.4	0	112.6	K83 R84 F89 E90 S91	K83-K87 WeakPolarHBondContact O-CB 3.49Å; K83-K87 WeakPolarHBondContact O-CG 3.34Å; K83-K87 PolarHBondContact O-N 3.34Å; R84-K87 PolarHBondContact O-N 2.78Å; R84-K87 VanDerWaalsContact O-N 3.15Å; K87-F89 VanDerWaalsContact C-N 3.35Å; K87-E90 PolarHBondContact O-N 3.04Å; K87-S91 WeakPolarHBondContact O-CB 3.39Å; K87-S91 PolarHBondContact O-N 2.99Å; K87-S91 PolarHBondContact O-OG 3.01Å
88	T	76.1	Confident	71.6	Confident	2 Å²	2	67.9 Å²	67.9	1%	0.012	34%	0.338	C	S	.	.	H	α-helix	trans	-63.5	-43	175.4	-54.5	0	0	0	0	110.4	L54 E57 L58 R84 H85 S91 I92	L54-T88 HydrophobicContact CB-CG2 4.16Å; L54-T88 HydrophobicContact CD2-CG2 3.89Å; L54-T88 VanDerWaalsContact O-CG2 3.29Å; L54-T88 WeakPolarHBondContact O-CG2 3.38Å; E57-T88 HydrophobicContact CB-CG2 4.12Å; E57-T88 HydrophobicContact CG-CG2 4.29Å; E57-T88 PolarHBondContact OE1-OG1 2.72Å; E57-T88 PolarHBondContact OE2-OG1 3.47Å; E57-T88 VanDerWaalsContact OE2-OG1 3.05Å; L58-T88 HydrophobicContact CB-CG2 4.1Å; L58-T88 HydrophobicContact CD1-CG2 4.13Å; R84-T88 PolarHBondContact O-N 3.01Å; R84-T88 PolarHBondContact O-OG1 3.47Å; H85-T88 PolarHBondContact O-N 3.11Å; T88-S91 PolarHBondContact O-N 2.89Å; T88-I92 HydrophobicContact CG2-CD1 4.31Å; T88-I92 WeakPolarHBondContact O-CG1 3.44Å; T88-I92 PolarHBondContact O-N 2.71Å
89	F	74.4	Confident	69.8	Low	97 Å²	97	72.3 Å²	72.3	43%	0.425	36%	0.363	S	S	.	.	H	α-helix	trans	-63.9	-44.2	176.8	-160.7	-88.2	0	0	0	112.3	L58 H85 A86 K87 S91 I92 A93	L58-F89 HydrophobicContact CD1-CD2 4.2Å; H85-F89 WeakPolarHBondContact O-CB 3.16Å; H85-F89 PolarHBondContact O-N 2.98Å; A86-F89 PolarHBondContact O-N 3.22Å; K87-F89 VanDerWaalsContact C-N 3.35Å; F89-S91 VanDerWaalsContact C-N 3.29Å; F89-S91 PolarHBondContact O-N 3.24Å; F89-I92 PolarHBondContact O-N 3.12Å; F89-A93 WeakPolarHBondContact O-CB 3.27Å; F89-A93 PolarHBondContact O-N 2.79Å
90	E	71.3	Confident	67.9	Low	99 Å²	99	71.2 Å²	71.2	46%	0.463	36%	0.362	S	S	.	.	H	α-helix	trans	-59.9	-40.1	174	-166.5	-169.6	157.3	0	0	111.7	A86 K87 A93 K94	A86-E90 WeakPolarHBondContact O-CB 3.3Å; A86-E90 PolarHBondContact O-N 3.37Å; K87-E90 PolarHBondContact O-N 3.04Å; E90-A93 WeakPolarHBondContact O-CB 2.9Å; E90-A93 PolarHBondContact O-N 3.07Å; E90-K94 WeakPolarHBondContact O-CG 3.06Å; E90-K94 PolarHBondContact O-N 3.17Å; E90-K94 VanDerWaalsContact OE1-CE 3.22Å; E90-K94 WeakPolarHBondContact OE1-CE 3.4Å; E90-K94 IonicContact OE1-NZ 3.88Å; E90-K94 PolarHBondContact OE1-NZ 2.99Å
91	S	76.6	Confident	65.3	Low	46 Å²	46	73.4 Å²	73.4	32%	0.322	37%	0.37	S	S	.	.	H	α-helix	trans	-67.6	-39	176.8	-60.6	0	0	0	0	112.5	K87 T88 F89 K94 I95	K87-S91 WeakPolarHBondContact O-CB 3.39Å; K87-S91 PolarHBondContact O-N 2.99Å; K87-S91 PolarHBondContact O-OG 3.01Å; T88-S91 PolarHBondContact O-N 2.89Å; F89-S91 VanDerWaalsContact C-N 3.29Å; F89-S91 PolarHBondContact O-N 3.24Å; S91-K94 PolarHBondContact O-N 2.87Å; S91-I95 WeakPolarHBondContact O-CD1 3.12Å; S91-I95 WeakPolarHBondContact O-CG1 3.45Å; S91-I95 PolarHBondContact O-N 3.48Å; S91-I95 VanDerWaalsContact O-N 3.15Å
92	I	72.4	Confident	62.8	Low	31 Å²	31	80.4 Å²	80.4	16%	0.159	40%	0.4	C	S	.	.	H	α-helix	trans	-61.6	-48.4	171.4	-68.3	168.1	0	0	0	109.2	L51 L54 L58 T88 F89 K94 I95 T96	L51-I92 HydrophobicContact CD1-CG2 4.28Å; L54-I92 HydrophobicContact CB-CD1 4.08Å; L54-I92 HydrophobicContact CB-CG1 3.62Å; L54-I92 HydrophobicContact CD1-CG1 3.98Å; L54-I92 HydrophobicContact CG-CG1 4.38Å; L58-I92 HydrophobicContact CD1-CD1 4.17Å; T88-I92 HydrophobicContact CG2-CD1 4.31Å; T88-I92 WeakPolarHBondContact O-CG1 3.44Å; T88-I92 PolarHBondContact O-N 2.71Å; F89-I92 PolarHBondContact O-N 3.12Å; I92-K94 VanDerWaalsContact C-N 3.29Å; I92-K94 PolarHBondContact O-N 2.76Å; I92-I95 PolarHBondContact O-N 3.46Å; I92-T96 HydrophobicContact CG2-CG2 4.28Å; I92-T96 PolarHBondContact O-N 3.35Å; I92-T96 PolarHBondContact O-OG1 3.07Å
93	A	65.3	Low	60.6	Low	48 Å²	48	84.1 Å²	84.1	40%	0.397	42%	0.419	S	S	.	.	H	α-helix	trans	-57.8	-40	-179.9	0	0	0	0	0	112.4	F89 E90 T96 D97	F89-A93 WeakPolarHBondContact O-CB 3.27Å; F89-A93 PolarHBondContact O-N 2.79Å; E90-A93 WeakPolarHBondContact O-CB 2.9Å; E90-A93 PolarHBondContact O-N 3.07Å; A93-T96 WeakPolarHBondContact CA-OG1 3.4Å; A93-T96 CarbonylContact O-C 3.53Å; A93-T96 PolarHBondContact O-N 3.47Å; A93-T96 PolarHBondContact O-OG1 3.31Å; A93-D97 PolarHBondContact O-N 3.14Å; A93-D97 VanDerWaalsContact O-N 3.11Å
94	K	69.3	Low	58.4	Low	135 Å²	135	86.4 Å²	86.4	59%	0.587	43%	0.431	S	S	*	.	H	α-helix	trans	-67.3	-32.8	175.3	-74.2	174.3	-176.3	169.3	0	113.6	E90 S91 I92	E90-K94 WeakPolarHBondContact O-CG 3.06Å; E90-K94 PolarHBondContact O-N 3.17Å; E90-K94 VanDerWaalsContact OE1-CE 3.22Å; E90-K94 WeakPolarHBondContact OE1-CE 3.4Å; E90-K94 IonicContact OE1-NZ 3.88Å; E90-K94 PolarHBondContact OE1-NZ 2.99Å; S91-K94 PolarHBondContact O-N 2.87Å; I92-K94 VanDerWaalsContact C-N 3.29Å; I92-K94 PolarHBondContact O-N 2.76Å
95	I	64.9	Low	56.1	Low	21 Å²	21	86.3 Å²	86.3	11%	0.108	44%	0.437	C	S	.	.	H	α-helix	trans	-77.9	-33.7	175.5	-65.8	161.8	0	0	0	110.7	N47 K50 L51 L54 S91 I92 D97	N47-I95 HydrophobicContact CB-CG2 4.13Å; K50-I95 HydrophobicContact CB-CD1 4.21Å; K50-I95 HydrophobicContact CD-CD1 3.59Å; K50-I95 HydrophobicContact CD-CG1 4.22Å; K50-I95 HydrophobicContact CG-CD1 3.62Å; L51-I95 HydrophobicContact CD1-CB 4.37Å; L51-I95 HydrophobicContact CD1-CG2 3.9Å; L54-I95 HydrophobicContact CD1-CD1 3.2Å; S91-I95 WeakPolarHBondContact O-CD1 3.12Å; S91-I95 WeakPolarHBondContact O-CG1 3.45Å; S91-I95 PolarHBondContact O-N 3.48Å; S91-I95 VanDerWaalsContact O-N 3.15Å; I92-I95 PolarHBondContact O-N 3.46Å; I95-D97 VanDerWaalsContact C-N 3.29Å; I95-D97 PolarHBondContact O-N 3.26Å
96	T	57.9	Low	54.2	Low	60 Å²	60	91.8 Å²	91.8	37%	0.368	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93	24	177.8	59.4	0	0	0	0	112.7	L51 I92 A93 P98	L51-T96 HydrophobicContact CD1-CG2 3.7Å; I92-T96 HydrophobicContact CG2-CG2 4.28Å; I92-T96 PolarHBondContact O-N 3.35Å; I92-T96 PolarHBondContact O-OG1 3.07Å; A93-T96 WeakPolarHBondContact CA-OG1 3.4Å; A93-T96 CarbonylContact O-C 3.53Å; A93-T96 PolarHBondContact O-N 3.47Å; A93-T96 PolarHBondContact O-OG1 3.31Å; T96-P98 WeakPolarHBondContact O-CD 3.35Å; T96-P98 VanDerWaalsContact O-N 3.09Å
97	D	47.2	Very low	52.5	Low	65 Å²	65	97.1 Å²	97.1	35%	0.348	48%	0.484	S	S	.	.			trans	-48.7	120.6	-179.3	-167.2	-33.3	0	0	0	108.8	A93 I95 N99 I100	A93-D97 PolarHBondContact O-N 3.14Å; A93-D97 VanDerWaalsContact O-N 3.11Å; I95-D97 VanDerWaalsContact C-N 3.29Å; I95-D97 PolarHBondContact O-N 3.26Å; D97-N99 PolarHBondContact O-N 3.13Å; D97-N99 PolarHBondContact OD1-N 3.37Å; D97-I100 HydrophobicContact CB-CD1 4.29Å; D97-I100 HydrophobicContact CB-CG1 4.48Å; D97-I100 PolarHBondContact O-N 2.69Å
98	P	38.2	Very low	50.7	Low	61 Å²	61	93.2 Å²	93.2	40%	0.396	47%	0.469	S	S	.	.	G	3₁₀ helix	trans	-50.8	-30.6	-175.5	-25.9	31.5	0	0	0	112.8	T96 I100 F101 F102	T96-P98 WeakPolarHBondContact O-CD 3.35Å; T96-P98 VanDerWaalsContact O-N 3.09Å; P98-I100 PolarHBondContact O-N 3.04Å; P98-F101 PolarHBondContact O-N 3.25Å; P98-F102 HydrophobicContact CB-CD2 4.21Å; P98-F102 HydrophobicContact CB-CE2 3.9Å; P98-F102 WeakPolarHBondContact O-CD2 3.49Å; P98-F102 PolarHBondContact O-N 2.89Å
99	N	39.2	Very low	49	Very low	110 Å²	110	100.5 Å²	100.5	59%	0.588	50%	0.503	S	S	*	.	G	3₁₀ helix	trans	-65.5	-22.4	-178.4	-67.5	-31	0	0	0	114.2	D97 F101 F102	D97-N99 PolarHBondContact O-N 3.13Å; D97-N99 PolarHBondContact OD1-N 3.37Å; N99-F101 PolarHBondContact O-N 3.23Å; N99-F102 PolarHBondContact O-N 3.19Å
100	I	35.7	Very low	47.5	Very low	84 Å²	84	103 Å²	103	43%	0.431	52%	0.516	S	S	.	.	G	3₁₀ helix	trans	-73.3	-18.6	175.5	-62.3	172.3	0	0	0	111.5	D97 P98	D97-I100 HydrophobicContact CB-CD1 4.29Å; D97-I100 HydrophobicContact CB-CG1 4.48Å; D97-I100 PolarHBondContact O-N 2.69Å; P98-I100 PolarHBondContact O-N 3.04Å
101	F	29.9	Very low	46.2	Very low	143 Å²	143	107.3 Å²	107.3	63%	0.627	53%	0.528	S	S	*	.	G	3₁₀ helix	trans	-100.9	-0.8	176	-71.3	-83.1	0	0	0	113.9	P98 N99	P98-F101 PolarHBondContact O-N 3.25Å; N99-F101 PolarHBondContact O-N 3.23Å
102	F	29.1	Very low	44.5	Very low	158 Å²	158	109.7 Å²	109.7	69%	0.693	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.3	-2.9	-179	-69.3	-64.4	0	0	0	114.6	P98 N99 H104	P98-F102 HydrophobicContact CB-CD2 4.21Å; P98-F102 HydrophobicContact CB-CE2 3.9Å; P98-F102 WeakPolarHBondContact O-CD2 3.49Å; P98-F102 PolarHBondContact O-N 2.89Å; N99-F102 PolarHBondContact O-N 3.19Å; F102-H104 VanDerWaalsContact C-N 3.32Å; F102-H104 PolarHBondContact O-N 3.25Å
103	E	30.5	Very low	43	Very low	159 Å²	159	113.4 Å²	113.4	74%	0.743	55%	0.553	S	S	*	*	S	Bend	trans	-83	1.5	178.3	-96.1	-174.2	169.8	0	0	115.5
104	H	35.3	Very low	42	Very low	160 Å²	160	115.3 Å²	115.3	74%	0.741	56%	0.557	S	S	*	*	S	Bend	trans	-134.2	75.7	173.6	-71.4	-69.2	0	0	0	110.4	F102	F102-H104 VanDerWaalsContact C-N 3.32Å; F102-H104 PolarHBondContact O-N 3.25Å
105	N	32.9	Very low	40.6	Very low	95 Å²	95	110.4 Å²	110.4	51%	0.508	54%	0.544	S	S	.	.			trans	-159.6	35.1	160.4	-111.6	0.3	0	0	0	116.2	E107 D108	N105-E107 PolarHBondContact O-N 3Å; N105-D108 HydrophobicContact CB-CB 4.29Å; N105-D108 VanDerWaalsContact CG-OD2 3.28Å; N105-D108 PolarHBondContact ND2-OD2 3.03Å; N105-D108 PolarHBondContact O-N 2.94Å; N105-D108 PolarHBondContact OD1-OD2 2.95Å; N105-D108 VanDerWaalsContact OD1-OD2 3.13Å
106	N	37.9	Very low	39.1	Very low	166 Å²	166	116.5 Å²	116.5	89%	0.888	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.5	6.6	166.3	-82.4	-7.4	0	0	0	113.7
107	E	37.3	Very low	38.2	Very low	169 Å²	169	119.4 Å²	119.4	79%	0.79	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.8	-3.2	174.7	-67.4	-174	163.6	0	0	113.4	N105	N105-E107 PolarHBondContact O-N 3Å
108	D	42.3	Very low	37.7	Very low	48 Å²	48	126.4 Å²	126.4	26%	0.257	60%	0.599	S	S	.	*	H	α-helix	trans	-92.7	-14.9	-179.7	-101.7	-8.1	0	0	0	113.5	N105 R111 I112	N105-D108 HydrophobicContact CB-CB 4.29Å; N105-D108 VanDerWaalsContact CG-OD2 3.28Å; N105-D108 PolarHBondContact ND2-OD2 3.03Å; N105-D108 PolarHBondContact O-N 2.94Å; N105-D108 PolarHBondContact OD1-OD2 2.95Å; N105-D108 VanDerWaalsContact OD1-OD2 3.13Å; D108-R111 PolarHBondContact O-N 2.84Å; D108-I112 HydrophobicContact CB-CD1 4.4Å; D108-I112 VanDerWaalsContact O-CB 3.23Å; D108-I112 WeakPolarHBondContact O-CB 2.67Å; D108-I112 WeakPolarHBondContact O-CD1 3.33Å; D108-I112 WeakPolarHBondContact O-CG1 3.31Å; D108-I112 PolarHBondContact O-N 3.08Å
109	E	41.9	Very low	37.7	Very low	156 Å²	156	131.2 Å²	131.2	73%	0.729	61%	0.614	S	S	*	*	H	α-helix	trans	-68.8	-42.8	174	-77.6	-168.9	150.3	0	0	112	R111 E113	E109-R111 VanDerWaalsContact C-N 3.32Å; E109-R111 PolarHBondContact O-N 2.93Å; E109-E113 VanDerWaalsContact O-CB 3.27Å; E109-E113 WeakPolarHBondContact O-CB 3.29Å; E109-E113 PolarHBondContact O-N 3.2Å
110	E	42	Very low	37.5	Very low	150 Å²	150	135.8 Å²	135.8	70%	0.701	62%	0.623	S	S	*	*	H	α-helix	trans	-70.2	-28.3	173.1	-78.2	-166.6	153.5	0	0	112.7	N114	E110-N114 WeakPolarHBondContact O-CB 3.45Å; E110-N114 VanDerWaalsContact O-CG 3.29Å; E110-N114 PolarHBondContact O-N 2.78Å; E110-N114 PolarHBondContact O-ND2 2.84Å
111	R	43.5	Very low	37.5	Very low	188 Å²	188	139.9 Å²	139.9	71%	0.709	64%	0.64	S	S	*	*	H	α-helix	trans	-80.7	-32.9	-179.7	-157.6	178.5	175.2	179.2	2.4	112.6	D108 E109 G115	D108-R111 PolarHBondContact O-N 2.84Å; E109-R111 VanDerWaalsContact C-N 3.32Å; E109-R111 PolarHBondContact O-N 2.93Å; R111-G115 WeakPolarHBondContact O-CA 3.45Å; R111-G115 PolarHBondContact O-N 3.09Å
112	I	42.3	Very low	37.6	Very low	96 Å²	96	142.3 Å²	142.3	49%	0.492	65%	0.65	S	S	.	*	H	α-helix	trans	-71.2	-42.8	169.6	-69.1	167.2	0	0	0	109	D108 N114 G115 F116	D108-I112 HydrophobicContact CB-CD1 4.4Å; D108-I112 VanDerWaalsContact O-CB 3.23Å; D108-I112 WeakPolarHBondContact O-CB 2.67Å; D108-I112 WeakPolarHBondContact O-CD1 3.33Å; D108-I112 WeakPolarHBondContact O-CG1 3.31Å; D108-I112 PolarHBondContact O-N 3.08Å; I112-N114 PolarHBondContact O-N 3.47Å; I112-G115 CarbonylContact O-C 3.37Å; I112-G115 PolarHBondContact O-N 3.22Å; I112-F116 HydrophobicContact CG2-CD2 3.7Å; I112-F116 HydrophobicContact CG2-CE2 3.64Å; I112-F116 WeakPolarHBondContact O-CD2 3.44Å; I112-F116 PolarHBondContact O-N 3.36Å
113	E	39.9	Very low	37.8	Very low	109 Å²	109	145 Å²	145	51%	0.509	66%	0.656	S	S	.	*	H	α-helix	trans	-65.3	-38.8	176.7	-154.2	-171.1	147.6	0	0	112.5	E109 K117	E109-E113 VanDerWaalsContact O-CB 3.27Å; E109-E113 WeakPolarHBondContact O-CB 3.29Å; E109-E113 PolarHBondContact O-N 3.2Å; E113-K117 PolarHBondContact O-N 3.07Å; E113-K117 VanDerWaalsContact O-N 3.13Å; E113-K117 IonicContact OE1-NZ 2.69Å; E113-K117 PolarHBondContact OE1-NZ 3.35Å
114	N	45.4	Very low	37.9	Very low	89 Å²	89	146.3 Å²	146.3	48%	0.476	66%	0.659	S	S	.	*	H	α-helix	trans	-77.7	-22.5	172.7	-73.9	-41.8	0	0	0	113.6	E110 I112 R118	E110-N114 WeakPolarHBondContact O-CB 3.45Å; E110-N114 VanDerWaalsContact O-CG 3.29Å; E110-N114 PolarHBondContact O-N 2.78Å; E110-N114 PolarHBondContact O-ND2 2.84Å; I112-N114 PolarHBondContact O-N 3.47Å; N114-R118 WeakPolarHBondContact O-CB 3.42Å; N114-R118 PolarHBondContact O-N 3.44Å
115	G	38.5	Very low	37.7	Very low	31 Å²	31	149.3 Å²	149.3	32%	0.32	67%	0.665	S	S	.	*	H	α-helix	trans	-74.2	-30.2	171.2	0	0	0	0	0	113.4	R111 I112 K119	R111-G115 WeakPolarHBondContact O-CA 3.45Å; R111-G115 PolarHBondContact O-N 3.09Å; I112-G115 CarbonylContact O-C 3.37Å; I112-G115 PolarHBondContact O-N 3.22Å; G115-K119 PolarHBondContact O-N 2.95Å
116	F	34.5	Very low	38.1	Very low	150 Å²	150	150.1 Å²	150.1	66%	0.658	67%	0.67	S	S	*	*	H	α-helix	trans	-78.4	-29.6	170.1	-84.1	-76.2	0	0	0	112.4	I112	I112-F116 HydrophobicContact CG2-CD2 3.7Å; I112-F116 HydrophobicContact CG2-CE2 3.64Å; I112-F116 WeakPolarHBondContact O-CD2 3.44Å; I112-F116 PolarHBondContact O-N 3.36Å
117	K	38.4	Very low	38.2	Very low	120 Å²	120	146.1 Å²	146.1	52%	0.522	66%	0.655	S	S	.	*	H	α-helix	trans	-74.8	-36.1	172.5	-75.8	168.6	179.2	156	0	112.9	E113	E113-K117 PolarHBondContact O-N 3.07Å; E113-K117 VanDerWaalsContact O-N 3.13Å; E113-K117 IonicContact OE1-NZ 2.69Å; E113-K117 PolarHBondContact OE1-NZ 3.35Å
118	R	37.5	Very low	38.1	Very low	213 Å²	213	143.8 Å²	143.8	80%	0.804	65%	0.648	S	S	*	*	H	α-helix	trans	-78.9	-15.1	175.2	-78.4	-178.6	172.7	180	-0.7	115.7	N114	N114-R118 WeakPolarHBondContact O-CB 3.42Å; N114-R118 PolarHBondContact O-N 3.44Å
119	K	37.2	Very low	38	Very low	161 Å²	161	144.3 Å²	144.3	70%	0.7	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.4	1.9	172.3	-78.3	-176.9	179.1	175.3	0	114.4	G115	G115-K119 PolarHBondContact O-N 2.95Å
120	R	34.6	Very low	37.9	Very low	206 Å²	206	145.8 Å²	145.8	78%	0.777	65%	0.654	S	S	*	*	S	Bend	trans	-83.6	-18.7	169.6	-87	-177.3	174.4	179.3	-0.4	113.7
121	E	35.8	Very low	38.2	Very low	171 Å²	171	143.7 Å²	143.7	80%	0.799	64%	0.644	S	S	*	*	S	Bend	trans	-106.5	-4.1	-177.3	-76.6	-179.6	150	0	0	115.6
122	K	33.6	Very low	38.1	Very low	193 Å²	193	141.1 Å²	141.1	84%	0.839	64%	0.639	S	S	*	*	S	Bend	trans	-98	11.6	169.9	-80.7	-172.7	175.3	-177.4	0	114.4	K124	K122-K124 VanDerWaalsContact C-N 3.28Å; K122-K124 PolarHBondContact O-N 3.05Å
123	R	32.3	Very low	38.1	Very low	214 Å²	214	139.2 Å²	139.2	81%	0.808	64%	0.637	S	S	*	*			trans	-86.4	69.3	167.4	-65	-172.5	-168.9	-170.2	1.5	109.8
124	K	33.5	Very low	38.2	Very low	187 Å²	187	141.1 Å²	141.1	81%	0.813	64%	0.64	S	S	*	*			trans	-126.1	18.5	171.9	-137.8	-178.9	-174.2	-177.7	0	113.3	K122	K122-K124 VanDerWaalsContact C-N 3.28Å; K122-K124 PolarHBondContact O-N 3.05Å
125	Y	30.2	Very low	38.3	Very low	223 Å²	223	143.7 Å²	143.7	88%	0.875	65%	0.647	S	S	*	*	S	Bend	trans	-132.9	137.9	170.6	-80	-89.3	0	0	0	108.3
126	D	41.3	Very low	38.6	Very low	113 Å²	113	146.6 Å²	146.6	60%	0.604	65%	0.654	S	S	*	*			trans	91.5	17.3	-177	-96.1	9.6	0	0	0	120	D128 S129 W130	D126-D128 PolarHBondContact O-N 3.47Å; D126-S129 WeakPolarHBondContact OD1-CB 3.4Å; D126-S129 PolarHBondContact OD1-OG 3.49Å; D126-W130 PolarHBondContact O-N 2.88Å
127	S	39.4	Very low	38.6	Very low	82 Å²	82	148.3 Å²	148.3	57%	0.573	66%	0.656	S	S	*	*	H	α-helix	trans	-62.6	-34.9	162.5	64.3	0	0	0	0	111.7	E131	S127-E131 VanDerWaalsContact O-CB 3.3Å; S127-E131 WeakPolarHBondContact O-CB 3.18Å; S127-E131 PolarHBondContact O-N 2.82Å
128	D	36.6	Very low	38.7	Very low	119 Å²	119	147.7 Å²	147.7	64%	0.636	66%	0.659	S	S	*	*	H	α-helix	trans	-78.8	-36	-175	-63.3	-4.2	0	0	0	112.2	D126 F132	D126-D128 PolarHBondContact O-N 3.47Å; D128-F132 WeakPolarHBondContact O-CA 3.47Å; D128-F132 WeakPolarHBondContact O-CB 3.33Å; D128-F132 PolarHBondContact O-N 3.25Å
129	S	39.9	Very low	39	Very low	60 Å²	60	142.1 Å²	142.1	42%	0.42	64%	0.641	S	S	.	*	H	α-helix	trans	-70	-33	176.3	-52.2	0	0	0	0	112.5	D126 A133	D126-S129 WeakPolarHBondContact OD1-CB 3.4Å; D126-S129 PolarHBondContact OD1-OG 3.49Å; S129-A133 WeakPolarHBondContact O-CB 3.21Å; S129-A133 PolarHBondContact O-N 2.76Å
130	W	40.7	Very low	39	Very low	186 Å²	186	141.7 Å²	141.7	71%	0.705	64%	0.639	S	S	*	*	H	α-helix	trans	-81.7	-38	177.3	-155.1	67.2	0	0	0	112.2	D126 F132 R134	D126-W130 PolarHBondContact O-N 2.88Å; W130-F132 VanDerWaalsContact C-N 3.33Å; W130-R134 VanDerWaalsContact O-CB 3.22Å; W130-R134 WeakPolarHBondContact O-CB 3.39Å; W130-R134 PolarHBondContact O-N 2.76Å
131	E	46.3	Very low	39.1	Very low	106 Å²	106	139.4 Å²	139.4	50%	0.495	63%	0.634	S	S	.	*	H	α-helix	trans	-66.2	-33	167.4	-83.1	-166.2	145.3	0	0	112.4	S127 R134 K135	S127-E131 VanDerWaalsContact O-CB 3.3Å; S127-E131 WeakPolarHBondContact O-CB 3.18Å; S127-E131 PolarHBondContact O-N 2.82Å; E131-R134 CarbonylContact O-C 3.24Å; E131-R134 PolarHBondContact O-N 3.36Å; E131-K135 VanDerWaalsContact O-CB 3.3Å; E131-K135 WeakPolarHBondContact O-CB 3.46Å; E131-K135 WeakPolarHBondContact O-CG 3.23Å; E131-K135 PolarHBondContact O-N 3.27Å
132	F	41.7	Very low	39.1	Very low	135 Å²	135	137 Å²	137	59%	0.592	62%	0.623	S	S	*	*	H	α-helix	trans	-66.9	-47.4	173.4	-178.8	-106.5	0	0	0	111.6	D128 W130 R134 K135 L136	D128-F132 WeakPolarHBondContact O-CA 3.47Å; D128-F132 WeakPolarHBondContact O-CB 3.33Å; D128-F132 PolarHBondContact O-N 3.25Å; W130-F132 VanDerWaalsContact C-N 3.33Å; F132-R134 PolarHBondContact O-N 3.03Å; F132-K135 PolarHBondContact O-N 3.08Å; F132-L136 HydrophobicContact CD1-CD1 3.74Å; F132-L136 HydrophobicContact CE1-CD1 3.25Å; F132-L136 HydrophobicContact CE2-CD1 4.11Å; F132-L136 HydrophobicContact CG-CD1 4.36Å; F132-L136 HydrophobicContact CZ-CD1 3.46Å; F132-L136 VanDerWaalsContact CZ-CD1 3.46Å; F132-L136 WeakPolarHBondContact O-CB 3.23Å; F132-L136 PolarHBondContact O-N 3.46Å
133	A	42.2	Very low	39.3	Very low	55 Å²	55	130.8 Å²	130.8	46%	0.455	60%	0.599	S	S	.	*	H	α-helix	trans	-63.4	-29.9	173.9	0	0	0	0	0	112.6	S129 R137	S129-A133 WeakPolarHBondContact O-CB 3.21Å; S129-A133 PolarHBondContact O-N 2.76Å; A133-R137 VanDerWaalsContact O-CB 3.25Å; A133-R137 WeakPolarHBondContact O-CB 3.48Å; A133-R137 PolarHBondContact O-N 3.1Å; A133-R137 VanDerWaalsContact O-N 3.08Å
134	R	41.9	Very low	39.6	Very low	150 Å²	150	128.1 Å²	128.1	57%	0.566	60%	0.597	S	S	*	*	H	α-helix	trans	-76.6	-39	174.7	-165.1	175.4	177.6	-177.4	-3.2	112.1	W130 E131 F132 R137 N138	W130-R134 VanDerWaalsContact O-CB 3.22Å; W130-R134 WeakPolarHBondContact O-CB 3.39Å; W130-R134 PolarHBondContact O-N 2.76Å; E131-R134 CarbonylContact O-C 3.24Å; E131-R134 PolarHBondContact O-N 3.36Å; F132-R134 PolarHBondContact O-N 3.03Å; R134-R137 PolarHBondContact O-N 3.17Å; R134-N138 WeakPolarHBondContact O-CB 3.27Å; R134-N138 PolarHBondContact O-N 3.12Å
135	K	48.6	Very low	40.2	Very low	143 Å²	143	127.2 Å²	127.2	62%	0.622	60%	0.596	S	S	*	*	H	α-helix	trans	-64.1	-43.9	170.7	-82.6	177.3	177	173.8	0	111.4	E131 F132 R137 N138 K139	E131-K135 VanDerWaalsContact O-CB 3.3Å; E131-K135 WeakPolarHBondContact O-CB 3.46Å; E131-K135 WeakPolarHBondContact O-CG 3.23Å; E131-K135 PolarHBondContact O-N 3.27Å; F132-K135 PolarHBondContact O-N 3.08Å; K135-R137 VanDerWaalsContact C-N 3.32Å; K135-R137 PolarHBondContact O-N 2.9Å; K135-N138 PolarHBondContact O-N 3.28Å; K135-K139 WeakPolarHBondContact O-CB 3.41Å; K135-K139 PolarHBondContact O-N 3.05Å
136	L	43.5	Very low	40.6	Very low	91 Å²	91	119 Å²	119	48%	0.476	57%	0.567	S	S	.	*	H	α-helix	trans	-63.4	-34.6	173.5	-104.5	149.4	0	0	0	112.7	F132 K140	F132-L136 HydrophobicContact CD1-CD1 3.74Å; F132-L136 HydrophobicContact CE1-CD1 3.25Å; F132-L136 HydrophobicContact CE2-CD1 4.11Å; F132-L136 HydrophobicContact CG-CD1 4.36Å; F132-L136 HydrophobicContact CZ-CD1 3.46Å; F132-L136 VanDerWaalsContact CZ-CD1 3.46Å; F132-L136 WeakPolarHBondContact O-CB 3.23Å; F132-L136 PolarHBondContact O-N 3.46Å; L136-K140 WeakPolarHBondContact O-CB 3.18Å; L136-K140 PolarHBondContact O-N 2.82Å
137	R	35.7	Very low	41.5	Very low	186 Å²	186	116.2 Å²	116.2	70%	0.702	56%	0.556	S	S	*	*	H	α-helix	trans	-77.1	-30	177.5	-157.7	179.5	-151.6	-167.8	5.4	113	A133 R134 K135 F141	A133-R137 VanDerWaalsContact O-CB 3.25Å; A133-R137 WeakPolarHBondContact O-CB 3.48Å; A133-R137 PolarHBondContact O-N 3.1Å; A133-R137 VanDerWaalsContact O-N 3.08Å; R134-R137 PolarHBondContact O-N 3.17Å; K135-R137 VanDerWaalsContact C-N 3.32Å; K135-R137 PolarHBondContact O-N 2.9Å; R137-F141 WeakPolarHBondContact O-CD2 3.13Å
138	N	41.1	Very low	42.5	Very low	107 Å²	107	119.1 Å²	119.1	57%	0.572	57%	0.566	S	S	*	*	H	α-helix	trans	-79.1	-37.6	173.4	-74.2	-6.9	0	0	0	111.5	R134 K135 K140 F141	R134-N138 WeakPolarHBondContact O-CB 3.27Å; R134-N138 PolarHBondContact O-N 3.12Å; K135-N138 PolarHBondContact O-N 3.28Å; N138-K140 VanDerWaalsContact C-N 3.31Å; N138-K140 PolarHBondContact O-N 3.39Å; N138-F141 PolarHBondContact O-N 2.9Å
139	K	42.3	Very low	43.9	Very low	97 Å²	97	119.8 Å²	119.8	42%	0.422	57%	0.569	S	S	.	*	H	α-helix	trans	-67.4	-26.6	169.7	-82	-166.3	163.3	-160	0	113.2	K135 F141 E142 I143 E154	K135-K139 WeakPolarHBondContact O-CB 3.41Å; K135-K139 PolarHBondContact O-N 3.05Å; K139-F141 PolarHBondContact O-N 3.43Å; K139-E142 CarbonylContact O-C 3.59Å; K139-E142 WeakPolarHBondContact O-CA 3.35Å; K139-E142 PolarHBondContact O-N 2.9Å; K139-I143 WeakPolarHBondContact O-CG1 3.26Å; K139-I143 PolarHBondContact O-N 3.45Å; K139-E154 IonicContact NZ-OE1 2.79Å; K139-E154 PolarHBondContact NZ-OE1 3.38Å
140	K	38.8	Very low	45	Very low	152 Å²	152	121.4 Å²	121.4	66%	0.661	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.3	-15.7	176.9	-149.6	173.8	-176	172.5	0	114.4	L136 N138	L136-K140 WeakPolarHBondContact O-CB 3.18Å; L136-K140 PolarHBondContact O-N 2.82Å; N138-K140 VanDerWaalsContact C-N 3.31Å; N138-K140 PolarHBondContact O-N 3.39Å
141	F	35.5	Very low	45.7	Very low	157 Å²	157	116.1 Å²	116.1	69%	0.689	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96	-18.8	173.3	-71.4	-82.4	0	0	0	113.3	R137 N138 K139	R137-F141 WeakPolarHBondContact O-CD2 3.13Å; N138-F141 PolarHBondContact O-N 2.9Å; K139-F141 PolarHBondContact O-N 3.43Å
142	E	36.8	Very low	46.3	Very low	121 Å²	121	116.6 Å²	116.6	57%	0.565	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	-22.6	171.8	-73	170.9	162	0	0	112.5	K139 M144 E145	K139-E142 CarbonylContact O-C 3.59Å; K139-E142 WeakPolarHBondContact O-CA 3.35Å; K139-E142 PolarHBondContact O-N 2.9Å; E142-M144 PolarHBondContact O-N 2.88Å; E142-M144 VanDerWaalsContact O-N 3.08Å; E142-E145 PolarHBondContact O-N 3.29Å
143	I	37.5	Very low	47.7	Very low	63 Å²	63	117.5 Å²	117.5	32%	0.323	56%	0.561	S	S	.	*	T	Hydrogen-bonded Turn	trans	-62.5	-16.2	176.4	-67.2	168.1	0	0	0	113	K139 E145 L146 L151	K139-I143 WeakPolarHBondContact O-CG1 3.26Å; K139-I143 PolarHBondContact O-N 3.45Å; I143-E145 PolarHBondContact O-N 3.35Å; I143-L146 HydrophobicContact CB-CD1 4.36Å; I143-L146 HydrophobicContact CG1-CD1 4.05Å; I143-L151 HydrophobicContact CG2-CD1 4.32Å
144	M	37.4	Very low	48.4	Very low	157 Å²	157	118.1 Å²	118.1	77%	0.773	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	-7.1	173.8	-75.2	-169.1	-58.1	0	0	113.9	E142	E142-M144 PolarHBondContact O-N 2.88Å; E142-M144 VanDerWaalsContact O-N 3.08Å
145	E	46.6	Very low	49	Very low	169 Å²	169	116.1 Å²	116.1	79%	0.79	55%	0.548	S	S	*	.	S	Bend	trans	-113.1	-3.5	179.9	-66.4	-178.9	170.4	0	0	113.3	E142 I143	E142-E145 PolarHBondContact O-N 3.29Å; I143-E145 PolarHBondContact O-N 3.35Å
146	L	40.1	Very low	49.8	Very low	49 Å²	49	113.9 Å²	113.9	26%	0.257	54%	0.54	S	S	.	.			trans	-75	130.6	178.4	-64.9	173.9	0	0	0	110.7	I143 E150 L151	I143-L146 HydrophobicContact CB-CD1 4.36Å; I143-L146 HydrophobicContact CG1-CD1 4.05Å; L146-E150 HydrophobicContact CB-CB 4.17Å; L146-E150 HydrophobicContact CD2-CB 3.87Å; L146-L151 HydrophobicContact CB-CD1 4.07Å; L146-L151 HydrophobicContact CB-CG 4.31Å; L146-L151 HydrophobicContact CD1-CG 4.37Å
147	S	58.4	Low	50.8	Low	56 Å²	56	115.1 Å²	115.1	39%	0.392	54%	0.543	S	S	.	.			trans	-63.1	156.6	166.3	60.2	0	0	0	0	110.9	D149 E150 L151	S147-D149 PolarHBondContact O-N 3.07Å; S147-D149 VanDerWaalsContact O-N 3.09Å; S147-E150 WeakPolarHBondContact CB-OE2 3.28Å; S147-E150 PolarHBondContact N-OE2 3.2Å; S147-E150 PolarHBondContact O-N 2.87Å; S147-E150 VanDerWaalsContact OG-CD 3.28Å; S147-E150 VanDerWaalsContact OG-CG 3.31Å; S147-E150 WeakPolarHBondContact OG-CG 3.4Å; S147-E150 PolarHBondContact OG-OE2 3.47Å; S147-L151 PolarHBondContact O-N 3.12Å
148	D	60.3	Low	51.2	Low	143 Å²	143	110.2 Å²	110.2	77%	0.765	53%	0.533	S	S	*	.	H	α-helix	trans	-52.2	-34.2	178.5	-73.7	-27.2	0	0	0	111.8	Q152	D148-Q152 WeakPolarHBondContact O-CB 3.33Å; D148-Q152 PolarHBondContact O-N 2.88Å
149	D	67.4	Low	51.3	Low	133 Å²	133	108.3 Å²	108.3	71%	0.711	53%	0.526	S	S	*	.	H	α-helix	trans	-70.6	-37.7	178.4	-66.2	-25.9	0	0	0	113.3	S147 K153	S147-D149 PolarHBondContact O-N 3.07Å; S147-D149 VanDerWaalsContact O-N 3.09Å; D149-K153 WeakPolarHBondContact O-CB 3.27Å; D149-K153 PolarHBondContact O-N 3.38Å
150	E	63.5	Low	52	Low	93 Å²	93	111.6 Å²	111.6	44%	0.435	54%	0.54	S	S	.	.	H	α-helix	trans	-73.7	-36.3	178.5	-68.8	165.7	132.5	0	0	111.6	L146 S147 K153 E154	L146-E150 HydrophobicContact CB-CB 4.17Å; L146-E150 HydrophobicContact CD2-CB 3.87Å; S147-E150 WeakPolarHBondContact CB-OE2 3.28Å; S147-E150 PolarHBondContact N-OE2 3.2Å; S147-E150 PolarHBondContact O-N 2.87Å; S147-E150 VanDerWaalsContact OG-CD 3.28Å; S147-E150 VanDerWaalsContact OG-CG 3.31Å; S147-E150 WeakPolarHBondContact OG-CG 3.4Å; S147-E150 PolarHBondContact OG-OE2 3.47Å; E150-K153 PolarHBondContact O-N 2.94Å; E150-E154 PolarHBondContact O-N 2.86Å
151	L	54.7	Low	52.3	Low	76 Å²	76	111.5 Å²	111.5	40%	0.398	54%	0.541	S	S	.	.	H	α-helix	trans	-65.9	-41.1	175	-122.2	147.5	0	0	0	111.3	I143 L146 S147 Y155	I143-L151 HydrophobicContact CG2-CD1 4.32Å; L146-L151 HydrophobicContact CB-CD1 4.07Å; L146-L151 HydrophobicContact CB-CG 4.31Å; L146-L151 HydrophobicContact CD1-CG 4.37Å; S147-L151 PolarHBondContact O-N 3.12Å; L151-Y155 WeakPolarHBondContact O-CB 3.35Å; L151-Y155 PolarHBondContact O-N 3.25Å
152	Q	58.7	Low	52.3	Low	115 Å²	115	107 Å²	107	54%	0.537	53%	0.527	S	S	.	.	H	α-helix	trans	-63.5	-44.3	173.7	-169.4	83.4	12.3	0	0	111.2	D148 Y155 E156	D148-Q152 WeakPolarHBondContact O-CB 3.33Å; D148-Q152 PolarHBondContact O-N 2.88Å; Q152-Y155 PolarHBondContact O-N 3.04Å; Q152-E156 WeakPolarHBondContact O-CB 3.48Å; Q152-E156 VanDerWaalsContact O-CG 3.3Å; Q152-E156 WeakPolarHBondContact O-CG 3.48Å; Q152-E156 PolarHBondContact O-N 2.94Å
153	K	70.9	Confident	52.3	Low	155 Å²	155	106.2 Å²	106.2	67%	0.674	53%	0.532	S	S	*	.	H	α-helix	trans	-67.2	-44.9	-179.4	-166	176.9	-178.7	-178.2	0	112.9	D149 E150 Y155 E156 E157	D149-K153 WeakPolarHBondContact O-CB 3.27Å; D149-K153 PolarHBondContact O-N 3.38Å; E150-K153 PolarHBondContact O-N 2.94Å; K153-Y155 VanDerWaalsContact C-N 3.34Å; K153-E156 PolarHBondContact O-N 3.44Å; K153-E157 WeakPolarHBondContact O-CB 3.08Å; K153-E157 PolarHBondContact O-N 3Å; K153-E157 VanDerWaalsContact O-N 3.09Å
154	E	57.8	Low	52.1	Low	68 Å²	68	109.5 Å²	109.5	32%	0.318	56%	0.555	S	S	.	*	H	α-helix	trans	-65.8	-37.7	174.2	-84.3	-156.3	151.9	0	0	111.3	K139 E150 E157 V158	K139-E154 IonicContact NZ-OE1 2.79Å; K139-E154 PolarHBondContact NZ-OE1 3.38Å; E150-E154 PolarHBondContact O-N 2.86Å; E154-E157 PolarHBondContact O-N 2.78Å; E154-V158 WeakPolarHBondContact O-CB 3.31Å; E154-V158 VanDerWaalsContact O-CG2 3.23Å; E154-V158 WeakPolarHBondContact O-CG2 3.48Å; E154-V158 PolarHBondContact O-N 2.87Å
155	Y	52.8	Low	51.8	Low	107 Å²	107	108.1 Å²	108.1	42%	0.42	55%	0.551	S	S	.	*	H	α-helix	trans	-64.5	-45.6	176.1	-177.7	-100.5	0	0	0	111.9	L151 Q152 K153 E157 V158 V159	L151-Y155 WeakPolarHBondContact O-CB 3.35Å; L151-Y155 PolarHBondContact O-N 3.25Å; Q152-Y155 PolarHBondContact O-N 3.04Å; K153-Y155 VanDerWaalsContact C-N 3.34Å; Y155-E157 VanDerWaalsContact C-N 3.26Å; Y155-E157 PolarHBondContact O-N 3.21Å; Y155-V158 PolarHBondContact O-N 3.12Å; Y155-V159 HydrophobicContact CD1-CG2 3.96Å; Y155-V159 HydrophobicContact CD2-CG2 4.34Å; Y155-V159 HydrophobicContact CE1-CG2 3.61Å; Y155-V159 HydrophobicContact CE2-CG2 4.01Å; Y155-V159 HydrophobicContact CG-CG2 4.31Å; Y155-V159 WeakPolarHBondContact O-CB 3.27Å; Y155-V159 WeakPolarHBondContact O-CG2 3.35Å; Y155-V159 PolarHBondContact O-N 3.2Å
156	E	66.5	Low	51.1	Low	97 Å²	97	107.4 Å²	107.4	45%	0.453	55%	0.551	S	S	.	*	H	α-helix	trans	-60.3	-35.9	175.3	-76.7	176.4	-172.1	0	0	112.3	Q152 K153 K160	Q152-E156 WeakPolarHBondContact O-CB 3.48Å; Q152-E156 VanDerWaalsContact O-CG 3.3Å; Q152-E156 WeakPolarHBondContact O-CG 3.48Å; Q152-E156 PolarHBondContact O-N 2.94Å; K153-E156 PolarHBondContact O-N 3.44Å; E156-K160 VanDerWaalsContact O-CG 3.27Å; E156-K160 WeakPolarHBondContact O-CG 3.09Å; E156-K160 PolarHBondContact O-N 3.42Å; E156-K160 VanDerWaalsContact O-N 3.07Å
157	E	63.3	Low	50.8	Low	117 Å²	117	109.3 Å²	109.3	55%	0.547	57%	0.565	S	S	.	*	H	α-helix	trans	-69.6	-41.2	176	-154	169	-155.7	0	0	111.7	K153 E154 Y155 K160 H161	K153-E157 WeakPolarHBondContact O-CB 3.08Å; K153-E157 PolarHBondContact O-N 3Å; K153-E157 VanDerWaalsContact O-N 3.09Å; E154-E157 PolarHBondContact O-N 2.78Å; Y155-E157 VanDerWaalsContact C-N 3.26Å; Y155-E157 PolarHBondContact O-N 3.21Å; E157-K160 PolarHBondContact O-N 3.29Å; E157-H161 PolarHBondContact O-CD2 2.99Å; E157-H161 PolarHBondContact O-N 3.08Å
158	V	44	Very low	49.6	Very low	83 Å²	83	110.5 Å²	110.5	50%	0.503	57%	0.571	S	S	.	*	H	α-helix	trans	-69.5	-37	176.4	171.7	0	0	0	0	112	E154 Y155 H161 T162	E154-V158 WeakPolarHBondContact O-CB 3.31Å; E154-V158 VanDerWaalsContact O-CG2 3.23Å; E154-V158 WeakPolarHBondContact O-CG2 3.48Å; E154-V158 PolarHBondContact O-N 2.87Å; Y155-V158 PolarHBondContact O-N 3.12Å; V158-H161 PolarHBondContact O-N 3.15Å; V158-T162 PolarHBondContact O-N 2.92Å; V158-T162 PolarHBondContact O-OG1 3.09Å
159	V	45.2	Very low	48.5	Very low	67 Å²	67	107.6 Å²	107.6	41%	0.406	56%	0.558	S	S	.	*	H	α-helix	trans	-69.5	-34.2	177.1	171.3	0	0	0	0	111.4	Y155 H161	Y155-V159 HydrophobicContact CD1-CG2 3.96Å; Y155-V159 HydrophobicContact CD2-CG2 4.34Å; Y155-V159 HydrophobicContact CE1-CG2 3.61Å; Y155-V159 HydrophobicContact CE2-CG2 4.01Å; Y155-V159 HydrophobicContact CG-CG2 4.31Å; Y155-V159 WeakPolarHBondContact O-CB 3.27Å; Y155-V159 WeakPolarHBondContact O-CG2 3.35Å; Y155-V159 PolarHBondContact O-N 3.2Å; V159-H161 VanDerWaalsContact C-N 3.25Å; V159-H161 PolarHBondContact O-N 2.87Å
160	K	55.5	Low	47.2	Very low	165 Å²	165	106.9 Å²	106.9	72%	0.717	56%	0.555	S	S	*	*	H	α-helix	trans	-62.5	-29.5	171.7	-79.7	171.6	-176.8	172.4	0	113.2	E156 E157	E156-K160 VanDerWaalsContact O-CG 3.27Å; E156-K160 WeakPolarHBondContact O-CG 3.09Å; E156-K160 PolarHBondContact O-N 3.42Å; E156-K160 VanDerWaalsContact O-N 3.07Å; E157-K160 PolarHBondContact O-N 3.29Å
161	H	46.2	Very low	46	Very low	151 Å²	151	110 Å²	110	70%	0.699	57%	0.566	S	S	*	*	H	α-helix	trans	-104	-11.5	-174.2	-71.3	-59.2	0	0	0	115.4	E157 V158 V159	E157-H161 PolarHBondContact O-CD2 2.99Å; E157-H161 PolarHBondContact O-N 3.08Å; V158-H161 PolarHBondContact O-N 3.15Å; V159-H161 VanDerWaalsContact C-N 3.25Å; V159-H161 PolarHBondContact O-N 2.87Å
162	T	35.8	Very low	45.3	Very low	62 Å²	62	112.6 Å²	112.6	38%	0.38	58%	0.577	S	S	.	*			trans	-145	79.7	-179.4	26.1	0	0	0	0	112.3	V158 T164	V158-T162 PolarHBondContact O-N 2.92Å; V158-T162 PolarHBondContact O-OG1 3.09Å; T162-T164 PolarHBondContact O-N 3.02Å
163	P	35.3	Very low	44.3	Very low	104 Å²	104	109.8 Å²	109.8	68%	0.675	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	-2.5	-173.5	23.5	-31.9	0	0	0	115.5
164	T	34.7	Very low	43.2	Very low	132 Å²	132	111 Å²	111	81%	0.81	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.4	1.3	-174.7	31.7	0	0	0	0	115.2	T162	T162-T164 PolarHBondContact O-N 3.02Å
165	L	30.5	Very low	42.8	Very low	129 Å²	129	113.2 Å²	113.2	68%	0.675	58%	0.581	S	S	*	*			trans	-102.2	55.2	178.3	-83.8	157.4	0	0	0	112.2	V167	L165-V167 PolarHBondContact O-N 3.28Å
166	L	30.8	Very low	42.3	Very low	153 Å²	153	115.7 Å²	115.7	80%	0.801	59%	0.591	S	S	*	*			trans	-86.7	73.3	171.1	-72.5	168	0	0	0	110.6
167	V	34.5	Very low	41.6	Very low	90 Å²	90	119.6 Å²	119.6	55%	0.545	60%	0.601	S	S	.	*			trans	-113.5	113.1	154.4	-178	0	0	0	0	106.5	L165 V169	L165-V167 PolarHBondContact O-N 3.28Å; V167-V169 PolarHBondContact O-N 2.85Å
168	P	34.1	Very low	41.5	Very low	80 Å²	80	119.2 Å²	119.2	52%	0.519	60%	0.603	S	S	.	*			trans	-66.7	105.2	-178.1	24	-29.4	0	0	0	109	D170 K171	P168-D170 PolarHBondContact O-N 2.73Å; P168-K171 PolarHBondContact O-N 2.81Å
169	V	35.4	Very low	41.8	Very low	83 Å²	83	120 Å²	120	50%	0.503	60%	0.601	S	S	.	*	H	α-helix	trans	-48.2	-29.3	176.2	176.8	0	0	0	0	111.3	V167 K171 E172 V173	V167-V169 PolarHBondContact O-N 2.85Å; V169-K171 VanDerWaalsContact C-N 3.27Å; V169-K171 PolarHBondContact O-N 3.11Å; V169-E172 PolarHBondContact O-N 3.49Å; V169-V173 HydrophobicContact CG1-CG2 3.92Å; V169-V173 WeakPolarHBondContact O-CG2 3.29Å; V169-V173 PolarHBondContact O-N 2.98Å
170	D	40.9	Very low	42.4	Very low	118 Å²	118	122.3 Å²	122.3	63%	0.631	61%	0.606	S	S	*	*	H	α-helix	trans	-55.9	-32.9	175.7	-118.3	5	0	0	0	114.8	P168 R174	P168-D170 PolarHBondContact O-N 2.73Å; D170-R174 WeakPolarHBondContact O-CB 3.37Å; D170-R174 PolarHBondContact O-N 3.41Å
171	K	38.2	Very low	42.7	Very low	157 Å²	157	122.4 Å²	122.4	68%	0.683	60%	0.602	S	S	*	*	H	α-helix	trans	-78.2	-36.8	-179.1	-137.4	176.4	-173.2	177	0	111.8	P168 V169 L175	P168-K171 PolarHBondContact O-N 2.81Å; V169-K171 VanDerWaalsContact C-N 3.27Å; V169-K171 PolarHBondContact O-N 3.11Å; K171-L175 WeakPolarHBondContact O-CD1 3.16Å; K171-L175 WeakPolarHBondContact O-CG 3.49Å; K171-L175 PolarHBondContact O-N 3.02Å; K171-L175 VanDerWaalsContact O-N 3.16Å
172	E	39.3	Very low	43.3	Very low	131 Å²	131	123.8 Å²	123.8	61%	0.612	60%	0.601	S	S	*	*	H	α-helix	trans	-75.1	-37.9	177.4	-68	-169.3	160.6	0	0	111.8	V169 L175 Y176	V169-E172 PolarHBondContact O-N 3.49Å; E172-L175 PolarHBondContact O-N 2.64Å; E172-Y176 WeakPolarHBondContact O-CB 3.29Å; E172-Y176 PolarHBondContact O-N 3.31Å
173	V	38.5	Very low	44.4	Very low	56 Å²	56	127.4 Å²	127.4	34%	0.339	61%	0.607	S	S	.	*	H	α-helix	trans	-65.8	-40.3	175.2	176.1	0	0	0	0	111.3	V169 Y176 R177	V169-V173 HydrophobicContact CG1-CG2 3.92Å; V169-V173 WeakPolarHBondContact O-CG2 3.29Å; V169-V173 PolarHBondContact O-N 2.98Å; V173-Y176 PolarHBondContact O-N 2.85Å; V173-R177 WeakPolarHBondContact O-CG 3.32Å; V173-R177 PolarHBondContact O-N 3.46Å
174	R	48.1	Very low	45.7	Very low	180 Å²	180	127 Å²	127	68%	0.679	60%	0.596	S	S	*	*	H	α-helix	trans	-63.3	-44.3	172.5	-91.3	-173.5	-164.7	-177.4	6	113.1	D170 Y176 R177 N178	D170-R174 WeakPolarHBondContact O-CB 3.37Å; D170-R174 PolarHBondContact O-N 3.41Å; R174-Y176 VanDerWaalsContact C-N 3.29Å; R174-Y176 PolarHBondContact O-N 2.99Å; R174-R177 PolarHBondContact O-N 3Å; R174-N178 WeakPolarHBondContact O-CB 3.35Å; R174-N178 PolarHBondContact O-N 3.45Å
175	L	48.6	Very low	46.6	Very low	116 Å²	116	125.4 Å²	125.4	61%	0.607	58%	0.58	S	S	*	*	H	α-helix	trans	-59.2	-42.9	177.2	-79.8	165.3	0	0	0	111	K171 E172 N178 E179	K171-L175 WeakPolarHBondContact O-CD1 3.16Å; K171-L175 WeakPolarHBondContact O-CG 3.49Å; K171-L175 PolarHBondContact O-N 3.02Å; K171-L175 VanDerWaalsContact O-N 3.16Å; E172-L175 PolarHBondContact O-N 2.64Å; L175-N178 PolarHBondContact O-N 2.87Å; L175-E179 WeakPolarHBondContact O-CB 3.41Å; L175-E179 PolarHBondContact O-N 2.99Å
176	Y	44	Very low	47.6	Very low	159 Å²	159	122.6 Å²	122.6	62%	0.624	57%	0.565	S	S	*	*	H	α-helix	trans	-66.2	-42.1	178.3	-170.9	-101.8	0	0	0	113.1	E172 V173 R174 E179 K180	E172-Y176 WeakPolarHBondContact O-CB 3.29Å; E172-Y176 PolarHBondContact O-N 3.31Å; V173-Y176 PolarHBondContact O-N 2.85Å; R174-Y176 VanDerWaalsContact C-N 3.29Å; R174-Y176 PolarHBondContact O-N 2.99Å; Y176-E179 PolarHBondContact O-N 2.83Å; Y176-K180 WeakPolarHBondContact O-CB 3.44Å; Y176-K180 PolarHBondContact O-N 3.01Å
177	R	51.1	Low	48.5	Very low	178 Å²	178	122.9 Å²	122.9	67%	0.672	56%	0.56	S	S	*	*	H	α-helix	trans	-66.2	-40.6	177	-72.2	-179.2	-177.5	-177.9	2.2	112.3	V173 R174 K180 R181	V173-R177 WeakPolarHBondContact O-CG 3.32Å; V173-R177 PolarHBondContact O-N 3.46Å; R174-R177 PolarHBondContact O-N 3Å; R177-K180 PolarHBondContact O-N 3.24Å; R177-R181 PolarHBondContact O-N 3.36Å
178	N	60.7	Low	49.2	Very low	109 Å²	109	126.2 Å²	126.2	58%	0.583	57%	0.57	S	S	*	*	H	α-helix	trans	-64.6	-40.9	175	-82.2	-9.8	0	0	0	112.1	R174 L175 R181 R182	R174-N178 WeakPolarHBondContact O-CB 3.35Å; R174-N178 PolarHBondContact O-N 3.45Å; L175-N178 PolarHBondContact O-N 2.87Å; N178-R181 PolarHBondContact O-N 3.41Å; N178-R182 WeakPolarHBondContact O-CB 3.35Å; N178-R182 PolarHBondContact O-N 3.16Å
179	E	50.7	Low	49.4	Very low	99 Å²	99	129.4 Å²	129.4	46%	0.463	58%	0.578	S	S	.	*	H	α-helix	trans	-68.8	-34.6	177.8	-154.3	-177.5	149.8	0	0	112	L175 Y176 R183	L175-E179 WeakPolarHBondContact O-CB 3.41Å; L175-E179 PolarHBondContact O-N 2.99Å; Y176-E179 PolarHBondContact O-N 2.83Å; E179-R183 WeakPolarHBondContact O-CG 3.48Å; E179-R183 PolarHBondContact O-N 3.09Å; E179-R183 IonicContact OE1-CZ 2.69Å; E179-R183 IonicContact OE1-NE 3.89Å; E179-R183 IonicContact OE1-NH2 3.97Å; E179-R183 PolarHBondContact OE1-NH2 3.07Å
180	K	58.3	Low	49.7	Very low	117 Å²	117	131.6 Å²	131.6	51%	0.509	58%	0.582	S	S	.	*	H	α-helix	trans	-65.3	-46	173.1	-168.8	-177.7	178	-169.7	0	111.8	Y176 R177 R182 R183 E184	Y176-K180 WeakPolarHBondContact O-CB 3.44Å; Y176-K180 PolarHBondContact O-N 3.01Å; R177-K180 PolarHBondContact O-N 3.24Å; K180-R182 VanDerWaalsContact C-N 3.33Å; K180-R182 PolarHBondContact O-N 3.36Å; K180-R183 PolarHBondContact O-N 3.49Å; K180-R183 VanDerWaalsContact O-N 3.13Å; K180-E184 VanDerWaalsContact CE-OE1 3.3Å; K180-E184 WeakPolarHBondContact CE-OE1 3.41Å; K180-E184 PolarHBondContact O-N 3.35Å
181	R	60.1	Low	49.5	Very low	167 Å²	167	132.3 Å²	132.3	63%	0.63	59%	0.591	S	S	*	*	H	α-helix	trans	-60.4	-43.7	176.4	-150.7	-175.8	-145.7	175.6	3.4	111.3	R177 N178 R183 E184 E185	R177-R181 PolarHBondContact O-N 3.36Å; N178-R181 PolarHBondContact O-N 3.41Å; R181-R183 VanDerWaalsContact C-N 3.34Å; R181-R183 PolarHBondContact O-N 3.14Å; R181-E184 PolarHBondContact O-N 3.22Å; R181-E185 WeakPolarHBondContact O-CB 2.74Å; R181-E185 WeakPolarHBondContact O-CG 3.4Å; R181-E185 PolarHBondContact O-N 3.41Å
182	R	60.3	Low	49.1	Very low	179 Å²	179	129.1 Å²	129.1	68%	0.675	59%	0.594	S	S	*	*	H	α-helix	trans	-60.3	-39.8	173.9	-125	178.3	168.8	-178.6	-5.1	112.7	N178 K180 L186	N178-R182 WeakPolarHBondContact O-CB 3.35Å; N178-R182 PolarHBondContact O-N 3.16Å; K180-R182 VanDerWaalsContact C-N 3.33Å; K180-R182 PolarHBondContact O-N 3.36Å; R182-L186 VanDerWaalsContact O-CB 3.27Å; R182-L186 WeakPolarHBondContact O-CB 3.45Å; R182-L186 WeakPolarHBondContact O-CD1 3.38Å; R182-L186 WeakPolarHBondContact O-CG 3.36Å; R182-L186 PolarHBondContact O-N 2.88Å
183	R	57.6	Low	48.5	Very low	138 Å²	138	126.4 Å²	126.4	52%	0.521	60%	0.601	S	S	.	*	H	α-helix	trans	-68	-33.8	175.7	-75	179	-168.4	177.6	9.4	112.8	E179 K180 R181 K187	E179-R183 WeakPolarHBondContact O-CG 3.48Å; E179-R183 PolarHBondContact O-N 3.09Å; E179-R183 IonicContact OE1-CZ 2.69Å; E179-R183 IonicContact OE1-NE 3.89Å; E179-R183 IonicContact OE1-NH2 3.97Å; E179-R183 PolarHBondContact OE1-NH2 3.07Å; K180-R183 PolarHBondContact O-N 3.49Å; K180-R183 VanDerWaalsContact O-N 3.13Å; R181-R183 VanDerWaalsContact C-N 3.34Å; R181-R183 PolarHBondContact O-N 3.14Å; R183-K187 WeakPolarHBondContact O-CG 3.46Å; R183-K187 PolarHBondContact O-N 2.75Å; R183-K187 VanDerWaalsContact O-N 3.16Å
184	E	62.4	Low	48.2	Very low	95 Å²	95	132.1 Å²	132.1	44%	0.444	62%	0.621	S	S	.	*	H	α-helix	trans	-73.8	-42.8	175.1	-74.1	168.8	-177.6	0	0	111.4	K180 R181 L186 K187 H188	K180-E184 VanDerWaalsContact CE-OE1 3.3Å; K180-E184 WeakPolarHBondContact CE-OE1 3.41Å; K180-E184 PolarHBondContact O-N 3.35Å; R181-E184 PolarHBondContact O-N 3.22Å; E184-L186 PolarHBondContact O-N 2.91Å; E184-K187 WeakPolarHBondContact O-CB 3.41Å; E184-K187 PolarHBondContact O-N 3.38Å; E184-K187 VanDerWaalsContact O-N 3.16Å; E184-H188 PolarHBondContact O-CD2 3.41Å; E184-H188 VanDerWaalsContact O-CD2 3.28Å; E184-H188 PolarHBondContact O-N 3.36Å
185	E	55.6	Low	47.4	Very low	100 Å²	100	129.1 Å²	129.1	47%	0.467	62%	0.623	S	S	.	*	H	α-helix	trans	-59.8	-43.6	172.3	-72.9	165.1	-172.9	0	0	111.7	R181 K187 H188 Q189	R181-E185 WeakPolarHBondContact O-CB 2.74Å; R181-E185 WeakPolarHBondContact O-CG 3.4Å; R181-E185 PolarHBondContact O-N 3.41Å; E185-K187 VanDerWaalsContact C-N 3.32Å; E185-K187 PolarHBondContact O-N 3.44Å; E185-H188 PolarHBondContact O-N 2.97Å; E185-H188 VanDerWaalsContact O-N 3.17Å; E185-Q189 PolarHBondContact O-N 3.5Å; E185-Q189 VanDerWaalsContact O-N 3.09Å
186	L	51.5	Low	46.7	Very low	70 Å²	70	128.7 Å²	128.7	37%	0.366	63%	0.627	S	S	.	*	H	α-helix	trans	-65.1	-31.5	175.5	-75.1	167	0	0	0	112.9	R182 E184 H188 Q190	R182-L186 VanDerWaalsContact O-CB 3.27Å; R182-L186 WeakPolarHBondContact O-CB 3.45Å; R182-L186 WeakPolarHBondContact O-CD1 3.38Å; R182-L186 WeakPolarHBondContact O-CG 3.36Å; R182-L186 PolarHBondContact O-N 2.88Å; E184-L186 PolarHBondContact O-N 2.91Å; L186-H188 VanDerWaalsContact C-N 3.33Å; L186-Q190 WeakPolarHBondContact O-CB 3.2Å; L186-Q190 WeakPolarHBondContact O-CG 3.19Å; L186-Q190 PolarHBondContact O-N 3.08Å
187	K	49.6	Very low	45.9	Very low	158 Å²	158	126 Å²	126	69%	0.687	63%	0.627	S	S	*	*	H	α-helix	trans	-67.9	-32.6	173.4	-82.7	178.8	177.1	-175.9	0	112.5	R183 E184 E185	R183-K187 WeakPolarHBondContact O-CG 3.46Å; R183-K187 PolarHBondContact O-N 2.75Å; R183-K187 VanDerWaalsContact O-N 3.16Å; E184-K187 WeakPolarHBondContact O-CB 3.41Å; E184-K187 PolarHBondContact O-N 3.38Å; E184-K187 VanDerWaalsContact O-N 3.16Å; E185-K187 VanDerWaalsContact C-N 3.32Å; E185-K187 PolarHBondContact O-N 3.44Å
188	H	48.2	Very low	45.2	Very low	161 Å²	161	119.3 Å²	119.3	75%	0.745	61%	0.613	S	S	*	*	H	α-helix	trans	-85	-18.6	179.4	-75.3	-68.6	0	0	0	114	E184 E185 L186	E184-H188 PolarHBondContact O-CD2 3.41Å; E184-H188 VanDerWaalsContact O-CD2 3.28Å; E184-H188 PolarHBondContact O-N 3.36Å; E185-H188 PolarHBondContact O-N 2.97Å; E185-H188 VanDerWaalsContact O-N 3.17Å; L186-H188 VanDerWaalsContact C-N 3.33Å
189	Q	39	Very low	44.5	Very low	147 Å²	147	120.1 Å²	120.1	69%	0.687	61%	0.612	S	S	*	*	H	α-helix	trans	-94.1	-11.4	175.9	-71.5	-179.3	-13.1	0	0	114.4	E185 T191	E185-Q189 PolarHBondContact O-N 3.5Å; E185-Q189 VanDerWaalsContact O-N 3.09Å; Q189-T191 PolarHBondContact O-N 3.37Å
190	Q	40.7	Very low	44.4	Very low	129 Å²	129	119.1 Å²	119.1	60%	0.603	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	6	-173.4	-84	-178.9	-3.5	0	0	116.3	L186	L186-Q190 WeakPolarHBondContact O-CB 3.2Å; L186-Q190 WeakPolarHBondContact O-CG 3.19Å; L186-Q190 PolarHBondContact O-N 3.08Å
191	T	36.8	Very low	43.8	Very low	133 Å²	133	113.8 Å²	113.8	82%	0.816	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.5	-4.6	175	42.1	0	0	0	0	114.5	Q189	Q189-T191 PolarHBondContact O-N 3.37Å
192	A	30.8	Very low	43	Very low	90 Å²	90	108.3 Å²	108.3	74%	0.744	57%	0.572	S	S	*	*	S	Bend	trans	-121.7	102.9	176.1	0	0	0	0	0	110.8
193	G	26.8	Very low	42.3	Very low	73 Å²	73	99.9 Å²	99.9	75%	0.753	54%	0.54	S	S	*	.			trans	116.8	17.9	159.7	0	0	0	0	0	119.5	T195	G193-T195 PolarHBondContact O-N 3.26Å
194	F	31	Very low	41.8	Very low	177 Å²	177	93.5 Å²	93.5	78%	0.776	52%	0.516	S	S	*	.			trans	-85.8	87.1	169.8	-126.4	-87.2	0	0	0	110.8	P196	F194-P196 VanDerWaalsContact O-CD 3.27Å; F194-P196 WeakPolarHBondContact O-CD 3.02Å
195	T	32.2	Very low	41	Very low	116 Å²	116	90.4 Å²	90.4	71%	0.712	50%	0.504	S	S	*	.			trans	-66	115.5	164.1	26.4	0	0	0	0	108.9	G193 V197	G193-T195 PolarHBondContact O-N 3.26Å; T195-V197 PolarHBondContact O-N 3.38Å
196	P	34.2	Very low	40.6	Very low	107 Å²	107	89 Å²	89	70%	0.695	50%	0.5	S	S	*	.			trans	-75	94.5	-179.9	30.4	-30.7	0	0	0	108.7	F194 G198	F194-P196 VanDerWaalsContact O-CD 3.27Å; F194-P196 WeakPolarHBondContact O-CD 3.02Å; P196-G198 PolarHBondContact O-N 2.98Å
197	V	27.3	Very low	40.5	Very low	104 Å²	104	85.7 Å²	85.7	63%	0.63	48%	0.483	S	S	*	.			trans	-75.9	67.2	162.1	-170	0	0	0	0	107.6	T195 K199	T195-V197 PolarHBondContact O-N 3.38Å; V197-K199 PolarHBondContact O-N 3.05Å; V197-K199 VanDerWaalsContact O-N 3.11Å
198	G	34.5	Very low	40.7	Very low	36 Å²	36	78.2 Å²	78.2	37%	0.371	45%	0.45	S	S	.	.			trans	-80.4	83.3	-178.8	0	0	0	0	0	110.3	P196 D200	P196-G198 PolarHBondContact O-N 2.98Å; G198-D200 PolarHBondContact O-N 3.07Å
199	K	46.7	Very low	40.9	Very low	126 Å²	126	70.7 Å²	70.7	55%	0.548	42%	0.416	S	S	.	.			trans	-80	109.8	167.5	-68.9	-177	180	-177.2	0	108.2	V197 K281	V197-K199 PolarHBondContact O-N 3.05Å; V197-K199 VanDerWaalsContact O-N 3.11Å; K199-K281 PolarHBondContact O-NZ 2.99Å
200	D	49.6	Very low	41.4	Very low	78 Å²	78	65 Å²	65	42%	0.417	39%	0.39	S	S	.	.			trans	-45	141	171.5	-65.9	-28.9	0	0	0	111.2	G198 K395	G198-D200 PolarHBondContact O-N 3.07Å; D200-K395 HydrophobicContact CB-CB 4.06Å; D200-K395 HydrophobicContact CB-CD 4.12Å; D200-K395 HydrophobicContact CB-CG 3.99Å; D200-K395 WeakPolarHBondContact OD2-CD 3.06Å; D200-K395 IonicContact OD2-NZ 3.04Å
201	I	44.8	Very low	41.7	Very low	6 Å²	6	58.9 Å²	58.9	3%	0.031	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	137.6	169.7	56.3	160.1	0	0	0	109	V203 L277 K281 F307 F394 K395 A396 I398 I401	I201-V203 HydrophobicContact CB-CG2 4.37Å; I201-V203 HydrophobicContact CD1-CG2 3.43Å; I201-V203 VanDerWaalsContact CD1-CG2 3.43Å; I201-V203 HydrophobicContact CG1-CG2 3.69Å; I201-L277 HydrophobicContact CD1-CD1 3.85Å; I201-L277 HydrophobicContact CD1-CD2 4.35Å; I201-L277 HydrophobicContact CD1-CG 4.49Å; I201-K281 HydrophobicContact CG2-CD 4.15Å; I201-F307 HydrophobicContact CG2-CE2 3.4Å; I201-F307 VanDerWaalsContact CG2-CE2 3.4Å; I201-F307 HydrophobicContact CG2-CZ 3.49Å; I201-F307 VanDerWaalsContact CG2-CZ 3.49Å; I201-F394 VanDerWaalsContact O-O 3.07Å; I201-K395 CarbonylContact O-C 3.55Å; I201-K395 WeakPolarHBondContact O-CA 3Å; I201-A396 HydrophobicContact CD1-CB 4.29Å; I201-A396 HydrophobicContact CG1-CB 3.9Å; I201-A396 VanDerWaalsContact CG1-O 3.26Å; I201-A396 WeakPolarHBondContact CG1-O 3.26Å; I201-A396 PolarHBondContact N-O 3.28Å; I201-A396 VanDerWaalsContact N-O 3.08Å; I201-A396 PolarHBondContact O-N 3.38Å; I201-I398 HydrophobicContact CD1-CD1 4.15Å; I201-I398 HydrophobicContact CG2-CB 4.4Å; I201-I401 HydrophobicContact CD1-CD1 4.31Å
202	T	42.5	Very low	42.2	Very low	52 Å²	52	52.7 Å²	52.7	32%	0.319	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	117.5	173.3	-3.8	0	0	0	0	109.7	F393 F394	T202-F393 HydrophobicContact CG2-CB 3.52Å; T202-F393 HydrophobicContact CG2-CD1 2.94Å; T202-F393 HydrophobicContact CG2-CE1 3.5Å; T202-F393 HydrophobicContact CG2-CG 3.45Å; T202-F393 VanDerWaalsContact CG2-CG 3.45Å; T202-F394 WeakPolarHBondContact CA-O 3.23Å
203	V	45.5	Very low	42.5	Very low	1 Å²	1	48.8 Å²	48.8	1%	0.006	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	137.1	-171.2	-175.9	0	0	0	0	109.1	I201 P205 V208 L277 F393 F394 A396 L420	I201-V203 HydrophobicContact CB-CG2 4.37Å; I201-V203 HydrophobicContact CD1-CG2 3.43Å; I201-V203 VanDerWaalsContact CD1-CG2 3.43Å; I201-V203 HydrophobicContact CG1-CG2 3.69Å; V203-P205 WeakPolarHBondContact O-CD 3.23Å; V203-V208 HydrophobicContact CG1-CB 3.44Å; V203-V208 VanDerWaalsContact CG1-CB 3.44Å; V203-V208 HydrophobicContact CG1-CG1 3.76Å; V203-V208 HydrophobicContact CG1-CG2 3.54Å; V203-L277 HydrophobicContact CG2-CD2 4.44Å; V203-F393 CarbonylContact O-C 3.51Å; V203-F394 HydrophobicContact CB-CD1 4.1Å; V203-F394 HydrophobicContact CB-CD2 4.31Å; V203-F394 HydrophobicContact CB-CE1 3.56Å; V203-F394 HydrophobicContact CB-CE2 3.84Å; V203-F394 HydrophobicContact CB-CG 4.48Å; V203-F394 HydrophobicContact CB-CZ 3.48Å; V203-F394 VanDerWaalsContact CB-CZ 3.48Å; V203-F394 HydrophobicContact CG1-CE1 3.57Å; V203-F394 HydrophobicContact CG1-CE2 4.18Å; V203-F394 HydrophobicContact CG1-CZ 3.4Å; V203-F394 VanDerWaalsContact CG1-CZ 3.4Å; V203-F394 HydrophobicContact CG2-CE2 4.32Å; V203-F394 HydrophobicContact CG2-CZ 4.33Å; V203-F394 PolarHBondContact N-O 2.98Å; V203-F394 WeakPolarHBondContact O-CD1 3.46Å; V203-F394 WeakPolarHBondContact O-CE1 3.26Å; V203-F394 PolarHBondContact O-N 2.9Å; V203-A396 HydrophobicContact CG2-CB 3.96Å; V203-L420 HydrophobicContact CG1-CD2 4.27Å; V203-L420 HydrophobicContact CG2-CD2 4.29Å
204	V	48.3	Very low	42.8	Very low	4 Å²	4	46.7 Å²	46.7	2%	0.024	26%	0.263	C	S	.	.			trans	-85.2	115.7	171.6	176.5	0	0	0	0	108	N206 F207 V208 L388 F389 C392	V204-N206 PolarHBondContact O-N 3.5Å; V204-F207 HydrophobicContact CB-CB 3.98Å; V204-F207 HydrophobicContact CG1-CB 3.75Å; V204-F207 PolarHBondContact O-N 3.47Å; V204-V208 PolarHBondContact O-N 2.91Å; V204-L388 HydrophobicContact CB-CG 4.46Å; V204-L388 HydrophobicContact CG1-CD1 4.23Å; V204-L388 HydrophobicContact CG1-CD2 3.95Å; V204-L388 HydrophobicContact CG1-CG 3.88Å; V204-L388 HydrophobicContact CG2-CD2 4.4Å; V204-L388 HydrophobicContact CG2-CG 3.9Å; V204-F389 HydrophobicContact CB-CD1 4.21Å; V204-F389 HydrophobicContact CB-CE1 4.09Å; V204-F389 HydrophobicContact CG2-CB 4.4Å; V204-F389 HydrophobicContact CG2-CD1 3.36Å; V204-F389 HydrophobicContact CG2-CE1 3.73Å; V204-F389 HydrophobicContact CG2-CG 3.96Å; V204-C392 HydrophobicContact CB-CB 4.4Å; V204-C392 HydrophobicContact CG1-CB 3.92Å; V204-C392 HydrophobicContact CG2-CB 4.07Å; V204-C392 VanDerWaalsContact CG2-O 3.24Å; V204-C392 WeakPolarHBondContact CG2-O 3.09Å
205	P	45.6	Very low	43.1	Very low	30 Å²	30	39 Å²	39	20%	0.195	23%	0.232	C	C	.	.	H	α-helix	trans	-41.6	-67.4	-177.4	-34.3	37.5	0	0	0	114.5	V203 F207 L209 F394 S424	V203-P205 WeakPolarHBondContact O-CD 3.23Å; P205-F207 PolarHBondContact O-N 2.94Å; P205-L209 WeakPolarHBondContact O-CB 3.5Å; P205-L209 WeakPolarHBondContact O-CD1 3.43Å; P205-L209 WeakPolarHBondContact O-CG 3.33Å; P205-L209 PolarHBondContact O-N 3.34Å; P205-L209 VanDerWaalsContact O-N 3.16Å; P205-F394 HydrophobicContact CB-CD1 4.47Å; P205-F394 HydrophobicContact CB-CE1 4.21Å; P205-F394 HydrophobicContact CG-CD1 3.58Å; P205-F394 HydrophobicContact CG-CE1 3.77Å; P205-S424 VanDerWaalsContact CB-CB 3.45Å
206	N	47.2	Very low	43.5	Very low	72 Å²	72	35.7 Å²	35.7	39%	0.385	21%	0.207	S	C	.	.	H	α-helix	trans	-73.2	-32.6	-170.3	-68.2	-25.9	0	0	0	112.1	V204 N210	V204-N206 PolarHBondContact O-N 3.5Å; N206-N210 WeakPolarHBondContact O-CB 3.23Å; N206-N210 PolarHBondContact O-N 2.83Å; N206-N210 PolarHBondContact O-ND2 3.2Å
207	F	49.6	Very low	43.6	Very low	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-72.9	-48.9	-177.4	-178	-116.8	0	0	0	112.6	V204 P205 L209 N210 V211 V261 F276 W334 L347 L385 L388 F389	V204-F207 HydrophobicContact CB-CB 3.98Å; V204-F207 HydrophobicContact CG1-CB 3.75Å; V204-F207 PolarHBondContact O-N 3.47Å; P205-F207 PolarHBondContact O-N 2.94Å; F207-L209 VanDerWaalsContact C-N 3.32Å; F207-L209 PolarHBondContact O-N 3.27Å; F207-N210 CarbonylContact O-C 3.59Å; F207-N210 PolarHBondContact O-N 2.93Å; F207-V211 HydrophobicContact CD1-CG2 4.35Å; F207-V211 HydrophobicContact CD2-CG2 4.13Å; F207-V211 HydrophobicContact CE1-CG2 4.12Å; F207-V211 HydrophobicContact CE2-CG2 3.86Å; F207-V211 HydrophobicContact CG-CG2 4.39Å; F207-V211 HydrophobicContact CZ-CG2 3.89Å; F207-V211 VanDerWaalsContact O-CB 3.28Å; F207-V211 WeakPolarHBondContact O-CB 3.3Å; F207-V211 WeakPolarHBondContact O-CG2 3.32Å; F207-V211 PolarHBondContact O-N 3.45Å; F207-V261 HydrophobicContact CB-CG1 3.79Å; F207-V261 HydrophobicContact CD2-CG1 3.56Å; F207-V261 HydrophobicContact CG-CG1 4.07Å; F207-F276 HydrophobicContact CD1-CE1 4.45Å; F207-F276 AromaticContact CE1-CE1 3.5Å; F207-F276 HydrophobicContact CE1-CE1 3.5Å; F207-F276 VanDerWaalsContact CE1-CE1 3.5Å; F207-F276 AromaticContact CE1-CZ 3.68Å; F207-F276 HydrophobicContact CE1-CZ 3.68Å; F207-F276 HydrophobicContact CZ-CE1 4.07Å; F207-F276 HydrophobicContact CZ-CZ 4.04Å; F207-W334 HydrophobicContact CD2-CB 4.49Å; F207-W334 HydrophobicContact CE2-CB 3.6Å; F207-W334 HydrophobicContact CE2-CG 4.11Å; F207-W334 HydrophobicContact CZ-CB 4.39Å; F207-L347 HydrophobicContact CE1-CD2 4.19Å; F207-L347 HydrophobicContact CE2-CD2 3.88Å; F207-L347 HydrophobicContact CZ-CD2 3.27Å; F207-L385 HydrophobicContact CD1-CD2 4.38Å; F207-L385 HydrophobicContact CD2-CD2 4.22Å; F207-L385 HydrophobicContact CE1-CD1 4.12Å; F207-L385 HydrophobicContact CE1-CD2 3.72Å; F207-L385 HydrophobicContact CE1-CG 4.44Å; F207-L385 HydrophobicContact CE2-CD2 3.55Å; F207-L385 HydrophobicContact CZ-CD1 3.59Å; F207-L385 HydrophobicContact CZ-CD2 3.23Å; F207-L385 HydrophobicContact CZ-CG 4.01Å; F207-L388 HydrophobicContact CB-CD2 4.07Å; F207-L388 HydrophobicContact CG-CD2 4.23Å; F207-F389 HydrophobicContact CD1-CE1 4.11Å; F207-F389 AromaticContact CD1-CE2 3.79Å; F207-F389 HydrophobicContact CD1-CE2 3.79Å; F207-F389 AromaticContact CD1-CZ 3.28Å; F207-F389 HydrophobicContact CD1-CZ 3.28Å; F207-F389 AromaticContact CE1-CE2 3.5Å; F207-F389 HydrophobicContact CE1-CE2 3.5Å; F207-F389 AromaticContact CE1-CZ 3.37Å; F207-F389 HydrophobicContact CE1-CZ 3.37Å
208	V	54.2	Low	43.7	Very low	0 Å²	0	30.2 Å²	30.2	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-72.8	-31.5	-179.5	177.9	0	0	0	0	111.1	V203 V204 V211 I212 V273 L277 F389 L420	V203-V208 HydrophobicContact CG1-CB 3.44Å; V203-V208 VanDerWaalsContact CG1-CB 3.44Å; V203-V208 HydrophobicContact CG1-CG1 3.76Å; V203-V208 HydrophobicContact CG1-CG2 3.54Å; V204-V208 PolarHBondContact O-N 2.91Å; V208-V211 PolarHBondContact O-N 2.75Å; V208-I212 HydrophobicContact CG1-CD1 3.84Å; V208-I212 HydrophobicContact CG1-CG1 4.38Å; V208-I212 WeakPolarHBondContact O-CB 3.34Å; V208-I212 WeakPolarHBondContact O-CD1 3.42Å; V208-I212 VanDerWaalsContact O-CG1 3.26Å; V208-I212 WeakPolarHBondContact O-CG1 3.23Å; V208-I212 PolarHBondContact O-N 2.82Å; V208-V273 HydrophobicContact CG1-CG1 4.24Å; V208-L277 HydrophobicContact CG1-CD1 4.48Å; V208-L277 HydrophobicContact CG1-CD2 4.23Å; V208-L277 HydrophobicContact CG2-CD2 4.02Å; V208-F389 HydrophobicContact CG2-CE1 3.89Å; V208-F389 HydrophobicContact CG2-CZ 4.1Å; V208-L420 HydrophobicContact CG1-CD1 3.95Å
209	L	51	Low	43.6	Very low	3 Å²	3	39.7 Å²	39.7	2%	0.016	20%	0.199	C	C	.	.	H	α-helix	trans	-65.8	-37.7	171	-67.2	172	0	0	0	112.4	P205 F207 S213 W417 L420 Y421	P205-L209 WeakPolarHBondContact O-CB 3.5Å; P205-L209 WeakPolarHBondContact O-CD1 3.43Å; P205-L209 WeakPolarHBondContact O-CG 3.33Å; P205-L209 PolarHBondContact O-N 3.34Å; P205-L209 VanDerWaalsContact O-N 3.16Å; F207-L209 VanDerWaalsContact C-N 3.32Å; F207-L209 PolarHBondContact O-N 3.27Å; L209-S213 WeakPolarHBondContact O-CB 3.25Å; L209-S213 PolarHBondContact O-N 2.86Å; L209-W417 HydrophobicContact CD2-CD2 4.35Å; L209-W417 HydrophobicContact CD2-CG 4.15Å; L209-W417 VanDerWaalsContact CD2-O 3.3Å; L209-W417 WeakPolarHBondContact CD2-O 3.3Å; L209-W417 PolarHBondContact O-NE1 2.7Å; L209-L420 HydrophobicContact CD2-CB 3.86Å; L209-Y421 HydrophobicContact CD1-CD2 3.93Å
210	N	50.1	Low	43	Very low	28 Å²	28	43.3 Å²	43.3	15%	0.15	21%	0.209	C	C	.	.	H	α-helix	trans	-77.4	-25.6	174	-74.4	-19.4	0	0	0	113.3	N206 F207 S213 V261 Y263	N206-N210 WeakPolarHBondContact O-CB 3.23Å; N206-N210 PolarHBondContact O-N 2.83Å; N206-N210 PolarHBondContact O-ND2 3.2Å; F207-N210 CarbonylContact O-C 3.59Å; F207-N210 PolarHBondContact O-N 2.93Å; N210-S213 WeakPolarHBondContact CA-OG 3.42Å; N210-S213 PolarHBondContact O-OG 2.97Å; N210-V261 PolarHBondContact ND2-O 3.42Å; N210-Y263 WeakPolarHBondContact O-CB 3.3Å
211	V	47.8	Very low	42.1	Very low	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-70.9	-45.1	171.9	159.7	0	0	0	0	109.4	F207 V208 S213 Y263 I268 V273 F276 L347	F207-V211 HydrophobicContact CD1-CG2 4.35Å; F207-V211 HydrophobicContact CD2-CG2 4.13Å; F207-V211 HydrophobicContact CE1-CG2 4.12Å; F207-V211 HydrophobicContact CE2-CG2 3.86Å; F207-V211 HydrophobicContact CG-CG2 4.39Å; F207-V211 HydrophobicContact CZ-CG2 3.89Å; F207-V211 VanDerWaalsContact O-CB 3.28Å; F207-V211 WeakPolarHBondContact O-CB 3.3Å; F207-V211 WeakPolarHBondContact O-CG2 3.32Å; F207-V211 PolarHBondContact O-N 3.45Å; V208-V211 PolarHBondContact O-N 2.75Å; V211-S213 VanDerWaalsContact C-N 3.27Å; V211-S213 PolarHBondContact O-N 2.75Å; V211-Y263 HydrophobicContact CG2-CD2 3.79Å; V211-Y263 HydrophobicContact CG2-CE2 4.48Å; V211-Y263 HydrophobicContact CG2-CG 3.97Å; V211-I268 HydrophobicContact CB-CD1 3.94Å; V211-I268 HydrophobicContact CG1-CD1 3.15Å; V211-I268 HydrophobicContact CG1-CG1 4.37Å; V211-I268 HydrophobicContact CG2-CD1 4.46Å; V211-I268 WeakPolarHBondContact O-CD1 3.3Å; V211-I268 WeakPolarHBondContact O-CG1 3.5Å; V211-V273 HydrophobicContact CG1-CG1 4.28Å; V211-V273 HydrophobicContact CG1-CG2 3.91Å; V211-F276 HydrophobicContact CG1-CD1 4.24Å; V211-L347 HydrophobicContact CG2-CD2 3.98Å
212	I	45.7	Very low	41.6	Very low	3 Å²	3	53.2 Å²	53.2	2%	0.015	26%	0.257	C	S	.	.	H	α-helix	trans	-69	-28	175.4	-64.6	163.7	0	0	0	111.8	V208 V214 A215 V273 W417 L420	V208-I212 HydrophobicContact CG1-CD1 3.84Å; V208-I212 HydrophobicContact CG1-CG1 4.38Å; V208-I212 WeakPolarHBondContact O-CB 3.34Å; V208-I212 WeakPolarHBondContact O-CD1 3.42Å; V208-I212 VanDerWaalsContact O-CG1 3.26Å; V208-I212 WeakPolarHBondContact O-CG1 3.23Å; V208-I212 PolarHBondContact O-N 2.82Å; I212-V214 VanDerWaalsContact C-N 3.26Å; I212-V214 PolarHBondContact O-N 2.71Å; I212-A215 WeakPolarHBondContact O-CB 3.35Å; I212-A215 PolarHBondContact O-N 2.88Å; I212-V273 HydrophobicContact CD1-CG1 4.02Å; I212-V273 HydrophobicContact CG1-CB 4.12Å; I212-V273 HydrophobicContact CG1-CG1 3.58Å; I212-V273 HydrophobicContact CG1-CG2 3.76Å; I212-W417 HydrophobicContact CG2-CB 3.74Å; I212-W417 HydrophobicContact CG2-CG 4.33Å; I212-L420 HydrophobicContact CD1-CD1 3.17Å
213	S	38.4	Very low	41	Very low	8 Å²	8	57.3 Å²	57.3	6%	0.056	28%	0.277	C	S	.	.	H	α-helix	trans	-59.8	-39.5	-178.3	75.8	0	0	0	0	113.1	L209 N210 V211 A215 R464 T465	L209-S213 WeakPolarHBondContact O-CB 3.25Å; L209-S213 PolarHBondContact O-N 2.86Å; N210-S213 WeakPolarHBondContact CA-OG 3.42Å; N210-S213 PolarHBondContact O-OG 2.97Å; V211-S213 VanDerWaalsContact C-N 3.27Å; V211-S213 PolarHBondContact O-N 2.75Å; S213-A215 PolarHBondContact O-N 3.21Å; S213-R464 WeakPolarHBondContact CB-O 3.46Å; S213-T465 VanDerWaalsContact CB-CA 3.42Å; S213-T465 CarbonylContact O-C 3.55Å
214	V	33.2	Very low	40.4	Very low	29 Å²	29	63.9 Å²	63.9	18%	0.176	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-82.4	-3.5	-175.2	-175.2	0	0	0	0	111.8	I212 R216 Y263 G265 E267	I212-V214 VanDerWaalsContact C-N 3.26Å; I212-V214 PolarHBondContact O-N 2.71Å; V214-R216 VanDerWaalsContact C-N 3.25Å; V214-R216 PolarHBondContact O-N 3.5Å; V214-R216 VanDerWaalsContact O-N 3.15Å; V214-Y263 HydrophobicContact CB-CD1 3.61Å; V214-Y263 HydrophobicContact CB-CE1 3.61Å; V214-Y263 HydrophobicContact CG1-CD1 4.15Å; V214-Y263 HydrophobicContact CG1-CE1 3.79Å; V214-Y263 HydrophobicContact CG2-CD1 3.5Å; V214-Y263 HydrophobicContact CG2-CE1 4.02Å; V214-G265 VanDerWaalsContact CG1-O 3.24Å; V214-G265 WeakPolarHBondContact CG1-O 3.24Å; V214-E267 HydrophobicContact CG1-CB 4.47Å; V214-E267 HydrophobicContact CG1-CG 3.91Å; V214-E267 WeakPolarHBondContact O-CA 3.42Å; V214-E267 WeakPolarHBondContact O-CB 3.43Å; V214-E267 WeakPolarHBondContact O-CG 3.49Å
215	A	36.7	Very low	39.6	Very low	15 Å²	15	73.2 Å²	73.2	12%	0.124	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-58.6	-22.1	177.2	0	0	0	0	0	117.2	I212 S213 I268	I212-A215 WeakPolarHBondContact O-CB 3.35Å; I212-A215 PolarHBondContact O-N 2.88Å; S213-A215 PolarHBondContact O-N 3.21Å; A215-I268 WeakPolarHBondContact CA-O 2.91Å; A215-I268 WeakPolarHBondContact CB-O 3.26Å
216	R	41.1	Very low	38.9	Very low	48 Å²	48	83.3 Å²	83.3	18%	0.181	39%	0.389	C	S	.	.	G	3₁₀ helix	trans	-104	-1.3	-152.4	-68.7	-174.2	88.5	-163	4.1	117.2	V214 D413	V214-R216 VanDerWaalsContact C-N 3.25Å; V214-R216 PolarHBondContact O-N 3.5Å; V214-R216 VanDerWaalsContact O-N 3.15Å; R216-D413 HydrophobicContact CG-CB 4.03Å
217	H	35.4	Very low	38	Very low	39 Å²	39	81.8 Å²	81.8	18%	0.181	39%	0.391	C	S	.	.			trans	-118.1	-1.4	-167	-58.9	-42.7	0	0	0	117.8	R219 E267 T465 G466 Y467 I468	H217-R219 PolarHBondContact O-N 3.2Å; H217-E267 VanDerWaalsContact CA-CD 3.44Å; H217-E267 VanDerWaalsContact CA-OE1 3.3Å; H217-E267 WeakPolarHBondContact CA-OE1 3.28Å; H217-E267 WeakPolarHBondContact CA-OE2 3.43Å; H217-E267 VanDerWaalsContact CB-CD 3.42Å; H217-E267 WeakPolarHBondContact CB-OE1 3.47Å; H217-E267 VanDerWaalsContact CB-OE2 3.29Å; H217-E267 WeakPolarHBondContact CB-OE2 3.39Å; H217-E267 PolarHBondContact N-OE2 3.42Å; H217-T465 PolarHBondContact NE2-O 3.4Å; H217-G466 VanDerWaalsContact CD2-C 3.46Å; H217-G466 PolarHBondContact CD2-O 2.9Å; H217-G466 PolarHBondContact CE1-O 3.34Å; H217-G466 VanDerWaalsContact CE1-O 3.24Å; H217-G466 WeakPolarHBondContact NE2-CA 3.33Å; H217-G466 PolarHBondContact NE2-O 2.94Å; H217-Y467 WeakPolarHBondContact CE1-CA 3.45Å; H217-Y467 WeakPolarHBondContact NE2-CA 3.45Å; H217-Y467 PolarHBondContact NE2-N 3.45Å; H217-I468 HydrophobicContact CB-CD1 3.56Å; H217-I468 HydrophobicContact CB-CG1 4.19Å; H217-I468 PolarHBondContact CE1-N 2.93Å; H217-I468 VanDerWaalsContact CG-CD1 3.44Å; H217-I468 VanDerWaalsContact CG-CG1 3.49Å; H217-I468 WeakPolarHBondContact ND1-CB 3.43Å; H217-I468 VanDerWaalsContact ND1-CG1 3.28Å; H217-I468 WeakPolarHBondContact ND1-CG1 3.31Å; H217-I468 PolarHBondContact ND1-N 3.39Å
218	A	28.8	Very low	37.5	Very low	57 Å²	57	90.4 Å²	90.4	47%	0.471	43%	0.428	S	S	.	.			trans	-93	94.6	-161.3	0	0	0	0	0	108.3	R220 E267	A218-R220 PolarHBondContact O-N 2.98Å; A218-E267 WeakPolarHBondContact CA-OE1 3.3Å; A218-E267 VanDerWaalsContact CA-OE2 3.32Å; A218-E267 WeakPolarHBondContact CA-OE2 3.3Å; A218-E267 HydrophobicContact CB-CB 3.39Å; A218-E267 HydrophobicContact CB-CG 3.62Å; A218-E267 WeakPolarHBondContact CB-OE1 3.25Å; A218-E267 VanDerWaalsContact CB-OE2 3.29Å; A218-E267 WeakPolarHBondContact CB-OE2 3.13Å; A218-E267 PolarHBondContact N-OE1 2.79Å; A218-E267 PolarHBondContact N-OE2 3.29Å
219	R	32.8	Very low	36.6	Very low	235 Å²	235	97.8 Å²	97.8	89%	0.887	46%	0.46	S	S	*	.			trans	-56.6	98.9	140.4	-72.5	-176.8	176.1	-171.1	0.3	106.5	H217 P221	H217-R219 PolarHBondContact O-N 3.2Å; R219-P221 WeakPolarHBondContact O-CD 3.14Å
220	R	34.9	Very low	35.7	Very low	202 Å²	202	103.6 Å²	103.6	76%	0.762	49%	0.492	S	S	*	.			trans	-40.5	119.6	165	-76.4	-176.2	174.1	175	0.5	107	A218 K222	A218-R220 PolarHBondContact O-N 2.98Å; R220-K222 VanDerWaalsContact C-N 3.33Å; R220-K222 PolarHBondContact O-N 3.43Å
221	P	30.7	Very low	34.8	Very low	87 Å²	87	104.7 Å²	104.7	57%	0.565	50%	0.501	S	S	*	.			trans	-56.5	108.8	164.6	19.5	-27.2	0	0	0	105.6	R219 N223 M224	R219-P221 WeakPolarHBondContact O-CD 3.14Å; P221-N223 PolarHBondContact O-N 2.98Å; P221-M224 HydrophobicContact CB-CG 4.28Å; P221-M224 HydrophobicContact CG-CG 3.93Å; P221-M224 HydrophobicContact CG-SD 3.82Å
222	K	35.1	Very low	34	Very low	205 Å²	205	109.7 Å²	109.7	89%	0.891	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	9.4	-172.6	-118	-179.3	178.9	-176.3	0	113.1	R220	R220-K222 VanDerWaalsContact C-N 3.33Å; R220-K222 PolarHBondContact O-N 3.43Å
223	N	28.2	Very low	33.3	Very low	138 Å²	138	118.1 Å²	118.1	74%	0.738	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.7	16.9	-165.7	-78.1	-9.9	0	0	0	115.7	P221 M225	P221-N223 PolarHBondContact O-N 2.98Å; N223-M225 VanDerWaalsContact C-N 3.35Å; N223-M225 PolarHBondContact O-N 3.44Å
224	M	33	Very low	32.9	Very low	139 Å²	139	123.1 Å²	123.1	69%	0.685	58%	0.577	S	S	*	*	G	3₁₀ helix	trans	-84.2	6.6	-178.4	-70.1	-163.6	89.1	0	0	116.4	P221 R226	P221-M224 HydrophobicContact CB-CG 4.28Å; P221-M224 HydrophobicContact CG-CG 3.93Å; P221-M224 HydrophobicContact CG-SD 3.82Å; M224-R226 PolarHBondContact O-N 3.27Å
225	M	31.2	Very low	32.8	Very low	199 Å²	199	125.5 Å²	125.5	98%	0.98	59%	0.585	S	S	*	*	G	3₁₀ helix	trans	-81.1	12.5	165	-75.2	-158.9	-177.6	0	0	113.8	N223	N223-M225 VanDerWaalsContact C-N 3.35Å; N223-M225 PolarHBondContact O-N 3.44Å
226	R	31.3	Very low	32.6	Very low	242 Å²	242	129 Å²	129	91%	0.913	61%	0.605	S	S	*	*	G	3₁₀ helix	trans	-127.3	16.4	-172.7	-108.6	-177.6	179.9	-169.1	-0.8	117.5	M224	M224-R226 PolarHBondContact O-N 3.27Å
227	G	28.8	Very low	32.1	Very low	40 Å²	40	133.3 Å²	133.3	41%	0.412	63%	0.627	S	S	.	*			trans	-141.5	70.5	179	0	0	0	0	0	114.8	K229	G227-K229 PolarHBondContact O-N 3.45Å; G227-K229 VanDerWaalsContact O-N 3.14Å
228	K	38.6	Very low	32.1	Very low	182 Å²	182	133 Å²	133	79%	0.791	63%	0.625	S	S	*	*	H	α-helix	trans	-60.8	-13.7	170.8	-88.7	-176.6	174.2	-179.3	0	114	S231	K228-S231 PolarHBondContact O-OG 2.87Å
229	K	35.2	Very low	32.2	Very low	154 Å²	154	135.9 Å²	135.9	67%	0.67	63%	0.629	S	S	*	*	H	α-helix	trans	-81.5	-29.2	-176.2	-75.7	-174.2	172.7	-175.2	0	114.1	G227	G227-K229 PolarHBondContact O-N 3.45Å; G227-K229 VanDerWaalsContact O-N 3.14Å
230	D	32.2	Very low	32	Very low	126 Å²	126	131.3 Å²	131.3	67%	0.674	62%	0.622	S	S	*	*	H	α-helix	trans	-78	-27	179.9	-65.5	-27.8	0	0	0	112.2	F234	D230-F234 PolarHBondContact O-N 3.4Å
231	S	32	Very low	31.9	Very low	51 Å²	51	126.6 Å²	126.6	36%	0.357	61%	0.607	S	S	.	*	H	α-helix	trans	-72.5	-26	176.9	51.6	0	0	0	0	114	K228 F235	K228-S231 PolarHBondContact O-OG 2.87Å; S231-F235 PolarHBondContact O-N 3.46Å
232	E	30.9	Very low	32.1	Very low	105 Å²	105	124.3 Å²	124.3	49%	0.491	59%	0.587	S	S	.	*	H	α-helix	trans	-81.5	-39.4	-179	-75	176.6	172.1	0	0	111.6	F234 F235	E232-F234 VanDerWaalsContact C-N 3.33Å; E232-F234 PolarHBondContact O-N 3.19Å; E232-F235 WeakPolarHBondContact O-CB 3.2Å; E232-F235 PolarHBondContact O-N 2.87Å; E232-F235 VanDerWaalsContact O-N 3.09Å
233	R	30.1	Very low	32.2	Very low	180 Å²	180	123.4 Å²	123.4	68%	0.679	58%	0.583	S	S	*	*	H	α-helix	trans	-65.1	-37.2	177.2	-152	175.3	-175.7	178	1.3	112	F235	R233-F235 VanDerWaalsContact C-N 3.29Å; R233-F235 PolarHBondContact O-N 3.38Å
234	F	31.9	Very low	32.4	Very low	113 Å²	113	124.9 Å²	124.9	50%	0.496	59%	0.586	S	S	.	*	H	α-helix	trans	-70.8	-21.5	174.1	-147.9	-91.1	0	0	0	113.2	D230 E232 K238	D230-F234 PolarHBondContact O-N 3.4Å; E232-F234 VanDerWaalsContact C-N 3.33Å; E232-F234 PolarHBondContact O-N 3.19Å; F234-K238 VanDerWaalsContact O-CB 3.31Å; F234-K238 WeakPolarHBondContact O-CB 3.32Å; F234-K238 PolarHBondContact O-N 2.95Å
235	F	31.2	Very low	32.5	Very low	78 Å²	78	121.9 Å²	121.9	34%	0.342	57%	0.567	S	S	.	*	H	α-helix	trans	-78	-28.7	-178.5	-127	-90.2	0	0	0	113.1	S231 E232 R233 K238	S231-F235 PolarHBondContact O-N 3.46Å; E232-F235 WeakPolarHBondContact O-CB 3.2Å; E232-F235 PolarHBondContact O-N 2.87Å; E232-F235 VanDerWaalsContact O-N 3.09Å; R233-F235 VanDerWaalsContact C-N 3.29Å; R233-F235 PolarHBondContact O-N 3.38Å; F235-K238 WeakPolarHBondContact O-CB 3.37Å
236	V	31.5	Very low	33	Very low	89 Å²	89	114.8 Å²	114.8	54%	0.539	53%	0.532	S	S	.	.	H	α-helix	trans	-78.5	-42.8	179.8	179.9	0	0	0	0	111.1	K238 Q239	V236-K238 PolarHBondContact O-N 3.41Å; V236-Q239 PolarHBondContact O-N 3.05Å
237	E	30.7	Very low	33.3	Very low	139 Å²	139	110.6 Å²	110.6	65%	0.65	52%	0.524	S	S	*	.	H	α-helix	trans	-60.7	-34.3	168.7	-74.9	177	162.7	0	0	111.5	Q239 L240 F241	E237-Q239 VanDerWaalsContact C-N 3.28Å; E237-Q239 PolarHBondContact O-N 2.9Å; E237-L240 PolarHBondContact O-N 3.49Å; E237-F241 PolarHBondContact O-N 3.34Å
238	K	35.9	Very low	33.8	Very low	32 Å²	32	113.8 Å²	113.8	14%	0.139	53%	0.532	C	S	.	.	H	α-helix	trans	-59.4	-26.6	175.7	-118.7	-172.7	-178.8	-166.1	0	114.8	F234 F235 V236 Y242 A349	F234-K238 VanDerWaalsContact O-CB 3.31Å; F234-K238 WeakPolarHBondContact O-CB 3.32Å; F234-K238 PolarHBondContact O-N 2.95Å; F235-K238 WeakPolarHBondContact O-CB 3.37Å; V236-K238 PolarHBondContact O-N 3.41Å; K238-Y242 WeakPolarHBondContact O-CD2 3.47Å; K238-A349 PolarHBondContact NZ-O 3Å
239	Q	29.8	Very low	33.8	Very low	117 Å²	117	105.4 Å²	105.4	55%	0.547	50%	0.496	S	S	.	.	H	α-helix	trans	-93.2	-30.9	-177.6	-74.2	-161.1	-0.8	0	0	113.2	V236 E237	V236-Q239 PolarHBondContact O-N 3.05Å; E237-Q239 VanDerWaalsContact C-N 3.28Å; E237-Q239 PolarHBondContact O-N 2.9Å
240	L	28.6	Very low	34	Very low	140 Å²	140	99.6 Å²	99.6	73%	0.733	48%	0.475	S	S	*	.	H	α-helix	trans	-72.5	-31.6	177.9	-77.1	161.1	0	0	0	112	E237 Y242	E237-L240 PolarHBondContact O-N 3.49Å; L240-Y242 VanDerWaalsContact C-N 3.33Å; L240-Y242 PolarHBondContact O-N 2.9Å
241	F	32.4	Very low	34.4	Very low	103 Å²	103	99.9 Å²	99.9	45%	0.452	47%	0.472	S	S	.	.	H	α-helix	trans	-69	-24.1	178.6	-158.4	-93.9	0	0	0	114.1	E237 Y245	E237-F241 PolarHBondContact O-N 3.34Å; F241-Y245 HydrophobicContact CD1-CG 4.49Å; F241-Y245 AromaticContact CE1-CD1 3.93Å; F241-Y245 HydrophobicContact CE1-CD1 3.93Å; F241-Y245 HydrophobicContact CE1-CD2 4.15Å; F241-Y245 HydrophobicContact CE1-CE1 4.06Å; F241-Y245 HydrophobicContact CE1-CE2 4.29Å; F241-Y245 AromaticContact CE1-CG 3.98Å; F241-Y245 HydrophobicContact CE1-CG 3.98Å; F241-Y245 HydrophobicContact CE2-CE2 4.46Å; F241-Y245 HydrophobicContact CZ-CD1 4.41Å; F241-Y245 HydrophobicContact CZ-CD2 4.04Å; F241-Y245 HydrophobicContact CZ-CE1 4.21Å; F241-Y245 AromaticContact CZ-CE2 3.83Å; F241-Y245 HydrophobicContact CZ-CE2 3.83Å; F241-Y245 HydrophobicContact CZ-CG 4.33Å; F241-Y245 AromaticContact CZ-CZ 3.92Å; F241-Y245 WeakPolarHBondContact O-CB 3.29Å
242	Y	35.2	Very low	34.6	Very low	38 Å²	38	100.8 Å²	100.8	15%	0.149	47%	0.473	C	S	.	.	H	α-helix	trans	-85.4	-25.2	-171	-90.1	-98.4	0	0	0	115.3	K238 L240 E246 A349	K238-Y242 WeakPolarHBondContact O-CD2 3.47Å; L240-Y242 VanDerWaalsContact C-N 3.33Å; L240-Y242 PolarHBondContact O-N 2.9Å; Y242-E246 HydrophobicContact CD1-CG 4.25Å; Y242-A349 HydrophobicContact CE1-CB 4.09Å; Y242-A349 VanDerWaalsContact OH-CB 3.25Å; Y242-A349 WeakPolarHBondContact OH-CB 3.44Å
243	K	37.5	Very low	35	Very low	187 Å²	187	95.8 Å²	95.8	81%	0.813	45%	0.449	S	S	*	.	H	α-helix	trans	-80.1	-31.8	-169.7	-99	-176.1	174.5	-178.8	0	114.9
244	E	33.6	Very low	35.5	Very low	169 Å²	169	93.9 Å²	93.9	79%	0.79	45%	0.446	S	S	*	.	H	α-helix	trans	-96.4	-21.6	178.6	-72.8	-178.3	157.5	0	0	112.9
245	Y	35	Very low	35.8	Very low	75 Å²	75	99.5 Å²	99.5	29%	0.294	46%	0.464	S	S	.	.	H	α-helix	trans	-88.3	-30.4	-170.6	-140.1	-98.4	0	0	0	113.5	F241 M247 V249 V342 Y343	F241-Y245 HydrophobicContact CD1-CG 4.49Å; F241-Y245 AromaticContact CE1-CD1 3.93Å; F241-Y245 HydrophobicContact CE1-CD1 3.93Å; F241-Y245 HydrophobicContact CE1-CD2 4.15Å; F241-Y245 HydrophobicContact CE1-CE1 4.06Å; F241-Y245 HydrophobicContact CE1-CE2 4.29Å; F241-Y245 AromaticContact CE1-CG 3.98Å; F241-Y245 HydrophobicContact CE1-CG 3.98Å; F241-Y245 HydrophobicContact CE2-CE2 4.46Å; F241-Y245 HydrophobicContact CZ-CD1 4.41Å; F241-Y245 HydrophobicContact CZ-CD2 4.04Å; F241-Y245 HydrophobicContact CZ-CE1 4.21Å; F241-Y245 AromaticContact CZ-CE2 3.83Å; F241-Y245 HydrophobicContact CZ-CE2 3.83Å; F241-Y245 HydrophobicContact CZ-CG 4.33Å; F241-Y245 AromaticContact CZ-CZ 3.92Å; F241-Y245 WeakPolarHBondContact O-CB 3.29Å; Y245-M247 PolarHBondContact O-N 3.48Å; Y245-V249 HydrophobicContact CD1-CG2 3.6Å; Y245-V249 HydrophobicContact CE1-CG2 3.73Å; Y245-V249 HydrophobicContact CG-CG2 4.28Å; Y245-V249 WeakPolarHBondContact O-CB 3.35Å; Y245-V249 WeakPolarHBondContact O-CG2 3.23Å; Y245-V249 PolarHBondContact O-N 3.47Å; Y245-V342 PolarHBondContact OH-O 3.49Å; Y245-V342 VanDerWaalsContact OH-O 3.05Å; Y245-Y343 HydrophobicContact CE1-CD1 4.35Å
246	E	40.2	Very low	36.2	Very low	51 Å²	51	100.9 Å²	100.9	24%	0.238	47%	0.47	C	S	.	.	H	α-helix	trans	-72.9	-27.1	-173.9	-81.1	-172.5	140.8	0	0	114.8	Y242 R380 P383	Y242-E246 HydrophobicContact CD1-CG 4.25Å; E246-R380 IonicContact OE1-CZ 2.78Å; E246-R380 IonicContact OE1-NE 3.65Å; E246-R380 IonicContact OE1-NH2 3.93Å; E246-R380 PolarHBondContact OE1-NH2 2.97Å; E246-R380 IonicContact OE2-CZ 3.69Å; E246-R380 IonicContact OE2-NH2 3.72Å; E246-R380 PolarHBondContact OE2-NH2 3.05Å; E246-P383 HydrophobicContact CG-CG 4.46Å; E246-P383 WeakPolarHBondContact OE1-CD 3.22Å; E246-P383 WeakPolarHBondContact OE1-CG 3.48Å
247	M	38.1	Very low	36.9	Very low	153 Å²	153	101.5 Å²	101.5	75%	0.754	48%	0.478	S	S	*	.	H	α-helix	trans	-82.2	-37.5	-178.9	-77.3	-177.1	45.7	0	0	113.2	Y245	Y245-M247 PolarHBondContact O-N 3.48Å
248	N	39.6	Very low	37.9	Very low	108 Å²	108	97 Å²	97	58%	0.578	46%	0.457	S	S	*	.	H	α-helix	trans	-84.5	-23.5	-176	-73.8	-24.2	0	0	0	114.1	N252	N248-N252 PolarHBondContact O-N 2.94Å; N248-N252 PolarHBondContact O-ND2 2.85Å
249	V	38	Very low	38.5	Very low	5 Å²	5	101.8 Å²	101.8	3%	0.03	48%	0.479	C	S	.	.	H	α-helix	trans	-81.6	-40.6	-176.6	177.5	0	0	0	0	111.7	Y245 E251 N252 I253 Y343 P384	Y245-V249 HydrophobicContact CD1-CG2 3.6Å; Y245-V249 HydrophobicContact CE1-CG2 3.73Å; Y245-V249 HydrophobicContact CG-CG2 4.28Å; Y245-V249 WeakPolarHBondContact O-CB 3.35Å; Y245-V249 WeakPolarHBondContact O-CG2 3.23Å; Y245-V249 PolarHBondContact O-N 3.47Å; V249-E251 VanDerWaalsContact C-N 3.31Å; V249-E251 PolarHBondContact O-N 2.84Å; V249-N252 PolarHBondContact O-N 3.27Å; V249-I253 HydrophobicContact CG1-CD1 3.4Å; V249-I253 HydrophobicContact CG1-CG1 3.99Å; V249-I253 VanDerWaalsContact O-CB 3.24Å; V249-I253 WeakPolarHBondContact O-CB 3.41Å; V249-I253 WeakPolarHBondContact O-CG1 3.42Å; V249-I253 PolarHBondContact O-N 2.88Å; V249-Y343 HydrophobicContact CB-CD1 4.02Å; V249-Y343 HydrophobicContact CB-CE1 4.13Å; V249-Y343 HydrophobicContact CG1-CD1 3.5Å; V249-Y343 HydrophobicContact CG1-CD2 4.48Å; V249-Y343 HydrophobicContact CG1-CE1 3.88Å; V249-Y343 HydrophobicContact CG1-CG 3.83Å; V249-Y343 HydrophobicContact CG2-CD1 3.38Å; V249-Y343 HydrophobicContact CG2-CE1 3.59Å; V249-Y343 HydrophobicContact CG2-CG 4.43Å; V249-P384 HydrophobicContact CB-CG 4.46Å; V249-P384 HydrophobicContact CG1-CB 4.06Å; V249-P384 HydrophobicContact CG1-CG 3.73Å
250	S	40.2	Very low	39.5	Very low	32 Å²	32	97.4 Å²	97.4	22%	0.224	46%	0.462	C	S	.	.	H	α-helix	trans	-65.2	-31.8	-179.3	-71.1	0	0	0	0	113.3	K254	S250-K254 VanDerWaalsContact O-CG 3.31Å; S250-K254 WeakPolarHBondContact O-CG 3.24Å
251	E	39.7	Very low	40.6	Very low	133 Å²	133	91.1 Å²	91.1	62%	0.621	43%	0.429	S	S	*	.	H	α-helix	trans	-78.8	-39.4	175.8	-69.3	-165.1	155.5	0	0	112.9	V249 K254	V249-E251 VanDerWaalsContact C-N 3.31Å; V249-E251 PolarHBondContact O-N 2.84Å; E251-K254 WeakPolarHBondContact O-CB 3.44Å; E251-K254 PolarHBondContact O-N 3.44Å
252	N	36	Very low	41.8	Very low	69 Å²	69	89.8 Å²	89.8	37%	0.369	42%	0.424	S	S	.	.	H	α-helix	trans	-70.4	-37.2	178.6	-80.1	-46	0	0	0	112.8	N248 V249 K254 R255 Y343	N248-N252 PolarHBondContact O-N 2.94Å; N248-N252 PolarHBondContact O-ND2 2.85Å; V249-N252 PolarHBondContact O-N 3.27Å; N252-K254 PolarHBondContact O-N 3.31Å; N252-R255 PolarHBondContact O-N 3.39Å; N252-R255 VanDerWaalsContact O-N 3.14Å; N252-Y343 VanDerWaalsContact CB-OH 3.3Å; N252-Y343 WeakPolarHBondContact CB-OH 3.46Å
253	I	39.7	Very low	42.7	Very low	0 Å²	0	88.6 Å²	88.6	0%	0	42%	0.42	C	S	.	.	H	α-helix	trans	-62.9	-26.9	172.1	-73.1	-177.5	0	0	0	111.8	V249 R255 F258 Y343 P384 A387 K391	V249-I253 HydrophobicContact CG1-CD1 3.4Å; V249-I253 HydrophobicContact CG1-CG1 3.99Å; V249-I253 VanDerWaalsContact O-CB 3.24Å; V249-I253 WeakPolarHBondContact O-CB 3.41Å; V249-I253 WeakPolarHBondContact O-CG1 3.42Å; V249-I253 PolarHBondContact O-N 2.88Å; I253-R255 PolarHBondContact O-N 2.91Å; I253-F258 HydrophobicContact CB-CE1 4.22Å; I253-F258 HydrophobicContact CB-CZ 4.45Å; I253-F258 HydrophobicContact CD1-CE1 4.35Å; I253-F258 HydrophobicContact CG1-CE1 3.97Å; I253-F258 HydrophobicContact CG2-CE1 3.61Å; I253-F258 HydrophobicContact CG2-CZ 3.42Å; I253-F258 VanDerWaalsContact CG2-CZ 3.42Å; I253-Y343 HydrophobicContact CD1-CD2 4.49Å; I253-Y343 HydrophobicContact CG1-CD2 4.41Å; I253-Y343 HydrophobicContact CG1-CE2 4.2Å; I253-P384 HydrophobicContact CD1-CB 3.74Å; I253-A387 HydrophobicContact CG2-CB 4.05Å; I253-K391 PolarHBondContact O-NZ 2.75Å
254	K	41.2	Very low	43.3	Very low	141 Å²	141	83.8 Å²	83.8	61%	0.613	41%	0.406	S	S	*	.	H	α-helix	trans	-67.4	-23.9	176.5	-80.1	172.8	-175	178.8	0	112.7	S250 E251 N252 K391	S250-K254 VanDerWaalsContact O-CG 3.31Å; S250-K254 WeakPolarHBondContact O-CG 3.24Å; E251-K254 WeakPolarHBondContact O-CB 3.44Å; E251-K254 PolarHBondContact O-N 3.44Å; N252-K254 PolarHBondContact O-N 3.31Å; K254-K391 PolarHBondContact O-NZ 2.86Å
255	R	38.2	Very low	44	Very low	230 Å²	230	76.4 Å²	76.4	87%	0.868	38%	0.375	S	S	*	.	H	α-helix	trans	-109.5	-15.5	-168.2	-67.4	-175.8	174.9	178	0.1	116.6	N252 I253	N252-R255 PolarHBondContact O-N 3.39Å; N252-R255 VanDerWaalsContact O-N 3.14Å; I253-R255 PolarHBondContact O-N 2.91Å
256	K	38.7	Very low	44.6	Very low	107 Å²	107	79.1 Å²	79.1	47%	0.465	39%	0.386	S	S	.	.	S	Bend	trans	-119.4	149.2	-174.7	-67	-172.5	177.6	-173.7	0	113.4	S338	K256-S338 WeakPolarHBondContact CB-OG 3.45Å
257	S	46.2	Very low	45.3	Very low	103 Å²	103	79.1 Å²	79.1	72%	0.72	39%	0.386	S	S	*	.			trans	-69.3	135	164.7	50.5	0	0	0	0	109.4
258	F	51.8	Low	46.3	Very low	45 Å²	45	71.8 Å²	71.8	20%	0.197	35%	0.35	C	S	.	.			trans	-79.1	132.3	177.3	-49.9	-80.9	0	0	0	110.3	I253 V261 I336 L388	I253-F258 HydrophobicContact CB-CE1 4.22Å; I253-F258 HydrophobicContact CB-CZ 4.45Å; I253-F258 HydrophobicContact CD1-CE1 4.35Å; I253-F258 HydrophobicContact CG1-CE1 3.97Å; I253-F258 HydrophobicContact CG2-CE1 3.61Å; I253-F258 HydrophobicContact CG2-CZ 3.42Å; I253-F258 VanDerWaalsContact CG2-CZ 3.42Å; F258-V261 HydrophobicContact CB-CG2 4.42Å; F258-I336 HydrophobicContact CD1-CG2 3.46Å; F258-I336 VanDerWaalsContact CD1-CG2 3.46Å; F258-I336 HydrophobicContact CE1-CG2 3.95Å; F258-I336 HydrophobicContact CG-CG2 4.37Å; F258-L388 HydrophobicContact CD1-CD1 4.49Å; F258-L388 HydrophobicContact CD2-CD1 3.74Å; F258-L388 HydrophobicContact CE1-CD1 4.15Å; F258-L388 HydrophobicContact CE2-CD1 3.36Å; F258-L388 HydrophobicContact CG-CD1 4.26Å; F258-L388 HydrophobicContact CZ-CD1 3.53Å
259	E	49.3	Very low	47.7	Very low	131 Å²	131	68.6 Å²	68.6	61%	0.612	34%	0.336	S	S	*	.	S	Bend	trans	-83.6	-41.8	177.8	-70.5	171.1	174.1	0	0	110.4	E337 G339	E259-E337 PolarHBondContact N-O 2.93Å; E259-G339 VanDerWaalsContact CD-N 3.25Å; E259-G339 WeakPolarHBondContact OE1-CA 3.48Å; E259-G339 PolarHBondContact OE1-N 2.89Å; E259-G339 WeakPolarHBondContact OE2-CA 3.43Å; E259-G339 PolarHBondContact OE2-N 3.08Å
260	S	50.8	Low	49.4	Very low	25 Å²	25	68.5 Å²	68.5	18%	0.175	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	152	176.5	84.5	0	0	0	0	111.8	I336 E337	S260-I336 WeakPolarHBondContact O-CA 3.34Å; S260-E337 PolarHBondContact N-O 3.22Å; S260-E337 PolarHBondContact O-N 3.12Å; S260-E337 VanDerWaalsContact OG-CB 3.29Å; S260-E337 WeakPolarHBondContact OG-CB 3.26Å; S260-E337 VanDerWaalsContact OG-CD 3.24Å; S260-E337 VanDerWaalsContact OG-CG 3.25Å; S260-E337 WeakPolarHBondContact OG-CG 3.45Å; S260-E337 PolarHBondContact OG-OE2 3.04Å
261	V	52	Low	51.2	Low	8 Å²	8	69.6 Å²	69.6	5%	0.048	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	110.2	170.4	-178.4	0	0	0	0	107.9	F207 N210 F258 K335 I336 L388	F207-V261 HydrophobicContact CB-CG1 3.79Å; F207-V261 HydrophobicContact CD2-CG1 3.56Å; F207-V261 HydrophobicContact CG-CG1 4.07Å; N210-V261 PolarHBondContact ND2-O 3.42Å; F258-V261 HydrophobicContact CB-CG2 4.42Å; V261-K335 CarbonylContact C-O 3.45Å; V261-K335 WeakPolarHBondContact CA-O 3.33Å; V261-I336 HydrophobicContact CB-CG1 4.3Å; V261-I336 HydrophobicContact CG1-CG1 3.76Å; V261-I336 HydrophobicContact CG2-CG1 3.97Å; V261-I336 HydrophobicContact CG2-CG2 4.25Å; V261-L388 HydrophobicContact CG1-CD2 4Å; V261-L388 HydrophobicContact CG2-CD1 4.28Å; V261-L388 HydrophobicContact CG2-CD2 4.19Å
262	E	56.3	Low	53.1	Low	75 Å²	75	64.4 Å²	64.4	35%	0.35	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	150.2	-177.4	-58.5	-179.1	161	0	0	111.2	W334 K335	E262-W334 CarbonylContact O-C 3.58Å; E262-W334 VanDerWaalsContact O-CA 3.31Å; E262-W334 WeakPolarHBondContact O-CA 3.34Å; E262-K335 HydrophobicContact CB-CB 4.29Å; E262-K335 PolarHBondContact N-O 3.29Å; E262-K335 PolarHBondContact O-N 3.43Å; E262-K335 VanDerWaalsContact O-O 3.12Å; E262-K335 IonicContact OE2-NZ 3.97Å
263	Y	54.3	Low	55	Low	14 Å²	14	61.1 Å²	61.1	6%	0.055	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	123.3	168.2	175.4	-99.2	0	0	0	107.3	N210 V211 V214 Y266 I268 G332 T333 L347	N210-Y263 WeakPolarHBondContact O-CB 3.3Å; V211-Y263 HydrophobicContact CG2-CD2 3.79Å; V211-Y263 HydrophobicContact CG2-CE2 4.48Å; V211-Y263 HydrophobicContact CG2-CG 3.97Å; V214-Y263 HydrophobicContact CB-CD1 3.61Å; V214-Y263 HydrophobicContact CB-CE1 3.61Å; V214-Y263 HydrophobicContact CG1-CD1 4.15Å; V214-Y263 HydrophobicContact CG1-CE1 3.79Å; V214-Y263 HydrophobicContact CG2-CD1 3.5Å; V214-Y263 HydrophobicContact CG2-CE1 4.02Å; Y263-Y266 VanDerWaalsContact CE1-O 3.27Å; Y263-Y266 WeakPolarHBondContact CE1-O 3.5Å; Y263-Y266 PolarHBondContact OH-O 3.11Å; Y263-I268 HydrophobicContact CE1-CD1 4.02Å; Y263-I268 HydrophobicContact CE1-CG1 4.19Å; Y263-I268 HydrophobicContact CE2-CD1 4.25Å; Y263-G332 WeakPolarHBondContact OH-CA 3.18Å; Y263-T333 WeakPolarHBondContact CD2-O 3.46Å; Y263-T333 WeakPolarHBondContact CE2-O 3.38Å; Y263-L347 HydrophobicContact CD2-CD1 4.26Å; Y263-L347 HydrophobicContact CD2-CD2 3.86Å; Y263-L347 HydrophobicContact CD2-CG 4.21Å; Y263-L347 HydrophobicContact CE2-CD1 3.49Å; Y263-L347 VanDerWaalsContact CE2-CD1 3.49Å; Y263-L347 HydrophobicContact CE2-CD2 3.84Å; Y263-L347 HydrophobicContact CE2-CG 3.66Å
264	T	49.5	Very low	57	Low	86 Å²	86	61.1 Å²	61.1	53%	0.528	30%	0.295	S	S	.	.			trans	-114.6	7.1	-173.3	55.7	0	0	0	0	112.3	T333 K335	T264-T333 PolarHBondContact N-O 3.43Å; T264-T333 PolarHBondContact OG1-OG1 3.07Å; T264-K335 HydrophobicContact CG2-CB 4.32Å
265	G	50	Low	59.2	Low	13 Å²	13	54.4 Å²	54.4	13%	0.134	27%	0.266	C	S	.	.	S	Bend	trans	-87.9	-174.3	-170.9	0	0	0	0	0	115.4	V214 T333	V214-G265 VanDerWaalsContact CG1-O 3.24Å; V214-G265 WeakPolarHBondContact CG1-O 3.24Å; G265-T333 VanDerWaalsContact CA-OG1 3.29Å; G265-T333 WeakPolarHBondContact CA-OG1 3.4Å; G265-T333 PolarHBondContact N-O 3.16Å; G265-T333 PolarHBondContact N-OG1 3.38Å
266	Y	47.4	Very low	61.4	Low	133 Å²	133	43.5 Å²	43.5	52%	0.522	22%	0.224	S	C	.	.	S	Bend	trans	-60.1	160	173.7	-69.8	-92.2	0	0	0	112.2	Y263 I268 Y331	Y263-Y266 VanDerWaalsContact CE1-O 3.27Å; Y263-Y266 WeakPolarHBondContact CE1-O 3.5Å; Y263-Y266 PolarHBondContact OH-O 3.11Å; Y266-I268 PolarHBondContact O-N 2.96Å; Y266-Y331 VanDerWaalsContact CD2-CB 3.42Å; Y266-Y331 HydrophobicContact CD2-CG 4.38Å; Y266-Y331 HydrophobicContact CE2-CD1 4.42Å; Y266-Y331 HydrophobicContact CE2-CG 4.35Å
267	E	54.6	Low	63.5	Low	50 Å²	50	38.7 Å²	38.7	23%	0.234	20%	0.204	C	C	.	.			trans	-69	129.1	-178.9	-55.1	-155.2	-143.9	0	0	113.4	V214 H217 A218	V214-E267 HydrophobicContact CG1-CB 4.47Å; V214-E267 HydrophobicContact CG1-CG 3.91Å; V214-E267 WeakPolarHBondContact O-CA 3.42Å; V214-E267 WeakPolarHBondContact O-CB 3.43Å; V214-E267 WeakPolarHBondContact O-CG 3.49Å; H217-E267 VanDerWaalsContact CA-CD 3.44Å; H217-E267 VanDerWaalsContact CA-OE1 3.3Å; H217-E267 WeakPolarHBondContact CA-OE1 3.28Å; H217-E267 WeakPolarHBondContact CA-OE2 3.43Å; H217-E267 VanDerWaalsContact CB-CD 3.42Å; H217-E267 WeakPolarHBondContact CB-OE1 3.47Å; H217-E267 VanDerWaalsContact CB-OE2 3.29Å; H217-E267 WeakPolarHBondContact CB-OE2 3.39Å; H217-E267 PolarHBondContact N-OE2 3.42Å; A218-E267 WeakPolarHBondContact CA-OE1 3.3Å; A218-E267 VanDerWaalsContact CA-OE2 3.32Å; A218-E267 WeakPolarHBondContact CA-OE2 3.3Å; A218-E267 HydrophobicContact CB-CB 3.39Å; A218-E267 HydrophobicContact CB-CG 3.62Å; A218-E267 WeakPolarHBondContact CB-OE1 3.25Å; A218-E267 VanDerWaalsContact CB-OE2 3.29Å; A218-E267 WeakPolarHBondContact CB-OE2 3.13Å; A218-E267 PolarHBondContact N-OE1 2.79Å; A218-E267 PolarHBondContact N-OE2 3.29Å
268	I	59.7	Low	65.3	Low	0 Å²	0	34 Å²	34	0%	0	17%	0.172	C	C	.	.			trans	-124.2	106.8	-173.4	46.7	178.1	0	0	0	110.6	V211 A215 Y263 Y266 E272 V273 V328 L329 L347	V211-I268 HydrophobicContact CB-CD1 3.94Å; V211-I268 HydrophobicContact CG1-CD1 3.15Å; V211-I268 HydrophobicContact CG1-CG1 4.37Å; V211-I268 HydrophobicContact CG2-CD1 4.46Å; V211-I268 WeakPolarHBondContact O-CD1 3.3Å; V211-I268 WeakPolarHBondContact O-CG1 3.5Å; A215-I268 WeakPolarHBondContact CA-O 2.91Å; A215-I268 WeakPolarHBondContact CB-O 3.26Å; Y263-I268 HydrophobicContact CE1-CD1 4.02Å; Y263-I268 HydrophobicContact CE1-CG1 4.19Å; Y263-I268 HydrophobicContact CE2-CD1 4.25Å; Y266-I268 PolarHBondContact O-N 2.96Å; I268-E272 VanDerWaalsContact CA-OE2 3.25Å; I268-E272 WeakPolarHBondContact CA-OE2 3.3Å; I268-E272 HydrophobicContact CB-CB 3.93Å; I268-E272 HydrophobicContact CG2-CB 4.19Å; I268-V273 HydrophobicContact CD1-CG2 4.18Å; I268-V273 HydrophobicContact CG1-CG2 4.27Å; I268-V328 HydrophobicContact CG2-CG1 3.7Å; I268-L329 HydrophobicContact CG2-CD2 4.13Å; I268-L347 HydrophobicContact CD1-CD1 4.01Å
269	S	68.6	Low	67	Low	40 Å²	40	31.9 Å²	31.9	28%	0.28	16%	0.162	S	C	.	.			trans	-48	157.2	171.7	63.1	0	0	0	0	113.3	E271 E272 V273	S269-E271 PolarHBondContact O-N 3.19Å; S269-E272 WeakPolarHBondContact CB-OE2 3.44Å; S269-E272 PolarHBondContact N-OE2 3.39Å; S269-E272 WeakPolarHBondContact O-CA 3.01Å; S269-E272 WeakPolarHBondContact O-CB 2.93Å; S269-E272 PolarHBondContact O-N 2.96Å; S269-E272 PolarHBondContact OG-N 3.24Å; S269-E272 PolarHBondContact OG-OE2 3.26Å; S269-V273 WeakPolarHBondContact O-CG2 3.48Å; S269-V273 PolarHBondContact O-N 3.41Å
270	L	73	Confident	68.5	Low	3 Å²	3	26 Å²	26	2%	0.016	14%	0.135	C	C	.	.	H	α-helix	trans	-52.8	-31.2	173.5	178.7	60.9	0	0	0	112.9	V273 L274 I401 L405 N412 D413 A416	L270-V273 PolarHBondContact O-N 3.15Å; L270-L274 HydrophobicContact CD1-CG 4.42Å; L270-L274 HydrophobicContact CG-CD1 4.21Å; L270-L274 WeakPolarHBondContact O-CB 3.31Å; L270-L274 VanDerWaalsContact O-CG 3.23Å; L270-L274 WeakPolarHBondContact O-CG 3.07Å; L270-L274 PolarHBondContact O-N 2.93Å; L270-I401 HydrophobicContact CD1-CG2 3.91Å; L270-L405 HydrophobicContact CB-CD1 4.45Å; L270-L405 HydrophobicContact CD2-CB 4.26Å; L270-L405 HydrophobicContact CD2-CD1 3.88Å; L270-L405 HydrophobicContact CG-CD1 4.15Å; L270-N412 HydrophobicContact CD2-CB 4.35Å; L270-D413 WeakPolarHBondContact CB-OD1 2.85Å; L270-A416 HydrophobicContact CD1-CB 3.44Å; L270-A416 VanDerWaalsContact CD1-CB 3.44Å; L270-A416 HydrophobicContact CD2-CB 3.79Å; L270-A416 HydrophobicContact CG-CB 4.27Å
271	E	78.6	Confident	69.8	Low	56 Å²	56	26.3 Å²	26.3	26%	0.262	13%	0.133	S	C	.	.	H	α-helix	trans	-66.9	-42.9	174.9	-61	-175.7	148.7	0	0	112.1	S269 V273 L274 V275 K321 L405	S269-E271 PolarHBondContact O-N 3.19Å; E271-V273 VanDerWaalsContact C-N 3.33Å; E271-L274 PolarHBondContact O-N 3.18Å; E271-V275 WeakPolarHBondContact O-CG2 2.87Å; E271-V275 PolarHBondContact O-N 3.02Å; E271-K321 WeakPolarHBondContact OE1-CE 3.42Å; E271-K321 IonicContact OE1-NZ 2.84Å; E271-K321 PolarHBondContact OE1-NZ 3.18Å; E271-K321 WeakPolarHBondContact OE2-CE 3.18Å; E271-K321 IonicContact OE2-NZ 3.75Å; E271-K321 PolarHBondContact OE2-NZ 3.41Å; E271-L405 HydrophobicContact CG-CD1 3.79Å
272	E	80	Confident	71.4	Confident	23 Å²	23	26.4 Å²	26.4	11%	0.107	13%	0.133	C	C	.	.	H	α-helix	trans	-62.7	-41	173.1	-79.6	140.9	-179.8	0	0	111.3	I268 S269 L274 V275 F276 C325 V328 L329	I268-E272 VanDerWaalsContact CA-OE2 3.25Å; I268-E272 WeakPolarHBondContact CA-OE2 3.3Å; I268-E272 HydrophobicContact CB-CB 3.93Å; I268-E272 HydrophobicContact CG2-CB 4.19Å; S269-E272 WeakPolarHBondContact CB-OE2 3.44Å; S269-E272 PolarHBondContact N-OE2 3.39Å; S269-E272 WeakPolarHBondContact O-CA 3.01Å; S269-E272 WeakPolarHBondContact O-CB 2.93Å; S269-E272 PolarHBondContact O-N 2.96Å; S269-E272 PolarHBondContact OG-N 3.24Å; S269-E272 PolarHBondContact OG-OE2 3.26Å; E272-L274 PolarHBondContact O-N 3.18Å; E272-V275 PolarHBondContact O-N 2.84Å; E272-F276 WeakPolarHBondContact O-CB 2.71Å; E272-F276 PolarHBondContact O-N 3.01Å; E272-C325 HydrophobicContact CB-CB 4.48Å; E272-C325 HydrophobicContact CG-CB 3.63Å; E272-V328 HydrophobicContact CG-CB 4.37Å; E272-V328 WeakPolarHBondContact OE1-CG2 3.37Å; E272-L329 HydrophobicContact CB-CD2 4.29Å; E272-L329 HydrophobicContact CB-CG 4.41Å
273	V	75.9	Confident	72.5	Confident	1 Å²	1	23 Å²	23	1%	0.006	12%	0.117	C	C	.	.	H	α-helix	trans	-61.3	-44.4	173.3	-179.2	0	0	0	0	111.3	V208 V211 I212 I268 S269 L270 E271 V275 F276 L277	V208-V273 HydrophobicContact CG1-CG1 4.24Å; V211-V273 HydrophobicContact CG1-CG1 4.28Å; V211-V273 HydrophobicContact CG1-CG2 3.91Å; I212-V273 HydrophobicContact CD1-CG1 4.02Å; I212-V273 HydrophobicContact CG1-CB 4.12Å; I212-V273 HydrophobicContact CG1-CG1 3.58Å; I212-V273 HydrophobicContact CG1-CG2 3.76Å; I268-V273 HydrophobicContact CD1-CG2 4.18Å; I268-V273 HydrophobicContact CG1-CG2 4.27Å; S269-V273 WeakPolarHBondContact O-CG2 3.48Å; S269-V273 PolarHBondContact O-N 3.41Å; L270-V273 PolarHBondContact O-N 3.15Å; E271-V273 VanDerWaalsContact C-N 3.33Å; V273-V275 PolarHBondContact O-N 2.71Å; V273-F276 WeakPolarHBondContact O-CB 3.46Å; V273-F276 PolarHBondContact O-N 3.22Å; V273-L277 HydrophobicContact CG1-CD1 4.03Å; V273-L277 HydrophobicContact CG1-CG 4.28Å; V273-L277 WeakPolarHBondContact O-CB 3.34Å; V273-L277 VanDerWaalsContact O-CG 3.3Å; V273-L277 WeakPolarHBondContact O-CG 3.43Å; V273-L277 PolarHBondContact O-N 3.32Å
274	L	80.9	Confident	73.4	Confident	0 Å²	0	24 Å²	24	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-66	-37.9	178.8	-74.4	169.7	0	0	0	112.5	L270 E271 E272 F276 L277 A278 F307 I308 I398 I401 L405	L270-L274 HydrophobicContact CD1-CG 4.42Å; L270-L274 HydrophobicContact CG-CD1 4.21Å; L270-L274 WeakPolarHBondContact O-CB 3.31Å; L270-L274 VanDerWaalsContact O-CG 3.23Å; L270-L274 WeakPolarHBondContact O-CG 3.07Å; L270-L274 PolarHBondContact O-N 2.93Å; E271-L274 PolarHBondContact O-N 3.18Å; E272-L274 PolarHBondContact O-N 3.18Å; L274-F276 VanDerWaalsContact C-N 3.34Å; L274-L277 PolarHBondContact O-N 3.05Å; L274-A278 WeakPolarHBondContact O-CB 3.42Å; L274-A278 PolarHBondContact O-N 3.43Å; L274-F307 HydrophobicContact CD2-CE1 4.42Å; L274-F307 WeakPolarHBondContact O-CE1 3.17Å; L274-I308 HydrophobicContact CB-CD1 4.38Å; L274-I308 HydrophobicContact CB-CG1 4.03Å; L274-I308 HydrophobicContact CD1-CG2 4.23Å; L274-I398 HydrophobicContact CD2-CD1 3.52Å; L274-I401 HydrophobicContact CD1-CG2 4.39Å; L274-I401 HydrophobicContact CD2-CB 4.34Å; L274-I401 HydrophobicContact CD2-CG2 3.71Å; L274-I401 HydrophobicContact CG-CG2 4.31Å; L274-L405 HydrophobicContact CD1-CD2 3.82Å
275	V	88	Confident	74.6	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-61	-46	170.9	170.3	0	0	0	0	109.9	E271 E272 V273 A278 L279 I304 I308 C325 L326 L329	E271-V275 WeakPolarHBondContact O-CG2 2.87Å; E271-V275 PolarHBondContact O-N 3.02Å; E272-V275 PolarHBondContact O-N 2.84Å; V273-V275 PolarHBondContact O-N 2.71Å; V275-A278 WeakPolarHBondContact O-CB 3.42Å; V275-A278 PolarHBondContact O-N 3.35Å; V275-L279 HydrophobicContact CG1-CD1 4.46Å; V275-L279 WeakPolarHBondContact O-CG 3.42Å; V275-L279 PolarHBondContact O-N 3.32Å; V275-I304 HydrophobicContact CG2-CG2 4.01Å; V275-I308 HydrophobicContact CG2-CD1 3.64Å; V275-C325 HydrophobicContact CB-CB 4.09Å; V275-C325 HydrophobicContact CG1-CB 4.15Å; V275-C325 HydrophobicContact CG2-CB 3.82Å; V275-L326 HydrophobicContact CG1-CD2 4.3Å; V275-L329 HydrophobicContact CB-CD1 4.26Å; V275-L329 HydrophobicContact CG1-CD1 3.92Å
276	F	84.6	Confident	75.8	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-61.6	-45.4	178.2	-179.5	-124.3	0	0	0	112.5	F207 V211 E272 V273 L274 A278 L279 I280 L329 L347 I348 L385 F389	F207-F276 HydrophobicContact CD1-CE1 4.45Å; F207-F276 AromaticContact CE1-CE1 3.5Å; F207-F276 HydrophobicContact CE1-CE1 3.5Å; F207-F276 VanDerWaalsContact CE1-CE1 3.5Å; F207-F276 AromaticContact CE1-CZ 3.68Å; F207-F276 HydrophobicContact CE1-CZ 3.68Å; F207-F276 HydrophobicContact CZ-CE1 4.07Å; F207-F276 HydrophobicContact CZ-CZ 4.04Å; V211-F276 HydrophobicContact CG1-CD1 4.24Å; E272-F276 WeakPolarHBondContact O-CB 2.71Å; E272-F276 PolarHBondContact O-N 3.01Å; V273-F276 WeakPolarHBondContact O-CB 3.46Å; V273-F276 PolarHBondContact O-N 3.22Å; L274-F276 VanDerWaalsContact C-N 3.34Å; F276-A278 VanDerWaalsContact C-N 3.3Å; F276-A278 PolarHBondContact O-N 2.8Å; F276-L279 WeakPolarHBondContact O-CB 3.45Å; F276-L279 PolarHBondContact O-N 2.98Å; F276-L279 VanDerWaalsContact O-N 3.12Å; F276-I280 HydrophobicContact CD1-CD1 3.67Å; F276-I280 HydrophobicContact CD2-CD1 4.21Å; F276-I280 HydrophobicContact CD2-CG1 4.47Å; F276-I280 HydrophobicContact CE1-CD1 3.47Å; F276-I280 VanDerWaalsContact CE1-CD1 3.47Å; F276-I280 HydrophobicContact CE1-CG1 4.47Å; F276-I280 HydrophobicContact CE2-CD1 4Å; F276-I280 HydrophobicContact CE2-CG1 4.18Å; F276-I280 HydrophobicContact CG-CD1 4.05Å; F276-I280 HydrophobicContact CZ-CD1 3.63Å; F276-I280 HydrophobicContact CZ-CG1 4.18Å; F276-I280 WeakPolarHBondContact O-CD1 3.46Å; F276-I280 WeakPolarHBondContact O-CG1 3.37Å; F276-I280 PolarHBondContact O-N 3.23Å; F276-L329 HydrophobicContact CB-CD1 3.91Å; F276-L329 HydrophobicContact CB-CD2 3.83Å; F276-L329 HydrophobicContact CG-CD2 4.28Å; F276-L347 HydrophobicContact CD2-CB 4.36Å; F276-L347 HydrophobicContact CE1-CD2 4.08Å; F276-L347 HydrophobicContact CE2-CB 3.87Å; F276-L347 HydrophobicContact CE2-CD2 4.47Å; F276-L347 HydrophobicContact CZ-CB 4.12Å; F276-L347 HydrophobicContact CZ-CD2 3.86Å; F276-L347 HydrophobicContact CZ-CG 4.45Å; F276-I348 HydrophobicContact CD2-CG1 4.29Å; F276-I348 HydrophobicContact CE2-CG1 4.45Å; F276-L385 HydrophobicContact CZ-CD1 4.13Å; F276-F389 HydrophobicContact CE1-CE2 4.29Å; F276-F389 HydrophobicContact CE1-CZ 4.08Å; F276-F389 HydrophobicContact CZ-CE2 4.06Å; F276-F389 HydrophobicContact CZ-CZ 4.32Å
277	L	81	Confident	76.8	Confident	6 Å²	6	22.1 Å²	22.1	3%	0.031	11%	0.111	C	C	.	.	H	α-helix	trans	-60.9	-37.6	174	-70.1	173.2	0	0	0	112.2	I201 V203 V208 V273 L274 L279 I280 K281 F307	I201-L277 HydrophobicContact CD1-CD1 3.85Å; I201-L277 HydrophobicContact CD1-CD2 4.35Å; I201-L277 HydrophobicContact CD1-CG 4.49Å; V203-L277 HydrophobicContact CG2-CD2 4.44Å; V208-L277 HydrophobicContact CG1-CD1 4.48Å; V208-L277 HydrophobicContact CG1-CD2 4.23Å; V208-L277 HydrophobicContact CG2-CD2 4.02Å; V273-L277 HydrophobicContact CG1-CD1 4.03Å; V273-L277 HydrophobicContact CG1-CG 4.28Å; V273-L277 WeakPolarHBondContact O-CB 3.34Å; V273-L277 VanDerWaalsContact O-CG 3.3Å; V273-L277 WeakPolarHBondContact O-CG 3.43Å; V273-L277 PolarHBondContact O-N 3.32Å; L274-L277 PolarHBondContact O-N 3.05Å; L277-L279 VanDerWaalsContact C-N 3.33Å; L277-I280 HydrophobicContact CD2-CD1 4.25Å; L277-I280 PolarHBondContact O-N 2.94Å; L277-K281 WeakPolarHBondContact O-CB 3.41Å; L277-K281 PolarHBondContact O-N 3.08Å; L277-F307 HydrophobicContact CB-CE1 3.96Å; L277-F307 HydrophobicContact CB-CZ 4.05Å
278	A	85.6	Confident	77	Confident	6 Å²	6	28.4 Å²	28.4	5%	0.05	14%	0.138	C	C	.	.	H	α-helix	trans	-62.6	-41.2	174.2	0	0	0	0	0	111.7	L274 V275 F276 K281 N282 I304 F307	L274-A278 WeakPolarHBondContact O-CB 3.42Å; L274-A278 PolarHBondContact O-N 3.43Å; V275-A278 WeakPolarHBondContact O-CB 3.42Å; V275-A278 PolarHBondContact O-N 3.35Å; F276-A278 VanDerWaalsContact C-N 3.3Å; F276-A278 PolarHBondContact O-N 2.8Å; A278-K281 PolarHBondContact O-N 2.81Å; A278-N282 WeakPolarHBondContact O-CB 3.33Å; A278-N282 PolarHBondContact O-N 3.24Å; A278-I304 HydrophobicContact CB-CB 4.46Å; A278-I304 HydrophobicContact CB-CG1 4.03Å; A278-I304 HydrophobicContact CB-CG2 4.34Å; A278-F307 HydrophobicContact CB-CB 3.97Å; A278-F307 HydrophobicContact CB-CD1 3.46Å; A278-F307 VanDerWaalsContact CB-CD1 3.46Å; A278-F307 HydrophobicContact CB-CD2 4.43Å; A278-F307 HydrophobicContact CB-CE1 3.99Å; A278-F307 HydrophobicContact CB-CG 3.69Å
279	L	87.8	Confident	76.7	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-67.6	-42.7	176.8	-66	174.5	0	0	0	112	V275 F276 L277 K281 N282 T283 C299 I304 L326 I348 F377 Y379 I381	V275-L279 HydrophobicContact CG1-CD1 4.46Å; V275-L279 WeakPolarHBondContact O-CG 3.42Å; V275-L279 PolarHBondContact O-N 3.32Å; F276-L279 WeakPolarHBondContact O-CB 3.45Å; F276-L279 PolarHBondContact O-N 2.98Å; F276-L279 VanDerWaalsContact O-N 3.12Å; L277-L279 VanDerWaalsContact C-N 3.33Å; L279-K281 VanDerWaalsContact C-N 3.32Å; L279-K281 PolarHBondContact O-N 3.28Å; L279-N282 PolarHBondContact O-N 2.85Å; L279-T283 WeakPolarHBondContact O-CB 3.34Å; L279-T283 PolarHBondContact O-N 3.12Å; L279-T283 PolarHBondContact O-OG1 2.92Å; L279-C299 HydrophobicContact CD2-CB 4Å; L279-I304 HydrophobicContact CD2-CD1 4.08Å; L279-L326 HydrophobicContact CD1-CD2 3.62Å; L279-I348 HydrophobicContact CD1-CD1 3.35Å; L279-I348 HydrophobicContact CD1-CG1 4.34Å; L279-F377 HydrophobicContact CD2-CE2 4.01Å; L279-F377 HydrophobicContact CD2-CZ 3.96Å; L279-Y379 HydrophobicContact CB-CD2 4.23Å; L279-Y379 HydrophobicContact CB-CE2 3.85Å; L279-Y379 HydrophobicContact CD1-CD2 4.25Å; L279-Y379 HydrophobicContact CD2-CD1 4.05Å; L279-Y379 HydrophobicContact CD2-CD2 3.92Å; L279-Y379 HydrophobicContact CD2-CE1 4.13Å; L279-Y379 HydrophobicContact CD2-CE2 3.97Å; L279-Y379 HydrophobicContact CD2-CG 3.97Å; L279-Y379 HydrophobicContact CG-CD2 4.37Å; L279-Y379 HydrophobicContact CG-CE2 4.37Å; L279-Y379 PolarHBondContact O-OH 2.79Å; L279-I381 HydrophobicContact CB-CD1 4.21Å
280	I	79.2	Confident	75.9	Confident	7 Å²	7	35.6 Å²	35.6	4%	0.036	19%	0.186	C	C	.	.	H	α-helix	trans	-59.3	-46.6	175.9	-67.5	154.3	0	0	0	110.1	F276 L277 N282 T283 T284 I381 F389	F276-I280 HydrophobicContact CD1-CD1 3.67Å; F276-I280 HydrophobicContact CD2-CD1 4.21Å; F276-I280 HydrophobicContact CD2-CG1 4.47Å; F276-I280 HydrophobicContact CE1-CD1 3.47Å; F276-I280 VanDerWaalsContact CE1-CD1 3.47Å; F276-I280 HydrophobicContact CE1-CG1 4.47Å; F276-I280 HydrophobicContact CE2-CD1 4Å; F276-I280 HydrophobicContact CE2-CG1 4.18Å; F276-I280 HydrophobicContact CG-CD1 4.05Å; F276-I280 HydrophobicContact CZ-CD1 3.63Å; F276-I280 HydrophobicContact CZ-CG1 4.18Å; F276-I280 WeakPolarHBondContact O-CD1 3.46Å; F276-I280 WeakPolarHBondContact O-CG1 3.37Å; F276-I280 PolarHBondContact O-N 3.23Å; L277-I280 HydrophobicContact CD2-CD1 4.25Å; L277-I280 PolarHBondContact O-N 2.94Å; I280-N282 VanDerWaalsContact C-N 3.34Å; I280-N282 PolarHBondContact O-N 3Å; I280-T283 WeakPolarHBondContact O-CB 3.46Å; I280-T283 PolarHBondContact O-N 3.13Å; I280-T283 VanDerWaalsContact O-N 3.12Å; I280-T284 HydrophobicContact CG2-CG2 4.4Å; I280-T284 WeakPolarHBondContact O-CG2 3.45Å; I280-T284 PolarHBondContact O-N 3.28Å; I280-T284 PolarHBondContact O-OG1 2.63Å; I280-I381 HydrophobicContact CB-CD1 4.4Å; I280-I381 HydrophobicContact CG1-CD1 3.83Å; I280-F389 HydrophobicContact CD1-CD1 4.34Å; I280-F389 HydrophobicContact CD1-CD2 4.02Å; I280-F389 HydrophobicContact CD1-CE1 3.69Å; I280-F389 HydrophobicContact CD1-CE2 3.31Å; I280-F389 HydrophobicContact CD1-CZ 3.11Å; I280-F389 HydrophobicContact CG1-CD2 3.99Å; I280-F389 HydrophobicContact CG1-CE2 3.71Å; I280-F389 HydrophobicContact CG1-CZ 4.01Å; I280-F389 HydrophobicContact CG2-CB 4.05Å; I280-F389 HydrophobicContact CG2-CD1 3.85Å; I280-F389 HydrophobicContact CG2-CD2 3.89Å; I280-F389 HydrophobicContact CG2-CE1 4.27Å; I280-F389 HydrophobicContact CG2-CE2 4.32Å; I280-F389 HydrophobicContact CG2-CG 3.67Å; I280-F389 HydrophobicContact CG2-CZ 4.49Å
281	K	78.6	Confident	74.9	Confident	32 Å²	32	42.3 Å²	42.3	14%	0.139	22%	0.217	C	C	.	.	H	α-helix	trans	-59.9	-43.3	175.8	179.8	172.6	-176.1	161.4	0	112.5	K199 I201 L277 A278 L279 T283 T284 Q285 F307	K199-K281 PolarHBondContact O-NZ 2.99Å; I201-K281 HydrophobicContact CG2-CD 4.15Å; L277-K281 WeakPolarHBondContact O-CB 3.41Å; L277-K281 PolarHBondContact O-N 3.08Å; A278-K281 PolarHBondContact O-N 2.81Å; L279-K281 VanDerWaalsContact C-N 3.32Å; L279-K281 PolarHBondContact O-N 3.28Å; K281-T283 VanDerWaalsContact C-N 3.28Å; K281-T283 PolarHBondContact O-N 2.86Å; K281-T284 PolarHBondContact O-N 2.97Å; K281-T284 PolarHBondContact O-OG1 3.32Å; K281-T284 VanDerWaalsContact O-OG1 3.05Å; K281-Q285 WeakPolarHBondContact O-CB 3.4Å; K281-Q285 VanDerWaalsContact O-CG 3.23Å; K281-Q285 WeakPolarHBondContact O-CG 3.27Å; K281-Q285 PolarHBondContact O-N 2.8Å; K281-Q285 VanDerWaalsContact O-N 3.07Å; K281-F307 HydrophobicContact CD-CD2 3.87Å; K281-F307 HydrophobicContact CD-CE2 3.52Å
282	N	85.1	Confident	74.2	Confident	10 Å²	10	41.5 Å²	41.5	5%	0.053	22%	0.215	C	C	.	.	H	α-helix	trans	-64.6	-36.4	176	-173.8	78.6	0	0	0	111.1	A278 L279 I280 K286 T298 Y379	A278-N282 WeakPolarHBondContact O-CB 3.33Å; A278-N282 PolarHBondContact O-N 3.24Å; L279-N282 PolarHBondContact O-N 2.85Å; I280-N282 VanDerWaalsContact C-N 3.34Å; I280-N282 PolarHBondContact O-N 3Å; N282-K286 WeakPolarHBondContact O-CB 3.48Å; N282-K286 WeakPolarHBondContact O-CG 3.25Å; N282-K286 PolarHBondContact O-N 2.8Å; N282-T298 PolarHBondContact ND2-O 2.9Å; N282-Y379 WeakPolarHBondContact ND2-CE1 3.07Å; N282-Y379 PolarHBondContact ND2-OH 3.44Å
283	T	80.8	Confident	72.9	Confident	2 Å²	2	46 Å²	46	1%	0.012	25%	0.246	C	C	.	.	H	α-helix	trans	-66.1	-48.1	176	-63.7	0	0	0	0	112.4	L279 I280 K281 Q285 K286 Q287 L297 Y379 I381 I386	L279-T283 WeakPolarHBondContact O-CB 3.34Å; L279-T283 PolarHBondContact O-N 3.12Å; L279-T283 PolarHBondContact O-OG1 2.92Å; I280-T283 WeakPolarHBondContact O-CB 3.46Å; I280-T283 PolarHBondContact O-N 3.13Å; I280-T283 VanDerWaalsContact O-N 3.12Å; K281-T283 VanDerWaalsContact C-N 3.28Å; K281-T283 PolarHBondContact O-N 2.86Å; T283-Q285 VanDerWaalsContact C-N 3.26Å; T283-Q285 PolarHBondContact O-N 3Å; T283-K286 PolarHBondContact O-N 2.77Å; T283-Q287 HydrophobicContact CG2-CG 4.39Å; T283-Q287 WeakPolarHBondContact O-CB 3.46Å; T283-Q287 WeakPolarHBondContact O-CG 3.45Å; T283-Q287 PolarHBondContact O-N 3.22Å; T283-L297 HydrophobicContact CG2-CD1 3.66Å; T283-L297 WeakPolarHBondContact OG1-CD1 3.26Å; T283-Y379 PolarHBondContact N-OH 2.82Å; T283-Y379 VanDerWaalsContact OG1-CE2 3.27Å; T283-Y379 WeakPolarHBondContact OG1-CE2 3.42Å; T283-Y379 PolarHBondContact OG1-OH 3.24Å; T283-I381 HydrophobicContact CG2-CD1 4.39Å; T283-I381 VanDerWaalsContact OG1-CD1 3.25Å; T283-I381 WeakPolarHBondContact OG1-CD1 3.39Å; T283-I386 HydrophobicContact CG2-CD1 3.74Å; T283-I386 HydrophobicContact CG2-CG1 3.99Å; T283-I386 HydrophobicContact CG2-CG2 4.13Å
284	T	72.2	Confident	72.2	Confident	37 Å²	37	51.7 Å²	51.7	23%	0.227	27%	0.267	C	S	.	.	H	α-helix	trans	-66.5	-30	179.5	54.6	0	0	0	0	112.3	I280 K281	I280-T284 HydrophobicContact CG2-CG2 4.4Å; I280-T284 WeakPolarHBondContact O-CG2 3.45Å; I280-T284 PolarHBondContact O-N 3.28Å; I280-T284 PolarHBondContact O-OG1 2.63Å; K281-T284 PolarHBondContact O-N 2.97Å; K281-T284 PolarHBondContact O-OG1 3.32Å; K281-T284 VanDerWaalsContact O-OG1 3.05Å
285	Q	75	Confident	71.8	Confident	92 Å²	92	52.6 Å²	52.6	43%	0.43	28%	0.277	S	S	.	.	H	α-helix	trans	-70.2	-49.5	172.2	-73.2	176.4	-23.6	0	0	111.8	K281 T283 K288	K281-Q285 WeakPolarHBondContact O-CB 3.4Å; K281-Q285 VanDerWaalsContact O-CG 3.23Å; K281-Q285 WeakPolarHBondContact O-CG 3.27Å; K281-Q285 PolarHBondContact O-N 2.8Å; K281-Q285 VanDerWaalsContact O-N 3.07Å; T283-Q285 VanDerWaalsContact C-N 3.26Å; T283-Q285 PolarHBondContact O-N 3Å; Q285-K288 WeakPolarHBondContact O-CB 3.4Å; Q285-K288 PolarHBondContact O-N 2.92Å
286	K	76.1	Confident	71.5	Confident	58 Å²	58	53.1 Å²	53.1	25%	0.252	28%	0.28	S	S	.	.	H	α-helix	trans	-74.4	-25	-175.2	-71.5	-171.5	175.3	-155	0	115	N282 T283 K288 D289 L297 T298	N282-K286 WeakPolarHBondContact O-CB 3.48Å; N282-K286 WeakPolarHBondContact O-CG 3.25Å; N282-K286 PolarHBondContact O-N 2.8Å; T283-K286 PolarHBondContact O-N 2.77Å; K286-K288 PolarHBondContact O-N 3.17Å; K286-D289 WeakPolarHBondContact O-CB 3.36Å; K286-D289 PolarHBondContact O-N 2.96Å; K286-L297 HydrophobicContact CB-CD1 4.4Å; K286-L297 HydrophobicContact CB-CD2 4.18Å; K286-T298 VanDerWaalsContact CE-O 3.25Å; K286-T298 WeakPolarHBondContact CE-O 3.48Å; K286-T298 PolarHBondContact NZ-O 2.87Å; K286-T298 PolarHBondContact NZ-OG1 2.87Å
287	Q	66.5	Low	71.6	Confident	41 Å²	41	54.3 Å²	54.3	19%	0.192	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-69.4	-10.7	175.4	-78.5	-166.5	-21.3	0	0	113.6	T283	T283-Q287 HydrophobicContact CG2-CG 4.39Å; T283-Q287 WeakPolarHBondContact O-CB 3.46Å; T283-Q287 WeakPolarHBondContact O-CG 3.45Å; T283-Q287 PolarHBondContact O-N 3.22Å
288	K	59.7	Low	72	Confident	183 Å²	183	54.9 Å²	54.9	80%	0.796	29%	0.29	S	S	*	.	G	3₁₀ helix	trans	-73.2	-19.2	167.7	-64.2	-171.9	175.2	-168.4	0	112.4	Q285 K286	Q285-K288 WeakPolarHBondContact O-CB 3.4Å; Q285-K288 PolarHBondContact O-N 2.92Å; K286-K288 PolarHBondContact O-N 3.17Å
289	D	53.9	Low	72.2	Confident	136 Å²	136	54.7 Å²	54.7	73%	0.727	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-97.3	12.9	-170.3	-55.4	-32.6	0	0	0	113.6	K286	K286-D289 WeakPolarHBondContact O-CB 3.36Å; K286-D289 PolarHBondContact O-N 2.96Å
290	G	52.2	Low	72.3	Confident	55 Å²	55	59.6 Å²	59.6	57%	0.567	31%	0.309	S	S	*	.			trans	103.5	133.4	-177.3	0	0	0	0	0	112.9	N292	G290-N292 PolarHBondContact O-N 2.81Å
291	E	52.2	Low	72.8	Confident	144 Å²	144	61.3 Å²	61.3	67%	0.673	32%	0.316	S	S	*	.			trans	-78.8	117	-174.2	-69.2	-174	159.3	0	0	111.3	P293	E291-P293 WeakPolarHBondContact O-CD 3.3Å
292	N	62.1	Low	73.2	Confident	39 Å²	39	60.7 Å²	60.7	21%	0.209	32%	0.319	C	S	.	.			trans	-64.5	119.5	158.4	177.1	-2	0	0	0	107.6	G290 W294 G295 I296	G290-N292 PolarHBondContact O-N 2.81Å; N292-W294 PolarHBondContact O-N 3.46Å; N292-W294 WeakPolarHBondContact OD1-CB 3.44Å; N292-W294 PolarHBondContact OD1-N 3.12Å; N292-G295 PolarHBondContact O-N 2.92Å; N292-I296 PolarHBondContact ND2-O 3.01Å
293	P	54.7	Low	73.3	Confident	118 Å²	118	64.1 Å²	64.1	77%	0.766	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-18.2	-177.7	20.6	-31	0	0	0	113.5	E291	E291-P293 WeakPolarHBondContact O-CD 3.3Å
294	W	60.2	Low	73.7	Confident	119 Å²	119	64 Å²	64	45%	0.451	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-6.9	177.5	-61.8	86.3	0	0	0	114	N292 I296 P366 R380	N292-W294 PolarHBondContact O-N 3.46Å; N292-W294 WeakPolarHBondContact OD1-CB 3.44Å; N292-W294 PolarHBondContact OD1-N 3.12Å; W294-I296 HydrophobicContact CB-CD1 4.06Å; W294-I296 HydrophobicContact CB-CG1 4Å; W294-I296 PolarHBondContact O-N 3.37Å; W294-I296 VanDerWaalsContact O-N 3.08Å; W294-P366 HydrophobicContact CB-CG 4.33Å; W294-P366 VanDerWaalsContact CD1-CG 3.41Å; W294-P366 HydrophobicContact CD2-CG 3.82Å; W294-P366 HydrophobicContact CG-CB 4.26Å; W294-P366 HydrophobicContact CG-CG 3.59Å; W294-R380 PolarHBondContact O-NE 2.89Å
295	G	73.4	Confident	74.4	Confident	20 Å²	20	63 Å²	63	21%	0.206	33%	0.33	C	S	.	.			trans	63.4	10.7	-173.9	0	0	0	0	0	114.3	N292	N292-G295 PolarHBondContact O-N 2.92Å
296	I	81.5	Confident	74.8	Confident	11 Å²	11	61.9 Å²	61.9	6%	0.056	33%	0.327	C	S	.	.			trans	-84.4	123.4	178.4	-59.2	174.4	0	0	0	108.7	N292 W294 Y352 L358 L369 Y378 Y379 R380	N292-I296 PolarHBondContact ND2-O 3.01Å; W294-I296 HydrophobicContact CB-CD1 4.06Å; W294-I296 HydrophobicContact CB-CG1 4Å; W294-I296 PolarHBondContact O-N 3.37Å; W294-I296 VanDerWaalsContact O-N 3.08Å; I296-Y352 HydrophobicContact CD1-CE2 4.48Å; I296-L358 HydrophobicContact CD1-CD1 3.94Å; I296-L358 HydrophobicContact CD1-CD2 4.25Å; I296-L369 HydrophobicContact CB-CD1 4.24Å; I296-L369 HydrophobicContact CG2-CD1 3.92Å; I296-Y378 HydrophobicContact CG2-CD1 4.06Å; I296-Y378 HydrophobicContact CG2-CG 4.2Å; I296-Y379 WeakPolarHBondContact CA-O 3.3Å; I296-R380 HydrophobicContact CG1-CB 4.45Å
297	L	86.2	Confident	75.2	Confident	24 Å²	24	59.8 Å²	59.8	13%	0.126	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	155.6	179.8	-63.2	178.8	0	0	0	110.8	T283 K286 Y378 Y379	T283-L297 HydrophobicContact CG2-CD1 3.66Å; T283-L297 WeakPolarHBondContact OG1-CD1 3.26Å; K286-L297 HydrophobicContact CB-CD1 4.4Å; K286-L297 HydrophobicContact CB-CD2 4.18Å; L297-Y378 CarbonylContact O-C 3.4Å; L297-Y378 VanDerWaalsContact O-CA 3.3Å; L297-Y378 WeakPolarHBondContact O-CA 3.21Å; L297-Y379 HydrophobicContact CB-CD1 4.31Å; L297-Y379 HydrophobicContact CB-CE1 3.61Å; L297-Y379 PolarHBondContact N-O 2.83Å; L297-Y379 WeakPolarHBondContact O-CD1 3.49Å; L297-Y379 PolarHBondContact O-N 3.31Å
298	T	88.6	Confident	75.9	Confident	19 Å²	19	57.9 Å²	57.9	12%	0.117	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	141.6	172.5	53.9	0	0	0	0	110.6	N282 K286 P370 L372 F377 Y378	N282-T298 PolarHBondContact ND2-O 2.9Å; K286-T298 VanDerWaalsContact CE-O 3.25Å; K286-T298 WeakPolarHBondContact CE-O 3.48Å; K286-T298 PolarHBondContact NZ-O 2.87Å; K286-T298 PolarHBondContact NZ-OG1 2.87Å; T298-P370 HydrophobicContact CG2-CG 4.05Å; T298-L372 HydrophobicContact CG2-CD2 3.79Å; T298-F377 CarbonylContact C-O 3.59Å; T298-F377 WeakPolarHBondContact CA-O 3.26Å; T298-Y378 HydrophobicContact CG2-CD1 3.53Å; T298-Y378 HydrophobicContact CG2-CE1 3.52Å
299	C	90.2	Very high	76.8	Confident	1 Å²	1	50.6 Å²	50.6	1%	0.007	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	136.5	170.5	-167.7	0	0	0	0	110.3	L279 E376 F377 Y379	L279-C299 HydrophobicContact CD2-CB 4Å; C299-E376 VanDerWaalsContact O-CA 3.29Å; C299-E376 WeakPolarHBondContact O-CA 3.4Å; C299-F377 HydrophobicContact CB-CE1 4.16Å; C299-F377 HydrophobicContact CB-CE2 4.07Å; C299-F377 HydrophobicContact CB-CZ 3.8Å; C299-F377 PolarHBondContact N-O 2.79Å; C299-F377 WeakPolarHBondContact O-CD1 3.42Å; C299-F377 PolarHBondContact O-N 3.43Å; C299-Y379 HydrophobicContact CB-CD1 3.83Å; C299-Y379 HydrophobicContact CB-CE1 3.59Å
300	K	90.7	Very high	78.1	Confident	104 Å²	104	44.8 Å²	44.8	45%	0.452	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	129.1	173.6	-170.6	176.5	-178.4	177.8	0	109.4	G302 N303 E376	K300-G302 PolarHBondContact O-N 2.79Å; K300-G302 VanDerWaalsContact O-N 3.07Å; K300-N303 WeakPolarHBondContact O-CB 2.99Å; K300-N303 PolarHBondContact O-N 2.82Å; K300-E376 HydrophobicContact CB-CG 4.08Å; K300-E376 HydrophobicContact CG-CG 4.21Å
301	K	88.8	Confident	78.9	Confident	43 Å²	43	48.6 Å²	48.6	19%	0.187	26%	0.257	C	S	.	.	H	α-helix	trans	-52.2	-34.4	176	72.7	-173.8	176.9	-173.2	0	112.8	N303 I304 I305 Y319 I322 G375	K301-N303 VanDerWaalsContact C-N 3.32Å; K301-N303 PolarHBondContact O-N 3.19Å; K301-I304 PolarHBondContact O-N 2.88Å; K301-I305 HydrophobicContact CG-CD1 4.49Å; K301-I305 WeakPolarHBondContact O-CG1 3.04Å; K301-I305 PolarHBondContact O-N 3.32Å; K301-Y319 HydrophobicContact CB-CD2 3.85Å; K301-Y319 HydrophobicContact CB-CE2 4.28Å; K301-Y319 HydrophobicContact CD-CD2 3.41Å; K301-Y319 VanDerWaalsContact CD-CD2 3.41Å; K301-Y319 HydrophobicContact CD-CE2 4.09Å; K301-Y319 HydrophobicContact CD-CG 4.07Å; K301-Y319 HydrophobicContact CG-CD2 4.25Å; K301-I322 HydrophobicContact CB-CD1 3.9Å; K301-G375 WeakPolarHBondContact CB-O 3.4Å; K301-G375 VanDerWaalsContact CG-O 3.29Å; K301-G375 WeakPolarHBondContact CG-O 3.3Å; K301-G375 PolarHBondContact N-O 2.68Å
302	G	86.5	Confident	79.3	Confident	19 Å²	19	49.5 Å²	49.5	20%	0.196	26%	0.258	C	S	.	.	H	α-helix	trans	-60.2	-39.5	176.5	0	0	0	0	0	112.6	K300 I304 I305 D306	K300-G302 PolarHBondContact O-N 2.79Å; K300-G302 VanDerWaalsContact O-N 3.07Å; G302-I304 VanDerWaalsContact C-N 3.27Å; G302-I304 PolarHBondContact O-N 2.68Å; G302-I305 PolarHBondContact O-N 2.88Å; G302-D306 VanDerWaalsContact O-CB 3.31Å; G302-D306 WeakPolarHBondContact O-CB 3.29Å; G302-D306 PolarHBondContact O-N 2.81Å; G302-D306 VanDerWaalsContact O-OD1 3.04Å
303	N	87.5	Confident	78.9	Confident	82 Å²	82	50.9 Å²	50.9	44%	0.439	28%	0.282	S	S	.	.	H	α-helix	trans	-64.5	-36.2	177.9	-64.4	0.6	0	0	0	111.1	K300 K301 F307	K300-N303 WeakPolarHBondContact O-CB 2.99Å; K300-N303 PolarHBondContact O-N 2.82Å; K301-N303 VanDerWaalsContact C-N 3.32Å; K301-N303 PolarHBondContact O-N 3.19Å; N303-F307 WeakPolarHBondContact O-CB 3.3Å; N303-F307 PolarHBondContact O-N 3.29Å
304	I	89	Confident	78.9	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-71.1	-46	176.6	-60.9	177.9	0	0	0	110.5	V275 A278 L279 K301 G302 D306 F307 I308 I322 F377	V275-I304 HydrophobicContact CG2-CG2 4.01Å; A278-I304 HydrophobicContact CB-CB 4.46Å; A278-I304 HydrophobicContact CB-CG1 4.03Å; A278-I304 HydrophobicContact CB-CG2 4.34Å; L279-I304 HydrophobicContact CD2-CD1 4.08Å; K301-I304 PolarHBondContact O-N 2.88Å; G302-I304 VanDerWaalsContact C-N 3.27Å; G302-I304 PolarHBondContact O-N 2.68Å; I304-D306 VanDerWaalsContact C-N 3.29Å; I304-D306 PolarHBondContact O-N 3.23Å; I304-F307 CarbonylContact O-C 3.58Å; I304-F307 WeakPolarHBondContact O-CB 3.39Å; I304-F307 PolarHBondContact O-N 3.49Å; I304-F307 VanDerWaalsContact O-N 3.12Å; I304-I308 HydrophobicContact CG2-CD1 3.62Å; I304-I308 HydrophobicContact CG2-CG1 4.27Å; I304-I308 VanDerWaalsContact O-CG1 3.27Å; I304-I308 WeakPolarHBondContact O-CG1 3.45Å; I304-I308 PolarHBondContact O-N 3.18Å; I304-I322 HydrophobicContact CB-CD1 4.02Å; I304-I322 HydrophobicContact CD1-CG2 4Å; I304-I322 HydrophobicContact CG2-CD1 3.98Å; I304-I322 HydrophobicContact CG2-CG1 4.01Å; I304-F377 HydrophobicContact CD1-CE1 3.9Å; I304-F377 HydrophobicContact CD1-CZ 3.57Å
305	I	86.7	Confident	78.6	Confident	16 Å²	16	46.6 Å²	46.6	8%	0.082	27%	0.27	C	S	.	.	H	α-helix	trans	-55.6	-47.8	176.2	-70.4	165.8	0	0	0	110.2	K301 G302 F307 I308 G309 W310 I322	K301-I305 HydrophobicContact CG-CD1 4.49Å; K301-I305 WeakPolarHBondContact O-CG1 3.04Å; K301-I305 PolarHBondContact O-N 3.32Å; G302-I305 PolarHBondContact O-N 2.88Å; I305-F307 VanDerWaalsContact C-N 3.32Å; I305-F307 PolarHBondContact O-N 2.72Å; I305-I308 PolarHBondContact O-N 2.83Å; I305-G309 PolarHBondContact O-N 2.79Å; I305-W310 HydrophobicContact CG1-CE3 4.18Å; I305-W310 HydrophobicContact CG2-CB 4.11Å; I305-W310 PolarHBondContact O-N 2.82Å; I305-W310 VanDerWaalsContact O-N 3.14Å; I305-I322 HydrophobicContact CG1-CD1 4.17Å
306	D	84.3	Confident	78	Confident	68 Å²	68	48 Å²	48	36%	0.364	29%	0.285	S	S	.	.	H	α-helix	trans	-67.4	-35	179	-68.1	14.2	0	0	0	111.6	G302 I304 K312 R402	G302-D306 VanDerWaalsContact O-CB 3.31Å; G302-D306 WeakPolarHBondContact O-CB 3.29Å; G302-D306 PolarHBondContact O-N 2.81Å; G302-D306 VanDerWaalsContact O-OD1 3.04Å; I304-D306 VanDerWaalsContact C-N 3.29Å; I304-D306 PolarHBondContact O-N 3.23Å; D306-K312 WeakPolarHBondContact OD1-CE 3.38Å; D306-K312 IonicContact OD1-NZ 3.07Å; D306-K312 PolarHBondContact OD1-NZ 3.41Å; D306-K312 WeakPolarHBondContact OD2-CE 3.43Å; D306-K312 IonicContact OD2-NZ 2.79Å; D306-K312 PolarHBondContact OD2-NZ 3.3Å; D306-R402 VanDerWaalsContact O-CZ 3.26Å; D306-R402 PolarHBondContact O-NH1 2.84Å; D306-R402 PolarHBondContact O-NH2 3.49Å
307	F	83.9	Confident	77.7	Confident	14 Å²	14	51.3 Å²	51.3	6%	0.061	31%	0.305	C	S	.	.	H	α-helix	trans	-69.8	-34	176.6	-174.9	-90.7	0	0	0	112.8	I201 L274 L277 A278 K281 N303 I304 I305 I398 R402	I201-F307 HydrophobicContact CG2-CE2 3.4Å; I201-F307 VanDerWaalsContact CG2-CE2 3.4Å; I201-F307 HydrophobicContact CG2-CZ 3.49Å; I201-F307 VanDerWaalsContact CG2-CZ 3.49Å; L274-F307 HydrophobicContact CD2-CE1 4.42Å; L274-F307 WeakPolarHBondContact O-CE1 3.17Å; L277-F307 HydrophobicContact CB-CE1 3.96Å; L277-F307 HydrophobicContact CB-CZ 4.05Å; A278-F307 HydrophobicContact CB-CB 3.97Å; A278-F307 HydrophobicContact CB-CD1 3.46Å; A278-F307 VanDerWaalsContact CB-CD1 3.46Å; A278-F307 HydrophobicContact CB-CD2 4.43Å; A278-F307 HydrophobicContact CB-CE1 3.99Å; A278-F307 HydrophobicContact CB-CG 3.69Å; K281-F307 HydrophobicContact CD-CD2 3.87Å; K281-F307 HydrophobicContact CD-CE2 3.52Å; N303-F307 WeakPolarHBondContact O-CB 3.3Å; N303-F307 PolarHBondContact O-N 3.29Å; I304-F307 CarbonylContact O-C 3.58Å; I304-F307 WeakPolarHBondContact O-CB 3.39Å; I304-F307 PolarHBondContact O-N 3.49Å; I304-F307 VanDerWaalsContact O-N 3.12Å; I305-F307 VanDerWaalsContact C-N 3.32Å; I305-F307 PolarHBondContact O-N 2.72Å; F307-I398 HydrophobicContact CD1-CD1 4.37Å; F307-I398 HydrophobicContact CD1-CG1 4.43Å; F307-I398 HydrophobicContact CE1-CD1 3.54Å; F307-I398 HydrophobicContact CE1-CG1 3.96Å; F307-I398 HydrophobicContact CE2-CD1 4.34Å; F307-I398 HydrophobicContact CE2-CG1 4.08Å; F307-I398 HydrophobicContact CZ-CD1 3.54Å; F307-I398 HydrophobicContact CZ-CG1 3.78Å; F307-R402 PolarHBondContact O-NE 2.11Å; F307-R402 PolarHBondContact O-NH2 2.89Å
308	I	81.3	Confident	77.5	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-86.8	-22.9	178.3	-59.1	173.6	0	0	0	111.1	L274 V275 I304 I305 W310 R402 L405	L274-I308 HydrophobicContact CB-CD1 4.38Å; L274-I308 HydrophobicContact CB-CG1 4.03Å; L274-I308 HydrophobicContact CD1-CG2 4.23Å; V275-I308 HydrophobicContact CG2-CD1 3.64Å; I304-I308 HydrophobicContact CG2-CD1 3.62Å; I304-I308 HydrophobicContact CG2-CG1 4.27Å; I304-I308 VanDerWaalsContact O-CG1 3.27Å; I304-I308 WeakPolarHBondContact O-CG1 3.45Å; I304-I308 PolarHBondContact O-N 3.18Å; I305-I308 PolarHBondContact O-N 2.83Å; I308-W310 HydrophobicContact CB-CD2 4.24Å; I308-W310 HydrophobicContact CB-CG 4.37Å; I308-W310 HydrophobicContact CD1-CD2 4.42Å; I308-W310 HydrophobicContact CD1-CE3 4.34Å; I308-W310 HydrophobicContact CD1-CH2 3.7Å; I308-W310 HydrophobicContact CD1-CZ2 3.77Å; I308-W310 HydrophobicContact CD1-CZ3 4.01Å; I308-W310 HydrophobicContact CG2-CD2 3.98Å; I308-W310 HydrophobicContact CG2-CG 4.04Å; I308-W310 HydrophobicContact CG2-CZ2 4.04Å; I308-W310 VanDerWaalsContact CG2-NE1 3.27Å; I308-R402 WeakPolarHBondContact O-CG 3.39Å; I308-L405 HydrophobicContact CG2-CD2 3.87Å
309	G	78.6	Confident	77.2	Confident	30 Å²	30	53.5 Å²	53.5	31%	0.309	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.1	27.7	-175.1	0	0	0	0	0	112.8	I305	I305-G309 PolarHBondContact O-N 2.79Å
310	W	81.7	Confident	76.9	Confident	14 Å²	14	60.4 Å²	60.4	5%	0.053	34%	0.34	C	S	.	.			trans	-71.1	138.3	172.2	-74	-16.6	0	0	0	110.6	I305 I308 K312 Y318 K321 I322	I305-W310 HydrophobicContact CG1-CE3 4.18Å; I305-W310 HydrophobicContact CG2-CB 4.11Å; I305-W310 PolarHBondContact O-N 2.82Å; I305-W310 VanDerWaalsContact O-N 3.14Å; I308-W310 HydrophobicContact CB-CD2 4.24Å; I308-W310 HydrophobicContact CB-CG 4.37Å; I308-W310 HydrophobicContact CD1-CD2 4.42Å; I308-W310 HydrophobicContact CD1-CE3 4.34Å; I308-W310 HydrophobicContact CD1-CH2 3.7Å; I308-W310 HydrophobicContact CD1-CZ2 3.77Å; I308-W310 HydrophobicContact CD1-CZ3 4.01Å; I308-W310 HydrophobicContact CG2-CD2 3.98Å; I308-W310 HydrophobicContact CG2-CG 4.04Å; I308-W310 HydrophobicContact CG2-CZ2 4.04Å; I308-W310 VanDerWaalsContact CG2-NE1 3.27Å; W310-K312 PolarHBondContact O-N 3.1Å; W310-Y318 HydrophobicContact CB-CD1 3.88Å; W310-Y318 HydrophobicContact CB-CD2 4.39Å; W310-Y318 HydrophobicContact CB-CE1 3.54Å; W310-Y318 HydrophobicContact CB-CE2 4.09Å; W310-Y318 HydrophobicContact CB-CG 4.29Å; W310-Y318 AromaticContact CD2-CD1 3.38Å; W310-Y318 HydrophobicContact CD2-CD1 3.38Å; W310-Y318 AromaticContact CD2-CE1 3.6Å; W310-Y318 HydrophobicContact CD2-CE1 3.6Å; W310-Y318 HydrophobicContact CD2-CG 4.22Å; W310-Y318 AromaticContact CE3-CD1 3.17Å; W310-Y318 HydrophobicContact CE3-CD1 3.17Å; W310-Y318 AromaticContact CE3-CE1 3.91Å; W310-Y318 HydrophobicContact CE3-CE1 3.91Å; W310-Y318 AromaticContact CE3-CG 3.68Å; W310-Y318 HydrophobicContact CE3-CG 3.68Å; W310-Y318 AromaticContact CG-CD1 3.71Å; W310-Y318 HydrophobicContact CG-CD1 3.71Å; W310-Y318 AromaticContact CG-CE1 3.43Å; W310-Y318 HydrophobicContact CG-CE1 3.43Å; W310-Y318 VanDerWaalsContact CG-CE1 3.43Å; W310-Y318 AromaticContact CZ3-CD1 3.88Å; W310-Y318 HydrophobicContact CZ3-CD1 3.88Å; W310-Y318 HydrophobicContact CZ3-CG 4.38Å; W310-K321 HydrophobicContact CH2-CB 4.22Å; W310-K321 HydrophobicContact CH2-CD 3.59Å; W310-K321 HydrophobicContact CH2-CG 3.78Å; W310-K321 HydrophobicContact CZ2-CD 3.6Å; W310-K321 VanDerWaalsContact CZ2-CE 3.45Å; W310-K321 HydrophobicContact CZ2-CG 4.22Å; W310-K321 HydrophobicContact CZ3-CB 4.42Å; W310-K321 HydrophobicContact CZ3-CD 4.2Å; W310-K321 HydrophobicContact CZ3-CG 4.43Å; W310-I322 HydrophobicContact CH2-CG1 4.44Å; W310-I322 HydrophobicContact CZ3-CD1 4.43Å; W310-I322 HydrophobicContact CZ3-CG1 3.83Å
311	E	69.9	Low	76.6	Confident	136 Å²	136	58.1 Å²	58.1	64%	0.636	33%	0.33	S	S	*	.			trans	-59.9	123.3	-175.6	-70.8	-180	177.2	0	0	111.7	G313 Y318	E311-G313 PolarHBondContact O-N 2.89Å; E311-Y318 WeakPolarHBondContact O-CE2 3.43Å
312	K	60.2	Low	76.7	Confident	162 Å²	162	56.1 Å²	56.1	70%	0.704	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	90.5	176.1	-68.3	-179.7	176.1	-178.4	0	109.5	D306 W310	D306-K312 WeakPolarHBondContact OD1-CE 3.38Å; D306-K312 IonicContact OD1-NZ 3.07Å; D306-K312 PolarHBondContact OD1-NZ 3.41Å; D306-K312 WeakPolarHBondContact OD2-CE 3.43Å; D306-K312 IonicContact OD2-NZ 2.79Å; D306-K312 PolarHBondContact OD2-NZ 3.3Å; W310-K312 PolarHBondContact O-N 3.1Å
313	G	52.2	Low	76.7	Confident	68 Å²	68	55.8 Å²	55.8	70%	0.701	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	179.6	-23.9	178.5	0	0	0	0	0	114.1	E311	E311-G313 PolarHBondContact O-N 2.89Å
314	V	56.2	Low	76.6	Confident	68 Å²	68	59.9 Å²	59.9	41%	0.412	32%	0.324	S	S	.	.			trans	-103.9	42.2	179.7	-154.1	0	0	0	0	111.3	G316 T317 Y318	V314-G316 VanDerWaalsContact C-N 3.25Å; V314-G316 PolarHBondContact O-N 2.64Å; V314-T317 HydrophobicContact CG1-CG2 3.76Å; V314-T317 VanDerWaalsContact CG1-OG1 3.23Å; V314-T317 WeakPolarHBondContact CG1-OG1 3.5Å; V314-T317 PolarHBondContact O-N 2.9Å; V314-T317 PolarHBondContact O-OG1 2.97Å; V314-Y318 HydrophobicContact CB-CD2 4.32Å; V314-Y318 HydrophobicContact CB-CE2 3.71Å; V314-Y318 HydrophobicContact CG2-CE2 4.23Å; V314-Y318 WeakPolarHBondContact O-CD2 3.33Å
315	S	52.5	Low	76.5	Confident	80 Å²	80	60.1 Å²	60.1	56%	0.559	33%	0.326	S	S	*	.	H	α-helix	trans	-57	-28.3	-159.8	68.7	0	0	0	0	115.7
316	G	61.1	Low	76.6	Confident	50 Å²	50	59.3 Å²	59.3	52%	0.515	32%	0.322	S	S	.	.	H	α-helix	trans	-73.9	-30.5	178.2	0	0	0	0	0	114.8	V314	V314-G316 VanDerWaalsContact C-N 3.25Å; V314-G316 PolarHBondContact O-N 2.64Å
317	T	74.8	Confident	76.6	Confident	79 Å²	79	59 Å²	59	49%	0.485	32%	0.32	S	S	.	.	H	α-helix	trans	-80	-36.2	-177.9	62.9	0	0	0	0	111.2	V314 K320 K321	V314-T317 HydrophobicContact CG1-CG2 3.76Å; V314-T317 VanDerWaalsContact CG1-OG1 3.23Å; V314-T317 WeakPolarHBondContact CG1-OG1 3.5Å; V314-T317 PolarHBondContact O-N 2.9Å; V314-T317 PolarHBondContact O-OG1 2.97Å; T317-K320 PolarHBondContact O-N 3.19Å; T317-K321 WeakPolarHBondContact O-CB 3.31Å; T317-K321 PolarHBondContact O-N 3.32Å
318	Y	82.5	Confident	76.2	Confident	34 Å²	34	60.3 Å²	60.3	13%	0.133	33%	0.329	C	S	.	.	H	α-helix	trans	-68.5	-37.5	-179.8	-64.2	-55.3	0	0	0	113.1	W310 E311 V314 K320 K321 I322	W310-Y318 HydrophobicContact CB-CD1 3.88Å; W310-Y318 HydrophobicContact CB-CD2 4.39Å; W310-Y318 HydrophobicContact CB-CE1 3.54Å; W310-Y318 HydrophobicContact CB-CE2 4.09Å; W310-Y318 HydrophobicContact CB-CG 4.29Å; W310-Y318 AromaticContact CD2-CD1 3.38Å; W310-Y318 HydrophobicContact CD2-CD1 3.38Å; W310-Y318 AromaticContact CD2-CE1 3.6Å; W310-Y318 HydrophobicContact CD2-CE1 3.6Å; W310-Y318 HydrophobicContact CD2-CG 4.22Å; W310-Y318 AromaticContact CE3-CD1 3.17Å; W310-Y318 HydrophobicContact CE3-CD1 3.17Å; W310-Y318 AromaticContact CE3-CE1 3.91Å; W310-Y318 HydrophobicContact CE3-CE1 3.91Å; W310-Y318 AromaticContact CE3-CG 3.68Å; W310-Y318 HydrophobicContact CE3-CG 3.68Å; W310-Y318 AromaticContact CG-CD1 3.71Å; W310-Y318 HydrophobicContact CG-CD1 3.71Å; W310-Y318 AromaticContact CG-CE1 3.43Å; W310-Y318 HydrophobicContact CG-CE1 3.43Å; W310-Y318 VanDerWaalsContact CG-CE1 3.43Å; W310-Y318 AromaticContact CZ3-CD1 3.88Å; W310-Y318 HydrophobicContact CZ3-CD1 3.88Å; W310-Y318 HydrophobicContact CZ3-CG 4.38Å; E311-Y318 WeakPolarHBondContact O-CE2 3.43Å; V314-Y318 HydrophobicContact CB-CD2 4.32Å; V314-Y318 HydrophobicContact CB-CE2 3.71Å; V314-Y318 HydrophobicContact CG2-CE2 4.23Å; V314-Y318 WeakPolarHBondContact O-CD2 3.33Å; Y318-K320 PolarHBondContact O-N 3.4Å; Y318-K321 HydrophobicContact CD1-CD 4.47Å; Y318-K321 CarbonylContact O-C 3.53Å; Y318-K321 WeakPolarHBondContact O-CA 3.38Å; Y318-K321 WeakPolarHBondContact O-CB 3.22Å; Y318-K321 PolarHBondContact O-N 2.86Å; Y318-K321 VanDerWaalsContact O-N 3.11Å; Y318-I322 WeakPolarHBondContact O-CG1 3.38Å; Y318-I322 PolarHBondContact O-N 3.37Å
319	Y	82.5	Confident	76.3	Confident	56 Å²	56	60.3 Å²	60.3	22%	0.22	33%	0.329	C	S	.	.	H	α-helix	trans	-62.3	-46.5	175.8	-172.2	-110.9	0	0	0	111.5	K301 K321 I322 I323	K301-Y319 HydrophobicContact CB-CD2 3.85Å; K301-Y319 HydrophobicContact CB-CE2 4.28Å; K301-Y319 HydrophobicContact CD-CD2 3.41Å; K301-Y319 VanDerWaalsContact CD-CD2 3.41Å; K301-Y319 HydrophobicContact CD-CE2 4.09Å; K301-Y319 HydrophobicContact CD-CG 4.07Å; K301-Y319 HydrophobicContact CG-CD2 4.25Å; Y319-K321 PolarHBondContact O-N 3.06Å; Y319-I322 PolarHBondContact O-N 3.46Å; Y319-I323 HydrophobicContact CD1-CG1 4.23Å; Y319-I323 HydrophobicContact CE1-CD1 4.27Å; Y319-I323 HydrophobicContact CE1-CG1 3.93Å; Y319-I323 HydrophobicContact CE2-CD1 4.36Å; Y319-I323 HydrophobicContact CE2-CG1 4.4Å; Y319-I323 VanDerWaalsContact O-CG1 3.28Å; Y319-I323 WeakPolarHBondContact O-CG1 3.44Å; Y319-I323 PolarHBondContact O-N 3.12Å
320	K	83.3	Confident	76.3	Confident	146 Å²	146	59.4 Å²	59.4	64%	0.635	32%	0.318	S	S	*	.	H	α-helix	trans	-58.6	-35.5	173.8	-69.7	-178.1	-179.8	178.5	0	111.9	T317 Y318 R324	T317-K320 PolarHBondContact O-N 3.19Å; Y318-K320 PolarHBondContact O-N 3.4Å; K320-R324 VanDerWaalsContact O-CG 3.3Å; K320-R324 WeakPolarHBondContact O-CG 3.21Å; K320-R324 PolarHBondContact O-N 2.98Å
321	K	86.3	Confident	75.7	Confident	56 Å²	56	64.2 Å²	64.2	24%	0.243	34%	0.336	C	S	.	.	H	α-helix	trans	-68.2	-47.3	176.9	-165.6	174	179.2	-176.4	0	112.1	E271 W310 T317 Y318 Y319 I323 R324 C325	E271-K321 WeakPolarHBondContact OE1-CE 3.42Å; E271-K321 IonicContact OE1-NZ 2.84Å; E271-K321 PolarHBondContact OE1-NZ 3.18Å; E271-K321 WeakPolarHBondContact OE2-CE 3.18Å; E271-K321 IonicContact OE2-NZ 3.75Å; E271-K321 PolarHBondContact OE2-NZ 3.41Å; W310-K321 HydrophobicContact CH2-CB 4.22Å; W310-K321 HydrophobicContact CH2-CD 3.59Å; W310-K321 HydrophobicContact CH2-CG 3.78Å; W310-K321 HydrophobicContact CZ2-CD 3.6Å; W310-K321 VanDerWaalsContact CZ2-CE 3.45Å; W310-K321 HydrophobicContact CZ2-CG 4.22Å; W310-K321 HydrophobicContact CZ3-CB 4.42Å; W310-K321 HydrophobicContact CZ3-CD 4.2Å; W310-K321 HydrophobicContact CZ3-CG 4.43Å; T317-K321 WeakPolarHBondContact O-CB 3.31Å; T317-K321 PolarHBondContact O-N 3.32Å; Y318-K321 HydrophobicContact CD1-CD 4.47Å; Y318-K321 CarbonylContact O-C 3.53Å; Y318-K321 WeakPolarHBondContact O-CA 3.38Å; Y318-K321 WeakPolarHBondContact O-CB 3.22Å; Y318-K321 PolarHBondContact O-N 2.86Å; Y318-K321 VanDerWaalsContact O-N 3.11Å; Y319-K321 PolarHBondContact O-N 3.06Å; K321-I323 VanDerWaalsContact C-N 3.31Å; K321-I323 PolarHBondContact O-N 2.91Å; K321-R324 WeakPolarHBondContact O-CB 3.34Å; K321-R324 PolarHBondContact O-N 2.94Å; K321-C325 PolarHBondContact O-N 2.51Å; K321-C325 PolarHBondContact O-SG 3.46Å
322	I	88.9	Confident	75.7	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-56.2	-48.3	174.2	-66.9	167.5	0	0	0	110.1	K301 I304 I305 W310 Y318 Y319 R324 C325 L326 F377	K301-I322 HydrophobicContact CB-CD1 3.9Å; I304-I322 HydrophobicContact CB-CD1 4.02Å; I304-I322 HydrophobicContact CD1-CG2 4Å; I304-I322 HydrophobicContact CG2-CD1 3.98Å; I304-I322 HydrophobicContact CG2-CG1 4.01Å; I305-I322 HydrophobicContact CG1-CD1 4.17Å; W310-I322 HydrophobicContact CH2-CG1 4.44Å; W310-I322 HydrophobicContact CZ3-CD1 4.43Å; W310-I322 HydrophobicContact CZ3-CG1 3.83Å; Y318-I322 WeakPolarHBondContact O-CG1 3.38Å; Y318-I322 PolarHBondContact O-N 3.37Å; Y319-I322 PolarHBondContact O-N 3.46Å; I322-R324 VanDerWaalsContact C-N 3.33Å; I322-R324 PolarHBondContact O-N 2.89Å; I322-C325 CarbonylContact O-C 2.98Å; I322-C325 WeakPolarHBondContact O-CB 3.39Å; I322-C325 PolarHBondContact O-N 2.67Å; I322-C325 VanDerWaalsContact O-N 3.1Å; I322-L326 HydrophobicContact CG2-CD1 3.96Å; I322-L326 HydrophobicContact CG2-CG 4.22Å; I322-L326 WeakPolarHBondContact O-CG 3.49Å; I322-L326 PolarHBondContact O-N 3.08Å; I322-F377 HydrophobicContact CG2-CE1 4.19Å; I322-F377 HydrophobicContact CG2-CZ 4.31Å
323	I	87.6	Confident	76.1	Confident	13 Å²	13	51.6 Å²	51.6	7%	0.067	28%	0.283	C	S	.	.	H	α-helix	trans	-58.7	-44.5	178.9	-69.2	-61.9	0	0	0	111.5	Y319 K321 C325 L326 D327 Y351 R353	Y319-I323 HydrophobicContact CD1-CG1 4.23Å; Y319-I323 HydrophobicContact CE1-CD1 4.27Å; Y319-I323 HydrophobicContact CE1-CG1 3.93Å; Y319-I323 HydrophobicContact CE2-CD1 4.36Å; Y319-I323 HydrophobicContact CE2-CG1 4.4Å; Y319-I323 VanDerWaalsContact O-CG1 3.28Å; Y319-I323 WeakPolarHBondContact O-CG1 3.44Å; Y319-I323 PolarHBondContact O-N 3.12Å; K321-I323 VanDerWaalsContact C-N 3.31Å; K321-I323 PolarHBondContact O-N 2.91Å; I323-C325 VanDerWaalsContact C-N 3.32Å; I323-C325 PolarHBondContact O-N 3.36Å; I323-L326 HydrophobicContact CD1-CD1 4.28Å; I323-L326 PolarHBondContact O-N 3.35Å; I323-D327 PolarHBondContact O-N 2.74Å; I323-Y351 HydrophobicContact CD1-CE2 3.8Å; I323-R353 HydrophobicContact CD1-CG 4.42Å
324	R	85.6	Confident	76.9	Confident	168 Å²	168	48.4 Å²	48.4	63%	0.634	25%	0.249	S	C	*	.	H	α-helix	trans	-61	-42.1	174.5	-74.9	172.1	178.4	-176.1	-0.8	112	K320 K321 I322 L326 D327 V328	K320-R324 VanDerWaalsContact O-CG 3.3Å; K320-R324 WeakPolarHBondContact O-CG 3.21Å; K320-R324 PolarHBondContact O-N 2.98Å; K321-R324 WeakPolarHBondContact O-CB 3.34Å; K321-R324 PolarHBondContact O-N 2.94Å; I322-R324 VanDerWaalsContact C-N 3.33Å; I322-R324 PolarHBondContact O-N 2.89Å; R324-L326 VanDerWaalsContact C-N 3.35Å; R324-D327 PolarHBondContact O-N 3.25Å; R324-V328 WeakPolarHBondContact O-CG2 2.78Å; R324-V328 PolarHBondContact O-N 2.97Å
325	C	87.4	Confident	77.2	Confident	4 Å²	4	47.7 Å²	47.7	3%	0.027	24%	0.241	C	C	.	.	H	α-helix	trans	-62.3	-44.2	175.8	-61	0	0	0	0	111	E272 V275 K321 I322 I323 D327 V328 L329	E272-C325 HydrophobicContact CB-CB 4.48Å; E272-C325 HydrophobicContact CG-CB 3.63Å; V275-C325 HydrophobicContact CB-CB 4.09Å; V275-C325 HydrophobicContact CG1-CB 4.15Å; V275-C325 HydrophobicContact CG2-CB 3.82Å; K321-C325 PolarHBondContact O-N 2.51Å; K321-C325 PolarHBondContact O-SG 3.46Å; I322-C325 CarbonylContact O-C 2.98Å; I322-C325 WeakPolarHBondContact O-CB 3.39Å; I322-C325 PolarHBondContact O-N 2.67Å; I322-C325 VanDerWaalsContact O-N 3.1Å; I323-C325 VanDerWaalsContact C-N 3.32Å; I323-C325 PolarHBondContact O-N 3.36Å; C325-D327 PolarHBondContact O-N 3.32Å; C325-V328 PolarHBondContact O-N 3.01Å; C325-L329 WeakPolarHBondContact O-CB 3.08Å; C325-L329 WeakPolarHBondContact O-CG 3.09Å; C325-L329 PolarHBondContact O-N 2.77Å
326	L	88.5	Confident	77.7	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-60.9	-44.6	177.3	-69.6	172.7	0	0	0	111.7	V275 L279 I322 I323 R324 V328 L329 T330 I348 Y351 F377	V275-L326 HydrophobicContact CG1-CD2 4.3Å; L279-L326 HydrophobicContact CD1-CD2 3.62Å; I322-L326 HydrophobicContact CG2-CD1 3.96Å; I322-L326 HydrophobicContact CG2-CG 4.22Å; I322-L326 WeakPolarHBondContact O-CG 3.49Å; I322-L326 PolarHBondContact O-N 3.08Å; I323-L326 HydrophobicContact CD1-CD1 4.28Å; I323-L326 PolarHBondContact O-N 3.35Å; R324-L326 VanDerWaalsContact C-N 3.35Å; L326-V328 VanDerWaalsContact C-N 3.32Å; L326-V328 PolarHBondContact O-N 3.21Å; L326-L329 PolarHBondContact O-N 3.17Å; L326-T330 WeakPolarHBondContact O-CG2 3.34Å; L326-T330 PolarHBondContact O-N 2.79Å; L326-I348 HydrophobicContact CD2-CD1 3.85Å; L326-Y351 HydrophobicContact CB-CD1 3.7Å; L326-Y351 HydrophobicContact CB-CD2 4.39Å; L326-Y351 HydrophobicContact CB-CE1 3.71Å; L326-Y351 HydrophobicContact CB-CE2 4.4Å; L326-Y351 HydrophobicContact CB-CG 4.05Å; L326-Y351 HydrophobicContact CD1-CD1 4.49Å; L326-Y351 HydrophobicContact CD1-CD2 3.8Å; L326-Y351 HydrophobicContact CD1-CE2 4.16Å; L326-Y351 HydrophobicContact CD1-CG 3.99Å; L326-F377 HydrophobicContact CD1-CD2 3.93Å; L326-F377 HydrophobicContact CD1-CE1 4.38Å; L326-F377 HydrophobicContact CD1-CE2 3.55Å; L326-F377 HydrophobicContact CD1-CG 4.49Å; L326-F377 HydrophobicContact CD1-CZ 3.78Å; L326-F377 HydrophobicContact CD2-CE2 4.14Å; L326-F377 HydrophobicContact CD2-CZ 4.46Å
327	D	82.8	Confident	77.7	Confident	62 Å²	62	44 Å²	44	33%	0.332	20%	0.201	S	C	.	.	H	α-helix	trans	-53.1	-51.9	175.4	-70.8	-30.1	0	0	0	110.2	I323 R324 C325 L329 T330 Y331 Y351	I323-D327 PolarHBondContact O-N 2.74Å; R324-D327 PolarHBondContact O-N 3.25Å; C325-D327 PolarHBondContact O-N 3.32Å; D327-L329 PolarHBondContact O-N 3.39Å; D327-T330 PolarHBondContact O-N 3.21Å; D327-T330 PolarHBondContact O-OG1 2.96Å; D327-Y331 WeakPolarHBondContact O-CD2 3.37Å; D327-Y331 WeakPolarHBondContact O-CE2 3.5Å; D327-Y351 VanDerWaalsContact OD1-CE1 3.27Å; D327-Y351 WeakPolarHBondContact OD1-CE1 2.99Å; D327-Y351 VanDerWaalsContact OD1-CZ 3.28Å; D327-Y351 PolarHBondContact OD1-OH 3.4Å
328	V	77.4	Confident	77	Confident	40 Å²	40	40.2 Å²	40.2	24%	0.242	18%	0.178	C	C	.	.	H	α-helix	trans	-61.8	-44.7	178.1	-179.4	0	0	0	0	111.6	I268 E272 R324 C325 L326 T330 Y331 G332	I268-V328 HydrophobicContact CG2-CG1 3.7Å; E272-V328 HydrophobicContact CG-CB 4.37Å; E272-V328 WeakPolarHBondContact OE1-CG2 3.37Å; R324-V328 WeakPolarHBondContact O-CG2 2.78Å; R324-V328 PolarHBondContact O-N 2.97Å; C325-V328 PolarHBondContact O-N 3.01Å; L326-V328 VanDerWaalsContact C-N 3.32Å; L326-V328 PolarHBondContact O-N 3.21Å; V328-T330 VanDerWaalsContact C-N 3.25Å; V328-T330 PolarHBondContact O-N 3.45Å; V328-Y331 PolarHBondContact O-N 3.01Å; V328-G332 PolarHBondContact O-N 3.4Å
329	L	82.2	Confident	76.1	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-63.6	-27.1	-179.7	-69.7	169	0	0	0	113.2	I268 E272 V275 F276 C325 L326 D327 Y331 G332 L347 I348	I268-L329 HydrophobicContact CG2-CD2 4.13Å; E272-L329 HydrophobicContact CB-CD2 4.29Å; E272-L329 HydrophobicContact CB-CG 4.41Å; V275-L329 HydrophobicContact CB-CD1 4.26Å; V275-L329 HydrophobicContact CG1-CD1 3.92Å; F276-L329 HydrophobicContact CB-CD1 3.91Å; F276-L329 HydrophobicContact CB-CD2 3.83Å; F276-L329 HydrophobicContact CG-CD2 4.28Å; C325-L329 WeakPolarHBondContact O-CB 3.08Å; C325-L329 WeakPolarHBondContact O-CG 3.09Å; C325-L329 PolarHBondContact O-N 2.77Å; L326-L329 PolarHBondContact O-N 3.17Å; D327-L329 PolarHBondContact O-N 3.39Å; L329-Y331 PolarHBondContact O-N 3.03Å; L329-G332 PolarHBondContact O-N 3.38Å; L329-L347 HydrophobicContact CD2-CD1 3.73Å; L329-I348 HydrophobicContact CB-CD1 3.57Å; L329-I348 HydrophobicContact CB-CG1 4.13Å; L329-I348 HydrophobicContact CD1-CD1 3.85Å; L329-I348 HydrophobicContact CG-CD1 4.34Å
330	T	78.6	Confident	75.1	Confident	12 Å²	12	46.9 Å²	46.9	7%	0.074	22%	0.221	C	C	.	.	H	α-helix	trans	-68.9	-20.9	173	63.5	0	0	0	0	113.8	L326 D327 V328 H346 I348 Y351	L326-T330 WeakPolarHBondContact O-CG2 3.34Å; L326-T330 PolarHBondContact O-N 2.79Å; D327-T330 PolarHBondContact O-N 3.21Å; D327-T330 PolarHBondContact O-OG1 2.96Å; V328-T330 VanDerWaalsContact C-N 3.25Å; V328-T330 PolarHBondContact O-N 3.45Å; T330-H346 PolarHBondContact O-ND1 3.01Å; T330-I348 WeakPolarHBondContact CA-O 3.24Å; T330-I348 HydrophobicContact CG2-CB 4.48Å; T330-I348 HydrophobicContact CG2-CG2 4.39Å; T330-Y351 HydrophobicContact CG2-CD1 3.79Å; T330-Y351 HydrophobicContact CG2-CE1 4.29Å
331	Y	69.6	Low	73.6	Confident	114 Å²	114	42.9 Å²	42.9	45%	0.447	21%	0.207	S	C	.	.	H	α-helix	trans	-93.2	-11.2	174.2	-61.6	-76.5	0	0	0	112.9	Y266 D327 V328 L329 T333	Y266-Y331 VanDerWaalsContact CD2-CB 3.42Å; Y266-Y331 HydrophobicContact CD2-CG 4.38Å; Y266-Y331 HydrophobicContact CE2-CD1 4.42Å; Y266-Y331 HydrophobicContact CE2-CG 4.35Å; D327-Y331 WeakPolarHBondContact O-CD2 3.37Å; D327-Y331 WeakPolarHBondContact O-CE2 3.5Å; V328-Y331 PolarHBondContact O-N 3.01Å; L329-Y331 PolarHBondContact O-N 3.03Å; Y331-T333 PolarHBondContact O-N 3.38Å
332	G	69.9	Low	72.3	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.214	C	C	.	.			trans	-67.8	128.9	175.6	0	0	0	0	0	111.1	Y263 V328 L329 H346 L347	Y263-G332 WeakPolarHBondContact OH-CA 3.18Å; V328-G332 PolarHBondContact O-N 3.4Å; L329-G332 PolarHBondContact O-N 3.38Å; G332-H346 CarbonylContact O-C 3.58Å; G332-H346 VanDerWaalsContact O-CA 3.24Å; G332-H346 WeakPolarHBondContact O-CA 3.49Å; G332-L347 PolarHBondContact O-N 3.08Å
333	T	67.4	Low	71	Confident	34 Å²	34	43.9 Å²	43.9	21%	0.209	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	152.3	178.8	55.3	0	0	0	0	111.7	Y263 T264 G265 Y331 G345	Y263-T333 WeakPolarHBondContact CD2-O 3.46Å; Y263-T333 WeakPolarHBondContact CE2-O 3.38Å; T264-T333 PolarHBondContact N-O 3.43Å; T264-T333 PolarHBondContact OG1-OG1 3.07Å; G265-T333 VanDerWaalsContact CA-OG1 3.29Å; G265-T333 WeakPolarHBondContact CA-OG1 3.4Å; G265-T333 PolarHBondContact N-O 3.16Å; G265-T333 PolarHBondContact N-OG1 3.38Å; Y331-T333 PolarHBondContact O-N 3.38Å; T333-G345 CarbonylContact C-O 3.37Å; T333-G345 WeakPolarHBondContact CA-O 3.24Å; T333-G345 WeakPolarHBondContact CB-O 3.39Å
334	W	69.6	Low	69.8	Low	1 Å²	1	45.7 Å²	45.7	0%	0.004	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	158.9	178.9	60.4	-95.6	0	0	0	110.7	F207 E262 I336 Y343 C344 G345 H346 P384 L385	F207-W334 HydrophobicContact CD2-CB 4.49Å; F207-W334 HydrophobicContact CE2-CB 3.6Å; F207-W334 HydrophobicContact CE2-CG 4.11Å; F207-W334 HydrophobicContact CZ-CB 4.39Å; E262-W334 CarbonylContact O-C 3.58Å; E262-W334 VanDerWaalsContact O-CA 3.31Å; E262-W334 WeakPolarHBondContact O-CA 3.34Å; W334-I336 HydrophobicContact CE3-CB 4.29Å; W334-I336 HydrophobicContact CE3-CD1 3.69Å; W334-I336 HydrophobicContact CE3-CG1 3.56Å; W334-I336 HydrophobicContact CH2-CD1 4.08Å; W334-I336 HydrophobicContact CZ3-CB 3.98Å; W334-I336 HydrophobicContact CZ3-CD1 3.39Å; W334-I336 HydrophobicContact CZ3-CG1 3.56Å; W334-Y343 VanDerWaalsContact CZ3-O 3.29Å; W334-Y343 WeakPolarHBondContact CZ3-O 3.22Å; W334-C344 CarbonylContact O-C 3.59Å; W334-C344 VanDerWaalsContact O-CA 3.24Å; W334-C344 WeakPolarHBondContact O-CA 3.37Å; W334-G345 VanDerWaalsContact CD1-C 3.45Å; W334-G345 VanDerWaalsContact CD1-O 3.23Å; W334-G345 VanDerWaalsContact CE2-CA 3.5Å; W334-G345 PolarHBondContact N-O 3.43Å; W334-G345 PolarHBondContact O-N 3.22Å; W334-H346 VanDerWaalsContact CD1-O 3.31Å; W334-H346 PolarHBondContact NE1-O 2.78Å; W334-P384 HydrophobicContact CH2-CB 3.39Å; W334-P384 HydrophobicContact CH2-CG 3.75Å; W334-P384 HydrophobicContact CZ2-CB 3.6Å; W334-P384 HydrophobicContact CZ2-CG 3.83Å; W334-P384 HydrophobicContact CZ3-CB 4.41Å; W334-L385 HydrophobicContact CD2-CD2 3.8Å; W334-L385 HydrophobicContact CD2-CG 4.25Å; W334-L385 HydrophobicContact CE3-CD2 4.5Å; W334-L385 HydrophobicContact CG-CD1 4.33Å; W334-L385 HydrophobicContact CG-CD2 3.81Å; W334-L385 HydrophobicContact CG-CG 4.29Å; W334-L385 HydrophobicContact CZ2-CD2 4.49Å; W334-L385 HydrophobicContact CZ2-CG 4.29Å
335	K	63.8	Low	68.8	Low	52 Å²	52	38.3 Å²	38.3	23%	0.226	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	131.3	176.5	-176.2	-168.4	-174.6	-156.1	0	108.4	V261 E262 T264 E337 V342 Y343	V261-K335 CarbonylContact C-O 3.45Å; V261-K335 WeakPolarHBondContact CA-O 3.33Å; E262-K335 HydrophobicContact CB-CB 4.29Å; E262-K335 PolarHBondContact N-O 3.29Å; E262-K335 PolarHBondContact O-N 3.43Å; E262-K335 VanDerWaalsContact O-O 3.12Å; E262-K335 IonicContact OE2-NZ 3.97Å; T264-K335 HydrophobicContact CG2-CB 4.32Å; K335-E337 WeakPolarHBondContact CE-OE1 3.35Å; K335-E337 IonicContact NZ-OE1 3.6Å; K335-E337 PolarHBondContact NZ-OE1 3.05Å; K335-V342 HydrophobicContact CD-CG1 4.03Å; K335-V342 HydrophobicContact CG-CG1 3.58Å; K335-Y343 CarbonylContact C-O 3.23Å; K335-Y343 WeakPolarHBondContact CA-O 3.01Å
336	I	62.5	Low	68.1	Low	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	124.6	174.8	-65.9	167.6	0	0	0	107	F258 S260 V261 W334 Y343 L388	F258-I336 HydrophobicContact CD1-CG2 3.46Å; F258-I336 VanDerWaalsContact CD1-CG2 3.46Å; F258-I336 HydrophobicContact CE1-CG2 3.95Å; F258-I336 HydrophobicContact CG-CG2 4.37Å; S260-I336 WeakPolarHBondContact O-CA 3.34Å; V261-I336 HydrophobicContact CB-CG1 4.3Å; V261-I336 HydrophobicContact CG1-CG1 3.76Å; V261-I336 HydrophobicContact CG2-CG1 3.97Å; V261-I336 HydrophobicContact CG2-CG2 4.25Å; W334-I336 HydrophobicContact CE3-CB 4.29Å; W334-I336 HydrophobicContact CE3-CD1 3.69Å; W334-I336 HydrophobicContact CE3-CG1 3.56Å; W334-I336 HydrophobicContact CH2-CD1 4.08Å; W334-I336 HydrophobicContact CZ3-CB 3.98Å; W334-I336 HydrophobicContact CZ3-CD1 3.39Å; W334-I336 HydrophobicContact CZ3-CG1 3.56Å; I336-Y343 HydrophobicContact CB-CD2 4.33Å; I336-Y343 HydrophobicContact CG2-CD2 4.19Å; I336-Y343 PolarHBondContact N-O 2.92Å; I336-Y343 PolarHBondContact O-N 3.32Å; I336-L388 HydrophobicContact CD1-CD2 4.12Å
337	E	60.6	Low	67.5	Low	52 Å²	52	39.2 Å²	39.2	24%	0.243	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	133.8	174.2	-53.9	178.6	152.1	0	0	109.7	E259 S260 K335 N341 V342	E259-E337 PolarHBondContact N-O 2.93Å; S260-E337 PolarHBondContact N-O 3.22Å; S260-E337 PolarHBondContact O-N 3.12Å; S260-E337 VanDerWaalsContact OG-CB 3.29Å; S260-E337 WeakPolarHBondContact OG-CB 3.26Å; S260-E337 VanDerWaalsContact OG-CD 3.24Å; S260-E337 VanDerWaalsContact OG-CG 3.25Å; S260-E337 WeakPolarHBondContact OG-CG 3.45Å; S260-E337 PolarHBondContact OG-OE2 3.04Å; K335-E337 WeakPolarHBondContact CE-OE1 3.35Å; K335-E337 IonicContact NZ-OE1 3.6Å; K335-E337 PolarHBondContact NZ-OE1 3.05Å; E337-N341 WeakPolarHBondContact CA-O 3.03Å; E337-V342 HydrophobicContact CG-CG2 4.27Å
338	S	60	Low	67.3	Low	1 Å²	1	36.3 Å²	36.3	1%	0.007	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	83.5	-177.5	167.7	0	0	0	0	109.8	K256 N341	K256-S338 WeakPolarHBondContact CB-OG 3.45Å; S338-N341 PolarHBondContact N-O 3.26Å; S338-N341 PolarHBondContact O-N 2.83Å
339	G	64.5	Low	67.3	Low	33 Å²	33	34.8 Å²	34.8	34%	0.34	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.5	-131.6	-171.4	0	0	0	0	0	109.7	E259 N341	E259-G339 VanDerWaalsContact CD-N 3.25Å; E259-G339 WeakPolarHBondContact OE1-CA 3.48Å; E259-G339 PolarHBondContact OE1-N 2.89Å; E259-G339 WeakPolarHBondContact OE2-CA 3.43Å; E259-G339 PolarHBondContact OE2-N 3.08Å; G339-N341 PolarHBondContact O-N 2.77Å
340	E	61.6	Low	67.3	Low	196 Å²	196	35.4 Å²	35.4	92%	0.916	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-6.9	177.6	-61.8	177.2	171.9	0	0	114
341	N	51.2	Low	67.8	Low	63 Å²	63	35.1 Å²	35.1	34%	0.337	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	130.1	-175.9	-66.2	-44.2	0	0	0	112	E337 S338 G339 Y343	E337-N341 WeakPolarHBondContact CA-O 3.03Å; S338-N341 PolarHBondContact N-O 3.26Å; S338-N341 PolarHBondContact O-N 2.83Å; G339-N341 PolarHBondContact O-N 2.77Å; N341-Y343 HydrophobicContact CB-CE1 4.3Å; N341-Y343 HydrophobicContact CB-CE2 4Å; N341-Y343 PolarHBondContact ND2-OH 3.27Å
342	V	59.2	Low	68.7	Low	66 Å²	66	30.3 Å²	30.3	40%	0.4	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	121.3	170.5	-178.3	0	0	0	0	108.8	Y245 K335 E337	Y245-V342 PolarHBondContact OH-O 3.49Å; Y245-V342 VanDerWaalsContact OH-O 3.05Å; K335-V342 HydrophobicContact CD-CG1 4.03Å; K335-V342 HydrophobicContact CG-CG1 3.58Å; E337-V342 HydrophobicContact CG-CG2 4.27Å
343	Y	60.5	Low	69.5	Low	11 Å²	11	35.6 Å²	35.6	4%	0.043	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	129.3	175.9	-54.2	-68.2	0	0	0	109.8	Y245 V249 N252 I253 W334 K335 I336 N341	Y245-Y343 HydrophobicContact CE1-CD1 4.35Å; V249-Y343 HydrophobicContact CB-CD1 4.02Å; V249-Y343 HydrophobicContact CB-CE1 4.13Å; V249-Y343 HydrophobicContact CG1-CD1 3.5Å; V249-Y343 HydrophobicContact CG1-CD2 4.48Å; V249-Y343 HydrophobicContact CG1-CE1 3.88Å; V249-Y343 HydrophobicContact CG1-CG 3.83Å; V249-Y343 HydrophobicContact CG2-CD1 3.38Å; V249-Y343 HydrophobicContact CG2-CE1 3.59Å; V249-Y343 HydrophobicContact CG2-CG 4.43Å; N252-Y343 VanDerWaalsContact CB-OH 3.3Å; N252-Y343 WeakPolarHBondContact CB-OH 3.46Å; I253-Y343 HydrophobicContact CD1-CD2 4.49Å; I253-Y343 HydrophobicContact CG1-CD2 4.41Å; I253-Y343 HydrophobicContact CG1-CE2 4.2Å; W334-Y343 VanDerWaalsContact CZ3-O 3.29Å; W334-Y343 WeakPolarHBondContact CZ3-O 3.22Å; K335-Y343 CarbonylContact C-O 3.23Å; K335-Y343 WeakPolarHBondContact CA-O 3.01Å; I336-Y343 HydrophobicContact CB-CD2 4.33Å; I336-Y343 HydrophobicContact CG2-CD2 4.19Å; I336-Y343 PolarHBondContact N-O 2.92Å; I336-Y343 PolarHBondContact O-N 3.32Å; N341-Y343 HydrophobicContact CB-CE1 4.3Å; N341-Y343 HydrophobicContact CB-CE2 4Å; N341-Y343 PolarHBondContact ND2-OH 3.27Å
344	C	62.8	Low	70.4	Confident	51 Å²	51	36 Å²	36	35%	0.345	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	148.7	175	-62.6	0	0	0	0	111.1	W334	W334-C344 CarbonylContact O-C 3.59Å; W334-C344 VanDerWaalsContact O-CA 3.24Å; W334-C344 WeakPolarHBondContact O-CA 3.37Å
345	G	65.8	Low	71.2	Confident	13 Å²	13	38.9 Å²	38.9	13%	0.134	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167.4	-175.5	175.8	0	0	0	0	0	113.6	T333 W334	T333-G345 CarbonylContact C-O 3.37Å; T333-G345 WeakPolarHBondContact CA-O 3.24Å; T333-G345 WeakPolarHBondContact CB-O 3.39Å; W334-G345 VanDerWaalsContact CD1-C 3.45Å; W334-G345 VanDerWaalsContact CD1-O 3.23Å; W334-G345 VanDerWaalsContact CE2-CA 3.5Å; W334-G345 PolarHBondContact N-O 3.43Å; W334-G345 PolarHBondContact O-N 3.22Å
346	H	72.3	Confident	72.1	Confident	23 Å²	23	43 Å²	43	11%	0.106	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	152.6	176.1	-67.7	-80.7	0	0	0	111.8	T330 G332 W334 S382	T330-H346 PolarHBondContact O-ND1 3.01Å; G332-H346 CarbonylContact O-C 3.58Å; G332-H346 VanDerWaalsContact O-CA 3.24Å; G332-H346 WeakPolarHBondContact O-CA 3.49Å; W334-H346 VanDerWaalsContact CD1-O 3.31Å; W334-H346 PolarHBondContact NE1-O 2.78Å; H346-S382 WeakPolarHBondContact O-CB 3.48Å
347	L	74.5	Confident	73.1	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.231	C	C	.	.	S	Bend	trans	-60.1	-52.1	172.8	-64.1	-176.3	0	0	0	110.7	F207 V211 Y263 I268 F276 L329 G332 L385	F207-L347 HydrophobicContact CE1-CD2 4.19Å; F207-L347 HydrophobicContact CE2-CD2 3.88Å; F207-L347 HydrophobicContact CZ-CD2 3.27Å; V211-L347 HydrophobicContact CG2-CD2 3.98Å; Y263-L347 HydrophobicContact CD2-CD1 4.26Å; Y263-L347 HydrophobicContact CD2-CD2 3.86Å; Y263-L347 HydrophobicContact CD2-CG 4.21Å; Y263-L347 HydrophobicContact CE2-CD1 3.49Å; Y263-L347 VanDerWaalsContact CE2-CD1 3.49Å; Y263-L347 HydrophobicContact CE2-CD2 3.84Å; Y263-L347 HydrophobicContact CE2-CG 3.66Å; I268-L347 HydrophobicContact CD1-CD1 4.01Å; F276-L347 HydrophobicContact CD2-CB 4.36Å; F276-L347 HydrophobicContact CE1-CD2 4.08Å; F276-L347 HydrophobicContact CE2-CB 3.87Å; F276-L347 HydrophobicContact CE2-CD2 4.47Å; F276-L347 HydrophobicContact CZ-CB 4.12Å; F276-L347 HydrophobicContact CZ-CD2 3.86Å; F276-L347 HydrophobicContact CZ-CG 4.45Å; L329-L347 HydrophobicContact CD2-CD1 3.73Å; G332-L347 PolarHBondContact O-N 3.08Å; L347-L385 HydrophobicContact CD2-CD1 4.22Å
348	I	80.4	Confident	74.1	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	123.1	174	-55.1	178.5	0	0	0	106.3	F276 L279 L326 L329 T330 D350 R380	F276-I348 HydrophobicContact CD2-CG1 4.29Å; F276-I348 HydrophobicContact CE2-CG1 4.45Å; L279-I348 HydrophobicContact CD1-CD1 3.35Å; L279-I348 HydrophobicContact CD1-CG1 4.34Å; L326-I348 HydrophobicContact CD2-CD1 3.85Å; L329-I348 HydrophobicContact CB-CD1 3.57Å; L329-I348 HydrophobicContact CB-CG1 4.13Å; L329-I348 HydrophobicContact CD1-CD1 3.85Å; L329-I348 HydrophobicContact CG-CD1 4.34Å; T330-I348 WeakPolarHBondContact CA-O 3.24Å; T330-I348 HydrophobicContact CG2-CB 4.48Å; T330-I348 HydrophobicContact CG2-CG2 4.39Å; I348-D350 VanDerWaalsContact CG2-O 3.26Å; I348-D350 WeakPolarHBondContact CG2-O 3.35Å; I348-R380 CarbonylContact C-O 3.57Å; I348-R380 WeakPolarHBondContact CA-O 3.24Å; I348-R380 VanDerWaalsContact CG2-O 3.32Å; I348-R380 WeakPolarHBondContact CG2-O 3.2Å
349	A	75.4	Confident	75	Confident	8 Å²	8	42.6 Å²	42.6	7%	0.066	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	-47.4	177.9	0	0	0	0	0	110.8	K238 Y242 R380	K238-A349 PolarHBondContact NZ-O 3Å; Y242-A349 HydrophobicContact CE1-CB 4.09Å; Y242-A349 VanDerWaalsContact OH-CB 3.25Å; Y242-A349 WeakPolarHBondContact OH-CB 3.44Å; A349-R380 HydrophobicContact CB-CB 4.21Å; A349-R380 HydrophobicContact CB-CG 4.01Å; A349-R380 PolarHBondContact N-O 2.99Å
350	D	82.5	Confident	75.5	Confident	13 Å²	13	49.3 Å²	49.3	7%	0.07	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167	170.8	174.4	-150	-18.6	0	0	0	111.2	I348 Y352 K361 Y379 R380	I348-D350 VanDerWaalsContact CG2-O 3.26Å; I348-D350 WeakPolarHBondContact CG2-O 3.35Å; D350-Y352 HydrophobicContact CB-CE1 4.19Å; D350-Y352 HydrophobicContact CB-CE2 4.01Å; D350-Y352 VanDerWaalsContact CB-OH 3.32Å; D350-Y352 WeakPolarHBondContact CB-OH 3.44Å; D350-Y352 WeakPolarHBondContact OD2-CE1 3.4Å; D350-Y352 PolarHBondContact OD2-OH 2.67Å; D350-K361 IonicContact OD1-NZ 2.65Å; D350-K361 PolarHBondContact OD1-NZ 3.12Å; D350-K361 WeakPolarHBondContact OD2-CD 3.43Å; D350-K361 IonicContact OD2-NZ 3.7Å; D350-K361 PolarHBondContact OD2-NZ 2.79Å; D350-Y379 WeakPolarHBondContact O-CA 3.36Å; D350-R380 PolarHBondContact O-N 3.07Å
351	Y	89.4	Confident	76	Confident	6 Å²	6	42.3 Å²	42.3	2%	0.024	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	153.1	166.7	80.2	-83.6	0	0	0	110.8	I323 L326 D327 T330 R353 K361 Y378	I323-Y351 HydrophobicContact CD1-CE2 3.8Å; L326-Y351 HydrophobicContact CB-CD1 3.7Å; L326-Y351 HydrophobicContact CB-CD2 4.39Å; L326-Y351 HydrophobicContact CB-CE1 3.71Å; L326-Y351 HydrophobicContact CB-CE2 4.4Å; L326-Y351 HydrophobicContact CB-CG 4.05Å; L326-Y351 HydrophobicContact CD1-CD1 4.49Å; L326-Y351 HydrophobicContact CD1-CD2 3.8Å; L326-Y351 HydrophobicContact CD1-CE2 4.16Å; L326-Y351 HydrophobicContact CD1-CG 3.99Å; D327-Y351 VanDerWaalsContact OD1-CE1 3.27Å; D327-Y351 WeakPolarHBondContact OD1-CE1 2.99Å; D327-Y351 VanDerWaalsContact OD1-CZ 3.28Å; D327-Y351 PolarHBondContact OD1-OH 3.4Å; T330-Y351 HydrophobicContact CG2-CD1 3.79Å; T330-Y351 HydrophobicContact CG2-CE1 4.29Å; Y351-R353 HydrophobicContact CE2-CG 4.16Å; Y351-R353 PolarHBondContact OH-NH2 2.59Å; Y351-K361 PolarHBondContact O-NZ 2.97Å; Y351-K361 VanDerWaalsContact O-NZ 3.14Å; Y351-Y378 CarbonylContact C-O 3.57Å; Y351-Y378 WeakPolarHBondContact CA-O 3.14Å; Y351-Y378 WeakPolarHBondContact CB-O 3.41Å
352	Y	88.1	Confident	76.9	Confident	13 Å²	13	41.9 Å²	41.9	5%	0.051	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	134	-174	-42.2	-89.6	0	0	0	110.3	I296 D350 E357 L358 K361 T362 Y378	I296-Y352 HydrophobicContact CD1-CE2 4.48Å; D350-Y352 HydrophobicContact CB-CE1 4.19Å; D350-Y352 HydrophobicContact CB-CE2 4.01Å; D350-Y352 VanDerWaalsContact CB-OH 3.32Å; D350-Y352 WeakPolarHBondContact CB-OH 3.44Å; D350-Y352 WeakPolarHBondContact OD2-CE1 3.4Å; D350-Y352 PolarHBondContact OD2-OH 2.67Å; Y352-E357 HydrophobicContact CD1-CG 4.49Å; Y352-L358 HydrophobicContact CD1-CB 4.05Å; Y352-L358 HydrophobicContact CD1-CD1 3.78Å; Y352-L358 HydrophobicContact CD2-CD1 3.67Å; Y352-L358 HydrophobicContact CE1-CD1 3.61Å; Y352-L358 HydrophobicContact CE2-CD1 3.48Å; Y352-L358 VanDerWaalsContact CE2-CD1 3.48Å; Y352-L358 HydrophobicContact CG-CB 4.05Å; Y352-L358 HydrophobicContact CG-CD1 3.82Å; Y352-L358 VanDerWaalsContact CZ-CD1 3.44Å; Y352-K361 HydrophobicContact CD1-CB 4.44Å; Y352-K361 HydrophobicContact CD1-CD 3.78Å; Y352-K361 HydrophobicContact CE1-CB 3.87Å; Y352-K361 HydrophobicContact CE1-CD 3.56Å; Y352-K361 HydrophobicContact CE1-CG 4.36Å; Y352-T362 HydrophobicContact CE1-CG2 4.21Å; Y352-Y378 PolarHBondContact N-O 3.33Å; Y352-Y378 PolarHBondContact O-N 3.15Å
353	R	86.7	Confident	77.7	Confident	112 Å²	112	39.9 Å²	39.9	42%	0.423	20%	0.198	S	C	.	.	S	Bend	trans	-92.1	-10.7	-177.8	-54.8	174.9	-167.4	178.6	6.8	112.8	I323 Y351 E357 L372	I323-R353 HydrophobicContact CD1-CG 4.42Å; Y351-R353 HydrophobicContact CE2-CG 4.16Å; Y351-R353 PolarHBondContact OH-NH2 2.59Å; R353-E357 VanDerWaalsContact CB-OE2 3.24Å; R353-E357 WeakPolarHBondContact CB-OE2 3.16Å; R353-E357 WeakPolarHBondContact CG-OE2 3.15Å; R353-E357 PolarHBondContact N-OE2 2.99Å; R353-L372 WeakPolarHBondContact O-CD1 3.32Å
354	S	87.4	Confident	78.4	Confident	42 Å²	42	45.7 Å²	45.7	29%	0.294	22%	0.224	S	C	.	.	S	Bend	trans	-156.1	163.2	177.4	66	0	0	0	0	110.9	E356 E357 L358	S354-E356 PolarHBondContact O-N 3.06Å; S354-E357 PolarHBondContact O-N 3.06Å; S354-E357 WeakPolarHBondContact OG-CB 2.98Å; S354-E357 PolarHBondContact OG-N 3.36Å; S354-L358 PolarHBondContact O-N 3.46Å; S354-L358 VanDerWaalsContact O-N 3.11Å
355	K	85.7	Confident	79.2	Confident	61 Å²	61	45.7 Å²	45.7	27%	0.265	22%	0.222	S	C	.	.	H	α-helix	trans	-62.5	-32.5	169.9	-74.9	-175.9	171.2	172.9	0	111.7	L358 C359 V365 L369 D371 Y378	K355-L358 WeakPolarHBondContact O-CB 3.14Å; K355-L358 PolarHBondContact O-N 3.42Å; K355-C359 PolarHBondContact O-N 2.79Å; K355-V365 HydrophobicContact CB-CG1 4.33Å; K355-V365 HydrophobicContact CD-CG1 4.2Å; K355-V365 HydrophobicContact CG-CG1 4.2Å; K355-V365 WeakPolarHBondContact O-CG2 2.99Å; K355-L369 WeakPolarHBondContact CE-O 3.39Å; K355-L369 HydrophobicContact CG-CD2 4.48Å; K355-L369 PolarHBondContact NZ-O 3.39Å; K355-D371 VanDerWaalsContact CD-OD1 3.3Å; K355-D371 WeakPolarHBondContact CD-OD1 3.47Å; K355-D371 WeakPolarHBondContact CE-OD1 3.32Å; K355-D371 IonicContact NZ-OD1 2.64Å; K355-D371 PolarHBondContact NZ-OD1 3.46Å; K355-D371 IonicContact NZ-OD2 2.68Å; K355-Y378 WeakPolarHBondContact CE-OH 3.04Å; K355-Y378 HydrophobicContact CG-CE2 4.06Å; K355-Y378 VanDerWaalsContact CG-OH 3.29Å; K355-Y378 WeakPolarHBondContact CG-OH 2.73Å
356	E	83.1	Confident	79.7	Confident	139 Å²	139	45.6 Å²	45.6	65%	0.65	22%	0.219	S	C	*	.	H	α-helix	trans	-65	-45	175.2	-171.3	-170.7	171.4	0	0	111.6	S354 L358 C359 R360	S354-E356 PolarHBondContact O-N 3.06Å; E356-L358 PolarHBondContact O-N 3.41Å; E356-C359 PolarHBondContact O-N 2.85Å; E356-R360 VanDerWaalsContact O-CB 3.32Å; E356-R360 WeakPolarHBondContact O-CB 3.33Å; E356-R360 PolarHBondContact O-N 2.82Å
357	E	83.8	Confident	79.7	Confident	29 Å²	29	53.7 Å²	53.7	14%	0.136	26%	0.257	C	S	.	.	H	α-helix	trans	-62.8	-35.8	174.9	-176.8	172.9	-161	0	0	111.5	Y352 R353 S354 R360 K361	Y352-E357 HydrophobicContact CD1-CG 4.49Å; R353-E357 VanDerWaalsContact CB-OE2 3.24Å; R353-E357 WeakPolarHBondContact CB-OE2 3.16Å; R353-E357 WeakPolarHBondContact CG-OE2 3.15Å; R353-E357 PolarHBondContact N-OE2 2.99Å; S354-E357 PolarHBondContact O-N 3.06Å; S354-E357 WeakPolarHBondContact OG-CB 2.98Å; S354-E357 PolarHBondContact OG-N 3.36Å; E357-R360 IonicContact OE1-NH2 3.9Å; E357-K361 HydrophobicContact CG-CD 4.35Å; E357-K361 WeakPolarHBondContact O-CB 3.47Å; E357-K361 WeakPolarHBondContact O-CG 3.49Å; E357-K361 PolarHBondContact O-N 3.37Å; E357-K361 VanDerWaalsContact O-N 3.09Å; E357-K361 IonicContact OE1-NZ 3.92Å
358	L	81	Confident	79.7	Confident	1 Å²	1	60.9 Å²	60.9	1%	0.005	30%	0.295	C	S	.	.	H	α-helix	trans	-63.1	-56.7	171.3	-178.6	67.2	0	0	0	111.2	I296 Y352 S354 K355 E356 R360 K361 T362 V365 L369	I296-L358 HydrophobicContact CD1-CD1 3.94Å; I296-L358 HydrophobicContact CD1-CD2 4.25Å; Y352-L358 HydrophobicContact CD1-CB 4.05Å; Y352-L358 HydrophobicContact CD1-CD1 3.78Å; Y352-L358 HydrophobicContact CD2-CD1 3.67Å; Y352-L358 HydrophobicContact CE1-CD1 3.61Å; Y352-L358 HydrophobicContact CE2-CD1 3.48Å; Y352-L358 VanDerWaalsContact CE2-CD1 3.48Å; Y352-L358 HydrophobicContact CG-CB 4.05Å; Y352-L358 HydrophobicContact CG-CD1 3.82Å; Y352-L358 VanDerWaalsContact CZ-CD1 3.44Å; S354-L358 PolarHBondContact O-N 3.46Å; S354-L358 VanDerWaalsContact O-N 3.11Å; K355-L358 WeakPolarHBondContact O-CB 3.14Å; K355-L358 PolarHBondContact O-N 3.42Å; E356-L358 PolarHBondContact O-N 3.41Å; L358-R360 PolarHBondContact O-N 3.44Å; L358-K361 PolarHBondContact O-N 2.79Å; L358-T362 HydrophobicContact CD1-CG2 3.7Å; L358-T362 PolarHBondContact O-N 2.83Å; L358-T362 PolarHBondContact O-OG1 3.34Å; L358-V365 HydrophobicContact CD2-CG1 4.3Å; L358-V365 HydrophobicContact CD2-CG2 4.45Å; L358-V365 HydrophobicContact CG-CG2 4.47Å; L358-L369 HydrophobicContact CD2-CD2 3.4Å
359	C	78.9	Confident	79.6	Confident	15 Å²	15	61.1 Å²	61.1	10%	0.101	30%	0.296	C	S	.	.	H	α-helix	trans	-54.6	-41.1	178.7	-158.1	0	0	0	0	110.6	C73 K355 E356 K361 G363 V365	C73-C359 WeakPolarHBondContact CB-SG 3.29Å; C73-C359 WeakPolarHBondContact SG-CB 3.28Å; C73-C359 CovalentContact SG-SG 2.11Å; C73-C359 PolarHBondContact SG-SG 3.11Å; K355-C359 PolarHBondContact O-N 2.79Å; E356-C359 PolarHBondContact O-N 2.85Å; C359-K361 PolarHBondContact O-N 3.45Å; C359-G363 WeakPolarHBondContact O-CA 3.15Å; C359-G363 PolarHBondContact O-N 3.32Å; C359-V365 HydrophobicContact CB-CG2 3.55Å
360	R	74.3	Confident	79.9	Confident	173 Å²	173	64.2 Å²	64.2	65%	0.653	32%	0.316	S	S	*	.	H	α-helix	trans	-62.4	-39.6	179.5	-171.4	-176.9	67.2	179.5	-2.3	113.1	E356 E357 L358	E356-R360 VanDerWaalsContact O-CB 3.32Å; E356-R360 WeakPolarHBondContact O-CB 3.33Å; E356-R360 PolarHBondContact O-N 2.82Å; E357-R360 IonicContact OE1-NH2 3.9Å; L358-R360 PolarHBondContact O-N 3.44Å
361	K	73.4	Confident	80	Confident	50 Å²	50	69.2 Å²	69.2	22%	0.217	34%	0.343	C	S	.	.	H	α-helix	trans	-86.1	-32.8	-177.2	-76.5	-177	175.5	-178.7	0	113.4	D350 Y351 Y352 E357 L358 C359	D350-K361 IonicContact OD1-NZ 2.65Å; D350-K361 PolarHBondContact OD1-NZ 3.12Å; D350-K361 WeakPolarHBondContact OD2-CD 3.43Å; D350-K361 IonicContact OD2-NZ 3.7Å; D350-K361 PolarHBondContact OD2-NZ 2.79Å; Y351-K361 PolarHBondContact O-NZ 2.97Å; Y351-K361 VanDerWaalsContact O-NZ 3.14Å; Y352-K361 HydrophobicContact CD1-CB 4.44Å; Y352-K361 HydrophobicContact CD1-CD 3.78Å; Y352-K361 HydrophobicContact CE1-CB 3.87Å; Y352-K361 HydrophobicContact CE1-CD 3.56Å; Y352-K361 HydrophobicContact CE1-CG 4.36Å; E357-K361 HydrophobicContact CG-CD 4.35Å; E357-K361 WeakPolarHBondContact O-CB 3.47Å; E357-K361 WeakPolarHBondContact O-CG 3.49Å; E357-K361 PolarHBondContact O-N 3.37Å; E357-K361 VanDerWaalsContact O-N 3.09Å; E357-K361 IonicContact OE1-NZ 3.92Å; L358-K361 PolarHBondContact O-N 2.79Å; C359-K361 PolarHBondContact O-N 3.45Å
362	T	70.4	Confident	79.8	Confident	54 Å²	54	70.9 Å²	70.9	33%	0.331	35%	0.352	S	S	.	.	H	α-helix	trans	-111.4	-11.6	-172.6	61.9	0	0	0	0	113.9	Y352 L358 K364	Y352-T362 HydrophobicContact CE1-CG2 4.21Å; L358-T362 HydrophobicContact CD1-CG2 3.7Å; L358-T362 PolarHBondContact O-N 2.83Å; L358-T362 PolarHBondContact O-OG1 3.34Å; T362-K364 PolarHBondContact O-N 2.93Å; T362-K364 PolarHBondContact OG1-N 3.14Å; T362-K364 PolarHBondContact OG1-O 3.28Å
363	G	74.4	Confident	79.8	Confident	24 Å²	24	77.8 Å²	77.8	25%	0.247	38%	0.382	C	S	.	.	S	Bend	trans	72	-3.2	-175.3	0	0	0	0	0	114.9	C359	C359-G363 WeakPolarHBondContact O-CA 3.15Å; C359-G363 PolarHBondContact O-N 3.32Å
364	K	76.3	Confident	79.4	Confident	133 Å²	133	80.6 Å²	80.6	58%	0.578	40%	0.399	S	S	*	.			trans	-146.5	139.6	-178.5	-63.6	-174.5	-179.3	-175.8	0	110.9	T362	T362-K364 PolarHBondContact O-N 2.93Å; T362-K364 PolarHBondContact OG1-N 3.14Å; T362-K364 PolarHBondContact OG1-O 3.28Å
365	V	79.4	Confident	79.2	Confident	50 Å²	50	79 Å²	79	30%	0.303	39%	0.39	S	S	.	.			trans	-111.7	123.4	169.2	179.7	0	0	0	0	107.6	K355 L358 C359 E367 L369	K355-V365 HydrophobicContact CB-CG1 4.33Å; K355-V365 HydrophobicContact CD-CG1 4.2Å; K355-V365 HydrophobicContact CG-CG1 4.2Å; K355-V365 WeakPolarHBondContact O-CG2 2.99Å; L358-V365 HydrophobicContact CD2-CG1 4.3Å; L358-V365 HydrophobicContact CD2-CG2 4.45Å; L358-V365 HydrophobicContact CG-CG2 4.47Å; C359-V365 HydrophobicContact CB-CG2 3.55Å; V365-E367 PolarHBondContact O-N 3.27Å; V365-L369 HydrophobicContact CG1-CD2 4.49Å
366	P	76.3	Confident	79.4	Confident	12 Å²	12	78 Å²	78	8%	0.078	39%	0.387	C	S	.	.			trans	-59.7	132.4	174.6	-21.4	32.6	0	0	0	110.6	W294 N368 L369	W294-P366 HydrophobicContact CB-CG 4.33Å; W294-P366 VanDerWaalsContact CD1-CG 3.41Å; W294-P366 HydrophobicContact CD2-CG 3.82Å; W294-P366 HydrophobicContact CG-CB 4.26Å; W294-P366 HydrophobicContact CG-CG 3.59Å; P366-N368 PolarHBondContact O-N 3.4Å; P366-L369 HydrophobicContact CB-CB 4.37Å; P366-L369 WeakPolarHBondContact O-CB 3.13Å; P366-L369 PolarHBondContact O-N 3.18Å; P366-L369 VanDerWaalsContact O-N 3.12Å
367	E	72.5	Confident	79.7	Confident	192 Å²	192	71.4 Å²	71.4	90%	0.897	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-34.3	-178.5	-66.9	176.8	178.1	0	0	112.1	V365 L369	V365-E367 PolarHBondContact O-N 3.27Å; E367-L369 VanDerWaalsContact C-N 3.28Å; E367-L369 PolarHBondContact O-N 3.24Å
368	N	74.1	Confident	80	Confident	151 Å²	151	70 Å²	70	81%	0.807	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	10.3	-178.4	-62.4	-23.9	0	0	0	114.4	P366	P366-N368 PolarHBondContact O-N 3.4Å
369	L	77.9	Confident	80.5	Confident	5 Å²	5	70 Å²	70	3%	0.026	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-79.8	121.2	-179	-160	74.9	0	0	0	110.4	I296 K355 L358 V365 P366 E367 Y378	I296-L369 HydrophobicContact CB-CD1 4.24Å; I296-L369 HydrophobicContact CG2-CD1 3.92Å; K355-L369 WeakPolarHBondContact CE-O 3.39Å; K355-L369 HydrophobicContact CG-CD2 4.48Å; K355-L369 PolarHBondContact NZ-O 3.39Å; L358-L369 HydrophobicContact CD2-CD2 3.4Å; V365-L369 HydrophobicContact CG1-CD2 4.49Å; P366-L369 HydrophobicContact CB-CB 4.37Å; P366-L369 WeakPolarHBondContact O-CB 3.13Å; P366-L369 PolarHBondContact O-N 3.18Å; P366-L369 VanDerWaalsContact O-N 3.12Å; E367-L369 VanDerWaalsContact C-N 3.28Å; E367-L369 PolarHBondContact O-N 3.24Å; L369-Y378 HydrophobicContact CD1-CD1 4.09Å; L369-Y378 HydrophobicContact CD1-CE1 3.93Å; L369-Y378 HydrophobicContact CD2-CD1 3.84Å; L369-Y378 HydrophobicContact CD2-CD2 4.32Å; L369-Y378 HydrophobicContact CD2-CE1 3.42Å; L369-Y378 VanDerWaalsContact CD2-CE1 3.42Å; L369-Y378 HydrophobicContact CD2-CE2 3.91Å; L369-Y378 HydrophobicContact CD2-CG 4.27Å; L369-Y378 VanDerWaalsContact CD2-CZ 3.43Å; L369-Y378 HydrophobicContact CG-CD1 4.04Å; L369-Y378 HydrophobicContact CG-CE1 3.44Å; L369-Y378 VanDerWaalsContact CG-CE1 3.44Å
370	P	82.8	Confident	80.8	Confident	74 Å²	74	71.5 Å²	71.5	48%	0.481	35%	0.352	S	S	.	.	P	Polyproline II helix	trans	-69.8	141.4	-177.9	28.7	-35.1	0	0	0	110.9	T298 Y378	T298-P370 HydrophobicContact CG2-CG 4.05Å; P370-Y378 WeakPolarHBondContact O-CE1 3.33Å; P370-Y378 PolarHBondContact O-OH 2.88Å
371	D	83.5	Confident	81.2	Confident	117 Å²	117	63.4 Å²	63.4	63%	0.626	32%	0.322	S	S	*	.	P	Polyproline II helix	trans	-60.8	139.7	174.8	-70.4	-41.3	0	0	0	112.1	K355 K373	K355-D371 VanDerWaalsContact CD-OD1 3.3Å; K355-D371 WeakPolarHBondContact CD-OD1 3.47Å; K355-D371 WeakPolarHBondContact CE-OD1 3.32Å; K355-D371 IonicContact NZ-OD1 2.64Å; K355-D371 PolarHBondContact NZ-OD1 3.46Å; K355-D371 IonicContact NZ-OD2 2.68Å; D371-K373 PolarHBondContact O-N 3.28Å
372	L	86.5	Confident	81.2	Confident	41 Å²	41	61.3 Å²	61.3	22%	0.215	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-70.5	126	178.7	-65.6	177	0	0	0	110.4	T298 R353 E376 Y378	T298-L372 HydrophobicContact CG2-CD2 3.79Å; R353-L372 WeakPolarHBondContact O-CD1 3.32Å; L372-E376 HydrophobicContact CB-CB 4.29Å; L372-E376 HydrophobicContact CD2-CB 3.92Å; L372-Y378 HydrophobicContact CD1-CD2 3.63Å; L372-Y378 HydrophobicContact CD1-CE2 3.47Å; L372-Y378 VanDerWaalsContact CD1-CE2 3.47Å; L372-Y378 HydrophobicContact CD1-CG 4.39Å; L372-Y378 HydrophobicContact CD2-CD1 3.78Å; L372-Y378 HydrophobicContact CD2-CD2 3.95Å; L372-Y378 HydrophobicContact CD2-CE1 3.55Å; L372-Y378 HydrophobicContact CD2-CE2 3.78Å; L372-Y378 HydrophobicContact CD2-CG 3.96Å; L372-Y378 HydrophobicContact CG-CD1 4.49Å; L372-Y378 HydrophobicContact CG-CD2 3.92Å; L372-Y378 HydrophobicContact CG-CE1 4.01Å; L372-Y378 HydrophobicContact CG-CE2 3.41Å; L372-Y378 VanDerWaalsContact CG-CE2 3.41Å; L372-Y378 HydrophobicContact CG-CG 4.44Å; L372-Y378 VanDerWaalsContact CG-CZ 3.46Å
373	K	86.9	Confident	81.1	Confident	158 Å²	158	60.1 Å²	60.1	69%	0.687	31%	0.307	S	S	*	.	P	Polyproline II helix	trans	-75.7	163.8	167.2	-59.9	179.5	179.2	178.7	0	110.2	D371 G375 E376	D371-K373 PolarHBondContact O-N 3.28Å; K373-G375 PolarHBondContact O-N 3.43Å; K373-G375 VanDerWaalsContact O-N 3.08Å; K373-E376 HydrophobicContact CB-CG 4.21Å; K373-E376 WeakPolarHBondContact CB-OE2 3.43Å; K373-E376 PolarHBondContact N-OE2 2.57Å; K373-E376 WeakPolarHBondContact O-CB 3.49Å; K373-E376 PolarHBondContact O-N 2.99Å
374	H	79.4	Confident	80.8	Confident	171 Å²	171	59.4 Å²	59.4	79%	0.792	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	119.7	179.7	-178.6	79.2	0	0	0	112
375	G	82.4	Confident	80.5	Confident	10 Å²	10	53 Å²	53	10%	0.103	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	85.5	12.1	-179	0	0	0	0	0	115.2	K301 K373	K301-G375 WeakPolarHBondContact CB-O 3.4Å; K301-G375 VanDerWaalsContact CG-O 3.29Å; K301-G375 WeakPolarHBondContact CG-O 3.3Å; K301-G375 PolarHBondContact N-O 2.68Å; K373-G375 PolarHBondContact O-N 3.43Å; K373-G375 VanDerWaalsContact O-N 3.08Å
376	E	89.5	Confident	80	Confident	40 Å²	40	51.3 Å²	51.3	19%	0.187	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	157.2	169	-60.8	-178	162.8	0	0	111.5	C299 K300 L372 K373	C299-E376 VanDerWaalsContact O-CA 3.29Å; C299-E376 WeakPolarHBondContact O-CA 3.4Å; K300-E376 HydrophobicContact CB-CG 4.08Å; K300-E376 HydrophobicContact CG-CG 4.21Å; L372-E376 HydrophobicContact CB-CB 4.29Å; L372-E376 HydrophobicContact CD2-CB 3.92Å; K373-E376 HydrophobicContact CB-CG 4.21Å; K373-E376 WeakPolarHBondContact CB-OE2 3.43Å; K373-E376 PolarHBondContact N-OE2 2.57Å; K373-E376 WeakPolarHBondContact O-CB 3.49Å; K373-E376 PolarHBondContact O-N 2.99Å
377	F	91	Very high	79.5	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	156.2	172.1	60.3	-87.9	0	0	0	109.9	L279 T298 C299 I304 I322 L326 Y379	L279-F377 HydrophobicContact CD2-CE2 4.01Å; L279-F377 HydrophobicContact CD2-CZ 3.96Å; T298-F377 CarbonylContact C-O 3.59Å; T298-F377 WeakPolarHBondContact CA-O 3.26Å; C299-F377 HydrophobicContact CB-CE1 4.16Å; C299-F377 HydrophobicContact CB-CE2 4.07Å; C299-F377 HydrophobicContact CB-CZ 3.8Å; C299-F377 PolarHBondContact N-O 2.79Å; C299-F377 WeakPolarHBondContact O-CD1 3.42Å; C299-F377 PolarHBondContact O-N 3.43Å; I304-F377 HydrophobicContact CD1-CE1 3.9Å; I304-F377 HydrophobicContact CD1-CZ 3.57Å; I322-F377 HydrophobicContact CG2-CE1 4.19Å; I322-F377 HydrophobicContact CG2-CZ 4.31Å; L326-F377 HydrophobicContact CD1-CD2 3.93Å; L326-F377 HydrophobicContact CD1-CE1 4.38Å; L326-F377 HydrophobicContact CD1-CE2 3.55Å; L326-F377 HydrophobicContact CD1-CG 4.49Å; L326-F377 HydrophobicContact CD1-CZ 3.78Å; L326-F377 HydrophobicContact CD2-CE2 4.14Å; L326-F377 HydrophobicContact CD2-CZ 4.46Å; F377-Y379 HydrophobicContact CE2-CD1 4.24Å; F377-Y379 HydrophobicContact CE2-CG 4.4Å
378	Y	90.4	Very high	79	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	145.6	170.1	-56.3	-69.9	0	0	0	110.2	I296 L297 T298 Y351 Y352 K355 L369 P370 L372	I296-Y378 HydrophobicContact CG2-CD1 4.06Å; I296-Y378 HydrophobicContact CG2-CG 4.2Å; L297-Y378 CarbonylContact O-C 3.4Å; L297-Y378 VanDerWaalsContact O-CA 3.3Å; L297-Y378 WeakPolarHBondContact O-CA 3.21Å; T298-Y378 HydrophobicContact CG2-CD1 3.53Å; T298-Y378 HydrophobicContact CG2-CE1 3.52Å; Y351-Y378 CarbonylContact C-O 3.57Å; Y351-Y378 WeakPolarHBondContact CA-O 3.14Å; Y351-Y378 WeakPolarHBondContact CB-O 3.41Å; Y352-Y378 PolarHBondContact N-O 3.33Å; Y352-Y378 PolarHBondContact O-N 3.15Å; K355-Y378 WeakPolarHBondContact CE-OH 3.04Å; K355-Y378 HydrophobicContact CG-CE2 4.06Å; K355-Y378 VanDerWaalsContact CG-OH 3.29Å; K355-Y378 WeakPolarHBondContact CG-OH 2.73Å; L369-Y378 HydrophobicContact CD1-CD1 4.09Å; L369-Y378 HydrophobicContact CD1-CE1 3.93Å; L369-Y378 HydrophobicContact CD2-CD1 3.84Å; L369-Y378 HydrophobicContact CD2-CD2 4.32Å; L369-Y378 HydrophobicContact CD2-CE1 3.42Å; L369-Y378 VanDerWaalsContact CD2-CE1 3.42Å; L369-Y378 HydrophobicContact CD2-CE2 3.91Å; L369-Y378 HydrophobicContact CD2-CG 4.27Å; L369-Y378 VanDerWaalsContact CD2-CZ 3.43Å; L369-Y378 HydrophobicContact CG-CD1 4.04Å; L369-Y378 HydrophobicContact CG-CE1 3.44Å; L369-Y378 VanDerWaalsContact CG-CE1 3.44Å; P370-Y378 WeakPolarHBondContact O-CE1 3.33Å; P370-Y378 PolarHBondContact O-OH 2.88Å; L372-Y378 HydrophobicContact CD1-CD2 3.63Å; L372-Y378 HydrophobicContact CD1-CE2 3.47Å; L372-Y378 VanDerWaalsContact CD1-CE2 3.47Å; L372-Y378 HydrophobicContact CD1-CG 4.39Å; L372-Y378 HydrophobicContact CD2-CD1 3.78Å; L372-Y378 HydrophobicContact CD2-CD2 3.95Å; L372-Y378 HydrophobicContact CD2-CE1 3.55Å; L372-Y378 HydrophobicContact CD2-CE2 3.78Å; L372-Y378 HydrophobicContact CD2-CG 3.96Å; L372-Y378 HydrophobicContact CG-CD1 4.49Å; L372-Y378 HydrophobicContact CG-CD2 3.92Å; L372-Y378 HydrophobicContact CG-CE1 4.01Å; L372-Y378 HydrophobicContact CG-CE2 3.41Å; L372-Y378 VanDerWaalsContact CG-CE2 3.41Å; L372-Y378 HydrophobicContact CG-CG 4.44Å; L372-Y378 VanDerWaalsContact CG-CZ 3.46Å
379	Y	90.7	Very high	78.4	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	159.6	172.6	72.1	-74.8	0	0	0	110.1	L279 N282 T283 I296 L297 C299 D350 F377 I381	L279-Y379 HydrophobicContact CB-CD2 4.23Å; L279-Y379 HydrophobicContact CB-CE2 3.85Å; L279-Y379 HydrophobicContact CD1-CD2 4.25Å; L279-Y379 HydrophobicContact CD2-CD1 4.05Å; L279-Y379 HydrophobicContact CD2-CD2 3.92Å; L279-Y379 HydrophobicContact CD2-CE1 4.13Å; L279-Y379 HydrophobicContact CD2-CE2 3.97Å; L279-Y379 HydrophobicContact CD2-CG 3.97Å; L279-Y379 HydrophobicContact CG-CD2 4.37Å; L279-Y379 HydrophobicContact CG-CE2 4.37Å; L279-Y379 PolarHBondContact O-OH 2.79Å; N282-Y379 WeakPolarHBondContact ND2-CE1 3.07Å; N282-Y379 PolarHBondContact ND2-OH 3.44Å; T283-Y379 PolarHBondContact N-OH 2.82Å; T283-Y379 VanDerWaalsContact OG1-CE2 3.27Å; T283-Y379 WeakPolarHBondContact OG1-CE2 3.42Å; T283-Y379 PolarHBondContact OG1-OH 3.24Å; I296-Y379 WeakPolarHBondContact CA-O 3.3Å; L297-Y379 HydrophobicContact CB-CD1 4.31Å; L297-Y379 HydrophobicContact CB-CE1 3.61Å; L297-Y379 PolarHBondContact N-O 2.83Å; L297-Y379 WeakPolarHBondContact O-CD1 3.49Å; L297-Y379 PolarHBondContact O-N 3.31Å; C299-Y379 HydrophobicContact CB-CD1 3.83Å; C299-Y379 HydrophobicContact CB-CE1 3.59Å; D350-Y379 WeakPolarHBondContact O-CA 3.36Å; F377-Y379 HydrophobicContact CE2-CD1 4.24Å; F377-Y379 HydrophobicContact CE2-CG 4.4Å; Y379-I381 HydrophobicContact CD2-CG1 3.99Å; Y379-I381 HydrophobicContact CE2-CD1 3.99Å; Y379-I381 HydrophobicContact CE2-CG1 3.78Å
380	R	85.7	Confident	77.7	Confident	46 Å²	46	39.8 Å²	39.8	17%	0.174	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	111.9	175.8	-179.1	178.7	176.9	-173.1	7.1	109.9	E246 W294 I296 I348 A349 D350	E246-R380 IonicContact OE1-CZ 2.78Å; E246-R380 IonicContact OE1-NE 3.65Å; E246-R380 IonicContact OE1-NH2 3.93Å; E246-R380 PolarHBondContact OE1-NH2 2.97Å; E246-R380 IonicContact OE2-CZ 3.69Å; E246-R380 IonicContact OE2-NH2 3.72Å; E246-R380 PolarHBondContact OE2-NH2 3.05Å; W294-R380 PolarHBondContact O-NE 2.89Å; I296-R380 HydrophobicContact CG1-CB 4.45Å; I348-R380 CarbonylContact C-O 3.57Å; I348-R380 WeakPolarHBondContact CA-O 3.24Å; I348-R380 VanDerWaalsContact CG2-O 3.32Å; I348-R380 WeakPolarHBondContact CG2-O 3.2Å; A349-R380 HydrophobicContact CB-CB 4.21Å; A349-R380 HydrophobicContact CB-CG 4.01Å; A349-R380 PolarHBondContact N-O 2.99Å; D350-R380 PolarHBondContact O-N 3.07Å
381	I	80.9	Confident	76.3	Confident	3 Å²	3	40.7 Å²	40.7	2%	0.015	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	143.9	168.4	-62.3	-177.4	0	0	0	108	L279 I280 T283 Y379 L385 I386	L279-I381 HydrophobicContact CB-CD1 4.21Å; I280-I381 HydrophobicContact CB-CD1 4.4Å; I280-I381 HydrophobicContact CG1-CD1 3.83Å; T283-I381 HydrophobicContact CG2-CD1 4.39Å; T283-I381 VanDerWaalsContact OG1-CD1 3.25Å; T283-I381 WeakPolarHBondContact OG1-CD1 3.39Å; Y379-I381 HydrophobicContact CD2-CG1 3.99Å; Y379-I381 HydrophobicContact CE2-CD1 3.99Å; Y379-I381 HydrophobicContact CE2-CG1 3.78Å; I381-L385 HydrophobicContact CG2-CB 4.05Å; I381-L385 HydrophobicContact CG2-CD1 4.43Å; I381-I386 HydrophobicContact CB-CD1 4.15Å; I381-I386 HydrophobicContact CB-CG1 4.02Å; I381-I386 HydrophobicContact CG2-CD1 4.38Å; I381-I386 HydrophobicContact CG2-CG1 3.73Å
382	S	73.9	Confident	74.7	Confident	6 Å²	6	37.1 Å²	37.1	4%	0.042	18%	0.182	C	C	.	.			trans	-61.4	126	175.5	-175.8	0	0	0	0	110.7	H346 P384 L385 I386	H346-S382 WeakPolarHBondContact O-CB 3.48Å; S382-P384 VanDerWaalsContact C-CD 3.43Å; S382-P384 WeakPolarHBondContact OG-CD 3.25Å; S382-L385 WeakPolarHBondContact O-CB 3.15Å; S382-L385 PolarHBondContact O-N 3.09Å; S382-I386 PolarHBondContact O-N 2.53Å
383	P	69.4	Low	73.1	Confident	30 Å²	30	38.3 Å²	38.3	20%	0.195	19%	0.185	C	C	.	.	H	α-helix	trans	-54.1	-38.9	-173.4	-27.5	35	0	0	0	116.2	E246 L385 I386 A387	E246-P383 HydrophobicContact CG-CG 4.46Å; E246-P383 WeakPolarHBondContact OE1-CD 3.22Å; E246-P383 WeakPolarHBondContact OE1-CG 3.48Å; P383-L385 PolarHBondContact O-N 2.88Å; P383-I386 WeakPolarHBondContact O-CB 3.4Å; P383-I386 PolarHBondContact O-N 2.94Å; P383-A387 PolarHBondContact O-N 3.22Å
384	P	67	Low	71.4	Confident	8 Å²	8	30.9 Å²	30.9	5%	0.052	15%	0.153	C	C	.	.	H	α-helix	trans	-57.9	-35.9	175.1	-27.5	37	0	0	0	113.4	V249 I253 W334 S382 A387 L388	V249-P384 HydrophobicContact CB-CG 4.46Å; V249-P384 HydrophobicContact CG1-CB 4.06Å; V249-P384 HydrophobicContact CG1-CG 3.73Å; I253-P384 HydrophobicContact CD1-CB 3.74Å; W334-P384 HydrophobicContact CH2-CB 3.39Å; W334-P384 HydrophobicContact CH2-CG 3.75Å; W334-P384 HydrophobicContact CZ2-CB 3.6Å; W334-P384 HydrophobicContact CZ2-CG 3.83Å; W334-P384 HydrophobicContact CZ3-CB 4.41Å; S382-P384 VanDerWaalsContact C-CD 3.43Å; S382-P384 WeakPolarHBondContact OG-CD 3.25Å; P384-A387 PolarHBondContact O-N 2.89Å; P384-L388 WeakPolarHBondContact O-CB 3.38Å; P384-L388 PolarHBondContact O-N 3.01Å
385	L	70.2	Confident	70.4	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-66.8	-39.8	174.9	-65.4	-178.6	0	0	0	111.3	F207 F276 W334 L347 I381 S382 P383 A387 L388 F389	F207-L385 HydrophobicContact CD1-CD2 4.38Å; F207-L385 HydrophobicContact CD2-CD2 4.22Å; F207-L385 HydrophobicContact CE1-CD1 4.12Å; F207-L385 HydrophobicContact CE1-CD2 3.72Å; F207-L385 HydrophobicContact CE1-CG 4.44Å; F207-L385 HydrophobicContact CE2-CD2 3.55Å; F207-L385 HydrophobicContact CZ-CD1 3.59Å; F207-L385 HydrophobicContact CZ-CD2 3.23Å; F207-L385 HydrophobicContact CZ-CG 4.01Å; F276-L385 HydrophobicContact CZ-CD1 4.13Å; W334-L385 HydrophobicContact CD2-CD2 3.8Å; W334-L385 HydrophobicContact CD2-CG 4.25Å; W334-L385 HydrophobicContact CE3-CD2 4.5Å; W334-L385 HydrophobicContact CG-CD1 4.33Å; W334-L385 HydrophobicContact CG-CD2 3.81Å; W334-L385 HydrophobicContact CG-CG 4.29Å; W334-L385 HydrophobicContact CZ2-CD2 4.49Å; W334-L385 HydrophobicContact CZ2-CG 4.29Å; L347-L385 HydrophobicContact CD2-CD1 4.22Å; I381-L385 HydrophobicContact CG2-CB 4.05Å; I381-L385 HydrophobicContact CG2-CD1 4.43Å; S382-L385 WeakPolarHBondContact O-CB 3.15Å; S382-L385 PolarHBondContact O-N 3.09Å; P383-L385 PolarHBondContact O-N 2.88Å; L385-A387 VanDerWaalsContact C-N 3.31Å; L385-A387 PolarHBondContact O-N 2.7Å; L385-L388 HydrophobicContact CD2-CD2 4.41Å; L385-L388 WeakPolarHBondContact O-CB 3.41Å; L385-L388 PolarHBondContact O-N 2.54Å; L385-F389 HydrophobicContact CB-CD2 4.2Å; L385-F389 HydrophobicContact CB-CE2 4.17Å; L385-F389 WeakPolarHBondContact O-CB 3.25Å; L385-F389 WeakPolarHBondContact O-CD2 3.27Å; L385-F389 PolarHBondContact O-N 2.76Å
386	I	69.2	Low	69.5	Low	13 Å²	13	28.8 Å²	28.8	7%	0.067	14%	0.138	C	C	.	.	H	α-helix	trans	-61.9	-43.1	177.2	-54.6	175.1	0	0	0	110.2	T283 I381 S382 P383 L388 F389 K390	T283-I386 HydrophobicContact CG2-CD1 3.74Å; T283-I386 HydrophobicContact CG2-CG1 3.99Å; T283-I386 HydrophobicContact CG2-CG2 4.13Å; I381-I386 HydrophobicContact CB-CD1 4.15Å; I381-I386 HydrophobicContact CB-CG1 4.02Å; I381-I386 HydrophobicContact CG2-CD1 4.38Å; I381-I386 HydrophobicContact CG2-CG1 3.73Å; S382-I386 PolarHBondContact O-N 2.53Å; P383-I386 WeakPolarHBondContact O-CB 3.4Å; P383-I386 PolarHBondContact O-N 2.94Å; I386-L388 VanDerWaalsContact C-N 3.35Å; I386-F389 CarbonylContact O-C 3.55Å; I386-F389 PolarHBondContact O-N 2.99Å; I386-K390 WeakPolarHBondContact O-CB 3.06Å; I386-K390 WeakPolarHBondContact O-CG 3.14Å; I386-K390 PolarHBondContact O-N 2.81Å
387	A	64.8	Low	68.5	Low	20 Å²	20	29 Å²	29	17%	0.165	14%	0.141	C	C	.	.	H	α-helix	trans	-61.9	-42	175.1	0	0	0	0	0	112	I253 P383 P384 L385 K390 K391	I253-A387 HydrophobicContact CG2-CB 4.05Å; P383-A387 PolarHBondContact O-N 3.22Å; P384-A387 PolarHBondContact O-N 2.89Å; L385-A387 VanDerWaalsContact C-N 3.31Å; L385-A387 PolarHBondContact O-N 2.7Å; A387-K390 PolarHBondContact O-N 2.92Å; A387-K391 PolarHBondContact O-N 3.47Å
388	L	62.3	Low	67.6	Low	1 Å²	1	29.1 Å²	29.1	1%	0.005	14%	0.142	C	C	.	.	H	α-helix	trans	-62.2	-48.3	175.4	-175.2	69.3	0	0	0	111.6	V204 F207 F258 V261 I336 P384 L385 I386 K390 K391 C392	V204-L388 HydrophobicContact CB-CG 4.46Å; V204-L388 HydrophobicContact CG1-CD1 4.23Å; V204-L388 HydrophobicContact CG1-CD2 3.95Å; V204-L388 HydrophobicContact CG1-CG 3.88Å; V204-L388 HydrophobicContact CG2-CD2 4.4Å; V204-L388 HydrophobicContact CG2-CG 3.9Å; F207-L388 HydrophobicContact CB-CD2 4.07Å; F207-L388 HydrophobicContact CG-CD2 4.23Å; F258-L388 HydrophobicContact CD1-CD1 4.49Å; F258-L388 HydrophobicContact CD2-CD1 3.74Å; F258-L388 HydrophobicContact CE1-CD1 4.15Å; F258-L388 HydrophobicContact CE2-CD1 3.36Å; F258-L388 HydrophobicContact CG-CD1 4.26Å; F258-L388 HydrophobicContact CZ-CD1 3.53Å; V261-L388 HydrophobicContact CG1-CD2 4Å; V261-L388 HydrophobicContact CG2-CD1 4.28Å; V261-L388 HydrophobicContact CG2-CD2 4.19Å; I336-L388 HydrophobicContact CD1-CD2 4.12Å; P384-L388 WeakPolarHBondContact O-CB 3.38Å; P384-L388 PolarHBondContact O-N 3.01Å; L385-L388 HydrophobicContact CD2-CD2 4.41Å; L385-L388 WeakPolarHBondContact O-CB 3.41Å; L385-L388 PolarHBondContact O-N 2.54Å; I386-L388 VanDerWaalsContact C-N 3.35Å; L388-K390 PolarHBondContact O-N 3.36Å; L388-K391 PolarHBondContact O-N 2.58Å; L388-K391 VanDerWaalsContact O-N 3.08Å; L388-C392 PolarHBondContact O-N 3.38Å
389	F	62.7	Low	66.8	Low	2 Å²	2	30.6 Å²	30.6	1%	0.009	15%	0.152	C	C	.	.	H	α-helix	trans	-67.5	-9.9	174.6	-75.8	-65.2	0	0	0	113.8	V204 F207 V208 F276 I280 L385 I386 F393	V204-F389 HydrophobicContact CB-CD1 4.21Å; V204-F389 HydrophobicContact CB-CE1 4.09Å; V204-F389 HydrophobicContact CG2-CB 4.4Å; V204-F389 HydrophobicContact CG2-CD1 3.36Å; V204-F389 HydrophobicContact CG2-CE1 3.73Å; V204-F389 HydrophobicContact CG2-CG 3.96Å; F207-F389 HydrophobicContact CD1-CE1 4.11Å; F207-F389 AromaticContact CD1-CE2 3.79Å; F207-F389 HydrophobicContact CD1-CE2 3.79Å; F207-F389 AromaticContact CD1-CZ 3.28Å; F207-F389 HydrophobicContact CD1-CZ 3.28Å; F207-F389 AromaticContact CE1-CE2 3.5Å; F207-F389 HydrophobicContact CE1-CE2 3.5Å; F207-F389 AromaticContact CE1-CZ 3.37Å; F207-F389 HydrophobicContact CE1-CZ 3.37Å; V208-F389 HydrophobicContact CG2-CE1 3.89Å; V208-F389 HydrophobicContact CG2-CZ 4.1Å; F276-F389 HydrophobicContact CE1-CE2 4.29Å; F276-F389 HydrophobicContact CE1-CZ 4.08Å; F276-F389 HydrophobicContact CZ-CE2 4.06Å; F276-F389 HydrophobicContact CZ-CZ 4.32Å; I280-F389 HydrophobicContact CD1-CD1 4.34Å; I280-F389 HydrophobicContact CD1-CD2 4.02Å; I280-F389 HydrophobicContact CD1-CE1 3.69Å; I280-F389 HydrophobicContact CD1-CE2 3.31Å; I280-F389 HydrophobicContact CD1-CZ 3.11Å; I280-F389 HydrophobicContact CG1-CD2 3.99Å; I280-F389 HydrophobicContact CG1-CE2 3.71Å; I280-F389 HydrophobicContact CG1-CZ 4.01Å; I280-F389 HydrophobicContact CG2-CB 4.05Å; I280-F389 HydrophobicContact CG2-CD1 3.85Å; I280-F389 HydrophobicContact CG2-CD2 3.89Å; I280-F389 HydrophobicContact CG2-CE1 4.27Å; I280-F389 HydrophobicContact CG2-CE2 4.32Å; I280-F389 HydrophobicContact CG2-CG 3.67Å; I280-F389 HydrophobicContact CG2-CZ 4.49Å; L385-F389 HydrophobicContact CB-CD2 4.2Å; L385-F389 HydrophobicContact CB-CE2 4.17Å; L385-F389 WeakPolarHBondContact O-CB 3.25Å; L385-F389 WeakPolarHBondContact O-CD2 3.27Å; L385-F389 PolarHBondContact O-N 2.76Å; I386-F389 CarbonylContact O-C 3.55Å; I386-F389 PolarHBondContact O-N 2.99Å; F389-F393 WeakPolarHBondContact O-CD1 3.15Å; F389-F393 WeakPolarHBondContact O-CE1 3.39Å; F389-F393 VanDerWaalsContact O-CZ 3.31Å; F389-F393 WeakPolarHBondContact O-CZ 3.32Å
390	K	62.7	Low	65.9	Low	95 Å²	95	30.6 Å²	30.6	41%	0.413	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93	-11.4	171.2	-81.9	-176	-178.9	177.7	0	113.3	I386 A387 L388 F393	I386-K390 WeakPolarHBondContact O-CB 3.06Å; I386-K390 WeakPolarHBondContact O-CG 3.14Å; I386-K390 PolarHBondContact O-N 2.81Å; A387-K390 PolarHBondContact O-N 2.92Å; L388-K390 PolarHBondContact O-N 3.36Å; K390-F393 VanDerWaalsContact CA-CZ 3.42Å; K390-F393 WeakPolarHBondContact O-CE2 3.46Å; K390-F393 WeakPolarHBondContact O-CZ 3.41Å
391	K	53.1	Low	65.4	Low	93 Å²	93	28.5 Å²	28.5	40%	0.404	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.2	-36.6	-172.8	-77.2	-176.3	161.2	-155.5	0	113.9	I253 K254 A387 L388	I253-K391 PolarHBondContact O-NZ 2.75Å; K254-K391 PolarHBondContact O-NZ 2.86Å; A387-K391 PolarHBondContact O-N 3.47Å; L388-K391 PolarHBondContact O-N 2.58Å; L388-K391 VanDerWaalsContact O-N 3.08Å
392	C	49.1	Very low	65.2	Low	43 Å²	43	30.6 Å²	30.6	29%	0.291	15%	0.152	S	C	.	.	S	Bend	trans	-112.2	109.8	-173.4	-64	0	0	0	0	109.1	V204 L388	V204-C392 HydrophobicContact CB-CB 4.4Å; V204-C392 HydrophobicContact CG1-CB 3.92Å; V204-C392 HydrophobicContact CG2-CB 4.07Å; V204-C392 VanDerWaalsContact CG2-O 3.24Å; V204-C392 WeakPolarHBondContact CG2-O 3.09Å; L388-C392 PolarHBondContact O-N 3.38Å
393	F	53.5	Low	65.3	Low	66 Å²	66	34 Å²	34	29%	0.289	16%	0.164	S	C	.	.			trans	-130.1	135.4	-165.5	-67.7	-54.9	0	0	0	110.4	T202 V203 F389 K390 F427	T202-F393 HydrophobicContact CG2-CB 3.52Å; T202-F393 HydrophobicContact CG2-CD1 2.94Å; T202-F393 HydrophobicContact CG2-CE1 3.5Å; T202-F393 HydrophobicContact CG2-CG 3.45Å; T202-F393 VanDerWaalsContact CG2-CG 3.45Å; V203-F393 CarbonylContact O-C 3.51Å; F389-F393 WeakPolarHBondContact O-CD1 3.15Å; F389-F393 WeakPolarHBondContact O-CE1 3.39Å; F389-F393 VanDerWaalsContact O-CZ 3.31Å; F389-F393 WeakPolarHBondContact O-CZ 3.32Å; K390-F393 VanDerWaalsContact CA-CZ 3.42Å; K390-F393 WeakPolarHBondContact O-CE2 3.46Å; K390-F393 WeakPolarHBondContact O-CZ 3.41Å; F393-F427 HydrophobicContact CB-CE1 4.44Å; F393-F427 HydrophobicContact CB-CZ 4.02Å; F393-F427 WeakPolarHBondContact O-CD1 3.38Å; F393-F427 VanDerWaalsContact O-CD2 3.26Å; F393-F427 WeakPolarHBondContact O-CD2 3.24Å; F393-F427 WeakPolarHBondContact O-CE1 3.29Å; F393-F427 VanDerWaalsContact O-CE2 3.3Å; F393-F427 WeakPolarHBondContact O-CE2 3.46Å; F393-F427 WeakPolarHBondContact O-CG 3.39Å; F393-F427 WeakPolarHBondContact O-CZ 3.46Å
394	F	52.1	Low	65.8	Low	1 Å²	1	32.6 Å²	32.6	0%	0.004	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	147.8	143.1	63.7	-84.5	0	0	0	108.2	I201 T202 V203 P205 A396 L420 M423 F427	I201-F394 VanDerWaalsContact O-O 3.07Å; T202-F394 WeakPolarHBondContact CA-O 3.23Å; V203-F394 HydrophobicContact CB-CD1 4.1Å; V203-F394 HydrophobicContact CB-CD2 4.31Å; V203-F394 HydrophobicContact CB-CE1 3.56Å; V203-F394 HydrophobicContact CB-CE2 3.84Å; V203-F394 HydrophobicContact CB-CG 4.48Å; V203-F394 HydrophobicContact CB-CZ 3.48Å; V203-F394 VanDerWaalsContact CB-CZ 3.48Å; V203-F394 HydrophobicContact CG1-CE1 3.57Å; V203-F394 HydrophobicContact CG1-CE2 4.18Å; V203-F394 HydrophobicContact CG1-CZ 3.4Å; V203-F394 VanDerWaalsContact CG1-CZ 3.4Å; V203-F394 HydrophobicContact CG2-CE2 4.32Å; V203-F394 HydrophobicContact CG2-CZ 4.33Å; V203-F394 PolarHBondContact N-O 2.98Å; V203-F394 WeakPolarHBondContact O-CD1 3.46Å; V203-F394 WeakPolarHBondContact O-CE1 3.26Å; V203-F394 PolarHBondContact O-N 2.9Å; P205-F394 HydrophobicContact CB-CD1 4.47Å; P205-F394 HydrophobicContact CB-CE1 4.21Å; P205-F394 HydrophobicContact CG-CD1 3.58Å; P205-F394 HydrophobicContact CG-CE1 3.77Å; F394-A396 HydrophobicContact CD2-CB 4.05Å; F394-A396 HydrophobicContact CE2-CB 3.72Å; F394-A396 PolarHBondContact O-N 3.05Å; F394-L420 HydrophobicContact CE2-CD2 3.75Å; F394-L420 HydrophobicContact CZ-CB 4.26Å; F394-L420 HydrophobicContact CZ-CD2 3.87Å; F394-L420 WeakPolarHBondContact CZ-O 3.31Å; F394-M423 HydrophobicContact CD2-CB 3.32Å; F394-M423 HydrophobicContact CD2-CG 4.45Å; F394-M423 HydrophobicContact CE2-CB 3.24Å; F394-M423 HydrophobicContact CE2-CG 4.29Å; F394-M423 HydrophobicContact CG-CB 4.38Å; F394-M423 HydrophobicContact CZ-CB 4.29Å; F394-F427 VanDerWaalsContact CA-CD2 3.47Å; F394-F427 HydrophobicContact CB-CB 3.7Å; F394-F427 HydrophobicContact CB-CD2 3.74Å; F394-F427 HydrophobicContact CB-CG 3.87Å
395	K	58.9	Low	66.2	Low	137 Å²	137	33.4 Å²	33.4	60%	0.596	16%	0.158	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-80.2	112.2	173.3	-74	176.8	165.3	-166.3	0	108.2	D200 I201	D200-K395 HydrophobicContact CB-CB 4.06Å; D200-K395 HydrophobicContact CB-CD 4.12Å; D200-K395 HydrophobicContact CB-CG 3.99Å; D200-K395 WeakPolarHBondContact OD2-CD 3.06Å; D200-K395 IonicContact OD2-NZ 3.04Å; I201-K395 CarbonylContact O-C 3.55Å; I201-K395 WeakPolarHBondContact O-CA 3Å
396	A	61.6	Low	66.3	Low	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	139.1	170.5	0	0	0	0	0	109.9	I201 V203 F394 I398 Y419 L420 M423	I201-A396 HydrophobicContact CD1-CB 4.29Å; I201-A396 HydrophobicContact CG1-CB 3.9Å; I201-A396 VanDerWaalsContact CG1-O 3.26Å; I201-A396 WeakPolarHBondContact CG1-O 3.26Å; I201-A396 PolarHBondContact N-O 3.28Å; I201-A396 VanDerWaalsContact N-O 3.08Å; I201-A396 PolarHBondContact O-N 3.38Å; V203-A396 HydrophobicContact CG2-CB 3.96Å; F394-A396 HydrophobicContact CD2-CB 4.05Å; F394-A396 HydrophobicContact CE2-CB 3.72Å; F394-A396 PolarHBondContact O-N 3.05Å; A396-I398 PolarHBondContact O-N 3.01Å; A396-Y419 HydrophobicContact CB-CE1 4.26Å; A396-L420 HydrophobicContact CB-CD2 3.62Å; A396-M423 HydrophobicContact CB-CG 4.44Å
397	N	68.7	Low	66.5	Low	45 Å²	45	41.1 Å²	41.1	24%	0.241	19%	0.194	C	C	.	.			trans	-79.6	109.5	173.6	-170.3	-30.2	0	0	0	109	S399 A400 Y419 Y488	N397-S399 PolarHBondContact O-N 2.7Å; N397-S399 WeakPolarHBondContact OD1-CB 3.4Å; N397-S399 PolarHBondContact OD1-N 3.41Å; N397-S399 PolarHBondContact OD1-OG 3.4Å; N397-A400 VanDerWaalsContact O-CB 3.27Å; N397-A400 WeakPolarHBondContact O-CB 3.27Å; N397-A400 PolarHBondContact O-N 3.38Å; N397-Y419 WeakPolarHBondContact CB-OH 3.32Å; N397-Y419 PolarHBondContact N-OH 2.96Å; N397-Y488 PolarHBondContact ND2-OH 2.85Å
398	I	72	Confident	66.5	Low	2 Å²	2	45 Å²	45	1%	0.01	21%	0.212	C	C	.	.	H	α-helix	trans	-58.3	-30.2	179.6	-167.9	58.4	0	0	0	112.2	I201 L274 F307 A396 A400 I401 R402	I201-I398 HydrophobicContact CD1-CD1 4.15Å; I201-I398 HydrophobicContact CG2-CB 4.4Å; L274-I398 HydrophobicContact CD2-CD1 3.52Å; F307-I398 HydrophobicContact CD1-CD1 4.37Å; F307-I398 HydrophobicContact CD1-CG1 4.43Å; F307-I398 HydrophobicContact CE1-CD1 3.54Å; F307-I398 HydrophobicContact CE1-CG1 3.96Å; F307-I398 HydrophobicContact CE2-CD1 4.34Å; F307-I398 HydrophobicContact CE2-CG1 4.08Å; F307-I398 HydrophobicContact CZ-CD1 3.54Å; F307-I398 HydrophobicContact CZ-CG1 3.78Å; A396-I398 PolarHBondContact O-N 3.01Å; I398-A400 PolarHBondContact O-N 2.89Å; I398-I401 HydrophobicContact CD1-CB 4.43Å; I398-I401 HydrophobicContact CD1-CD1 4.23Å; I398-I401 PolarHBondContact O-N 2.79Å; I398-I401 VanDerWaalsContact O-N 3.12Å; I398-R402 HydrophobicContact CG1-CG 4.36Å; I398-R402 WeakPolarHBondContact O-CG 3.02Å; I398-R402 PolarHBondContact O-N 2.72Å
399	S	73.8	Confident	66.8	Low	32 Å²	32	53.3 Å²	53.3	22%	0.224	25%	0.248	C	C	.	.	H	α-helix	trans	-62.1	-30.7	178.1	-54.3	0	0	0	0	112.3	N397 R403	N397-S399 PolarHBondContact O-N 2.7Å; N397-S399 WeakPolarHBondContact OD1-CB 3.4Å; N397-S399 PolarHBondContact OD1-N 3.41Å; N397-S399 PolarHBondContact OD1-OG 3.4Å; S399-R403 WeakPolarHBondContact O-CB 3.29Å; S399-R403 PolarHBondContact O-N 2.76Å
400	A	73.4	Confident	66.9	Low	0 Å²	0	63 Å²	63	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-63.3	-49.9	172.9	0	0	0	0	0	111	N397 I398 R402 R403 F404 Y419 Y488	N397-A400 VanDerWaalsContact O-CB 3.27Å; N397-A400 WeakPolarHBondContact O-CB 3.27Å; N397-A400 PolarHBondContact O-N 3.38Å; I398-A400 PolarHBondContact O-N 2.89Å; A400-R402 VanDerWaalsContact C-N 3.35Å; A400-R402 PolarHBondContact O-N 2.8Å; A400-R403 WeakPolarHBondContact O-CB 3.32Å; A400-R403 PolarHBondContact O-N 2.81Å; A400-F404 HydrophobicContact CB-CE2 4.07Å; A400-F404 HydrophobicContact CB-CZ 4.43Å; A400-F404 WeakPolarHBondContact O-CD2 3.15Å; A400-F404 WeakPolarHBondContact O-CE2 3.06Å; A400-F404 VanDerWaalsContact O-CG 3.29Å; A400-F404 WeakPolarHBondContact O-CG 3.3Å; A400-F404 PolarHBondContact O-N 3.18Å; A400-Y419 HydrophobicContact CB-CD1 4Å; A400-Y419 HydrophobicContact CB-CD2 4.06Å; A400-Y419 HydrophobicContact CB-CE1 3.53Å; A400-Y419 HydrophobicContact CB-CE2 3.61Å; A400-Y419 HydrophobicContact CB-CG 4.24Å; A400-Y488 HydrophobicContact CB-CD1 4.09Å; A400-Y488 HydrophobicContact CB-CD2 4.15Å; A400-Y488 HydrophobicContact CB-CE1 3.57Å; A400-Y488 HydrophobicContact CB-CE2 3.62Å; A400-Y488 HydrophobicContact CB-CG 4.37Å
401	I	74.6	Confident	67.4	Low	1 Å²	1	59.1 Å²	59.1	1%	0.005	27%	0.269	C	S	.	.	H	α-helix	trans	-66.3	-40.3	-178	-52	172.6	0	0	0	110.5	I201 L270 L274 I398 F404 L405 A416 Y419 L420	I201-I401 HydrophobicContact CD1-CD1 4.31Å; L270-I401 HydrophobicContact CD1-CG2 3.91Å; L274-I401 HydrophobicContact CD1-CG2 4.39Å; L274-I401 HydrophobicContact CD2-CB 4.34Å; L274-I401 HydrophobicContact CD2-CG2 3.71Å; L274-I401 HydrophobicContact CG-CG2 4.31Å; I398-I401 HydrophobicContact CD1-CB 4.43Å; I398-I401 HydrophobicContact CD1-CD1 4.23Å; I398-I401 PolarHBondContact O-N 2.79Å; I398-I401 VanDerWaalsContact O-N 3.12Å; I401-F404 PolarHBondContact O-N 3.34Å; I401-L405 PolarHBondContact O-N 2.81Å; I401-A416 HydrophobicContact CG2-CB 3.98Å; I401-Y419 HydrophobicContact CG1-CD1 3.85Å; I401-Y419 HydrophobicContact CG1-CE1 4.02Å; I401-L420 HydrophobicContact CD1-CD1 4.06Å; I401-L420 HydrophobicContact CD1-CD2 3.78Å; I401-L420 HydrophobicContact CD1-CG 4.05Å
402	R	75.4	Confident	68.5	Low	48 Å²	48	55 Å²	55	18%	0.181	25%	0.251	C	S	.	.	H	α-helix	trans	-58.5	-48	173.3	-69.3	-177.3	-169.7	175.7	1.6	111.5	D306 F307 I308 I398 A400 F404 L405 H406	D306-R402 VanDerWaalsContact O-CZ 3.26Å; D306-R402 PolarHBondContact O-NH1 2.84Å; D306-R402 PolarHBondContact O-NH2 3.49Å; F307-R402 PolarHBondContact O-NE 2.11Å; F307-R402 PolarHBondContact O-NH2 2.89Å; I308-R402 WeakPolarHBondContact O-CG 3.39Å; I398-R402 HydrophobicContact CG1-CG 4.36Å; I398-R402 WeakPolarHBondContact O-CG 3.02Å; I398-R402 PolarHBondContact O-N 2.72Å; A400-R402 VanDerWaalsContact C-N 3.35Å; A400-R402 PolarHBondContact O-N 2.8Å; R402-F404 VanDerWaalsContact C-N 3.28Å; R402-F404 PolarHBondContact O-N 2.9Å; R402-L405 WeakPolarHBondContact O-CB 2.91Å; R402-L405 PolarHBondContact O-N 3.24Å; R402-L405 VanDerWaalsContact O-N 3.07Å; R402-H406 PolarHBondContact O-CD2 2.87Å; R402-H406 PolarHBondContact O-N 3.08Å
403	R	77.5	Confident	69.6	Low	77 Å²	77	54.8 Å²	54.8	29%	0.291	25%	0.247	S	C	.	.	H	α-helix	trans	-55.3	-47.4	176.6	177.1	-176.6	171.1	166.2	1.8	110.7	S399 A400 L405 H406 E407	S399-R403 WeakPolarHBondContact O-CB 3.29Å; S399-R403 PolarHBondContact O-N 2.76Å; A400-R403 WeakPolarHBondContact O-CB 3.32Å; A400-R403 PolarHBondContact O-N 2.81Å; R403-L405 VanDerWaalsContact C-N 3.31Å; R403-L405 PolarHBondContact O-N 3.44Å; R403-H406 PolarHBondContact O-N 3.29Å; R403-H406 VanDerWaalsContact O-N 3.13Å; R403-E407 WeakPolarHBondContact CG-OE1 3.46Å; R403-E407 IonicContact CZ-OE1 3.98Å; R403-E407 IonicContact NE-OE1 3.47Å; R403-E407 PolarHBondContact NE-OE1 3.22Å; R403-E407 WeakPolarHBondContact O-CG 3.29Å; R403-E407 PolarHBondContact O-N 3.04Å
404	F	80.3	Confident	70.7	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-62.5	-36.9	177.7	-54.8	-39	0	0	0	112.5	A400 I401 R402 H406 E407 N412 K415 Y419 V485 Y488	A400-F404 HydrophobicContact CB-CE2 4.07Å; A400-F404 HydrophobicContact CB-CZ 4.43Å; A400-F404 WeakPolarHBondContact O-CD2 3.15Å; A400-F404 WeakPolarHBondContact O-CE2 3.06Å; A400-F404 VanDerWaalsContact O-CG 3.29Å; A400-F404 WeakPolarHBondContact O-CG 3.3Å; A400-F404 PolarHBondContact O-N 3.18Å; I401-F404 PolarHBondContact O-N 3.34Å; R402-F404 VanDerWaalsContact C-N 3.28Å; R402-F404 PolarHBondContact O-N 2.9Å; F404-H406 PolarHBondContact O-N 2.79Å; F404-E407 PolarHBondContact O-N 3.36Å; F404-N412 WeakPolarHBondContact O-CB 3.28Å; F404-N412 PolarHBondContact O-ND2 3.42Å; F404-N412 VanDerWaalsContact O-ND2 3.09Å; F404-N412 PolarHBondContact O-OD1 3.47Å; F404-K415 HydrophobicContact CB-CB 3.86Å; F404-K415 HydrophobicContact CB-CD 4.3Å; F404-K415 HydrophobicContact CD1-CB 4.02Å; F404-K415 HydrophobicContact CD1-CD 4.1Å; F404-K415 HydrophobicContact CD2-CB 4.11Å; F404-K415 HydrophobicContact CG-CB 3.72Å; F404-K415 HydrophobicContact CG-CD 4.4Å; F404-Y419 HydrophobicContact CE2-CD1 4.28Å; F404-Y419 HydrophobicContact CE2-CD2 4.1Å; F404-Y419 AromaticContact CE2-CG 3.7Å; F404-Y419 HydrophobicContact CE2-CG 3.7Å; F404-Y419 HydrophobicContact CZ-CD2 4.46Å; F404-Y419 HydrophobicContact CZ-CG 4.47Å; F404-V485 HydrophobicContact CE1-CG2 4.24Å; F404-V485 HydrophobicContact CE2-CG2 4.13Å; F404-V485 HydrophobicContact CZ-CB 4.46Å; F404-V485 HydrophobicContact CZ-CG2 3.75Å; F404-Y488 HydrophobicContact CZ-CG 4.29Å
405	L	73.6	Confident	72.1	Confident	25 Å²	25	52.1 Å²	52.1	13%	0.131	24%	0.236	C	C	.	.	H	α-helix	trans	-58.3	-33.9	175.8	-175.6	69.2	0	0	0	112.7	L270 E271 L274 I308 I401 R402 R403 N412	L270-L405 HydrophobicContact CB-CD1 4.45Å; L270-L405 HydrophobicContact CD2-CB 4.26Å; L270-L405 HydrophobicContact CD2-CD1 3.88Å; L270-L405 HydrophobicContact CG-CD1 4.15Å; E271-L405 HydrophobicContact CG-CD1 3.79Å; L274-L405 HydrophobicContact CD1-CD2 3.82Å; I308-L405 HydrophobicContact CG2-CD2 3.87Å; I401-L405 PolarHBondContact O-N 2.81Å; R402-L405 WeakPolarHBondContact O-CB 2.91Å; R402-L405 PolarHBondContact O-N 3.24Å; R402-L405 VanDerWaalsContact O-N 3.07Å; R403-L405 VanDerWaalsContact C-N 3.31Å; R403-L405 PolarHBondContact O-N 3.44Å; L405-N412 PolarHBondContact O-ND2 3.18Å
406	H	72.7	Confident	73	Confident	122 Å²	122	45.6 Å²	45.6	57%	0.565	21%	0.207	S	C	*	.	H	α-helix	trans	-89.5	-7.6	-178.6	-62.5	-64.3	0	0	0	114.2	R402 R403 F404	R402-H406 PolarHBondContact O-CD2 2.87Å; R402-H406 PolarHBondContact O-N 3.08Å; R403-H406 PolarHBondContact O-N 3.29Å; R403-H406 VanDerWaalsContact O-N 3.13Å; F404-H406 PolarHBondContact O-N 2.79Å
407	E	74.5	Confident	73.7	Confident	53 Å²	53	45.7 Å²	45.7	25%	0.248	21%	0.208	C	C	.	.	S	Bend	trans	-82.4	-172	174.4	-72.3	177.9	-172.6	0	0	111.9	R403 F404 K409 N412 K415	R403-E407 WeakPolarHBondContact CG-OE1 3.46Å; R403-E407 IonicContact CZ-OE1 3.98Å; R403-E407 IonicContact NE-OE1 3.47Å; R403-E407 PolarHBondContact NE-OE1 3.22Å; R403-E407 WeakPolarHBondContact O-CG 3.29Å; R403-E407 PolarHBondContact O-N 3.04Å; F404-E407 PolarHBondContact O-N 3.36Å; E407-K409 PolarHBondContact O-N 3.37Å; E407-N412 VanDerWaalsContact C-OD1 3.29Å; E407-N412 PolarHBondContact O-ND2 3.34Å; E407-N412 PolarHBondContact O-OD1 3.43Å; E407-K415 IonicContact OE2-NZ 3.56Å; E407-K415 PolarHBondContact OE2-NZ 3.09Å
408	D	64.5	Low	74.2	Confident	103 Å²	103	43.6 Å²	43.6	55%	0.551	20%	0.196	S	C	*	.			trans	-53.8	108.9	-178	-176.3	-3.7	0	0	0	113.6	R410 V411 N412	D408-R410 PolarHBondContact O-N 3.49Å; D408-R410 PolarHBondContact OD1-N 3.37Å; D408-V411 PolarHBondContact O-N 3.19Å; D408-V411 VanDerWaalsContact O-N 3.11Å; D408-N412 PolarHBondContact O-OD1 3.14Å
409	K	67.4	Low	74.6	Confident	174 Å²	174	43.7 Å²	43.7	76%	0.757	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-45	-28	-175.3	-65	-175.2	-179.6	179.1	0	115.4	E407 V411 N412	E407-K409 PolarHBondContact O-N 3.37Å; K409-V411 VanDerWaalsContact C-N 3.29Å; K409-V411 PolarHBondContact O-N 3.21Å; K409-N412 WeakPolarHBondContact CA-ND2 3.44Å
410	R	65.4	Low	74.5	Confident	207 Å²	207	42.2 Å²	42.2	78%	0.781	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-24.5	-175.7	-65.6	-175.5	178.7	-174.9	2.6	114	D408	D408-R410 PolarHBondContact O-N 3.49Å; D408-R410 PolarHBondContact OD1-N 3.37Å
411	V	73.8	Confident	74.6	Confident	13 Å²	13	42.6 Å²	42.6	8%	0.079	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-124.8	1.3	-172.2	-161.8	0	0	0	0	112	D408 K409 D413 L414 K415 Q477 A480 A481	D408-V411 PolarHBondContact O-N 3.19Å; D408-V411 VanDerWaalsContact O-N 3.11Å; K409-V411 VanDerWaalsContact C-N 3.29Å; K409-V411 PolarHBondContact O-N 3.21Å; V411-D413 VanDerWaalsContact C-N 3.33Å; V411-D413 PolarHBondContact O-N 3.35Å; V411-L414 HydrophobicContact CG1-CB 4.03Å; V411-L414 HydrophobicContact CG1-CD2 4.29Å; V411-L414 PolarHBondContact O-N 3.37Å; V411-L414 VanDerWaalsContact O-N 3.07Å; V411-K415 HydrophobicContact CG1-CG 4.33Å; V411-K415 WeakPolarHBondContact O-CG 3.3Å; V411-K415 PolarHBondContact O-N 2.95Å; V411-Q477 HydrophobicContact CG1-CB 4.37Å; V411-Q477 VanDerWaalsContact CG1-O 3.24Å; V411-Q477 WeakPolarHBondContact CG1-O 3.45Å; V411-A480 HydrophobicContact CG1-CB 4.49Å; V411-A481 HydrophobicContact CG1-CB 3.95Å
412	N	75.2	Confident	74.5	Confident	6 Å²	6	42.6 Å²	42.6	3%	0.032	19%	0.188	C	C	.	.	H	α-helix	trans	-56.9	-43.8	-175.2	-69.7	-3.8	0	0	0	112.8	L270 F404 L405 E407 D408 K409 L414 K415 A416	L270-N412 HydrophobicContact CD2-CB 4.35Å; F404-N412 WeakPolarHBondContact O-CB 3.28Å; F404-N412 PolarHBondContact O-ND2 3.42Å; F404-N412 VanDerWaalsContact O-ND2 3.09Å; F404-N412 PolarHBondContact O-OD1 3.47Å; L405-N412 PolarHBondContact O-ND2 3.18Å; E407-N412 VanDerWaalsContact C-OD1 3.29Å; E407-N412 PolarHBondContact O-ND2 3.34Å; E407-N412 PolarHBondContact O-OD1 3.43Å; D408-N412 PolarHBondContact O-OD1 3.14Å; K409-N412 WeakPolarHBondContact CA-ND2 3.44Å; N412-L414 VanDerWaalsContact C-N 3.33Å; N412-L414 PolarHBondContact O-N 3.35Å; N412-K415 WeakPolarHBondContact O-CB 3.21Å; N412-K415 PolarHBondContact O-N 3.29Å; N412-A416 WeakPolarHBondContact O-CB 3.42Å; N412-A416 PolarHBondContact O-N 3Å
413	D	72.4	Confident	74.2	Confident	38 Å²	38	41.4 Å²	41.4	20%	0.203	18%	0.184	C	C	.	.	H	α-helix	trans	-63.8	-40.8	178.6	-52.9	-25.1	0	0	0	111.3	R216 L270 V411 A416 W417	R216-D413 HydrophobicContact CG-CB 4.03Å; L270-D413 WeakPolarHBondContact CB-OD1 2.85Å; V411-D413 VanDerWaalsContact C-N 3.33Å; V411-D413 PolarHBondContact O-N 3.35Å; D413-A416 PolarHBondContact O-N 3.31Å; D413-W417 VanDerWaalsContact O-CB 3.24Å; D413-W417 WeakPolarHBondContact O-CB 3.33Å; D413-W417 PolarHBondContact O-N 2.79Å
414	L	77.1	Confident	73.5	Confident	1 Å²	1	38.6 Å²	38.6	1%	0.005	18%	0.176	C	C	.	.	H	α-helix	trans	-72.2	-34.1	179.4	-168.9	61.5	0	0	0	112	V411 N412 W417 F418 T465 L474 Q477 L478 A481	V411-L414 HydrophobicContact CG1-CB 4.03Å; V411-L414 HydrophobicContact CG1-CD2 4.29Å; V411-L414 PolarHBondContact O-N 3.37Å; V411-L414 VanDerWaalsContact O-N 3.07Å; N412-L414 VanDerWaalsContact C-N 3.33Å; N412-L414 PolarHBondContact O-N 3.35Å; L414-W417 HydrophobicContact CD1-CE3 4.27Å; L414-F418 WeakPolarHBondContact O-CB 3.15Å; L414-F418 PolarHBondContact O-N 2.64Å; L414-T465 HydrophobicContact CD1-CG2 4.25Å; L414-L474 HydrophobicContact CD2-CD1 4.28Å; L414-Q477 VanDerWaalsContact CD2-C 3.5Å; L414-Q477 HydrophobicContact CD2-CB 3.74Å; L414-L478 HydrophobicContact CD1-CD1 3.98Å; L414-L478 HydrophobicContact CD2-CB 4.07Å; L414-L478 HydrophobicContact CD2-CD1 4.08Å; L414-L478 HydrophobicContact CG-CD1 4Å; L414-A481 HydrophobicContact CB-CB 4.37Å; L414-A481 HydrophobicContact CD2-CB 4.29Å; L414-A481 HydrophobicContact CG-CB 4Å
415	K	82.1	Confident	72.6	Confident	11 Å²	11	39.7 Å²	39.7	5%	0.048	18%	0.182	C	C	.	.	H	α-helix	trans	-62.3	-49.6	171.3	-71.9	171.5	-174	-171.3	0	111	F404 E407 V411 N412 F418 Y419 A481 S484	F404-K415 HydrophobicContact CB-CB 3.86Å; F404-K415 HydrophobicContact CB-CD 4.3Å; F404-K415 HydrophobicContact CD1-CB 4.02Å; F404-K415 HydrophobicContact CD1-CD 4.1Å; F404-K415 HydrophobicContact CD2-CB 4.11Å; F404-K415 HydrophobicContact CG-CB 3.72Å; F404-K415 HydrophobicContact CG-CD 4.4Å; E407-K415 IonicContact OE2-NZ 3.56Å; E407-K415 PolarHBondContact OE2-NZ 3.09Å; V411-K415 HydrophobicContact CG1-CG 4.33Å; V411-K415 WeakPolarHBondContact O-CG 3.3Å; V411-K415 PolarHBondContact O-N 2.95Å; N412-K415 WeakPolarHBondContact O-CB 3.21Å; N412-K415 PolarHBondContact O-N 3.29Å; K415-F418 PolarHBondContact O-N 2.72Å; K415-Y419 VanDerWaalsContact O-CB 3.31Å; K415-Y419 WeakPolarHBondContact O-CB 3.36Å; K415-Y419 PolarHBondContact O-N 2.99Å; K415-A481 HydrophobicContact CG-CB 3.98Å; K415-S484 WeakPolarHBondContact CE-OG 3.45Å; K415-S484 PolarHBondContact NZ-OG 2.93Å
416	A	76.6	Confident	71.9	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-63.4	-46.5	178.9	0	0	0	0	0	111.8	L270 I401 N412 D413 Y419 L420	L270-A416 HydrophobicContact CD1-CB 3.44Å; L270-A416 VanDerWaalsContact CD1-CB 3.44Å; L270-A416 HydrophobicContact CD2-CB 3.79Å; L270-A416 HydrophobicContact CG-CB 4.27Å; I401-A416 HydrophobicContact CG2-CB 3.98Å; N412-A416 WeakPolarHBondContact O-CB 3.42Å; N412-A416 PolarHBondContact O-N 3Å; D413-A416 PolarHBondContact O-N 3.31Å; A416-Y419 PolarHBondContact O-N 2.88Å; A416-L420 WeakPolarHBondContact O-CB 2.97Å; A416-L420 WeakPolarHBondContact O-CG 3.43Å; A416-L420 PolarHBondContact O-N 3.21Å
417	W	76.9	Confident	70.8	Confident	2 Å²	2	40.4 Å²	40.4	1%	0.008	18%	0.182	C	C	.	.	H	α-helix	trans	-56.8	-51.3	174.3	-177.8	90.9	0	0	0	111	L209 I212 D413 L414 Y419 L420 Y421 I456 I461 R464 T465	L209-W417 HydrophobicContact CD2-CD2 4.35Å; L209-W417 HydrophobicContact CD2-CG 4.15Å; L209-W417 VanDerWaalsContact CD2-O 3.3Å; L209-W417 WeakPolarHBondContact CD2-O 3.3Å; L209-W417 PolarHBondContact O-NE1 2.7Å; I212-W417 HydrophobicContact CG2-CB 3.74Å; I212-W417 HydrophobicContact CG2-CG 4.33Å; D413-W417 VanDerWaalsContact O-CB 3.24Å; D413-W417 WeakPolarHBondContact O-CB 3.33Å; D413-W417 PolarHBondContact O-N 2.79Å; L414-W417 HydrophobicContact CD1-CE3 4.27Å; W417-Y419 PolarHBondContact O-N 2.75Å; W417-L420 PolarHBondContact O-N 3.28Å; W417-Y421 HydrophobicContact CH2-CD2 4.4Å; W417-Y421 HydrophobicContact CH2-CG 4.19Å; W417-Y421 HydrophobicContact CZ3-CG 4.43Å; W417-Y421 WeakPolarHBondContact O-CB 3.25Å; W417-Y421 PolarHBondContact O-N 2.89Å; W417-I456 HydrophobicContact CH2-CD1 4.11Å; W417-I461 HydrophobicContact CH2-CB 4.37Å; W417-I461 HydrophobicContact CH2-CD1 4.49Å; W417-I461 HydrophobicContact CH2-CG1 3.92Å; W417-I461 HydrophobicContact CH2-CG2 4.01Å; W417-I461 HydrophobicContact CZ3-CD1 4.4Å; W417-I461 HydrophobicContact CZ3-CG1 4.27Å; W417-I461 HydrophobicContact CZ3-CG2 3.96Å; W417-R464 HydrophobicContact CZ2-CB 4.03Å; W417-R464 PolarHBondContact NE1-O 2.68Å; W417-T465 HydrophobicContact CD2-CG2 3.63Å; W417-T465 HydrophobicContact CE3-CG2 4.11Å; W417-T465 HydrophobicContact CG-CG2 3.95Å; W417-T465 HydrophobicContact CH2-CG2 4.49Å; W417-T465 HydrophobicContact CZ2-CG2 4Å
418	F	79.2	Confident	69.6	Low	0 Å²	0	44.9 Å²	44.9	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-64.2	-43.8	-177.3	-171.8	-113.9	0	0	0	111.3	L414 K415 L420 Y421 L422 L478 V482 V485 F496 L508 V510	L414-F418 WeakPolarHBondContact O-CB 3.15Å; L414-F418 PolarHBondContact O-N 2.64Å; K415-F418 PolarHBondContact O-N 2.72Å; F418-L420 PolarHBondContact O-N 3.18Å; F418-Y421 HydrophobicContact CD2-CD1 4.45Å; F418-Y421 HydrophobicContact CE2-CD1 4.46Å; F418-Y421 WeakPolarHBondContact O-CB 3.18Å; F418-Y421 PolarHBondContact O-N 2.98Å; F418-L422 HydrophobicContact CD1-CD1 4.09Å; F418-L422 HydrophobicContact CD1-CG 4.43Å; F418-L422 HydrophobicContact CE1-CD1 3.77Å; F418-L422 HydrophobicContact CE1-CD2 4.35Å; F418-L422 HydrophobicContact CE1-CG 4.2Å; F418-L422 HydrophobicContact CE2-CD2 4.33Å; F418-L422 HydrophobicContact CZ-CD1 4.3Å; F418-L422 HydrophobicContact CZ-CD2 4.02Å; F418-L422 HydrophobicContact CZ-CG 4.32Å; F418-L422 VanDerWaalsContact O-CG 3.3Å; F418-L422 WeakPolarHBondContact O-CG 3.15Å; F418-L422 PolarHBondContact O-N 2.87Å; F418-L478 HydrophobicContact CD2-CD1 4.08Å; F418-L478 HydrophobicContact CG-CD1 4.44Å; F418-V482 HydrophobicContact CD1-CG2 4.17Å; F418-V482 HydrophobicContact CE1-CB 4.23Å; F418-V482 HydrophobicContact CE1-CG2 3.52Å; F418-V482 HydrophobicContact CE2-CG2 4.27Å; F418-V482 HydrophobicContact CZ-CG2 3.57Å; F418-V485 HydrophobicContact CD1-CB 4.07Å; F418-V485 HydrophobicContact CD1-CG1 4.2Å; F418-V485 HydrophobicContact CD1-CG2 4.04Å; F418-F496 AromaticContact CE1-CE1 3.8Å; F418-F496 HydrophobicContact CE1-CE1 3.8Å; F418-F496 AromaticContact CE1-CZ 3.48Å; F418-F496 HydrophobicContact CE1-CZ 3.48Å; F418-F496 VanDerWaalsContact CE1-CZ 3.48Å; F418-F496 HydrophobicContact CZ-CE1 4.29Å; F418-F496 AromaticContact CZ-CZ 3.64Å; F418-F496 HydrophobicContact CZ-CZ 3.64Å; F418-L508 HydrophobicContact CE2-CD2 3.87Å; F418-L508 HydrophobicContact CZ-CD2 3.97Å; F418-V510 HydrophobicContact CE2-CG2 4.37Å; F418-V510 HydrophobicContact CZ-CG2 4.1Å
419	Y	80.2	Confident	68.5	Low	4 Å²	4	43.4 Å²	43.4	2%	0.016	20%	0.197	C	C	.	.	H	α-helix	trans	-56.7	-48.3	174.3	172	-103.1	0	0	0	112.5	A396 N397 A400 I401 F404 K415 A416 W417 Y421 L422 M423 V485 Y488 F489	A396-Y419 HydrophobicContact CB-CE1 4.26Å; N397-Y419 WeakPolarHBondContact CB-OH 3.32Å; N397-Y419 PolarHBondContact N-OH 2.96Å; A400-Y419 HydrophobicContact CB-CD1 4Å; A400-Y419 HydrophobicContact CB-CD2 4.06Å; A400-Y419 HydrophobicContact CB-CE1 3.53Å; A400-Y419 HydrophobicContact CB-CE2 3.61Å; A400-Y419 HydrophobicContact CB-CG 4.24Å; I401-Y419 HydrophobicContact CG1-CD1 3.85Å; I401-Y419 HydrophobicContact CG1-CE1 4.02Å; F404-Y419 HydrophobicContact CE2-CD1 4.28Å; F404-Y419 HydrophobicContact CE2-CD2 4.1Å; F404-Y419 AromaticContact CE2-CG 3.7Å; F404-Y419 HydrophobicContact CE2-CG 3.7Å; F404-Y419 HydrophobicContact CZ-CD2 4.46Å; F404-Y419 HydrophobicContact CZ-CG 4.47Å; K415-Y419 VanDerWaalsContact O-CB 3.31Å; K415-Y419 WeakPolarHBondContact O-CB 3.36Å; K415-Y419 PolarHBondContact O-N 2.99Å; A416-Y419 PolarHBondContact O-N 2.88Å; W417-Y419 PolarHBondContact O-N 2.75Å; Y419-Y421 VanDerWaalsContact C-N 3.3Å; Y419-Y421 PolarHBondContact O-N 3.18Å; Y419-L422 WeakPolarHBondContact O-CB 3.24Å; Y419-L422 PolarHBondContact O-N 3Å; Y419-M423 HydrophobicContact CD1-CG 4.26Å; Y419-M423 HydrophobicContact CD2-CG 4.32Å; Y419-M423 HydrophobicContact CE1-CG 3.78Å; Y419-M423 HydrophobicContact CE2-CE 3.97Å; Y419-M423 HydrophobicContact CE2-CG 3.83Å; Y419-M423 HydrophobicContact CE2-SD 4.03Å; Y419-M423 VanDerWaalsContact O-CG 3.3Å; Y419-M423 WeakPolarHBondContact O-CG 3.21Å; Y419-M423 PolarHBondContact O-N 3.44Å; Y419-M423 PolarHBondContact OH-SD 3.41Å; Y419-V485 HydrophobicContact CD2-CG1 4.3Å; Y419-Y488 HydrophobicContact CE2-CD1 4.11Å; Y419-Y488 AromaticContact CE2-CE1 3.91Å; Y419-Y488 HydrophobicContact CE2-CE1 3.91Å; Y419-F489 HydrophobicContact CD2-CE2 4.44Å
420	L	72.8	Confident	67.3	Low	1 Å²	1	43.8 Å²	43.8	1%	0.005	20%	0.202	C	C	.	.	H	α-helix	trans	-65.1	-35.8	177.8	-73.7	170.2	0	0	0	112.1	V203 V208 L209 I212 F394 A396 I401 A416 W417 F418 L422 M423 S424	V203-L420 HydrophobicContact CG1-CD2 4.27Å; V203-L420 HydrophobicContact CG2-CD2 4.29Å; V208-L420 HydrophobicContact CG1-CD1 3.95Å; L209-L420 HydrophobicContact CD2-CB 3.86Å; I212-L420 HydrophobicContact CD1-CD1 3.17Å; F394-L420 HydrophobicContact CE2-CD2 3.75Å; F394-L420 HydrophobicContact CZ-CB 4.26Å; F394-L420 HydrophobicContact CZ-CD2 3.87Å; F394-L420 WeakPolarHBondContact CZ-O 3.31Å; A396-L420 HydrophobicContact CB-CD2 3.62Å; I401-L420 HydrophobicContact CD1-CD1 4.06Å; I401-L420 HydrophobicContact CD1-CD2 3.78Å; I401-L420 HydrophobicContact CD1-CG 4.05Å; A416-L420 WeakPolarHBondContact O-CB 2.97Å; A416-L420 WeakPolarHBondContact O-CG 3.43Å; A416-L420 PolarHBondContact O-N 3.21Å; W417-L420 PolarHBondContact O-N 3.28Å; F418-L420 PolarHBondContact O-N 3.18Å; L420-L422 VanDerWaalsContact C-N 3.34Å; L420-M423 PolarHBondContact O-N 3.34Å; L420-S424 PolarHBondContact O-N 3.16Å
421	Y	74.1	Confident	66.1	Low	8 Å²	8	43 Å²	43	3%	0.031	20%	0.204	C	C	.	.	H	α-helix	trans	-62.5	-44.9	175.6	172.9	-104.8	0	0	0	110.1	L209 W417 F418 Y419 S424 L425 K454 I456	L209-Y421 HydrophobicContact CD1-CD2 3.93Å; W417-Y421 HydrophobicContact CH2-CD2 4.4Å; W417-Y421 HydrophobicContact CH2-CG 4.19Å; W417-Y421 HydrophobicContact CZ3-CG 4.43Å; W417-Y421 WeakPolarHBondContact O-CB 3.25Å; W417-Y421 PolarHBondContact O-N 2.89Å; F418-Y421 HydrophobicContact CD2-CD1 4.45Å; F418-Y421 HydrophobicContact CE2-CD1 4.46Å; F418-Y421 WeakPolarHBondContact O-CB 3.18Å; F418-Y421 PolarHBondContact O-N 2.98Å; Y419-Y421 VanDerWaalsContact C-N 3.3Å; Y419-Y421 PolarHBondContact O-N 3.18Å; Y421-S424 PolarHBondContact O-N 2.84Å; Y421-S424 PolarHBondContact O-OG 2.97Å; Y421-L425 HydrophobicContact CD1-CD1 4.44Å; Y421-L425 HydrophobicContact CE1-CD1 3.86Å; Y421-L425 HydrophobicContact CE2-CD2 4.49Å; Y421-L425 WeakPolarHBondContact O-CG 3.21Å; Y421-L425 PolarHBondContact O-N 3.1Å; Y421-K454 WeakPolarHBondContact OH-CD 3.29Å; Y421-K454 WeakPolarHBondContact OH-CE 3.48Å; Y421-I456 HydrophobicContact CE1-CD1 4.06Å; Y421-I456 HydrophobicContact CE1-CG2 4.38Å; Y421-I456 HydrophobicContact CE2-CD1 4Å
422	L	72.4	Confident	64.5	Low	2 Å²	2	45 Å²	45	1%	0.01	22%	0.218	C	C	.	.	H	α-helix	trans	-61.4	-50.2	174.7	-62.8	178.7	0	0	0	111.6	F418 Y419 L420 S424 L425 Y426 V485 F489 F496 V510	F418-L422 HydrophobicContact CD1-CD1 4.09Å; F418-L422 HydrophobicContact CD1-CG 4.43Å; F418-L422 HydrophobicContact CE1-CD1 3.77Å; F418-L422 HydrophobicContact CE1-CD2 4.35Å; F418-L422 HydrophobicContact CE1-CG 4.2Å; F418-L422 HydrophobicContact CE2-CD2 4.33Å; F418-L422 HydrophobicContact CZ-CD1 4.3Å; F418-L422 HydrophobicContact CZ-CD2 4.02Å; F418-L422 HydrophobicContact CZ-CG 4.32Å; F418-L422 VanDerWaalsContact O-CG 3.3Å; F418-L422 WeakPolarHBondContact O-CG 3.15Å; F418-L422 PolarHBondContact O-N 2.87Å; Y419-L422 WeakPolarHBondContact O-CB 3.24Å; Y419-L422 PolarHBondContact O-N 3Å; L420-L422 VanDerWaalsContact C-N 3.34Å; L422-S424 PolarHBondContact O-N 2.71Å; L422-L425 WeakPolarHBondContact O-CA 2.87Å; L422-L425 WeakPolarHBondContact O-CB 3.33Å; L422-L425 PolarHBondContact O-N 2.88Å; L422-Y426 HydrophobicContact CB-CE2 4.48Å; L422-Y426 VanDerWaalsContact O-CD2 3.23Å; L422-Y426 WeakPolarHBondContact O-CD2 3.39Å; L422-Y426 PolarHBondContact O-N 3.28Å; L422-Y426 VanDerWaalsContact O-N 3.08Å; L422-V485 HydrophobicContact CD1-CG1 3.56Å; L422-F489 HydrophobicContact CD1-CE2 3.75Å; L422-F489 HydrophobicContact CD1-CZ 4.35Å; L422-F496 HydrophobicContact CD1-CD2 3.76Å; L422-F496 HydrophobicContact CD1-CE1 4.23Å; L422-F496 HydrophobicContact CD1-CE2 3.17Å; L422-F496 HydrophobicContact CD1-CG 4.49Å; L422-F496 HydrophobicContact CD1-CZ 3.45Å; L422-F496 VanDerWaalsContact CD1-CZ 3.45Å; L422-F496 HydrophobicContact CD2-CE2 3.49Å; L422-F496 VanDerWaalsContact CD2-CE2 3.49Å; L422-F496 HydrophobicContact CD2-CZ 3.91Å; L422-F496 HydrophobicContact CG-CE2 3.92Å; L422-F496 HydrophobicContact CG-CZ 4.28Å; L422-V510 HydrophobicContact CD2-CG1 3.57Å
423	M	68.8	Low	62.8	Low	22 Å²	22	49.1 Å²	49.1	11%	0.108	24%	0.244	C	C	.	.	H	α-helix	trans	-57.6	-32.6	179.4	-69.4	-67.5	100.6	0	0	112.3	F394 A396 Y419 L420 L425 Y426 F489	F394-M423 HydrophobicContact CD2-CB 3.32Å; F394-M423 HydrophobicContact CD2-CG 4.45Å; F394-M423 HydrophobicContact CE2-CB 3.24Å; F394-M423 HydrophobicContact CE2-CG 4.29Å; F394-M423 HydrophobicContact CG-CB 4.38Å; F394-M423 HydrophobicContact CZ-CB 4.29Å; A396-M423 HydrophobicContact CB-CG 4.44Å; Y419-M423 HydrophobicContact CD1-CG 4.26Å; Y419-M423 HydrophobicContact CD2-CG 4.32Å; Y419-M423 HydrophobicContact CE1-CG 3.78Å; Y419-M423 HydrophobicContact CE2-CE 3.97Å; Y419-M423 HydrophobicContact CE2-CG 3.83Å; Y419-M423 HydrophobicContact CE2-SD 4.03Å; Y419-M423 VanDerWaalsContact O-CG 3.3Å; Y419-M423 WeakPolarHBondContact O-CG 3.21Å; Y419-M423 PolarHBondContact O-N 3.44Å; Y419-M423 PolarHBondContact OH-SD 3.41Å; L420-M423 PolarHBondContact O-N 3.34Å; M423-L425 VanDerWaalsContact C-N 3.32Å; M423-L425 PolarHBondContact O-N 3.05Å; M423-Y426 HydrophobicContact CE-CD2 3.61Å; M423-Y426 HydrophobicContact CE-CE2 3.76Å; M423-Y426 HydrophobicContact CE-CG 4.41Å; M423-Y426 PolarHBondContact O-N 3.18Å; M423-F489 HydrophobicContact CE-CE1 3.57Å; M423-F489 HydrophobicContact CE-CE2 4.27Å; M423-F489 HydrophobicContact CE-CZ 3.17Å
424	S	63.7	Low	61.4	Low	18 Å²	18	52.3 Å²	52.3	13%	0.126	26%	0.258	C	S	.	.	H	α-helix	trans	-68.6	-28.5	172.4	67.5	0	0	0	0	114.4	P205 L420 Y421 L422	P205-S424 VanDerWaalsContact CB-CB 3.45Å; L420-S424 PolarHBondContact O-N 3.16Å; Y421-S424 PolarHBondContact O-N 2.84Å; Y421-S424 PolarHBondContact O-OG 2.97Å; L422-S424 PolarHBondContact O-N 2.71Å
425	L	61	Low	59.8	Low	23 Å²	23	62.4 Å²	62.4	12%	0.12	30%	0.296	C	S	.	.	H	α-helix	trans	-73.4	-37.3	173.9	-57.3	179.6	0	0	0	110.9	Y421 L422 M423 F427 D428 Y452 K454	Y421-L425 HydrophobicContact CD1-CD1 4.44Å; Y421-L425 HydrophobicContact CE1-CD1 3.86Å; Y421-L425 HydrophobicContact CE2-CD2 4.49Å; Y421-L425 WeakPolarHBondContact O-CG 3.21Å; Y421-L425 PolarHBondContact O-N 3.1Å; L422-L425 WeakPolarHBondContact O-CA 2.87Å; L422-L425 WeakPolarHBondContact O-CB 3.33Å; L422-L425 PolarHBondContact O-N 2.88Å; M423-L425 VanDerWaalsContact C-N 3.32Å; M423-L425 PolarHBondContact O-N 3.05Å; L425-F427 PolarHBondContact O-N 3.04Å; L425-F427 VanDerWaalsContact O-N 3.13Å; L425-D428 PolarHBondContact O-N 3.14Å; L425-Y452 WeakPolarHBondContact O-CD1 3.48Å; L425-Y452 WeakPolarHBondContact O-CE1 3.29Å; L425-K454 HydrophobicContact CD1-CB 3.94Å; L425-K454 HydrophobicContact CD1-CD 3.79Å; L425-K454 HydrophobicContact CD1-CG 4.43Å; L425-K454 HydrophobicContact CD2-CD 3.35Å; L425-K454 HydrophobicContact CG-CD 4.21Å
426	Y	59	Low	58.2	Low	51 Å²	51	65 Å²	65	20%	0.2	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-18.1	178.7	-85.7	-82.7	0	0	0	114.6	L422 M423 D428 Y452 F489 A512	L422-Y426 HydrophobicContact CB-CE2 4.48Å; L422-Y426 VanDerWaalsContact O-CD2 3.23Å; L422-Y426 WeakPolarHBondContact O-CD2 3.39Å; L422-Y426 PolarHBondContact O-N 3.28Å; L422-Y426 VanDerWaalsContact O-N 3.08Å; M423-Y426 HydrophobicContact CE-CD2 3.61Å; M423-Y426 HydrophobicContact CE-CE2 3.76Å; M423-Y426 HydrophobicContact CE-CG 4.41Å; M423-Y426 PolarHBondContact O-N 3.18Å; Y426-D428 VanDerWaalsContact C-N 3.35Å; Y426-Y452 HydrophobicContact CD1-CD2 4.22Å; Y426-Y452 AromaticContact CD1-CE2 3.98Å; Y426-Y452 HydrophobicContact CD1-CE2 3.98Å; Y426-Y452 HydrophobicContact CG-CE2 4.48Å; Y426-Y452 PolarHBondContact O-OH 3.39Å; Y426-F489 HydrophobicContact CD2-CZ 4.48Å; Y426-F489 AromaticContact CE2-CE1 3.65Å; Y426-F489 HydrophobicContact CE2-CE1 3.65Å; Y426-F489 AromaticContact CE2-CZ 3.56Å; Y426-F489 HydrophobicContact CE2-CZ 3.56Å; Y426-F489 AromaticContact CZ-CE1 3.66Å; Y426-F489 WeakPolarHBondContact OH-CE1 3.17Å; Y426-A512 HydrophobicContact CE1-CB 4.36Å; Y426-A512 HydrophobicContact CE2-CB 3.89Å; Y426-A512 WeakPolarHBondContact OH-CB 3.32Å
427	F	50.9	Low	56.7	Low	111 Å²	111	72.9 Å²	72.9	49%	0.487	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-12.2	-176.8	-157.4	-97.8	0	0	0	113.5	F393 F394 L425	F393-F427 HydrophobicContact CB-CE1 4.44Å; F393-F427 HydrophobicContact CB-CZ 4.02Å; F393-F427 WeakPolarHBondContact O-CD1 3.38Å; F393-F427 VanDerWaalsContact O-CD2 3.26Å; F393-F427 WeakPolarHBondContact O-CD2 3.24Å; F393-F427 WeakPolarHBondContact O-CE1 3.29Å; F393-F427 VanDerWaalsContact O-CE2 3.3Å; F393-F427 WeakPolarHBondContact O-CE2 3.46Å; F393-F427 WeakPolarHBondContact O-CG 3.39Å; F393-F427 WeakPolarHBondContact O-CZ 3.46Å; F394-F427 VanDerWaalsContact CA-CD2 3.47Å; F394-F427 HydrophobicContact CB-CB 3.7Å; F394-F427 HydrophobicContact CB-CD2 3.74Å; F394-F427 HydrophobicContact CB-CG 3.87Å; L425-F427 PolarHBondContact O-N 3.04Å; L425-F427 VanDerWaalsContact O-N 3.13Å
428	D	47.4	Very low	55.5	Low	147 Å²	147	73.7 Å²	73.7	79%	0.786	36%	0.358	S	S	*	.	S	Bend	trans	-90.5	-1.8	-170.6	-125.8	-3.9	0	0	0	114.5	L425 Y426	L425-D428 PolarHBondContact O-N 3.14Å; Y426-D428 VanDerWaalsContact C-N 3.35Å
429	E	43.2	Very low	53.9	Low	72 Å²	72	84.9 Å²	84.9	34%	0.336	40%	0.4	S	S	.	.			trans	-143	60.8	-177.6	-48.7	162.7	174.4	0	0	113.1	K431 T450 Y452	E429-K431 VanDerWaalsContact C-N 3.3Å; E429-K431 PolarHBondContact O-N 3.47Å; E429-T450 HydrophobicContact CB-CG2 3.37Å; E429-T450 HydrophobicContact CG-CG2 4.27Å; E429-T450 WeakPolarHBondContact O-CB 3.33Å; E429-T450 WeakPolarHBondContact O-CG2 3.31Å; E429-T450 PolarHBondContact O-OG1 3.18Å; E429-T450 VanDerWaalsContact OE2-CB 3.23Å; E429-T450 WeakPolarHBondContact OE2-CB 3.24Å; E429-T450 WeakPolarHBondContact OE2-CG2 3.43Å; E429-Y452 WeakPolarHBondContact CA-OH 3.25Å; E429-Y452 HydrophobicContact CB-CE1 3.59Å; E429-Y452 HydrophobicContact CB-CE2 4.42Å; E429-Y452 VanDerWaalsContact CB-CZ 3.43Å; E429-Y452 WeakPolarHBondContact CB-OH 3.24Å; E429-Y452 VanDerWaalsContact CD-CD1 3.42Å; E429-Y452 HydrophobicContact CG-CD1 4.03Å; E429-Y452 HydrophobicContact CG-CE1 3.22Å; E429-Y452 PolarHBondContact N-OH 3.26Å; E429-Y452 PolarHBondContact O-OH 2.91Å; E429-Y452 WeakPolarHBondContact OE2-CD1 3.4Å; E429-Y452 VanDerWaalsContact OE2-CE1 3.26Å; E429-Y452 WeakPolarHBondContact OE2-CE1 3.47Å
430	E	41.7	Very low	52.5	Low	182 Å²	182	93.5 Å²	93.5	85%	0.85	44%	0.44	S	S	*	.			trans	-84.2	73.1	157.9	-79.3	-169.3	161.8	0	0	110.1
431	K	40.7	Very low	51.4	Low	191 Å²	191	96.2 Å²	96.2	83%	0.83	47%	0.469	S	S	*	.			trans	-149	74.1	173.8	-68.2	-169.6	-178.3	178.1	0	112.8	E429	E429-K431 VanDerWaalsContact C-N 3.3Å; E429-K431 PolarHBondContact O-N 3.47Å
432	S	38.8	Very low	50.2	Low	55 Å²	55	99 Å²	99	39%	0.385	48%	0.484	S	S	.	.			trans	-177.9	112.6	142.1	52.9	0	0	0	0	111.6
433	T	40.9	Very low	49.2	Very low	92 Å²	92	102 Å²	102	56%	0.564	50%	0.502	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.7	129.7	160.3	31	0	0	0	0	107.4	V447	T433-V447 HydrophobicContact CG2-CG2 4.27Å
434	Q	42.4	Very low	48.2	Very low	105 Å²	105	103.7 Å²	103.7	49%	0.491	51%	0.51	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	126.9	170.2	-81.5	-175.7	-14.7	0	0	108.6	T446 M448	Q434-T446 PolarHBondContact N-O 3.36Å; Q434-T446 PolarHBondContact O-N 3.48Å; Q434-M448 HydrophobicContact CG-CE 4.21Å
435	R	43.6	Very low	47.3	Very low	214 Å²	214	106.3 Å²	106.3	81%	0.808	52%	0.519	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.6	124.2	168	-74.9	-179.4	166.6	174.8	-5.2	107.6
436	V	48	Very low	46.5	Very low	64 Å²	64	106.6 Å²	106.6	39%	0.388	52%	0.522	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	125.1	175.3	-172.5	0	0	0	0	107.4	G438 Q444 T446	V436-G438 PolarHBondContact O-N 3.45Å; V436-Q444 PolarHBondContact N-O 2.65Å; V436-Q444 PolarHBondContact O-N 3.05Å; V436-T446 WeakPolarHBondContact CG2-OG1 3.19Å
437	Q	45.1	Very low	45.7	Very low	166 Å²	166	106.8 Å²	106.8	78%	0.776	53%	0.528	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.4	116.3	169.8	-96.7	177.8	-27.1	0	0	108.8
438	G	51.8	Low	45.2	Very low	19 Å²	19	105.2 Å²	105.2	20%	0.196	52%	0.523	C	S	.	.	P	Polyproline II helix	trans	-74.4	166.6	173.6	0	0	0	0	0	112.2	V436 H440 G441 I442	V436-G438 PolarHBondContact O-N 3.45Å; G438-H440 PolarHBondContact O-N 2.98Å; G438-G441 PolarHBondContact O-N 3.44Å; G438-I442 PolarHBondContact N-O 2.89Å
439	R	46	Very low	45	Very low	236 Å²	236	100 Å²	100	89%	0.891	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	134.9	163.7	-81.3	-178.4	171.3	-179.5	-3.1	108.2
440	H	51.2	Low	45.3	Very low	184 Å²	184	98.5 Å²	98.5	85%	0.852	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	87	13.5	-173.5	-51.4	-66.2	0	0	0	117.6	G438 I442	G438-H440 PolarHBondContact O-N 2.98Å; H440-I442 PolarHBondContact O-N 3.45Å
441	G	49.5	Very low	45.7	Very low	59 Å²	59	96 Å²	96	61%	0.608	48%	0.478	S	S	*	.	S	Bend	trans	74.8	3.7	174.2	0	0	0	0	0	114.3	G438 T443	G438-G441 PolarHBondContact O-N 3.44Å; G441-T443 PolarHBondContact O-N 3.45Å
442	I	47.5	Very low	46.7	Very low	67 Å²	67	87.8 Å²	87.8	34%	0.344	44%	0.442	S	S	.	.			trans	-71.6	119.5	171.2	-58.7	172.2	0	0	0	108.1	G438 H440 Q444 D520	G438-I442 PolarHBondContact N-O 2.89Å; H440-I442 PolarHBondContact O-N 3.45Å; I442-Q444 HydrophobicContact CG2-CG 4.2Å; I442-Q444 PolarHBondContact O-N 3.21Å; I442-D520 WeakPolarHBondContact CG2-OD1 3.23Å
443	T	53.1	Low	48	Very low	65 Å²	65	88.8 Å²	88.8	40%	0.399	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	112.1	175.5	-47.6	0	0	0	0	107.3	G441 V521	G441-T443 PolarHBondContact O-N 3.45Å; T443-V521 WeakPolarHBondContact O-CG2 3.27Å
444	Q	46.1	Very low	49.7	Very low	57 Å²	57	89.1 Å²	89.1	27%	0.266	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	132	177.6	-69.5	-177.6	-20.9	0	0	109.5	V436 I442 T446 L518	V436-Q444 PolarHBondContact N-O 2.65Å; V436-Q444 PolarHBondContact O-N 3.05Å; I442-Q444 HydrophobicContact CG2-CG 4.2Å; I442-Q444 PolarHBondContact O-N 3.21Å; Q444-T446 PolarHBondContact O-N 3.38Å; Q444-L518 HydrophobicContact CB-CD2 4.38Å
445	K	45.5	Very low	51.3	Low	73 Å²	73	86.5 Å²	86.5	32%	0.317	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	101.9	172.7	-158.9	177.1	-177.9	-177	0	108.1	V447 V521	K445-V447 PolarHBondContact O-N 3.4Å; K445-V521 HydrophobicContact CB-CG2 4.11Å
446	T	44.3	Very low	53.1	Low	29 Å²	29	76.6 Å²	76.6	18%	0.178	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	103	172.8	-49.5	0	0	0	0	107.6	Q434 V436 Q444 M448	Q434-T446 PolarHBondContact N-O 3.36Å; Q434-T446 PolarHBondContact O-N 3.48Å; V436-T446 WeakPolarHBondContact CG2-OG1 3.19Å; Q444-T446 PolarHBondContact O-N 3.38Å; T446-M448 VanDerWaalsContact C-N 3.33Å; T446-M448 HydrophobicContact CG2-CG 4.29Å; T446-M448 PolarHBondContact O-N 3.49Å
447	V	41.8	Very low	54.9	Low	54 Å²	54	75.4 Å²	75.4	33%	0.327	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	97.1	165.6	-176.7	0	0	0	0	106.3	T433 K445	T433-V447 HydrophobicContact CG2-CG2 4.27Å; K445-V447 PolarHBondContact O-N 3.4Å
448	M	40.9	Very low	56.8	Low	79 Å²	79	67.5 Å²	67.5	39%	0.389	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-67.1	140.7	173.4	-76.7	-148.3	-59.4	0	0	109.4	Q434 T446	Q434-M448 HydrophobicContact CG-CE 4.21Å; T446-M448 VanDerWaalsContact C-N 3.33Å; T446-M448 HydrophobicContact CG2-CG 4.29Å; T446-M448 PolarHBondContact O-N 3.49Å
449	V	43.7	Very low	57.9	Low	37 Å²	37	69.3 Å²	69.3	22%	0.224	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-93.2	120.4	-166	172.9	0	0	0	0	107.6	K451 F513 K514 P516	V449-K451 PolarHBondContact O-N 3.15Å; V449-F513 VanDerWaalsContact CG1-CA 3.49Å; V449-F513 HydrophobicContact CG1-CB 3.84Å; V449-K514 HydrophobicContact CB-CB 4.41Å; V449-K514 WeakPolarHBondContact CB-O 3.36Å; V449-K514 HydrophobicContact CG1-CB 3.7Å; V449-K514 WeakPolarHBondContact CG1-O 3.43Å; V449-K514 HydrophobicContact CG2-CB 4.04Å; V449-K514 WeakPolarHBondContact CG2-O 3.33Å; V449-P516 HydrophobicContact CG2-CB 4.48Å
450	T	47.6	Very low	59.3	Low	40 Å²	40	61 Å²	61	25%	0.245	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-63.2	123.9	175.5	11.6	0	0	0	0	111.5	E429 Y452	E429-T450 HydrophobicContact CB-CG2 3.37Å; E429-T450 HydrophobicContact CG-CG2 4.27Å; E429-T450 WeakPolarHBondContact O-CB 3.33Å; E429-T450 WeakPolarHBondContact O-CG2 3.31Å; E429-T450 PolarHBondContact O-OG1 3.18Å; E429-T450 VanDerWaalsContact OE2-CB 3.23Å; E429-T450 WeakPolarHBondContact OE2-CB 3.24Å; E429-T450 WeakPolarHBondContact OE2-CG2 3.43Å; T450-Y452 PolarHBondContact O-N 2.9Å
451	K	52.1	Low	60.4	Low	130 Å²	130	52.3 Å²	52.3	57%	0.565	30%	0.3	S	S	*	.			trans	-91.6	90.8	-177	179.1	-171.7	177.1	-174.9	0	106.9	V449 S453 F513	V449-K451 PolarHBondContact O-N 3.15Å; K451-S453 PolarHBondContact O-N 3.08Å; K451-F513 HydrophobicContact CB-CE1 4.29Å; K451-F513 HydrophobicContact CD-CE1 4.26Å; K451-F513 HydrophobicContact CG-CD1 4.45Å; K451-F513 HydrophobicContact CG-CE1 3.75Å; K451-F513 HydrophobicContact CG-CZ 4.34Å
452	Y	60.3	Low	61.4	Low	18 Å²	18	53.2 Å²	53.2	7%	0.071	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	124.4	168.6	-59.3	-86.1	0	0	0	108.8	L425 Y426 E429 T450 K511 A512	L425-Y452 WeakPolarHBondContact O-CD1 3.48Å; L425-Y452 WeakPolarHBondContact O-CE1 3.29Å; Y426-Y452 HydrophobicContact CD1-CD2 4.22Å; Y426-Y452 AromaticContact CD1-CE2 3.98Å; Y426-Y452 HydrophobicContact CD1-CE2 3.98Å; Y426-Y452 HydrophobicContact CG-CE2 4.48Å; Y426-Y452 PolarHBondContact O-OH 3.39Å; E429-Y452 WeakPolarHBondContact CA-OH 3.25Å; E429-Y452 HydrophobicContact CB-CE1 3.59Å; E429-Y452 HydrophobicContact CB-CE2 4.42Å; E429-Y452 VanDerWaalsContact CB-CZ 3.43Å; E429-Y452 WeakPolarHBondContact CB-OH 3.24Å; E429-Y452 VanDerWaalsContact CD-CD1 3.42Å; E429-Y452 HydrophobicContact CG-CD1 4.03Å; E429-Y452 HydrophobicContact CG-CE1 3.22Å; E429-Y452 PolarHBondContact N-OH 3.26Å; E429-Y452 PolarHBondContact O-OH 2.91Å; E429-Y452 WeakPolarHBondContact OE2-CD1 3.4Å; E429-Y452 VanDerWaalsContact OE2-CE1 3.26Å; E429-Y452 WeakPolarHBondContact OE2-CE1 3.47Å; T450-Y452 PolarHBondContact O-N 2.9Å; Y452-K511 VanDerWaalsContact O-CA 3.3Å; Y452-K511 WeakPolarHBondContact O-CA 3.47Å; Y452-A512 PolarHBondContact O-N 2.85Å
453	S	66.4	Low	62.3	Low	77 Å²	77	57.4 Å²	57.4	54%	0.538	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	105.7	169.6	-175.5	0	0	0	0	107.7	K451 V510	K451-S453 PolarHBondContact O-N 3.08Å; S453-V510 WeakPolarHBondContact CA-O 3.48Å
454	K	75.7	Confident	62.7	Low	98 Å²	98	58.8 Å²	58.8	43%	0.426	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	138.2	178	-165.3	165.5	-177.6	171.4	0	110.9	Y421 L425 V510	Y421-K454 WeakPolarHBondContact OH-CD 3.29Å; Y421-K454 WeakPolarHBondContact OH-CE 3.48Å; L425-K454 HydrophobicContact CD1-CB 3.94Å; L425-K454 HydrophobicContact CD1-CD 3.79Å; L425-K454 HydrophobicContact CD1-CG 4.43Å; L425-K454 HydrophobicContact CD2-CD 3.35Å; L425-K454 HydrophobicContact CG-CD 4.21Å; K454-V510 PolarHBondContact N-O 2.76Å; K454-V510 PolarHBondContact O-N 3.38Å
455	S	77.7	Confident	63.4	Low	50 Å²	50	56.1 Å²	56.1	35%	0.35	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	136.5	171	172.6	0	0	0	0	109	R507 L508 N509	S455-R507 WeakPolarHBondContact OG-CD 3.05Å; S455-R507 WeakPolarHBondContact OG-CG 3.18Å; S455-L508 WeakPolarHBondContact CA-O 3.36Å; S455-N509 WeakPolarHBondContact CB-OD1 3.44Å
456	I	80.8	Confident	64.1	Low	6 Å²	6	54 Å²	54	3%	0.031	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	134.1	173	-173.8	167.7	0	0	0	110.3	W417 Y421 D460 I461 L508	W417-I456 HydrophobicContact CH2-CD1 4.11Å; Y421-I456 HydrophobicContact CE1-CD1 4.06Å; Y421-I456 HydrophobicContact CE1-CG2 4.38Å; Y421-I456 HydrophobicContact CE2-CD1 4Å; I456-D460 HydrophobicContact CG1-CB 4.35Å; I456-I461 HydrophobicContact CD1-CD1 4.11Å; I456-I461 HydrophobicContact CD1-CG1 3.51Å; I456-I461 HydrophobicContact CG1-CD1 4.16Å; I456-I461 HydrophobicContact CG1-CG1 3.73Å; I456-I461 HydrophobicContact CG2-CD1 3.91Å; I456-I461 HydrophobicContact CG2-CG1 4.44Å; I456-L508 HydrophobicContact CG2-CB 4.15Å; I456-L508 PolarHBondContact N-O 3.05Å; I456-L508 PolarHBondContact O-N 3.16Å
457	D	85.6	Confident	65	Low	40 Å²	40	53.6 Å²	53.6	21%	0.214	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	141.1	178.2	-75.6	-36.9	0	0	0	110.8	A459 D460 I461 R507	D457-A459 PolarHBondContact O-N 3.25Å; D457-D460 WeakPolarHBondContact O-CB 3.48Å; D457-D460 PolarHBondContact O-N 3.25Å; D457-D460 VanDerWaalsContact O-N 3.08Å; D457-I461 PolarHBondContact O-N 3.36Å; D457-R507 WeakPolarHBondContact OD1-CB 3.4Å; D457-R507 WeakPolarHBondContact OD1-CG 3.34Å; D457-R507 IonicContact OD1-CZ 2.84Å; D457-R507 IonicContact OD1-NE 3.01Å; D457-R507 PolarHBondContact OD1-NE 3.47Å; D457-R507 IonicContact OD1-NH2 2.68Å; D457-R507 PolarHBondContact OD1-NH2 3.35Å; D457-R507 IonicContact OD2-CZ 2.71Å; D457-R507 IonicContact OD2-NE 3.22Å; D457-R507 IonicContact OD2-NH2 3.53Å; D457-R507 PolarHBondContact OD2-NH2 2.94Å
458	L	84	Confident	65.9	Low	0 Å²	0	57.5 Å²	57.5	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-62.5	-24.5	178.3	-89.9	171.7	0	0	0	112.9	I461 K462 L471 L474 K475 L478 W500 Y506	L458-I461 HydrophobicContact CD2-CD1 4.38Å; L458-K462 VanDerWaalsContact O-CB 3.22Å; L458-K462 WeakPolarHBondContact O-CB 3.23Å; L458-K462 PolarHBondContact O-N 3.48Å; L458-L471 HydrophobicContact CB-CD2 4.23Å; L458-L474 HydrophobicContact CD2-CB 4.35Å; L458-L474 HydrophobicContact CD2-CD2 3.85Å; L458-L474 HydrophobicContact CD2-CG 3.72Å; L458-K475 HydrophobicContact CD1-CB 3.62Å; L458-K475 HydrophobicContact CD1-CD 4.26Å; L458-K475 HydrophobicContact CD1-CG 3.98Å; L458-L478 HydrophobicContact CD2-CD2 3.86Å; L458-W500 HydrophobicContact CD1-CH2 3.65Å; L458-W500 HydrophobicContact CD1-CZ3 3.56Å; L458-W500 HydrophobicContact CD2-CH2 3.98Å; L458-W500 HydrophobicContact CD2-CZ3 4.43Å; L458-W500 HydrophobicContact CG-CH2 3.83Å; L458-W500 HydrophobicContact CG-CZ3 3.78Å; L458-Y506 VanDerWaalsContact CB-O 3.25Å; L458-Y506 WeakPolarHBondContact CB-O 3.42Å; L458-Y506 HydrophobicContact CD1-CD1 3.78Å; L458-Y506 VanDerWaalsContact CG-O 3.31Å; L458-Y506 WeakPolarHBondContact CG-O 3.22Å; L458-Y506 PolarHBondContact N-O 3.24Å
459	A	76.1	Confident	67.4	Low	56 Å²	56	55 Å²	55	46%	0.463	30%	0.297	S	S	.	.	H	α-helix	trans	-64	-48.6	172	0	0	0	0	0	110.2	D457 I461 K462 E463	D457-A459 PolarHBondContact O-N 3.25Å; A459-I461 VanDerWaalsContact C-N 3.32Å; A459-I461 PolarHBondContact O-N 3.09Å; A459-K462 WeakPolarHBondContact O-CA 3.24Å; A459-K462 WeakPolarHBondContact O-CB 3.31Å; A459-K462 PolarHBondContact O-N 3.43Å; A459-E463 PolarHBondContact O-N 3.09Å
460	D	75	Confident	69.1	Low	63 Å²	63	56.4 Å²	56.4	34%	0.337	31%	0.313	S	S	.	.	H	α-helix	trans	-61.2	-41.6	175.4	-51.9	-5	0	0	0	111.2	I456 D457 K462 E463 R464	I456-D460 HydrophobicContact CG1-CB 4.35Å; D457-D460 WeakPolarHBondContact O-CB 3.48Å; D457-D460 PolarHBondContact O-N 3.25Å; D457-D460 VanDerWaalsContact O-N 3.08Å; D460-K462 VanDerWaalsContact C-N 3.32Å; D460-E463 PolarHBondContact O-N 2.97Å; D460-R464 WeakPolarHBondContact O-CB 3.04Å; D460-R464 WeakPolarHBondContact O-CG 3.41Å; D460-R464 PolarHBondContact O-N 3.31Å
461	I	75	Confident	70.8	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-63.4	-43.4	174.6	-61.4	179.3	0	0	0	109.8	W417 I456 D457 L458 A459 E463 R464 T465 L474 L478	W417-I461 HydrophobicContact CH2-CB 4.37Å; W417-I461 HydrophobicContact CH2-CD1 4.49Å; W417-I461 HydrophobicContact CH2-CG1 3.92Å; W417-I461 HydrophobicContact CH2-CG2 4.01Å; W417-I461 HydrophobicContact CZ3-CD1 4.4Å; W417-I461 HydrophobicContact CZ3-CG1 4.27Å; W417-I461 HydrophobicContact CZ3-CG2 3.96Å; I456-I461 HydrophobicContact CD1-CD1 4.11Å; I456-I461 HydrophobicContact CD1-CG1 3.51Å; I456-I461 HydrophobicContact CG1-CD1 4.16Å; I456-I461 HydrophobicContact CG1-CG1 3.73Å; I456-I461 HydrophobicContact CG2-CD1 3.91Å; I456-I461 HydrophobicContact CG2-CG1 4.44Å; D457-I461 PolarHBondContact O-N 3.36Å; L458-I461 HydrophobicContact CD2-CD1 4.38Å; A459-I461 VanDerWaalsContact C-N 3.32Å; A459-I461 PolarHBondContact O-N 3.09Å; I461-E463 VanDerWaalsContact C-N 3.32Å; I461-E463 PolarHBondContact O-N 3.44Å; I461-R464 CarbonylContact O-C 3.53Å; I461-R464 PolarHBondContact O-N 3.43Å; I461-T465 HydrophobicContact CG2-CG2 3.85Å; I461-T465 WeakPolarHBondContact O-CA 3.26Å; I461-T465 WeakPolarHBondContact O-CB 3.34Å; I461-T465 VanDerWaalsContact O-CG2 3.24Å; I461-T465 WeakPolarHBondContact O-CG2 3.47Å; I461-T465 PolarHBondContact O-N 3.48Å; I461-T465 PolarHBondContact O-OG1 3.34Å; I461-L474 HydrophobicContact CG2-CD2 4.31Å; I461-L478 HydrophobicContact CD1-CD1 4.39Å; I461-L478 HydrophobicContact CD1-CD2 3.36Å
462	K	70.1	Confident	72.3	Confident	78 Å²	78	59.3 Å²	59.3	34%	0.339	32%	0.324	S	S	.	.	H	α-helix	trans	-59.4	-47	179.5	-175.2	-178.3	175.6	-176	0	110.3	L458 A459 D460 T465 G466 Y467 L471 L474	L458-K462 VanDerWaalsContact O-CB 3.22Å; L458-K462 WeakPolarHBondContact O-CB 3.23Å; L458-K462 PolarHBondContact O-N 3.48Å; A459-K462 WeakPolarHBondContact O-CA 3.24Å; A459-K462 WeakPolarHBondContact O-CB 3.31Å; A459-K462 PolarHBondContact O-N 3.43Å; D460-K462 VanDerWaalsContact C-N 3.32Å; K462-T465 CarbonylContact O-C 3.46Å; K462-T465 PolarHBondContact O-N 3.41Å; K462-G466 CarbonylContact O-C 3.49Å; K462-G466 VanDerWaalsContact O-C 3.24Å; K462-G466 VanDerWaalsContact O-CA 3.32Å; K462-G466 WeakPolarHBondContact O-CA 3.47Å; K462-G466 PolarHBondContact O-N 3.04Å; K462-Y467 WeakPolarHBondContact CE-O 3.22Å; K462-Y467 HydrophobicContact CG-CD1 4.39Å; K462-Y467 VanDerWaalsContact CG-O 3.23Å; K462-Y467 WeakPolarHBondContact CG-O 3.21Å; K462-Y467 PolarHBondContact O-N 3.17Å; K462-L471 HydrophobicContact CB-CD2 4.2Å; K462-L471 HydrophobicContact CD-CD2 3.77Å; K462-L471 HydrophobicContact CD-CG 4.46Å; K462-L474 HydrophobicContact CB-CD2 3.69Å; K462-L474 HydrophobicContact CG-CD2 4.31Å
463	E	65.7	Low	73.5	Confident	155 Å²	155	61 Å²	61	72%	0.724	33%	0.333	S	S	*	.	H	α-helix	trans	-62.1	-54.8	175.7	-175.3	175.4	-164.9	0	0	111.4	A459 D460 I461 T465 G466	A459-E463 PolarHBondContact O-N 3.09Å; D460-E463 PolarHBondContact O-N 2.97Å; I461-E463 VanDerWaalsContact C-N 3.32Å; I461-E463 PolarHBondContact O-N 3.44Å; E463-T465 PolarHBondContact O-N 3.22Å; E463-G466 PolarHBondContact O-N 3.44Å; E463-G466 VanDerWaalsContact O-N 3.08Å
464	R	62.9	Low	74.3	Confident	94 Å²	94	57.3 Å²	57.3	36%	0.355	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	3.5	176.7	-63.2	171.7	179.5	-112.7	0.9	114.6	S213 W417 D460 I461	S213-R464 WeakPolarHBondContact CB-O 3.46Å; W417-R464 HydrophobicContact CZ2-CB 4.03Å; W417-R464 PolarHBondContact NE1-O 2.68Å; D460-R464 WeakPolarHBondContact O-CB 3.04Å; D460-R464 WeakPolarHBondContact O-CG 3.41Å; D460-R464 PolarHBondContact O-N 3.31Å; I461-R464 CarbonylContact O-C 3.53Å; I461-R464 PolarHBondContact O-N 3.43Å
465	T	61.2	Low	74.8	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.006	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-128.4	8.4	172.3	63.3	0	0	0	0	111.7	S213 H217 L414 W417 I461 K462 E463 Y467	S213-T465 VanDerWaalsContact CB-CA 3.42Å; S213-T465 CarbonylContact O-C 3.55Å; H217-T465 PolarHBondContact NE2-O 3.4Å; L414-T465 HydrophobicContact CD1-CG2 4.25Å; W417-T465 HydrophobicContact CD2-CG2 3.63Å; W417-T465 HydrophobicContact CE3-CG2 4.11Å; W417-T465 HydrophobicContact CG-CG2 3.95Å; W417-T465 HydrophobicContact CH2-CG2 4.49Å; W417-T465 HydrophobicContact CZ2-CG2 4Å; I461-T465 HydrophobicContact CG2-CG2 3.85Å; I461-T465 WeakPolarHBondContact O-CA 3.26Å; I461-T465 WeakPolarHBondContact O-CB 3.34Å; I461-T465 VanDerWaalsContact O-CG2 3.24Å; I461-T465 WeakPolarHBondContact O-CG2 3.47Å; I461-T465 PolarHBondContact O-N 3.48Å; I461-T465 PolarHBondContact O-OG1 3.34Å; K462-T465 CarbonylContact O-C 3.46Å; K462-T465 PolarHBondContact O-N 3.41Å; E463-T465 PolarHBondContact O-N 3.22Å; T465-Y467 PolarHBondContact O-N 3.46Å; T465-Y467 WeakPolarHBondContact OG1-CB 3.3Å
466	G	59.5	Low	75.2	Confident	29 Å²	29	60.7 Å²	60.7	30%	0.299	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.2	5.1	-169.4	0	0	0	0	0	115.5	H217 K462 E463 I468	H217-G466 VanDerWaalsContact CD2-C 3.46Å; H217-G466 PolarHBondContact CD2-O 2.9Å; H217-G466 PolarHBondContact CE1-O 3.34Å; H217-G466 VanDerWaalsContact CE1-O 3.24Å; H217-G466 WeakPolarHBondContact NE2-CA 3.33Å; H217-G466 PolarHBondContact NE2-O 2.94Å; K462-G466 CarbonylContact O-C 3.49Å; K462-G466 VanDerWaalsContact O-C 3.24Å; K462-G466 VanDerWaalsContact O-CA 3.32Å; K462-G466 WeakPolarHBondContact O-CA 3.47Å; K462-G466 PolarHBondContact O-N 3.04Å; E463-G466 PolarHBondContact O-N 3.44Å; E463-G466 VanDerWaalsContact O-N 3.08Å; G466-I468 WeakPolarHBondContact O-CG1 3.12Å; G466-I468 PolarHBondContact O-N 3.06Å
467	Y	63.9	Low	75.4	Confident	20 Å²	20	61.9 Å²	61.9	8%	0.078	32%	0.317	C	S	.	.			trans	-52.4	105.8	-155.3	179.2	-94.4	0	0	0	114.2	H217 K462 T465 G469 E473 L474	H217-Y467 WeakPolarHBondContact CE1-CA 3.45Å; H217-Y467 WeakPolarHBondContact NE2-CA 3.45Å; H217-Y467 PolarHBondContact NE2-N 3.45Å; K462-Y467 WeakPolarHBondContact CE-O 3.22Å; K462-Y467 HydrophobicContact CG-CD1 4.39Å; K462-Y467 VanDerWaalsContact CG-O 3.23Å; K462-Y467 WeakPolarHBondContact CG-O 3.21Å; K462-Y467 PolarHBondContact O-N 3.17Å; T465-Y467 PolarHBondContact O-N 3.46Å; T465-Y467 WeakPolarHBondContact OG1-CB 3.3Å; Y467-G469 VanDerWaalsContact CE1-C 3.5Å; Y467-G469 PolarHBondContact O-N 3.25Å; Y467-G469 VanDerWaalsContact O-N 3.09Å; Y467-E473 WeakPolarHBondContact OH-CB 3.44Å; Y467-E473 WeakPolarHBondContact OH-CG 3.5Å; Y467-L474 HydrophobicContact CD1-CB 3.65Å; Y467-L474 HydrophobicContact CD1-CD1 3.92Å; Y467-L474 HydrophobicContact CD1-CD2 3.92Å; Y467-L474 HydrophobicContact CD1-CG 4.02Å; Y467-L474 HydrophobicContact CD2-CD1 3.84Å; Y467-L474 HydrophobicContact CE1-CB 3.51Å; Y467-L474 HydrophobicContact CE1-CD1 4.3Å; Y467-L474 HydrophobicContact CE1-CG 4.33Å; Y467-L474 HydrophobicContact CE2-CD1 4.21Å; Y467-L474 HydrophobicContact CG-CB 4.31Å; Y467-L474 HydrophobicContact CG-CD1 3.67Å; Y467-L474 HydrophobicContact CG-CD2 4.19Å; Y467-L474 HydrophobicContact CG-CG 4.25Å
468	I	60	Low	75.5	Confident	136 Å²	136	60 Å²	60	70%	0.697	31%	0.306	S	S	*	.			trans	-86.3	80.4	175.9	-54.3	174.4	0	0	0	109.2	H217 G466	H217-I468 HydrophobicContact CB-CD1 3.56Å; H217-I468 HydrophobicContact CB-CG1 4.19Å; H217-I468 PolarHBondContact CE1-N 2.93Å; H217-I468 VanDerWaalsContact CG-CD1 3.44Å; H217-I468 VanDerWaalsContact CG-CG1 3.49Å; H217-I468 WeakPolarHBondContact ND1-CB 3.43Å; H217-I468 VanDerWaalsContact ND1-CG1 3.28Å; H217-I468 WeakPolarHBondContact ND1-CG1 3.31Å; H217-I468 PolarHBondContact ND1-N 3.39Å; G466-I468 WeakPolarHBondContact O-CG1 3.12Å; G466-I468 PolarHBondContact O-N 3.06Å
469	G	71.5	Confident	75.5	Confident	27 Å²	27	62 Å²	62	28%	0.278	32%	0.323	S	S	.	.	S	Bend	trans	-165.2	178.2	172.2	0	0	0	0	0	112.2	Y467	Y467-G469 VanDerWaalsContact CE1-C 3.5Å; Y467-G469 PolarHBondContact O-N 3.25Å; Y467-G469 VanDerWaalsContact O-N 3.09Å
470	A	80.3	Confident	75.9	Confident	66 Å²	66	61.6 Å²	61.6	55%	0.545	32%	0.32	S	S	.	.			trans	-67.1	138.8	174.3	0	0	0	0	0	110.1	K472 E473 L474	A470-K472 PolarHBondContact O-N 2.81Å; A470-K472 VanDerWaalsContact O-N 3.12Å; A470-E473 WeakPolarHBondContact O-CB 3.45Å; A470-E473 PolarHBondContact O-N 3.03Å; A470-L474 PolarHBondContact O-N 3.38Å
471	L	83.2	Confident	76.4	Confident	58 Å²	58	58.6 Å²	58.6	30%	0.304	30%	0.304	S	S	.	.	H	α-helix	trans	-55.6	-32.3	177.6	-72.7	170.7	0	0	0	112.5	L458 K462 E473 L474 K475 Y506	L458-L471 HydrophobicContact CB-CD2 4.23Å; K462-L471 HydrophobicContact CB-CD2 4.2Å; K462-L471 HydrophobicContact CD-CD2 3.77Å; K462-L471 HydrophobicContact CD-CG 4.46Å; L471-E473 VanDerWaalsContact C-N 3.32Å; L471-E473 PolarHBondContact O-N 2.89Å; L471-L474 PolarHBondContact O-N 3.25Å; L471-K475 WeakPolarHBondContact O-CB 3.49Å; L471-K475 PolarHBondContact O-N 2.91Å; L471-Y506 HydrophobicContact CB-CD1 4.14Å; L471-Y506 HydrophobicContact CB-CE1 3.85Å
472	K	84.4	Confident	76.9	Confident	173 Å²	173	59.4 Å²	59.4	75%	0.752	31%	0.309	S	S	*	.	H	α-helix	trans	-61.4	-39.1	174.6	-172.7	179.1	180	-178.6	0	112.5	A470 K475 R476	A470-K472 PolarHBondContact O-N 2.81Å; A470-K472 VanDerWaalsContact O-N 3.12Å; K472-K475 WeakPolarHBondContact O-CB 3.14Å; K472-R476 PolarHBondContact O-N 3.47Å
473	E	84.5	Confident	77.6	Confident	54 Å²	54	57.6 Å²	57.6	25%	0.252	31%	0.312	S	S	.	.	H	α-helix	trans	-75.3	-39.9	177.7	-177.4	58.6	-154.5	0	0	111	Y467 A470 L471 K475 R476 Q477	Y467-E473 WeakPolarHBondContact OH-CB 3.44Å; Y467-E473 WeakPolarHBondContact OH-CG 3.5Å; A470-E473 WeakPolarHBondContact O-CB 3.45Å; A470-E473 PolarHBondContact O-N 3.03Å; L471-E473 VanDerWaalsContact C-N 3.32Å; L471-E473 PolarHBondContact O-N 2.89Å; E473-K475 VanDerWaalsContact C-N 3.28Å; E473-K475 PolarHBondContact O-N 2.98Å; E473-R476 WeakPolarHBondContact O-CB 3.5Å; E473-R476 PolarHBondContact O-N 3.49Å; E473-R476 VanDerWaalsContact O-N 3.15Å; E473-R476 IonicContact OE1-CZ 3.6Å; E473-R476 IonicContact OE1-NE 3.36Å; E473-R476 PolarHBondContact OE1-NE 2.88Å; E473-R476 IonicContact OE1-NH2 2.64Å; E473-R476 PolarHBondContact OE1-NH2 2.9Å; E473-R476 IonicContact OE2-CZ 2.78Å; E473-R476 IonicContact OE2-NE 3.06Å; E473-R476 PolarHBondContact OE2-NE 3.31Å; E473-R476 IonicContact OE2-NH2 3.02Å; E473-R476 PolarHBondContact OE2-NH2 2.9Å; E473-Q477 WeakPolarHBondContact O-CG 3.32Å; E473-Q477 PolarHBondContact O-N 3.33Å; E473-Q477 PolarHBondContact OE1-NE2 3.47Å
474	L	83	Confident	78.6	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-56.7	-45.8	171.8	-174.9	54	0	0	0	110.9	L414 L458 I461 K462 Y467 A470 L471 R476 Q477 L478	L414-L474 HydrophobicContact CD2-CD1 4.28Å; L458-L474 HydrophobicContact CD2-CB 4.35Å; L458-L474 HydrophobicContact CD2-CD2 3.85Å; L458-L474 HydrophobicContact CD2-CG 3.72Å; I461-L474 HydrophobicContact CG2-CD2 4.31Å; K462-L474 HydrophobicContact CB-CD2 3.69Å; K462-L474 HydrophobicContact CG-CD2 4.31Å; Y467-L474 HydrophobicContact CD1-CB 3.65Å; Y467-L474 HydrophobicContact CD1-CD1 3.92Å; Y467-L474 HydrophobicContact CD1-CD2 3.92Å; Y467-L474 HydrophobicContact CD1-CG 4.02Å; Y467-L474 HydrophobicContact CD2-CD1 3.84Å; Y467-L474 HydrophobicContact CE1-CB 3.51Å; Y467-L474 HydrophobicContact CE1-CD1 4.3Å; Y467-L474 HydrophobicContact CE1-CG 4.33Å; Y467-L474 HydrophobicContact CE2-CD1 4.21Å; Y467-L474 HydrophobicContact CG-CB 4.31Å; Y467-L474 HydrophobicContact CG-CD1 3.67Å; Y467-L474 HydrophobicContact CG-CD2 4.19Å; Y467-L474 HydrophobicContact CG-CG 4.25Å; A470-L474 PolarHBondContact O-N 3.38Å; L471-L474 PolarHBondContact O-N 3.25Å; L474-R476 VanDerWaalsContact C-N 3.32Å; L474-R476 PolarHBondContact O-N 3.21Å; L474-Q477 PolarHBondContact O-N 3.44Å; L474-L478 VanDerWaalsContact O-CB 3.26Å; L474-L478 WeakPolarHBondContact O-CB 3.38Å; L474-L478 PolarHBondContact O-N 3.13Å
475	K	87.2	Confident	79.5	Confident	54 Å²	54	47 Å²	47	24%	0.235	27%	0.27	C	S	.	.	H	α-helix	trans	-55.2	-46.3	175.8	-174.8	170.8	179.1	173.8	0	111.9	L458 L471 K472 E473 L478 A479 W500 K505	L458-K475 HydrophobicContact CD1-CB 3.62Å; L458-K475 HydrophobicContact CD1-CD 4.26Å; L458-K475 HydrophobicContact CD1-CG 3.98Å; L471-K475 WeakPolarHBondContact O-CB 3.49Å; L471-K475 PolarHBondContact O-N 2.91Å; K472-K475 WeakPolarHBondContact O-CB 3.14Å; E473-K475 VanDerWaalsContact C-N 3.28Å; E473-K475 PolarHBondContact O-N 2.98Å; K475-L478 PolarHBondContact O-N 2.89Å; K475-A479 WeakPolarHBondContact O-CB 3.36Å; K475-A479 PolarHBondContact O-N 3.03Å; K475-W500 HydrophobicContact CB-CH2 4.37Å; K475-W500 HydrophobicContact CD-CD2 4.46Å; K475-W500 HydrophobicContact CD-CE3 4.42Å; K475-W500 HydrophobicContact CD-CH2 4.39Å; K475-W500 HydrophobicContact CD-CZ2 4.42Å; K475-W500 HydrophobicContact CD-CZ3 4.4Å; K475-W500 VanDerWaalsContact CE-CD2 3.49Å; K475-W500 HydrophobicContact CG-CD2 4.45Å; K475-W500 HydrophobicContact CG-CH2 3.68Å; K475-W500 HydrophobicContact CG-CZ2 3.58Å; K475-W500 HydrophobicContact CG-CZ3 4.17Å; K475-K505 WeakPolarHBondContact CE-O 3.49Å; K475-K505 PolarHBondContact NZ-O 3.42Å
476	R	86.2	Confident	80.5	Confident	164 Å²	164	48.1 Å²	48.1	62%	0.619	28%	0.277	S	S	*	.	H	α-helix	trans	-63.1	-46.8	178.8	-175.9	176.5	71.7	164.3	2.9	111.8	K472 E473 L474 L478 A479 A480	K472-R476 PolarHBondContact O-N 3.47Å; E473-R476 WeakPolarHBondContact O-CB 3.5Å; E473-R476 PolarHBondContact O-N 3.49Å; E473-R476 VanDerWaalsContact O-N 3.15Å; E473-R476 IonicContact OE1-CZ 3.6Å; E473-R476 IonicContact OE1-NE 3.36Å; E473-R476 PolarHBondContact OE1-NE 2.88Å; E473-R476 IonicContact OE1-NH2 2.64Å; E473-R476 PolarHBondContact OE1-NH2 2.9Å; E473-R476 IonicContact OE2-CZ 2.78Å; E473-R476 IonicContact OE2-NE 3.06Å; E473-R476 PolarHBondContact OE2-NE 3.31Å; E473-R476 IonicContact OE2-NH2 3.02Å; E473-R476 PolarHBondContact OE2-NH2 2.9Å; L474-R476 VanDerWaalsContact C-N 3.32Å; L474-R476 PolarHBondContact O-N 3.21Å; R476-L478 VanDerWaalsContact C-N 3.33Å; R476-A479 PolarHBondContact O-N 3.21Å; R476-A480 PolarHBondContact O-N 3Å
477	Q	85.3	Confident	81.6	Confident	32 Å²	32	48.4 Å²	48.4	15%	0.15	28%	0.277	C	S	.	.	H	α-helix	trans	-66.3	-38.7	178.6	-66.6	178.6	7.9	0	0	111.3	V411 L414 E473 L474 A480 A481	V411-Q477 HydrophobicContact CG1-CB 4.37Å; V411-Q477 VanDerWaalsContact CG1-O 3.24Å; V411-Q477 WeakPolarHBondContact CG1-O 3.45Å; L414-Q477 VanDerWaalsContact CD2-C 3.5Å; L414-Q477 HydrophobicContact CD2-CB 3.74Å; E473-Q477 WeakPolarHBondContact O-CG 3.32Å; E473-Q477 PolarHBondContact O-N 3.33Å; E473-Q477 PolarHBondContact OE1-NE2 3.47Å; L474-Q477 PolarHBondContact O-N 3.44Å; Q477-A480 PolarHBondContact O-N 3.05Å; Q477-A481 PolarHBondContact O-N 3.46Å
478	L	86.4	Confident	82.4	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-67.3	-38.6	177.3	-168.7	69.5	0	0	0	111.4	L414 F418 L458 I461 L474 K475 R476 A480 A481 V482 W500 L508	L414-L478 HydrophobicContact CD1-CD1 3.98Å; L414-L478 HydrophobicContact CD2-CB 4.07Å; L414-L478 HydrophobicContact CD2-CD1 4.08Å; L414-L478 HydrophobicContact CG-CD1 4Å; F418-L478 HydrophobicContact CD2-CD1 4.08Å; F418-L478 HydrophobicContact CG-CD1 4.44Å; L458-L478 HydrophobicContact CD2-CD2 3.86Å; I461-L478 HydrophobicContact CD1-CD1 4.39Å; I461-L478 HydrophobicContact CD1-CD2 3.36Å; L474-L478 VanDerWaalsContact O-CB 3.26Å; L474-L478 WeakPolarHBondContact O-CB 3.38Å; L474-L478 PolarHBondContact O-N 3.13Å; K475-L478 PolarHBondContact O-N 2.89Å; R476-L478 VanDerWaalsContact C-N 3.33Å; L478-A480 VanDerWaalsContact C-N 3.31Å; L478-A480 PolarHBondContact O-N 3.47Å; L478-A481 WeakPolarHBondContact O-CB 3.42Å; L478-A481 PolarHBondContact O-N 2.9Å; L478-A481 VanDerWaalsContact O-N 3.15Å; L478-V482 HydrophobicContact CG-CG2 4.35Å; L478-V482 VanDerWaalsContact O-CB 3.32Å; L478-V482 WeakPolarHBondContact O-CB 3.48Å; L478-V482 WeakPolarHBondContact O-CG2 3.46Å; L478-V482 PolarHBondContact O-N 3.49Å; L478-W500 HydrophobicContact CD2-CH2 3.78Å; L478-W500 HydrophobicContact CD2-CZ2 4.23Å; L478-L508 HydrophobicContact CD2-CD2 3.82Å; L478-L508 HydrophobicContact CG-CD2 4.38Å
479	A	85.2	Confident	83.1	Confident	42 Å²	42	42.7 Å²	42.7	35%	0.347	25%	0.247	S	C	.	.	H	α-helix	trans	-60.2	-41	173.7	0	0	0	0	0	112	K475 R476 G483	K475-A479 WeakPolarHBondContact O-CB 3.36Å; K475-A479 PolarHBondContact O-N 3.03Å; R476-A479 PolarHBondContact O-N 3.21Å; A479-G483 PolarHBondContact O-N 3.38Å
480	A	84.4	Confident	83.3	Confident	48 Å²	48	45.2 Å²	45.2	40%	0.397	25%	0.254	S	S	.	.	H	α-helix	trans	-66	-38.7	173.7	0	0	0	0	0	112.4	V411 R476 Q477 L478 S484	V411-A480 HydrophobicContact CG1-CB 4.49Å; R476-A480 PolarHBondContact O-N 3Å; Q477-A480 PolarHBondContact O-N 3.05Å; L478-A480 VanDerWaalsContact C-N 3.31Å; L478-A480 PolarHBondContact O-N 3.47Å; A480-S484 PolarHBondContact O-N 3.18Å; A480-S484 VanDerWaalsContact O-N 3.12Å; A480-S484 PolarHBondContact O-OG 3.36Å
481	A	84.5	Confident	83	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-63.7	-48.3	175.3	0	0	0	0	0	111.6	V411 L414 K415 Q477 L478 G483 S484 V485	V411-A481 HydrophobicContact CG1-CB 3.95Å; L414-A481 HydrophobicContact CB-CB 4.37Å; L414-A481 HydrophobicContact CD2-CB 4.29Å; L414-A481 HydrophobicContact CG-CB 4Å; K415-A481 HydrophobicContact CG-CB 3.98Å; Q477-A481 PolarHBondContact O-N 3.46Å; L478-A481 WeakPolarHBondContact O-CB 3.42Å; L478-A481 PolarHBondContact O-N 2.9Å; L478-A481 VanDerWaalsContact O-N 3.15Å; A481-G483 PolarHBondContact O-N 2.98Å; A481-S484 PolarHBondContact O-N 3.44Å; A481-V485 WeakPolarHBondContact O-CB 3.35Å; A481-V485 VanDerWaalsContact O-CG2 3.31Å; A481-V485 WeakPolarHBondContact O-CG2 3.48Å; A481-V485 PolarHBondContact O-N 3.18Å
482	V	85.5	Confident	82.3	Confident	17 Å²	17	49.9 Å²	49.9	10%	0.103	27%	0.266	C	S	.	.	H	α-helix	trans	-53.4	-50.1	174.5	160.7	0	0	0	0	111.1	F418 L478 S484 V485 S486 F496 A498 L508	F418-V482 HydrophobicContact CD1-CG2 4.17Å; F418-V482 HydrophobicContact CE1-CB 4.23Å; F418-V482 HydrophobicContact CE1-CG2 3.52Å; F418-V482 HydrophobicContact CE2-CG2 4.27Å; F418-V482 HydrophobicContact CZ-CG2 3.57Å; L478-V482 HydrophobicContact CG-CG2 4.35Å; L478-V482 VanDerWaalsContact O-CB 3.32Å; L478-V482 WeakPolarHBondContact O-CB 3.48Å; L478-V482 WeakPolarHBondContact O-CG2 3.46Å; L478-V482 PolarHBondContact O-N 3.49Å; V482-S484 VanDerWaalsContact C-N 3.34Å; V482-S484 PolarHBondContact O-N 3.42Å; V482-V485 PolarHBondContact O-N 3.47Å; V482-S486 VanDerWaalsContact O-CB 3.29Å; V482-S486 WeakPolarHBondContact O-CB 3.47Å; V482-S486 PolarHBondContact O-N 2.88Å; V482-F496 HydrophobicContact CG1-CE1 4.25Å; V482-A498 HydrophobicContact CG1-CB 3.68Å; V482-A498 HydrophobicContact CG2-CB 4.28Å; V482-L508 HydrophobicContact CG2-CD2 3.84Å
483	G	85.1	Confident	81.3	Confident	40 Å²	40	42.9 Å²	42.9	41%	0.412	24%	0.243	S	C	.	.	H	α-helix	trans	-61.7	-41.4	179.4	0	0	0	0	0	112.8	A479 A481 S486 A487	A479-G483 PolarHBondContact O-N 3.38Å; A481-G483 PolarHBondContact O-N 2.98Å; G483-S486 PolarHBondContact O-N 3.06Å; G483-A487 WeakPolarHBondContact O-CB 3.46Å; G483-A487 PolarHBondContact O-N 3.13Å
484	S	85.5	Confident	80.4	Confident	27 Å²	27	40.6 Å²	40.6	19%	0.189	23%	0.234	C	C	.	.	H	α-helix	trans	-68.3	-42.2	179.3	-53	0	0	0	0	112	K415 A480 A481 V482 A487 Y488	K415-S484 WeakPolarHBondContact CE-OG 3.45Å; K415-S484 PolarHBondContact NZ-OG 2.93Å; A480-S484 PolarHBondContact O-N 3.18Å; A480-S484 VanDerWaalsContact O-N 3.12Å; A480-S484 PolarHBondContact O-OG 3.36Å; A481-S484 PolarHBondContact O-N 3.44Å; V482-S484 VanDerWaalsContact C-N 3.34Å; V482-S484 PolarHBondContact O-N 3.42Å; S484-A487 PolarHBondContact O-N 3.45Å; S484-Y488 PolarHBondContact O-N 3.05Å; S484-Y488 VanDerWaalsContact O-N 3.12Å
485	V	82.8	Confident	79.6	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-68.5	-39.3	176.9	174.8	0	0	0	0	110.8	F404 F418 Y419 L422 A481 V482 Y488 F489	F404-V485 HydrophobicContact CE1-CG2 4.24Å; F404-V485 HydrophobicContact CE2-CG2 4.13Å; F404-V485 HydrophobicContact CZ-CB 4.46Å; F404-V485 HydrophobicContact CZ-CG2 3.75Å; F418-V485 HydrophobicContact CD1-CB 4.07Å; F418-V485 HydrophobicContact CD1-CG1 4.2Å; F418-V485 HydrophobicContact CD1-CG2 4.04Å; Y419-V485 HydrophobicContact CD2-CG1 4.3Å; L422-V485 HydrophobicContact CD1-CG1 3.56Å; A481-V485 WeakPolarHBondContact O-CB 3.35Å; A481-V485 VanDerWaalsContact O-CG2 3.31Å; A481-V485 WeakPolarHBondContact O-CG2 3.48Å; A481-V485 PolarHBondContact O-N 3.18Å; V482-V485 PolarHBondContact O-N 3.47Å; V485-Y488 WeakPolarHBondContact O-CB 3.35Å; V485-Y488 PolarHBondContact O-N 2.96Å; V485-Y488 VanDerWaalsContact O-N 3.17Å; V485-F489 HydrophobicContact CG1-CD2 3.92Å; V485-F489 HydrophobicContact CG1-CE2 3.7Å; V485-F489 VanDerWaalsContact O-CD2 3.28Å; V485-F489 WeakPolarHBondContact O-CD2 3.45Å; V485-F489 PolarHBondContact O-N 2.99Å
486	S	82	Confident	78.9	Confident	23 Å²	23	41 Å²	41	16%	0.161	24%	0.238	C	C	.	.	H	α-helix	trans	-56.9	-50.8	173.1	-163.8	0	0	0	0	111.9	V482 G483 Y488 F489 D490 F496	V482-S486 VanDerWaalsContact O-CB 3.29Å; V482-S486 WeakPolarHBondContact O-CB 3.47Å; V482-S486 PolarHBondContact O-N 2.88Å; G483-S486 PolarHBondContact O-N 3.06Å; S486-Y488 PolarHBondContact O-N 2.82Å; S486-F489 PolarHBondContact O-N 3.31Å; S486-D490 PolarHBondContact O-N 3.15Å; S486-F496 PolarHBondContact OG-O 3.45Å; S486-F496 VanDerWaalsContact OG-O 3.1Å
487	A	81.9	Confident	78.2	Confident	36 Å²	36	40.3 Å²	40.3	30%	0.298	24%	0.235	S	C	.	.	H	α-helix	trans	-59.5	-34.5	178.2	0	0	0	0	0	112.1	G483 S484 Q491	G483-A487 WeakPolarHBondContact O-CB 3.46Å; G483-A487 PolarHBondContact O-N 3.13Å; S484-A487 PolarHBondContact O-N 3.45Å; A487-Q491 WeakPolarHBondContact O-CB 3.29Å; A487-Q491 VanDerWaalsContact O-CG 3.23Å; A487-Q491 WeakPolarHBondContact O-CG 3.36Å; A487-Q491 PolarHBondContact O-N 2.84Å; A487-Q491 VanDerWaalsContact O-N 3.16Å
488	Y	82	Confident	77.8	Confident	19 Å²	19	40 Å²	40	8%	0.075	24%	0.238	C	C	.	.	H	α-helix	trans	-63.8	-45.8	172.2	178.5	-90.9	0	0	0	111.9	N397 A400 F404 Y419 S484 V485 S486 N492	N397-Y488 PolarHBondContact ND2-OH 2.85Å; A400-Y488 HydrophobicContact CB-CD1 4.09Å; A400-Y488 HydrophobicContact CB-CD2 4.15Å; A400-Y488 HydrophobicContact CB-CE1 3.57Å; A400-Y488 HydrophobicContact CB-CE2 3.62Å; A400-Y488 HydrophobicContact CB-CG 4.37Å; F404-Y488 HydrophobicContact CZ-CG 4.29Å; Y419-Y488 HydrophobicContact CE2-CD1 4.11Å; Y419-Y488 AromaticContact CE2-CE1 3.91Å; Y419-Y488 HydrophobicContact CE2-CE1 3.91Å; S484-Y488 PolarHBondContact O-N 3.05Å; S484-Y488 VanDerWaalsContact O-N 3.12Å; V485-Y488 WeakPolarHBondContact O-CB 3.35Å; V485-Y488 PolarHBondContact O-N 2.96Å; V485-Y488 VanDerWaalsContact O-N 3.17Å; S486-Y488 PolarHBondContact O-N 2.82Å; Y488-N492 WeakPolarHBondContact CE2-ND2 3.44Å; Y488-N492 PolarHBondContact O-N 3.26Å; Y488-N492 PolarHBondContact O-ND2 3.31Å
489	F	74.8	Confident	77.7	Confident	17 Å²	17	45 Å²	45	8%	0.075	26%	0.261	C	S	.	.	H	α-helix	trans	-63.6	-45.8	176.7	-83.6	-83.6	0	0	0	112.4	Y419 L422 M423 Y426 V485 S486 Q491 N492 G493 G494 F496	Y419-F489 HydrophobicContact CD2-CE2 4.44Å; L422-F489 HydrophobicContact CD1-CE2 3.75Å; L422-F489 HydrophobicContact CD1-CZ 4.35Å; M423-F489 HydrophobicContact CE-CE1 3.57Å; M423-F489 HydrophobicContact CE-CE2 4.27Å; M423-F489 HydrophobicContact CE-CZ 3.17Å; Y426-F489 HydrophobicContact CD2-CZ 4.48Å; Y426-F489 AromaticContact CE2-CE1 3.65Å; Y426-F489 HydrophobicContact CE2-CE1 3.65Å; Y426-F489 AromaticContact CE2-CZ 3.56Å; Y426-F489 HydrophobicContact CE2-CZ 3.56Å; Y426-F489 AromaticContact CZ-CE1 3.66Å; Y426-F489 WeakPolarHBondContact OH-CE1 3.17Å; V485-F489 HydrophobicContact CG1-CD2 3.92Å; V485-F489 HydrophobicContact CG1-CE2 3.7Å; V485-F489 VanDerWaalsContact O-CD2 3.28Å; V485-F489 WeakPolarHBondContact O-CD2 3.45Å; V485-F489 PolarHBondContact O-N 2.99Å; S486-F489 PolarHBondContact O-N 3.31Å; F489-Q491 VanDerWaalsContact C-N 3.29Å; F489-Q491 PolarHBondContact O-N 2.9Å; F489-N492 CarbonylContact O-C 3.58Å; F489-N492 WeakPolarHBondContact O-CA 3.22Å; F489-N492 PolarHBondContact O-N 2.92Å; F489-G493 PolarHBondContact O-N 2.88Å; F489-G493 VanDerWaalsContact O-N 3.13Å; F489-G494 WeakPolarHBondContact O-CA 3.4Å; F489-G494 PolarHBondContact O-N 2.94Å; F489-F496 HydrophobicContact CB-CB 3.83Å; F489-F496 HydrophobicContact CD2-CB 3.87Å; F489-F496 HydrophobicContact CD2-CD2 4.4Å; F489-F496 HydrophobicContact CD2-CG 4.11Å; F489-F496 HydrophobicContact CE2-CD2 4.38Å; F489-F496 HydrophobicContact CG-CB 3.94Å
490	D	74.6	Confident	77.6	Confident	80 Å²	80	46 Å²	46	43%	0.428	26%	0.256	S	S	.	.	H	α-helix	trans	-60.1	-41	-177.8	-66.8	-28.1	0	0	0	111.5	S486 N492 G493	S486-D490 PolarHBondContact O-N 3.15Å; D490-N492 VanDerWaalsContact C-N 3.27Å; D490-N492 PolarHBondContact O-N 3.44Å; D490-G493 PolarHBondContact O-N 3.42Å
491	Q	74.3	Confident	77.5	Confident	132 Å²	132	45.6 Å²	45.6	62%	0.617	25%	0.247	S	C	*	.	H	α-helix	trans	-67.6	-24.5	175.1	-72.3	177.7	-4.2	0	0	113.6	A487 F489	A487-Q491 WeakPolarHBondContact O-CB 3.29Å; A487-Q491 VanDerWaalsContact O-CG 3.23Å; A487-Q491 WeakPolarHBondContact O-CG 3.36Å; A487-Q491 PolarHBondContact O-N 2.84Å; A487-Q491 VanDerWaalsContact O-N 3.16Å; F489-Q491 VanDerWaalsContact C-N 3.29Å; F489-Q491 PolarHBondContact O-N 2.9Å
492	N	69.1	Low	77.1	Confident	90 Å²	90	53.1 Å²	53.1	48%	0.481	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.1	18	-178.6	-70.3	-78.1	0	0	0	113.2	Y488 F489 D490 G494	Y488-N492 WeakPolarHBondContact CE2-ND2 3.44Å; Y488-N492 PolarHBondContact O-N 3.26Å; Y488-N492 PolarHBondContact O-ND2 3.31Å; F489-N492 CarbonylContact O-C 3.58Å; F489-N492 WeakPolarHBondContact O-CA 3.22Å; F489-N492 PolarHBondContact O-N 2.92Å; D490-N492 VanDerWaalsContact C-N 3.27Å; D490-N492 PolarHBondContact O-N 3.44Å; N492-G494 VanDerWaalsContact C-N 3.34Å; N492-G494 PolarHBondContact O-N 3.27Å
493	G	63.3	Low	76.7	Confident	25 Å²	25	62 Å²	62	26%	0.258	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	77	15.3	175.6	0	0	0	0	0	115	F489 D490 K515	F489-G493 PolarHBondContact O-N 2.88Å; F489-G493 VanDerWaalsContact O-N 3.13Å; D490-G493 PolarHBondContact O-N 3.42Å; G493-K515 VanDerWaalsContact O-CB 3.27Å; G493-K515 WeakPolarHBondContact O-CB 2.91Å; G493-K515 VanDerWaalsContact O-CG 3.31Å; G493-K515 WeakPolarHBondContact O-CG 3.27Å; G493-K515 PolarHBondContact O-N 2.84Å
494	G	66.3	Low	76.5	Confident	6 Å²	6	62.8 Å²	62.8	6%	0.062	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	168.4	162.7	0	0	0	0	0	111.6	F489 N492 F513	F489-G494 WeakPolarHBondContact O-CA 3.4Å; F489-G494 PolarHBondContact O-N 2.94Å; N492-G494 VanDerWaalsContact C-N 3.34Å; N492-G494 PolarHBondContact O-N 3.27Å; G494-F513 CarbonylContact C-O 3.6Å
495	I	65.4	Low	76.1	Confident	58 Å²	58	68.3 Å²	68.3	30%	0.297	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	115.5	164.3	-61	170.5	0	0	0	104.9	R497 F513 K515	I495-R497 HydrophobicContact CG2-CG 4.44Å; I495-F513 CarbonylContact C-O 3.5Å; I495-F513 HydrophobicContact CB-CB 4.16Å; I495-F513 HydrophobicContact CB-CD2 4.27Å; I495-F513 HydrophobicContact CG2-CD2 4.01Å; I495-F513 PolarHBondContact N-O 3.31Å; I495-F513 PolarHBondContact O-N 3.13Å; I495-K515 HydrophobicContact CD1-CG 3.97Å; I495-K515 HydrophobicContact CG1-CG 3.9Å
496	F	72.7	Confident	76.1	Confident	5 Å²	5	73.5 Å²	73.5	2%	0.022	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	129.3	176.7	178	-99.2	0	0	0	109	F418 L422 V482 S486 F489 A498 V510 A512	F418-F496 AromaticContact CE1-CE1 3.8Å; F418-F496 HydrophobicContact CE1-CE1 3.8Å; F418-F496 AromaticContact CE1-CZ 3.48Å; F418-F496 HydrophobicContact CE1-CZ 3.48Å; F418-F496 VanDerWaalsContact CE1-CZ 3.48Å; F418-F496 HydrophobicContact CZ-CE1 4.29Å; F418-F496 AromaticContact CZ-CZ 3.64Å; F418-F496 HydrophobicContact CZ-CZ 3.64Å; L422-F496 HydrophobicContact CD1-CD2 3.76Å; L422-F496 HydrophobicContact CD1-CE1 4.23Å; L422-F496 HydrophobicContact CD1-CE2 3.17Å; L422-F496 HydrophobicContact CD1-CG 4.49Å; L422-F496 HydrophobicContact CD1-CZ 3.45Å; L422-F496 VanDerWaalsContact CD1-CZ 3.45Å; L422-F496 HydrophobicContact CD2-CE2 3.49Å; L422-F496 VanDerWaalsContact CD2-CE2 3.49Å; L422-F496 HydrophobicContact CD2-CZ 3.91Å; L422-F496 HydrophobicContact CG-CE2 3.92Å; L422-F496 HydrophobicContact CG-CZ 4.28Å; V482-F496 HydrophobicContact CG1-CE1 4.25Å; S486-F496 PolarHBondContact OG-O 3.45Å; S486-F496 VanDerWaalsContact OG-O 3.1Å; F489-F496 HydrophobicContact CB-CB 3.83Å; F489-F496 HydrophobicContact CD2-CB 3.87Å; F489-F496 HydrophobicContact CD2-CD2 4.4Å; F489-F496 HydrophobicContact CD2-CG 4.11Å; F489-F496 HydrophobicContact CE2-CD2 4.38Å; F489-F496 HydrophobicContact CG-CB 3.94Å; F496-A498 HydrophobicContact CE1-CB 3.89Å; F496-A498 HydrophobicContact CZ-CB 3.89Å; F496-V510 HydrophobicContact CD2-CG1 4.31Å; F496-V510 HydrophobicContact CE2-CG1 3.21Å; F496-V510 HydrophobicContact CZ-CG1 3.51Å; F496-A512 HydrophobicContact CD2-CB 3.82Å; F496-A512 HydrophobicContact CE2-CB 4.37Å
497	R	72.2	Confident	76.1	Confident	150 Å²	150	76.3 Å²	76.3	57%	0.566	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.2	131.9	175	-66	-168.5	179.9	-164.3	1.6	108.9	I495 K511	I495-R497 HydrophobicContact CG2-CG 4.44Å; R497-K511 CarbonylContact C-O 3.38Å; R497-K511 HydrophobicContact CB-CB 4.44Å; R497-K511 PolarHBondContact N-O 3.45Å; R497-K511 CarbonylContact O-C 3.57Å; R497-K511 PolarHBondContact O-N 2.95Å
498	A	76.9	Confident	76.2	Confident	25 Å²	25	74.6 Å²	74.6	21%	0.207	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	127.7	168.2	0	0	0	0	0	108.9	V482 F496 L508 N509 V510	V482-A498 HydrophobicContact CG1-CB 3.68Å; V482-A498 HydrophobicContact CG2-CB 4.28Å; F496-A498 HydrophobicContact CE1-CB 3.89Å; F496-A498 HydrophobicContact CZ-CB 3.89Å; A498-L508 HydrophobicContact CB-CD1 3.99Å; A498-L508 HydrophobicContact CB-CD2 4.41Å; A498-L508 HydrophobicContact CB-CG 4.29Å; A498-N509 CarbonylContact C-O 3.6Å; A498-N509 VanDerWaalsContact CA-O 3.3Å; A498-N509 WeakPolarHBondContact CA-O 3.43Å; A498-V510 HydrophobicContact CB-CG2 4.08Å
499	E	82.3	Confident	76.1	Confident	104 Å²	104	75.9 Å²	75.9	49%	0.486	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	136.8	-174.2	-70	170.6	-172.2	0	0	108.6	N509	E499-N509 PolarHBondContact N-O 3.48Å; E499-N509 WeakPolarHBondContact O-CB 3.49Å; E499-N509 PolarHBondContact O-N 2.87Å
500	W	83.6	Confident	76.1	Confident	65 Å²	65	75.3 Å²	75.3	25%	0.246	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	136.3	173.6	-68.3	99.2	0	0	0	109.7	L458 K475 L478 I502 L508	L458-W500 HydrophobicContact CD1-CH2 3.65Å; L458-W500 HydrophobicContact CD1-CZ3 3.56Å; L458-W500 HydrophobicContact CD2-CH2 3.98Å; L458-W500 HydrophobicContact CD2-CZ3 4.43Å; L458-W500 HydrophobicContact CG-CH2 3.83Å; L458-W500 HydrophobicContact CG-CZ3 3.78Å; K475-W500 HydrophobicContact CB-CH2 4.37Å; K475-W500 HydrophobicContact CD-CD2 4.46Å; K475-W500 HydrophobicContact CD-CE3 4.42Å; K475-W500 HydrophobicContact CD-CH2 4.39Å; K475-W500 HydrophobicContact CD-CZ2 4.42Å; K475-W500 HydrophobicContact CD-CZ3 4.4Å; K475-W500 VanDerWaalsContact CE-CD2 3.49Å; K475-W500 HydrophobicContact CG-CD2 4.45Å; K475-W500 HydrophobicContact CG-CH2 3.68Å; K475-W500 HydrophobicContact CG-CZ2 3.58Å; K475-W500 HydrophobicContact CG-CZ3 4.17Å; L478-W500 HydrophobicContact CD2-CH2 3.78Å; L478-W500 HydrophobicContact CD2-CZ2 4.23Å; W500-I502 PolarHBondContact O-N 3.11Å; W500-L508 HydrophobicContact CD2-CD1 3.89Å; W500-L508 HydrophobicContact CE3-CB 4.18Å; W500-L508 HydrophobicContact CE3-CD1 4.18Å; W500-L508 HydrophobicContact CG-CD1 4.36Å; W500-L508 HydrophobicContact CH2-CB 4.24Å; W500-L508 HydrophobicContact CH2-CD1 4.31Å; W500-L508 HydrophobicContact CZ2-CD1 4.04Å; W500-L508 HydrophobicContact CZ3-CB 3.91Å; W500-L508 HydrophobicContact CZ3-CD1 4.37Å
501	D	82.6	Confident	75.9	Confident	38 Å²	38	75.1 Å²	75.1	20%	0.203	35%	0.353	C	S	.	.			trans	-63.5	129.5	174.8	-169.3	-59.4	0	0	0	110.3	K503 N504 K505 R507	D501-K503 WeakPolarHBondContact OD1-CA 3.41Å; D501-K503 WeakPolarHBondContact OD1-CB 3.23Å; D501-K503 PolarHBondContact OD1-N 3.38Å; D501-N504 HydrophobicContact CB-CB 4.48Å; D501-N504 WeakPolarHBondContact CB-O 3.19Å; D501-N504 CarbonylContact O-C 3.59Å; D501-N504 VanDerWaalsContact O-C 3.23Å; D501-N504 PolarHBondContact OD1-N 3.39Å; D501-K505 PolarHBondContact O-N 3.05Å; D501-R507 HydrophobicContact CB-CB 3.82Å; D501-R507 HydrophobicContact CB-CG 4.1Å; D501-R507 PolarHBondContact N-O 2.97Å
502	I	76.3	Confident	75.4	Confident	158 Å²	158	69 Å²	69	81%	0.81	33%	0.325	S	S	*	.	S	Bend	trans	-68.5	-37.2	-176.8	-61.7	171.8	0	0	0	110.7	W500	W500-I502 PolarHBondContact O-N 3.11Å
503	K	77.4	Confident	74.9	Confident	204 Å²	204	67.5 Å²	67.5	89%	0.887	31%	0.314	S	S	*	.	S	Bend	trans	-78.9	-45.8	-180	-64.1	-177.2	178.2	-178.4	0	110.5	D501	D501-K503 WeakPolarHBondContact OD1-CA 3.41Å; D501-K503 WeakPolarHBondContact OD1-CB 3.23Å; D501-K503 PolarHBondContact OD1-N 3.38Å
504	N	79.7	Confident	74.5	Confident	56 Å²	56	72 Å²	72	30%	0.299	33%	0.327	S	S	.	.			trans	-110.2	90.9	175.5	-174.4	-3.3	0	0	0	110.9	D501 Y506 R507	D501-N504 HydrophobicContact CB-CB 4.48Å; D501-N504 WeakPolarHBondContact CB-O 3.19Å; D501-N504 CarbonylContact O-C 3.59Å; D501-N504 VanDerWaalsContact O-C 3.23Å; D501-N504 PolarHBondContact OD1-N 3.39Å; N504-Y506 PolarHBondContact O-N 3.15Å; N504-Y506 PolarHBondContact OD1-N 2.86Å; N504-Y506 VanDerWaalsContact OD1-N 3.12Å; N504-R507 HydrophobicContact CB-CB 4Å; N504-R507 WeakPolarHBondContact O-CB 3.41Å; N504-R507 PolarHBondContact O-N 2.88Å
505	K	78.9	Confident	73.8	Confident	144 Å²	144	76.5 Å²	76.5	63%	0.626	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-11.3	-179.4	-65.4	180	-177.3	175.4	0	114.3	K475 D501	K475-K505 WeakPolarHBondContact CE-O 3.49Å; K475-K505 PolarHBondContact NZ-O 3.42Å; D501-K505 PolarHBondContact O-N 3.05Å
506	Y	81.4	Confident	72.8	Confident	108 Å²	108	77.9 Å²	77.9	42%	0.424	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	2.8	177.9	-63.9	-77.8	0	0	0	114.4	L458 L471 N504	L458-Y506 VanDerWaalsContact CB-O 3.25Å; L458-Y506 WeakPolarHBondContact CB-O 3.42Å; L458-Y506 HydrophobicContact CD1-CD1 3.78Å; L458-Y506 VanDerWaalsContact CG-O 3.31Å; L458-Y506 WeakPolarHBondContact CG-O 3.22Å; L458-Y506 PolarHBondContact N-O 3.24Å; L471-Y506 HydrophobicContact CB-CD1 4.14Å; L471-Y506 HydrophobicContact CB-CE1 3.85Å; N504-Y506 PolarHBondContact O-N 3.15Å; N504-Y506 PolarHBondContact OD1-N 2.86Å; N504-Y506 VanDerWaalsContact OD1-N 3.12Å
507	R	82.7	Confident	71.4	Confident	83 Å²	83	83.9 Å²	83.9	31%	0.313	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	129.9	-179.3	-179.5	170.9	-75	-173.4	-3.3	110.8	S455 D457 D501 N504	S455-R507 WeakPolarHBondContact OG-CD 3.05Å; S455-R507 WeakPolarHBondContact OG-CG 3.18Å; D457-R507 WeakPolarHBondContact OD1-CB 3.4Å; D457-R507 WeakPolarHBondContact OD1-CG 3.34Å; D457-R507 IonicContact OD1-CZ 2.84Å; D457-R507 IonicContact OD1-NE 3.01Å; D457-R507 PolarHBondContact OD1-NE 3.47Å; D457-R507 IonicContact OD1-NH2 2.68Å; D457-R507 PolarHBondContact OD1-NH2 3.35Å; D457-R507 IonicContact OD2-CZ 2.71Å; D457-R507 IonicContact OD2-NE 3.22Å; D457-R507 IonicContact OD2-NH2 3.53Å; D457-R507 PolarHBondContact OD2-NH2 2.94Å; D501-R507 HydrophobicContact CB-CB 3.82Å; D501-R507 HydrophobicContact CB-CG 4.1Å; D501-R507 PolarHBondContact N-O 2.97Å; N504-R507 HydrophobicContact CB-CB 4Å; N504-R507 WeakPolarHBondContact O-CB 3.41Å; N504-R507 PolarHBondContact O-N 2.88Å
508	L	83.5	Confident	70	Confident	0 Å²	0	82 Å²	82	0%	0	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	115.9	177.9	-174.3	69.6	0	0	0	109.6	F418 S455 I456 L478 V482 A498 W500 V510	F418-L508 HydrophobicContact CE2-CD2 3.87Å; F418-L508 HydrophobicContact CZ-CD2 3.97Å; S455-L508 WeakPolarHBondContact CA-O 3.36Å; I456-L508 HydrophobicContact CG2-CB 4.15Å; I456-L508 PolarHBondContact N-O 3.05Å; I456-L508 PolarHBondContact O-N 3.16Å; L478-L508 HydrophobicContact CD2-CD2 3.82Å; L478-L508 HydrophobicContact CG-CD2 4.38Å; V482-L508 HydrophobicContact CG2-CD2 3.84Å; A498-L508 HydrophobicContact CB-CD1 3.99Å; A498-L508 HydrophobicContact CB-CD2 4.41Å; A498-L508 HydrophobicContact CB-CG 4.29Å; W500-L508 HydrophobicContact CD2-CD1 3.89Å; W500-L508 HydrophobicContact CE3-CB 4.18Å; W500-L508 HydrophobicContact CE3-CD1 4.18Å; W500-L508 HydrophobicContact CG-CD1 4.36Å; W500-L508 HydrophobicContact CH2-CB 4.24Å; W500-L508 HydrophobicContact CH2-CD1 4.31Å; W500-L508 HydrophobicContact CZ2-CD1 4.04Å; W500-L508 HydrophobicContact CZ3-CB 3.91Å; W500-L508 HydrophobicContact CZ3-CD1 4.37Å; L508-V510 HydrophobicContact CD2-CG2 3.94Å; L508-V510 HydrophobicContact CG-CG2 3.93Å
509	N	80.2	Confident	68.4	Low	46 Å²	46	84.3 Å²	84.3	25%	0.246	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	117.3	173.3	-68.2	-48.8	0	0	0	109	S455 A498 E499	S455-N509 WeakPolarHBondContact CB-OD1 3.44Å; A498-N509 CarbonylContact C-O 3.6Å; A498-N509 VanDerWaalsContact CA-O 3.3Å; A498-N509 WeakPolarHBondContact CA-O 3.43Å; E499-N509 PolarHBondContact N-O 3.48Å; E499-N509 WeakPolarHBondContact O-CB 3.49Å; E499-N509 PolarHBondContact O-N 2.87Å
510	V	75.5	Confident	66.9	Low	5 Å²	5	82.7 Å²	82.7	3%	0.03	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	129.1	-177.3	-178	0	0	0	0	109.8	F418 L422 S453 K454 F496 A498 L508	F418-V510 HydrophobicContact CE2-CG2 4.37Å; F418-V510 HydrophobicContact CZ-CG2 4.1Å; L422-V510 HydrophobicContact CD2-CG1 3.57Å; S453-V510 WeakPolarHBondContact CA-O 3.48Å; K454-V510 PolarHBondContact N-O 2.76Å; K454-V510 PolarHBondContact O-N 3.38Å; F496-V510 HydrophobicContact CD2-CG1 4.31Å; F496-V510 HydrophobicContact CE2-CG1 3.21Å; F496-V510 HydrophobicContact CZ-CG1 3.51Å; A498-V510 HydrophobicContact CB-CG2 4.08Å; L508-V510 HydrophobicContact CD2-CG2 3.94Å; L508-V510 HydrophobicContact CG-CG2 3.93Å
511	K	69.9	Low	65.4	Low	75 Å²	75	81.4 Å²	81.4	33%	0.326	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	126	173.8	-67.7	175.4	-174.9	164.6	0	109.5	Y452 R497 F513	Y452-K511 VanDerWaalsContact O-CA 3.3Å; Y452-K511 WeakPolarHBondContact O-CA 3.47Å; R497-K511 CarbonylContact C-O 3.38Å; R497-K511 HydrophobicContact CB-CB 4.44Å; R497-K511 PolarHBondContact N-O 3.45Å; R497-K511 CarbonylContact O-C 3.57Å; R497-K511 PolarHBondContact O-N 2.95Å; K511-F513 HydrophobicContact CB-CE2 4Å; K511-F513 HydrophobicContact CB-CZ 4.32Å
512	A	63.5	Low	63.8	Low	4 Å²	4	86.9 Å²	86.9	3%	0.033	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	139.4	179.1	0	0	0	0	0	110.3	Y426 Y452 F496	Y426-A512 HydrophobicContact CE1-CB 4.36Å; Y426-A512 HydrophobicContact CE2-CB 3.89Å; Y426-A512 WeakPolarHBondContact OH-CB 3.32Å; Y452-A512 PolarHBondContact O-N 2.85Å; F496-A512 HydrophobicContact CD2-CB 3.82Å; F496-A512 HydrophobicContact CE2-CB 4.37Å
513	F	59.6	Low	62.6	Low	58 Å²	58	86.5 Å²	86.5	25%	0.254	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	129	178.9	-44.6	-99.1	0	0	0	107.4	V449 K451 G494 I495 K511	V449-F513 VanDerWaalsContact CG1-CA 3.49Å; V449-F513 HydrophobicContact CG1-CB 3.84Å; K451-F513 HydrophobicContact CB-CE1 4.29Å; K451-F513 HydrophobicContact CD-CE1 4.26Å; K451-F513 HydrophobicContact CG-CD1 4.45Å; K451-F513 HydrophobicContact CG-CE1 3.75Å; K451-F513 HydrophobicContact CG-CZ 4.34Å; G494-F513 CarbonylContact C-O 3.6Å; I495-F513 CarbonylContact C-O 3.5Å; I495-F513 HydrophobicContact CB-CB 4.16Å; I495-F513 HydrophobicContact CB-CD2 4.27Å; I495-F513 HydrophobicContact CG2-CD2 4.01Å; I495-F513 PolarHBondContact N-O 3.31Å; I495-F513 PolarHBondContact O-N 3.13Å; K511-F513 HydrophobicContact CB-CE2 4Å; K511-F513 HydrophobicContact CB-CZ 4.32Å
514	K	54.2	Low	61.1	Low	120 Å²	120	79.2 Å²	79.2	52%	0.522	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	148	153.5	-156.9	171.9	-174.8	176.7	0	108.5	V449	V449-K514 HydrophobicContact CB-CB 4.41Å; V449-K514 WeakPolarHBondContact CB-O 3.36Å; V449-K514 HydrophobicContact CG1-CB 3.7Å; V449-K514 WeakPolarHBondContact CG1-O 3.43Å; V449-K514 HydrophobicContact CG2-CB 4.04Å; V449-K514 WeakPolarHBondContact CG2-O 3.33Å
515	K	51.3	Low	59.3	Low	100 Å²	100	82.6 Å²	82.6	44%	0.435	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-70.9	140.9	167.1	-73.3	177.5	-178.5	175.1	0	108.6	G493 I495 R517	G493-K515 VanDerWaalsContact O-CB 3.27Å; G493-K515 WeakPolarHBondContact O-CB 2.91Å; G493-K515 VanDerWaalsContact O-CG 3.31Å; G493-K515 WeakPolarHBondContact O-CG 3.27Å; G493-K515 PolarHBondContact O-N 2.84Å; I495-K515 HydrophobicContact CD1-CG 3.97Å; I495-K515 HydrophobicContact CG1-CG 3.9Å; K515-R517 PolarHBondContact O-N 3.4Å
516	P	44.2	Very low	58.2	Low	87 Å²	87	81.3 Å²	81.3	57%	0.565	38%	0.381	S	S	*	.	P	Polyproline II helix	trans	-58.1	124.5	168.4	23.3	-29.3	0	0	0	107.6	V449	V449-P516 HydrophobicContact CG2-CB 4.48Å
517	R	43.3	Very low	56.8	Low	132 Å²	132	83.1 Å²	83.1	50%	0.498	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-99	128.3	167.8	-74	-179.5	179.2	-170.7	-0.6	106.8	K515 Y519	K515-R517 PolarHBondContact O-N 3.4Å; R517-Y519 HydrophobicContact CB-CD2 4.2Å; R517-Y519 HydrophobicContact CB-CE1 4.27Å; R517-Y519 HydrophobicContact CB-CE2 3.61Å; R517-Y519 WeakPolarHBondContact CD-OH 3.39Å; R517-Y519 PolarHBondContact NH1-OH 2.81Å
518	L	42.6	Very low	54.8	Low	111 Å²	111	82.4 Å²	82.4	58%	0.581	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.4	119.7	164.9	-67.3	168.9	0	0	0	105.7	Q444	Q444-L518 HydrophobicContact CB-CD2 4.38Å
519	Y	44.3	Very low	53.1	Low	73 Å²	73	88.7 Å²	88.7	29%	0.286	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	138.9	168	-59.3	-77.5	0	0	0	107.9	R517	R517-Y519 HydrophobicContact CB-CD2 4.2Å; R517-Y519 HydrophobicContact CB-CE1 4.27Å; R517-Y519 HydrophobicContact CB-CE2 3.61Å; R517-Y519 WeakPolarHBondContact CD-OH 3.39Å; R517-Y519 PolarHBondContact NH1-OH 2.81Å
520	D	50	Low	51.5	Low	69 Å²	69	90.3 Å²	90.3	37%	0.369	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	123.4	165.4	-141.4	-26	0	0	0	107.8	I442 E522 E523 E524	I442-D520 WeakPolarHBondContact CG2-OD1 3.23Å; D520-E522 PolarHBondContact O-N 2.87Å; D520-E523 HydrophobicContact CB-CB 4.47Å; D520-E523 PolarHBondContact O-N 2.93Å; D520-E523 VanDerWaalsContact O-N 3.15Å; D520-E524 PolarHBondContact O-N 3.24Å
521	V	51.5	Low	50	Low	39 Å²	39	96.2 Å²	96.2	24%	0.236	46%	0.464	C	S	.	.	H	α-helix	trans	-64.4	-29.2	-169.7	170.2	0	0	0	0	111.4	T443 K445 E525	T443-V521 WeakPolarHBondContact O-CG2 3.27Å; K445-V521 HydrophobicContact CB-CG2 4.11Å; V521-E525 PolarHBondContact O-N 3.03Å
522	E	50.2	Low	48.3	Very low	152 Å²	152	97 Å²	97	71%	0.71	47%	0.472	S	S	*	.	H	α-helix	trans	-74.4	-24.1	178.2	-68.6	-177.5	166.9	0	0	113.6	D520 N526	D520-E522 PolarHBondContact O-N 2.87Å; E522-N526 PolarHBondContact O-ND2 3.24Å
523	E	51.1	Low	47.2	Very low	151 Å²	151	105.2 Å²	105.2	71%	0.706	52%	0.515	S	S	*	.	H	α-helix	trans	-83.2	-30.4	175.1	-113.4	-177.5	176.3	0	0	111.9	D520 W527	D520-E523 HydrophobicContact CB-CB 4.47Å; D520-E523 PolarHBondContact O-N 2.93Å; D520-E523 VanDerWaalsContact O-N 3.15Å; E523-W527 VanDerWaalsContact O-CB 3.25Å; E523-W527 WeakPolarHBondContact O-CB 3.46Å; E523-W527 PolarHBondContact O-N 2.69Å
524	E	45	Very low	46.6	Very low	51 Å²	51	106.1 Å²	106.1	24%	0.238	52%	0.521	C	S	.	.	H	α-helix	trans	-77.5	-34.6	179	-152.7	179.7	-157.7	0	0	112.1	D520 W527 L528	D520-E524 PolarHBondContact O-N 3.24Å; E524-W527 PolarHBondContact O-N 2.97Å; E524-L528 HydrophobicContact CG-CD1 4.14Å; E524-L528 VanDerWaalsContact O-CB 3.29Å; E524-L528 WeakPolarHBondContact O-CB 3.47Å; E524-L528 PolarHBondContact O-N 3.49Å
525	E	43.3	Very low	46.4	Very low	127 Å²	127	110.1 Å²	110.1	59%	0.593	53%	0.533	S	S	*	.	H	α-helix	trans	-63.7	-44.3	170	-80	-177.1	168.2	0	0	110.9	V521 W527 L528 D529	V521-E525 PolarHBondContact O-N 3.03Å; E525-W527 PolarHBondContact O-N 3.37Å; E525-L528 PolarHBondContact O-N 3.4Å; E525-D529 VanDerWaalsContact O-CB 3.25Å; E525-D529 WeakPolarHBondContact O-CB 3.22Å; E525-D529 VanDerWaalsContact O-CG 3.28Å; E525-D529 PolarHBondContact O-N 3.03Å
526	N	54.3	Low	46.3	Very low	117 Å²	117	113.8 Å²	113.8	63%	0.626	55%	0.551	S	S	*	*	H	α-helix	trans	-68.1	-29.6	173.8	-82.8	-43.4	0	0	0	113.9	E522 S530	E522-N526 PolarHBondContact O-ND2 3.24Å; N526-S530 VanDerWaalsContact O-CB 3.25Å; N526-S530 WeakPolarHBondContact O-CB 3.11Å; N526-S530 PolarHBondContact O-N 3.49Å; N526-S530 VanDerWaalsContact O-N 3.09Å; N526-S530 PolarHBondContact O-OG 3Å
527	W	53.1	Low	46.3	Very low	145 Å²	145	116.1 Å²	116.1	55%	0.549	56%	0.555	S	S	.	*	H	α-helix	trans	-76.1	-42.2	175.3	-175.9	80.7	0	0	0	112.3	E523 E524 E525 S530 H531	E523-W527 VanDerWaalsContact O-CB 3.25Å; E523-W527 WeakPolarHBondContact O-CB 3.46Å; E523-W527 PolarHBondContact O-N 2.69Å; E524-W527 PolarHBondContact O-N 2.97Å; E525-W527 PolarHBondContact O-N 3.37Å; W527-S530 WeakPolarHBondContact CA-OG 3.27Å; W527-S530 PolarHBondContact O-N 3.42Å; W527-S530 PolarHBondContact O-OG 3.43Å; W527-S530 VanDerWaalsContact O-OG 3.06Å; W527-H531 HydrophobicContact CZ2-CB 4.49Å; W527-H531 AromaticContact NE1-CE1 3.93Å; W527-H531 AromaticContact NE1-ND1 3.84Å; W527-H531 WeakPolarHBondContact O-CB 3.34Å; W527-H531 PolarHBondContact O-N 3.4Å
528	L	40.3	Very low	46.5	Very low	68 Å²	68	114.9 Å²	114.9	36%	0.356	55%	0.554	S	S	.	*	H	α-helix	trans	-64.1	-42.4	172.9	-87.8	150.3	0	0	0	110.9	E524 E525 S530 H531 L532	E524-L528 HydrophobicContact CG-CD1 4.14Å; E524-L528 VanDerWaalsContact O-CB 3.29Å; E524-L528 WeakPolarHBondContact O-CB 3.47Å; E524-L528 PolarHBondContact O-N 3.49Å; E525-L528 PolarHBondContact O-N 3.4Å; L528-S530 VanDerWaalsContact C-N 3.27Å; L528-S530 PolarHBondContact O-N 3.11Å; L528-H531 PolarHBondContact O-N 3.06Å; L528-L532 HydrophobicContact CD2-CD1 3.31Å; L528-L532 HydrophobicContact CD2-CG 4.04Å; L528-L532 VanDerWaalsContact O-CB 3.27Å; L528-L532 WeakPolarHBondContact O-CB 3.18Å; L528-L532 PolarHBondContact O-N 3.43Å
529	D	48.1	Very low	46.9	Very low	132 Å²	132	113.4 Å²	113.4	71%	0.706	55%	0.547	S	S	*	.	H	α-helix	trans	-67.9	-25.3	175.9	-75.7	-12.9	0	0	0	112.8	E525	E525-D529 VanDerWaalsContact O-CB 3.25Å; E525-D529 WeakPolarHBondContact O-CB 3.22Å; E525-D529 VanDerWaalsContact O-CG 3.28Å; E525-D529 PolarHBondContact O-N 3.03Å
530	S	46.1	Very low	48	Very low	80 Å²	80	119.4 Å²	119.4	56%	0.559	57%	0.569	S	S	*	*	H	α-helix	trans	-91.2	-11.8	176.1	62.5	0	0	0	0	115.1	N526 W527 L528	N526-S530 VanDerWaalsContact O-CB 3.25Å; N526-S530 WeakPolarHBondContact O-CB 3.11Å; N526-S530 PolarHBondContact O-N 3.49Å; N526-S530 VanDerWaalsContact O-N 3.09Å; N526-S530 PolarHBondContact O-OG 3Å; W527-S530 WeakPolarHBondContact CA-OG 3.27Å; W527-S530 PolarHBondContact O-N 3.42Å; W527-S530 PolarHBondContact O-OG 3.43Å; W527-S530 VanDerWaalsContact O-OG 3.06Å; L528-S530 VanDerWaalsContact C-N 3.27Å; L528-S530 PolarHBondContact O-N 3.11Å
531	H	44.7	Very low	48.2	Very low	130 Å²	130	123 Å²	123	60%	0.602	59%	0.587	S	S	*	*	H	α-helix	trans	-125.1	-4.7	-178	-78.9	60.8	0	0	0	114.8	W527 L528	W527-H531 HydrophobicContact CZ2-CB 4.49Å; W527-H531 AromaticContact NE1-CE1 3.93Å; W527-H531 AromaticContact NE1-ND1 3.84Å; W527-H531 WeakPolarHBondContact O-CB 3.34Å; W527-H531 PolarHBondContact O-N 3.4Å; L528-H531 PolarHBondContact O-N 3.06Å
532	L	33.2	Very low	47.9	Very low	92 Å²	92	128.1 Å²	128.1	48%	0.482	61%	0.612	S	S	.	*			trans	-106	92.5	164.7	-69.7	174.9	0	0	0	109.3	L528 M534	L528-L532 HydrophobicContact CD2-CD1 3.31Å; L528-L532 HydrophobicContact CD2-CG 4.04Å; L528-L532 VanDerWaalsContact O-CB 3.27Å; L528-L532 WeakPolarHBondContact O-CB 3.18Å; L528-L532 PolarHBondContact O-N 3.43Å; L532-M534 PolarHBondContact O-N 3.18Å
533	D	41.9	Very low	47.7	Very low	175 Å²	175	131.7 Å²	131.7	94%	0.936	63%	0.626	S	S	*	*			trans	-71.1	40.5	166.7	-131.8	2.8	0	0	0	111
534	M	45.4	Very low	47.6	Very low	78 Å²	78	130.8 Å²	130.8	38%	0.384	62%	0.622	S	S	.	*			trans	-88.1	113.2	174	-88.2	-180	38.3	0	0	108.1	L532 E536 I539	L532-M534 PolarHBondContact O-N 3.18Å; M534-E536 PolarHBondContact O-N 3.05Å; M534-I539 HydrophobicContact CE-CG1 4.13Å
535	R	50.5	Low	47.7	Very low	204 Å²	204	134.9 Å²	134.9	77%	0.77	64%	0.642	S	S	*	*			trans	-57.8	137.9	179	-57.2	-179.8	-153	-178.2	6.2	109.2	E537 E538	R535-E537 PolarHBondContact O-N 3.22Å; R535-E538 PolarHBondContact O-N 3Å
536	E	49.9	Very low	48	Very low	176 Å²	176	135.4 Å²	135.4	82%	0.822	64%	0.644	S	S	*	*	H	α-helix	trans	-39.1	-29.8	174.4	-127.9	171	171.4	0	0	114.4	M534 I539 R540	M534-E536 PolarHBondContact O-N 3.05Å; E536-I539 PolarHBondContact O-N 2.89Å; E536-R540 PolarHBondContact O-N 3.33Å
537	E	43.9	Very low	47.6	Very low	136 Å²	136	136.5 Å²	136.5	64%	0.636	65%	0.646	S	S	*	*	H	α-helix	trans	-70.1	-32.9	179.7	-153.5	139.9	-152.1	0	0	114.4	R535 R540 L541	R535-E537 PolarHBondContact O-N 3.22Å; E537-R540 PolarHBondContact O-N 3.37Å; E537-L541 WeakPolarHBondContact O-CG 3.47Å; E537-L541 PolarHBondContact O-N 3.31Å; E537-L541 VanDerWaalsContact O-N 3.09Å
538	E	48.1	Very low	47.2	Very low	106 Å²	106	135.9 Å²	135.9	50%	0.495	65%	0.652	S	S	.	*	H	α-helix	trans	-75.3	-32.2	175.5	-69.6	-176.6	162.3	0	0	111.7	R535 L541 L542	R535-E538 PolarHBondContact O-N 3Å; E538-L541 PolarHBondContact O-N 3.45Å; E538-L542 PolarHBondContact O-N 3.18Å; E538-L542 VanDerWaalsContact O-N 3.14Å
539	I	50.9	Low	47.7	Very low	81 Å²	81	140.5 Å²	140.5	42%	0.415	67%	0.671	S	S	.	*	H	α-helix	trans	-70.1	-36.8	172.8	-64	176.2	0	0	0	110.4	M534 E536 L541 L542 K543	M534-I539 HydrophobicContact CE-CG1 4.13Å; E536-I539 PolarHBondContact O-N 2.89Å; I539-L541 VanDerWaalsContact C-N 3.31Å; I539-L541 PolarHBondContact O-N 3.04Å; I539-L542 PolarHBondContact O-N 3.25Å; I539-K543 PolarHBondContact O-N 3.08Å
540	R	65.9	Low	47.7	Very low	198 Å²	198	141.1 Å²	141.1	75%	0.747	67%	0.669	S	S	*	*	H	α-helix	trans	-67	-29.5	173	-178.3	-179.6	157.1	-177.3	-6.6	113	E536 E537	E536-R540 PolarHBondContact O-N 3.33Å; E537-R540 PolarHBondContact O-N 3.37Å
541	L	54.9	Low	47.8	Very low	146 Å²	146	145.8 Å²	145.8	76%	0.764	68%	0.677	S	S	*	*	H	α-helix	trans	-81.9	-18.3	175.9	-76.1	165.7	0	0	0	113.5	E537 E538 I539	E537-L541 WeakPolarHBondContact O-CG 3.47Å; E537-L541 PolarHBondContact O-N 3.31Å; E537-L541 VanDerWaalsContact O-N 3.09Å; E538-L541 PolarHBondContact O-N 3.45Å; I539-L541 VanDerWaalsContact C-N 3.31Å; I539-L541 PolarHBondContact O-N 3.04Å
542	L	44.8	Very low	48	Very low	145 Å²	145	147.1 Å²	147.1	76%	0.759	68%	0.684	S	S	*	*	H	α-helix	trans	-93.1	-26.8	177.2	-93.2	159.1	0	0	0	114	E538 I539	E538-L542 PolarHBondContact O-N 3.18Å; E538-L542 VanDerWaalsContact O-N 3.14Å; I539-L542 PolarHBondContact O-N 3.25Å
543	K	47.2	Very low	49.4	Very low	228 Å²	228	152.1 Å²	152.1	99%	0.991	70%	0.702	S	S	*	*			trans	-78.5	0	166.6	-82	-177.2	175.9	174.8	0	110.4	I539	I539-K543 PolarHBondContact O-N 3.08Å

Retrieved 543 of 543 residues in 689.4 ms (Link to these results)

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