A0A077Z5H2_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z5H2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 505 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.5	Very low	32.6	Very low	252 Å²	252	140.8 Å²	140.8	100%	1.241	83%	0.827	S	S	*	*				0	125.5	0	-65	-168.6	-159.6	0	0	107.5
2	S	33.8	Very low	32.5	Very low	118 Å²	118	144.3 Å²	144.3	83%	0.825	82%	0.824	S	S	*	*			trans	-87.3	139.3	-178.2	169.9	0	0	0	0	110.3
3	C	32.2	Very low	32.5	Very low	121 Å²	121	143.4 Å²	143.4	82%	0.818	82%	0.815	S	S	*	*			trans	-169.5	144.4	150.8	-84.8	0	0	0	0	105.9
4	S	32.2	Very low	32.2	Very low	93 Å²	93	144.2 Å²	144.2	65%	0.65	82%	0.815	S	S	*	*			cis	172.1	131.5	-21.5	45.3	0	0	0	0	105.5
5	N	30.4	Very low	32.4	Very low	170 Å²	170	144.2 Å²	144.2	91%	0.909	81%	0.81	S	S	*	*			trans	43.4	127	145.5	-61.9	-16.1	0	0	0	122.6
6	G	28.4	Very low	32.3	Very low	76 Å²	76	141.4 Å²	141.4	78%	0.784	80%	0.802	S	S	*	*			trans	-161.3	117.7	151.6	0	0	0	0	0	111.2
7	P	35.6	Very low	32.5	Very low	122 Å²	122	143 Å²	143	79%	0.792	80%	0.799	S	S	*	*			trans	-104	164.9	-172.3	38.6	-32.7	0	0	0	114.2
8	K	35.2	Very low	32.3	Very low	196 Å²	196	143.4 Å²	143.4	85%	0.852	80%	0.799	S	S	*	*			trans	149.8	143.7	153.2	-87.8	171.4	-176	-175.1	0	109.1
9	Q	32.2	Very low	32.6	Very low	158 Å²	158	143.3 Å²	143.3	74%	0.738	80%	0.797	S	S	*	*			cis	-179.2	131.1	-5.1	-172.6	169.9	4.5	0	0	107.2
10	V	28.6	Very low	32.6	Very low	115 Å²	115	145.1 Å²	145.1	70%	0.697	80%	0.799	S	S	*	*			trans	58.4	119.9	142.4	-176.6	0	0	0	0	122.4
11	T	35.9	Very low	32.9	Very low	128 Å²	128	143.9 Å²	143.9	79%	0.785	80%	0.798	S	S	*	*				-167.1	110.9	118.5	34.1	0	0	0	0	107.9
12	K	31.2	Very low	33	Very low	183 Å²	183	140 Å²	140	80%	0.796	78%	0.781	S	S	*	*				75.3	133.6	96	-88.6	-170.9	176.3	-176	0	115.6
13	D	31.9	Very low	32.9	Very low	132 Å²	132	140.3 Å²	140.3	71%	0.706	78%	0.778	S	S	*	*			trans	85.2	99.7	165	-52	-22.2	0	0	0	116.3
14	L	28.3	Very low	33.1	Very low	155 Å²	155	140.2 Å²	140.2	81%	0.812	78%	0.776	S	S	*	*				59.4	109.5	89	-67.5	165.5	0	0	0	110.1
15	I	34.9	Very low	33.2	Very low	144 Å²	144	142.1 Å²	142.1	74%	0.738	78%	0.783	S	S	*	*				-158.7	131.2	97.4	-78.8	139.6	0	0	0	109.7
16	S	32.1	Very low	33.2	Very low	99 Å²	99	141.7 Å²	141.7	69%	0.692	78%	0.781	S	S	*	*			trans	-77.2	133.4	164.6	53.7	0	0	0	0	110	D18	S16-D18 PolarHBondContact O-N 3.05Å
17	F	34.3	Very low	33.2	Very low	169 Å²	169	146.9 Å²	146.9	74%	0.741	79%	0.785	S	S	*	*			trans	-94.7	80.9	170	-73.5	-82.4	0	0	0	109.8
18	D	29.3	Very low	33.1	Very low	150 Å²	150	150.3 Å²	150.3	80%	0.802	79%	0.793	S	S	*	*			trans	-107.3	85.4	155.5	-80.2	-34.2	0	0	0	106.6	S16	S16-D18 PolarHBondContact O-N 3.05Å
19	D	37.6	Very low	32.8	Very low	142 Å²	142	147.7 Å²	147.7	76%	0.759	79%	0.793	S	S	*	*			trans	-100.1	95.5	172.2	-76.9	-36.9	0	0	0	109
20	E	33.8	Very low	32.9	Very low	178 Å²	178	148.7 Å²	148.7	83%	0.832	80%	0.798	S	S	*	*			trans	-63.8	146.6	158.8	-70.7	-173.8	150.5	0	0	110.1	L22	E20-L22 PolarHBondContact O-N 2.86Å
21	P	38.1	Very low	32.9	Very low	120 Å²	120	148.3 Å²	148.3	78%	0.779	80%	0.8	S	S	*	*			trans	-72.4	116.9	175.3	28.7	-30.8	0	0	0	110.4	V23	P21-V23 PolarHBondContact O-N 2.8Å; P21-V23 VanDerWaalsContact O-N 3.13Å
22	L	36	Very low	32.7	Very low	172 Å²	172	148.7 Å²	148.7	90%	0.901	80%	0.802	S	S	*	*			trans	-54.2	112.2	167.8	-82.4	153.9	0	0	0	110.6	E20	E20-L22 PolarHBondContact O-N 2.86Å
23	V	33.4	Very low	32.6	Very low	123 Å²	123	145.7 Å²	145.7	75%	0.745	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-72.3	129	167.8	-178.9	0	0	0	0	108.1	P21 T25	P21-V23 PolarHBondContact O-N 2.8Å; P21-V23 VanDerWaalsContact O-N 3.13Å; V23-T25 PolarHBondContact O-N 2.97Å
24	P	36.5	Very low	32.4	Very low	120 Å²	120	148 Å²	148	78%	0.779	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-67.5	122.5	169.7	-14	28.3	0	0	0	109.4
25	T	34.2	Very low	32.7	Very low	132 Å²	132	146.1 Å²	146.1	81%	0.81	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-66	136.4	173.5	38	0	0	0	0	111.4	V23 E27	V23-T25 PolarHBondContact O-N 2.97Å; T25-E27 PolarHBondContact O-N 3.04Å
26	D	28.7	Very low	32.6	Very low	161 Å²	161	146.4 Å²	146.4	86%	0.861	81%	0.807	S	S	*	*	S	Bend	trans	-55.9	103.3	169.9	-79.1	-43.5	0	0	0	110.6
27	E	30.5	Very low	32.8	Very low	186 Å²	186	144.6 Å²	144.6	87%	0.869	79%	0.794	S	S	*	*			trans	-179.1	83.8	152.7	-104.6	172.2	-160.4	0	0	109.3	T25	T25-E27 PolarHBondContact O-N 3.04Å
28	M	32.2	Very low	32.9	Very low	194 Å²	194	142.3 Å²	142.3	96%	0.956	79%	0.789	S	S	*	*			trans	-170.4	59.5	147.7	-101.6	-176.2	116	0	0	108.8
29	V	28.2	Very low	33.4	Very low	140 Å²	140	139.6 Å²	139.6	85%	0.848	78%	0.777	S	S	*	*			trans	-89.5	98.2	162.6	176.8	0	0	0	0	107.2
30	Q	34.9	Very low	33.3	Very low	180 Å²	180	137.6 Å²	137.6	84%	0.841	77%	0.767	S	S	*	*			trans	-138.6	91.3	154.3	-76.9	-164.5	-11.4	0	0	109.6
31	S	27.9	Very low	33.6	Very low	106 Å²	106	131.9 Å²	131.9	74%	0.741	75%	0.75	S	S	*	*			trans	23.9	114.4	136.4	57.2	0	0	0	0	119.1
32	T	32.9	Very low	33.7	Very low	137 Å²	137	134.6 Å²	134.6	84%	0.84	75%	0.745	S	S	*	*			trans	-137.1	137.7	137	10.7	0	0	0	0	108.9
33	P	29.7	Very low	33.7	Very low	120 Å²	120	132.7 Å²	132.7	78%	0.779	74%	0.735	S	S	*	*			trans	-76.4	154.2	-167.4	32.1	-33.4	0	0	0	112.2
34	E	27.1	Very low	33.7	Very low	180 Å²	180	132.3 Å²	132.3	84%	0.841	73%	0.733	S	S	*	*			trans	-37.3	133.8	175.2	-60.9	175.8	152	0	0	114.2
35	P	34.5	Very low	33.4	Very low	116 Å²	116	135 Å²	135	75%	0.753	74%	0.735	S	S	*	*			trans	-90.5	113.8	152.8	31.6	-22.1	0	0	0	109
36	I	33.7	Very low	33.5	Very low	150 Å²	150	135.2 Å²	135.2	77%	0.769	74%	0.737	S	S	*	*			trans	-37.5	136.3	165.3	-66.7	158.2	0	0	0	111.9	L38	I36-L38 PolarHBondContact O-N 2.74Å; I36-L38 VanDerWaalsContact O-N 3.09Å
37	S	35.9	Very low	34	Very low	60 Å²	60	133.1 Å²	133.1	42%	0.42	73%	0.731	S	S	.	*			trans	-16	95.4	171.5	-172.6	0	0	0	0	116.2	V39 D40	S37-V39 VanDerWaalsContact C-N 3.26Å; S37-D40 VanDerWaalsContact OG-CG 3.24Å; S37-D40 PolarHBondContact OG-N 3.35Å; S37-D40 PolarHBondContact OG-OD2 2.78Å
38	L	36.4	Very low	33.9	Very low	122 Å²	122	132.1 Å²	132.1	64%	0.639	73%	0.732	S	S	*	*	S	Bend	trans	-82.1	-6.6	160.6	-90.5	157.6	0	0	0	112.2	I36	I36-L38 PolarHBondContact O-N 2.74Å; I36-L38 VanDerWaalsContact O-N 3.09Å
39	V	38.6	Very low	34	Very low	93 Å²	93	130.7 Å²	130.7	56%	0.564	73%	0.728	S	S	*	*	S	Bend	trans	-79.3	-30	-178.6	-177.9	0	0	0	0	111.3	S37	S37-V39 VanDerWaalsContact C-N 3.26Å
40	D	35.5	Very low	34.1	Very low	99 Å²	99	129.1 Å²	129.1	53%	0.529	72%	0.72	S	S	.	*	S	Bend	trans	-82.4	-18.1	179.1	-65.1	-43.5	0	0	0	113.7	S37	S37-D40 VanDerWaalsContact OG-CG 3.24Å; S37-D40 PolarHBondContact OG-N 3.35Å; S37-D40 PolarHBondContact OG-OD2 2.78Å
41	A	39.8	Very low	33.9	Very low	59 Å²	59	128.3 Å²	128.3	49%	0.488	72%	0.721	S	S	.	*	S	Bend	trans	-84.1	-13.6	176.1	0	0	0	0	0	113.8
42	W	40.3	Very low	34.2	Very low	177 Å²	177	128.6 Å²	128.6	67%	0.67	72%	0.72	S	S	*	*	S	Bend	trans	-89.6	-7.5	-176.9	-91.9	57.6	0	0	0	114.4
43	L	36.8	Very low	34.1	Very low	131 Å²	131	127.6 Å²	127.6	69%	0.686	72%	0.719	S	S	*	*	S	Bend	trans	-101.4	1.8	-176.9	-75.5	165.6	0	0	0	114.2
44	T	33.1	Very low	34.3	Very low	115 Å²	115	127.3 Å²	127.3	71%	0.706	72%	0.72	S	S	*	*	S	Bend	trans	-117	26.8	-174.1	39.7	0	0	0	0	115
45	Q	31	Very low	34.4	Very low	178 Å²	178	126.4 Å²	126.4	83%	0.832	72%	0.721	S	S	*	*			trans	-125.7	82.6	170.7	-67.3	-171.1	2.5	0	0	111.7
46	T	35.4	Very low	34.3	Very low	136 Å²	136	125.2 Å²	125.2	83%	0.834	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-88.5	122.4	153.9	26.6	0	0	0	0	108.5
47	P	38.9	Very low	34.1	Very low	116 Å²	116	123.6 Å²	123.6	75%	0.753	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-76.6	131.4	163.7	29.8	-27.4	0	0	0	109.3	L49	P47-L49 PolarHBondContact O-N 3.19Å
48	D	28.4	Very low	33.9	Very low	165 Å²	165	129.1 Å²	129.1	88%	0.882	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-51.7	121.6	171.1	-76.8	-47.9	0	0	0	111.5
49	L	34	Very low	33.6	Very low	165 Å²	165	129.2 Å²	129.2	86%	0.864	75%	0.747	S	S	*	*			trans	-142	114.2	158.6	-109.1	150.7	0	0	0	107.5	P47	P47-L49 PolarHBondContact O-N 3.19Å
50	P	30.8	Very low	33.4	Very low	106 Å²	106	130.2 Å²	130.2	69%	0.688	76%	0.755	S	S	*	*			trans	-90.2	152.2	-176.5	34.8	-32	0	0	0	112
51	L	31.9	Very low	33.4	Very low	163 Å²	163	133.1 Å²	133.1	85%	0.853	77%	0.77	S	S	*	*			trans	128.6	148.1	148	-71.9	151.4	0	0	0	113.6
52	P	33.4	Very low	33.4	Very low	112 Å²	112	134.3 Å²	134.3	73%	0.727	77%	0.772	S	S	*	*			cis	-131.5	173.5	-44.8	31.8	-13.4	0	0	0	113.2
53	S	31.2	Very low	33.9	Very low	116 Å²	116	130.1 Å²	130.1	81%	0.811	78%	0.776	S	S	*	*			trans	-40.8	139.3	177.8	57.9	0	0	0	0	118.4
54	S	33	Very low	35.1	Very low	115 Å²	115	129.8 Å²	129.8	80%	0.804	78%	0.775	S	S	*	*			trans	-155.7	132.2	140.4	123.8	0	0	0	0	110	A56	S54-A56 PolarHBondContact O-N 3.42Å
55	D	28.8	Very low	37.1	Very low	161 Å²	161	131.6 Å²	131.6	86%	0.861	78%	0.775	S	S	*	*			trans	-39.8	126	176.1	-88.7	-50.5	0	0	0	115
56	A	32.3	Very low	39.8	Very low	90 Å²	90	123.5 Å²	123.5	74%	0.744	74%	0.738	S	S	*	*			trans	-145.7	90.8	151.3	0	0	0	0	0	108.9	S54 K58	S54-A56 PolarHBondContact O-N 3.42Å; A56-K58 PolarHBondContact O-N 2.94Å
57	S	30.9	Very low	42.5	Very low	117 Å²	117	119.6 Å²	119.6	82%	0.818	72%	0.716	S	S	*	*			trans	-65.5	79.9	167.2	41.4	0	0	0	0	110.5
58	K	31.7	Very low	45	Very low	176 Å²	176	115.8 Å²	115.8	77%	0.765	69%	0.69	S	S	*	*	S	Bend	trans	-173.9	126.2	153.2	-101	168.4	-171.8	-178.9	0	104.8	A56 P60	A56-K58 PolarHBondContact O-N 2.94Å; K58-P60 VanDerWaalsContact O-CD 3.31Å; K58-P60 WeakPolarHBondContact O-CD 3.23Å; K58-P60 VanDerWaalsContact O-N 3.07Å
59	P	30.7	Very low	48	Very low	123 Å²	123	115.5 Å²	115.5	80%	0.799	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-57.3	122	170.9	24.7	-30.2	0	0	0	106.8	L61	P59-L61 PolarHBondContact O-N 3.46Å
60	P	34	Very low	50.8	Low	115 Å²	115	108.9 Å²	108.9	75%	0.747	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-59.2	127.6	168.2	25	-29.1	0	0	0	105.8	K58	K58-P60 VanDerWaalsContact O-CD 3.31Å; K58-P60 WeakPolarHBondContact O-CD 3.23Å; K58-P60 VanDerWaalsContact O-N 3.07Å
61	L	34.8	Very low	53.8	Low	160 Å²	160	103.8 Å²	103.8	84%	0.838	62%	0.615	S	S	*	*	P	Polyproline II helix	trans	-46.1	126.7	163	-82.2	146.8	0	0	0	106.4	P59 A63	P59-L61 PolarHBondContact O-N 3.46Å; L61-A63 PolarHBondContact O-N 2.95Å
62	P	39.1	Very low	56.7	Low	83 Å²	83	97 Å²	97	54%	0.539	58%	0.58	S	S	.	*	P	Polyproline II helix	trans	-59.8	117.3	-174.5	24.4	-31.1	0	0	0	107	D64	P62-D64 PolarHBondContact O-N 2.74Å
63	A	52.6	Low	59.5	Low	89 Å²	89	92 Å²	92	74%	0.736	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	5.1	-173.5	0	0	0	0	0	113.8	L61	L61-A63 PolarHBondContact O-N 2.95Å
64	D	60.8	Low	62.5	Low	125 Å²	125	86.5 Å²	86.5	67%	0.668	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.2	12.2	-164	-70.8	-28	0	0	0	115.1	P62	P62-D64 PolarHBondContact O-N 2.74Å
65	Q	75.8	Confident	65.4	Low	152 Å²	152	81 Å²	81	71%	0.71	47%	0.47	S	S	*	.	P	Polyproline II helix	trans	-96	133.8	177.3	-64.8	-170.1	3.8	0	0	112.2	K100	Q65-K100 PolarHBondContact O-NZ 3.13Å
66	L	87.6	Confident	68.4	Low	9 Å²	9	75.5 Å²	75.5	5%	0.047	44%	0.437	C	S	.	.	P	Polyproline II helix	trans	-74	127.2	173.5	-168.7	85.3	0	0	0	108.1	E70 M71 L74 V94 T98 K100 C102 L106	L66-E70 HydrophobicContact CD1-CB 4.37Å; L66-E70 HydrophobicContact CD1-CG 3.83Å; L66-E70 HydrophobicContact CG-CB 4.48Å; L66-E70 HydrophobicContact CG-CG 4.46Å; L66-M71 HydrophobicContact CD2-CB 3.96Å; L66-M71 HydrophobicContact CD2-CG 4.3Å; L66-M71 HydrophobicContact CD2-SD 3.67Å; L66-L74 HydrophobicContact CD1-CD1 4.1Å; L66-V94 HydrophobicContact CD1-CG1 4.33Å; L66-V94 HydrophobicContact CD2-CG1 3.51Å; L66-T98 HydrophobicContact CD1-CG2 3.68Å; L66-K100 HydrophobicContact CB-CB 4.26Å; L66-K100 HydrophobicContact CB-CD 4.21Å; L66-K100 HydrophobicContact CD1-CB 4.46Å; L66-K100 HydrophobicContact CD1-CD 4.15Å; L66-C102 HydrophobicContact CD2-CB 4.47Å; L66-L106 HydrophobicContact CB-CD2 3.67Å; L66-L106 HydrophobicContact CD2-CD2 3.71Å; L66-L106 HydrophobicContact CG-CD2 4.06Å; L66-L106 VanDerWaalsContact O-CD2 3.24Å; L66-L106 WeakPolarHBondContact O-CD2 3.25Å
67	S	91.4	Very high	71.3	Confident	54 Å²	54	71.4 Å²	71.4	38%	0.378	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-81	158.7	178	74.9	0	0	0	0	111.6	E69 E70 M71	S67-E69 VanDerWaalsContact C-N 3.3Å; S67-E69 PolarHBondContact O-N 3.23Å; S67-E70 PolarHBondContact O-N 3.12Å; S67-E70 VanDerWaalsContact OG-CB 3.31Å; S67-E70 WeakPolarHBondContact OG-CB 3.28Å; S67-E70 PolarHBondContact OG-N 3.13Å; S67-E70 VanDerWaalsContact OG-N 3.11Å; S67-M71 PolarHBondContact O-N 3.46Å
68	V	91.2	Very high	74.3	Confident	36 Å²	36	65.8 Å²	65.8	22%	0.218	36%	0.364	C	S	.	.	H	α-helix	trans	-58.5	-43.6	175.1	179.1	0	0	0	0	110.9	E70 M71 I72 L106 E109 A110 A113	V68-E70 PolarHBondContact O-N 3.12Å; V68-M71 WeakPolarHBondContact O-CB 3.38Å; V68-M71 PolarHBondContact O-N 2.77Å; V68-I72 HydrophobicContact CG1-CD1 4.1Å; V68-I72 VanDerWaalsContact O-CG1 3.29Å; V68-I72 WeakPolarHBondContact O-CG1 3.39Å; V68-I72 PolarHBondContact O-N 3.26Å; V68-L106 HydrophobicContact CG2-CD1 3.77Å; V68-E109 HydrophobicContact CG2-CB 4.48Å; V68-E109 HydrophobicContact CG2-CG 3.89Å; V68-A110 HydrophobicContact CG1-CB 4.18Å; V68-A113 HydrophobicContact CG1-CB 4.31Å
69	E	92	Very high	77.1	Confident	159 Å²	159	58.2 Å²	58.2	74%	0.743	33%	0.333	S	S	*	.	H	α-helix	trans	-62.1	-41.9	177.3	-66.2	168.7	172.4	0	0	112.2	S67 M71 I72 N73	S67-E69 VanDerWaalsContact C-N 3.3Å; S67-E69 PolarHBondContact O-N 3.23Å; E69-M71 VanDerWaalsContact C-N 3.35Å; E69-I72 PolarHBondContact O-N 2.86Å; E69-N73 PolarHBondContact O-N 3.49Å
70	E	93.2	Very high	80	Confident	25 Å²	25	58.2 Å²	58.2	12%	0.117	32%	0.317	C	S	.	.	H	α-helix	trans	-63.1	-43.4	175.8	-171.5	170.2	-158.9	0	0	110.8	L66 S67 V68 I72 N73 L74 K100 Y141	L66-E70 HydrophobicContact CD1-CB 4.37Å; L66-E70 HydrophobicContact CD1-CG 3.83Å; L66-E70 HydrophobicContact CG-CB 4.48Å; L66-E70 HydrophobicContact CG-CG 4.46Å; S67-E70 PolarHBondContact O-N 3.12Å; S67-E70 VanDerWaalsContact OG-CB 3.31Å; S67-E70 WeakPolarHBondContact OG-CB 3.28Å; S67-E70 PolarHBondContact OG-N 3.13Å; S67-E70 VanDerWaalsContact OG-N 3.11Å; V68-E70 PolarHBondContact O-N 3.12Å; E70-I72 PolarHBondContact O-N 2.69Å; E70-N73 PolarHBondContact O-N 3.46Å; E70-L74 HydrophobicContact CG-CD1 4.34Å; E70-L74 WeakPolarHBondContact O-CG 3.4Å; E70-L74 PolarHBondContact O-N 3.12Å; E70-K100 IonicContact OE2-NZ 2.95Å; E70-K100 PolarHBondContact OE2-NZ 2.74Å; E70-Y141 VanDerWaalsContact CG-OH 3.24Å; E70-Y141 WeakPolarHBondContact CG-OH 3.47Å; E70-Y141 PolarHBondContact OE1-OH 3.37Å
71	M	93.2	Very high	82.7	Confident	0 Å²	0	56 Å²	56	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-62.5	-42.4	176.4	-171.9	56.7	-168.2	0	0	112.3	L66 S67 V68 E69 N73 L74 L75 I90 V94 L107 A110	L66-M71 HydrophobicContact CD2-CB 3.96Å; L66-M71 HydrophobicContact CD2-CG 4.3Å; L66-M71 HydrophobicContact CD2-SD 3.67Å; S67-M71 PolarHBondContact O-N 3.46Å; V68-M71 WeakPolarHBondContact O-CB 3.38Å; V68-M71 PolarHBondContact O-N 2.77Å; E69-M71 VanDerWaalsContact C-N 3.35Å; M71-N73 VanDerWaalsContact C-N 3.32Å; M71-N73 PolarHBondContact O-N 3.09Å; M71-L74 PolarHBondContact O-N 3.36Å; M71-L75 HydrophobicContact CE-CD1 4.38Å; M71-L75 HydrophobicContact CE-CD2 3.99Å; M71-L75 HydrophobicContact CE-CG 4.01Å; M71-L75 WeakPolarHBondContact O-CG 3.46Å; M71-L75 PolarHBondContact O-N 2.71Å; M71-I90 HydrophobicContact CE-CG2 3.95Å; M71-V94 HydrophobicContact CE-CG2 3.94Å; M71-V94 HydrophobicContact SD-CB 4.49Å; M71-V94 HydrophobicContact SD-CG1 4.01Å; M71-V94 HydrophobicContact SD-CG2 3.85Å; M71-L107 HydrophobicContact CE-CB 4.11Å; M71-L107 HydrophobicContact CE-CD1 3.29Å; M71-L107 HydrophobicContact CE-CG 4.23Å; M71-A110 HydrophobicContact CB-CB 3.95Å; M71-A110 HydrophobicContact CG-CB 3.69Å
72	I	92.1	Very high	85.3	Confident	21 Å²	21	49 Å²	49	11%	0.108	26%	0.26	C	S	.	.	H	α-helix	trans	-58.5	-44.8	173.8	-72.3	172.1	0	0	0	110.9	V68 E69 E70 L74 L75 R76 A110 A113 L114	V68-I72 HydrophobicContact CG1-CD1 4.1Å; V68-I72 VanDerWaalsContact O-CG1 3.29Å; V68-I72 WeakPolarHBondContact O-CG1 3.39Å; V68-I72 PolarHBondContact O-N 3.26Å; E69-I72 PolarHBondContact O-N 2.86Å; E70-I72 PolarHBondContact O-N 2.69Å; I72-L74 VanDerWaalsContact C-N 3.33Å; I72-L74 PolarHBondContact O-N 3.28Å; I72-L75 PolarHBondContact O-N 3.39Å; I72-R76 WeakPolarHBondContact O-CG 3.34Å; I72-R76 PolarHBondContact O-N 2.99Å; I72-A110 HydrophobicContact CG1-CB 3.91Å; I72-A113 HydrophobicContact CD1-CB 3.85Å; I72-L114 HydrophobicContact CB-CD1 4.24Å; I72-L114 HydrophobicContact CD1-CD2 4.49Å; I72-L114 HydrophobicContact CD1-CG 4.16Å; I72-L114 HydrophobicContact CG1-CD1 3.88Å; I72-L114 HydrophobicContact CG1-CD2 4.42Å; I72-L114 HydrophobicContact CG1-CG 3.89Å; I72-L114 HydrophobicContact CG2-CD1 3.94Å; I72-L114 HydrophobicContact CG2-CD2 3.72Å; I72-L114 HydrophobicContact CG2-CG 4.06Å
73	N	93.4	Very high	87.6	Confident	7 Å²	7	54.6 Å²	54.6	4%	0.037	27%	0.271	C	S	.	.	H	α-helix	trans	-64.9	-38	178.7	-163.6	48.3	0	0	0	112.1	E69 E70 M71 R76 L77 Y136 E137	E69-N73 PolarHBondContact O-N 3.49Å; E70-N73 PolarHBondContact O-N 3.46Å; M71-N73 VanDerWaalsContact C-N 3.32Å; M71-N73 PolarHBondContact O-N 3.09Å; N73-R76 WeakPolarHBondContact O-CB 3.26Å; N73-R76 PolarHBondContact O-N 3.4Å; N73-L77 PolarHBondContact O-N 3.15Å; N73-Y136 WeakPolarHBondContact O-CD2 3.38Å; N73-Y136 WeakPolarHBondContact OD1-CD2 3.35Å; N73-E137 PolarHBondContact ND2-O 3.15Å; N73-E137 PolarHBondContact OD1-N 2.96Å
74	L	94.3	Very high	89.3	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-68.2	-39.6	175.4	-70.9	167.2	0	0	0	112.5	L66 E70 M71 I72 R76 L77 I78 V94 L97 T98 Y141	L66-L74 HydrophobicContact CD1-CD1 4.1Å; E70-L74 HydrophobicContact CG-CD1 4.34Å; E70-L74 WeakPolarHBondContact O-CG 3.4Å; E70-L74 PolarHBondContact O-N 3.12Å; M71-L74 PolarHBondContact O-N 3.36Å; I72-L74 VanDerWaalsContact C-N 3.33Å; I72-L74 PolarHBondContact O-N 3.28Å; L74-R76 VanDerWaalsContact C-N 3.28Å; L74-R76 PolarHBondContact O-N 3.4Å; L74-L77 HydrophobicContact CD2-CD2 4.47Å; L74-L77 WeakPolarHBondContact O-CB 2.94Å; L74-L77 PolarHBondContact O-N 3.19Å; L74-I78 VanDerWaalsContact O-CG1 3.29Å; L74-I78 WeakPolarHBondContact O-CG1 3.4Å; L74-I78 PolarHBondContact O-N 3.47Å; L74-V94 HydrophobicContact CB-CG2 4.26Å; L74-V94 HydrophobicContact CD1-CG1 3.86Å; L74-V94 HydrophobicContact CD1-CG2 4.19Å; L74-L97 HydrophobicContact CD2-CB 4.43Å; L74-L97 HydrophobicContact CD2-CD1 3.82Å; L74-T98 HydrophobicContact CD1-CG2 3.56Å; L74-Y141 HydrophobicContact CD2-CD1 4.29Å; L74-Y141 HydrophobicContact CD2-CD2 3.61Å; L74-Y141 HydrophobicContact CD2-CE1 4.23Å; L74-Y141 HydrophobicContact CD2-CE2 3.5Å; L74-Y141 VanDerWaalsContact CD2-CE2 3.5Å; L74-Y141 HydrophobicContact CD2-CG 4.02Å; L74-Y141 HydrophobicContact CG-CE2 4.16Å
75	L	92.8	Very high	90.7	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-61.4	-39.2	172.3	-71.6	173.7	0	0	0	111.6	M71 I72 I78 S79 I90 L107 A110 L111 L114 L126 L128 M131	M71-L75 HydrophobicContact CE-CD1 4.38Å; M71-L75 HydrophobicContact CE-CD2 3.99Å; M71-L75 HydrophobicContact CE-CG 4.01Å; M71-L75 WeakPolarHBondContact O-CG 3.46Å; M71-L75 PolarHBondContact O-N 2.71Å; I72-L75 PolarHBondContact O-N 3.39Å; L75-I78 PolarHBondContact O-N 3.38Å; L75-S79 WeakPolarHBondContact O-CB 3.36Å; L75-S79 PolarHBondContact O-N 3.08Å; L75-I90 HydrophobicContact CD2-CG2 3.91Å; L75-L107 HydrophobicContact CD1-CD1 3.99Å; L75-L107 HydrophobicContact CD2-CD1 3.87Å; L75-L107 HydrophobicContact CG-CD1 4.39Å; L75-A110 HydrophobicContact CD1-CB 4.33Å; L75-L111 HydrophobicContact CD1-CD2 3.88Å; L75-L111 HydrophobicContact CD1-CG 4.43Å; L75-L114 HydrophobicContact CD1-CD1 4.25Å; L75-L126 HydrophobicContact CD2-CD2 4.31Å; L75-L128 HydrophobicContact CD2-CD2 4.08Å; L75-M131 HydrophobicContact CB-SD 4.27Å
76	R	92.3	Very high	91.4	Very high	45 Å²	45	47.5 Å²	47.5	17%	0.17	21%	0.214	C	C	.	.	H	α-helix	trans	-60	-46.9	171.9	-75.8	174.6	-175.2	161.6	12.4	111.6	I72 N73 L74 S79 R80 M131 K135	I72-R76 WeakPolarHBondContact O-CG 3.34Å; I72-R76 PolarHBondContact O-N 2.99Å; N73-R76 WeakPolarHBondContact O-CB 3.26Å; N73-R76 PolarHBondContact O-N 3.4Å; L74-R76 VanDerWaalsContact C-N 3.28Å; L74-R76 PolarHBondContact O-N 3.4Å; R76-S79 PolarHBondContact O-N 3.38Å; R76-S79 PolarHBondContact O-OG 3.02Å; R76-R80 PolarHBondContact O-N 3.44Å; R76-M131 WeakPolarHBondContact CG-O 3.39Å; R76-K135 WeakPolarHBondContact CD-O 3.26Å; R76-K135 PolarHBondContact NH1-O 2.93Å
77	L	93.3	Very high	91.5	Very high	3 Å²	3	47.1 Å²	47.1	2%	0.016	21%	0.212	C	C	.	.	H	α-helix	trans	-56	-53.6	175.2	176	58.1	0	0	0	111.4	N73 L74 S79 R80 F81 L97 Y136 Y141 L142 F209	N73-L77 PolarHBondContact O-N 3.15Å; L74-L77 HydrophobicContact CD2-CD2 4.47Å; L74-L77 WeakPolarHBondContact O-CB 2.94Å; L74-L77 PolarHBondContact O-N 3.19Å; L77-S79 VanDerWaalsContact C-N 3.28Å; L77-S79 PolarHBondContact O-N 2.98Å; L77-R80 VanDerWaalsContact O-CB 3.26Å; L77-R80 WeakPolarHBondContact O-CB 3.12Å; L77-R80 PolarHBondContact O-N 3.13Å; L77-R80 VanDerWaalsContact O-N 3.09Å; L77-F81 HydrophobicContact CD1-CE2 4.17Å; L77-F81 WeakPolarHBondContact O-CD2 3.07Å; L77-L97 HydrophobicContact CD2-CD1 4.15Å; L77-Y136 HydrophobicContact CB-CD2 3.76Å; L77-Y136 HydrophobicContact CB-CE2 3.61Å; L77-Y136 HydrophobicContact CB-CG 4.49Å; L77-Y136 HydrophobicContact CD1-CE1 4.01Å; L77-Y136 HydrophobicContact CD1-CE2 4.1Å; L77-Y136 HydrophobicContact CD2-CE2 4.23Å; L77-Y136 HydrophobicContact CG-CE2 4.18Å; L77-Y141 HydrophobicContact CD2-CD2 4.4Å; L77-L142 HydrophobicContact CD1-CD1 4.06Å; L77-L142 HydrophobicContact CD2-CD1 4.13Å; L77-L142 HydrophobicContact CD2-CG 4.43Å; L77-L142 HydrophobicContact CG-CD1 4.47Å; L77-F209 HydrophobicContact CD2-CE1 4.42Å; L77-F209 HydrophobicContact CD2-CZ 4.49Å; L77-F209 HydrophobicContact CG-CE1 4.04Å
78	I	94.1	Very high	91.4	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-60	-40.4	-178.8	-63.5	167.1	0	0	0	110.8	L74 L75 R80 F81 A82 L85 I90 T93 V94 L128 F207 F209	L74-I78 VanDerWaalsContact O-CG1 3.29Å; L74-I78 WeakPolarHBondContact O-CG1 3.4Å; L74-I78 PolarHBondContact O-N 3.47Å; L75-I78 PolarHBondContact O-N 3.38Å; I78-R80 PolarHBondContact O-N 2.87Å; I78-R80 VanDerWaalsContact O-N 3.12Å; I78-F81 PolarHBondContact O-N 2.95Å; I78-A82 PolarHBondContact O-N 2.97Å; I78-L85 HydrophobicContact CG2-CD1 3.26Å; I78-I90 HydrophobicContact CD1-CG2 4.26Å; I78-T93 HydrophobicContact CD1-CG2 4.48Å; I78-V94 HydrophobicContact CD1-CG2 4.42Å; I78-L128 HydrophobicContact CB-CD1 4.33Å; I78-L128 HydrophobicContact CG2-CD1 3.56Å; I78-F207 HydrophobicContact CG2-CD1 4.02Å; I78-F207 HydrophobicContact CG2-CE1 4.17Å; I78-F209 HydrophobicContact CG1-CE1 4.07Å; I78-F209 HydrophobicContact CG1-CZ 4.06Å
79	S	91.3	Very high	91.5	Very high	17 Å²	17	51.3 Å²	51.3	12%	0.119	23%	0.226	C	C	.	.	H	α-helix	trans	-62.2	-19.3	178.9	78.6	0	0	0	0	114.4	L75 R76 L77 F81 L128	L75-S79 WeakPolarHBondContact O-CB 3.36Å; L75-S79 PolarHBondContact O-N 3.08Å; R76-S79 PolarHBondContact O-N 3.38Å; R76-S79 PolarHBondContact O-OG 3.02Å; L77-S79 VanDerWaalsContact C-N 3.28Å; L77-S79 PolarHBondContact O-N 2.98Å; S79-F81 PolarHBondContact O-N 3.06Å; S79-L128 WeakPolarHBondContact CB-O 3.27Å
80	R	90	Very high	91.6	Very high	122 Å²	122	43.7 Å²	43.7	46%	0.46	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-24.8	173.1	-65	175.9	70	173.9	2.5	112.1	R76 L77 I78 P133 Y136 E138	R76-R80 PolarHBondContact O-N 3.44Å; L77-R80 VanDerWaalsContact O-CB 3.26Å; L77-R80 WeakPolarHBondContact O-CB 3.12Å; L77-R80 PolarHBondContact O-N 3.13Å; L77-R80 VanDerWaalsContact O-N 3.09Å; I78-R80 PolarHBondContact O-N 2.87Å; I78-R80 VanDerWaalsContact O-N 3.12Å; R80-P133 HydrophobicContact CG-CB 3.6Å; R80-Y136 VanDerWaalsContact NH1-CD1 3.33Å; R80-E138 IonicContact NH1-OE2 2.7Å
81	F	90.6	Very high	91.6	Very high	70 Å²	70	43.9 Å²	43.9	31%	0.307	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-119.1	-28.5	-171	-59.8	-90.6	0	0	0	113.5	L77 I78 S79 F207 F209 L265	L77-F81 HydrophobicContact CD1-CE2 4.17Å; L77-F81 WeakPolarHBondContact O-CD2 3.07Å; I78-F81 PolarHBondContact O-N 2.95Å; S79-F81 PolarHBondContact O-N 3.06Å; F81-F207 HydrophobicContact CB-CE1 3.89Å; F81-F207 HydrophobicContact CB-CZ 3.62Å; F81-F209 AromaticContact CD2-CD1 3.57Å; F81-F209 HydrophobicContact CD2-CD1 3.57Å; F81-F209 HydrophobicContact CD2-CE1 4.25Å; F81-F209 AromaticContact CE2-CD1 3.81Å; F81-F209 HydrophobicContact CE2-CD1 3.81Å; F81-F209 HydrophobicContact CG-CD1 4.13Å; F81-L265 HydrophobicContact CE1-CD1 4.31Å; F81-L265 HydrophobicContact CZ-CD1 3.94Å
82	A	89.8	Confident	91.6	Very high	11 Å²	11	44.8 Å²	44.8	9%	0.091	20%	0.199	C	C	.	.			trans	-129.2	140.1	-179.1	0	0	0	0	0	112.3	I78 L85 F207	I78-A82 PolarHBondContact O-N 2.97Å; A82-L85 HydrophobicContact CB-CD1 3.63Å; A82-L85 HydrophobicContact CB-CG 3.89Å; A82-F207 HydrophobicContact CB-CD2 4.47Å; A82-F207 HydrophobicContact CB-CE1 4.37Å; A82-F207 HydrophobicContact CB-CE2 3.75Å; A82-F207 HydrophobicContact CB-CZ 3.68Å
83	R	87.3	Confident	91.8	Very high	202 Å²	202	43.8 Å²	43.8	76%	0.762	19%	0.194	S	C	*	.	S	Bend	trans	-91.5	-27.6	173.8	-66.9	-176.6	178.9	177.8	-0.2	113.1	F127 L128	R83-F127 HydrophobicContact CB-CE2 4.29Å; R83-F127 CarbonylContact O-C 3.48Å; R83-F127 WeakPolarHBondContact O-CA 3.09Å; R83-F127 VanDerWaalsContact O-CD2 3.29Å; R83-F127 WeakPolarHBondContact O-CD2 3.38Å; R83-L128 PolarHBondContact O-N 3.05Å
84	R	88.3	Confident	91.9	Very high	175 Å²	175	43.4 Å²	43.4	66%	0.66	19%	0.192	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-142.4	130.4	-177.7	-71	-177.7	-179.9	178.8	-0.8	109.6	M125 L126 F127	R84-M125 HydrophobicContact CB-CE 3.97Å; R84-L126 WeakPolarHBondContact CA-O 3.32Å; R84-F127 HydrophobicContact CG-CD2 3.67Å; R84-F127 HydrophobicContact CG-CE2 4.39Å
85	L	89.8	Confident	91.8	Very high	14 Å²	14	45 Å²	45	7%	0.073	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	149.6	175.5	-84.1	165.6	0	0	0	110.2	I78 A82 K89 I90 L126 L128 F207	I78-L85 HydrophobicContact CG2-CD1 3.26Å; A82-L85 HydrophobicContact CB-CD1 3.63Å; A82-L85 HydrophobicContact CB-CG 3.89Å; L85-K89 HydrophobicContact CD2-CB 4.37Å; L85-K89 HydrophobicContact CD2-CD 4.18Å; L85-I90 HydrophobicContact CB-CD1 4Å; L85-I90 HydrophobicContact CB-CG1 3.82Å; L85-I90 HydrophobicContact CD1-CG1 4.36Å; L85-L126 PolarHBondContact N-O 3.11Å; L85-L126 PolarHBondContact O-N 3.47Å; L85-L128 HydrophobicContact CD1-CD1 4.05Å; L85-F207 HydrophobicContact CD1-CB 4.04Å; L85-F207 HydrophobicContact CD1-CD1 4.07Å; L85-F207 HydrophobicContact CD1-CD2 3.88Å; L85-F207 HydrophobicContact CD1-CE2 4.36Å; L85-F207 HydrophobicContact CD1-CG 3.7Å; L85-F207 HydrophobicContact CD2-CB 4.04Å; L85-F207 HydrophobicContact CD2-CD2 3.67Å; L85-F207 HydrophobicContact CD2-CE2 4.46Å; L85-F207 HydrophobicContact CD2-CG 4.05Å; L85-F207 HydrophobicContact CG-CD2 4.31Å
86	S	90.3	Very high	91.8	Very high	28 Å²	28	45.2 Å²	45.2	20%	0.196	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	148.8	171.7	62	0	0	0	0	110.3	D88 K89 I90 N124 M125	S86-D88 PolarHBondContact O-N 3.19Å; S86-K89 PolarHBondContact O-N 3.03Å; S86-K89 VanDerWaalsContact OG-CG 3.31Å; S86-K89 WeakPolarHBondContact OG-CG 3.11Å; S86-I90 WeakPolarHBondContact O-CG1 3.22Å; S86-I90 PolarHBondContact O-N 3.26Å; S86-I90 VanDerWaalsContact O-N 3.08Å; S86-N124 WeakPolarHBondContact CA-O 3.49Å; S86-M125 VanDerWaalsContact CA-SD 3.53Å; S86-M125 PolarHBondContact N-SD 3.49Å; S86-M125 VanDerWaalsContact N-SD 3.37Å
87	I	90.3	Very high	91.9	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.005	20%	0.195	C	C	.	.	H	α-helix	trans	-55	-43.4	178.9	-72.1	167.7	0	0	0	111	K89 I90 I91 K104 L107 L120 N124	I87-K89 VanDerWaalsContact C-N 3.35Å; I87-K89 PolarHBondContact O-N 3.14Å; I87-I90 WeakPolarHBondContact O-CB 3.46Å; I87-I90 PolarHBondContact O-N 3.03Å; I87-I90 VanDerWaalsContact O-N 3.15Å; I87-I91 HydrophobicContact CG2-CD1 3.7Å; I87-I91 HydrophobicContact CG2-CG1 4.36Å; I87-I91 WeakPolarHBondContact O-CG1 3.45Å; I87-I91 PolarHBondContact O-N 3.47Å; I87-K104 HydrophobicContact CG2-CD 4.49Å; I87-K104 HydrophobicContact CG2-CG 4.34Å; I87-L107 HydrophobicContact CB-CD2 4.39Å; I87-L107 HydrophobicContact CG1-CD2 4.23Å; I87-L107 HydrophobicContact CG2-CD2 3.75Å; I87-L120 HydrophobicContact CD1-CD2 3.63Å; I87-L120 HydrophobicContact CD1-CG 4.17Å; I87-N124 HydrophobicContact CD1-CB 4.42Å; I87-N124 WeakPolarHBondContact CG1-O 3.35Å; I87-N124 PolarHBondContact N-O 3.19Å
88	D	90.1	Very high	91.8	Very high	104 Å²	104	44 Å²	44	56%	0.556	20%	0.199	S	C	*	.	H	α-helix	trans	-64.9	-38.7	-178.1	-56.8	-35.1	0	0	0	112.1	S86 I90 I91 A92	S86-D88 PolarHBondContact O-N 3.19Å; D88-I90 VanDerWaalsContact C-N 3.35Å; D88-I91 PolarHBondContact O-N 3.45Å; D88-A92 WeakPolarHBondContact O-CB 3.38Å; D88-A92 PolarHBondContact O-N 3.02Å
89	K	93.7	Very high	91.6	Very high	73 Å²	73	45.7 Å²	45.7	32%	0.317	22%	0.217	S	C	.	.	H	α-helix	trans	-65.3	-39.8	174	-73.4	-168.9	-166.8	-147	0	111.6	L85 S86 I87 T93 D204 S205	L85-K89 HydrophobicContact CD2-CB 4.37Å; L85-K89 HydrophobicContact CD2-CD 4.18Å; S86-K89 PolarHBondContact O-N 3.03Å; S86-K89 VanDerWaalsContact OG-CG 3.31Å; S86-K89 WeakPolarHBondContact OG-CG 3.11Å; I87-K89 VanDerWaalsContact C-N 3.35Å; I87-K89 PolarHBondContact O-N 3.14Å; K89-T93 VanDerWaalsContact O-CB 3.27Å; K89-T93 WeakPolarHBondContact O-CB 3.28Å; K89-T93 PolarHBondContact O-N 3.35Å; K89-T93 PolarHBondContact O-OG1 2.97Å; K89-D204 WeakPolarHBondContact CE-O 3.03Å; K89-D204 PolarHBondContact NZ-O 3.31Å; K89-S205 WeakPolarHBondContact CA-O 3.01Å; K89-S205 WeakPolarHBondContact CG-O 3.18Å
90	I	93.8	Very high	91.6	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-62.2	-48.7	176.8	-66.3	169.4	0	0	0	109.8	M71 L75 I78 L85 S86 I87 D88 T93 V94 L107 L126	M71-I90 HydrophobicContact CE-CG2 3.95Å; L75-I90 HydrophobicContact CD2-CG2 3.91Å; I78-I90 HydrophobicContact CD1-CG2 4.26Å; L85-I90 HydrophobicContact CB-CD1 4Å; L85-I90 HydrophobicContact CB-CG1 3.82Å; L85-I90 HydrophobicContact CD1-CG1 4.36Å; S86-I90 WeakPolarHBondContact O-CG1 3.22Å; S86-I90 PolarHBondContact O-N 3.26Å; S86-I90 VanDerWaalsContact O-N 3.08Å; I87-I90 WeakPolarHBondContact O-CB 3.46Å; I87-I90 PolarHBondContact O-N 3.03Å; I87-I90 VanDerWaalsContact O-N 3.15Å; D88-I90 VanDerWaalsContact C-N 3.35Å; I90-T93 PolarHBondContact O-N 2.96Å; I90-V94 HydrophobicContact CG2-CG2 4.43Å; I90-V94 WeakPolarHBondContact O-CG2 3.38Å; I90-V94 PolarHBondContact O-N 3.31Å; I90-L107 HydrophobicContact CG2-CD1 4.26Å; I90-L126 HydrophobicContact CD1-CB 3.98Å; I90-L126 HydrophobicContact CD1-CD2 3.6Å; I90-L126 HydrophobicContact CD1-CG 4.43Å
91	I	93.5	Very high	91.5	Very high	28 Å²	28	49.1 Å²	49.1	14%	0.144	23%	0.228	C	C	.	.	H	α-helix	trans	-57.1	-53.7	178	-70.8	169.9	0	0	0	110.2	I87 D88 T93 V94 D95 C102 K104	I87-I91 HydrophobicContact CG2-CD1 3.7Å; I87-I91 HydrophobicContact CG2-CG1 4.36Å; I87-I91 WeakPolarHBondContact O-CG1 3.45Å; I87-I91 PolarHBondContact O-N 3.47Å; D88-I91 PolarHBondContact O-N 3.45Å; I91-T93 VanDerWaalsContact C-N 3.26Å; I91-T93 PolarHBondContact O-N 3.13Å; I91-V94 PolarHBondContact O-N 3.29Å; I91-V94 VanDerWaalsContact O-N 3.14Å; I91-D95 WeakPolarHBondContact O-CB 3.39Å; I91-D95 PolarHBondContact O-N 3Å; I91-C102 HydrophobicContact CG2-CB 4.22Å; I91-C102 VanDerWaalsContact CG2-O 3.31Å; I91-C102 WeakPolarHBondContact CG2-O 3.44Å; I91-K104 HydrophobicContact CD1-CB 4.33Å
92	A	93.1	Very high	91.4	Very high	19 Å²	19	46 Å²	46	16%	0.157	22%	0.215	C	C	.	.	H	α-helix	trans	-60.7	-35.1	-179.7	0	0	0	0	0	112.8	D88 L96 I206	D88-A92 WeakPolarHBondContact O-CB 3.38Å; D88-A92 PolarHBondContact O-N 3.02Å; A92-L96 WeakPolarHBondContact O-CB 3.19Å; A92-L96 PolarHBondContact O-N 3.48Å; A92-I206 HydrophobicContact CB-CG1 4.11Å
93	T	95.6	Very high	91.3	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-69.5	-42.4	176.8	-54	0	0	0	0	111.4	I78 K89 I90 I91 L96 L97 F207 F209	I78-T93 HydrophobicContact CD1-CG2 4.48Å; K89-T93 VanDerWaalsContact O-CB 3.27Å; K89-T93 WeakPolarHBondContact O-CB 3.28Å; K89-T93 PolarHBondContact O-N 3.35Å; K89-T93 PolarHBondContact O-OG1 2.97Å; I90-T93 PolarHBondContact O-N 2.96Å; I91-T93 VanDerWaalsContact C-N 3.26Å; I91-T93 PolarHBondContact O-N 3.13Å; T93-L96 PolarHBondContact O-N 3.44Å; T93-L97 HydrophobicContact CG2-CD1 4.24Å; T93-L97 HydrophobicContact CG2-CG 4.39Å; T93-L97 VanDerWaalsContact O-CG 3.28Å; T93-L97 WeakPolarHBondContact O-CG 3.48Å; T93-L97 PolarHBondContact O-N 3.25Å; T93-F207 HydrophobicContact CG2-CB 4.27Å; T93-F207 WeakPolarHBondContact CG2-O 3.36Å; T93-F207 WeakPolarHBondContact OG1-CB 3.22Å; T93-F207 PolarHBondContact OG1-N 3.5Å; T93-F209 HydrophobicContact CG2-CE2 3.84Å; T93-F209 HydrophobicContact CG2-CZ 3.82Å
94	V	94.9	Very high	91.4	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-66.3	-42.8	176.8	167.8	0	0	0	0	111.1	L66 M71 L74 I78 I90 I91 L96 L97 T98 C102	L66-V94 HydrophobicContact CD1-CG1 4.33Å; L66-V94 HydrophobicContact CD2-CG1 3.51Å; M71-V94 HydrophobicContact CE-CG2 3.94Å; M71-V94 HydrophobicContact SD-CB 4.49Å; M71-V94 HydrophobicContact SD-CG1 4.01Å; M71-V94 HydrophobicContact SD-CG2 3.85Å; L74-V94 HydrophobicContact CB-CG2 4.26Å; L74-V94 HydrophobicContact CD1-CG1 3.86Å; L74-V94 HydrophobicContact CD1-CG2 4.19Å; I78-V94 HydrophobicContact CD1-CG2 4.42Å; I90-V94 HydrophobicContact CG2-CG2 4.43Å; I90-V94 WeakPolarHBondContact O-CG2 3.38Å; I90-V94 PolarHBondContact O-N 3.31Å; I91-V94 PolarHBondContact O-N 3.29Å; I91-V94 VanDerWaalsContact O-N 3.14Å; V94-L96 VanDerWaalsContact C-N 3.26Å; V94-L96 PolarHBondContact O-N 2.9Å; V94-L97 PolarHBondContact O-N 3.06Å; V94-T98 HydrophobicContact CG1-CG2 4.49Å; V94-T98 WeakPolarHBondContact O-CB 3.39Å; V94-T98 PolarHBondContact O-N 3.45Å; V94-T98 PolarHBondContact O-OG1 2.51Å; V94-C102 HydrophobicContact CB-CB 4.09Å; V94-C102 HydrophobicContact CG1-CB 3.67Å
95	D	92.6	Very high	91.4	Very high	34 Å²	34	38.4 Å²	38.4	18%	0.182	21%	0.209	C	C	.	.	H	α-helix	trans	-56.5	-43.9	172.3	-74	12.9	0	0	0	109.9	I91 G99 C102	I91-D95 WeakPolarHBondContact O-CB 3.39Å; I91-D95 PolarHBondContact O-N 3Å; D95-G99 WeakPolarHBondContact O-CA 3.17Å; D95-G99 PolarHBondContact O-N 2.93Å; D95-C102 WeakPolarHBondContact OD1-CA 3.29Å; D95-C102 WeakPolarHBondContact OD1-CB 3.26Å; D95-C102 PolarHBondContact OD1-N 2.66Å
96	L	93	Very high	91.4	Very high	3 Å²	3	38.8 Å²	38.8	2%	0.016	21%	0.211	C	C	.	.	H	α-helix	trans	-65.4	-47.8	176.3	170.2	61	0	0	0	113	A92 T93 V94 T98 Y199 I206 W208 P267 R269 I270	A92-L96 WeakPolarHBondContact O-CB 3.19Å; A92-L96 PolarHBondContact O-N 3.48Å; T93-L96 PolarHBondContact O-N 3.44Å; V94-L96 VanDerWaalsContact C-N 3.26Å; V94-L96 PolarHBondContact O-N 2.9Å; L96-T98 VanDerWaalsContact C-N 3.3Å; L96-T98 PolarHBondContact O-N 3.12Å; L96-Y199 HydrophobicContact CD1-CD2 3.48Å; L96-Y199 VanDerWaalsContact CD1-CD2 3.48Å; L96-Y199 HydrophobicContact CD1-CE2 4.12Å; L96-Y199 HydrophobicContact CD1-CG 3.79Å; L96-I206 HydrophobicContact CD2-CD1 4.11Å; L96-I206 HydrophobicContact CD2-CG2 3.81Å; L96-W208 HydrophobicContact CD2-CE3 4.44Å; L96-W208 HydrophobicContact CD2-CH2 3.44Å; L96-W208 VanDerWaalsContact CD2-CH2 3.44Å; L96-W208 HydrophobicContact CD2-CZ2 4.26Å; L96-W208 HydrophobicContact CD2-CZ3 3.54Å; L96-P267 HydrophobicContact CD2-CG 3.91Å; L96-P267 HydrophobicContact CG-CB 4.39Å; L96-P267 HydrophobicContact CG-CG 4.22Å; L96-R269 WeakPolarHBondContact O-CD 3.25Å; L96-I270 HydrophobicContact CD1-CD1 3.59Å; L96-I270 HydrophobicContact CD1-CG1 3.85Å; L96-I270 HydrophobicContact CD2-CD1 4.04Å; L96-I270 HydrophobicContact CG-CD1 4.36Å
97	L	94.7	Very high	91.4	Very high	5 Å²	5	37.4 Å²	37.4	3%	0.026	20%	0.202	C	C	.	.	H	α-helix	trans	-66.2	-34.7	-174.5	-71.2	-180	0	0	0	112.3	L74 L77 T93 V94 Y141 L142 F209 P267	L74-L97 HydrophobicContact CD2-CB 4.43Å; L74-L97 HydrophobicContact CD2-CD1 3.82Å; L77-L97 HydrophobicContact CD2-CD1 4.15Å; T93-L97 HydrophobicContact CG2-CD1 4.24Å; T93-L97 HydrophobicContact CG2-CG 4.39Å; T93-L97 VanDerWaalsContact O-CG 3.28Å; T93-L97 WeakPolarHBondContact O-CG 3.48Å; T93-L97 PolarHBondContact O-N 3.25Å; V94-L97 PolarHBondContact O-N 3.06Å; L97-Y141 HydrophobicContact CB-CD1 4.4Å; L97-L142 HydrophobicContact CD2-CD2 3.82Å; L97-F209 HydrophobicContact CD1-CE2 4.02Å; L97-F209 HydrophobicContact CD1-CZ 3.79Å; L97-F209 HydrophobicContact CD2-CE2 4.01Å; L97-F209 HydrophobicContact CG-CE2 4.36Å; L97-P267 HydrophobicContact CD2-CB 3.93Å; L97-P267 HydrophobicContact CD2-CG 4.01Å
98	T	92	Very high	91.3	Very high	17 Å²	17	40.2 Å²	40.2	10%	0.104	22%	0.216	C	C	.	.	H	α-helix	trans	-107.7	-27.2	-173.4	67.8	0	0	0	0	113.1	L66 L74 V94 L96 K100 Y141 R269	L66-T98 HydrophobicContact CD1-CG2 3.68Å; L74-T98 HydrophobicContact CD1-CG2 3.56Å; V94-T98 HydrophobicContact CG1-CG2 4.49Å; V94-T98 WeakPolarHBondContact O-CB 3.39Å; V94-T98 PolarHBondContact O-N 3.45Å; V94-T98 PolarHBondContact O-OG1 2.51Å; L96-T98 VanDerWaalsContact C-N 3.3Å; L96-T98 PolarHBondContact O-N 3.12Å; T98-K100 PolarHBondContact O-N 3.4Å; T98-K100 PolarHBondContact OG1-N 2.99Å; T98-K100 VanDerWaalsContact OG1-N 3.09Å; T98-K100 PolarHBondContact OG1-O 3.23Å; T98-Y141 HydrophobicContact CG2-CD1 4.45Å; T98-Y141 HydrophobicContact CG2-CE1 3.89Å; T98-R269 PolarHBondContact O-NH1 3.12Å
99	G	89.6	Confident	91.2	Very high	36 Å²	36	40.3 Å²	40.3	37%	0.371	21%	0.213	S	C	.	.			trans	47.7	29.3	-160.3	0	0	0	0	0	115.2	D95	D95-G99 WeakPolarHBondContact O-CA 3.17Å; D95-G99 PolarHBondContact O-N 2.93Å
100	K	90.9	Very high	91.1	Very high	50 Å²	50	36.8 Å²	36.8	22%	0.217	20%	0.198	C	C	.	.	S	Bend	trans	-101	141.1	160.1	-58	179.6	-174.5	174.1	0	107.4	Q65 L66 E70 T98 C102	Q65-K100 PolarHBondContact O-NZ 3.13Å; L66-K100 HydrophobicContact CB-CB 4.26Å; L66-K100 HydrophobicContact CB-CD 4.21Å; L66-K100 HydrophobicContact CD1-CB 4.46Å; L66-K100 HydrophobicContact CD1-CD 4.15Å; E70-K100 IonicContact OE2-NZ 2.95Å; E70-K100 PolarHBondContact OE2-NZ 2.74Å; T98-K100 PolarHBondContact O-N 3.4Å; T98-K100 PolarHBondContact OG1-N 2.99Å; T98-K100 VanDerWaalsContact OG1-N 3.09Å; T98-K100 PolarHBondContact OG1-O 3.23Å; K100-C102 PolarHBondContact O-N 3.48Å
101	R	86.8	Confident	90.7	Very high	161 Å²	161	36.8 Å²	36.8	61%	0.608	20%	0.198	S	C	*	.	P	Polyproline II helix	trans	-70.7	118.1	179	-171	177.2	-177	174.2	2.3	110.3
102	C	89.4	Confident	90.4	Very high	5 Å²	5	40.7 Å²	40.7	3%	0.034	22%	0.215	C	C	.	.	P	Polyproline II helix	trans	-86.7	124.4	171.9	-178.6	0	0	0	0	109.4	L66 I91 V94 D95 K100	L66-C102 HydrophobicContact CD2-CB 4.47Å; I91-C102 HydrophobicContact CG2-CB 4.22Å; I91-C102 VanDerWaalsContact CG2-O 3.31Å; I91-C102 WeakPolarHBondContact CG2-O 3.44Å; V94-C102 HydrophobicContact CB-CB 4.09Å; V94-C102 HydrophobicContact CG1-CB 3.67Å; D95-C102 WeakPolarHBondContact OD1-CA 3.29Å; D95-C102 WeakPolarHBondContact OD1-CB 3.26Å; D95-C102 PolarHBondContact OD1-N 2.66Å; K100-C102 PolarHBondContact O-N 3.48Å
103	T	88.6	Confident	90.1	Very high	67 Å²	67	42.9 Å²	42.9	41%	0.411	23%	0.233	S	C	.	.	P	Polyproline II helix	trans	-97.9	153	174.5	65.8	0	0	0	0	110.4	A105 L106 L107	T103-A105 PolarHBondContact O-N 2.81Å; T103-L106 PolarHBondContact O-N 2.96Å; T103-L106 PolarHBondContact OG1-N 2.74Å; T103-L107 PolarHBondContact O-N 2.62Å; T103-L107 VanDerWaalsContact O-N 3.09Å
104	K	88.1	Confident	89.5	Confident	92 Å²	92	44.7 Å²	44.7	40%	0.4	24%	0.243	S	C	.	.	H	α-helix	trans	-57.2	-34.2	173.2	-171.2	172.2	-176.8	170.2	0	111.8	I87 I91 L107 I108 N124	I87-K104 HydrophobicContact CG2-CD 4.49Å; I87-K104 HydrophobicContact CG2-CG 4.34Å; I91-K104 HydrophobicContact CD1-CB 4.33Å; K104-L107 PolarHBondContact O-N 3.09Å; K104-I108 HydrophobicContact CG-CD1 4.03Å; K104-I108 VanDerWaalsContact O-CG1 3.24Å; K104-I108 WeakPolarHBondContact O-CG1 3.44Å; K104-I108 PolarHBondContact O-N 2.96Å; K104-N124 PolarHBondContact NZ-OD1 2.88Å
105	A	88.4	Confident	88.8	Confident	69 Å²	69	53.5 Å²	53.5	57%	0.57	28%	0.284	S	S	*	.	H	α-helix	trans	-62.5	-47.9	176.9	0	0	0	0	0	112.1	T103 L107 I108 E109	T103-A105 PolarHBondContact O-N 2.81Å; A105-L107 PolarHBondContact O-N 3.42Å; A105-I108 PolarHBondContact O-N 2.91Å; A105-E109 PolarHBondContact O-N 3.43Å
106	L	91	Very high	87.8	Confident	22 Å²	22	52.6 Å²	52.6	12%	0.115	28%	0.281	C	S	.	.	H	α-helix	trans	-63.8	-40.8	177.6	-179.3	66.9	0	0	0	112.1	L66 V68 T103 I108 E109 A110	L66-L106 HydrophobicContact CB-CD2 3.67Å; L66-L106 HydrophobicContact CD2-CD2 3.71Å; L66-L106 HydrophobicContact CG-CD2 4.06Å; L66-L106 VanDerWaalsContact O-CD2 3.24Å; L66-L106 WeakPolarHBondContact O-CD2 3.25Å; V68-L106 HydrophobicContact CG2-CD1 3.77Å; T103-L106 PolarHBondContact O-N 2.96Å; T103-L106 PolarHBondContact OG1-N 2.74Å; L106-I108 VanDerWaalsContact C-N 3.34Å; L106-I108 PolarHBondContact O-N 3.46Å; L106-E109 PolarHBondContact O-N 2.97Å; L106-A110 PolarHBondContact O-N 3.44Å
107	L	90.2	Very high	86.4	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-59.4	-46.6	173.8	171	64	0	0	0	110.8	M71 L75 I87 I90 T103 K104 A105 E109 A110 L111	M71-L107 HydrophobicContact CE-CB 4.11Å; M71-L107 HydrophobicContact CE-CD1 3.29Å; M71-L107 HydrophobicContact CE-CG 4.23Å; L75-L107 HydrophobicContact CD1-CD1 3.99Å; L75-L107 HydrophobicContact CD2-CD1 3.87Å; L75-L107 HydrophobicContact CG-CD1 4.39Å; I87-L107 HydrophobicContact CB-CD2 4.39Å; I87-L107 HydrophobicContact CG1-CD2 4.23Å; I87-L107 HydrophobicContact CG2-CD2 3.75Å; I90-L107 HydrophobicContact CG2-CD1 4.26Å; T103-L107 PolarHBondContact O-N 2.62Å; T103-L107 VanDerWaalsContact O-N 3.09Å; K104-L107 PolarHBondContact O-N 3.09Å; A105-L107 PolarHBondContact O-N 3.42Å; L107-E109 PolarHBondContact O-N 3.19Å; L107-A110 PolarHBondContact O-N 3.32Å; L107-L111 HydrophobicContact CD1-CD1 4.1Å; L107-L111 HydrophobicContact CD1-CG 4.21Å; L107-L111 HydrophobicContact CG-CD1 4.09Å; L107-L111 VanDerWaalsContact O-CG 3.24Å; L107-L111 WeakPolarHBondContact O-CG 3.33Å; L107-L111 PolarHBondContact O-N 3.39Å
108	I	86.9	Confident	84.8	Confident	59 Å²	59	65.3 Å²	65.3	30%	0.303	34%	0.342	S	S	.	.	H	α-helix	trans	-59.6	-48.5	177.5	-70.3	165	0	0	0	109.9	K104 A105 L106 A110 L111 Q112	K104-I108 HydrophobicContact CG-CD1 4.03Å; K104-I108 VanDerWaalsContact O-CG1 3.24Å; K104-I108 WeakPolarHBondContact O-CG1 3.44Å; K104-I108 PolarHBondContact O-N 2.96Å; A105-I108 PolarHBondContact O-N 2.91Å; L106-I108 VanDerWaalsContact C-N 3.34Å; L106-I108 PolarHBondContact O-N 3.46Å; I108-A110 VanDerWaalsContact C-N 3.33Å; I108-A110 PolarHBondContact O-N 3.23Å; I108-L111 CarbonylContact O-C 3.58Å; I108-L111 WeakPolarHBondContact O-CA 3.33Å; I108-L111 WeakPolarHBondContact O-CB 3.38Å; I108-L111 PolarHBondContact O-N 2.85Å; I108-Q112 HydrophobicContact CG2-CG 4.15Å; I108-Q112 WeakPolarHBondContact O-CG 3.18Å; I108-Q112 PolarHBondContact O-N 3.43Å
109	E	89.2	Confident	83.1	Confident	106 Å²	106	65.6 Å²	65.6	50%	0.495	35%	0.345	S	S	.	.	H	α-helix	trans	-54.4	-46.7	178.1	-168.9	176	176.9	0	0	112.2	V68 A105 L106 L107 L111 Q112 A113	V68-E109 HydrophobicContact CG2-CB 4.48Å; V68-E109 HydrophobicContact CG2-CG 3.89Å; A105-E109 PolarHBondContact O-N 3.43Å; L106-E109 PolarHBondContact O-N 2.97Å; L107-E109 PolarHBondContact O-N 3.19Å; E109-L111 VanDerWaalsContact C-N 3.32Å; E109-L111 PolarHBondContact O-N 3.26Å; E109-Q112 WeakPolarHBondContact O-CB 3.39Å; E109-Q112 PolarHBondContact O-N 2.9Å; E109-Q112 VanDerWaalsContact O-N 3.16Å; E109-A113 PolarHBondContact O-N 3.41Å
110	A	89.8	Confident	81.7	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-61.7	-37.8	174.9	0	0	0	0	0	113	V68 M71 I72 L75 L106 L107 I108 A113 L114	V68-A110 HydrophobicContact CG1-CB 4.18Å; M71-A110 HydrophobicContact CB-CB 3.95Å; M71-A110 HydrophobicContact CG-CB 3.69Å; I72-A110 HydrophobicContact CG1-CB 3.91Å; L75-A110 HydrophobicContact CD1-CB 4.33Å; L106-A110 PolarHBondContact O-N 3.44Å; L107-A110 PolarHBondContact O-N 3.32Å; I108-A110 VanDerWaalsContact C-N 3.33Å; I108-A110 PolarHBondContact O-N 3.23Å; A110-A113 PolarHBondContact O-N 3.46Å; A110-L114 WeakPolarHBondContact O-CG 3.48Å; A110-L114 PolarHBondContact O-N 3.28Å; A110-L114 VanDerWaalsContact O-N 3.09Å
111	L	86.8	Confident	80.2	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-69.1	-33.6	175.1	-65.6	170.9	0	0	0	112.5	L75 L107 I108 E109 L114 E115 A116 L120 L126 M131	L75-L111 HydrophobicContact CD1-CD2 3.88Å; L75-L111 HydrophobicContact CD1-CG 4.43Å; L107-L111 HydrophobicContact CD1-CD1 4.1Å; L107-L111 HydrophobicContact CD1-CG 4.21Å; L107-L111 HydrophobicContact CG-CD1 4.09Å; L107-L111 VanDerWaalsContact O-CG 3.24Å; L107-L111 WeakPolarHBondContact O-CG 3.33Å; L107-L111 PolarHBondContact O-N 3.39Å; I108-L111 CarbonylContact O-C 3.58Å; I108-L111 WeakPolarHBondContact O-CA 3.33Å; I108-L111 WeakPolarHBondContact O-CB 3.38Å; I108-L111 PolarHBondContact O-N 2.85Å; E109-L111 VanDerWaalsContact C-N 3.32Å; E109-L111 PolarHBondContact O-N 3.26Å; L111-L114 PolarHBondContact O-N 2.84Å; L111-E115 PolarHBondContact O-N 3.37Å; L111-A116 HydrophobicContact CD2-CB 4.4Å; L111-A116 PolarHBondContact O-N 3.49Å; L111-L120 HydrophobicContact CD1-CD1 3.7Å; L111-L126 HydrophobicContact CD1-CD1 3.53Å; L111-L126 HydrophobicContact CD1-CD2 4.08Å; L111-L126 HydrophobicContact CD1-CG 4.46Å; L111-L126 HydrophobicContact CD2-CD1 3.92Å; L111-L126 HydrophobicContact CD2-CD2 3.82Å; L111-L126 HydrophobicContact CD2-CG 4.44Å; L111-L126 HydrophobicContact CG-CD1 4.38Å; L111-M131 HydrophobicContact CD2-CE 3.38Å; L111-M131 HydrophobicContact CD2-SD 4.46Å
112	Q	86	Confident	78.8	Confident	109 Å²	109	69.7 Å²	69.7	51%	0.509	37%	0.369	S	S	.	.	H	α-helix	trans	-64.8	-46.8	173.3	-40.2	-156.8	-54.6	0	0	110.6	I108 E109 L114 E115 I117	I108-Q112 HydrophobicContact CG2-CG 4.15Å; I108-Q112 WeakPolarHBondContact O-CG 3.18Å; I108-Q112 PolarHBondContact O-N 3.43Å; E109-Q112 WeakPolarHBondContact O-CB 3.39Å; E109-Q112 PolarHBondContact O-N 2.9Å; E109-Q112 VanDerWaalsContact O-N 3.16Å; Q112-L114 PolarHBondContact O-N 3.2Å; Q112-E115 PolarHBondContact O-N 3.1Å; Q112-I117 HydrophobicContact CB-CD1 3.63Å; Q112-I117 HydrophobicContact CB-CG1 4.07Å; Q112-I117 HydrophobicContact CG-CD1 3.3Å; Q112-I117 HydrophobicContact CG-CG1 3.74Å
113	A	86.7	Confident	77.5	Confident	65 Å²	65	74.4 Å²	74.4	54%	0.537	40%	0.397	S	S	.	.	H	α-helix	trans	-63.2	-24.2	177.4	0	0	0	0	0	113.3	V68 I72 E109 A110	V68-A113 HydrophobicContact CG1-CB 4.31Å; I72-A113 HydrophobicContact CD1-CB 3.85Å; E109-A113 PolarHBondContact O-N 3.41Å; A110-A113 PolarHBondContact O-N 3.46Å
114	L	83.8	Confident	77	Confident	39 Å²	39	74.5 Å²	74.5	20%	0.204	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	3	173.7	-74.3	172.6	0	0	0	114.1	I72 L75 A110 L111 Q112 A116 M131	I72-L114 HydrophobicContact CB-CD1 4.24Å; I72-L114 HydrophobicContact CD1-CD2 4.49Å; I72-L114 HydrophobicContact CD1-CG 4.16Å; I72-L114 HydrophobicContact CG1-CD1 3.88Å; I72-L114 HydrophobicContact CG1-CD2 4.42Å; I72-L114 HydrophobicContact CG1-CG 3.89Å; I72-L114 HydrophobicContact CG2-CD1 3.94Å; I72-L114 HydrophobicContact CG2-CD2 3.72Å; I72-L114 HydrophobicContact CG2-CG 4.06Å; L75-L114 HydrophobicContact CD1-CD1 4.25Å; A110-L114 WeakPolarHBondContact O-CG 3.48Å; A110-L114 PolarHBondContact O-N 3.28Å; A110-L114 VanDerWaalsContact O-N 3.09Å; L111-L114 PolarHBondContact O-N 2.84Å; Q112-L114 PolarHBondContact O-N 3.2Å; L114-A116 HydrophobicContact CB-CB 4.11Å; L114-A116 PolarHBondContact O-N 3.39Å; L114-M131 HydrophobicContact CD1-SD 3.4Å; L114-M131 WeakPolarHBondContact CD1-SD 3.45Å
115	E	79.4	Confident	76.7	Confident	184 Å²	184	73.2 Å²	73.2	86%	0.86	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.3	32.9	-174	-58.5	176.6	170.1	0	0	112.1	L111 Q112	L111-E115 PolarHBondContact O-N 3.37Å; Q112-E115 PolarHBondContact O-N 3.1Å
116	A	73.3	Confident	76.5	Confident	15 Å²	15	70 Å²	70	12%	0.124	36%	0.364	C	S	.	.			trans	-115.1	9.6	-170.5	0	0	0	0	0	113.5	L111 L114 E118 S119 M131	L111-A116 HydrophobicContact CD2-CB 4.4Å; L111-A116 PolarHBondContact O-N 3.49Å; L114-A116 HydrophobicContact CB-CB 4.11Å; L114-A116 PolarHBondContact O-N 3.39Å; A116-E118 PolarHBondContact O-N 3.28Å; A116-S119 VanDerWaalsContact O-CB 3.3Å; A116-S119 WeakPolarHBondContact O-CB 3.38Å; A116-S119 PolarHBondContact O-N 3.1Å; A116-S119 PolarHBondContact O-OG 2.97Å; A116-M131 HydrophobicContact CB-CE 3.68Å
117	I	62.3	Low	76.1	Confident	77 Å²	77	73 Å²	73	40%	0.395	38%	0.377	S	S	.	.	G	3₁₀ helix	trans	-55.5	-36.4	-178.1	-68.2	170.8	0	0	0	112.4	Q112 S119 L120	Q112-I117 HydrophobicContact CB-CD1 3.63Å; Q112-I117 HydrophobicContact CB-CG1 4.07Å; Q112-I117 HydrophobicContact CG-CD1 3.3Å; Q112-I117 HydrophobicContact CG-CG1 3.74Å; I117-S119 PolarHBondContact O-N 3.13Å; I117-L120 WeakPolarHBondContact O-CB 3.47Å; I117-L120 PolarHBondContact O-N 2.78Å
118	E	60.8	Low	75.7	Confident	199 Å²	199	73.1 Å²	73.1	93%	0.93	38%	0.377	S	S	*	.	G	3₁₀ helix	trans	-59.9	-13	-179.2	-62.1	-175	173.5	0	0	113.2	A116 L120	A116-E118 PolarHBondContact O-N 3.28Å; E118-L120 VanDerWaalsContact C-N 3.33Å
119	S	57.2	Low	74.9	Confident	23 Å²	23	72.6 Å²	72.6	16%	0.161	39%	0.387	C	S	.	.	G	3₁₀ helix	trans	-82.9	-1.4	177.3	70.4	0	0	0	0	115.2	A116 I117 T121 L126 F127	A116-S119 VanDerWaalsContact O-CB 3.3Å; A116-S119 WeakPolarHBondContact O-CB 3.38Å; A116-S119 PolarHBondContact O-N 3.1Å; A116-S119 PolarHBondContact O-OG 2.97Å; I117-S119 PolarHBondContact O-N 3.13Å; S119-T121 PolarHBondContact O-N 3.04Å; S119-L126 VanDerWaalsContact OG-CD1 3.29Å; S119-L126 WeakPolarHBondContact OG-CD1 3.47Å; S119-F127 PolarHBondContact O-N 3.28Å
120	L	60	Low	73.9	Confident	57 Å²	57	70 Å²	70	30%	0.298	39%	0.388	S	S	.	.	B	Isolated β-bridge	trans	-83.6	101.4	174.7	-123.3	131.9	0	0	0	109.2	I87 L111 I117 E118 L126	I87-L120 HydrophobicContact CD1-CD2 3.63Å; I87-L120 HydrophobicContact CD1-CG 4.17Å; L111-L120 HydrophobicContact CD1-CD1 3.7Å; I117-L120 WeakPolarHBondContact O-CB 3.47Å; I117-L120 PolarHBondContact O-N 2.78Å; E118-L120 VanDerWaalsContact C-N 3.33Å; L120-L126 HydrophobicContact CD1-CD1 4.4Å; L120-L126 HydrophobicContact CG-CD1 4.45Å
121	T	59.9	Low	73.2	Confident	72 Å²	72	70 Å²	70	44%	0.442	39%	0.388	S	S	.	.			trans	-79.9	157.2	175	56.4	0	0	0	0	110.9	S119 T123 N124 M125	S119-T121 PolarHBondContact O-N 3.04Å; T121-T123 PolarHBondContact O-N 3.13Å; T121-T123 PolarHBondContact OG1-OG1 3.49Å; T121-N124 PolarHBondContact O-N 2.93Å; T121-M125 PolarHBondContact N-O 3.25Å; T121-M125 PolarHBondContact OG1-O 2.91Å; T121-M125 VanDerWaalsContact OG1-O 3.14Å
122	E	57	Low	72.9	Confident	204 Å²	204	76.9 Å²	76.9	95%	0.953	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-21	176.3	-66.8	-177	162.7	0	0	113.4	N124	E122-N124 VanDerWaalsContact C-N 3.32Å; E122-N124 PolarHBondContact O-N 3.39Å
123	T	62.5	Low	72.2	Confident	103 Å²	103	74.2 Å²	74.2	63%	0.632	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	14.2	-178.8	51.4	0	0	0	0	115.6	T121 M125	T121-T123 PolarHBondContact O-N 3.13Å; T121-T123 PolarHBondContact OG1-OG1 3.49Å; T123-M125 PolarHBondContact O-N 3.45Å; T123-M125 VanDerWaalsContact O-N 3.1Å
124	N	77.7	Confident	71.8	Confident	70 Å²	70	78.1 Å²	78.1	37%	0.374	41%	0.413	S	S	.	.	S	Bend	trans	56.5	21.2	-173.6	-79.6	-32.5	0	0	0	113.8	S86 I87 K104 T121 E122	S86-N124 WeakPolarHBondContact CA-O 3.49Å; I87-N124 HydrophobicContact CD1-CB 4.42Å; I87-N124 WeakPolarHBondContact CG1-O 3.35Å; I87-N124 PolarHBondContact N-O 3.19Å; K104-N124 PolarHBondContact NZ-OD1 2.88Å; T121-N124 PolarHBondContact O-N 2.93Å; E122-N124 VanDerWaalsContact C-N 3.32Å; E122-N124 PolarHBondContact O-N 3.39Å
125	M	82.5	Confident	71.9	Confident	64 Å²	64	80.9 Å²	80.9	32%	0.315	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	137.8	175.4	-69.5	-68.3	-67	0	0	109.8	R84 S86 T121 T123	R84-M125 HydrophobicContact CB-CE 3.97Å; S86-M125 VanDerWaalsContact CA-SD 3.53Å; S86-M125 PolarHBondContact N-SD 3.49Å; S86-M125 VanDerWaalsContact N-SD 3.37Å; T121-M125 PolarHBondContact N-O 3.25Å; T121-M125 PolarHBondContact OG1-O 2.91Å; T121-M125 VanDerWaalsContact OG1-O 3.14Å; T123-M125 PolarHBondContact O-N 3.45Å; T123-M125 VanDerWaalsContact O-N 3.1Å
126	L	83.3	Confident	72.2	Confident	1 Å²	1	73.2 Å²	73.2	1%	0.005	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	129.7	177.7	-174.4	73.2	0	0	0	110.2	L75 R84 L85 I90 L111 S119 L120 L128	L75-L126 HydrophobicContact CD2-CD2 4.31Å; R84-L126 WeakPolarHBondContact CA-O 3.32Å; L85-L126 PolarHBondContact N-O 3.11Å; L85-L126 PolarHBondContact O-N 3.47Å; I90-L126 HydrophobicContact CD1-CB 3.98Å; I90-L126 HydrophobicContact CD1-CD2 3.6Å; I90-L126 HydrophobicContact CD1-CG 4.43Å; L111-L126 HydrophobicContact CD1-CD1 3.53Å; L111-L126 HydrophobicContact CD1-CD2 4.08Å; L111-L126 HydrophobicContact CD1-CG 4.46Å; L111-L126 HydrophobicContact CD2-CD1 3.92Å; L111-L126 HydrophobicContact CD2-CD2 3.82Å; L111-L126 HydrophobicContact CD2-CG 4.44Å; L111-L126 HydrophobicContact CG-CD1 4.38Å; S119-L126 VanDerWaalsContact OG-CD1 3.29Å; S119-L126 WeakPolarHBondContact OG-CD1 3.47Å; L120-L126 HydrophobicContact CD1-CD1 4.4Å; L120-L126 HydrophobicContact CG-CD1 4.45Å; L126-L128 HydrophobicContact CD2-CD2 3.55Å; L126-L128 HydrophobicContact CD2-CG 4.5Å; L126-L128 HydrophobicContact CG-CD2 4.17Å
127	F	83	Confident	73	Confident	87 Å²	87	78.8 Å²	78.8	38%	0.382	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	115	171.4	-174.8	-105.1	0	0	0	111.4	R83 R84 S119	R83-F127 HydrophobicContact CB-CE2 4.29Å; R83-F127 CarbonylContact O-C 3.48Å; R83-F127 WeakPolarHBondContact O-CA 3.09Å; R83-F127 VanDerWaalsContact O-CD2 3.29Å; R83-F127 WeakPolarHBondContact O-CD2 3.38Å; R84-F127 HydrophobicContact CG-CD2 3.67Å; R84-F127 HydrophobicContact CG-CE2 4.39Å; S119-F127 PolarHBondContact O-N 3.28Å
128	L	81.9	Confident	73.9	Confident	1 Å²	1	80.9 Å²	80.9	1%	0.005	42%	0.418	C	S	.	.	G	3₁₀ helix	trans	-90.4	1.9	-173.5	-64.6	173.8	0	0	0	114	L75 I78 S79 R83 L85 L126 G130 M131	L75-L128 HydrophobicContact CD2-CD2 4.08Å; I78-L128 HydrophobicContact CB-CD1 4.33Å; I78-L128 HydrophobicContact CG2-CD1 3.56Å; S79-L128 WeakPolarHBondContact CB-O 3.27Å; R83-L128 PolarHBondContact O-N 3.05Å; L85-L128 HydrophobicContact CD1-CD1 4.05Å; L126-L128 HydrophobicContact CD2-CD2 3.55Å; L126-L128 HydrophobicContact CD2-CG 4.5Å; L126-L128 HydrophobicContact CG-CD2 4.17Å; L128-G130 PolarHBondContact O-N 2.91Å; L128-G130 VanDerWaalsContact O-N 3.13Å; L128-M131 HydrophobicContact CB-CG 4.21Å; L128-M131 HydrophobicContact CD2-CE 4.25Å; L128-M131 HydrophobicContact CD2-CG 3.98Å; L128-M131 WeakPolarHBondContact O-CB 3.42Å; L128-M131 VanDerWaalsContact O-CG 3.24Å; L128-M131 WeakPolarHBondContact O-CG 3.47Å; L128-M131 PolarHBondContact O-N 3.04Å; L128-M131 VanDerWaalsContact O-N 3.13Å
129	G	69.4	Low	75.1	Confident	48 Å²	48	75.3 Å²	75.3	50%	0.495	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-60.8	-25	-175.4	0	0	0	0	0	114.7
130	G	68.4	Low	76.5	Confident	51 Å²	51	80.5 Å²	80.5	53%	0.526	42%	0.417	S	S	.	.	G	3₁₀ helix	trans	-81.3	-7.5	178.9	0	0	0	0	0	115.2	L128 R132	L128-G130 PolarHBondContact O-N 2.91Å; L128-G130 VanDerWaalsContact O-N 3.13Å; G130-R132 PolarHBondContact O-N 3.26Å
131	M	76.4	Confident	78.2	Confident	1 Å²	1	78.7 Å²	78.7	1%	0.005	41%	0.406	C	S	.	.	S	Bend	trans	-73.3	-5.3	-165.5	-60.5	-60	156.7	0	0	114.5	L75 R76 L111 L114 A116 L128	L75-M131 HydrophobicContact CB-SD 4.27Å; R76-M131 WeakPolarHBondContact CG-O 3.39Å; L111-M131 HydrophobicContact CD2-CE 3.38Å; L111-M131 HydrophobicContact CD2-SD 4.46Å; L114-M131 HydrophobicContact CD1-SD 3.4Å; L114-M131 WeakPolarHBondContact CD1-SD 3.45Å; A116-M131 HydrophobicContact CB-CE 3.68Å; L128-M131 HydrophobicContact CB-CG 4.21Å; L128-M131 HydrophobicContact CD2-CE 4.25Å; L128-M131 HydrophobicContact CD2-CG 3.98Å; L128-M131 WeakPolarHBondContact O-CB 3.42Å; L128-M131 VanDerWaalsContact O-CG 3.24Å; L128-M131 WeakPolarHBondContact O-CG 3.47Å; L128-M131 PolarHBondContact O-N 3.04Å; L128-M131 VanDerWaalsContact O-N 3.13Å
132	R	78.7	Confident	79.8	Confident	145 Å²	145	76.1 Å²	76.1	55%	0.547	39%	0.39	S	S	.	.			trans	53.5	69.3	-178.5	-59.1	-172.8	-166.3	-175.2	10.6	112.1	G130 H134 K135	G130-R132 PolarHBondContact O-N 3.26Å; R132-H134 PolarHBondContact O-N 3.11Å; R132-K135 HydrophobicContact CB-CG 4.39Å; R132-K135 PolarHBondContact O-N 2.82Å
133	P	72.8	Confident	81.6	Confident	52 Å²	52	66.5 Å²	66.5	34%	0.338	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-55.9	-24.5	-174.6	18.1	-31.4	0	0	0	114.8	R80 K135 Y136	R80-P133 HydrophobicContact CG-CB 3.6Å; P133-K135 PolarHBondContact O-N 3.09Å; P133-Y136 VanDerWaalsContact O-CB 3.3Å; P133-Y136 WeakPolarHBondContact O-CB 3.49Å; P133-Y136 PolarHBondContact O-N 2.83Å
134	H	78.3	Confident	82.8	Confident	148 Å²	148	65.4 Å²	65.4	69%	0.685	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-68.3	-14.3	176.6	62.2	-91.2	0	0	0	114	R132	R132-H134 PolarHBondContact O-N 3.11Å
135	K	84.5	Confident	83.5	Confident	96 Å²	96	64 Å²	64	42%	0.417	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-95.4	12.1	173.8	-63.7	-165.3	171.9	-168.6	0	113	R76 R132 P133 E137	R76-K135 WeakPolarHBondContact CD-O 3.26Å; R76-K135 PolarHBondContact NH1-O 2.93Å; R132-K135 HydrophobicContact CB-CG 4.39Å; R132-K135 PolarHBondContact O-N 2.82Å; P133-K135 PolarHBondContact O-N 3.09Å; K135-E137 PolarHBondContact O-N 3.5Å
136	Y	86.8	Confident	83.9	Confident	23 Å²	23	64.7 Å²	64.7	9%	0.09	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-65.9	124.9	170.1	170.4	-113.5	0	0	0	108.8	N73 L77 R80 P133 E138 K139	N73-Y136 WeakPolarHBondContact O-CD2 3.38Å; N73-Y136 WeakPolarHBondContact OD1-CD2 3.35Å; L77-Y136 HydrophobicContact CB-CD2 3.76Å; L77-Y136 HydrophobicContact CB-CE2 3.61Å; L77-Y136 HydrophobicContact CB-CG 4.49Å; L77-Y136 HydrophobicContact CD1-CE1 4.01Å; L77-Y136 HydrophobicContact CD1-CE2 4.1Å; L77-Y136 HydrophobicContact CD2-CE2 4.23Å; L77-Y136 HydrophobicContact CG-CE2 4.18Å; R80-Y136 VanDerWaalsContact NH1-CD1 3.33Å; P133-Y136 VanDerWaalsContact O-CB 3.3Å; P133-Y136 WeakPolarHBondContact O-CB 3.49Å; P133-Y136 PolarHBondContact O-N 2.83Å; Y136-E138 HydrophobicContact CE1-CB 4.25Å; Y136-E138 HydrophobicContact CE1-CG 4.29Å; Y136-K139 PolarHBondContact OH-N 3.42Å; Y136-K139 PolarHBondContact OH-O 3.14Å
137	E	88.7	Confident	84.2	Confident	133 Å²	133	68 Å²	68	62%	0.621	35%	0.354	S	S	*	.	P	Polyproline II helix	trans	-89.5	116.5	170.1	-67.7	176.4	-174.6	0	0	107.9	N73 K135 K139	N73-E137 PolarHBondContact ND2-O 3.15Å; N73-E137 PolarHBondContact OD1-N 2.96Å; K135-E137 PolarHBondContact O-N 3.5Å; E137-K139 PolarHBondContact O-N 3.16Å; E137-K139 VanDerWaalsContact O-N 3.17Å
138	E	83.1	Confident	84.3	Confident	121 Å²	121	69.7 Å²	69.7	57%	0.565	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-58.1	120.3	-179.5	-154.4	100.5	-163.1	0	0	109.4	R80 Y136 N144	R80-E138 IonicContact NH1-OE2 2.7Å; Y136-E138 HydrophobicContact CE1-CB 4.25Å; Y136-E138 HydrophobicContact CE1-CG 4.29Å; E138-N144 PolarHBondContact OE1-ND2 3.36Å
139	K	85.5	Confident	84.6	Confident	82 Å²	82	70 Å²	70	36%	0.357	37%	0.373	S	S	.	.			trans	-124.9	161.2	170.1	-71.5	-173.6	176.1	-175.7	0	108.2	Y136 E137 Y141	Y136-K139 PolarHBondContact OH-N 3.42Å; Y136-K139 PolarHBondContact OH-O 3.14Å; E137-K139 PolarHBondContact O-N 3.16Å; E137-K139 VanDerWaalsContact O-N 3.17Å; K139-Y141 HydrophobicContact CB-CD2 3.67Å; K139-Y141 HydrophobicContact CB-CE2 3.54Å; K139-Y141 HydrophobicContact CB-CG 4.39Å; K139-Y141 HydrophobicContact CD-CD2 4.48Å; K139-Y141 HydrophobicContact CD-CE2 3.52Å; K139-Y141 VanDerWaalsContact CD-OH 3.3Å; K139-Y141 WeakPolarHBondContact CD-OH 3.25Å; K139-Y141 HydrophobicContact CG-CE2 4.08Å; K139-Y141 PolarHBondContact NZ-OH 2.99Å; K139-Y141 PolarHBondContact O-N 2.87Å
140	D	87.2	Confident	85.2	Confident	131 Å²	131	71.7 Å²	71.7	70%	0.701	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	46.3	-179.7	-51.6	-31	0	0	0	112.3	E268	D140-E268 WeakPolarHBondContact O-CB 3.38Å; D140-E268 VanDerWaalsContact O-CG 3.3Å; D140-E268 WeakPolarHBondContact O-CG 3.26Å
141	Y	93.9	Very high	85.6	Confident	20 Å²	20	71.1 Å²	71.1	8%	0.078	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-30	174	-64.3	-56.8	0	0	0	112	E70 L74 L77 L97 T98 K139 P267 E268	E70-Y141 VanDerWaalsContact CG-OH 3.24Å; E70-Y141 WeakPolarHBondContact CG-OH 3.47Å; E70-Y141 PolarHBondContact OE1-OH 3.37Å; L74-Y141 HydrophobicContact CD2-CD1 4.29Å; L74-Y141 HydrophobicContact CD2-CD2 3.61Å; L74-Y141 HydrophobicContact CD2-CE1 4.23Å; L74-Y141 HydrophobicContact CD2-CE2 3.5Å; L74-Y141 VanDerWaalsContact CD2-CE2 3.5Å; L74-Y141 HydrophobicContact CD2-CG 4.02Å; L74-Y141 HydrophobicContact CG-CE2 4.16Å; L77-Y141 HydrophobicContact CD2-CD2 4.4Å; L97-Y141 HydrophobicContact CB-CD1 4.4Å; T98-Y141 HydrophobicContact CG2-CD1 4.45Å; T98-Y141 HydrophobicContact CG2-CE1 3.89Å; K139-Y141 HydrophobicContact CB-CD2 3.67Å; K139-Y141 HydrophobicContact CB-CE2 3.54Å; K139-Y141 HydrophobicContact CB-CG 4.39Å; K139-Y141 HydrophobicContact CD-CD2 4.48Å; K139-Y141 HydrophobicContact CD-CE2 3.52Å; K139-Y141 VanDerWaalsContact CD-OH 3.3Å; K139-Y141 WeakPolarHBondContact CD-OH 3.25Å; K139-Y141 HydrophobicContact CG-CE2 4.08Å; K139-Y141 PolarHBondContact NZ-OH 2.99Å; K139-Y141 PolarHBondContact O-N 2.87Å; Y141-P267 WeakPolarHBondContact O-CA 3.24Å; Y141-E268 PolarHBondContact O-N 3.36Å
142	L	94.6	Very high	85.8	Confident	17 Å²	17	74.9 Å²	74.9	9%	0.089	37%	0.37	C	S	.	.	B	Isolated β-bridge	trans	-128.8	137.7	-178.7	-62.2	175.6	0	0	0	109.1	L77 L97 N144 F209 L265 I266 P267	L77-L142 HydrophobicContact CD1-CD1 4.06Å; L77-L142 HydrophobicContact CD2-CD1 4.13Å; L77-L142 HydrophobicContact CD2-CG 4.43Å; L77-L142 HydrophobicContact CG-CD1 4.47Å; L97-L142 HydrophobicContact CD2-CD2 3.82Å; L142-N144 PolarHBondContact O-N 2.99Å; L142-F209 HydrophobicContact CD1-CB 4.27Å; L142-F209 HydrophobicContact CD1-CD1 4Å; L142-F209 HydrophobicContact CD1-CD2 4.06Å; L142-F209 HydrophobicContact CD1-CE1 4.4Å; L142-F209 HydrophobicContact CD1-CE2 4.48Å; L142-F209 HydrophobicContact CD1-CG 3.83Å; L142-F209 HydrophobicContact CD2-CD2 3.66Å; L142-F209 HydrophobicContact CD2-CE2 4Å; L142-F209 HydrophobicContact CD2-CG 4.23Å; L142-F209 HydrophobicContact CG-CD2 4.49Å; L142-L265 HydrophobicContact CD1-CB 4.44Å; L142-L265 HydrophobicContact CD1-CD1 4.05Å; L142-L265 HydrophobicContact CD2-CB 4.39Å; L142-I266 WeakPolarHBondContact CA-O 3.2Å; L142-P267 HydrophobicContact CD2-CG 4.36Å
143	V	94.1	Very high	86.1	Confident	2 Å²	2	69.6 Å²	69.6	1%	0.012	35%	0.354	C	S	.	.			trans	-76.7	117	171.8	-176	0	0	0	0	108.9	S145 E147 P220 I266 E268 F271	V143-S145 WeakPolarHBondContact CG1-O 3.27Å; V143-E147 HydrophobicContact CG1-CG 4.49Å; V143-P220 HydrophobicContact CG1-CB 4.35Å; V143-P220 HydrophobicContact CG1-CG 4.23Å; V143-I266 HydrophobicContact CB-CG2 3.69Å; V143-I266 HydrophobicContact CG2-CG2 3.84Å; V143-I266 PolarHBondContact N-O 2.72Å; V143-E268 WeakPolarHBondContact CG2-OE2 3.43Å; V143-F271 HydrophobicContact CG2-CB 3.75Å; V143-F271 HydrophobicContact CG2-CD1 3.75Å; V143-F271 HydrophobicContact CG2-CD2 4.22Å; V143-F271 HydrophobicContact CG2-CE1 4.45Å; V143-F271 HydrophobicContact CG2-CG 3.63Å
144	N	88.6	Confident	86.8	Confident	80 Å²	80	67.5 Å²	67.5	43%	0.428	34%	0.34	S	S	.	.			trans	-117.2	3.2	179.3	64.6	9	0	0	0	112.3	E138 L142 K216	E138-N144 PolarHBondContact OE1-ND2 3.36Å; L142-N144 PolarHBondContact O-N 2.99Å; N144-K216 PolarHBondContact O-NZ 3.09Å; N144-K216 VanDerWaalsContact O-NZ 3.08Å
145	S	91.6	Very high	87.3	Confident	41 Å²	41	62.9 Å²	62.9	29%	0.287	33%	0.325	S	S	.	.	S	Bend	trans	-124.4	160.8	-172.6	108	0	0	0	0	110.8	V143 E147 L219 P220	V143-S145 WeakPolarHBondContact CG1-O 3.27Å; S145-E147 PolarHBondContact O-N 3.33Å; S145-E147 WeakPolarHBondContact OG-CG 3.43Å; S145-E147 PolarHBondContact OG-OE1 2.84Å; S145-L219 WeakPolarHBondContact O-CD1 3.22Å; S145-P220 WeakPolarHBondContact O-CD 3.12Å
146	V	91.7	Very high	87.5	Confident	79 Å²	79	59.4 Å²	59.4	48%	0.479	31%	0.312	S	S	.	.			trans	-75.9	118	177.6	172.2	0	0	0	0	107.4	P217 D218	V146-P217 WeakPolarHBondContact CG2-O 3.46Å; V146-D218 HydrophobicContact CG1-CB 3.72Å; V146-D218 HydrophobicContact CG2-CB 4.39Å
147	E	88.8	Confident	87.3	Confident	70 Å²	70	58.6 Å²	58.6	33%	0.327	31%	0.31	S	S	.	.			trans	-140.9	151.2	-177.4	-67.8	179.8	-147	0	0	110	V143 S145 P220 F271	V143-E147 HydrophobicContact CG1-CG 4.49Å; S145-E147 PolarHBondContact O-N 3.33Å; S145-E147 WeakPolarHBondContact OG-CG 3.43Å; S145-E147 PolarHBondContact OG-OE1 2.84Å; E147-P220 HydrophobicContact CB-CG 4.37Å; E147-P220 WeakPolarHBondContact O-CG 3.45Å; E147-F271 HydrophobicContact CB-CE1 3.96Å; E147-F271 HydrophobicContact CB-CE2 4.38Å; E147-F271 HydrophobicContact CB-CZ 3.52Å; E147-F271 WeakPolarHBondContact OE2-CE1 3.34Å
148	T	86.1	Confident	87	Confident	122 Å²	122	55.4 Å²	55.4	75%	0.748	30%	0.297	S	S	*	.	P	Polyproline II helix	trans	-99.7	131.5	-178.4	-48.1	0	0	0	0	109.9
149	Y	86.9	Confident	86.7	Confident	9 Å²	9	52 Å²	52	4%	0.035	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-62.7	141.3	172.8	-73.1	-87.6	0	0	0	111.3	R151 P220 R233 A234 I235 V250 I266 F271 V275	Y149-R151 PolarHBondContact O-N 3.11Å; Y149-P220 HydrophobicContact CE2-CB 3.92Å; Y149-P220 HydrophobicContact CE2-CG 4.37Å; Y149-R233 HydrophobicContact CE1-CB 4.34Å; Y149-A234 PolarHBondContact OH-O 3.17Å; Y149-I235 HydrophobicContact CD2-CD1 4.2Å; Y149-I235 HydrophobicContact CD2-CG1 4.18Å; Y149-I235 HydrophobicContact CE2-CD1 4.4Å; Y149-I235 HydrophobicContact CE2-CG1 3.86Å; Y149-V250 HydrophobicContact CD2-CB 4.46Å; Y149-V250 HydrophobicContact CD2-CG1 3.79Å; Y149-V250 HydrophobicContact CD2-CG2 4.29Å; Y149-V250 HydrophobicContact CE1-CG2 4.36Å; Y149-V250 HydrophobicContact CE2-CG1 3.85Å; Y149-V250 HydrophobicContact CE2-CG2 4.13Å; Y149-V250 HydrophobicContact CG-CG2 4.47Å; Y149-I266 HydrophobicContact CE1-CD1 4.14Å; Y149-I266 WeakPolarHBondContact OH-CD1 3.3Å; Y149-F271 AromaticContact CD1-CD2 3.74Å; Y149-F271 HydrophobicContact CD1-CD2 3.74Å; Y149-F271 AromaticContact CD1-CE2 3.72Å; Y149-F271 HydrophobicContact CD1-CE2 3.72Å; Y149-F271 HydrophobicContact CD2-CE2 4.01Å; Y149-F271 AromaticContact CE1-CD2 3.33Å; Y149-F271 HydrophobicContact CE1-CD2 3.33Å; Y149-F271 AromaticContact CE1-CE2 3.68Å; Y149-F271 HydrophobicContact CE1-CE2 3.68Å; Y149-F271 HydrophobicContact CE1-CG 4.32Å; Y149-F271 HydrophobicContact CE2-CD2 4.27Å; Y149-F271 AromaticContact CE2-CE2 3.98Å; Y149-F271 HydrophobicContact CE2-CE2 3.98Å; Y149-F271 HydrophobicContact CG-CD2 4.37Å; Y149-F271 AromaticContact CG-CE2 3.9Å; Y149-F271 HydrophobicContact CG-CE2 3.9Å; Y149-F271 AromaticContact CZ-CD2 3.64Å; Y149-F271 AromaticContact CZ-CE2 3.83Å; Y149-V275 HydrophobicContact CD1-CG2 4.07Å; Y149-V275 HydrophobicContact CG-CG2 4.03Å
150	V	82.4	Confident	86	Confident	82 Å²	82	50.6 Å²	50.6	50%	0.497	28%	0.28	S	S	.	.	P	Polyproline II helix	trans	-78.2	117.3	172.4	-168.7	0	0	0	0	109.4	Y274 V275	V150-Y274 HydrophobicContact CB-CD1 3.98Å; V150-Y274 HydrophobicContact CB-CE1 4.06Å; V150-Y274 HydrophobicContact CG1-CD1 3.72Å; V150-Y274 HydrophobicContact CG1-CE1 3.48Å; V150-Y274 VanDerWaalsContact CG1-CE1 3.48Å; V150-Y274 WeakPolarHBondContact O-CA 3.4Å; V150-V275 PolarHBondContact O-N 3.2Å
151	R	77.7	Confident	84.9	Confident	39 Å²	39	47.2 Å²	47.2	15%	0.147	27%	0.265	C	S	.	.			trans	-98.3	-17.1	-175.2	-68.9	-178.1	175.1	-135.4	-19.4	115.3	Y149 P153 E253 V275 Y278	Y149-R151 PolarHBondContact O-N 3.11Å; R151-P153 WeakPolarHBondContact O-CD 3.48Å; R151-E253 IonicContact CZ-OE1 2.67Å; R151-E253 IonicContact CZ-OE2 3.66Å; R151-E253 IonicContact NH1-OE1 3.42Å; R151-E253 PolarHBondContact NH1-OE1 3.3Å; R151-E253 IonicContact NH1-OE2 3.63Å; R151-E253 PolarHBondContact NH1-OE2 2.85Å; R151-E253 IonicContact NH2-OE1 2.85Å; R151-E253 PolarHBondContact NH2-OE1 3.42Å; R151-E253 IonicContact NH2-OE2 3.43Å; R151-V275 HydrophobicContact CG-CB 4.32Å; R151-Y278 WeakPolarHBondContact O-CE1 3.39Å; R151-Y278 PolarHBondContact O-OH 3.41Å
152	Y	80	Confident	83.3	Confident	81 Å²	81	56.6 Å²	56.6	32%	0.318	30%	0.301	S	S	.	.			trans	-110.1	67.8	-164.9	-50.9	-79.3	0	0	0	114.6	V154 L317 E318 E319 M322	Y152-V154 PolarHBondContact O-N 2.8Å; Y152-L317 HydrophobicContact CD1-CB 4.12Å; Y152-L317 HydrophobicContact CD1-CD1 4.25Å; Y152-L317 HydrophobicContact CD1-CD2 4.14Å; Y152-L317 HydrophobicContact CD1-CG 4.4Å; Y152-L317 HydrophobicContact CE1-CB 3.94Å; Y152-L317 HydrophobicContact CE1-CD2 4.47Å; Y152-E318 PolarHBondContact OH-O 3.36Å; Y152-E319 WeakPolarHBondContact OH-CA 3.44Å; Y152-M322 HydrophobicContact CD1-CE 4.29Å; Y152-M322 HydrophobicContact CE1-CE 3.26Å; Y152-M322 HydrophobicContact CE1-SD 3.62Å
153	P	85.5	Confident	81.5	Confident	34 Å²	34	59 Å²	59	22%	0.221	32%	0.319	C	S	.	.	S	Bend	trans	-75.7	13.2	161.7	37.7	-36	0	0	0	112.2	R151 R189 Y274 D276 Y278	R151-P153 WeakPolarHBondContact O-CD 3.48Å; P153-R189 PolarHBondContact O-NH1 3.01Å; P153-Y274 HydrophobicContact CB-CD1 4.02Å; P153-Y274 HydrophobicContact CB-CD2 3.96Å; P153-Y274 HydrophobicContact CB-CE1 4.46Å; P153-Y274 HydrophobicContact CB-CE2 4.42Å; P153-Y274 HydrophobicContact CB-CG 3.75Å; P153-Y274 HydrophobicContact CG-CD1 4.33Å; P153-Y274 HydrophobicContact CG-CG 4.03Å; P153-D276 VanDerWaalsContact CG-OD1 3.31Å; P153-D276 WeakPolarHBondContact CG-OD1 3.48Å; P153-Y278 WeakPolarHBondContact CD-OH 3.38Å; P153-Y278 WeakPolarHBondContact CG-OH 3.15Å
154	V	87.8	Confident	79.9	Confident	7 Å²	7	67.1 Å²	67.1	4%	0.042	36%	0.362	C	S	.	.	S	Bend	trans	-114.7	153.4	179	-64.4	0	0	0	0	110.6	Y152 Y172 Y278 F314 L317	Y152-V154 PolarHBondContact O-N 2.8Å; V154-Y172 WeakPolarHBondContact CA-OH 3.23Å; V154-Y172 HydrophobicContact CB-CD2 4.28Å; V154-Y172 HydrophobicContact CB-CE1 4.37Å; V154-Y172 HydrophobicContact CB-CE2 3.64Å; V154-Y172 HydrophobicContact CG1-CD1 4.11Å; V154-Y172 HydrophobicContact CG1-CD2 3.95Å; V154-Y172 HydrophobicContact CG1-CE1 3.91Å; V154-Y172 HydrophobicContact CG1-CE2 3.73Å; V154-Y172 HydrophobicContact CG1-CG 4.12Å; V154-Y278 HydrophobicContact CG1-CE1 4.5Å; V154-Y278 WeakPolarHBondContact CG1-OH 3.39Å; V154-Y278 HydrophobicContact CG2-CE1 3.83Å; V154-F314 HydrophobicContact CB-CD2 4Å; V154-F314 HydrophobicContact CB-CE2 3.9Å; V154-F314 HydrophobicContact CG1-CD2 4.34Å; V154-F314 HydrophobicContact CG1-CE2 3.77Å; V154-F314 HydrophobicContact CG1-CZ 4.34Å; V154-F314 HydrophobicContact CG2-CD1 4.42Å; V154-F314 HydrophobicContact CG2-CD2 3.96Å; V154-F314 HydrophobicContact CG2-CE1 4.33Å; V154-F314 HydrophobicContact CG2-CE2 3.86Å; V154-F314 HydrophobicContact CG2-CG 4.24Å; V154-F314 HydrophobicContact CG2-CZ 4.04Å; V154-L317 HydrophobicContact CG2-CD2 3.99Å
155	S	88.4	Confident	79	Confident	51 Å²	51	66.7 Å²	66.7	36%	0.357	38%	0.377	S	S	.	.			trans	-110.4	151.3	173.7	-65.8	0	0	0	0	109.9	Y172	S155-Y172 PolarHBondContact N-OH 3.41Å
156	S	87.7	Confident	78.1	Confident	23 Å²	23	72 Å²	72	16%	0.161	40%	0.397	C	S	.	.	B	Isolated β-bridge	trans	-67.3	157.7	168.6	44.7	0	0	0	0	111.7	N158 S159 F314	S156-N158 WeakPolarHBondContact CB-OD1 3.27Å; S156-N158 PolarHBondContact O-N 3.11Å; S156-N158 PolarHBondContact OG-OD1 2.67Å; S156-S159 VanDerWaalsContact O-CB 3.3Å; S156-S159 WeakPolarHBondContact O-CB 2.99Å; S156-S159 PolarHBondContact O-N 2.87Å; S156-F314 CarbonylContact C-O 3.52Å; S156-F314 WeakPolarHBondContact CA-O 3.42Å
157	F	84.1	Confident	77.5	Confident	7 Å²	7	72 Å²	72	3%	0.031	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-22.4	-177.6	77.8	-67.3	0	0	0	114.7	S159 I169 S313 F314 V315 A358 L359 L362	F157-S159 VanDerWaalsContact C-N 3.28Å; F157-I169 HydrophobicContact CB-CG2 4.06Å; F157-S313 VanDerWaalsContact CB-OG 3.31Å; F157-S313 WeakPolarHBondContact CB-OG 3.21Å; F157-F314 PolarHBondContact N-O 3.26Å; F157-V315 HydrophobicContact CD1-CB 4.36Å; F157-V315 HydrophobicContact CD1-CG1 4.25Å; F157-V315 HydrophobicContact CE1-CB 4.39Å; F157-V315 HydrophobicContact CE1-CG1 3.8Å; F157-V315 WeakPolarHBondContact CE1-O 3.35Å; F157-V315 HydrophobicContact CZ-CG1 4.39Å; F157-A358 HydrophobicContact CD2-CB 3.51Å; F157-A358 HydrophobicContact CE2-CB 3.35Å; F157-A358 HydrophobicContact CG-CB 4.5Å; F157-A358 HydrophobicContact CZ-CB 4.25Å; F157-L359 HydrophobicContact CE2-CB 4.41Å; F157-L362 HydrophobicContact CB-CD1 4.38Å; F157-L362 HydrophobicContact CD2-CB 4.42Å; F157-L362 HydrophobicContact CD2-CD2 4.05Å; F157-L362 HydrophobicContact CE2-CD2 4.37Å; F157-L362 HydrophobicContact CG-CD2 4.48Å
158	N	80.8	Confident	77.2	Confident	66 Å²	66	70.4 Å²	70.4	35%	0.353	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-9	177.8	64.4	-6.8	0	0	0	113.5	S156 F160 N355 A358	S156-N158 WeakPolarHBondContact CB-OD1 3.27Å; S156-N158 PolarHBondContact O-N 3.11Å; S156-N158 PolarHBondContact OG-OD1 2.67Å; N158-F160 PolarHBondContact O-N 2.88Å; N158-N355 HydrophobicContact CB-CB 4.06Å; N158-A358 HydrophobicContact CB-CB 4.09Å
159	S	78	Confident	77	Confident	49 Å²	49	66 Å²	66	34%	0.343	36%	0.361	S	S	.	.	S	Bend	trans	-79.7	100.9	170.1	-65.4	0	0	0	0	108.5	S156 F157 P161 V170	S156-S159 VanDerWaalsContact O-CB 3.3Å; S156-S159 WeakPolarHBondContact O-CB 2.99Å; S156-S159 PolarHBondContact O-N 2.87Å; F157-S159 VanDerWaalsContact C-N 3.28Å; S159-P161 WeakPolarHBondContact O-CD 3.18Å; S159-V170 WeakPolarHBondContact O-CG2 3.32Å
160	F	69.2	Low	77.1	Confident	52 Å²	52	66.7 Å²	66.7	23%	0.228	37%	0.366	C	S	.	.			trans	-84.9	112.5	-177.5	-59.2	-66.8	0	0	0	112.2	N158 R162 K167 E357 A358 L361	N158-F160 PolarHBondContact O-N 2.88Å; F160-R162 PolarHBondContact O-N 2.84Å; F160-K167 HydrophobicContact CB-CB 4.41Å; F160-K167 HydrophobicContact CB-CG 4.15Å; F160-K167 HydrophobicContact CD1-CB 3.94Å; F160-K167 HydrophobicContact CD1-CD 4.23Å; F160-K167 HydrophobicContact CD1-CG 4.28Å; F160-K167 HydrophobicContact CD2-CD 4Å; F160-K167 HydrophobicContact CE1-CB 4.46Å; F160-K167 HydrophobicContact CE1-CD 4.42Å; F160-K167 HydrophobicContact CE2-CD 4.17Å; F160-K167 HydrophobicContact CG-CB 4.24Å; F160-K167 HydrophobicContact CG-CD 4Å; F160-K167 HydrophobicContact CG-CG 4.09Å; F160-K167 HydrophobicContact CZ-CD 4.35Å; F160-E357 HydrophobicContact CZ-CB 4.49Å; F160-E357 HydrophobicContact CZ-CG 4.36Å; F160-A358 HydrophobicContact CE1-CB 3.75Å; F160-A358 HydrophobicContact CZ-CB 3.49Å; F160-A358 VanDerWaalsContact CZ-CB 3.49Å; F160-L361 HydrophobicContact CD1-CD1 4.26Å; F160-L361 HydrophobicContact CE1-CD1 3.8Å
161	P	65.5	Low	77.4	Confident	60 Å²	60	65.1 Å²	65.1	39%	0.39	36%	0.357	S	S	.	.			trans	-64.3	132.5	156.6	26.9	-34	0	0	0	108.4	S159 A168 V170	S159-P161 WeakPolarHBondContact O-CD 3.18Å; P161-A168 WeakPolarHBondContact CD-O 3.32Å; P161-A168 HydrophobicContact CG-CB 4.47Å; P161-A168 PolarHBondContact O-N 2.85Å; P161-V170 HydrophobicContact CG-CG2 3.88Å
162	R	59.4	Low	78.1	Confident	217 Å²	217	64.9 Å²	64.9	82%	0.819	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.5	107.6	168.8	-68.5	-174.7	179.3	-173.5	-0.5	107.7	F160	F160-R162 PolarHBondContact O-N 2.84Å
163	S	57.9	Low	78.7	Confident	67 Å²	67	64.6 Å²	64.6	47%	0.469	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	125.7	165.1	71	0	0	0	0	108.2	G165 E166	S163-G165 PolarHBondContact O-N 3.24Å; S163-E166 PolarHBondContact N-O 3.12Å; S163-E166 PolarHBondContact O-N 3.06Å
164	N	60.5	Low	79	Confident	173 Å²	173	63 Å²	63	93%	0.925	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	25.9	179.7	-61.5	-15.7	0	0	0	116	E166	N164-E166 VanDerWaalsContact C-N 3.28Å; N164-E166 PolarHBondContact O-N 3.1Å
165	G	69.8	Low	79.2	Confident	72 Å²	72	64.5 Å²	64.5	74%	0.742	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.8	-6.6	-178	0	0	0	0	0	114.9	S163	S163-G165 PolarHBondContact O-N 3.24Å
166	E	72	Confident	79.4	Confident	152 Å²	152	63.8 Å²	63.8	71%	0.71	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.9	140.3	173.4	-67.6	-176	169.3	0	0	110.4	S163 N164	S163-E166 PolarHBondContact N-O 3.12Å; S163-E166 PolarHBondContact O-N 3.06Å; N164-E166 VanDerWaalsContact C-N 3.28Å; N164-E166 PolarHBondContact O-N 3.1Å
167	K	80.1	Confident	79.5	Confident	78 Å²	78	64.9 Å²	64.9	34%	0.339	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	122.3	171.7	-72.4	177.6	179.1	170.3	0	107.7	F160 E357 L361	F160-K167 HydrophobicContact CB-CB 4.41Å; F160-K167 HydrophobicContact CB-CG 4.15Å; F160-K167 HydrophobicContact CD1-CB 3.94Å; F160-K167 HydrophobicContact CD1-CD 4.23Å; F160-K167 HydrophobicContact CD1-CG 4.28Å; F160-K167 HydrophobicContact CD2-CD 4Å; F160-K167 HydrophobicContact CE1-CB 4.46Å; F160-K167 HydrophobicContact CE1-CD 4.42Å; F160-K167 HydrophobicContact CE2-CD 4.17Å; F160-K167 HydrophobicContact CG-CB 4.24Å; F160-K167 HydrophobicContact CG-CD 4Å; F160-K167 HydrophobicContact CG-CG 4.09Å; F160-K167 HydrophobicContact CZ-CD 4.35Å; K167-E357 VanDerWaalsContact CD-OE1 3.28Å; K167-E357 WeakPolarHBondContact CD-OE1 3.46Å; K167-E357 WeakPolarHBondContact CE-OE1 3.16Å; K167-E357 IonicContact NZ-OE1 3.48Å; K167-E357 PolarHBondContact NZ-OE1 3.31Å; K167-E357 IonicContact NZ-OE2 3.19Å; K167-E357 PolarHBondContact NZ-OE2 3.03Å; K167-L361 HydrophobicContact CB-CD1 3.99Å; K167-L361 WeakPolarHBondContact O-CD1 3.15Å
168	A	81.5	Confident	79.7	Confident	37 Å²	37	67.7 Å²	67.7	31%	0.306	36%	0.363	S	S	.	.			trans	-110.4	154.9	171.2	0	0	0	0	0	110.1	P161	P161-A168 WeakPolarHBondContact CD-O 3.32Å; P161-A168 HydrophobicContact CG-CB 4.47Å; P161-A168 PolarHBondContact O-N 2.85Å
169	I	82.8	Confident	80.2	Confident	31 Å²	31	65.1 Å²	65.1	16%	0.159	35%	0.348	C	S	.	.			trans	-78.5	142.4	171	-56.1	172.8	0	0	0	108.8	F157 T171 S313 L361 L362	F157-I169 HydrophobicContact CB-CG2 4.06Å; I169-T171 HydrophobicContact CG2-CG2 4.43Å; I169-T171 PolarHBondContact O-N 3.1Å; I169-S313 WeakPolarHBondContact CG2-OG 3.46Å; I169-L361 HydrophobicContact CD1-CB 3.58Å; I169-L361 WeakPolarHBondContact CD1-O 2.9Å; I169-L361 HydrophobicContact CG1-CB 3.47Å; I169-L361 VanDerWaalsContact CG1-CB 3.47Å; I169-L361 HydrophobicContact CG1-CD1 4.32Å; I169-L362 HydrophobicContact CD1-CB 3.92Å; I169-L362 HydrophobicContact CD1-CD1 3.89Å; I169-L362 HydrophobicContact CG2-CD1 4.04Å
170	V	87.1	Confident	80.7	Confident	22 Å²	22	63.1 Å²	63.1	13%	0.133	34%	0.335	C	S	.	.			trans	-75.8	116.1	169.3	-173.8	0	0	0	0	109.4	S159 P161 Y172 S313	S159-V170 WeakPolarHBondContact O-CG2 3.32Å; P161-V170 HydrophobicContact CG-CG2 3.88Å; V170-Y172 HydrophobicContact CG1-CD2 4.27Å; V170-Y172 HydrophobicContact CG1-CE1 4.13Å; V170-Y172 HydrophobicContact CG1-CE2 3.43Å; V170-Y172 VanDerWaalsContact CG1-CE2 3.43Å; V170-Y172 VanDerWaalsContact CG1-OH 3.23Å; V170-Y172 WeakPolarHBondContact CG1-OH 3.19Å; V170-S313 WeakPolarHBondContact O-CB 3.33Å; V170-S313 PolarHBondContact O-OG 2.93Å
171	T	90	Very high	81.7	Confident	49 Å²	49	61.1 Å²	61.1	30%	0.301	33%	0.326	S	S	.	.			trans	-118.2	151.7	168.7	59.4	0	0	0	0	110	I169 Q311 A312 F327	I169-T171 HydrophobicContact CG2-CG2 4.43Å; I169-T171 PolarHBondContact O-N 3.1Å; T171-Q311 PolarHBondContact OG1-OE1 2.88Å; T171-A312 WeakPolarHBondContact CA-O 3.49Å; T171-F327 HydrophobicContact CG2-CD2 4.26Å; T171-F327 HydrophobicContact CG2-CE2 4.45Å
172	Y	91.8	Very high	83.1	Confident	34 Å²	34	58.3 Å²	58.3	13%	0.133	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	136.6	177.4	-61	-81.9	0	0	0	109.4	V154 S155 V170 M174 Q311 A312 F314	V154-Y172 WeakPolarHBondContact CA-OH 3.23Å; V154-Y172 HydrophobicContact CB-CD2 4.28Å; V154-Y172 HydrophobicContact CB-CE1 4.37Å; V154-Y172 HydrophobicContact CB-CE2 3.64Å; V154-Y172 HydrophobicContact CG1-CD1 4.11Å; V154-Y172 HydrophobicContact CG1-CD2 3.95Å; V154-Y172 HydrophobicContact CG1-CE1 3.91Å; V154-Y172 HydrophobicContact CG1-CE2 3.73Å; V154-Y172 HydrophobicContact CG1-CG 4.12Å; S155-Y172 PolarHBondContact N-OH 3.41Å; V170-Y172 HydrophobicContact CG1-CD2 4.27Å; V170-Y172 HydrophobicContact CG1-CE1 4.13Å; V170-Y172 HydrophobicContact CG1-CE2 3.43Å; V170-Y172 VanDerWaalsContact CG1-CE2 3.43Å; V170-Y172 VanDerWaalsContact CG1-OH 3.23Å; V170-Y172 WeakPolarHBondContact CG1-OH 3.19Å; Y172-M174 WeakPolarHBondContact O-CG 3.48Å; Y172-M174 PolarHBondContact O-N 3.42Å; Y172-Q311 CarbonylContact O-C 3.38Å; Y172-Q311 VanDerWaalsContact O-CA 3.28Å; Y172-Q311 WeakPolarHBondContact O-CA 3.35Å; Y172-A312 PolarHBondContact N-O 3.08Å; Y172-A312 PolarHBondContact O-N 3.01Å; Y172-F314 AromaticContact CD2-CD2 3.83Å; Y172-F314 HydrophobicContact CD2-CD2 3.83Å; Y172-F314 AromaticContact CD2-CE2 3.82Å; Y172-F314 HydrophobicContact CD2-CE2 3.82Å; Y172-F314 AromaticContact CE2-CD2 3.99Å; Y172-F314 HydrophobicContact CE2-CD2 3.99Å; Y172-F314 HydrophobicContact CE2-CE2 4.29Å
173	D	92.4	Very high	84.7	Confident	75 Å²	75	49.9 Å²	49.9	40%	0.401	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	127.1	170.1	-61.3	-33.5	0	0	0	109.1	S190 Q311	D173-S190 PolarHBondContact O-N 2.84Å; D173-Q311 VanDerWaalsContact OD1-CG 3.29Å; D173-Q311 WeakPolarHBondContact OD1-CG 3.46Å; D173-Q311 PolarHBondContact OD1-NE2 3.47Å
174	M	93	Very high	86.3	Confident	0 Å²	0	47 Å²	47	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	160.4	-172.4	-66.9	-64.5	-157.9	0	0	111.2	Y172 I187 R188 R189 S190 Y278 F310 A312 F314	Y172-M174 WeakPolarHBondContact O-CG 3.48Å; Y172-M174 PolarHBondContact O-N 3.42Å; M174-I187 HydrophobicContact CE-CD1 3.79Å; M174-I187 HydrophobicContact CE-CG1 4.35Å; M174-I187 HydrophobicContact CG-CD1 4.03Å; M174-I187 HydrophobicContact SD-CD1 4.1Å; M174-I187 HydrophobicContact SD-CG1 4.34Å; M174-R188 CarbonylContact C-O 3.58Å; M174-R188 VanDerWaalsContact CA-O 3.31Å; M174-R188 WeakPolarHBondContact CA-O 3.33Å; M174-R189 WeakPolarHBondContact SD-CA 3.49Å; M174-R189 HydrophobicContact SD-CB 4Å; M174-R189 HydrophobicContact SD-CG 4.24Å; M174-S190 PolarHBondContact O-OG 3.45Å; M174-Y278 HydrophobicContact CE-CD2 4.17Å; M174-Y278 HydrophobicContact CE-CE2 4.25Å; M174-F310 HydrophobicContact CB-CD2 3.97Å; M174-F310 HydrophobicContact CB-CE2 3.53Å; M174-F310 HydrophobicContact CB-CZ 4.03Å; M174-F310 HydrophobicContact CG-CE2 4.46Å; M174-F310 PolarHBondContact N-O 2.9Å; M174-F310 PolarHBondContact O-N 3.18Å; M174-A312 HydrophobicContact CE-CB 4.28Å; M174-A312 HydrophobicContact CG-CB 3.7Å; M174-F314 HydrophobicContact CE-CE2 3.35Å; M174-F314 HydrophobicContact CE-CZ 3.35Å
175	E	91.6	Very high	87.8	Confident	39 Å²	39	38.8 Å²	38.8	18%	0.182	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	147.8	166	66.4	178.8	146.1	0	0	111	I187 R188 K308	E175-I187 CarbonylContact O-C 3.53Å; E175-I187 VanDerWaalsContact O-CA 3.27Å; E175-I187 WeakPolarHBondContact O-CA 3.19Å; E175-R188 VanDerWaalsContact CD-NH2 3.3Å; E175-R188 HydrophobicContact CG-CB 4Å; E175-R188 PolarHBondContact N-O 2.94Å; E175-R188 PolarHBondContact O-N 3.43Å; E175-R188 IonicContact OE1-CZ 3.62Å; E175-R188 IonicContact OE1-NE 3.12Å; E175-R188 PolarHBondContact OE1-NE 2.87Å; E175-R188 IonicContact OE1-NH2 2.72Å; E175-R188 PolarHBondContact OE1-NH2 3.31Å; E175-R188 IonicContact OE2-NH2 2.71Å; E175-K308 IonicContact OE2-NZ 2.71Å; E175-K308 PolarHBondContact OE2-NZ 3.43Å; E175-K308 VanDerWaalsContact OE2-NZ 3.13Å
176	L	92.4	Very high	89	Confident	37 Å²	37	35.6 Å²	35.6	19%	0.194	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	130.4	173.1	-172.1	71.4	0	0	0	110	W178 F179 F185 I187 L305 K308 F310	L176-W178 VanDerWaalsContact CD1-O 3.26Å; L176-W178 WeakPolarHBondContact CD1-O 3.38Å; L176-F179 HydrophobicContact CD1-CB 4.19Å; L176-F179 HydrophobicContact CD2-CB 3.98Å; L176-F185 HydrophobicContact CD1-CB 4.42Å; L176-F185 HydrophobicContact CD1-CD2 4.02Å; L176-I187 HydrophobicContact CD1-CG2 4.33Å; L176-L305 HydrophobicContact CD1-CD1 4.05Å; L176-L305 HydrophobicContact CD1-CD2 4.42Å; L176-L305 HydrophobicContact CD2-CB 4.01Å; L176-K308 PolarHBondContact O-NZ 3.24Å; L176-F310 HydrophobicContact CB-CE1 4.1Å; L176-F310 HydrophobicContact CB-CZ 4.44Å
177	L	89.6	Confident	90	Very high	46 Å²	46	28.3 Å²	28.3	24%	0.241	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	-45.7	166	-66.3	-171.2	0	0	0	111.5	V186 R188 L252 V277	L177-V186 HydrophobicContact CB-CB 4.43Å; L177-V186 HydrophobicContact CB-CG1 4.09Å; L177-V186 HydrophobicContact CD1-CG1 4.09Å; L177-V186 PolarHBondContact N-O 3.2Å; L177-R188 HydrophobicContact CD1-CB 3.95Å; L177-R188 HydrophobicContact CD2-CB 4.08Å; L177-R188 HydrophobicContact CG-CB 3.85Å; L177-L252 HydrophobicContact CD1-CD2 4.33Å; L177-V277 HydrophobicContact CD1-CB 4.46Å; L177-V277 HydrophobicContact CD1-CG1 3.66Å; L177-V277 HydrophobicContact CD1-CG2 3.9Å
178	W	88.8	Confident	90.6	Very high	66 Å²	66	29.1 Å²	29.1	25%	0.25	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	149.1	-178.3	175.7	80.6	0	0	0	110.3	L176 F185 V186	L176-W178 VanDerWaalsContact CD1-O 3.26Å; L176-W178 WeakPolarHBondContact CD1-O 3.38Å; W178-F185 WeakPolarHBondContact O-CB 3.27Å; W178-V186 HydrophobicContact CB-CB 4.33Å; W178-V186 HydrophobicContact CE3-CG2 3.93Å; W178-V186 PolarHBondContact N-O 2.97Å; W178-V186 PolarHBondContact O-N 2.97Å
179	F	90.9	Very high	91	Very high	11 Å²	11	30.6 Å²	30.6	5%	0.048	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	130.4	176.5	176.4	-89.5	0	0	0	108.6	L176 P182 F185 V298 V301 Q302 L305 L479	L176-F179 HydrophobicContact CD1-CB 4.19Å; L176-F179 HydrophobicContact CD2-CB 3.98Å; F179-P182 HydrophobicContact CZ-CG 4.32Å; F179-F185 HydrophobicContact CB-CB 4.26Å; F179-F185 HydrophobicContact CD2-CB 3.67Å; F179-F185 HydrophobicContact CD2-CD1 4.49Å; F179-F185 HydrophobicContact CD2-CG 4.1Å; F179-F185 HydrophobicContact CE2-CB 4.46Å; F179-F185 HydrophobicContact CG-CB 4.32Å; F179-V298 HydrophobicContact CE1-CG1 4.18Å; F179-V298 HydrophobicContact CZ-CG1 4.39Å; F179-V301 HydrophobicContact CE2-CB 4.45Å; F179-V301 HydrophobicContact CE2-CG1 3.65Å; F179-V301 HydrophobicContact CZ-CG1 4.18Å; F179-Q302 HydrophobicContact CD1-CG 3.67Å; F179-Q302 HydrophobicContact CE1-CG 3.31Å; F179-Q302 HydrophobicContact CG-CG 4.44Å; F179-Q302 HydrophobicContact CZ-CG 3.82Å; F179-L305 HydrophobicContact CD2-CD1 3.38Å; F179-L305 HydrophobicContact CE2-CD1 3.76Å; F179-L305 HydrophobicContact CG-CD1 4.33Å; F179-L479 VanDerWaalsContact O-CD1 3.29Å; F179-L479 WeakPolarHBondContact O-CD1 3.38Å
180	S	88	Confident	91.3	Very high	8 Å²	8	30.1 Å²	30.1	6%	0.056	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	-56.8	165.1	162.6	0	0	0	0	110.3	D184	S180-D184 PolarHBondContact N-O 2.91Å; S180-D184 VanDerWaalsContact N-O 3.13Å
181	K	91.2	Very high	90.8	Very high	10 Å²	10	36.6 Å²	36.6	4%	0.043	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	163.7	-175.4	51.4	-177.1	-167.9	-166.7	0	110.3	D183 D184 N291 L473	K181-D183 WeakPolarHBondContact CB-OD1 3.34Å; K181-D183 WeakPolarHBondContact CD-OD1 3.46Å; K181-D183 VanDerWaalsContact CE-OD1 3.26Å; K181-D183 WeakPolarHBondContact CE-OD1 3.35Å; K181-D183 WeakPolarHBondContact CE-OD2 3.45Å; K181-D183 WeakPolarHBondContact CG-OD1 3.34Å; K181-D183 IonicContact NZ-OD2 3.68Å; K181-D183 PolarHBondContact O-N 3.36Å; K181-D183 VanDerWaalsContact O-N 3.12Å; K181-D184 HydrophobicContact CD-CB 4.37Å; K181-D184 HydrophobicContact CG-CB 3.7Å; K181-D184 PolarHBondContact N-O 3.29Å; K181-D184 CarbonylContact O-C 3.43Å; K181-D184 PolarHBondContact O-N 3.29Å; K181-N291 PolarHBondContact NZ-OD1 2.97Å; K181-L473 HydrophobicContact CB-CB 4.35Å; K181-L473 HydrophobicContact CB-CD1 3.54Å
182	P	93.8	Very high	90.1	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-20.1	-177	-22.1	32.9	0	0	0	114.6	F179 F185 L282 W293 V297 V298 V301	F179-P182 HydrophobicContact CZ-CG 4.32Å; P182-F185 WeakPolarHBondContact O-CE1 3.23Å; P182-L282 HydrophobicContact CB-CD1 3.97Å; P182-L282 HydrophobicContact CB-CG 4.41Å; P182-L282 PolarHBondContact O-N 3.01Å; P182-W293 HydrophobicContact CB-CE3 4.35Å; P182-W293 HydrophobicContact CB-CH2 3.57Å; P182-W293 HydrophobicContact CB-CZ2 3.94Å; P182-W293 HydrophobicContact CB-CZ3 3.78Å; P182-W293 HydrophobicContact CG-CD2 4.08Å; P182-W293 HydrophobicContact CG-CE3 3.82Å; P182-W293 HydrophobicContact CG-CH2 3.95Å; P182-W293 HydrophobicContact CG-CZ2 4.16Å; P182-W293 HydrophobicContact CG-CZ3 3.75Å; P182-V297 HydrophobicContact CG-CG1 4.39Å; P182-V298 HydrophobicContact CG-CG2 4.2Å; P182-V301 HydrophobicContact CB-CG1 4.49Å; P182-V301 HydrophobicContact CB-CG2 4.23Å; P182-V301 HydrophobicContact CG-CB 4.43Å; P182-V301 HydrophobicContact CG-CG2 4.17Å
183	D	92.8	Very high	89	Confident	41 Å²	41	40.4 Å²	40.4	22%	0.219	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.8	2.3	172.1	60.8	-37.8	0	0	0	114.3	K181 R281 W293	K181-D183 WeakPolarHBondContact CB-OD1 3.34Å; K181-D183 WeakPolarHBondContact CD-OD1 3.46Å; K181-D183 VanDerWaalsContact CE-OD1 3.26Å; K181-D183 WeakPolarHBondContact CE-OD1 3.35Å; K181-D183 WeakPolarHBondContact CE-OD2 3.45Å; K181-D183 WeakPolarHBondContact CG-OD1 3.34Å; K181-D183 IonicContact NZ-OD2 3.68Å; K181-D183 PolarHBondContact O-N 3.36Å; K181-D183 VanDerWaalsContact O-N 3.12Å; D183-R281 HydrophobicContact CB-CB 4.16Å; D183-R281 WeakPolarHBondContact O-CB 3.36Å; D183-W293 HydrophobicContact CB-CZ2 3.82Å; D183-W293 VanDerWaalsContact OD1-CZ2 3.22Å; D183-W293 WeakPolarHBondContact OD1-CZ2 3.27Å; D183-W293 PolarHBondContact OD1-NE1 2.71Å; D183-W293 VanDerWaalsContact OD1-NE1 3.15Å
184	D	91.7	Very high	88.1	Confident	7 Å²	7	38.3 Å²	38.3	4%	0.037	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	98.9	178.1	-175.3	15.1	0	0	0	111.9	S180 K181 R279 V280	S180-D184 PolarHBondContact N-O 2.91Å; S180-D184 VanDerWaalsContact N-O 3.13Å; K181-D184 HydrophobicContact CD-CB 4.37Å; K181-D184 HydrophobicContact CG-CB 3.7Å; K181-D184 PolarHBondContact N-O 3.29Å; K181-D184 CarbonylContact O-C 3.43Å; K181-D184 PolarHBondContact O-N 3.29Å; D184-R279 VanDerWaalsContact CG-NH2 3.29Å; D184-R279 WeakPolarHBondContact OD1-CG 3.42Å; D184-R279 IonicContact OD1-CZ 3.29Å; D184-R279 IonicContact OD1-NE 2.94Å; D184-R279 PolarHBondContact OD1-NE 2.82Å; D184-R279 IonicContact OD1-NH2 2.76Å; D184-R279 PolarHBondContact OD1-NH2 2.89Å; D184-R279 IonicContact OD2-CZ 3.87Å; D184-R279 IonicContact OD2-NE 3.08Å; D184-R279 IonicContact OD2-NH2 3.3Å; D184-R279 PolarHBondContact OD2-NH2 3.32Å; D184-V280 WeakPolarHBondContact CA-O 3.23Å
185	F	93.3	Very high	87.6	Confident	0 Å²	0	45 Å²	45	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	161.7	173	60.9	-78.1	0	0	0	110.7	L176 W178 F179 P182 I187 R279 V280 L282 L305 V324 L326	L176-F185 HydrophobicContact CD1-CB 4.42Å; L176-F185 HydrophobicContact CD1-CD2 4.02Å; W178-F185 WeakPolarHBondContact O-CB 3.27Å; F179-F185 HydrophobicContact CB-CB 4.26Å; F179-F185 HydrophobicContact CD2-CB 3.67Å; F179-F185 HydrophobicContact CD2-CD1 4.49Å; F179-F185 HydrophobicContact CD2-CG 4.1Å; F179-F185 HydrophobicContact CE2-CB 4.46Å; F179-F185 HydrophobicContact CG-CB 4.32Å; P182-F185 WeakPolarHBondContact O-CE1 3.23Å; F185-I187 HydrophobicContact CD2-CG2 3.67Å; F185-I187 HydrophobicContact CE2-CG2 3.68Å; F185-R279 CarbonylContact O-C 3.59Å; F185-R279 WeakPolarHBondContact O-CA 3.25Å; F185-V280 HydrophobicContact CD1-CG2 4.05Å; F185-V280 WeakPolarHBondContact CD1-O 3.44Å; F185-V280 HydrophobicContact CD2-CG2 3.51Å; F185-V280 HydrophobicContact CE1-CG2 3.8Å; F185-V280 HydrophobicContact CE2-CG2 3.24Å; F185-V280 HydrophobicContact CG-CG2 3.91Å; F185-V280 HydrophobicContact CZ-CB 4.48Å; F185-V280 HydrophobicContact CZ-CG2 3.39Å; F185-V280 PolarHBondContact N-O 2.92Å; F185-V280 WeakPolarHBondContact O-CG2 3.3Å; F185-V280 PolarHBondContact O-N 3.41Å; F185-L282 HydrophobicContact CE1-CD2 4.2Å; F185-L282 HydrophobicContact CE1-CG 4.06Å; F185-L282 HydrophobicContact CZ-CD2 3.93Å; F185-L282 HydrophobicContact CZ-CG 4.31Å; F185-L305 HydrophobicContact CD2-CD1 4.14Å; F185-L305 HydrophobicContact CE2-CD1 4.33Å; F185-L305 HydrophobicContact CE2-CD2 4.17Å; F185-V324 HydrophobicContact CZ-CG2 4.04Å; F185-L326 HydrophobicContact CE2-CD1 4.32Å; F185-L326 HydrophobicContact CZ-CD1 4.17Å
186	V	93.5	Very high	87.2	Confident	4 Å²	4	45.6 Å²	45.6	2%	0.024	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	123.7	-174.4	179.8	0	0	0	0	109.7	L177 W178 E253 V277 Y278 R279	L177-V186 HydrophobicContact CB-CB 4.43Å; L177-V186 HydrophobicContact CB-CG1 4.09Å; L177-V186 HydrophobicContact CD1-CG1 4.09Å; L177-V186 PolarHBondContact N-O 3.2Å; W178-V186 HydrophobicContact CB-CB 4.33Å; W178-V186 HydrophobicContact CE3-CG2 3.93Å; W178-V186 PolarHBondContact N-O 2.97Å; W178-V186 PolarHBondContact O-N 2.97Å; V186-E253 HydrophobicContact CG1-CB 3.91Å; V186-E253 HydrophobicContact CG1-CG 4.09Å; V186-E253 HydrophobicContact CG2-CB 3.81Å; V186-E253 HydrophobicContact CG2-CG 4.5Å; V186-V277 HydrophobicContact CG1-CG1 3.32Å; V186-Y278 WeakPolarHBondContact CA-O 3Å; V186-R279 HydrophobicContact CG2-CB 4.41Å; V186-R279 HydrophobicContact CG2-CG 4.42Å
187	I	93.5	Very high	87	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	152.2	177.8	63.5	178.6	0	0	0	110.8	M174 E175 L176 F185 V277 Y278 V280 F310 A312	M174-I187 HydrophobicContact CE-CD1 3.79Å; M174-I187 HydrophobicContact CE-CG1 4.35Å; M174-I187 HydrophobicContact CG-CD1 4.03Å; M174-I187 HydrophobicContact SD-CD1 4.1Å; M174-I187 HydrophobicContact SD-CG1 4.34Å; E175-I187 CarbonylContact O-C 3.53Å; E175-I187 VanDerWaalsContact O-CA 3.27Å; E175-I187 WeakPolarHBondContact O-CA 3.19Å; L176-I187 HydrophobicContact CD1-CG2 4.33Å; F185-I187 HydrophobicContact CD2-CG2 3.67Å; F185-I187 HydrophobicContact CE2-CG2 3.68Å; I187-V277 WeakPolarHBondContact O-CA 3.38Å; I187-Y278 PolarHBondContact N-O 2.84Å; I187-Y278 PolarHBondContact O-N 3.12Å; I187-V280 HydrophobicContact CD1-CG1 3.87Å; I187-V280 HydrophobicContact CD1-CG2 3.96Å; I187-V280 HydrophobicContact CG1-CG1 3.95Å; I187-V280 HydrophobicContact CG1-CG2 4.01Å; I187-V280 HydrophobicContact CG2-CG2 4.16Å; I187-F310 HydrophobicContact CB-CZ 4.48Å; I187-F310 HydrophobicContact CG2-CE2 4.11Å; I187-F310 HydrophobicContact CG2-CZ 3.75Å; I187-A312 HydrophobicContact CD1-CB 4.16Å
188	R	92.1	Very high	86.9	Confident	94 Å²	94	45.8 Å²	45.8	36%	0.355	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	141.5	174.8	177.8	171.8	66.1	-169.9	-1.4	110.2	M174 E175 L177 S190 D276 V277	M174-R188 CarbonylContact C-O 3.58Å; M174-R188 VanDerWaalsContact CA-O 3.31Å; M174-R188 WeakPolarHBondContact CA-O 3.33Å; E175-R188 VanDerWaalsContact CD-NH2 3.3Å; E175-R188 HydrophobicContact CG-CB 4Å; E175-R188 PolarHBondContact N-O 2.94Å; E175-R188 PolarHBondContact O-N 3.43Å; E175-R188 IonicContact OE1-CZ 3.62Å; E175-R188 IonicContact OE1-NE 3.12Å; E175-R188 PolarHBondContact OE1-NE 2.87Å; E175-R188 IonicContact OE1-NH2 2.72Å; E175-R188 PolarHBondContact OE1-NH2 3.31Å; E175-R188 IonicContact OE2-NH2 2.71Å; L177-R188 HydrophobicContact CD1-CB 3.95Å; L177-R188 HydrophobicContact CD2-CB 4.08Å; L177-R188 HydrophobicContact CG-CB 3.85Å; R188-S190 PolarHBondContact O-N 3.38Å; R188-D276 CarbonylContact C-O 3.6Å; R188-D276 VanDerWaalsContact CA-O 3.28Å; R188-D276 WeakPolarHBondContact CA-O 3.19Å; R188-V277 HydrophobicContact CB-CG2 4.04Å; R188-V277 HydrophobicContact CG-CG2 3.95Å
189	R	91.4	Very high	86.9	Confident	69 Å²	69	45.5 Å²	45.5	26%	0.26	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	125	172.8	-158.4	173.4	111.9	-165.9	-8	110.5	P153 M174 V192 D276	P153-R189 PolarHBondContact O-NH1 3.01Å; M174-R189 WeakPolarHBondContact SD-CA 3.49Å; M174-R189 HydrophobicContact SD-CB 4Å; M174-R189 HydrophobicContact SD-CG 4.24Å; R189-V192 HydrophobicContact CB-CG2 3.77Å; R189-V192 HydrophobicContact CG-CG2 3.67Å; R189-D276 HydrophobicContact CB-CB 4.15Å; R189-D276 PolarHBondContact N-O 3.41Å
190	S	87.9	Confident	86.8	Confident	21 Å²	21	45.6 Å²	45.6	15%	0.147	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	150.3	179.5	-65.5	0	0	0	0	110.8	D173 M174 R188 V192	D173-S190 PolarHBondContact O-N 2.84Å; M174-S190 PolarHBondContact O-OG 3.45Å; R188-S190 PolarHBondContact O-N 3.38Å; S190-V192 PolarHBondContact O-N 3.18Å; S190-V192 VanDerWaalsContact O-N 3.11Å
191	N	77.6	Confident	86.9	Confident	158 Å²	158	53.2 Å²	53.2	85%	0.845	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.9	20.5	171.8	-54.3	-37	0	0	0	115.9
192	V	73.8	Confident	86.7	Confident	52 Å²	52	56.5 Å²	56.5	32%	0.315	29%	0.288	S	S	.	.			trans	-95.4	102.3	171.9	-161.4	0	0	0	0	108.9	R189 S190 D276	R189-V192 HydrophobicContact CB-CG2 3.77Å; R189-V192 HydrophobicContact CG-CG2 3.67Å; S190-V192 PolarHBondContact O-N 3.18Å; S190-V192 VanDerWaalsContact O-N 3.11Å; V192-D276 VanDerWaalsContact CG1-OD2 3.25Å; V192-D276 WeakPolarHBondContact CG1-OD2 3.37Å
193	S	69.2	Low	86.2	Confident	111 Å²	111	58.3 Å²	58.3	78%	0.776	30%	0.299	S	S	*	.			trans	-112.9	114.3	169.9	70.9	0	0	0	0	109.8
194	S	73.9	Confident	85.9	Confident	31 Å²	31	62.5 Å²	62.5	22%	0.217	32%	0.321	C	S	.	.			trans	-78.7	134.1	161.2	153.9	0	0	0	0	108.8	E196 L197 C273	S194-E196 PolarHBondContact O-N 2.93Å; S194-E196 WeakPolarHBondContact OG-CB 3.42Å; S194-E196 PolarHBondContact OG-N 3.35Å; S194-E196 VanDerWaalsContact OG-N 3.15Å; S194-E196 PolarHBondContact OG-OE2 2.8Å; S194-L197 PolarHBondContact O-N 2.87Å; S194-L197 PolarHBondContact OG-N 3.16Å; S194-C273 PolarHBondContact OG-SG 3.26Å
195	K	81.7	Confident	85.8	Confident	141 Å²	141	65.2 Å²	65.2	61%	0.613	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-35.7	175.1	-68.7	-175.9	178.5	-178.9	0	110.6	A198	K195-A198 VanDerWaalsContact O-CB 3.25Å; K195-A198 WeakPolarHBondContact O-CB 3.2Å; K195-A198 PolarHBondContact O-N 2.83Å
196	E	85.2	Confident	85.7	Confident	51 Å²	51	65.4 Å²	65.4	24%	0.238	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-63.4	-40.9	177.7	-65.3	72.5	-164.9	0	0	112.3	S194 A198 Y199 R269	S194-E196 PolarHBondContact O-N 2.93Å; S194-E196 WeakPolarHBondContact OG-CB 3.42Å; S194-E196 PolarHBondContact OG-N 3.35Å; S194-E196 VanDerWaalsContact OG-N 3.15Å; S194-E196 PolarHBondContact OG-OE2 2.8Å; E196-A198 PolarHBondContact O-N 3.07Å; E196-Y199 WeakPolarHBondContact O-CB 3.35Å; E196-Y199 VanDerWaalsContact O-CD2 3.31Å; E196-Y199 WeakPolarHBondContact O-CD2 3.23Å; E196-Y199 PolarHBondContact O-N 3.49Å; E196-Y199 VanDerWaalsContact O-N 3.13Å; E196-R269 IonicContact OE1-NH2 2.64Å; E196-R269 PolarHBondContact OE1-NH2 3.25Å
197	L	86.7	Confident	85.8	Confident	41 Å²	41	66.6 Å²	66.6	22%	0.215	35%	0.347	C	S	.	.	G	3₁₀ helix	trans	-65.2	-21.5	177.2	-67	179.5	0	0	0	112.7	S194 Y199 L200 I270 C273	S194-L197 PolarHBondContact O-N 2.87Å; S194-L197 PolarHBondContact OG-N 3.16Å; L197-Y199 PolarHBondContact O-N 3.42Å; L197-L200 HydrophobicContact CD2-CD1 3.95Å; L197-L200 WeakPolarHBondContact O-CB 3.41Å; L197-L200 PolarHBondContact O-N 2.7Å; L197-I270 HydrophobicContact CD2-CG2 4.14Å; L197-C273 HydrophobicContact CD1-CB 4.4Å; L197-C273 HydrophobicContact CD2-CB 4.12Å; L197-C273 HydrophobicContact CG-CB 4.15Å
198	A	87.8	Confident	85.8	Confident	46 Å²	46	67.2 Å²	67.2	38%	0.38	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-65.6	-25.6	175.7	0	0	0	0	0	112.7	K195 E196 L200 K201	K195-A198 VanDerWaalsContact O-CB 3.25Å; K195-A198 WeakPolarHBondContact O-CB 3.2Å; K195-A198 PolarHBondContact O-N 2.83Å; E196-A198 PolarHBondContact O-N 3.07Å; A198-L200 PolarHBondContact O-N 3.42Å; A198-K201 WeakPolarHBondContact O-CB 3.26Å; A198-K201 PolarHBondContact O-N 3.19Å
199	Y	88	Confident	86	Confident	60 Å²	60	62.9 Å²	62.9	24%	0.235	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-62.9	-26.6	175.5	-71	-66.4	0	0	0	112.8	L96 E196 L197 K201 Q202 I206	L96-Y199 HydrophobicContact CD1-CD2 3.48Å; L96-Y199 VanDerWaalsContact CD1-CD2 3.48Å; L96-Y199 HydrophobicContact CD1-CE2 4.12Å; L96-Y199 HydrophobicContact CD1-CG 3.79Å; E196-Y199 WeakPolarHBondContact O-CB 3.35Å; E196-Y199 VanDerWaalsContact O-CD2 3.31Å; E196-Y199 WeakPolarHBondContact O-CD2 3.23Å; E196-Y199 PolarHBondContact O-N 3.49Å; E196-Y199 VanDerWaalsContact O-N 3.13Å; L197-Y199 PolarHBondContact O-N 3.42Å; Y199-K201 PolarHBondContact O-N 2.9Å; Y199-K201 VanDerWaalsContact O-N 3.1Å; Y199-Q202 WeakPolarHBondContact O-CB 3.45Å; Y199-Q202 PolarHBondContact O-N 2.85Å; Y199-I206 HydrophobicContact CD1-CD1 3.7Å; Y199-I206 HydrophobicContact CG-CD1 4.16Å
200	L	90.4	Very high	86.2	Confident	13 Å²	13	62.3 Å²	62.3	7%	0.068	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-63.1	-18.1	177.7	-62.8	178.5	0	0	0	113.4	L197 A198 W208 L222 L231 R233 I270	L197-L200 HydrophobicContact CD2-CD1 3.95Å; L197-L200 WeakPolarHBondContact O-CB 3.41Å; L197-L200 PolarHBondContact O-N 2.7Å; A198-L200 PolarHBondContact O-N 3.42Å; L200-W208 HydrophobicContact CD2-CH2 3.94Å; L200-W208 HydrophobicContact CD2-CZ3 4.4Å; L200-L222 HydrophobicContact CD2-CD1 3.84Å; L200-L222 HydrophobicContact CD2-CD2 3.71Å; L200-L222 HydrophobicContact CD2-CG 4.41Å; L200-L231 HydrophobicContact CB-CB 4.3Å; L200-L231 HydrophobicContact CD2-CB 3.93Å; L200-L231 PolarHBondContact O-N 3.42Å; L200-R233 HydrophobicContact CD1-CG 4.28Å; L200-I270 HydrophobicContact CD1-CG2 4.36Å; L200-I270 HydrophobicContact CD2-CD1 3.85Å; L200-I270 HydrophobicContact CD2-CG2 4.24Å; L200-I270 HydrophobicContact CG-CD1 4.41Å
201	K	89.1	Confident	86.5	Confident	167 Å²	167	61.3 Å²	61.3	73%	0.726	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-81.9	-17.2	173.9	-59.6	179.7	-178.8	177.7	0	112.7	A198 Y199 V203	A198-K201 WeakPolarHBondContact O-CB 3.26Å; A198-K201 PolarHBondContact O-N 3.19Å; Y199-K201 PolarHBondContact O-N 2.9Å; Y199-K201 VanDerWaalsContact O-N 3.1Å; K201-V203 VanDerWaalsContact C-N 3.29Å; K201-V203 PolarHBondContact O-N 3.43Å
202	Q	87	Confident	87.2	Confident	79 Å²	79	61 Å²	61	37%	0.369	32%	0.318	S	S	.	.			trans	-92.5	53.4	-176.9	-57.2	-177.7	23.8	0	0	111.2	Y199 D204 S205 I206	Y199-Q202 WeakPolarHBondContact O-CB 3.45Å; Y199-Q202 PolarHBondContact O-N 2.85Å; Q202-D204 VanDerWaalsContact C-N 3.32Å; Q202-D204 PolarHBondContact O-N 2.85Å; Q202-S205 PolarHBondContact O-N 3.43Å; Q202-I206 HydrophobicContact CB-CD1 3.96Å; Q202-I206 HydrophobicContact CB-CG1 4.25Å; Q202-I206 PolarHBondContact O-N 3.11Å
203	V	82.9	Confident	88	Confident	38 Å²	38	68.6 Å²	68.6	23%	0.23	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-42.7	-170.6	-178.9	0	0	0	0	111.9	K201 W208 L224 L231	K201-V203 VanDerWaalsContact C-N 3.29Å; K201-V203 PolarHBondContact O-N 3.43Å; V203-W208 PolarHBondContact O-NE1 3.21Å; V203-L224 HydrophobicContact CG1-CD2 4.41Å; V203-L231 HydrophobicContact CG2-CG 4.39Å
204	D	86.6	Confident	89.1	Confident	129 Å²	129	65.8 Å²	65.8	69%	0.69	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-26.1	-177.1	-64.4	-43.9	0	0	0	113.7	K89 Q202	K89-D204 WeakPolarHBondContact CE-O 3.03Å; K89-D204 PolarHBondContact NZ-O 3.31Å; Q202-D204 VanDerWaalsContact C-N 3.32Å; Q202-D204 PolarHBondContact O-N 2.85Å
205	S	89.5	Confident	90.1	Very high	65 Å²	65	65 Å²	65	46%	0.455	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-14.6	-175.6	-49.5	0	0	0	0	113.4	K89 Q202	K89-S205 WeakPolarHBondContact CA-O 3.01Å; K89-S205 WeakPolarHBondContact CG-O 3.18Å; Q202-S205 PolarHBondContact O-N 3.43Å
206	I	92.6	Very high	90.7	Very high	4 Å²	4	62.5 Å²	62.5	2%	0.021	31%	0.31	C	S	.	.	S	Bend	trans	-116.5	140.5	-176.7	-62.8	176	0	0	0	109.3	A92 L96 Y199 Q202 W208	A92-I206 HydrophobicContact CB-CG1 4.11Å; L96-I206 HydrophobicContact CD2-CD1 4.11Å; L96-I206 HydrophobicContact CD2-CG2 3.81Å; Y199-I206 HydrophobicContact CD1-CD1 3.7Å; Y199-I206 HydrophobicContact CG-CD1 4.16Å; Q202-I206 HydrophobicContact CB-CD1 3.96Å; Q202-I206 HydrophobicContact CB-CG1 4.25Å; Q202-I206 PolarHBondContact O-N 3.11Å; I206-W208 HydrophobicContact CB-CZ2 3.98Å; I206-W208 HydrophobicContact CD1-CH2 4.45Å; I206-W208 HydrophobicContact CD1-CZ2 3.95Å; I206-W208 HydrophobicContact CG2-CD2 4.02Å; I206-W208 HydrophobicContact CG2-CE3 4.42Å; I206-W208 HydrophobicContact CG2-CH2 4.27Å; I206-W208 HydrophobicContact CG2-CZ2 3.83Å; I206-W208 VanDerWaalsContact O-CD1 3.32Å; I206-W208 PolarHBondContact O-N 3.01Å
207	F	94.4	Very high	91.2	Very high	29 Å²	29	63.8 Å²	63.8	13%	0.127	32%	0.323	C	S	.	.			trans	-80.9	111.3	169	178.2	-107.3	0	0	0	109.9	I78 F81 A82 L85 T93 F209	I78-F207 HydrophobicContact CG2-CD1 4.02Å; I78-F207 HydrophobicContact CG2-CE1 4.17Å; F81-F207 HydrophobicContact CB-CE1 3.89Å; F81-F207 HydrophobicContact CB-CZ 3.62Å; A82-F207 HydrophobicContact CB-CD2 4.47Å; A82-F207 HydrophobicContact CB-CE1 4.37Å; A82-F207 HydrophobicContact CB-CE2 3.75Å; A82-F207 HydrophobicContact CB-CZ 3.68Å; L85-F207 HydrophobicContact CD1-CB 4.04Å; L85-F207 HydrophobicContact CD1-CD1 4.07Å; L85-F207 HydrophobicContact CD1-CD2 3.88Å; L85-F207 HydrophobicContact CD1-CE2 4.36Å; L85-F207 HydrophobicContact CD1-CG 3.7Å; L85-F207 HydrophobicContact CD2-CB 4.04Å; L85-F207 HydrophobicContact CD2-CD2 3.67Å; L85-F207 HydrophobicContact CD2-CE2 4.46Å; L85-F207 HydrophobicContact CD2-CG 4.05Å; L85-F207 HydrophobicContact CG-CD2 4.31Å; T93-F207 HydrophobicContact CG2-CB 4.27Å; T93-F207 WeakPolarHBondContact CG2-O 3.36Å; T93-F207 WeakPolarHBondContact OG1-CB 3.22Å; T93-F207 PolarHBondContact OG1-N 3.5Å; F207-F209 HydrophobicContact CD1-CD1 4.21Å; F207-F209 AromaticContact CD1-CE1 3.98Å; F207-F209 HydrophobicContact CD1-CE1 3.98Å; F207-F209 HydrophobicContact CD1-CZ 4.12Å; F207-F209 AromaticContact CE1-CD1 3.75Å; F207-F209 HydrophobicContact CE1-CD1 3.75Å; F207-F209 AromaticContact CE1-CE1 3.83Å; F207-F209 HydrophobicContact CE1-CE1 3.83Å; F207-F209 HydrophobicContact CE1-CG 4.31Å; F207-F209 HydrophobicContact CE1-CZ 4.42Å
208	W	95	Very high	91.6	Very high	13 Å²	13	65.1 Å²	65.1	5%	0.049	33%	0.33	C	S	.	.			trans	-93.5	130.8	175.5	-59.7	101.4	0	0	0	110.7	L96 L200 V203 I206 P210 L222 L231 F264 P267 I270	L96-W208 HydrophobicContact CD2-CE3 4.44Å; L96-W208 HydrophobicContact CD2-CH2 3.44Å; L96-W208 VanDerWaalsContact CD2-CH2 3.44Å; L96-W208 HydrophobicContact CD2-CZ2 4.26Å; L96-W208 HydrophobicContact CD2-CZ3 3.54Å; L200-W208 HydrophobicContact CD2-CH2 3.94Å; L200-W208 HydrophobicContact CD2-CZ3 4.4Å; V203-W208 PolarHBondContact O-NE1 3.21Å; I206-W208 HydrophobicContact CB-CZ2 3.98Å; I206-W208 HydrophobicContact CD1-CH2 4.45Å; I206-W208 HydrophobicContact CD1-CZ2 3.95Å; I206-W208 HydrophobicContact CG2-CD2 4.02Å; I206-W208 HydrophobicContact CG2-CE3 4.42Å; I206-W208 HydrophobicContact CG2-CH2 4.27Å; I206-W208 HydrophobicContact CG2-CZ2 3.83Å; I206-W208 VanDerWaalsContact O-CD1 3.32Å; I206-W208 PolarHBondContact O-N 3.01Å; W208-P210 VanDerWaalsContact O-CD 3.29Å; W208-P210 WeakPolarHBondContact O-CD 3.19Å; W208-L222 HydrophobicContact CE3-CD1 3.49Å; W208-L222 VanDerWaalsContact CE3-CD1 3.49Å; W208-L222 HydrophobicContact CH2-CD1 4.11Å; W208-L222 HydrophobicContact CZ3-CD1 3.25Å; W208-L231 HydrophobicContact CD2-CD1 3.32Å; W208-L231 HydrophobicContact CE3-CD1 3.94Å; W208-L231 HydrophobicContact CG-CD1 3.62Å; W208-L231 HydrophobicContact CH2-CD1 4.18Å; W208-L231 HydrophobicContact CZ2-CD1 3.62Å; W208-L231 HydrophobicContact CZ3-CD1 4.33Å; W208-F264 HydrophobicContact CB-CB 4.08Å; W208-F264 HydrophobicContact CB-CD1 3.4Å; W208-F264 HydrophobicContact CB-CD2 4.3Å; W208-F264 HydrophobicContact CB-CE1 3.81Å; W208-F264 HydrophobicContact CB-CG 3.67Å; W208-F264 HydrophobicContact CB-CZ 4.42Å; W208-F264 WeakPolarHBondContact O-CD1 3.36Å; W208-P267 HydrophobicContact CZ3-CG 4.09Å; W208-I270 HydrophobicContact CH2-CD1 3.84Å; W208-I270 HydrophobicContact CZ3-CD1 3.94Å
209	F	95.3	Very high	92	Very high	2 Å²	2	63 Å²	63	1%	0.009	31%	0.312	C	S	.	.			trans	-79.3	114.4	-172.4	-60.2	-91.3	0	0	0	110.8	L77 I78 F81 T93 L97 L142 F207 A211 F264 L265	L77-F209 HydrophobicContact CD2-CE1 4.42Å; L77-F209 HydrophobicContact CD2-CZ 4.49Å; L77-F209 HydrophobicContact CG-CE1 4.04Å; I78-F209 HydrophobicContact CG1-CE1 4.07Å; I78-F209 HydrophobicContact CG1-CZ 4.06Å; F81-F209 AromaticContact CD2-CD1 3.57Å; F81-F209 HydrophobicContact CD2-CD1 3.57Å; F81-F209 HydrophobicContact CD2-CE1 4.25Å; F81-F209 AromaticContact CE2-CD1 3.81Å; F81-F209 HydrophobicContact CE2-CD1 3.81Å; F81-F209 HydrophobicContact CG-CD1 4.13Å; T93-F209 HydrophobicContact CG2-CE2 3.84Å; T93-F209 HydrophobicContact CG2-CZ 3.82Å; L97-F209 HydrophobicContact CD1-CE2 4.02Å; L97-F209 HydrophobicContact CD1-CZ 3.79Å; L97-F209 HydrophobicContact CD2-CE2 4.01Å; L97-F209 HydrophobicContact CG-CE2 4.36Å; L142-F209 HydrophobicContact CD1-CB 4.27Å; L142-F209 HydrophobicContact CD1-CD1 4Å; L142-F209 HydrophobicContact CD1-CD2 4.06Å; L142-F209 HydrophobicContact CD1-CE1 4.4Å; L142-F209 HydrophobicContact CD1-CE2 4.48Å; L142-F209 HydrophobicContact CD1-CG 3.83Å; L142-F209 HydrophobicContact CD2-CD2 3.66Å; L142-F209 HydrophobicContact CD2-CE2 4Å; L142-F209 HydrophobicContact CD2-CG 4.23Å; L142-F209 HydrophobicContact CG-CD2 4.49Å; F207-F209 HydrophobicContact CD1-CD1 4.21Å; F207-F209 AromaticContact CD1-CE1 3.98Å; F207-F209 HydrophobicContact CD1-CE1 3.98Å; F207-F209 HydrophobicContact CD1-CZ 4.12Å; F207-F209 AromaticContact CE1-CD1 3.75Å; F207-F209 HydrophobicContact CE1-CD1 3.75Å; F207-F209 AromaticContact CE1-CE1 3.83Å; F207-F209 HydrophobicContact CE1-CE1 3.83Å; F207-F209 HydrophobicContact CE1-CG 4.31Å; F207-F209 HydrophobicContact CE1-CZ 4.42Å; F209-A211 PolarHBondContact O-N 3.15Å; F209-F264 CarbonylContact O-C 3.6Å; F209-F264 WeakPolarHBondContact O-CA 3.48Å; F209-F264 WeakPolarHBondContact O-CB 3.37Å; F209-L265 HydrophobicContact CB-CB 4.12Å; F209-L265 HydrophobicContact CB-CD1 4.27Å; F209-L265 HydrophobicContact CB-CG 4.46Å; F209-L265 PolarHBondContact O-N 3.4Å
210	P	95.2	Very high	92.4	Very high	57 Å²	57	60.1 Å²	60.1	37%	0.37	30%	0.301	S	S	.	.	B	Isolated β-bridge	trans	-59.4	129.4	-177.1	-25.2	34.9	0	0	0	112.8	W208	W208-P210 VanDerWaalsContact O-CD 3.29Å; W208-P210 WeakPolarHBondContact O-CD 3.19Å
211	A	95	Very high	92.8	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	30%	0.298	C	S	.	.			trans	-95.4	-11.7	-177.5	0	0	0	0	0	114.4	F209 K213 S214 L215 A263 F264 L265	F209-A211 PolarHBondContact O-N 3.15Å; A211-K213 PolarHBondContact O-N 3.32Å; A211-S214 CarbonylContact O-C 3.58Å; A211-S214 WeakPolarHBondContact O-CA 3.23Å; A211-S214 WeakPolarHBondContact O-CB 3.43Å; A211-S214 PolarHBondContact O-N 3.45Å; A211-L215 HydrophobicContact CB-CD2 3.96Å; A211-L215 HydrophobicContact CB-CG 4.35Å; A211-L215 WeakPolarHBondContact O-CG 3.17Å; A211-L215 PolarHBondContact O-N 2.93Å; A211-A263 HydrophobicContact CB-CB 4.26Å; A211-A263 PolarHBondContact N-O 3.38Å; A211-F264 VanDerWaalsContact CB-C 3.46Å; A211-L265 HydrophobicContact CB-CD2 3.9Å; A211-L265 HydrophobicContact CB-CG 4.11Å
212	R	91.1	Very high	93.2	Very high	152 Å²	152	51.6 Å²	51.6	57%	0.574	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.6	-40.8	-168.6	-177.4	177.9	175.2	-176.8	0.4	115	C260	R212-C260 HydrophobicContact CG-CB 4.34Å
213	K	90.9	Very high	93.6	Very high	211 Å²	211	47.8 Å²	47.8	92%	0.917	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-13.2	-179.1	-65.2	-174.5	179.1	-178.9	0	114.1	A211	A211-K213 PolarHBondContact O-N 3.32Å
214	S	92.2	Very high	94.1	Very high	53 Å²	53	46.9 Å²	46.9	37%	0.371	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.5	-12.1	-177.6	-50.9	0	0	0	0	112.8	A211 K216 L219	A211-S214 CarbonylContact O-C 3.58Å; A211-S214 WeakPolarHBondContact O-CA 3.23Å; A211-S214 WeakPolarHBondContact O-CB 3.43Å; A211-S214 PolarHBondContact O-N 3.45Å; S214-K216 PolarHBondContact O-N 3.05Å; S214-L219 WeakPolarHBondContact O-CD2 3.49Å
215	L	94.8	Very high	93.9	Very high	15 Å²	15	42.7 Å²	42.7	8%	0.079	22%	0.217	C	C	.	.			trans	-58.5	125.3	-178.8	-68.1	178.1	0	0	0	111.3	A211 F236 F239 F247 C260 A263	A211-L215 HydrophobicContact CB-CD2 3.96Å; A211-L215 HydrophobicContact CB-CG 4.35Å; A211-L215 WeakPolarHBondContact O-CG 3.17Å; A211-L215 PolarHBondContact O-N 2.93Å; L215-F236 HydrophobicContact CB-CD1 4.13Å; L215-F236 HydrophobicContact CB-CE1 4.08Å; L215-F236 HydrophobicContact CB-CE2 4.47Å; L215-F236 HydrophobicContact CB-CG 4.32Å; L215-F236 HydrophobicContact CB-CZ 4.24Å; L215-F236 HydrophobicContact CD1-CD2 4.08Å; L215-F236 HydrophobicContact CD1-CE2 4Å; L215-F236 HydrophobicContact CD1-CZ 4.47Å; L215-F236 HydrophobicContact CD2-CB 4.07Å; L215-F236 HydrophobicContact CD2-CD2 4.2Å; L215-F236 HydrophobicContact CD2-CG 4.04Å; L215-F236 HydrophobicContact CG-CD2 4.49Å; L215-F239 HydrophobicContact CB-CE1 4.44Å; L215-F239 HydrophobicContact CB-CZ 3.88Å; L215-F239 HydrophobicContact CD1-CE1 4.41Å; L215-F247 HydrophobicContact CD1-CZ 4.35Å; L215-F247 HydrophobicContact CD2-CE1 4.47Å; L215-C260 HydrophobicContact CD1-CB 3.91Å; L215-A263 HydrophobicContact CD1-CB 4.11Å; L215-A263 HydrophobicContact CD2-CB 4.16Å
216	K	95	Very high	93.6	Very high	88 Å²	88	47.5 Å²	47.5	38%	0.383	23%	0.225	S	C	.	.			trans	-143.2	151.9	173.3	59.9	-176.4	170.7	-172.6	0	108.2	N144 S214 D218 L219 F236	N144-K216 PolarHBondContact O-NZ 3.09Å; N144-K216 VanDerWaalsContact O-NZ 3.08Å; S214-K216 PolarHBondContact O-N 3.05Å; K216-D218 PolarHBondContact O-N 3.05Å; K216-L219 HydrophobicContact CG-CB 3.99Å; K216-L219 WeakPolarHBondContact O-CB 3.49Å; K216-L219 PolarHBondContact O-N 3.19Å; K216-L219 VanDerWaalsContact O-N 3.11Å; K216-F236 WeakPolarHBondContact O-CD1 3.43Å
217	P	95.4	Very high	92.8	Very high	78 Å²	78	52.5 Å²	52.5	51%	0.506	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48	137.6	179.2	-28.5	35.8	0	0	0	112.1	V146 L219 F236	V146-P217 WeakPolarHBondContact CG2-O 3.46Å; P217-L219 PolarHBondContact O-N 3Å; P217-F236 CarbonylContact C-O 3.6Å
218	D	94.9	Very high	92	Very high	69 Å²	69	55.2 Å²	55.2	37%	0.369	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.4	10.6	-179.7	-53.1	-47.2	0	0	0	116.2	V146 K216 P220 I235 F236 R237	V146-D218 HydrophobicContact CG1-CB 3.72Å; V146-D218 HydrophobicContact CG2-CB 4.39Å; K216-D218 PolarHBondContact O-N 3.05Å; D218-P220 VanDerWaalsContact O-CD 3.31Å; D218-P220 WeakPolarHBondContact O-CD 3.39Å; D218-I235 HydrophobicContact CB-CG2 4.39Å; D218-F236 WeakPolarHBondContact CA-O 3.29Å; D218-F236 PolarHBondContact N-O 3.17Å; D218-R237 IonicContact OD1-CZ 3.13Å; D218-R237 IonicContact OD1-NH1 3.58Å; D218-R237 PolarHBondContact OD1-NH1 2.85Å
219	L	96.6	Very high	91.5	Very high	1 Å²	1	55.1 Å²	55.1	1%	0.005	30%	0.297	C	S	.	.			trans	-70	125.8	173.2	-177.2	69.4	0	0	0	111.3	S145 S214 K216 P217 F236	S145-L219 WeakPolarHBondContact O-CD1 3.22Å; S214-L219 WeakPolarHBondContact O-CD2 3.49Å; K216-L219 HydrophobicContact CG-CB 3.99Å; K216-L219 WeakPolarHBondContact O-CB 3.49Å; K216-L219 PolarHBondContact O-N 3.19Å; K216-L219 VanDerWaalsContact O-N 3.11Å; P217-L219 PolarHBondContact O-N 3Å; L219-F236 PolarHBondContact O-N 3.47Å
220	P	97.3	Very high	91.1	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	133.6	167	-23.7	37	0	0	0	111.7	V143 S145 E147 Y149 D218 A234 I266 F271	V143-P220 HydrophobicContact CG1-CB 4.35Å; V143-P220 HydrophobicContact CG1-CG 4.23Å; S145-P220 WeakPolarHBondContact O-CD 3.12Å; E147-P220 HydrophobicContact CB-CG 4.37Å; E147-P220 WeakPolarHBondContact O-CG 3.45Å; Y149-P220 HydrophobicContact CE2-CB 3.92Å; Y149-P220 HydrophobicContact CE2-CG 4.37Å; D218-P220 VanDerWaalsContact O-CD 3.31Å; D218-P220 WeakPolarHBondContact O-CD 3.39Å; P220-A234 WeakPolarHBondContact CA-O 3.47Å; P220-I266 HydrophobicContact CB-CG2 4.02Å; P220-F271 HydrophobicContact CB-CD2 3.84Å; P220-F271 HydrophobicContact CB-CE2 3.68Å; P220-F271 HydrophobicContact CG-CD2 4.24Å; P220-F271 HydrophobicContact CG-CE2 3.59Å; P220-F271 HydrophobicContact CG-CZ 4.27Å
221	C	97.5	Very high	91.1	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	173.5	179.7	65.4	0	0	0	0	111.5	A234 F264	C221-A234 PolarHBondContact N-O 3.26Å; C221-A234 PolarHBondContact O-N 3.39Å; C221-A234 VanDerWaalsContact O-O 3.14Å; C221-F264 WeakPolarHBondContact CA-O 3.4Å; C221-F264 VanDerWaalsContact CB-O 3.32Å; C221-F264 WeakPolarHBondContact CB-O 3.5Å
222	L	97.3	Very high	91.1	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	147	164	-59.3	174.9	0	0	0	109.3	L200 W208 L231 R232 R233 A263 F264 I266 I270	L200-L222 HydrophobicContact CD2-CD1 3.84Å; L200-L222 HydrophobicContact CD2-CD2 3.71Å; L200-L222 HydrophobicContact CD2-CG 4.41Å; W208-L222 HydrophobicContact CE3-CD1 3.49Å; W208-L222 VanDerWaalsContact CE3-CD1 3.49Å; W208-L222 HydrophobicContact CH2-CD1 4.11Å; W208-L222 HydrophobicContact CZ3-CD1 3.25Å; L222-L231 HydrophobicContact CB-CD2 4.09Å; L222-R232 CarbonylContact C-O 3.56Å; L222-R232 VanDerWaalsContact CA-O 3.27Å; L222-R232 WeakPolarHBondContact CA-O 3.31Å; L222-R233 HydrophobicContact CD2-CB 4.5Å; L222-R233 HydrophobicContact CD2-CG 3.89Å; L222-A263 CarbonylContact O-C 3.52Å; L222-A263 WeakPolarHBondContact O-CA 3.35Å; L222-F264 HydrophobicContact CB-CB 4.28Å; L222-F264 PolarHBondContact N-O 2.72Å; L222-F264 PolarHBondContact O-N 2.82Å; L222-I266 HydrophobicContact CD1-CG1 4.47Å; L222-I266 HydrophobicContact CD2-CB 4.38Å; L222-I266 HydrophobicContact CD2-CD1 3.82Å; L222-I266 HydrophobicContact CD2-CG1 3.86Å; L222-I266 HydrophobicContact CG-CB 4.01Å; L222-I266 HydrophobicContact CG-CD1 4.39Å; L222-I266 HydrophobicContact CG-CG1 3.95Å; L222-I270 HydrophobicContact CD2-CG2 4.32Å
223	V	96.3	Very high	91.3	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	144.4	177.6	76.8	0	0	0	0	111.8	R232 A234 F247 L249 T258 H262	V223-R232 PolarHBondContact N-O 2.97Å; V223-R232 PolarHBondContact O-N 2.92Å; V223-A234 HydrophobicContact CB-CB 4.47Å; V223-A234 HydrophobicContact CG1-CB 3.85Å; V223-F247 HydrophobicContact CB-CD1 4.31Å; V223-F247 HydrophobicContact CG2-CD1 4.21Å; V223-F247 HydrophobicContact CG2-CD2 4.38Å; V223-F247 HydrophobicContact CG2-CE1 4.18Å; V223-F247 HydrophobicContact CG2-CE2 4.36Å; V223-F247 HydrophobicContact CG2-CG 4.31Å; V223-F247 HydrophobicContact CG2-CZ 4.26Å; V223-L249 HydrophobicContact CG1-CD2 3.66Å; V223-T258 HydrophobicContact CG2-CG2 3.34Å; V223-H262 WeakPolarHBondContact CA-O 3.49Å
224	L	93.9	Very high	91.6	Very high	19 Å²	19	41.5 Å²	41.5	10%	0.099	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	115	163.6	-60.7	167.6	0	0	0	108.5	V203 R226 G229 L231 T258 H262 F264	V203-L224 HydrophobicContact CG1-CD2 4.41Å; L224-R226 PolarHBondContact O-N 3.17Å; L224-G229 VanDerWaalsContact CD2-O 3.27Å; L224-G229 WeakPolarHBondContact CD2-O 3.47Å; L224-L231 HydrophobicContact CD2-CD2 3.73Å; L224-L231 HydrophobicContact CD2-CG 3.81Å; L224-L231 HydrophobicContact CG-CD2 3.77Å; L224-L231 HydrophobicContact CG-CG 4.4Å; L224-T258 PolarHBondContact O-OG1 2.98Å; L224-H262 HydrophobicContact CB-CB 4.11Å; L224-H262 PolarHBondContact N-O 2.55Å; L224-H262 VanDerWaalsContact N-O 3.17Å; L224-F264 HydrophobicContact CD1-CE2 4.14Å; L224-F264 HydrophobicContact CG-CE2 4.25Å
225	D	82.4	Confident	91.8	Very high	41 Å²	41	39.9 Å²	39.9	22%	0.219	23%	0.228	C	C	.	.	S	Bend	trans	-62.8	-33.2	177.1	58.7	-4.3	0	0	0	111.8	R232	D225-R232 IonicContact OD2-CZ 3.4Å; D225-R232 IonicContact OD2-NE 2.72Å; D225-R232 PolarHBondContact OD2-NE 2.66Å; D225-R232 IonicContact OD2-NH2 2.85Å; D225-R232 PolarHBondContact OD2-NH2 2.94Å
226	R	83	Confident	91.9	Very high	165 Å²	165	39.2 Å²	39.2	62%	0.623	22%	0.224	S	C	*	.	S	Bend	trans	-142.8	156.4	174.5	61.4	-166.8	160.2	174	-0.6	111.4	L224 G228 G229	L224-R226 PolarHBondContact O-N 3.17Å; R226-G228 PolarHBondContact O-N 3.32Å; R226-G229 PolarHBondContact O-N 3.31Å
227	P	76.4	Confident	92	Very high	109 Å²	109	39.8 Å²	39.8	71%	0.708	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.3	131.4	171.3	-23.2	33.5	0	0	0	111	G229	P227-G229 PolarHBondContact O-N 3.1Å
228	G	77.2	Confident	92	Very high	86 Å²	86	38.4 Å²	38.4	89%	0.887	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.1	8.4	-176.1	0	0	0	0	0	115.2	R226	R226-G228 PolarHBondContact O-N 3.32Å
229	G	83.8	Confident	92	Very high	12 Å²	12	40.9 Å²	40.9	12%	0.124	22%	0.223	C	C	.	.			trans	-72.6	-178.7	174.9	0	0	0	0	0	113.5	L224 R226 P227	L224-G229 VanDerWaalsContact CD2-O 3.27Å; L224-G229 WeakPolarHBondContact CD2-O 3.47Å; R226-G229 PolarHBondContact O-N 3.31Å; P227-G229 PolarHBondContact O-N 3.1Å
230	T	87.7	Confident	91.9	Very high	67 Å²	67	42.5 Å²	42.5	41%	0.411	23%	0.234	S	C	.	.			trans	-87.9	146.4	169.9	51.3	0	0	0	0	110.3
231	L	94.8	Very high	91.6	Very high	5 Å²	5	47 Å²	47	3%	0.026	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	138.8	172.6	-75.2	165.8	0	0	0	110.7	L200 V203 W208 L222 L224 F264	L200-L231 HydrophobicContact CB-CB 4.3Å; L200-L231 HydrophobicContact CD2-CB 3.93Å; L200-L231 PolarHBondContact O-N 3.42Å; V203-L231 HydrophobicContact CG2-CG 4.39Å; W208-L231 HydrophobicContact CD2-CD1 3.32Å; W208-L231 HydrophobicContact CE3-CD1 3.94Å; W208-L231 HydrophobicContact CG-CD1 3.62Å; W208-L231 HydrophobicContact CH2-CD1 4.18Å; W208-L231 HydrophobicContact CZ2-CD1 3.62Å; W208-L231 HydrophobicContact CZ3-CD1 4.33Å; L222-L231 HydrophobicContact CB-CD2 4.09Å; L224-L231 HydrophobicContact CD2-CD2 3.73Å; L224-L231 HydrophobicContact CD2-CG 3.81Å; L224-L231 HydrophobicContact CG-CD2 3.77Å; L224-L231 HydrophobicContact CG-CG 4.4Å; L231-F264 HydrophobicContact CD2-CD2 3.51Å; L231-F264 HydrophobicContact CD2-CE2 3.75Å
232	R	94.7	Very high	91.3	Very high	62 Å²	62	57.9 Å²	57.9	23%	0.234	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	146	175.8	-60.8	-174.5	-172	-106	11.1	110.4	L222 V223 D225 L249	L222-R232 CarbonylContact C-O 3.56Å; L222-R232 VanDerWaalsContact CA-O 3.27Å; L222-R232 WeakPolarHBondContact CA-O 3.31Å; V223-R232 PolarHBondContact N-O 2.97Å; V223-R232 PolarHBondContact O-N 2.92Å; D225-R232 IonicContact OD2-CZ 3.4Å; D225-R232 IonicContact OD2-NE 2.72Å; D225-R232 PolarHBondContact OD2-NE 2.66Å; D225-R232 IonicContact OD2-NH2 2.85Å; D225-R232 PolarHBondContact OD2-NH2 2.94Å; R232-L249 HydrophobicContact CB-CD2 4.2Å
233	R	95.8	Very high	91	Very high	1 Å²	1	59.7 Å²	59.7	0%	0.004	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	134.6	170.1	-58.4	-173.2	-62.8	171.8	-3.3	109.3	Y149 L200 L222 V250 D251 I266 I270 C273 Y274	Y149-R233 HydrophobicContact CE1-CB 4.34Å; L200-R233 HydrophobicContact CD1-CG 4.28Å; L222-R233 HydrophobicContact CD2-CB 4.5Å; L222-R233 HydrophobicContact CD2-CG 3.89Å; R233-V250 HydrophobicContact CB-CG2 3.6Å; R233-V250 PolarHBondContact O-N 2.94Å; R233-D251 WeakPolarHBondContact CB-OD2 3.46Å; R233-D251 IonicContact CZ-OD1 3.76Å; R233-D251 IonicContact CZ-OD2 3.77Å; R233-D251 IonicContact NE-OD1 2.74Å; R233-D251 PolarHBondContact NE-OD1 3.47Å; R233-D251 IonicContact NE-OD2 3.38Å; R233-D251 PolarHBondContact NE-OD2 3.45Å; R233-D251 IonicContact NH2-OD1 3.05Å; R233-D251 PolarHBondContact NH2-OD1 2.95Å; R233-D251 IonicContact NH2-OD2 3.57Å; R233-I266 HydrophobicContact CB-CD1 4.43Å; R233-I266 HydrophobicContact CG-CD1 3.96Å; R233-I270 HydrophobicContact CG-CG2 4.06Å; R233-I270 PolarHBondContact NH1-O 3.25Å; R233-C273 PolarHBondContact NH1-O 3.04Å; R233-Y274 PolarHBondContact NH2-O 3.47Å
234	A	96.5	Very high	91	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	165.1	-176.4	0	0	0	0	0	111.9	Y149 P220 C221 V223 F247 Y248 L249	Y149-A234 PolarHBondContact OH-O 3.17Å; P220-A234 WeakPolarHBondContact CA-O 3.47Å; C221-A234 PolarHBondContact N-O 3.26Å; C221-A234 PolarHBondContact O-N 3.39Å; C221-A234 VanDerWaalsContact O-O 3.14Å; V223-A234 HydrophobicContact CB-CB 4.47Å; V223-A234 HydrophobicContact CG1-CB 3.85Å; A234-F247 HydrophobicContact CB-CB 4.23Å; A234-F247 HydrophobicContact CB-CD1 4.36Å; A234-Y248 CarbonylContact C-O 3.55Å; A234-Y248 WeakPolarHBondContact CA-O 3.45Å; A234-L249 HydrophobicContact CB-CD2 3.95Å
235	I	96.4	Very high	91	Very high	20 Å²	20	62.7 Å²	62.7	10%	0.103	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	124.2	165.3	-60.8	172.2	0	0	0	107	Y149 D218 F247 Y248 V250	Y149-I235 HydrophobicContact CD2-CD1 4.2Å; Y149-I235 HydrophobicContact CD2-CG1 4.18Å; Y149-I235 HydrophobicContact CE2-CD1 4.4Å; Y149-I235 HydrophobicContact CE2-CG1 3.86Å; D218-I235 HydrophobicContact CB-CG2 4.39Å; I235-F247 CarbonylContact O-C 3.51Å; I235-F247 WeakPolarHBondContact O-CA 3.47Å; I235-Y248 PolarHBondContact N-O 2.72Å; I235-Y248 PolarHBondContact O-N 3.18Å; I235-V250 HydrophobicContact CD1-CG1 3.87Å; I235-V250 HydrophobicContact CG1-CG1 3.87Å
236	F	97.1	Very high	91.7	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	126.8	173.9	176.8	-101.1	0	0	0	110.2	L215 K216 P217 D218 L219 S238 F239 F247	L215-F236 HydrophobicContact CB-CD1 4.13Å; L215-F236 HydrophobicContact CB-CE1 4.08Å; L215-F236 HydrophobicContact CB-CE2 4.47Å; L215-F236 HydrophobicContact CB-CG 4.32Å; L215-F236 HydrophobicContact CB-CZ 4.24Å; L215-F236 HydrophobicContact CD1-CD2 4.08Å; L215-F236 HydrophobicContact CD1-CE2 4Å; L215-F236 HydrophobicContact CD1-CZ 4.47Å; L215-F236 HydrophobicContact CD2-CB 4.07Å; L215-F236 HydrophobicContact CD2-CD2 4.2Å; L215-F236 HydrophobicContact CD2-CG 4.04Å; L215-F236 HydrophobicContact CG-CD2 4.49Å; K216-F236 WeakPolarHBondContact O-CD1 3.43Å; P217-F236 CarbonylContact C-O 3.6Å; D218-F236 WeakPolarHBondContact CA-O 3.29Å; D218-F236 PolarHBondContact N-O 3.17Å; L219-F236 PolarHBondContact O-N 3.47Å; F236-S238 WeakPolarHBondContact CE2-O 3.39Å; F236-S238 WeakPolarHBondContact CZ-O 3.21Å; F236-F239 HydrophobicContact CE1-CD2 4.05Å; F236-F239 AromaticContact CE1-CE2 3.83Å; F236-F239 HydrophobicContact CE1-CE2 3.83Å; F236-F239 HydrophobicContact CE1-CZ 4.15Å; F236-F239 HydrophobicContact CE2-CD1 4.41Å; F236-F239 HydrophobicContact CE2-CE1 4.43Å; F236-F239 HydrophobicContact CZ-CB 4.47Å; F236-F239 AromaticContact CZ-CD1 3.81Å; F236-F239 HydrophobicContact CZ-CD1 3.81Å; F236-F239 AromaticContact CZ-CD2 3.67Å; F236-F239 HydrophobicContact CZ-CD2 3.67Å; F236-F239 AromaticContact CZ-CE1 3.82Å; F236-F239 HydrophobicContact CZ-CE1 3.82Å; F236-F239 AromaticContact CZ-CE2 3.68Å; F236-F239 HydrophobicContact CZ-CE2 3.68Å; F236-F239 AromaticContact CZ-CG 3.73Å; F236-F239 HydrophobicContact CZ-CG 3.73Å; F236-F239 AromaticContact CZ-CZ 3.76Å; F236-F239 HydrophobicContact CZ-CZ 3.76Å; F236-F247 HydrophobicContact CB-CD1 4.26Å; F236-F247 HydrophobicContact CB-CE1 4.19Å; F236-F247 HydrophobicContact CD2-CD1 4.07Å; F236-F247 AromaticContact CD2-CE1 3.58Å; F236-F247 HydrophobicContact CD2-CE1 3.58Å; F236-F247 HydrophobicContact CD2-CE2 4.29Å; F236-F247 AromaticContact CD2-CZ 3.7Å; F236-F247 HydrophobicContact CD2-CZ 3.7Å; F236-F247 HydrophobicContact CE2-CE1 4.5Å; F236-F247 HydrophobicContact CE2-CZ 4.19Å; F236-F247 HydrophobicContact CG-CE1 4.35Å
237	R	96.4	Very high	92.3	Very high	100 Å²	100	55.4 Å²	55.4	38%	0.377	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	-53.6	-178.9	-63.8	-59.4	-169.3	172.7	6.7	112.1	D218 L246	D218-R237 IonicContact OD1-CZ 3.13Å; D218-R237 IonicContact OD1-NH1 3.58Å; D218-R237 PolarHBondContact OD1-NH1 2.85Å; R237-L246 HydrophobicContact CB-CB 4.36Å; R237-L246 HydrophobicContact CB-CD2 4.14Å; R237-L246 HydrophobicContact CB-CG 4.22Å; R237-L246 PolarHBondContact N-O 3.47Å
238	S	95.9	Very high	93.2	Very high	49 Å²	49	51.8 Å²	51.8	34%	0.343	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	157.6	-175.9	60.5	0	0	0	0	112.5	F236 G245 L246	F236-S238 WeakPolarHBondContact CE2-O 3.39Å; F236-S238 WeakPolarHBondContact CZ-O 3.21Å; S238-G245 CarbonylContact O-C 3.45Å; S238-G245 WeakPolarHBondContact O-CA 3.47Å; S238-L246 PolarHBondContact O-N 3.31Å
239	F	95.6	Very high	94	Very high	121 Å²	121	47.8 Å²	47.8	53%	0.531	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	139.4	167.3	-69.8	-79.8	0	0	0	110.2	L215 F236	L215-F239 HydrophobicContact CB-CE1 4.44Å; L215-F239 HydrophobicContact CB-CZ 3.88Å; L215-F239 HydrophobicContact CD1-CE1 4.41Å; F236-F239 HydrophobicContact CE1-CD2 4.05Å; F236-F239 AromaticContact CE1-CE2 3.83Å; F236-F239 HydrophobicContact CE1-CE2 3.83Å; F236-F239 HydrophobicContact CE1-CZ 4.15Å; F236-F239 HydrophobicContact CE2-CD1 4.41Å; F236-F239 HydrophobicContact CE2-CE1 4.43Å; F236-F239 HydrophobicContact CZ-CB 4.47Å; F236-F239 AromaticContact CZ-CD1 3.81Å; F236-F239 HydrophobicContact CZ-CD1 3.81Å; F236-F239 AromaticContact CZ-CD2 3.67Å; F236-F239 HydrophobicContact CZ-CD2 3.67Å; F236-F239 AromaticContact CZ-CE1 3.82Å; F236-F239 HydrophobicContact CZ-CE1 3.82Å; F236-F239 AromaticContact CZ-CE2 3.68Å; F236-F239 HydrophobicContact CZ-CE2 3.68Å; F236-F239 AromaticContact CZ-CG 3.73Å; F236-F239 HydrophobicContact CZ-CG 3.73Å; F236-F239 AromaticContact CZ-CZ 3.76Å; F236-F239 HydrophobicContact CZ-CZ 3.76Å
240	C	93.4	Very high	94.4	Very high	35 Å²	35	47.3 Å²	47.3	24%	0.236	24%	0.237	C	C	.	.			trans	-109.2	164.4	171	-62.9	0	0	0	0	109.3	Q244 T257	C240-Q244 HydrophobicContact CB-CB 3.84Å; C240-Q244 PolarHBondContact N-O 3.48Å; C240-Q244 VanDerWaalsContact O-O 3.11Å; C240-T257 HydrophobicContact CB-CG2 4.49Å
241	P	91.4	Very high	94.6	Very high	94 Å²	94	45.7 Å²	45.7	61%	0.61	23%	0.226	S	C	*	.	G	3₁₀ helix	trans	-54.6	160.9	173.9	-26.9	36.4	0	0	0	113.3	G243 Q244	P241-G243 VanDerWaalsContact C-N 3.28Å; P241-G243 PolarHBondContact O-N 3.32Å; P241-Q244 PolarHBondContact O-N 3.44Å
242	Y	91.3	Very high	94.4	Very high	230 Å²	230	47.7 Å²	47.7	90%	0.902	24%	0.236	S	C	*	.	G	3₁₀ helix	trans	60.1	29.8	174.5	-46.1	-68.7	0	0	0	115.3	Q244	Y242-Q244 VanDerWaalsContact C-N 3.26Å; Y242-Q244 PolarHBondContact O-N 2.83Å
243	G	92	Very high	94.2	Very high	37 Å²	37	45.9 Å²	45.9	38%	0.381	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	74.8	14.8	177.1	0	0	0	0	0	114.3	P241 C260	P241-G243 VanDerWaalsContact C-N 3.28Å; P241-G243 PolarHBondContact O-N 3.32Å; G243-C260 WeakPolarHBondContact O-CB 3.43Å; G243-C260 PolarHBondContact O-N 3.28Å
244	Q	94.8	Very high	93.9	Very high	83 Å²	83	49.9 Å²	49.9	39%	0.388	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	164.3	172.3	-64.6	-172.1	-24	0	0	111.5	C240 P241 Y242 T257 T258 C260	C240-Q244 HydrophobicContact CB-CB 3.84Å; C240-Q244 PolarHBondContact N-O 3.48Å; C240-Q244 VanDerWaalsContact O-O 3.11Å; P241-Q244 PolarHBondContact O-N 3.44Å; Y242-Q244 VanDerWaalsContact C-N 3.26Å; Y242-Q244 PolarHBondContact O-N 2.83Å; Q244-T257 HydrophobicContact CB-CG2 3.89Å; Q244-T257 HydrophobicContact CG-CG2 4.44Å; Q244-T257 VanDerWaalsContact OE1-CG2 3.3Å; Q244-T258 CarbonylContact C-O 3.53Å; Q244-T258 WeakPolarHBondContact CA-O 3.47Å; Q244-C260 PolarHBondContact O-SG 2.89Å
245	G	94.6	Very high	93.7	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	152.4	172.6	0	0	0	0	0	110.8	S238 F247 T257 T258	S238-G245 CarbonylContact O-C 3.45Å; S238-G245 WeakPolarHBondContact O-CA 3.47Å; G245-F247 WeakPolarHBondContact O-CD2 3.22Å; G245-F247 WeakPolarHBondContact O-CE2 3.34Å; G245-T257 WeakPolarHBondContact O-CA 3.49Å; G245-T258 PolarHBondContact N-O 3.28Å; G245-T258 PolarHBondContact O-N 3.38Å; G245-T258 VanDerWaalsContact O-N 3.11Å
246	L	96.3	Very high	93.6	Very high	52 Å²	52	53.1 Å²	53.1	27%	0.272	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	122.4	170.2	-176.9	65.3	0	0	0	108.8	R237 S238	R237-L246 HydrophobicContact CB-CB 4.36Å; R237-L246 HydrophobicContact CB-CD2 4.14Å; R237-L246 HydrophobicContact CB-CG 4.22Å; R237-L246 PolarHBondContact N-O 3.47Å; S238-L246 PolarHBondContact O-N 3.31Å
247	F	95.9	Very high	93.4	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	134.7	-178	-63.1	-96.1	0	0	0	109.9	L215 V223 A234 I235 F236 G245 S255 V256 T258 A263	L215-F247 HydrophobicContact CD1-CZ 4.35Å; L215-F247 HydrophobicContact CD2-CE1 4.47Å; V223-F247 HydrophobicContact CB-CD1 4.31Å; V223-F247 HydrophobicContact CG2-CD1 4.21Å; V223-F247 HydrophobicContact CG2-CD2 4.38Å; V223-F247 HydrophobicContact CG2-CE1 4.18Å; V223-F247 HydrophobicContact CG2-CE2 4.36Å; V223-F247 HydrophobicContact CG2-CG 4.31Å; V223-F247 HydrophobicContact CG2-CZ 4.26Å; A234-F247 HydrophobicContact CB-CB 4.23Å; A234-F247 HydrophobicContact CB-CD1 4.36Å; I235-F247 CarbonylContact O-C 3.51Å; I235-F247 WeakPolarHBondContact O-CA 3.47Å; F236-F247 HydrophobicContact CB-CD1 4.26Å; F236-F247 HydrophobicContact CB-CE1 4.19Å; F236-F247 HydrophobicContact CD2-CD1 4.07Å; F236-F247 AromaticContact CD2-CE1 3.58Å; F236-F247 HydrophobicContact CD2-CE1 3.58Å; F236-F247 HydrophobicContact CD2-CE2 4.29Å; F236-F247 AromaticContact CD2-CZ 3.7Å; F236-F247 HydrophobicContact CD2-CZ 3.7Å; F236-F247 HydrophobicContact CE2-CE1 4.5Å; F236-F247 HydrophobicContact CE2-CZ 4.19Å; F236-F247 HydrophobicContact CG-CE1 4.35Å; G245-F247 WeakPolarHBondContact O-CD2 3.22Å; G245-F247 WeakPolarHBondContact O-CE2 3.34Å; F247-S255 CarbonylContact O-C 3.26Å; F247-S255 WeakPolarHBondContact O-CA 3.48Å; F247-V256 HydrophobicContact CB-CG2 4.09Å; F247-V256 PolarHBondContact N-O 3.02Å; F247-V256 PolarHBondContact O-N 3.26Å; F247-T258 HydrophobicContact CD2-CG2 3.5Å; F247-T258 HydrophobicContact CE2-CG2 3.6Å; F247-T258 HydrophobicContact CG-CG2 4.35Å; F247-A263 HydrophobicContact CE1-CB 3.86Å; F247-A263 HydrophobicContact CZ-CB 3.91Å
248	Y	94.6	Very high	93.3	Very high	33 Å²	33	52.4 Å²	52.4	13%	0.129	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	112	172.1	-175.1	-103.8	0	0	0	109.9	A234 I235 V250 E253	A234-Y248 CarbonylContact C-O 3.55Å; A234-Y248 WeakPolarHBondContact CA-O 3.45Å; I235-Y248 PolarHBondContact N-O 2.72Å; I235-Y248 PolarHBondContact O-N 3.18Å; Y248-V250 HydrophobicContact CD1-CG1 4.03Å; Y248-V250 HydrophobicContact CE1-CG1 4.37Å; Y248-V250 PolarHBondContact O-N 3.29Å; Y248-E253 WeakPolarHBondContact CE1-OE1 3.22Å; Y248-E253 WeakPolarHBondContact OH-CA 3.36Å; Y248-E253 WeakPolarHBondContact OH-CB 3.41Å; Y248-E253 PolarHBondContact OH-OE1 2.76Å; Y248-E253 PolarHBondContact OH-OE2 2.81Å
249	L	94.3	Very high	93.2	Very high	3 Å²	3	51.4 Å²	51.4	2%	0.016	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	104.9	179.6	-55.4	-176.6	0	0	0	109.6	V223 R232 A234 D251 L252 E253 K254 V256	V223-L249 HydrophobicContact CG1-CD2 3.66Å; R232-L249 HydrophobicContact CB-CD2 4.2Å; A234-L249 HydrophobicContact CB-CD2 3.95Å; L249-D251 VanDerWaalsContact C-N 3.31Å; L249-D251 PolarHBondContact O-N 3.08Å; L249-L252 HydrophobicContact CB-CB 4.18Å; L249-L252 HydrophobicContact CB-CD1 4.5Å; L249-L252 HydrophobicContact CD1-CD1 3.82Å; L249-L252 PolarHBondContact O-N 3.14Å; L249-L252 VanDerWaalsContact O-N 3.16Å; L249-E253 PolarHBondContact O-N 3.26Å; L249-K254 WeakPolarHBondContact CB-O 3.45Å; L249-K254 PolarHBondContact N-O 3Å; L249-K254 PolarHBondContact O-N 3.07Å; L249-V256 HydrophobicContact CD1-CB 4.4Å; L249-V256 HydrophobicContact CD1-CG1 3.56Å; L249-V256 HydrophobicContact CD1-CG2 3.92Å; L249-V256 HydrophobicContact CD2-CG2 3.84Å; L249-V256 HydrophobicContact CG-CG1 4.1Å; L249-V256 HydrophobicContact CG-CG2 3.81Å
250	V	93.4	Very high	93.1	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.006	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-31.4	-173.3	-61	0	0	0	0	112.8	Y149 R233 I235 Y248 L252 V275	Y149-V250 HydrophobicContact CD2-CB 4.46Å; Y149-V250 HydrophobicContact CD2-CG1 3.79Å; Y149-V250 HydrophobicContact CD2-CG2 4.29Å; Y149-V250 HydrophobicContact CE1-CG2 4.36Å; Y149-V250 HydrophobicContact CE2-CG1 3.85Å; Y149-V250 HydrophobicContact CE2-CG2 4.13Å; Y149-V250 HydrophobicContact CG-CG2 4.47Å; R233-V250 HydrophobicContact CB-CG2 3.6Å; R233-V250 PolarHBondContact O-N 2.94Å; I235-V250 HydrophobicContact CD1-CG1 3.87Å; I235-V250 HydrophobicContact CG1-CG1 3.87Å; Y248-V250 HydrophobicContact CD1-CG1 4.03Å; Y248-V250 HydrophobicContact CE1-CG1 4.37Å; Y248-V250 PolarHBondContact O-N 3.29Å; V250-L252 PolarHBondContact O-N 3.42Å; V250-V275 HydrophobicContact CB-CG1 4.43Å; V250-V275 HydrophobicContact CB-CG2 4.12Å; V250-V275 HydrophobicContact CG2-CG2 3.94Å; V250-V275 VanDerWaalsContact O-CG1 3.3Å; V250-V275 WeakPolarHBondContact O-CG1 3.28Å
251	D	91.8	Very high	93.1	Very high	34 Å²	34	49.6 Å²	49.6	18%	0.182	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	8	178.3	-64	-46.3	0	0	0	113.5	R233 L249 V277	R233-D251 WeakPolarHBondContact CB-OD2 3.46Å; R233-D251 IonicContact CZ-OD1 3.76Å; R233-D251 IonicContact CZ-OD2 3.77Å; R233-D251 IonicContact NE-OD1 2.74Å; R233-D251 PolarHBondContact NE-OD1 3.47Å; R233-D251 IonicContact NE-OD2 3.38Å; R233-D251 PolarHBondContact NE-OD2 3.45Å; R233-D251 IonicContact NH2-OD1 3.05Å; R233-D251 PolarHBondContact NH2-OD1 2.95Å; R233-D251 IonicContact NH2-OD2 3.57Å; L249-D251 VanDerWaalsContact C-N 3.31Å; L249-D251 PolarHBondContact O-N 3.08Å; D251-V277 WeakPolarHBondContact O-CG2 3.46Å
252	L	89.9	Confident	93.3	Very high	47 Å²	47	47 Å²	47	25%	0.246	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-137.9	-8	176.7	-68.1	-178.9	0	0	0	113.3	L177 L249 V250 K254	L177-L252 HydrophobicContact CD1-CD2 4.33Å; L249-L252 HydrophobicContact CB-CB 4.18Å; L249-L252 HydrophobicContact CB-CD1 4.5Å; L249-L252 HydrophobicContact CD1-CD1 3.82Å; L249-L252 PolarHBondContact O-N 3.14Å; L249-L252 VanDerWaalsContact O-N 3.16Å; V250-L252 PolarHBondContact O-N 3.42Å; L252-K254 HydrophobicContact CB-CB 4.35Å; L252-K254 PolarHBondContact O-N 3.17Å
253	E	90.9	Very high	93.5	Very high	23 Å²	23	36.1 Å²	36.1	11%	0.107	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	46.8	44.2	-169.7	-63.9	-74.4	102.9	0	0	112.5	R151 V186 Y248 L249 V277	R151-E253 IonicContact CZ-OE1 2.67Å; R151-E253 IonicContact CZ-OE2 3.66Å; R151-E253 IonicContact NH1-OE1 3.42Å; R151-E253 PolarHBondContact NH1-OE1 3.3Å; R151-E253 IonicContact NH1-OE2 3.63Å; R151-E253 PolarHBondContact NH1-OE2 2.85Å; R151-E253 IonicContact NH2-OE1 2.85Å; R151-E253 PolarHBondContact NH2-OE1 3.42Å; R151-E253 IonicContact NH2-OE2 3.43Å; V186-E253 HydrophobicContact CG1-CB 3.91Å; V186-E253 HydrophobicContact CG1-CG 4.09Å; V186-E253 HydrophobicContact CG2-CB 3.81Å; V186-E253 HydrophobicContact CG2-CG 4.5Å; Y248-E253 WeakPolarHBondContact CE1-OE1 3.22Å; Y248-E253 WeakPolarHBondContact OH-CA 3.36Å; Y248-E253 WeakPolarHBondContact OH-CB 3.41Å; Y248-E253 PolarHBondContact OH-OE1 2.76Å; Y248-E253 PolarHBondContact OH-OE2 2.81Å; L249-E253 PolarHBondContact O-N 3.26Å; E253-V277 HydrophobicContact CB-CG1 4.43Å; E253-V277 HydrophobicContact CG-CG1 3.73Å
254	K	90.2	Very high	93.7	Very high	85 Å²	85	36 Å²	36	37%	0.37	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	140.9	-178.9	172.9	165.9	174.8	144.8	0	111.9	L249 L252 V256 E478	L249-K254 WeakPolarHBondContact CB-O 3.45Å; L249-K254 PolarHBondContact N-O 3Å; L249-K254 PolarHBondContact O-N 3.07Å; L252-K254 HydrophobicContact CB-CB 4.35Å; L252-K254 PolarHBondContact O-N 3.17Å; K254-V256 HydrophobicContact CG-CG1 4.44Å; K254-E478 WeakPolarHBondContact CE-OE1 3.46Å; K254-E478 IonicContact NZ-OE1 2.72Å; K254-E478 PolarHBondContact NZ-OE1 3.14Å; K254-E478 IonicContact NZ-OE2 2.96Å; K254-E478 PolarHBondContact NZ-OE2 3.24Å; K254-E478 VanDerWaalsContact NZ-OE2 3.12Å
255	S	92.2	Very high	93.8	Very high	60 Å²	60	32.5 Å²	32.5	42%	0.42	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	139.8	169.2	-65.2	0	0	0	0	111.9	F247	F247-S255 CarbonylContact O-C 3.26Å; F247-S255 WeakPolarHBondContact O-CA 3.48Å
256	V	93.1	Very high	93.9	Very high	28 Å²	28	32.5 Å²	32.5	17%	0.17	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	149.3	174.2	-60.5	0	0	0	0	110.5	F247 L249 K254	F247-V256 HydrophobicContact CB-CG2 4.09Å; F247-V256 PolarHBondContact N-O 3.02Å; F247-V256 PolarHBondContact O-N 3.26Å; L249-V256 HydrophobicContact CD1-CB 4.4Å; L249-V256 HydrophobicContact CD1-CG1 3.56Å; L249-V256 HydrophobicContact CD1-CG2 3.92Å; L249-V256 HydrophobicContact CD2-CG2 3.84Å; L249-V256 HydrophobicContact CG-CG1 4.1Å; L249-V256 HydrophobicContact CG-CG2 3.81Å; K254-V256 HydrophobicContact CG-CG1 4.44Å
257	T	94	Very high	93.8	Very high	74 Å²	74	30.1 Å²	30.1	45%	0.454	16%	0.158	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	124	170	-57.8	0	0	0	0	108.8	C240 Q244 G245	C240-T257 HydrophobicContact CB-CG2 4.49Å; Q244-T257 HydrophobicContact CB-CG2 3.89Å; Q244-T257 HydrophobicContact CG-CG2 4.44Å; Q244-T257 VanDerWaalsContact OE1-CG2 3.3Å; G245-T257 WeakPolarHBondContact O-CA 3.49Å
258	T	93	Very high	93.8	Very high	11 Å²	11	31.2 Å²	31.2	7%	0.067	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	166.2	179.1	-176.2	0	0	0	0	110.7	V223 L224 Q244 G245 F247 C260	V223-T258 HydrophobicContact CG2-CG2 3.34Å; L224-T258 PolarHBondContact O-OG1 2.98Å; Q244-T258 CarbonylContact C-O 3.53Å; Q244-T258 WeakPolarHBondContact CA-O 3.47Å; G245-T258 PolarHBondContact N-O 3.28Å; G245-T258 PolarHBondContact O-N 3.38Å; G245-T258 VanDerWaalsContact O-N 3.11Å; F247-T258 HydrophobicContact CD2-CG2 3.5Å; F247-T258 HydrophobicContact CE2-CG2 3.6Å; F247-T258 HydrophobicContact CG-CG2 4.35Å; T258-C260 PolarHBondContact O-N 3.14Å
259	S	94.2	Very high	93.7	Very high	29 Å²	29	33.5 Å²	33.5	20%	0.203	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	132.3	179.9	-178.4	0	0	0	0	110.9	Q261 H262	S259-Q261 PolarHBondContact O-N 3.41Å; S259-Q261 VanDerWaalsContact OG-CG 3.25Å; S259-Q261 WeakPolarHBondContact OG-CG 3.45Å; S259-Q261 PolarHBondContact OG-N 3.34Å; S259-H262 WeakPolarHBondContact O-CB 3.36Å; S259-H262 PolarHBondContact O-N 3.09Å
260	C	94.8	Very high	93.7	Very high	2 Å²	2	33.4 Å²	33.4	1%	0.014	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-62.2	-15	177	-69.5	0	0	0	0	113.2	R212 L215 G243 Q244 T258 H262 A263	R212-C260 HydrophobicContact CG-CB 4.34Å; L215-C260 HydrophobicContact CD1-CB 3.91Å; G243-C260 WeakPolarHBondContact O-CB 3.43Å; G243-C260 PolarHBondContact O-N 3.28Å; Q244-C260 PolarHBondContact O-SG 2.89Å; T258-C260 PolarHBondContact O-N 3.14Å; C260-H262 VanDerWaalsContact C-N 3.25Å; C260-A263 PolarHBondContact O-N 3.23Å
261	Q	93.2	Very high	93.7	Very high	116 Å²	116	34 Å²	34	54%	0.542	17%	0.174	S	C	.	.	G	3₁₀ helix	trans	-72.2	-19.7	173.5	83.6	-163.8	-7.9	0	0	113.1	S259 A263	S259-Q261 PolarHBondContact O-N 3.41Å; S259-Q261 VanDerWaalsContact OG-CG 3.25Å; S259-Q261 WeakPolarHBondContact OG-CG 3.45Å; S259-Q261 PolarHBondContact OG-N 3.34Å; Q261-A263 VanDerWaalsContact C-N 3.29Å
262	H	93.8	Very high	93.7	Very high	39 Å²	39	40 Å²	40	18%	0.181	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-89.9	5.9	177.9	-61.6	161.1	0	0	0	112.9	V223 L224 S259 C260 F264	V223-H262 WeakPolarHBondContact CA-O 3.49Å; L224-H262 HydrophobicContact CB-CB 4.11Å; L224-H262 PolarHBondContact N-O 2.55Å; L224-H262 VanDerWaalsContact N-O 3.17Å; S259-H262 WeakPolarHBondContact O-CB 3.36Å; S259-H262 PolarHBondContact O-N 3.09Å; C260-H262 VanDerWaalsContact C-N 3.25Å; H262-F264 WeakPolarHBondContact O-CD2 3.5Å; H262-F264 VanDerWaalsContact O-CE2 3.31Å; H262-F264 WeakPolarHBondContact O-CE2 3.29Å
263	A	95.7	Very high	93.8	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.008	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	136.8	177.9	0	0	0	0	0	111.2	A211 L215 L222 F247 C260 Q261	A211-A263 HydrophobicContact CB-CB 4.26Å; A211-A263 PolarHBondContact N-O 3.38Å; L215-A263 HydrophobicContact CD1-CB 4.11Å; L215-A263 HydrophobicContact CD2-CB 4.16Å; L222-A263 CarbonylContact O-C 3.52Å; L222-A263 WeakPolarHBondContact O-CA 3.35Å; F247-A263 HydrophobicContact CE1-CB 3.86Å; F247-A263 HydrophobicContact CZ-CB 3.91Å; C260-A263 PolarHBondContact O-N 3.23Å; Q261-A263 VanDerWaalsContact C-N 3.29Å
264	F	96.8	Very high	93.8	Very high	36 Å²	36	43.1 Å²	43.1	16%	0.158	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	151.5	179.9	-53.4	-87.3	0	0	0	111.1	W208 F209 A211 C221 L222 L224 L231 H262	W208-F264 HydrophobicContact CB-CB 4.08Å; W208-F264 HydrophobicContact CB-CD1 3.4Å; W208-F264 HydrophobicContact CB-CD2 4.3Å; W208-F264 HydrophobicContact CB-CE1 3.81Å; W208-F264 HydrophobicContact CB-CG 3.67Å; W208-F264 HydrophobicContact CB-CZ 4.42Å; W208-F264 WeakPolarHBondContact O-CD1 3.36Å; F209-F264 CarbonylContact O-C 3.6Å; F209-F264 WeakPolarHBondContact O-CA 3.48Å; F209-F264 WeakPolarHBondContact O-CB 3.37Å; A211-F264 VanDerWaalsContact CB-C 3.46Å; C221-F264 WeakPolarHBondContact CA-O 3.4Å; C221-F264 VanDerWaalsContact CB-O 3.32Å; C221-F264 WeakPolarHBondContact CB-O 3.5Å; L222-F264 HydrophobicContact CB-CB 4.28Å; L222-F264 PolarHBondContact N-O 2.72Å; L222-F264 PolarHBondContact O-N 2.82Å; L224-F264 HydrophobicContact CD1-CE2 4.14Å; L224-F264 HydrophobicContact CG-CE2 4.25Å; L231-F264 HydrophobicContact CD2-CD2 3.51Å; L231-F264 HydrophobicContact CD2-CE2 3.75Å; H262-F264 WeakPolarHBondContact O-CD2 3.5Å; H262-F264 VanDerWaalsContact O-CE2 3.31Å; H262-F264 WeakPolarHBondContact O-CE2 3.29Å
265	L	96.5	Very high	93.8	Very high	9 Å²	9	39 Å²	39	5%	0.047	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	140.4	172.7	-62.1	172.8	0	0	0	108.2	F81 L142 F209 A211	F81-L265 HydrophobicContact CE1-CD1 4.31Å; F81-L265 HydrophobicContact CZ-CD1 3.94Å; L142-L265 HydrophobicContact CD1-CB 4.44Å; L142-L265 HydrophobicContact CD1-CD1 4.05Å; L142-L265 HydrophobicContact CD2-CB 4.39Å; F209-L265 HydrophobicContact CB-CB 4.12Å; F209-L265 HydrophobicContact CB-CD1 4.27Å; F209-L265 HydrophobicContact CB-CG 4.46Å; F209-L265 PolarHBondContact O-N 3.4Å; A211-L265 HydrophobicContact CB-CD2 3.9Å; A211-L265 HydrophobicContact CB-CG 4.11Å
266	I	96.7	Very high	93.8	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	17%	0.172	C	C	.	.	P	Polyproline II helix	trans	-87.8	128.6	-178.7	-171.7	167.2	0	0	0	110.1	L142 V143 Y149 P220 L222 R233 I270 F271	L142-I266 WeakPolarHBondContact CA-O 3.2Å; V143-I266 HydrophobicContact CB-CG2 3.69Å; V143-I266 HydrophobicContact CG2-CG2 3.84Å; V143-I266 PolarHBondContact N-O 2.72Å; Y149-I266 HydrophobicContact CE1-CD1 4.14Å; Y149-I266 WeakPolarHBondContact OH-CD1 3.3Å; P220-I266 HydrophobicContact CB-CG2 4.02Å; L222-I266 HydrophobicContact CD1-CG1 4.47Å; L222-I266 HydrophobicContact CD2-CB 4.38Å; L222-I266 HydrophobicContact CD2-CD1 3.82Å; L222-I266 HydrophobicContact CD2-CG1 3.86Å; L222-I266 HydrophobicContact CG-CB 4.01Å; L222-I266 HydrophobicContact CG-CD1 4.39Å; L222-I266 HydrophobicContact CG-CG1 3.95Å; R233-I266 HydrophobicContact CB-CD1 4.43Å; R233-I266 HydrophobicContact CG-CD1 3.96Å; I266-I270 HydrophobicContact CD1-CG2 4Å; I266-I270 HydrophobicContact CG1-CB 4.2Å; I266-I270 HydrophobicContact CG1-CG2 4.09Å; I266-F271 HydrophobicContact CD1-CB 4.01Å; I266-F271 HydrophobicContact CD1-CD2 4.39Å; I266-F271 HydrophobicContact CG1-CB 4.16Å; I266-F271 HydrophobicContact CG2-CB 4.27Å; I266-F271 HydrophobicContact CG2-CD2 4.42Å
267	P	95.8	Very high	93.7	Very high	1 Å²	1	36 Å²	36	1%	0.006	17%	0.165	C	C	.	.	B	Isolated β-bridge	trans	-60.6	136.8	167.1	-28.8	39.4	0	0	0	112	L96 L97 Y141 L142 W208 R269 I270 F271	L96-P267 HydrophobicContact CD2-CG 3.91Å; L96-P267 HydrophobicContact CG-CB 4.39Å; L96-P267 HydrophobicContact CG-CG 4.22Å; L97-P267 HydrophobicContact CD2-CB 3.93Å; L97-P267 HydrophobicContact CD2-CG 4.01Å; Y141-P267 WeakPolarHBondContact O-CA 3.24Å; L142-P267 HydrophobicContact CD2-CG 4.36Å; W208-P267 HydrophobicContact CZ3-CG 4.09Å; P267-R269 PolarHBondContact O-N 2.83Å; P267-R269 VanDerWaalsContact O-N 3.17Å; P267-I270 HydrophobicContact CB-CD1 4.37Å; P267-I270 HydrophobicContact CB-CG1 4.42Å; P267-I270 HydrophobicContact CG-CD1 4.17Å; P267-I270 PolarHBondContact O-N 3.28Å; P267-F271 PolarHBondContact O-N 3.29Å
268	E	94.4	Very high	93.7	Very high	24 Å²	24	32.6 Å²	32.6	11%	0.112	14%	0.144	C	C	.	.	H	α-helix	trans	-54.6	-38.9	-178.7	178.3	64.5	-173.5	0	0	112.3	D140 Y141 V143 I270 F271 R272	D140-E268 WeakPolarHBondContact O-CB 3.38Å; D140-E268 VanDerWaalsContact O-CG 3.3Å; D140-E268 WeakPolarHBondContact O-CG 3.26Å; Y141-E268 PolarHBondContact O-N 3.36Å; V143-E268 WeakPolarHBondContact CG2-OE2 3.43Å; E268-I270 VanDerWaalsContact C-N 3.31Å; E268-I270 PolarHBondContact O-N 3.05Å; E268-F271 WeakPolarHBondContact O-CB 3.49Å; E268-F271 PolarHBondContact O-N 3.13Å; E268-R272 HydrophobicContact CG-CG 4.43Å; E268-R272 WeakPolarHBondContact O-CB 3.31Å; E268-R272 WeakPolarHBondContact O-CG 3.32Å; E268-R272 PolarHBondContact O-N 2.71Å; E268-R272 IonicContact OE1-CZ 3.41Å; E268-R272 IonicContact OE1-NE 3.06Å; E268-R272 PolarHBondContact OE1-NE 2.9Å; E268-R272 IonicContact OE1-NH2 3.05Å; E268-R272 PolarHBondContact OE1-NH2 3.02Å
269	R	92.6	Very high	93.7	Very high	81 Å²	81	36 Å²	36	31%	0.306	16%	0.155	S	C	.	.	H	α-helix	trans	-61.5	-36.2	177.1	-71	-173.1	59.2	124.6	2.8	113.6	L96 T98 E196 P267 C273	L96-R269 WeakPolarHBondContact O-CD 3.25Å; T98-R269 PolarHBondContact O-NH1 3.12Å; E196-R269 IonicContact OE1-NH2 2.64Å; E196-R269 PolarHBondContact OE1-NH2 3.25Å; P267-R269 PolarHBondContact O-N 2.83Å; P267-R269 VanDerWaalsContact O-N 3.17Å; R269-C273 PolarHBondContact O-SG 3.36Å; R269-C273 VanDerWaalsContact O-SG 3.34Å
270	I	94.4	Very high	93.8	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-77.7	-37.2	175.9	-66.6	175.9	0	0	0	110.1	L96 L197 L200 W208 L222 R233 I266 P267 E268 C273	L96-I270 HydrophobicContact CD1-CD1 3.59Å; L96-I270 HydrophobicContact CD1-CG1 3.85Å; L96-I270 HydrophobicContact CD2-CD1 4.04Å; L96-I270 HydrophobicContact CG-CD1 4.36Å; L197-I270 HydrophobicContact CD2-CG2 4.14Å; L200-I270 HydrophobicContact CD1-CG2 4.36Å; L200-I270 HydrophobicContact CD2-CD1 3.85Å; L200-I270 HydrophobicContact CD2-CG2 4.24Å; L200-I270 HydrophobicContact CG-CD1 4.41Å; W208-I270 HydrophobicContact CH2-CD1 3.84Å; W208-I270 HydrophobicContact CZ3-CD1 3.94Å; L222-I270 HydrophobicContact CD2-CG2 4.32Å; R233-I270 HydrophobicContact CG-CG2 4.06Å; R233-I270 PolarHBondContact NH1-O 3.25Å; I266-I270 HydrophobicContact CD1-CG2 4Å; I266-I270 HydrophobicContact CG1-CB 4.2Å; I266-I270 HydrophobicContact CG1-CG2 4.09Å; P267-I270 HydrophobicContact CB-CD1 4.37Å; P267-I270 HydrophobicContact CB-CG1 4.42Å; P267-I270 HydrophobicContact CG-CD1 4.17Å; P267-I270 PolarHBondContact O-N 3.28Å; E268-I270 VanDerWaalsContact C-N 3.31Å; E268-I270 PolarHBondContact O-N 3.05Å; I270-C273 WeakPolarHBondContact O-CB 3.4Å; I270-C273 PolarHBondContact O-N 3.33Å
271	F	94.2	Very high	93.8	Very high	14 Å²	14	36.7 Å²	36.7	6%	0.061	15%	0.154	C	C	.	.	H	α-helix	trans	-60.9	-43.7	177.2	177.2	-108.6	0	0	0	111.9	V143 E147 Y149 P220 I266 P267 E268 C273	V143-F271 HydrophobicContact CG2-CB 3.75Å; V143-F271 HydrophobicContact CG2-CD1 3.75Å; V143-F271 HydrophobicContact CG2-CD2 4.22Å; V143-F271 HydrophobicContact CG2-CE1 4.45Å; V143-F271 HydrophobicContact CG2-CG 3.63Å; E147-F271 HydrophobicContact CB-CE1 3.96Å; E147-F271 HydrophobicContact CB-CE2 4.38Å; E147-F271 HydrophobicContact CB-CZ 3.52Å; E147-F271 WeakPolarHBondContact OE2-CE1 3.34Å; Y149-F271 AromaticContact CD1-CD2 3.74Å; Y149-F271 HydrophobicContact CD1-CD2 3.74Å; Y149-F271 AromaticContact CD1-CE2 3.72Å; Y149-F271 HydrophobicContact CD1-CE2 3.72Å; Y149-F271 HydrophobicContact CD2-CE2 4.01Å; Y149-F271 AromaticContact CE1-CD2 3.33Å; Y149-F271 HydrophobicContact CE1-CD2 3.33Å; Y149-F271 AromaticContact CE1-CE2 3.68Å; Y149-F271 HydrophobicContact CE1-CE2 3.68Å; Y149-F271 HydrophobicContact CE1-CG 4.32Å; Y149-F271 HydrophobicContact CE2-CD2 4.27Å; Y149-F271 AromaticContact CE2-CE2 3.98Å; Y149-F271 HydrophobicContact CE2-CE2 3.98Å; Y149-F271 HydrophobicContact CG-CD2 4.37Å; Y149-F271 AromaticContact CG-CE2 3.9Å; Y149-F271 HydrophobicContact CG-CE2 3.9Å; Y149-F271 AromaticContact CZ-CD2 3.64Å; Y149-F271 AromaticContact CZ-CE2 3.83Å; P220-F271 HydrophobicContact CB-CD2 3.84Å; P220-F271 HydrophobicContact CB-CE2 3.68Å; P220-F271 HydrophobicContact CG-CD2 4.24Å; P220-F271 HydrophobicContact CG-CE2 3.59Å; P220-F271 HydrophobicContact CG-CZ 4.27Å; I266-F271 HydrophobicContact CD1-CB 4.01Å; I266-F271 HydrophobicContact CD1-CD2 4.39Å; I266-F271 HydrophobicContact CG1-CB 4.16Å; I266-F271 HydrophobicContact CG2-CB 4.27Å; I266-F271 HydrophobicContact CG2-CD2 4.42Å; P267-F271 PolarHBondContact O-N 3.29Å; E268-F271 WeakPolarHBondContact O-CB 3.49Å; E268-F271 PolarHBondContact O-N 3.13Å; F271-C273 PolarHBondContact O-N 3.14Å
272	R	91.5	Very high	93.9	Very high	160 Å²	160	31.6 Å²	31.6	60%	0.604	13%	0.13	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-16.7	179	-74.1	-178.9	-175.2	176	8	115.2	E268 Y274	E268-R272 HydrophobicContact CG-CG 4.43Å; E268-R272 WeakPolarHBondContact O-CB 3.31Å; E268-R272 WeakPolarHBondContact O-CG 3.32Å; E268-R272 PolarHBondContact O-N 2.71Å; E268-R272 IonicContact OE1-CZ 3.41Å; E268-R272 IonicContact OE1-NE 3.06Å; E268-R272 PolarHBondContact OE1-NE 2.9Å; E268-R272 IonicContact OE1-NH2 3.05Å; E268-R272 PolarHBondContact OE1-NH2 3.02Å; R272-Y274 PolarHBondContact O-N 2.9Å
273	C	91.9	Very high	93.9	Very high	15 Å²	15	30 Å²	30	10%	0.101	12%	0.123	C	C	.	.	S	Bend	trans	-60.6	137.4	174.3	-60.6	0	0	0	0	109.5	S194 L197 R233 R269 I270 F271	S194-C273 PolarHBondContact OG-SG 3.26Å; L197-C273 HydrophobicContact CD1-CB 4.4Å; L197-C273 HydrophobicContact CD2-CB 4.12Å; L197-C273 HydrophobicContact CG-CB 4.15Å; R233-C273 PolarHBondContact NH1-O 3.04Å; R269-C273 PolarHBondContact O-SG 3.36Å; R269-C273 VanDerWaalsContact O-SG 3.34Å; I270-C273 WeakPolarHBondContact O-CB 3.4Å; I270-C273 PolarHBondContact O-N 3.33Å; F271-C273 PolarHBondContact O-N 3.14Å
274	Y	90.6	Very high	93.8	Very high	120 Å²	120	30 Å²	30	47%	0.471	12%	0.123	S	C	.	.			trans	-60	150.3	175.7	-66.8	-75.1	0	0	0	111.5	V150 P153 R233 R272	V150-Y274 HydrophobicContact CB-CD1 3.98Å; V150-Y274 HydrophobicContact CB-CE1 4.06Å; V150-Y274 HydrophobicContact CG1-CD1 3.72Å; V150-Y274 HydrophobicContact CG1-CE1 3.48Å; V150-Y274 VanDerWaalsContact CG1-CE1 3.48Å; V150-Y274 WeakPolarHBondContact O-CA 3.4Å; P153-Y274 HydrophobicContact CB-CD1 4.02Å; P153-Y274 HydrophobicContact CB-CD2 3.96Å; P153-Y274 HydrophobicContact CB-CE1 4.46Å; P153-Y274 HydrophobicContact CB-CE2 4.42Å; P153-Y274 HydrophobicContact CB-CG 3.75Å; P153-Y274 HydrophobicContact CG-CD1 4.33Å; P153-Y274 HydrophobicContact CG-CG 4.03Å; R233-Y274 PolarHBondContact NH2-O 3.47Å; R272-Y274 PolarHBondContact O-N 2.9Å
275	V	91.2	Very high	93.7	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	12%	0.118	C	C	.	.			trans	-87.7	109.2	165.6	177.1	0	0	0	0	107.3	Y149 V150 R151 V250 V277	Y149-V275 HydrophobicContact CD1-CG2 4.07Å; Y149-V275 HydrophobicContact CG-CG2 4.03Å; V150-V275 PolarHBondContact O-N 3.2Å; R151-V275 HydrophobicContact CG-CB 4.32Å; V250-V275 HydrophobicContact CB-CG1 4.43Å; V250-V275 HydrophobicContact CB-CG2 4.12Å; V250-V275 HydrophobicContact CG2-CG2 3.94Å; V250-V275 VanDerWaalsContact O-CG1 3.3Å; V250-V275 WeakPolarHBondContact O-CG1 3.28Å; V275-V277 HydrophobicContact CG1-CB 4.25Å; V275-V277 PolarHBondContact O-N 2.97Å
276	D	90.8	Very high	93.5	Very high	22 Å²	22	30.2 Å²	30.2	12%	0.118	12%	0.123	C	C	.	.			trans	-89.8	23.9	-179.7	-73.5	-65.4	0	0	0	112.8	P153 R188 R189 V192 Y278	P153-D276 VanDerWaalsContact CG-OD1 3.31Å; P153-D276 WeakPolarHBondContact CG-OD1 3.48Å; R188-D276 CarbonylContact C-O 3.6Å; R188-D276 VanDerWaalsContact CA-O 3.28Å; R188-D276 WeakPolarHBondContact CA-O 3.19Å; R189-D276 HydrophobicContact CB-CB 4.15Å; R189-D276 PolarHBondContact N-O 3.41Å; V192-D276 VanDerWaalsContact CG1-OD2 3.25Å; V192-D276 WeakPolarHBondContact CG1-OD2 3.37Å; D276-Y278 VanDerWaalsContact C-CE2 3.44Å; D276-Y278 WeakPolarHBondContact O-CE2 3.05Å
277	V	92.3	Very high	93.3	Very high	3 Å²	3	31.2 Å²	31.2	2%	0.018	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	132.3	179.7	-178.2	0	0	0	0	109.4	L177 V186 I187 R188 D251 E253 V275	L177-V277 HydrophobicContact CD1-CB 4.46Å; L177-V277 HydrophobicContact CD1-CG1 3.66Å; L177-V277 HydrophobicContact CD1-CG2 3.9Å; V186-V277 HydrophobicContact CG1-CG1 3.32Å; I187-V277 WeakPolarHBondContact O-CA 3.38Å; R188-V277 HydrophobicContact CB-CG2 4.04Å; R188-V277 HydrophobicContact CG-CG2 3.95Å; D251-V277 WeakPolarHBondContact O-CG2 3.46Å; E253-V277 HydrophobicContact CB-CG1 4.43Å; E253-V277 HydrophobicContact CG-CG1 3.73Å; V275-V277 HydrophobicContact CG1-CB 4.25Å; V275-V277 PolarHBondContact O-N 2.97Å
278	Y	93.5	Very high	92.9	Very high	2 Å²	2	31.4 Å²	31.4	1%	0.008	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	126.5	-171.4	-50.8	-92.9	0	0	0	109.1	R151 P153 V154 M174 V186 I187 D276 F314 M322	R151-Y278 WeakPolarHBondContact O-CE1 3.39Å; R151-Y278 PolarHBondContact O-OH 3.41Å; P153-Y278 WeakPolarHBondContact CD-OH 3.38Å; P153-Y278 WeakPolarHBondContact CG-OH 3.15Å; V154-Y278 HydrophobicContact CG1-CE1 4.5Å; V154-Y278 WeakPolarHBondContact CG1-OH 3.39Å; V154-Y278 HydrophobicContact CG2-CE1 3.83Å; M174-Y278 HydrophobicContact CE-CD2 4.17Å; M174-Y278 HydrophobicContact CE-CE2 4.25Å; V186-Y278 WeakPolarHBondContact CA-O 3Å; I187-Y278 PolarHBondContact N-O 2.84Å; I187-Y278 PolarHBondContact O-N 3.12Å; D276-Y278 VanDerWaalsContact C-CE2 3.44Å; D276-Y278 WeakPolarHBondContact O-CE2 3.05Å; Y278-F314 AromaticContact CD1-CE1 3.99Å; Y278-F314 HydrophobicContact CD1-CE1 3.99Å; Y278-F314 HydrophobicContact CD1-CZ 4.03Å; Y278-F314 HydrophobicContact CD2-CZ 4.05Å; Y278-F314 HydrophobicContact CE1-CZ 4.27Å; Y278-F314 HydrophobicContact CE2-CZ 4.32Å; Y278-F314 HydrophobicContact CG-CE1 4.07Å; Y278-F314 AromaticContact CG-CZ 3.92Å; Y278-F314 HydrophobicContact CG-CZ 3.92Å; Y278-M322 HydrophobicContact CD1-CG 4.42Å
279	R	93.5	Very high	92.2	Very high	81 Å²	81	35.3 Å²	35.3	31%	0.306	15%	0.145	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	128.5	159.2	-169.6	177.9	-175.1	-167.6	3	108.1	D184 F185 V186 V321 M322	D184-R279 VanDerWaalsContact CG-NH2 3.29Å; D184-R279 WeakPolarHBondContact OD1-CG 3.42Å; D184-R279 IonicContact OD1-CZ 3.29Å; D184-R279 IonicContact OD1-NE 2.94Å; D184-R279 PolarHBondContact OD1-NE 2.82Å; D184-R279 IonicContact OD1-NH2 2.76Å; D184-R279 PolarHBondContact OD1-NH2 2.89Å; D184-R279 IonicContact OD2-CZ 3.87Å; D184-R279 IonicContact OD2-NE 3.08Å; D184-R279 IonicContact OD2-NH2 3.3Å; D184-R279 PolarHBondContact OD2-NH2 3.32Å; F185-R279 CarbonylContact O-C 3.59Å; F185-R279 WeakPolarHBondContact O-CA 3.25Å; V186-R279 HydrophobicContact CG2-CB 4.41Å; V186-R279 HydrophobicContact CG2-CG 4.42Å; R279-V321 HydrophobicContact CG-CG2 4.16Å; R279-V321 WeakPolarHBondContact O-CA 3.35Å; R279-M322 PolarHBondContact O-N 3.38Å
280	V	95.4	Very high	91.7	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	159	-169.1	-58.3	0	0	0	0	112.3	D184 F185 I187 F314 M322 V324	D184-V280 WeakPolarHBondContact CA-O 3.23Å; F185-V280 HydrophobicContact CD1-CG2 4.05Å; F185-V280 WeakPolarHBondContact CD1-O 3.44Å; F185-V280 HydrophobicContact CD2-CG2 3.51Å; F185-V280 HydrophobicContact CE1-CG2 3.8Å; F185-V280 HydrophobicContact CE2-CG2 3.24Å; F185-V280 HydrophobicContact CG-CG2 3.91Å; F185-V280 HydrophobicContact CZ-CB 4.48Å; F185-V280 HydrophobicContact CZ-CG2 3.39Å; F185-V280 PolarHBondContact N-O 2.92Å; F185-V280 WeakPolarHBondContact O-CG2 3.3Å; F185-V280 PolarHBondContact O-N 3.41Å; I187-V280 HydrophobicContact CD1-CG1 3.87Å; I187-V280 HydrophobicContact CD1-CG2 3.96Å; I187-V280 HydrophobicContact CG1-CG1 3.95Å; I187-V280 HydrophobicContact CG1-CG2 4.01Å; I187-V280 HydrophobicContact CG2-CG2 4.16Å; V280-F314 HydrophobicContact CG1-CE1 4.35Å; V280-M322 CarbonylContact C-O 3.48Å; V280-M322 WeakPolarHBondContact CA-O 3.46Å; V280-M322 WeakPolarHBondContact CB-O 3.19Å; V280-M322 HydrophobicContact CG1-CB 3.98Å; V280-M322 HydrophobicContact CG1-CG 4.34Å; V280-V324 HydrophobicContact CB-CG1 4.1Å; V280-V324 HydrophobicContact CB-CG2 3.98Å; V280-V324 HydrophobicContact CG1-CG1 3.88Å; V280-V324 HydrophobicContact CG2-CG2 4.04Å
281	R	95	Very high	91.2	Very high	47 Å²	47	34.5 Å²	34.5	18%	0.177	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	151	168.9	64.4	174.8	-178.2	84.3	0	110.3	D183 A283 E318 V321 M322 S323 V324 E349	D183-R281 HydrophobicContact CB-CB 4.16Å; D183-R281 WeakPolarHBondContact O-CB 3.36Å; R281-A283 PolarHBondContact O-N 2.94Å; R281-E318 IonicContact NH2-OE1 3.04Å; R281-E318 PolarHBondContact NH2-OE1 2.88Å; R281-V321 HydrophobicContact CB-CG1 4Å; R281-V321 HydrophobicContact CG-CG1 4.13Å; R281-M322 PolarHBondContact N-O 3.19Å; R281-S323 PolarHBondContact NH1-OG 2.67Å; R281-V324 WeakPolarHBondContact O-CG2 3.48Å; R281-V324 PolarHBondContact O-N 2.73Å; R281-E349 IonicContact CZ-OE1 3.6Å; R281-E349 VanDerWaalsContact CZ-OE1 3.3Å; R281-E349 IonicContact NH1-OE1 3.54Å; R281-E349 PolarHBondContact NH1-OE1 3.37Å; R281-E349 IonicContact NH1-OE2 2.61Å; R281-E349 PolarHBondContact NH1-OE2 2.93Å; R281-E349 VanDerWaalsContact NH1-OE2 3.08Å; R281-E349 IonicContact NH2-OE1 2.7Å; R281-E349 PolarHBondContact NH2-OE1 3.2Å
282	L	95.7	Very high	90.9	Very high	8 Å²	8	33.9 Å²	33.9	4%	0.042	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	129.8	167.4	-69.4	-175.5	0	0	0	110.1	P182 F185 V285 V301 L326 L333 L337	P182-L282 HydrophobicContact CB-CD1 3.97Å; P182-L282 HydrophobicContact CB-CG 4.41Å; P182-L282 PolarHBondContact O-N 3.01Å; F185-L282 HydrophobicContact CE1-CD2 4.2Å; F185-L282 HydrophobicContact CE1-CG 4.06Å; F185-L282 HydrophobicContact CZ-CD2 3.93Å; F185-L282 HydrophobicContact CZ-CG 4.31Å; L282-V285 HydrophobicContact CB-CB 4.43Å; L282-V301 HydrophobicContact CD1-CB 4.49Å; L282-V301 HydrophobicContact CD1-CG1 3.99Å; L282-V301 HydrophobicContact CD1-CG2 3.6Å; L282-L326 HydrophobicContact CD2-CD1 3.6Å; L282-L326 HydrophobicContact CD2-CG 3.64Å; L282-L333 HydrophobicContact CD1-CD2 3.94Å; L282-L333 HydrophobicContact CD2-CD2 4.08Å; L282-L337 HydrophobicContact CD1-CD1 4.26Å
283	A	93.8	Very high	90.9	Very high	5 Å²	5	26.4 Å²	26.4	4%	0.041	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	145.7	171.7	0	0	0	0	0	110.6	R281 V285 V315 S323 V324 V325	R281-A283 PolarHBondContact O-N 2.94Å; A283-V285 PolarHBondContact O-N 3.37Å; A283-V285 VanDerWaalsContact O-N 3.07Å; A283-V315 HydrophobicContact CB-CB 4.3Å; A283-V315 HydrophobicContact CB-CG2 3.67Å; A283-S323 WeakPolarHBondContact CA-OG 3.31Å; A283-S323 WeakPolarHBondContact CB-OG 3.46Å; A283-V324 WeakPolarHBondContact CB-O 3.48Å; A283-V324 PolarHBondContact N-O 3.45Å; A283-V325 HydrophobicContact CB-CG2 3.86Å
284	F	92.9	Very high	90.9	Very high	1 Å²	1	25.8 Å²	25.8	0%	0.004	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.9	8.4	170.8	-39.6	-55.3	0	0	0	115.4	V315 V325 F334 F345 D346 E349 L350 L359 L362 L363	F284-V315 HydrophobicContact CE1-CG1 4.43Å; F284-V315 HydrophobicContact CE2-CG2 4.34Å; F284-V315 HydrophobicContact CZ-CG1 3.99Å; F284-V315 HydrophobicContact CZ-CG2 4.22Å; F284-V325 HydrophobicContact CD2-CG2 4.12Å; F284-V325 HydrophobicContact CE2-CG2 3.75Å; F284-F334 HydrophobicContact CB-CD2 4.12Å; F284-F334 HydrophobicContact CB-CE2 3.86Å; F284-F334 HydrophobicContact CD2-CD2 4.38Å; F284-F345 CarbonylContact O-C 3.55Å; F284-F345 WeakPolarHBondContact O-CA 3.34Å; F284-F345 WeakPolarHBondContact O-CB 3.25Å; F284-F345 WeakPolarHBondContact O-CD1 3.38Å; F284-D346 PolarHBondContact O-N 2.82Å; F284-E349 WeakPolarHBondContact CA-OE2 3.42Å; F284-E349 HydrophobicContact CD1-CB 4.17Å; F284-E349 HydrophobicContact CD1-CG 3.81Å; F284-E349 HydrophobicContact CE1-CG 3.96Å; F284-E349 PolarHBondContact N-OE2 2.86Å; F284-L350 HydrophobicContact CB-CD1 4.24Å; F284-L350 HydrophobicContact CB-CD2 3.93Å; F284-L350 HydrophobicContact CB-CG 3.86Å; F284-L350 HydrophobicContact CD1-CB 4.42Å; F284-L350 HydrophobicContact CD1-CD2 3.45Å; F284-L350 VanDerWaalsContact CD1-CD2 3.45Å; F284-L350 HydrophobicContact CD1-CG 3.58Å; F284-L350 HydrophobicContact CD2-CD2 3.88Å; F284-L350 HydrophobicContact CE1-CD2 3.84Å; F284-L350 HydrophobicContact CE1-CG 4.29Å; F284-L350 HydrophobicContact CE2-CD2 4.24Å; F284-L350 HydrophobicContact CG-CD2 3.46Å; F284-L350 VanDerWaalsContact CG-CD2 3.46Å; F284-L350 HydrophobicContact CG-CG 3.79Å; F284-L350 HydrophobicContact CZ-CD2 4.22Å; F284-L359 HydrophobicContact CE2-CD1 4.19Å; F284-L359 HydrophobicContact CZ-CD1 3.77Å; F284-L362 HydrophobicContact CE2-CD2 3.99Å; F284-L362 HydrophobicContact CZ-CD2 4.37Å; F284-L363 HydrophobicContact CD2-CD2 4.38Å; F284-L363 HydrophobicContact CE2-CD2 4.29Å
285	V	94.7	Very high	91	Very high	9 Å²	9	22.8 Å²	22.8	6%	0.055	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	135.3	177.2	-177.4	0	0	0	0	107.4	L282 A283 W293 L337 F345	L282-V285 HydrophobicContact CB-CB 4.43Å; A283-V285 PolarHBondContact O-N 3.37Å; A283-V285 VanDerWaalsContact O-N 3.07Å; V285-W293 HydrophobicContact CG1-CH2 4.29Å; V285-W293 HydrophobicContact CG1-CZ3 3.96Å; V285-L337 HydrophobicContact CG1-CD1 4.44Å; V285-L337 HydrophobicContact CG2-CD1 3.79Å; V285-F345 HydrophobicContact CG2-CD1 3.94Å; V285-F345 HydrophobicContact CG2-CE1 3.98Å
286	R	93.2	Very high	91.1	Very high	41 Å²	41	24.8 Å²	24.8	16%	0.155	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	157.5	-175.3	62.8	176.8	-174.7	91.6	-9	111.8	W293 V344 D346	R286-W293 VanDerWaalsContact C-CH2 3.49Å; R286-V344 HydrophobicContact CG-CB 4.32Å; R286-V344 HydrophobicContact CG-CG1 3.78Å; R286-V344 VanDerWaalsContact CZ-CG1 3.46Å; R286-V344 PolarHBondContact N-O 3.43Å; R286-D346 HydrophobicContact CB-CB 4.46Å; R286-D346 HydrophobicContact CG-CB 4.28Å
287	P	91.8	Very high	91.3	Very high	21 Å²	21	23.8 Å²	23.8	14%	0.136	12%	0.122	C	C	.	.			trans	-62.6	166.3	165.4	24.2	-28.7	0	0	0	110.6	Y289 G290 L292 W293	P287-Y289 VanDerWaalsContact C-N 3.34Å; P287-G290 WeakPolarHBondContact CB-O 3.43Å; P287-G290 WeakPolarHBondContact CG-O 3.46Å; P287-L292 VanDerWaalsContact CB-O 3.27Å; P287-L292 WeakPolarHBondContact CB-O 3.44Å; P287-W293 HydrophobicContact CB-CD2 4.04Å; P287-W293 HydrophobicContact CB-CG 4.3Å; P287-W293 HydrophobicContact CB-CZ2 4Å; P287-W293 VanDerWaalsContact CD-CZ2 3.44Å; P287-W293 HydrophobicContact CG-CZ2 4.06Å
288	F	87.9	Confident	91.4	Very high	5 Å²	5	24 Å²	24	2%	0.022	12%	0.123	C	C	.	.	S	Bend	trans	-61.3	-51.7	170.3	-72	-120.5	0	0	0	109	L292 L342 V344 L413 A417 L450 C454 L470	F288-L292 HydrophobicContact CB-CB 4.47Å; F288-L292 HydrophobicContact CB-CD2 4Å; F288-L292 HydrophobicContact CB-CG 4.45Å; F288-L292 HydrophobicContact CG-CD2 4.42Å; F288-L292 PolarHBondContact N-O 2.91Å; F288-L342 HydrophobicContact CZ-CB 3.92Å; F288-V344 HydrophobicContact CD1-CG2 4.47Å; F288-V344 HydrophobicContact CD2-CG2 4.07Å; F288-V344 HydrophobicContact CE2-CG2 4.13Å; F288-V344 HydrophobicContact CG-CG2 4.24Å; F288-V344 HydrophobicContact CZ-CG2 4.44Å; F288-L413 HydrophobicContact CD1-CD1 4.18Å; F288-L413 HydrophobicContact CD1-CD2 4.25Å; F288-L413 HydrophobicContact CD1-CG 3.98Å; F288-A417 HydrophobicContact CD1-CB 3.74Å; F288-A417 HydrophobicContact CE1-CB 3.07Å; F288-A417 HydrophobicContact CZ-CB 3.72Å; F288-L450 HydrophobicContact CD1-CD1 4.36Å; F288-C454 PolarHBondContact O-SG 3.42Å; F288-L470 HydrophobicContact CD1-CD2 4.4Å; F288-L470 HydrophobicContact CD2-CD2 4.47Å; F288-L470 HydrophobicContact CE1-CD2 3.83Å; F288-L470 HydrophobicContact CE2-CD2 4Å; F288-L470 HydrophobicContact CZ-CD2 3.6Å
289	Y	79.9	Confident	91.3	Very high	107 Å²	107	29.2 Å²	29.2	42%	0.42	15%	0.146	S	C	.	.	B	Isolated β-bridge	trans	-160.7	137.5	177.4	178.4	-95.4	0	0	0	109.8	P287 N291 L292 C454 V458	P287-Y289 VanDerWaalsContact C-N 3.34Å; Y289-N291 PolarHBondContact O-N 3.31Å; Y289-N291 VanDerWaalsContact O-N 3.11Å; Y289-L292 VanDerWaalsContact O-CB 3.24Å; Y289-L292 WeakPolarHBondContact O-CB 3.18Å; Y289-L292 PolarHBondContact O-N 2.62Å; Y289-C454 HydrophobicContact CD2-CB 4.16Å; Y289-C454 HydrophobicContact CG-CB 4.35Å; Y289-V458 HydrophobicContact CD1-CG2 3.48Å; Y289-V458 VanDerWaalsContact CD1-CG2 3.48Å; Y289-V458 HydrophobicContact CD2-CG2 3.88Å; Y289-V458 HydrophobicContact CE1-CB 4.34Å; Y289-V458 HydrophobicContact CE1-CG1 4.29Å; Y289-V458 HydrophobicContact CE1-CG2 3.14Å; Y289-V458 HydrophobicContact CE2-CG2 3.57Å; Y289-V458 HydrophobicContact CG-CG2 3.84Å; Y289-V458 WeakPolarHBondContact OH-CG1 3.39Å
290	G	80.6	Confident	91.3	Very high	41 Å²	41	26.7 Å²	26.7	42%	0.423	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.9	-119.9	178.9	0	0	0	0	0	111.5	P287	P287-G290 WeakPolarHBondContact CB-O 3.43Å; P287-G290 WeakPolarHBondContact CG-O 3.46Å
291	N	85.2	Confident	91.2	Very high	22 Å²	22	26.7 Å²	26.7	12%	0.118	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.3	12.3	179.4	-64.5	-24.5	0	0	0	114.6	K181 Y289 W293 Y472 L473	K181-N291 PolarHBondContact NZ-OD1 2.97Å; Y289-N291 PolarHBondContact O-N 3.31Å; Y289-N291 VanDerWaalsContact O-N 3.11Å; N291-W293 PolarHBondContact O-N 3.24Å; N291-Y472 HydrophobicContact CB-CD1 4.47Å; N291-Y472 HydrophobicContact CB-CD2 4.49Å; N291-Y472 HydrophobicContact CB-CE1 4.09Å; N291-Y472 HydrophobicContact CB-CE2 4.12Å; N291-L473 VanDerWaalsContact CB-O 3.23Å; N291-L473 WeakPolarHBondContact CB-O 3.43Å; N291-L473 PolarHBondContact O-N 3.25Å; N291-L473 VanDerWaalsContact O-N 3.1Å
292	L	87.2	Confident	91	Very high	2 Å²	2	27 Å²	27	1%	0.01	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	113.5	-179.7	-169.9	75.4	0	0	0	111	P287 F288 Y289 L413 L464 L470 Y472	P287-L292 VanDerWaalsContact CB-O 3.27Å; P287-L292 WeakPolarHBondContact CB-O 3.44Å; F288-L292 HydrophobicContact CB-CB 4.47Å; F288-L292 HydrophobicContact CB-CD2 4Å; F288-L292 HydrophobicContact CB-CG 4.45Å; F288-L292 HydrophobicContact CG-CD2 4.42Å; F288-L292 PolarHBondContact N-O 2.91Å; Y289-L292 VanDerWaalsContact O-CB 3.24Å; Y289-L292 WeakPolarHBondContact O-CB 3.18Å; Y289-L292 PolarHBondContact O-N 2.62Å; L292-L413 HydrophobicContact CD2-CD2 3.66Å; L292-L464 HydrophobicContact CD1-CB 4.11Å; L292-L464 HydrophobicContact CD2-CB 4.33Å; L292-L464 HydrophobicContact CD2-CD1 3.79Å; L292-L464 HydrophobicContact CD2-CD2 4.34Å; L292-L464 HydrophobicContact CD2-CG 4.38Å; L292-L470 HydrophobicContact CD1-CB 4.04Å; L292-L470 HydrophobicContact CD1-CD1 4.37Å; L292-L470 HydrophobicContact CD2-CD1 4.03Å; L292-L470 HydrophobicContact CD2-CD2 4.49Å; L292-Y472 HydrophobicContact CB-CD2 4.43Å; L292-Y472 HydrophobicContact CD1-CD2 4.32Å
293	W	91.9	Very high	90.7	Very high	3 Å²	3	33 Å²	33	1%	0.011	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	158	-176.6	-79.2	93.9	0	0	0	112.7	P182 D183 V285 R286 P287 N291 K295 V297 V298 L470 C471 L473	P182-W293 HydrophobicContact CB-CE3 4.35Å; P182-W293 HydrophobicContact CB-CH2 3.57Å; P182-W293 HydrophobicContact CB-CZ2 3.94Å; P182-W293 HydrophobicContact CB-CZ3 3.78Å; P182-W293 HydrophobicContact CG-CD2 4.08Å; P182-W293 HydrophobicContact CG-CE3 3.82Å; P182-W293 HydrophobicContact CG-CH2 3.95Å; P182-W293 HydrophobicContact CG-CZ2 4.16Å; P182-W293 HydrophobicContact CG-CZ3 3.75Å; D183-W293 HydrophobicContact CB-CZ2 3.82Å; D183-W293 VanDerWaalsContact OD1-CZ2 3.22Å; D183-W293 WeakPolarHBondContact OD1-CZ2 3.27Å; D183-W293 PolarHBondContact OD1-NE1 2.71Å; D183-W293 VanDerWaalsContact OD1-NE1 3.15Å; V285-W293 HydrophobicContact CG1-CH2 4.29Å; V285-W293 HydrophobicContact CG1-CZ3 3.96Å; R286-W293 VanDerWaalsContact C-CH2 3.49Å; P287-W293 HydrophobicContact CB-CD2 4.04Å; P287-W293 HydrophobicContact CB-CG 4.3Å; P287-W293 HydrophobicContact CB-CZ2 4Å; P287-W293 VanDerWaalsContact CD-CZ2 3.44Å; P287-W293 HydrophobicContact CG-CZ2 4.06Å; N291-W293 PolarHBondContact O-N 3.24Å; W293-K295 PolarHBondContact O-N 3.4Å; W293-V297 HydrophobicContact CE3-CG1 4.09Å; W293-V297 HydrophobicContact CZ3-CG1 4.03Å; W293-V298 HydrophobicContact CB-CG2 3.59Å; W293-V298 HydrophobicContact CD2-CG2 4.48Å; W293-V298 HydrophobicContact CG-CG2 4.06Å; W293-L470 WeakPolarHBondContact O-CA 3.48Å; W293-C471 PolarHBondContact N-O 3.2Å; W293-C471 PolarHBondContact O-N 2.75Å; W293-L473 HydrophobicContact CG-CD1 4.39Å
294	S	92.6	Very high	90.5	Very high	2 Å²	2	33 Å²	33	1%	0.014	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	122.8	162.4	164.8	0	0	0	0	108.3	A296 V297 V298 P341	S294-A296 PolarHBondContact O-N 2.63Å; S294-A296 PolarHBondContact OG-N 3.44Å; S294-V297 PolarHBondContact O-N 2.84Å; S294-V297 PolarHBondContact OG-N 3.16Å; S294-V298 WeakPolarHBondContact O-CG2 3.38Å; S294-V298 PolarHBondContact O-N 2.93Å; S294-V298 VanDerWaalsContact O-N 3.09Å; S294-P341 PolarHBondContact OG-O 3.46Å
295	K	91.5	Very high	90.4	Very high	56 Å²	56	33 Å²	33	24%	0.243	17%	0.169	C	C	.	.	H	α-helix	trans	-57.4	-31.9	175.5	-171	172.2	-172.9	168.8	0	111.8	W293 K299 N469 C471	W293-K295 PolarHBondContact O-N 3.4Å; K295-K299 WeakPolarHBondContact O-CB 3.35Å; K295-K299 VanDerWaalsContact O-CG 3.29Å; K295-K299 WeakPolarHBondContact O-CG 3.36Å; K295-K299 PolarHBondContact O-N 3.33Å; K295-K299 VanDerWaalsContact O-N 3.17Å; K295-N469 WeakPolarHBondContact CB-O 3.31Å; K295-N469 PolarHBondContact N-O 3.48Å; K295-C471 HydrophobicContact CB-CB 4.43Å
296	A	93.5	Very high	89.9	Confident	42 Å²	42	36 Å²	36	35%	0.347	19%	0.191	S	C	.	.	H	α-helix	trans	-69.2	-41.4	176.9	0	0	0	0	0	112	S294 S300 V340	S294-A296 PolarHBondContact O-N 2.63Å; S294-A296 PolarHBondContact OG-N 3.44Å; A296-S300 WeakPolarHBondContact O-CB 3.19Å; A296-S300 PolarHBondContact O-N 3.35Å; A296-V340 HydrophobicContact CB-CG1 3.85Å
297	V	95.1	Very high	89.2	Confident	2 Å²	2	39 Å²	39	1%	0.012	20%	0.202	C	C	.	.	H	α-helix	trans	-63.1	-51.2	176.8	173.7	0	0	0	0	110.5	P182 W293 S294 K299 S300 V301 L337 V340 A343	P182-V297 HydrophobicContact CG-CG1 4.39Å; W293-V297 HydrophobicContact CE3-CG1 4.09Å; W293-V297 HydrophobicContact CZ3-CG1 4.03Å; S294-V297 PolarHBondContact O-N 2.84Å; S294-V297 PolarHBondContact OG-N 3.16Å; V297-K299 VanDerWaalsContact C-N 3.31Å; V297-K299 PolarHBondContact O-N 3.03Å; V297-S300 WeakPolarHBondContact O-CA 3.36Å; V297-S300 WeakPolarHBondContact O-CB 3.32Å; V297-S300 PolarHBondContact O-N 2.69Å; V297-V301 HydrophobicContact CG1-CG2 4.25Å; V297-V301 WeakPolarHBondContact O-CG2 3.37Å; V297-V301 PolarHBondContact O-N 3.05Å; V297-L337 HydrophobicContact CG1-CD2 4.28Å; V297-V340 HydrophobicContact CG2-CG1 3.86Å; V297-A343 HydrophobicContact CG2-CB 3.68Å
298	V	94	Very high	88.3	Confident	8 Å²	8	44.5 Å²	44.5	5%	0.048	22%	0.223	C	C	.	.	H	α-helix	trans	-56	-47.9	-179.7	177	0	0	0	0	110.7	F179 P182 W293 S294 S300 V301 Q302 L473	F179-V298 HydrophobicContact CE1-CG1 4.18Å; F179-V298 HydrophobicContact CZ-CG1 4.39Å; P182-V298 HydrophobicContact CG-CG2 4.2Å; W293-V298 HydrophobicContact CB-CG2 3.59Å; W293-V298 HydrophobicContact CD2-CG2 4.48Å; W293-V298 HydrophobicContact CG-CG2 4.06Å; S294-V298 WeakPolarHBondContact O-CG2 3.38Å; S294-V298 PolarHBondContact O-N 2.93Å; S294-V298 VanDerWaalsContact O-N 3.09Å; V298-S300 VanDerWaalsContact C-N 3.33Å; V298-S300 PolarHBondContact O-N 2.81Å; V298-V301 PolarHBondContact O-N 2.9Å; V298-Q302 HydrophobicContact CG1-CG 4.44Å; V298-Q302 WeakPolarHBondContact O-CB 3.37Å; V298-Q302 WeakPolarHBondContact O-CG 3.37Å; V298-Q302 PolarHBondContact O-N 3.41Å; V298-L473 HydrophobicContact CG1-CD1 4.04Å; V298-L473 HydrophobicContact CG2-CD1 3.73Å
299	K	92.3	Very high	87.8	Confident	111 Å²	111	47.4 Å²	47.4	48%	0.483	25%	0.248	S	C	.	.	H	α-helix	trans	-61.9	-38.9	176.4	-75.6	-178.8	175.9	-169.8	0	112.9	K295 V297 K303	K295-K299 WeakPolarHBondContact O-CB 3.35Å; K295-K299 VanDerWaalsContact O-CG 3.29Å; K295-K299 WeakPolarHBondContact O-CG 3.36Å; K295-K299 PolarHBondContact O-N 3.33Å; K295-K299 VanDerWaalsContact O-N 3.17Å; V297-K299 VanDerWaalsContact C-N 3.31Å; V297-K299 PolarHBondContact O-N 3.03Å; K299-K303 VanDerWaalsContact O-CB 3.25Å; K299-K303 WeakPolarHBondContact O-CB 3.34Å; K299-K303 PolarHBondContact O-N 2.78Å
300	S	93.1	Very high	88.4	Confident	27 Å²	27	42.6 Å²	42.6	19%	0.189	23%	0.23	C	C	.	.	H	α-helix	trans	-64.3	-45.8	178	-160.6	0	0	0	0	111.1	A296 V297 V298 K303 Y304	A296-S300 WeakPolarHBondContact O-CB 3.19Å; A296-S300 PolarHBondContact O-N 3.35Å; V297-S300 WeakPolarHBondContact O-CA 3.36Å; V297-S300 WeakPolarHBondContact O-CB 3.32Å; V297-S300 PolarHBondContact O-N 2.69Å; V298-S300 VanDerWaalsContact C-N 3.33Å; V298-S300 PolarHBondContact O-N 2.81Å; S300-K303 PolarHBondContact O-N 3.18Å; S300-Y304 WeakPolarHBondContact O-CB 3.46Å; S300-Y304 PolarHBondContact O-N 3.22Å
301	V	93.8	Very high	89	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-65.5	-45.1	178.4	178.6	0	0	0	0	111	F179 P182 L282 V297 V298 K303 Y304 L305 L333 L337	F179-V301 HydrophobicContact CE2-CB 4.45Å; F179-V301 HydrophobicContact CE2-CG1 3.65Å; F179-V301 HydrophobicContact CZ-CG1 4.18Å; P182-V301 HydrophobicContact CB-CG1 4.49Å; P182-V301 HydrophobicContact CB-CG2 4.23Å; P182-V301 HydrophobicContact CG-CB 4.43Å; P182-V301 HydrophobicContact CG-CG2 4.17Å; L282-V301 HydrophobicContact CD1-CB 4.49Å; L282-V301 HydrophobicContact CD1-CG1 3.99Å; L282-V301 HydrophobicContact CD1-CG2 3.6Å; V297-V301 HydrophobicContact CG1-CG2 4.25Å; V297-V301 WeakPolarHBondContact O-CG2 3.37Å; V297-V301 PolarHBondContact O-N 3.05Å; V298-V301 PolarHBondContact O-N 2.9Å; V301-K303 PolarHBondContact O-N 3.07Å; V301-Y304 WeakPolarHBondContact O-CB 3.26Å; V301-Y304 PolarHBondContact O-N 3.23Å; V301-L305 HydrophobicContact CG1-CD1 3.77Å; V301-L305 HydrophobicContact CG1-CG 4.3Å; V301-L305 WeakPolarHBondContact O-CB 3.35Å; V301-L305 WeakPolarHBondContact O-CG 3.5Å; V301-L305 PolarHBondContact O-N 3.44Å; V301-L333 HydrophobicContact CG2-CD2 4.34Å; V301-L337 HydrophobicContact CG2-CD2 4.35Å
302	Q	91.1	Very high	89.4	Confident	53 Å²	53	42.6 Å²	42.6	25%	0.248	22%	0.218	C	C	.	.	H	α-helix	trans	-58.4	-47.6	175	-76.3	176.5	-29.6	0	0	111.8	F179 V298 Y304 L305 S306	F179-Q302 HydrophobicContact CD1-CG 3.67Å; F179-Q302 HydrophobicContact CE1-CG 3.31Å; F179-Q302 HydrophobicContact CG-CG 4.44Å; F179-Q302 HydrophobicContact CZ-CG 3.82Å; V298-Q302 HydrophobicContact CG1-CG 4.44Å; V298-Q302 WeakPolarHBondContact O-CB 3.37Å; V298-Q302 WeakPolarHBondContact O-CG 3.37Å; V298-Q302 PolarHBondContact O-N 3.41Å; Q302-Y304 VanDerWaalsContact C-N 3.27Å; Q302-Y304 PolarHBondContact O-N 3.26Å; Q302-L305 PolarHBondContact O-N 2.87Å; Q302-S306 WeakPolarHBondContact O-CB 3.46Å; Q302-S306 PolarHBondContact O-N 2.83Å
303	K	89	Confident	89.7	Confident	134 Å²	134	42.5 Å²	42.5	58%	0.583	22%	0.218	S	C	*	.	H	α-helix	trans	-60.9	-39.8	177.4	-175.9	180	-179.1	-175.9	0	111.1	K299 S300 V301 S306	K299-K303 VanDerWaalsContact O-CB 3.25Å; K299-K303 WeakPolarHBondContact O-CB 3.34Å; K299-K303 PolarHBondContact O-N 2.78Å; S300-K303 PolarHBondContact O-N 3.18Å; V301-K303 PolarHBondContact O-N 3.07Å; K303-S306 PolarHBondContact O-OG 3.49Å
304	Y	90.4	Very high	89.8	Confident	5 Å²	5	42.4 Å²	42.4	2%	0.02	22%	0.217	C	C	.	.	H	α-helix	trans	-63.2	-53.3	176.7	-173.3	-83	0	0	0	111.5	S300 V301 Q302 S306 R307 F310 L326 F327 D328 L333	S300-Y304 WeakPolarHBondContact O-CB 3.46Å; S300-Y304 PolarHBondContact O-N 3.22Å; V301-Y304 WeakPolarHBondContact O-CB 3.26Å; V301-Y304 PolarHBondContact O-N 3.23Å; Q302-Y304 VanDerWaalsContact C-N 3.27Å; Q302-Y304 PolarHBondContact O-N 3.26Å; Y304-S306 PolarHBondContact O-N 3.11Å; Y304-R307 WeakPolarHBondContact O-CB 3.39Å; Y304-R307 PolarHBondContact O-N 2.8Å; Y304-F310 HydrophobicContact CE1-CB 4.33Å; Y304-L326 HydrophobicContact CD1-CD1 4.3Å; Y304-L326 HydrophobicContact CE1-CB 3.74Å; Y304-L326 HydrophobicContact CE1-CD1 4.24Å; Y304-L326 PolarHBondContact OH-O 2.98Å; Y304-F327 WeakPolarHBondContact OH-CA 3.32Å; Y304-F327 PolarHBondContact OH-N 2.64Å; Y304-F327 PolarHBondContact OH-O 2.84Å; Y304-D328 HydrophobicContact CE2-CB 3.74Å; Y304-D328 PolarHBondContact OH-N 3.08Å; Y304-L333 HydrophobicContact CD1-CD2 4.09Å; Y304-L333 HydrophobicContact CD2-CB 4.32Å; Y304-L333 HydrophobicContact CD2-CD1 3.61Å; Y304-L333 HydrophobicContact CD2-CG 4.36Å; Y304-L333 HydrophobicContact CE1-CB 4.33Å; Y304-L333 HydrophobicContact CE1-CD2 4.41Å; Y304-L333 HydrophobicContact CE2-CB 3.9Å; Y304-L333 HydrophobicContact CE2-CD1 4.04Å; Y304-L333 HydrophobicContact CE2-CG 4.44Å; Y304-L333 HydrophobicContact CG-CD1 3.84Å; Y304-L333 HydrophobicContact CG-CD2 4.14Å; Y304-L333 HydrophobicContact CG-CG 4.42Å
305	L	90.5	Very high	89.7	Confident	2 Å²	2	42.8 Å²	42.8	1%	0.01	22%	0.219	C	C	.	.	H	α-helix	trans	-65.2	-21.7	-178.8	-68.5	169.8	0	0	0	113.8	L176 F179 F185 V301 Q302 R307 F310 L326	L176-L305 HydrophobicContact CD1-CD1 4.05Å; L176-L305 HydrophobicContact CD1-CD2 4.42Å; L176-L305 HydrophobicContact CD2-CB 4.01Å; F179-L305 HydrophobicContact CD2-CD1 3.38Å; F179-L305 HydrophobicContact CE2-CD1 3.76Å; F179-L305 HydrophobicContact CG-CD1 4.33Å; F185-L305 HydrophobicContact CD2-CD1 4.14Å; F185-L305 HydrophobicContact CE2-CD1 4.33Å; F185-L305 HydrophobicContact CE2-CD2 4.17Å; V301-L305 HydrophobicContact CG1-CD1 3.77Å; V301-L305 HydrophobicContact CG1-CG 4.3Å; V301-L305 WeakPolarHBondContact O-CB 3.35Å; V301-L305 WeakPolarHBondContact O-CG 3.5Å; V301-L305 PolarHBondContact O-N 3.44Å; Q302-L305 PolarHBondContact O-N 2.87Å; L305-R307 PolarHBondContact O-N 2.85Å; L305-F310 HydrophobicContact CD2-CD1 4.23Å; L305-F310 HydrophobicContact CD2-CD2 4.5Å; L305-F310 HydrophobicContact CD2-CE1 3.7Å; L305-F310 HydrophobicContact CD2-CE2 4.01Å; L305-F310 HydrophobicContact CD2-CZ 3.59Å; L305-L326 HydrophobicContact CD2-CD1 3.53Å; L305-L326 HydrophobicContact CG-CD1 4.32Å
306	S	84.3	Confident	89.5	Confident	73 Å²	73	45 Å²	45	51%	0.51	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-17.4	174	74.7	0	0	0	0	113.5	Q302 K303 Y304 K308	Q302-S306 WeakPolarHBondContact O-CB 3.46Å; Q302-S306 PolarHBondContact O-N 2.83Å; K303-S306 PolarHBondContact O-OG 3.49Å; Y304-S306 PolarHBondContact O-N 3.11Å; S306-K308 PolarHBondContact O-N 2.8Å
307	R	76.7	Confident	89.1	Confident	104 Å²	104	46.2 Å²	46.2	39%	0.392	23%	0.226	S	C	.	.	S	Bend	trans	-80.8	108.4	173.2	-56.5	177.3	-174.2	165.7	5.5	107.9	Y304 L305 D328	Y304-R307 WeakPolarHBondContact O-CB 3.39Å; Y304-R307 PolarHBondContact O-N 2.8Å; L305-R307 PolarHBondContact O-N 2.85Å; R307-D328 IonicContact NH1-OD2 3.89Å; R307-D328 PolarHBondContact NH1-OD2 3.03Å
308	K	73.6	Confident	88.3	Confident	135 Å²	135	49.5 Å²	49.5	59%	0.587	24%	0.241	S	C	*	.	S	Bend	trans	-97.8	137	174.4	-74	-164.5	173.5	-162.8	0	110.3	E175 L176 S306	E175-K308 IonicContact OE2-NZ 2.71Å; E175-K308 PolarHBondContact OE2-NZ 3.43Å; E175-K308 VanDerWaalsContact OE2-NZ 3.13Å; L176-K308 PolarHBondContact O-NZ 3.24Å; S306-K308 PolarHBondContact O-N 2.8Å
309	A	78.3	Confident	87.2	Confident	66 Å²	66	57.1 Å²	57.1	55%	0.545	28%	0.277	S	S	.	.	S	Bend	cis	-89.5	160.3	-7.6	0	0	0	0	0	111.8
310	F	91.5	Very high	86.8	Confident	6 Å²	6	58.6 Å²	58.6	3%	0.026	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	163.9	171.3	61.6	-94.5	0	0	0	110.5	M174 L176 I187 Y304 L305 L326	M174-F310 HydrophobicContact CB-CD2 3.97Å; M174-F310 HydrophobicContact CB-CE2 3.53Å; M174-F310 HydrophobicContact CB-CZ 4.03Å; M174-F310 HydrophobicContact CG-CE2 4.46Å; M174-F310 PolarHBondContact N-O 2.9Å; M174-F310 PolarHBondContact O-N 3.18Å; L176-F310 HydrophobicContact CB-CE1 4.1Å; L176-F310 HydrophobicContact CB-CZ 4.44Å; I187-F310 HydrophobicContact CB-CZ 4.48Å; I187-F310 HydrophobicContact CG2-CE2 4.11Å; I187-F310 HydrophobicContact CG2-CZ 3.75Å; Y304-F310 HydrophobicContact CE1-CB 4.33Å; L305-F310 HydrophobicContact CD2-CD1 4.23Å; L305-F310 HydrophobicContact CD2-CD2 4.5Å; L305-F310 HydrophobicContact CD2-CE1 3.7Å; L305-F310 HydrophobicContact CD2-CE2 4.01Å; L305-F310 HydrophobicContact CD2-CZ 3.59Å; F310-L326 HydrophobicContact CD2-CD2 4.16Å; F310-L326 HydrophobicContact CE2-CD2 4.02Å
311	Q	93.1	Very high	86.6	Confident	64 Å²	64	58.7 Å²	58.7	30%	0.299	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	147.8	177	-73.2	-174.7	-18.5	0	0	111.6	T171 Y172 D173 L326 F327	T171-Q311 PolarHBondContact OG1-OE1 2.88Å; Y172-Q311 CarbonylContact O-C 3.38Å; Y172-Q311 VanDerWaalsContact O-CA 3.28Å; Y172-Q311 WeakPolarHBondContact O-CA 3.35Å; D173-Q311 VanDerWaalsContact OD1-CG 3.29Å; D173-Q311 WeakPolarHBondContact OD1-CG 3.46Å; D173-Q311 PolarHBondContact OD1-NE2 3.47Å; Q311-L326 CarbonylContact O-C 3.18Å; Q311-L326 WeakPolarHBondContact O-CA 3.41Å; Q311-F327 HydrophobicContact CB-CB 4.03Å; Q311-F327 PolarHBondContact N-O 3.27Å; Q311-F327 PolarHBondContact O-N 2.79Å
312	A	94.1	Very high	86.5	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	139.7	173.5	0	0	0	0	0	111.3	T171 Y172 M174 I187 V325 L326	T171-A312 WeakPolarHBondContact CA-O 3.49Å; Y172-A312 PolarHBondContact N-O 3.08Å; Y172-A312 PolarHBondContact O-N 3.01Å; M174-A312 HydrophobicContact CE-CB 4.28Å; M174-A312 HydrophobicContact CG-CB 3.7Å; I187-A312 HydrophobicContact CD1-CB 4.16Å; A312-V325 WeakPolarHBondContact CA-O 3.44Å; A312-L326 HydrophobicContact CB-CD2 3.93Å
313	S	93.4	Very high	86.7	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	130.2	165.4	-165.4	0	0	0	0	109.5	F157 I169 V170 V324 V325	F157-S313 VanDerWaalsContact CB-OG 3.31Å; F157-S313 WeakPolarHBondContact CB-OG 3.21Å; I169-S313 WeakPolarHBondContact CG2-OG 3.46Å; V170-S313 WeakPolarHBondContact O-CB 3.33Å; V170-S313 PolarHBondContact O-OG 2.93Å; S313-V324 CarbonylContact O-C 3.43Å; S313-V324 VanDerWaalsContact O-CA 3.27Å; S313-V324 WeakPolarHBondContact O-CA 3.28Å; S313-V325 PolarHBondContact N-O 2.84Å; S313-V325 PolarHBondContact O-N 3.4Å
314	F	93.3	Very high	86.9	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	120.3	-179.3	-70.1	-94.1	0	0	0	110.3	V154 S156 F157 Y172 M174 Y278 V280 L317 M322 S323 V324	V154-F314 HydrophobicContact CB-CD2 4Å; V154-F314 HydrophobicContact CB-CE2 3.9Å; V154-F314 HydrophobicContact CG1-CD2 4.34Å; V154-F314 HydrophobicContact CG1-CE2 3.77Å; V154-F314 HydrophobicContact CG1-CZ 4.34Å; V154-F314 HydrophobicContact CG2-CD1 4.42Å; V154-F314 HydrophobicContact CG2-CD2 3.96Å; V154-F314 HydrophobicContact CG2-CE1 4.33Å; V154-F314 HydrophobicContact CG2-CE2 3.86Å; V154-F314 HydrophobicContact CG2-CG 4.24Å; V154-F314 HydrophobicContact CG2-CZ 4.04Å; S156-F314 CarbonylContact C-O 3.52Å; S156-F314 WeakPolarHBondContact CA-O 3.42Å; F157-F314 PolarHBondContact N-O 3.26Å; Y172-F314 AromaticContact CD2-CD2 3.83Å; Y172-F314 HydrophobicContact CD2-CD2 3.83Å; Y172-F314 AromaticContact CD2-CE2 3.82Å; Y172-F314 HydrophobicContact CD2-CE2 3.82Å; Y172-F314 AromaticContact CE2-CD2 3.99Å; Y172-F314 HydrophobicContact CE2-CD2 3.99Å; Y172-F314 HydrophobicContact CE2-CE2 4.29Å; M174-F314 HydrophobicContact CE-CE2 3.35Å; M174-F314 HydrophobicContact CE-CZ 3.35Å; Y278-F314 AromaticContact CD1-CE1 3.99Å; Y278-F314 HydrophobicContact CD1-CE1 3.99Å; Y278-F314 HydrophobicContact CD1-CZ 4.03Å; Y278-F314 HydrophobicContact CD2-CZ 4.05Å; Y278-F314 HydrophobicContact CE1-CZ 4.27Å; Y278-F314 HydrophobicContact CE2-CZ 4.32Å; Y278-F314 HydrophobicContact CG-CE1 4.07Å; Y278-F314 AromaticContact CG-CZ 3.92Å; Y278-F314 HydrophobicContact CG-CZ 3.92Å; V280-F314 HydrophobicContact CG1-CE1 4.35Å; F314-L317 HydrophobicContact CB-CD2 3.75Å; F314-L317 HydrophobicContact CD1-CD2 3.79Å; F314-L317 HydrophobicContact CG-CD2 3.92Å; F314-M322 HydrophobicContact CD1-CB 3.73Å; F314-M322 HydrophobicContact CD1-CG 4.12Å; F314-M322 HydrophobicContact CE1-CB 3.88Å; F314-M322 HydrophobicContact CE1-CG 3.94Å; F314-S323 CarbonylContact C-O 3.56Å; F314-V324 HydrophobicContact CD1-CG1 3.65Å; F314-V324 HydrophobicContact CE1-CG1 3.81Å; F314-V324 HydrophobicContact CG-CG1 4.18Å; F314-V324 HydrophobicContact CZ-CG1 4.47Å
315	V	90.3	Very high	87.1	Confident	10 Å²	10	49.8 Å²	49.8	6%	0.061	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	-49.9	177.6	-176.1	0	0	0	0	110.5	F157 A283 F284 S323 V325 L362	F157-V315 HydrophobicContact CD1-CB 4.36Å; F157-V315 HydrophobicContact CD1-CG1 4.25Å; F157-V315 HydrophobicContact CE1-CB 4.39Å; F157-V315 HydrophobicContact CE1-CG1 3.8Å; F157-V315 WeakPolarHBondContact CE1-O 3.35Å; F157-V315 HydrophobicContact CZ-CG1 4.39Å; A283-V315 HydrophobicContact CB-CB 4.3Å; A283-V315 HydrophobicContact CB-CG2 3.67Å; F284-V315 HydrophobicContact CE1-CG1 4.43Å; F284-V315 HydrophobicContact CE2-CG2 4.34Å; F284-V315 HydrophobicContact CZ-CG1 3.99Å; F284-V315 HydrophobicContact CZ-CG2 4.22Å; V315-S323 PolarHBondContact N-O 2.97Å; V315-V325 HydrophobicContact CG2-CG2 3.87Å; V315-L362 HydrophobicContact CG2-CD2 4.12Å
316	R	88.1	Confident	87.3	Confident	104 Å²	104	49.8 Å²	49.8	39%	0.392	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	133.9	177.1	-67.8	-176.8	178.3	167.4	2.8	109.9	E318 S323 S352	R316-E318 HydrophobicContact CB-CG 4.14Å; R316-S323 PolarHBondContact O-N 2.91Å; R316-S323 VanDerWaalsContact O-N 3.16Å; R316-S352 PolarHBondContact NH2-OG 3.39Å
317	L	84.3	Confident	87.7	Confident	66 Å²	66	47.1 Å²	47.1	35%	0.346	23%	0.225	S	C	.	.			trans	-95.8	85.6	172.6	-57.5	179.5	0	0	0	107.5	Y152 V154 F314	Y152-L317 HydrophobicContact CD1-CB 4.12Å; Y152-L317 HydrophobicContact CD1-CD1 4.25Å; Y152-L317 HydrophobicContact CD1-CD2 4.14Å; Y152-L317 HydrophobicContact CD1-CG 4.4Å; Y152-L317 HydrophobicContact CE1-CB 3.94Å; Y152-L317 HydrophobicContact CE1-CD2 4.47Å; V154-L317 HydrophobicContact CG2-CD2 3.99Å; F314-L317 HydrophobicContact CB-CD2 3.75Å; F314-L317 HydrophobicContact CD1-CD2 3.79Å; F314-L317 HydrophobicContact CG-CD2 3.92Å
318	E	79.9	Confident	88	Confident	71 Å²	71	44.3 Å²	44.3	33%	0.332	22%	0.218	S	C	.	.			trans	-85.1	167.5	175.5	-58.8	175.4	-164.8	0	0	109.4	Y152 R281 R316 V321 M322	Y152-E318 PolarHBondContact OH-O 3.36Å; R281-E318 IonicContact NH2-OE1 3.04Å; R281-E318 PolarHBondContact NH2-OE1 2.88Å; R316-E318 HydrophobicContact CB-CG 4.14Å; E318-V321 WeakPolarHBondContact CB-O 3.31Å; E318-M322 PolarHBondContact N-SD 3.13Å; E318-M322 VanDerWaalsContact N-SD 3.44Å; E318-M322 WeakPolarHBondContact O-CE 3.18Å
319	E	70.5	Confident	88	Confident	169 Å²	169	44.9 Å²	44.9	79%	0.79	23%	0.227	S	C	*	.	S	Bend	trans	-69.6	-36.5	-174.9	-71	-174.1	169.3	0	0	113.3	Y152	Y152-E319 WeakPolarHBondContact OH-CA 3.44Å
320	E	82.6	Confident	87.8	Confident	141 Å²	141	51 Å²	51	66%	0.659	24%	0.241	S	C	*	.	S	Bend	trans	-112	-46.9	-172.7	-62.8	-169.4	165.4	0	0	113.9
321	V	89.5	Confident	87.3	Confident	29 Å²	29	54.1 Å²	54.1	18%	0.176	26%	0.261	C	S	.	.	S	Bend	trans	-129.1	111	-173.5	-175.3	0	0	0	0	110.3	R279 R281 E318	R279-V321 HydrophobicContact CG-CG2 4.16Å; R279-V321 WeakPolarHBondContact O-CA 3.35Å; R281-V321 HydrophobicContact CB-CG1 4Å; R281-V321 HydrophobicContact CG-CG1 4.13Å; E318-V321 WeakPolarHBondContact CB-O 3.31Å
322	M	92.7	Very high	87.2	Confident	1 Å²	1	51.1 Å²	51.1	1%	0.005	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	144.5	-177.4	-39.8	-60.8	160.4	0	0	111.8	Y152 Y278 R279 V280 R281 F314 E318	Y152-M322 HydrophobicContact CD1-CE 4.29Å; Y152-M322 HydrophobicContact CE1-CE 3.26Å; Y152-M322 HydrophobicContact CE1-SD 3.62Å; Y278-M322 HydrophobicContact CD1-CG 4.42Å; R279-M322 PolarHBondContact O-N 3.38Å; V280-M322 CarbonylContact C-O 3.48Å; V280-M322 WeakPolarHBondContact CA-O 3.46Å; V280-M322 WeakPolarHBondContact CB-O 3.19Å; V280-M322 HydrophobicContact CG1-CB 3.98Å; V280-M322 HydrophobicContact CG1-CG 4.34Å; R281-M322 PolarHBondContact N-O 3.19Å; F314-M322 HydrophobicContact CD1-CB 3.73Å; F314-M322 HydrophobicContact CD1-CG 4.12Å; F314-M322 HydrophobicContact CE1-CB 3.88Å; F314-M322 HydrophobicContact CE1-CG 3.94Å; E318-M322 PolarHBondContact N-SD 3.13Å; E318-M322 VanDerWaalsContact N-SD 3.44Å; E318-M322 WeakPolarHBondContact O-CE 3.18Å
323	S	93.7	Very high	87.1	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	126.9	170.9	-175.3	0	0	0	0	110.2	R281 A283 F314 V315 R316 E349	R281-S323 PolarHBondContact NH1-OG 2.67Å; A283-S323 WeakPolarHBondContact CA-OG 3.31Å; A283-S323 WeakPolarHBondContact CB-OG 3.46Å; F314-S323 CarbonylContact C-O 3.56Å; V315-S323 PolarHBondContact N-O 2.97Å; R316-S323 PolarHBondContact O-N 2.91Å; R316-S323 VanDerWaalsContact O-N 3.16Å; S323-E349 PolarHBondContact OG-OE1 2.92Å
324	V	95	Very high	87	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	146.3	-177.6	-58.9	0	0	0	0	113.5	F185 V280 R281 A283 S313 F314 L326	F185-V324 HydrophobicContact CZ-CG2 4.04Å; V280-V324 HydrophobicContact CB-CG1 4.1Å; V280-V324 HydrophobicContact CB-CG2 3.98Å; V280-V324 HydrophobicContact CG1-CG1 3.88Å; V280-V324 HydrophobicContact CG2-CG2 4.04Å; R281-V324 WeakPolarHBondContact O-CG2 3.48Å; R281-V324 PolarHBondContact O-N 2.73Å; A283-V324 WeakPolarHBondContact CB-O 3.48Å; A283-V324 PolarHBondContact N-O 3.45Å; S313-V324 CarbonylContact O-C 3.43Å; S313-V324 VanDerWaalsContact O-CA 3.27Å; S313-V324 WeakPolarHBondContact O-CA 3.28Å; F314-V324 HydrophobicContact CD1-CG1 3.65Å; F314-V324 HydrophobicContact CE1-CG1 3.81Å; F314-V324 HydrophobicContact CG-CG1 4.18Å; F314-V324 HydrophobicContact CZ-CG1 4.47Å; V324-L326 HydrophobicContact CG2-CD2 3.83Å
325	V	94.4	Very high	86.9	Confident	5 Å²	5	53.8 Å²	53.8	3%	0.03	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	131	161.5	179.3	0	0	0	0	108.5	A283 F284 A312 S313 V315 F327 A332 L362	A283-V325 HydrophobicContact CB-CG2 3.86Å; F284-V325 HydrophobicContact CD2-CG2 4.12Å; F284-V325 HydrophobicContact CE2-CG2 3.75Å; A312-V325 WeakPolarHBondContact CA-O 3.44Å; S313-V325 PolarHBondContact N-O 2.84Å; S313-V325 PolarHBondContact O-N 3.4Å; V315-V325 HydrophobicContact CG2-CG2 3.87Å; V325-F327 HydrophobicContact CB-CE2 3.83Å; V325-F327 HydrophobicContact CB-CZ 4.23Å; V325-F327 HydrophobicContact CG1-CD2 4.26Å; V325-F327 HydrophobicContact CG1-CE1 4.4Å; V325-F327 HydrophobicContact CG1-CE2 3.5Å; V325-F327 HydrophobicContact CG1-CZ 3.58Å; V325-F327 WeakPolarHBondContact O-CD2 3.42Å; V325-F327 WeakPolarHBondContact O-CE2 3.12Å; V325-A332 HydrophobicContact CG1-CB 4Å; V325-L362 HydrophobicContact CB-CD1 4.24Å; V325-L362 HydrophobicContact CB-CD2 4.4Å; V325-L362 HydrophobicContact CB-CG 4.4Å; V325-L362 HydrophobicContact CG2-CD1 4.41Å; V325-L362 HydrophobicContact CG2-CD2 3.69Å; V325-L362 HydrophobicContact CG2-CG 4.14Å
326	L	94.5	Very high	86.9	Confident	1 Å²	1	56 Å²	56	1%	0.005	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	146.5	178.8	-53.7	-176.4	0	0	0	111.1	F185 L282 Y304 L305 F310 Q311 A312 V324 A332 L333	F185-L326 HydrophobicContact CE2-CD1 4.32Å; F185-L326 HydrophobicContact CZ-CD1 4.17Å; L282-L326 HydrophobicContact CD2-CD1 3.6Å; L282-L326 HydrophobicContact CD2-CG 3.64Å; Y304-L326 HydrophobicContact CD1-CD1 4.3Å; Y304-L326 HydrophobicContact CE1-CB 3.74Å; Y304-L326 HydrophobicContact CE1-CD1 4.24Å; Y304-L326 PolarHBondContact OH-O 2.98Å; L305-L326 HydrophobicContact CD2-CD1 3.53Å; L305-L326 HydrophobicContact CG-CD1 4.32Å; F310-L326 HydrophobicContact CD2-CD2 4.16Å; F310-L326 HydrophobicContact CE2-CD2 4.02Å; Q311-L326 CarbonylContact O-C 3.18Å; Q311-L326 WeakPolarHBondContact O-CA 3.41Å; A312-L326 HydrophobicContact CB-CD2 3.93Å; V324-L326 HydrophobicContact CG2-CD2 3.83Å; L326-A332 CarbonylContact O-C 3.54Å; L326-A332 WeakPolarHBondContact O-CA 3.48Å; L326-L333 HydrophobicContact CB-CB 4.1Å; L326-L333 HydrophobicContact CB-CD2 4.24Å; L326-L333 HydrophobicContact CD1-CD2 3.89Å; L326-L333 HydrophobicContact CG-CD2 4.43Å; L326-L333 PolarHBondContact O-N 3.35Å
327	F	91.6	Very high	87.2	Confident	18 Å²	18	51.1 Å²	51.1	8%	0.079	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	139	-178	-63.9	-95.4	0	0	0	112.3	T171 Y304 Q311 V325 T331 A332 L362	T171-F327 HydrophobicContact CG2-CD2 4.26Å; T171-F327 HydrophobicContact CG2-CE2 4.45Å; Y304-F327 WeakPolarHBondContact OH-CA 3.32Å; Y304-F327 PolarHBondContact OH-N 2.64Å; Y304-F327 PolarHBondContact OH-O 2.84Å; Q311-F327 HydrophobicContact CB-CB 4.03Å; Q311-F327 PolarHBondContact N-O 3.27Å; Q311-F327 PolarHBondContact O-N 2.79Å; V325-F327 HydrophobicContact CB-CE2 3.83Å; V325-F327 HydrophobicContact CB-CZ 4.23Å; V325-F327 HydrophobicContact CG1-CD2 4.26Å; V325-F327 HydrophobicContact CG1-CE1 4.4Å; V325-F327 HydrophobicContact CG1-CE2 3.5Å; V325-F327 HydrophobicContact CG1-CZ 3.58Å; V325-F327 WeakPolarHBondContact O-CD2 3.42Å; V325-F327 WeakPolarHBondContact O-CE2 3.12Å; F327-T331 WeakPolarHBondContact CA-O 3.48Å; F327-A332 HydrophobicContact CD1-CB 3.97Å; F327-A332 HydrophobicContact CE1-CB 3.63Å; F327-A332 HydrophobicContact CZ-CB 4.19Å; F327-L362 HydrophobicContact CE2-CD1 3.98Å; F327-L362 HydrophobicContact CZ-CD1 3.63Å; F327-L362 HydrophobicContact CZ-CG 4.28Å
328	D	84.6	Confident	87.6	Confident	45 Å²	45	48.2 Å²	48.2	24%	0.241	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	112.1	175.3	-176.8	5.4	0	0	0	106.4	Y304 R307 K330 T331	Y304-D328 HydrophobicContact CE2-CB 3.74Å; Y304-D328 PolarHBondContact OH-N 3.08Å; R307-D328 IonicContact NH1-OD2 3.89Å; R307-D328 PolarHBondContact NH1-OD2 3.03Å; D328-K330 PolarHBondContact O-N 3.23Å; D328-T331 PolarHBondContact N-O 2.59Å; D328-T331 PolarHBondContact O-N 3.25Å
329	D	73.2	Confident	88.3	Confident	147 Å²	147	51.3 Å²	51.3	79%	0.786	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	35.5	39.3	178.5	-74.1	-14.4	0	0	0	115.2
330	K	72.8	Confident	89.4	Confident	194 Å²	194	44.1 Å²	44.1	84%	0.843	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	105.6	-12.1	178.6	-58.1	160.2	-175.1	-177	0	118	D328	D328-K330 PolarHBondContact O-N 3.23Å
331	T	82.9	Confident	89.8	Confident	71 Å²	71	41.2 Å²	41.2	44%	0.436	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	127.7	179.3	-48.8	0	0	0	0	110.7	F327 D328 N335	F327-T331 WeakPolarHBondContact CA-O 3.48Å; D328-T331 PolarHBondContact N-O 2.59Å; D328-T331 PolarHBondContact O-N 3.25Å; T331-N335 HydrophobicContact CG2-CB 4.39Å
332	A	89.4	Confident	90	Very high	2 Å²	2	40.1 Å²	40.1	2%	0.017	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	134	173.6	0	0	0	0	0	110.7	V325 L326 F327 F334 N335	V325-A332 HydrophobicContact CG1-CB 4Å; L326-A332 CarbonylContact O-C 3.54Å; L326-A332 WeakPolarHBondContact O-CA 3.48Å; F327-A332 HydrophobicContact CD1-CB 3.97Å; F327-A332 HydrophobicContact CE1-CB 3.63Å; F327-A332 HydrophobicContact CZ-CB 4.19Å; A332-F334 HydrophobicContact CB-CB 4.28Å; A332-F334 PolarHBondContact O-N 3.32Å; A332-F334 VanDerWaalsContact O-N 3.08Å; A332-N335 WeakPolarHBondContact O-CB 3.4Å; A332-N335 PolarHBondContact O-N 3.39Å
333	L	92.3	Very high	90.1	Very high	2 Å²	2	40.1 Å²	40.1	1%	0.01	21%	0.205	C	C	.	.	H	α-helix	trans	-53.6	-29.9	171.5	174	58.8	0	0	0	111.8	L282 V301 Y304 L326 N335 E336 L337	L282-L333 HydrophobicContact CD1-CD2 3.94Å; L282-L333 HydrophobicContact CD2-CD2 4.08Å; V301-L333 HydrophobicContact CG2-CD2 4.34Å; Y304-L333 HydrophobicContact CD1-CD2 4.09Å; Y304-L333 HydrophobicContact CD2-CB 4.32Å; Y304-L333 HydrophobicContact CD2-CD1 3.61Å; Y304-L333 HydrophobicContact CD2-CG 4.36Å; Y304-L333 HydrophobicContact CE1-CB 4.33Å; Y304-L333 HydrophobicContact CE1-CD2 4.41Å; Y304-L333 HydrophobicContact CE2-CB 3.9Å; Y304-L333 HydrophobicContact CE2-CD1 4.04Å; Y304-L333 HydrophobicContact CE2-CG 4.44Å; Y304-L333 HydrophobicContact CG-CD1 3.84Å; Y304-L333 HydrophobicContact CG-CD2 4.14Å; Y304-L333 HydrophobicContact CG-CG 4.42Å; L326-L333 HydrophobicContact CB-CB 4.1Å; L326-L333 HydrophobicContact CB-CD2 4.24Å; L326-L333 HydrophobicContact CD1-CD2 3.89Å; L326-L333 HydrophobicContact CG-CD2 4.43Å; L326-L333 PolarHBondContact O-N 3.35Å; L333-N335 PolarHBondContact O-N 3.04Å; L333-E336 HydrophobicContact CD1-CB 4.31Å; L333-E336 PolarHBondContact O-N 3.48Å; L333-E336 VanDerWaalsContact O-N 3.13Å; L333-L337 HydrophobicContact CD1-CD1 4.42Å; L333-L337 HydrophobicContact CD1-CD2 4.34Å; L333-L337 HydrophobicContact CD1-CG 4.01Å; L333-L337 HydrophobicContact CG-CD1 4.03Å; L333-L337 HydrophobicContact CG-CG 4.12Å; L333-L337 WeakPolarHBondContact O-CG 3.27Å; L333-L337 PolarHBondContact O-N 3.27Å
334	F	92.6	Very high	90.1	Very high	7 Å²	7	40.2 Å²	40.2	3%	0.031	21%	0.206	C	C	.	.	H	α-helix	trans	-49.8	-45.1	172.7	-179.7	-91.7	0	0	0	112.2	F284 A332 L337 L338 F345 L350 L363 F424 F428	F284-F334 HydrophobicContact CB-CD2 4.12Å; F284-F334 HydrophobicContact CB-CE2 3.86Å; F284-F334 HydrophobicContact CD2-CD2 4.38Å; A332-F334 HydrophobicContact CB-CB 4.28Å; A332-F334 PolarHBondContact O-N 3.32Å; A332-F334 VanDerWaalsContact O-N 3.08Å; F334-L337 PolarHBondContact O-N 3.33Å; F334-L338 HydrophobicContact CE1-CD1 4.2Å; F334-L338 HydrophobicContact CE1-CD2 4.16Å; F334-L338 HydrophobicContact CE1-CG 4.29Å; F334-L338 HydrophobicContact CZ-CD2 4.3Å; F334-L338 PolarHBondContact O-N 2.87Å; F334-F345 HydrophobicContact CD2-CD1 4.11Å; F334-F345 AromaticContact CD2-CE1 4Å; F334-F345 HydrophobicContact CD2-CE1 4Å; F334-F345 AromaticContact CE2-CD1 3.51Å; F334-F345 HydrophobicContact CE2-CD1 3.51Å; F334-F345 AromaticContact CE2-CE1 3.75Å; F334-F345 HydrophobicContact CE2-CE1 3.75Å; F334-F345 HydrophobicContact CZ-CD1 4.12Å; F334-F345 HydrophobicContact CZ-CE1 4.26Å; F334-L350 HydrophobicContact CE2-CD1 4.39Å; F334-L350 HydrophobicContact CZ-CD1 4.35Å; F334-L363 HydrophobicContact CD1-CD2 3.99Å; F334-L363 HydrophobicContact CE1-CD2 4.3Å; F334-L363 HydrophobicContact CG-CD2 4.14Å; F334-F424 HydrophobicContact CZ-CE1 4.17Å; F334-F424 HydrophobicContact CZ-CZ 4.34Å; F334-F428 HydrophobicContact CZ-CD1 4.39Å
335	N	89.3	Confident	90	Very high	46 Å²	46	40.2 Å²	40.2	25%	0.246	21%	0.206	C	C	.	.	H	α-helix	trans	-68.7	-37.7	-178.6	-66.6	-22.9	0	0	0	112	T331 A332 L333 L337 L338 H339 S366	T331-N335 HydrophobicContact CG2-CB 4.39Å; A332-N335 WeakPolarHBondContact O-CB 3.4Å; A332-N335 PolarHBondContact O-N 3.39Å; L333-N335 PolarHBondContact O-N 3.04Å; N335-L337 VanDerWaalsContact C-N 3.33Å; N335-L338 WeakPolarHBondContact O-CB 3.36Å; N335-L338 PolarHBondContact O-N 3.11Å; N335-H339 PolarHBondContact O-CD2 3.31Å; N335-S366 PolarHBondContact OD1-OG 3.22Å
336	E	90.9	Very high	89.9	Confident	57 Å²	57	41.9 Å²	41.9	27%	0.266	22%	0.215	S	C	.	.	H	α-helix	trans	-63.7	-41.8	174.2	-62.7	-170.8	-172	0	0	111.2	L333 L338 H339	L333-E336 HydrophobicContact CD1-CB 4.31Å; L333-E336 PolarHBondContact O-N 3.48Å; L333-E336 VanDerWaalsContact O-N 3.13Å; E336-L338 PolarHBondContact O-N 2.76Å; E336-H339 WeakPolarHBondContact O-CB 3.48Å; E336-H339 PolarHBondContact O-N 2.77Å
337	L	94.5	Very high	89.5	Confident	1 Å²	1	42 Å²	42	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-64.9	-24.4	-179.6	-68.7	177.7	0	0	0	112.9	L282 V285 V297 V301 L333 F334 N335 H339 V340 F345	L282-L337 HydrophobicContact CD1-CD1 4.26Å; V285-L337 HydrophobicContact CG1-CD1 4.44Å; V285-L337 HydrophobicContact CG2-CD1 3.79Å; V297-L337 HydrophobicContact CG1-CD2 4.28Å; V301-L337 HydrophobicContact CG2-CD2 4.35Å; L333-L337 HydrophobicContact CD1-CD1 4.42Å; L333-L337 HydrophobicContact CD1-CD2 4.34Å; L333-L337 HydrophobicContact CD1-CG 4.01Å; L333-L337 HydrophobicContact CG-CD1 4.03Å; L333-L337 HydrophobicContact CG-CG 4.12Å; L333-L337 WeakPolarHBondContact O-CG 3.27Å; L333-L337 PolarHBondContact O-N 3.27Å; F334-L337 PolarHBondContact O-N 3.33Å; N335-L337 VanDerWaalsContact C-N 3.33Å; L337-H339 PolarHBondContact O-N 3.16Å; L337-H339 VanDerWaalsContact O-N 3.14Å; L337-V340 HydrophobicContact CD2-CB 4.35Å; L337-V340 HydrophobicContact CD2-CG2 4.04Å; L337-V340 PolarHBondContact O-N 3.04Å; L337-F345 HydrophobicContact CB-CE1 4.15Å; L337-F345 HydrophobicContact CB-CZ 3.98Å
338	L	93.5	Very high	89.1	Confident	5 Å²	5	44.9 Å²	44.9	3%	0.026	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-20.7	173.4	-64.9	173.8	0	0	0	112.5	F334 N335 E336 F345 H421 F424 A425 F428 M429	F334-L338 HydrophobicContact CE1-CD1 4.2Å; F334-L338 HydrophobicContact CE1-CD2 4.16Å; F334-L338 HydrophobicContact CE1-CG 4.29Å; F334-L338 HydrophobicContact CZ-CD2 4.3Å; F334-L338 PolarHBondContact O-N 2.87Å; N335-L338 WeakPolarHBondContact O-CB 3.36Å; N335-L338 PolarHBondContact O-N 3.11Å; E336-L338 PolarHBondContact O-N 2.76Å; L338-F345 HydrophobicContact CD2-CE1 4.12Å; L338-F345 HydrophobicContact CD2-CE2 3.98Å; L338-F345 HydrophobicContact CD2-CZ 3.71Å; L338-F345 HydrophobicContact CG-CZ 4.28Å; L338-H421 PolarHBondContact O-CE1 3.37Å; L338-H421 PolarHBondContact O-NE2 3.21Å; L338-F424 HydrophobicContact CD2-CD1 3.85Å; L338-F424 HydrophobicContact CD2-CE1 3.68Å; L338-A425 WeakPolarHBondContact O-CB 3.48Å; L338-F428 HydrophobicContact CD1-CB 4.37Å; L338-F428 HydrophobicContact CD2-CB 4.05Å; L338-M429 HydrophobicContact CB-CE 3.43Å; L338-M429 VanDerWaalsContact CB-CE 3.43Å; L338-M429 HydrophobicContact CD1-CG 4.35Å; L338-M429 WeakPolarHBondContact O-CE 3.42Å
339	H	93.9	Very high	89.3	Confident	137 Å²	137	43.4 Å²	43.4	63%	0.634	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.1	-5.7	176	-60.5	-74.6	0	0	0	113.2	N335 E336 L337 P341 M429	N335-H339 PolarHBondContact O-CD2 3.31Å; E336-H339 WeakPolarHBondContact O-CB 3.48Å; E336-H339 PolarHBondContact O-N 2.77Å; L337-H339 PolarHBondContact O-N 3.16Å; L337-H339 VanDerWaalsContact O-N 3.14Å; H339-P341 WeakPolarHBondContact O-CD 3.04Å; H339-M429 WeakPolarHBondContact CE1-CE 3.29Å; H339-M429 VanDerWaalsContact ND1-CE 3.31Å; H339-M429 WeakPolarHBondContact ND1-CE 3.28Å
340	V	94.3	Very high	90	Very high	17 Å²	17	36.4 Å²	36.4	10%	0.103	19%	0.192	C	C	.	.	S	Bend	trans	-90	118	-175.4	178.8	0	0	0	0	110.4	A296 V297 L337 L342 A343 H421	A296-V340 HydrophobicContact CB-CG1 3.85Å; V297-V340 HydrophobicContact CG2-CG1 3.86Å; L337-V340 HydrophobicContact CD2-CB 4.35Å; L337-V340 HydrophobicContact CD2-CG2 4.04Å; L337-V340 PolarHBondContact O-N 3.04Å; V340-L342 PolarHBondContact O-N 2.93Å; V340-A343 WeakPolarHBondContact O-CB 3.33Å; V340-A343 PolarHBondContact O-N 2.91Å; V340-H421 PolarHBondContact O-CD2 3.36Å; V340-H421 PolarHBondContact O-NE2 3.33Å
341	P	90.1	Very high	90.5	Very high	80 Å²	80	29 Å²	29	52%	0.519	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	140.9	-177.9	-24.9	33.3	0	0	0	112.9	S294 H339 A343	S294-P341 PolarHBondContact OG-O 3.46Å; H339-P341 WeakPolarHBondContact O-CD 3.04Å; P341-A343 PolarHBondContact O-N 3.36Å
342	L	93	Very high	90.5	Very high	7 Å²	7	28.1 Å²	28.1	4%	0.037	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.6	16.5	178	-47.6	173.5	0	0	0	114.1	F288 V340 V344 V414 A417 R418 N469	F288-L342 HydrophobicContact CZ-CB 3.92Å; V340-L342 PolarHBondContact O-N 2.93Å; L342-V344 PolarHBondContact O-N 3Å; L342-V414 HydrophobicContact CD1-CG1 4.07Å; L342-V414 HydrophobicContact CD2-CG1 4.02Å; L342-A417 HydrophobicContact CD2-CB 4.42Å; L342-R418 HydrophobicContact CD2-CB 3.6Å; L342-R418 HydrophobicContact CD2-CG 4.18Å; L342-N469 HydrophobicContact CD1-CB 3.68Å
343	A	94.9	Very high	90	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.162	C	C	.	.			trans	-62.5	130.1	166.7	0	0	0	0	0	109.9	V297 V340 P341 F345 H421	V297-A343 HydrophobicContact CG2-CB 3.68Å; V340-A343 WeakPolarHBondContact O-CB 3.33Å; V340-A343 PolarHBondContact O-N 2.91Å; P341-A343 PolarHBondContact O-N 3.36Å; A343-F345 HydrophobicContact CB-CE2 3.74Å; A343-F345 HydrophobicContact CB-CZ 3.96Å; A343-H421 PolarHBondContact O-CD2 3.05Å; A343-H421 VanDerWaalsContact O-CD2 3.32Å
344	V	94.5	Very high	89.2	Confident	3 Å²	3	36.4 Å²	36.4	2%	0.018	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	113	176.6	-174.9	0	0	0	0	107.4	R286 F288 L342 A417 F420 L450	R286-V344 HydrophobicContact CG-CB 4.32Å; R286-V344 HydrophobicContact CG-CG1 3.78Å; R286-V344 VanDerWaalsContact CZ-CG1 3.46Å; R286-V344 PolarHBondContact N-O 3.43Å; F288-V344 HydrophobicContact CD1-CG2 4.47Å; F288-V344 HydrophobicContact CD2-CG2 4.07Å; F288-V344 HydrophobicContact CE2-CG2 4.13Å; F288-V344 HydrophobicContact CG-CG2 4.24Å; F288-V344 HydrophobicContact CZ-CG2 4.44Å; L342-V344 PolarHBondContact O-N 3Å; V344-A417 HydrophobicContact CG2-CB 4.4Å; V344-F420 HydrophobicContact CB-CE1 4.44Å; V344-F420 HydrophobicContact CG1-CD1 4.19Å; V344-F420 HydrophobicContact CG1-CE1 3.84Å; V344-L450 HydrophobicContact CB-CD2 4.41Å; V344-L450 HydrophobicContact CG1-CD2 3.61Å; V344-L450 HydrophobicContact CG2-CD2 3.83Å
345	F	94.1	Very high	88.7	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	146.8	177	-62.2	-85.5	0	0	0	110.9	F284 V285 F334 L337 L338 A343 L347 F420 F424	F284-F345 CarbonylContact O-C 3.55Å; F284-F345 WeakPolarHBondContact O-CA 3.34Å; F284-F345 WeakPolarHBondContact O-CB 3.25Å; F284-F345 WeakPolarHBondContact O-CD1 3.38Å; V285-F345 HydrophobicContact CG2-CD1 3.94Å; V285-F345 HydrophobicContact CG2-CE1 3.98Å; F334-F345 HydrophobicContact CD2-CD1 4.11Å; F334-F345 AromaticContact CD2-CE1 4Å; F334-F345 HydrophobicContact CD2-CE1 4Å; F334-F345 AromaticContact CE2-CD1 3.51Å; F334-F345 HydrophobicContact CE2-CD1 3.51Å; F334-F345 AromaticContact CE2-CE1 3.75Å; F334-F345 HydrophobicContact CE2-CE1 3.75Å; F334-F345 HydrophobicContact CZ-CD1 4.12Å; F334-F345 HydrophobicContact CZ-CE1 4.26Å; L337-F345 HydrophobicContact CB-CE1 4.15Å; L337-F345 HydrophobicContact CB-CZ 3.98Å; L338-F345 HydrophobicContact CD2-CE1 4.12Å; L338-F345 HydrophobicContact CD2-CE2 3.98Å; L338-F345 HydrophobicContact CD2-CZ 3.71Å; L338-F345 HydrophobicContact CG-CZ 4.28Å; A343-F345 HydrophobicContact CB-CE2 3.74Å; A343-F345 HydrophobicContact CB-CZ 3.96Å; F345-L347 PolarHBondContact O-N 2.74Å; F345-F420 HydrophobicContact CB-CZ 4.5Å; F345-F424 HydrophobicContact CB-CD1 4.11Å; F345-F424 HydrophobicContact CB-CD2 4Å; F345-F424 HydrophobicContact CB-CE1 3.66Å; F345-F424 HydrophobicContact CB-CE2 3.52Å; F345-F424 HydrophobicContact CB-CG 4.28Å; F345-F424 HydrophobicContact CB-CZ 3.34Å; F345-F424 AromaticContact CD1-CE1 3.95Å; F345-F424 HydrophobicContact CD1-CE1 3.95Å; F345-F424 HydrophobicContact CD1-CZ 4.25Å; F345-F424 AromaticContact CD2-CD1 3.35Å; F345-F424 HydrophobicContact CD2-CD1 3.35Å; F345-F424 HydrophobicContact CD2-CD2 4.46Å; F345-F424 AromaticContact CD2-CE1 3.5Å; F345-F424 HydrophobicContact CD2-CE1 3.5Å; F345-F424 AromaticContact CD2-CG 3.89Å; F345-F424 HydrophobicContact CD2-CG 3.89Å; F345-F424 HydrophobicContact CD2-CZ 4.13Å; F345-F424 HydrophobicContact CE1-CE1 4.5Å; F345-F424 AromaticContact CE2-CD1 3.9Å; F345-F424 HydrophobicContact CE2-CD1 3.9Å; F345-F424 HydrophobicContact CE2-CE1 4.12Å; F345-F424 AromaticContact CG-CD1 3.78Å; F345-F424 HydrophobicContact CG-CD1 3.78Å; F345-F424 AromaticContact CG-CE1 3.4Å; F345-F424 HydrophobicContact CG-CE1 3.4Å; F345-F424 VanDerWaalsContact CG-CE1 3.4Å; F345-F424 HydrophobicContact CG-CE2 4.22Å; F345-F424 HydrophobicContact CG-CG 4.34Å; F345-F424 AromaticContact CG-CZ 3.66Å; F345-F424 HydrophobicContact CG-CZ 3.66Å
346	D	91	Very high	88.4	Confident	40 Å²	40	38.1 Å²	38.1	21%	0.214	21%	0.212	C	C	.	.			trans	-91.3	93.2	175.7	-165.8	-30	0	0	0	109.7	F284 R286 S348 E349 L350	F284-D346 PolarHBondContact O-N 2.82Å; R286-D346 HydrophobicContact CB-CB 4.46Å; R286-D346 HydrophobicContact CG-CB 4.28Å; D346-S348 VanDerWaalsContact C-N 3.26Å; D346-S348 PolarHBondContact O-N 2.9Å; D346-S348 WeakPolarHBondContact OD1-CB 3.43Å; D346-S348 PolarHBondContact OD1-N 2.87Å; D346-S348 VanDerWaalsContact OD1-N 3.07Å; D346-E349 HydrophobicContact CB-CB 3.94Å; D346-E349 PolarHBondContact OD1-N 3.27Å; D346-L350 PolarHBondContact O-N 2.85Å
347	L	86.7	Confident	88.1	Confident	4 Å²	4	39.7 Å²	39.7	2%	0.021	22%	0.219	C	C	.	.	H	α-helix	trans	-70.7	-29.2	-180	-171	63.3	0	0	0	110.9	F345 L350 M351 L373 F424 F428 I444 E447	F345-L347 PolarHBondContact O-N 2.74Å; L347-L350 PolarHBondContact O-N 3.41Å; L347-M351 HydrophobicContact CD1-CG 4.22Å; L347-M351 HydrophobicContact CG-CG 4.03Å; L347-M351 WeakPolarHBondContact O-CB 3.35Å; L347-M351 WeakPolarHBondContact O-CG 3.48Å; L347-M351 PolarHBondContact O-N 2.81Å; L347-L373 HydrophobicContact CD1-CD1 4.31Å; L347-L373 HydrophobicContact CD1-CD2 4.1Å; L347-L373 HydrophobicContact CD2-CD1 4.42Å; L347-L373 HydrophobicContact CD2-CD2 4.17Å; L347-L373 HydrophobicContact CG-CD2 4.41Å; L347-F424 HydrophobicContact CB-CE2 4.48Å; L347-F424 HydrophobicContact CD1-CE2 3.99Å; L347-F428 HydrophobicContact CD1-CE2 4.01Å; L347-F428 HydrophobicContact CD1-CZ 3.89Å; L347-I444 HydrophobicContact CD2-CB 4.47Å; L347-I444 HydrophobicContact CD2-CG1 3.58Å; L347-E447 VanDerWaalsContact CB-OE1 3.3Å; L347-E447 WeakPolarHBondContact CB-OE1 3.36Å; L347-E447 WeakPolarHBondContact CB-OE2 3.21Å; L347-E447 PolarHBondContact N-OE1 2.89Å; L347-E447 VanDerWaalsContact N-OE1 3.16Å
348	S	83.5	Confident	87.6	Confident	78 Å²	78	39.6 Å²	39.6	55%	0.545	22%	0.219	S	C	.	.	H	α-helix	trans	-66.1	-44.5	177.3	-62.6	0	0	0	0	110.7	D346 M351 S352	D346-S348 VanDerWaalsContact C-N 3.26Å; D346-S348 PolarHBondContact O-N 2.9Å; D346-S348 WeakPolarHBondContact OD1-CB 3.43Å; D346-S348 PolarHBondContact OD1-N 2.87Å; D346-S348 VanDerWaalsContact OD1-N 3.07Å; S348-M351 PolarHBondContact O-N 3.32Å; S348-S352 VanDerWaalsContact O-CB 3.23Å; S348-S352 WeakPolarHBondContact O-CB 3.35Å; S348-S352 PolarHBondContact O-N 3.16Å; S348-S352 PolarHBondContact O-OG 3.28Å
349	E	88	Confident	87.3	Confident	13 Å²	13	39.4 Å²	39.4	6%	0.061	22%	0.218	C	C	.	.	H	α-helix	trans	-59.4	-48.5	173.9	-170.4	175.9	-156.8	0	0	110.8	R281 F284 S323 D346 M351 S352	R281-E349 IonicContact CZ-OE1 3.6Å; R281-E349 VanDerWaalsContact CZ-OE1 3.3Å; R281-E349 IonicContact NH1-OE1 3.54Å; R281-E349 PolarHBondContact NH1-OE1 3.37Å; R281-E349 IonicContact NH1-OE2 2.61Å; R281-E349 PolarHBondContact NH1-OE2 2.93Å; R281-E349 VanDerWaalsContact NH1-OE2 3.08Å; R281-E349 IonicContact NH2-OE1 2.7Å; R281-E349 PolarHBondContact NH2-OE1 3.2Å; F284-E349 WeakPolarHBondContact CA-OE2 3.42Å; F284-E349 HydrophobicContact CD1-CB 4.17Å; F284-E349 HydrophobicContact CD1-CG 3.81Å; F284-E349 HydrophobicContact CE1-CG 3.96Å; F284-E349 PolarHBondContact N-OE2 2.86Å; S323-E349 PolarHBondContact OG-OE1 2.92Å; D346-E349 HydrophobicContact CB-CB 3.94Å; D346-E349 PolarHBondContact OD1-N 3.27Å; E349-M351 PolarHBondContact O-N 3.06Å; E349-S352 PolarHBondContact O-N 3.45Å; E349-S352 PolarHBondContact O-OG 3.47Å
350	L	88.9	Confident	87	Confident	0 Å²	0	37 Å²	37	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-58.8	-45.4	176.7	-76.6	166.1	0	0	0	112.7	F284 F334 D346 L347 S352 C353 L363 L370 F424 F428	F284-L350 HydrophobicContact CB-CD1 4.24Å; F284-L350 HydrophobicContact CB-CD2 3.93Å; F284-L350 HydrophobicContact CB-CG 3.86Å; F284-L350 HydrophobicContact CD1-CB 4.42Å; F284-L350 HydrophobicContact CD1-CD2 3.45Å; F284-L350 VanDerWaalsContact CD1-CD2 3.45Å; F284-L350 HydrophobicContact CD1-CG 3.58Å; F284-L350 HydrophobicContact CD2-CD2 3.88Å; F284-L350 HydrophobicContact CE1-CD2 3.84Å; F284-L350 HydrophobicContact CE1-CG 4.29Å; F284-L350 HydrophobicContact CE2-CD2 4.24Å; F284-L350 HydrophobicContact CG-CD2 3.46Å; F284-L350 VanDerWaalsContact CG-CD2 3.46Å; F284-L350 HydrophobicContact CG-CG 3.79Å; F284-L350 HydrophobicContact CZ-CD2 4.22Å; F334-L350 HydrophobicContact CE2-CD1 4.39Å; F334-L350 HydrophobicContact CZ-CD1 4.35Å; D346-L350 PolarHBondContact O-N 2.85Å; L347-L350 PolarHBondContact O-N 3.41Å; L350-S352 VanDerWaalsContact C-N 3.32Å; L350-S352 PolarHBondContact O-N 3.44Å; L350-C353 WeakPolarHBondContact O-CB 3.43Å; L350-C353 PolarHBondContact O-N 2.94Å; L350-L363 HydrophobicContact CD2-CD1 3.71Å; L350-L370 HydrophobicContact CB-CD1 3.96Å; L350-L370 HydrophobicContact CB-CD2 4.27Å; L350-L370 HydrophobicContact CD2-CD2 4.21Å; L350-F424 HydrophobicContact CD1-CE2 4.32Å; L350-F424 HydrophobicContact CD1-CZ 3.8Å; L350-F428 HydrophobicContact CD1-CE1 4.12Å; L350-F428 HydrophobicContact CD1-CZ 4.05Å
351	M	82.3	Confident	86.6	Confident	39 Å²	39	39.7 Å²	39.7	19%	0.192	22%	0.221	C	C	.	.	H	α-helix	trans	-70.6	-29	-177.6	-71.8	-79.8	-71.9	0	0	112.6	L347 S348 E349 C353 L370 L373 Q374 Y377	L347-M351 HydrophobicContact CD1-CG 4.22Å; L347-M351 HydrophobicContact CG-CG 4.03Å; L347-M351 WeakPolarHBondContact O-CB 3.35Å; L347-M351 WeakPolarHBondContact O-CG 3.48Å; L347-M351 PolarHBondContact O-N 2.81Å; S348-M351 PolarHBondContact O-N 3.32Å; E349-M351 PolarHBondContact O-N 3.06Å; M351-C353 VanDerWaalsContact C-N 3.28Å; M351-C353 PolarHBondContact O-N 3.16Å; M351-L370 HydrophobicContact CG-CD1 4.34Å; M351-L370 HydrophobicContact SD-CD1 4.02Å; M351-L373 HydrophobicContact CE-CD2 3.83Å; M351-L373 HydrophobicContact CG-CD2 4.24Å; M351-L373 HydrophobicContact SD-CD2 3.3Å; M351-L373 WeakPolarHBondContact SD-CD2 3.3Å; M351-Q374 HydrophobicContact CE-CB 4.48Å; M351-Q374 HydrophobicContact CE-CG 4.04Å; M351-Q374 PolarHBondContact O-NE2 3.33Å; M351-Q374 HydrophobicContact SD-CB 4.14Å; M351-Q374 HydrophobicContact SD-CG 3.27Å; M351-Q374 WeakPolarHBondContact SD-CG 3.48Å; M351-Y377 HydrophobicContact CE-CD1 3.97Å; M351-Y377 HydrophobicContact CE-CD2 4.17Å; M351-Y377 HydrophobicContact CE-CG 3.62Å
352	S	82.2	Confident	86.5	Confident	52 Å²	52	36 Å²	36	36%	0.364	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-1	-179.9	73.2	0	0	0	0	114.5	R316 S348 E349 L350 D354	R316-S352 PolarHBondContact NH2-OG 3.39Å; S348-S352 VanDerWaalsContact O-CB 3.23Å; S348-S352 WeakPolarHBondContact O-CB 3.35Å; S348-S352 PolarHBondContact O-N 3.16Å; S348-S352 PolarHBondContact O-OG 3.28Å; E349-S352 PolarHBondContact O-N 3.45Å; E349-S352 PolarHBondContact O-OG 3.47Å; L350-S352 VanDerWaalsContact C-N 3.32Å; L350-S352 PolarHBondContact O-N 3.44Å; S352-D354 PolarHBondContact O-N 3.03Å
353	C	79.9	Confident	86.3	Confident	16 Å²	16	35.9 Å²	35.9	11%	0.108	20%	0.196	C	C	.	.			trans	-74	118.4	-176.2	-153.2	0	0	0	0	111.4	L350 M351 L359	L350-C353 WeakPolarHBondContact O-CB 3.43Å; L350-C353 PolarHBondContact O-N 2.94Å; M351-C353 VanDerWaalsContact C-N 3.28Å; M351-C353 PolarHBondContact O-N 3.16Å; C353-L359 HydrophobicContact CB-CD2 3.75Å
354	D	75.2	Confident	85.8	Confident	162 Å²	162	37.6 Å²	37.6	87%	0.866	21%	0.213	S	C	*	.	S	Bend	trans	-73.8	-39.6	-173.7	-64.9	-41	0	0	0	113.4	S352 L356	S352-D354 PolarHBondContact O-N 3.03Å; D354-L356 PolarHBondContact O-N 3.24Å
355	N	83.1	Confident	85.3	Confident	45 Å²	45	42.1 Å²	42.1	24%	0.241	24%	0.237	C	C	.	.			trans	-93.1	83.1	-177.8	-167.8	-21.6	0	0	0	111.2	N158 E357 A358 L359	N158-N355 HydrophobicContact CB-CB 4.06Å; N355-E357 VanDerWaalsContact C-N 3.27Å; N355-E357 PolarHBondContact O-N 3.24Å; N355-E357 PolarHBondContact OD1-N 2.79Å; N355-A358 HydrophobicContact CB-CB 4.06Å; N355-A358 PolarHBondContact O-N 3.19Å; N355-A358 PolarHBondContact OD1-N 3.05Å; N355-L359 PolarHBondContact O-N 2.89Å
356	L	82.6	Confident	84.8	Confident	44 Å²	44	42.6 Å²	42.6	23%	0.23	24%	0.241	C	C	.	.	H	α-helix	trans	-61.1	-32.3	-179.8	-63.6	-175.1	0	0	0	113.7	D354 L359 E360 F367	D354-L356 PolarHBondContact O-N 3.24Å; L356-L359 PolarHBondContact O-N 2.84Å; L356-E360 WeakPolarHBondContact O-CB 3.28Å; L356-E360 PolarHBondContact O-N 2.98Å; L356-F367 HydrophobicContact CB-CE2 4.12Å; L356-F367 HydrophobicContact CB-CZ 3.94Å; L356-F367 HydrophobicContact CD2-CE2 4.3Å; L356-F367 WeakPolarHBondContact O-CE2 3.32Å; L356-F367 VanDerWaalsContact O-CZ 3.28Å; L356-F367 WeakPolarHBondContact O-CZ 3.49Å
357	E	83.8	Confident	84.6	Confident	90 Å²	90	40.8 Å²	40.8	42%	0.421	23%	0.231	S	C	.	.	H	α-helix	trans	-68.3	-41.5	177.5	-175.3	-177.4	-161.3	0	0	111.1	F160 K167 N355 L359 E360 L361	F160-E357 HydrophobicContact CZ-CB 4.49Å; F160-E357 HydrophobicContact CZ-CG 4.36Å; K167-E357 VanDerWaalsContact CD-OE1 3.28Å; K167-E357 WeakPolarHBondContact CD-OE1 3.46Å; K167-E357 WeakPolarHBondContact CE-OE1 3.16Å; K167-E357 IonicContact NZ-OE1 3.48Å; K167-E357 PolarHBondContact NZ-OE1 3.31Å; K167-E357 IonicContact NZ-OE2 3.19Å; K167-E357 PolarHBondContact NZ-OE2 3.03Å; N355-E357 VanDerWaalsContact C-N 3.27Å; N355-E357 PolarHBondContact O-N 3.24Å; N355-E357 PolarHBondContact OD1-N 2.79Å; E357-L359 VanDerWaalsContact C-N 3.29Å; E357-L359 PolarHBondContact O-N 3.4Å; E357-E360 WeakPolarHBondContact O-CB 3.38Å; E357-E360 PolarHBondContact O-N 3.5Å; E357-L361 PolarHBondContact O-N 3.39Å
358	A	84.8	Confident	84.7	Confident	0 Å²	0	47 Å²	47	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-65.3	-38.8	175.1	0	0	0	0	0	111.1	F157 N158 F160 N355 E360 L361 L362	F157-A358 HydrophobicContact CD2-CB 3.51Å; F157-A358 HydrophobicContact CE2-CB 3.35Å; F157-A358 HydrophobicContact CG-CB 4.5Å; F157-A358 HydrophobicContact CZ-CB 4.25Å; N158-A358 HydrophobicContact CB-CB 4.09Å; F160-A358 HydrophobicContact CE1-CB 3.75Å; F160-A358 HydrophobicContact CZ-CB 3.49Å; F160-A358 VanDerWaalsContact CZ-CB 3.49Å; N355-A358 HydrophobicContact CB-CB 4.06Å; N355-A358 PolarHBondContact O-N 3.19Å; N355-A358 PolarHBondContact OD1-N 3.05Å; A358-E360 VanDerWaalsContact C-N 3.33Å; A358-L361 PolarHBondContact O-N 2.9Å; A358-L362 WeakPolarHBondContact O-CB 3.17Å; A358-L362 PolarHBondContact O-N 3.35Å
359	L	86.8	Confident	84.8	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-68.9	-33.8	178.5	-167.4	65.5	0	0	0	112.1	F157 F284 C353 N355 L356 E357 L361 L362 L363 F367 L370	F157-L359 HydrophobicContact CE2-CB 4.41Å; F284-L359 HydrophobicContact CE2-CD1 4.19Å; F284-L359 HydrophobicContact CZ-CD1 3.77Å; C353-L359 HydrophobicContact CB-CD2 3.75Å; N355-L359 PolarHBondContact O-N 2.89Å; L356-L359 PolarHBondContact O-N 2.84Å; E357-L359 VanDerWaalsContact C-N 3.29Å; E357-L359 PolarHBondContact O-N 3.4Å; L359-L361 VanDerWaalsContact C-N 3.34Å; L359-L362 HydrophobicContact CD1-CD2 4.06Å; L359-L362 PolarHBondContact O-N 2.97Å; L359-L362 VanDerWaalsContact O-N 3.16Å; L359-L363 HydrophobicContact CD1-CD1 3.76Å; L359-L363 HydrophobicContact CD1-CG 3.95Å; L359-L363 HydrophobicContact CD2-CD1 4.32Å; L359-L363 HydrophobicContact CG-CD1 3.83Å; L359-L363 HydrophobicContact CG-CG 4.23Å; L359-L363 PolarHBondContact O-N 2.64Å; L359-F367 HydrophobicContact CB-CD2 4.27Å; L359-F367 HydrophobicContact CB-CE2 4.26Å; L359-F367 HydrophobicContact CD2-CD2 4.39Å; L359-F367 HydrophobicContact CD2-CE2 4.45Å; L359-F367 HydrophobicContact CG-CD2 4.21Å; L359-L370 HydrophobicContact CD2-CD2 3.32Å; L359-L370 HydrophobicContact CG-CD2 4.31Å
360	E	88.3	Confident	84.8	Confident	86 Å²	86	42.7 Å²	42.7	40%	0.402	23%	0.225	S	C	.	.	H	α-helix	trans	-59.1	-46.3	172.7	-177.4	163	-164.5	0	0	111.5	L356 E357 A358 L362 G364 F367	L356-E360 WeakPolarHBondContact O-CB 3.28Å; L356-E360 PolarHBondContact O-N 2.98Å; E357-E360 WeakPolarHBondContact O-CB 3.38Å; E357-E360 PolarHBondContact O-N 3.5Å; A358-E360 VanDerWaalsContact C-N 3.33Å; E360-L362 VanDerWaalsContact C-N 3.3Å; E360-L362 PolarHBondContact O-N 3.31Å; E360-G364 VanDerWaalsContact O-CA 3.28Å; E360-G364 WeakPolarHBondContact O-CA 3.48Å; E360-G364 PolarHBondContact O-N 2.66Å; E360-F367 VanDerWaalsContact CA-CG 3.42Å; E360-F367 HydrophobicContact CB-CB 4.33Å; E360-F367 HydrophobicContact CB-CD1 3.43Å; E360-F367 VanDerWaalsContact CB-CD1 3.43Å; E360-F367 HydrophobicContact CB-CD2 4.06Å; E360-F367 HydrophobicContact CB-CE1 3.58Å; E360-F367 HydrophobicContact CB-CE2 4.21Å; E360-F367 HydrophobicContact CB-CG 3.68Å; E360-F367 HydrophobicContact CB-CZ 3.98Å; E360-F367 HydrophobicContact CG-CB 4.37Å; E360-F367 HydrophobicContact CG-CD1 3.41Å; E360-F367 VanDerWaalsContact CG-CD1 3.41Å; E360-F367 HydrophobicContact CG-CE1 3.79Å; E360-F367 HydrophobicContact CG-CG 3.99Å; E360-F367 WeakPolarHBondContact OE2-CE1 3.47Å
361	L	86.1	Confident	84.8	Confident	75 Å²	75	47.7 Å²	47.7	39%	0.393	25%	0.247	S	C	.	.	H	α-helix	trans	-63.3	-40.8	174.6	-62.5	174.3	0	0	0	110.8	F160 K167 I169 E357 A358 L359	F160-L361 HydrophobicContact CD1-CD1 4.26Å; F160-L361 HydrophobicContact CE1-CD1 3.8Å; K167-L361 HydrophobicContact CB-CD1 3.99Å; K167-L361 WeakPolarHBondContact O-CD1 3.15Å; I169-L361 HydrophobicContact CD1-CB 3.58Å; I169-L361 WeakPolarHBondContact CD1-O 2.9Å; I169-L361 HydrophobicContact CG1-CB 3.47Å; I169-L361 VanDerWaalsContact CG1-CB 3.47Å; I169-L361 HydrophobicContact CG1-CD1 4.32Å; E357-L361 PolarHBondContact O-N 3.39Å; A358-L361 PolarHBondContact O-N 2.9Å; L359-L361 VanDerWaalsContact C-N 3.34Å
362	L	87.8	Confident	85.1	Confident	3 Å²	3	50.1 Å²	50.1	2%	0.016	25%	0.254	C	S	.	.	H	α-helix	trans	-68.2	-41.7	-173.3	-165.2	75.7	0	0	0	113.6	F157 I169 F284 V315 V325 F327 A358 L359 E360	F157-L362 HydrophobicContact CB-CD1 4.38Å; F157-L362 HydrophobicContact CD2-CB 4.42Å; F157-L362 HydrophobicContact CD2-CD2 4.05Å; F157-L362 HydrophobicContact CE2-CD2 4.37Å; F157-L362 HydrophobicContact CG-CD2 4.48Å; I169-L362 HydrophobicContact CD1-CB 3.92Å; I169-L362 HydrophobicContact CD1-CD1 3.89Å; I169-L362 HydrophobicContact CG2-CD1 4.04Å; F284-L362 HydrophobicContact CE2-CD2 3.99Å; F284-L362 HydrophobicContact CZ-CD2 4.37Å; V315-L362 HydrophobicContact CG2-CD2 4.12Å; V325-L362 HydrophobicContact CB-CD1 4.24Å; V325-L362 HydrophobicContact CB-CD2 4.4Å; V325-L362 HydrophobicContact CB-CG 4.4Å; V325-L362 HydrophobicContact CG2-CD1 4.41Å; V325-L362 HydrophobicContact CG2-CD2 3.69Å; V325-L362 HydrophobicContact CG2-CG 4.14Å; F327-L362 HydrophobicContact CE2-CD1 3.98Å; F327-L362 HydrophobicContact CZ-CD1 3.63Å; F327-L362 HydrophobicContact CZ-CG 4.28Å; A358-L362 WeakPolarHBondContact O-CB 3.17Å; A358-L362 PolarHBondContact O-N 3.35Å; L359-L362 HydrophobicContact CD1-CD2 4.06Å; L359-L362 PolarHBondContact O-N 2.97Å; L359-L362 VanDerWaalsContact O-N 3.16Å; E360-L362 VanDerWaalsContact C-N 3.3Å; E360-L362 PolarHBondContact O-N 3.31Å
363	L	87.4	Confident	85.3	Confident	3 Å²	3	47.7 Å²	47.7	2%	0.016	24%	0.237	C	C	.	.	H	α-helix	trans	-99.5	-12	-176.6	-58.2	-178.7	0	0	0	112.7	F284 F334 L350 L359 D365 S366 F367 L370	F284-L363 HydrophobicContact CD2-CD2 4.38Å; F284-L363 HydrophobicContact CE2-CD2 4.29Å; F334-L363 HydrophobicContact CD1-CD2 3.99Å; F334-L363 HydrophobicContact CE1-CD2 4.3Å; F334-L363 HydrophobicContact CG-CD2 4.14Å; L350-L363 HydrophobicContact CD2-CD1 3.71Å; L359-L363 HydrophobicContact CD1-CD1 3.76Å; L359-L363 HydrophobicContact CD1-CG 3.95Å; L359-L363 HydrophobicContact CD2-CD1 4.32Å; L359-L363 HydrophobicContact CG-CD1 3.83Å; L359-L363 HydrophobicContact CG-CG 4.23Å; L359-L363 PolarHBondContact O-N 2.64Å; L363-D365 PolarHBondContact O-N 3.07Å; L363-S366 PolarHBondContact O-N 3.37Å; L363-F367 HydrophobicContact CB-CB 4.35Å; L363-L370 HydrophobicContact CD1-CD2 4.26Å
364	G	85.6	Confident	85.5	Confident	36 Å²	36	47.1 Å²	47.1	37%	0.371	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	55.1	-123.8	-177.2	0	0	0	0	0	111.6	E360 S366 F367	E360-G364 VanDerWaalsContact O-CA 3.28Å; E360-G364 WeakPolarHBondContact O-CA 3.48Å; E360-G364 PolarHBondContact O-N 2.66Å; G364-S366 PolarHBondContact O-N 3.07Å; G364-F367 VanDerWaalsContact O-CB 3.25Å; G364-F367 WeakPolarHBondContact O-CB 3.34Å; G364-F367 PolarHBondContact O-N 3.48Å; G364-F367 VanDerWaalsContact O-N 3.07Å
365	D	83.7	Confident	86	Confident	98 Å²	98	41.9 Å²	41.9	52%	0.524	21%	0.207	S	C	.	.	G	3₁₀ helix	trans	-60.9	-30.3	-177	-74.3	-29.5	0	0	0	113.9	L363 F367 R368 P369 V431	L363-D365 PolarHBondContact O-N 3.07Å; D365-F367 PolarHBondContact O-N 2.82Å; D365-R368 PolarHBondContact O-N 2.74Å; D365-P369 WeakPolarHBondContact O-CD 3.21Å; D365-V431 HydrophobicContact CB-CB 4.45Å; D365-V431 HydrophobicContact CB-CG1 3.8Å; D365-V431 HydrophobicContact CB-CG2 3.77Å
366	S	83.1	Confident	86	Confident	10 Å²	10	40.4 Å²	40.4	7%	0.07	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-69.7	-9	177.9	-70	0	0	0	0	113.8	N335 L363 G364 P369 F428	N335-S366 PolarHBondContact OD1-OG 3.22Å; L363-S366 PolarHBondContact O-N 3.37Å; G364-S366 PolarHBondContact O-N 3.07Å; S366-P369 WeakPolarHBondContact O-CD 3.3Å; S366-F428 PolarHBondContact OG-O 2.64Å
367	F	87.2	Confident	85.8	Confident	2 Å²	2	42.9 Å²	42.9	1%	0.009	21%	0.205	C	C	.	.	H	α-helix	trans	-72.8	-33	174.5	175.3	-104.1	0	0	0	113.5	L356 L359 E360 L363 G364 D365 L370 K371	L356-F367 HydrophobicContact CB-CE2 4.12Å; L356-F367 HydrophobicContact CB-CZ 3.94Å; L356-F367 HydrophobicContact CD2-CE2 4.3Å; L356-F367 WeakPolarHBondContact O-CE2 3.32Å; L356-F367 VanDerWaalsContact O-CZ 3.28Å; L356-F367 WeakPolarHBondContact O-CZ 3.49Å; L359-F367 HydrophobicContact CB-CD2 4.27Å; L359-F367 HydrophobicContact CB-CE2 4.26Å; L359-F367 HydrophobicContact CD2-CD2 4.39Å; L359-F367 HydrophobicContact CD2-CE2 4.45Å; L359-F367 HydrophobicContact CG-CD2 4.21Å; E360-F367 VanDerWaalsContact CA-CG 3.42Å; E360-F367 HydrophobicContact CB-CB 4.33Å; E360-F367 HydrophobicContact CB-CD1 3.43Å; E360-F367 VanDerWaalsContact CB-CD1 3.43Å; E360-F367 HydrophobicContact CB-CD2 4.06Å; E360-F367 HydrophobicContact CB-CE1 3.58Å; E360-F367 HydrophobicContact CB-CE2 4.21Å; E360-F367 HydrophobicContact CB-CG 3.68Å; E360-F367 HydrophobicContact CB-CZ 3.98Å; E360-F367 HydrophobicContact CG-CB 4.37Å; E360-F367 HydrophobicContact CG-CD1 3.41Å; E360-F367 VanDerWaalsContact CG-CD1 3.41Å; E360-F367 HydrophobicContact CG-CE1 3.79Å; E360-F367 HydrophobicContact CG-CG 3.99Å; E360-F367 WeakPolarHBondContact OE2-CE1 3.47Å; L363-F367 HydrophobicContact CB-CB 4.35Å; G364-F367 VanDerWaalsContact O-CB 3.25Å; G364-F367 WeakPolarHBondContact O-CB 3.34Å; G364-F367 PolarHBondContact O-N 3.48Å; G364-F367 VanDerWaalsContact O-N 3.07Å; D365-F367 PolarHBondContact O-N 2.82Å; F367-L370 HydrophobicContact CD2-CD2 4.42Å; F367-L370 WeakPolarHBondContact O-CB 3.2Å; F367-L370 PolarHBondContact O-N 2.94Å; F367-L370 VanDerWaalsContact O-N 3.14Å; F367-K371 HydrophobicContact CE1-CB 4.15Å; F367-K371 HydrophobicContact CE1-CD 3.8Å; F367-K371 HydrophobicContact CE1-CG 4.48Å; F367-K371 HydrophobicContact CZ-CB 4.2Å; F367-K371 HydrophobicContact CZ-CD 4.13Å; F367-K371 HydrophobicContact CZ-CG 4.48Å; F367-K371 PolarHBondContact O-N 2.83Å
368	R	88.9	Confident	85.6	Confident	135 Å²	135	47.2 Å²	47.2	51%	0.509	22%	0.218	S	C	.	.	H	α-helix	trans	-61.9	-46.2	-176.2	-57.1	179.6	178.8	178.4	2.8	112.3	D365 L370 K371 R372 C433	D365-R368 PolarHBondContact O-N 2.74Å; R368-L370 VanDerWaalsContact C-N 3.31Å; R368-L370 PolarHBondContact O-N 3.32Å; R368-K371 PolarHBondContact O-N 2.87Å; R368-R372 PolarHBondContact O-N 3.42Å; R368-C433 VanDerWaalsContact C-SG 3.53Å
369	P	86.4	Confident	85.4	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-58.8	-40.8	172.5	-25.8	36	0	0	0	113.1	D365 S366 R372 L373 V427 D430 Y440	D365-P369 WeakPolarHBondContact O-CD 3.21Å; S366-P369 WeakPolarHBondContact O-CD 3.3Å; P369-R372 WeakPolarHBondContact O-CB 3.42Å; P369-R372 PolarHBondContact O-N 2.81Å; P369-L373 WeakPolarHBondContact O-CB 3.41Å; P369-L373 PolarHBondContact O-N 3.36Å; P369-V427 HydrophobicContact CB-CG1 4.01Å; P369-V427 WeakPolarHBondContact CB-O 3.43Å; P369-V427 VanDerWaalsContact CG-O 3.22Å; P369-V427 WeakPolarHBondContact CG-O 3.48Å; P369-D430 WeakPolarHBondContact CG-O 3.35Å; P369-Y440 HydrophobicContact CB-CE1 4.31Å
370	L	88	Confident	84.8	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-60.7	-46.8	176.7	177.3	62.1	0	0	0	111.5	L350 M351 L359 L363 F367 R368 R372 L373 Q374 F428	L350-L370 HydrophobicContact CB-CD1 3.96Å; L350-L370 HydrophobicContact CB-CD2 4.27Å; L350-L370 HydrophobicContact CD2-CD2 4.21Å; M351-L370 HydrophobicContact CG-CD1 4.34Å; M351-L370 HydrophobicContact SD-CD1 4.02Å; L359-L370 HydrophobicContact CD2-CD2 3.32Å; L359-L370 HydrophobicContact CG-CD2 4.31Å; L363-L370 HydrophobicContact CD1-CD2 4.26Å; F367-L370 HydrophobicContact CD2-CD2 4.42Å; F367-L370 WeakPolarHBondContact O-CB 3.2Å; F367-L370 PolarHBondContact O-N 2.94Å; F367-L370 VanDerWaalsContact O-N 3.14Å; R368-L370 VanDerWaalsContact C-N 3.31Å; R368-L370 PolarHBondContact O-N 3.32Å; L370-R372 VanDerWaalsContact C-N 3.3Å; L370-R372 PolarHBondContact O-N 2.87Å; L370-L373 PolarHBondContact O-N 2.78Å; L370-L373 VanDerWaalsContact O-N 3.16Å; L370-Q374 HydrophobicContact CD1-CG 4.29Å; L370-Q374 WeakPolarHBondContact O-CB 3.22Å; L370-Q374 WeakPolarHBondContact O-CG 3.4Å; L370-Q374 PolarHBondContact O-N 2.9Å; L370-F428 HydrophobicContact CB-CE1 3.9Å; L370-F428 HydrophobicContact CB-CZ 4.23Å; L370-F428 HydrophobicContact CD1-CE1 4.48Å; L370-F428 HydrophobicContact CD1-CZ 4.18Å
371	K	88.3	Confident	83.8	Confident	105 Å²	105	58 Å²	58	46%	0.457	28%	0.276	S	S	.	.	H	α-helix	trans	-61	-38.8	177.2	-172.1	175.5	-174.4	171	0	111.8	F367 R368 T375	F367-K371 HydrophobicContact CE1-CB 4.15Å; F367-K371 HydrophobicContact CE1-CD 3.8Å; F367-K371 HydrophobicContact CE1-CG 4.48Å; F367-K371 HydrophobicContact CZ-CB 4.2Å; F367-K371 HydrophobicContact CZ-CD 4.13Å; F367-K371 HydrophobicContact CZ-CG 4.48Å; F367-K371 PolarHBondContact O-N 2.83Å; R368-K371 PolarHBondContact O-N 2.87Å; K371-T375 VanDerWaalsContact O-CB 3.31Å; K371-T375 WeakPolarHBondContact O-CB 3.34Å; K371-T375 PolarHBondContact O-N 2.81Å; K371-T375 PolarHBondContact O-OG1 2.93Å
372	R	87.9	Confident	82.6	Confident	91 Å²	91	56.5 Å²	56.5	34%	0.343	28%	0.278	S	S	.	.	H	α-helix	trans	-62.6	-48.5	173.1	176.9	61.4	-178.4	-170.7	2.8	110.9	R368 P369 L370 T375 M376 D437 Y440	R368-R372 PolarHBondContact O-N 3.42Å; P369-R372 WeakPolarHBondContact O-CB 3.42Å; P369-R372 PolarHBondContact O-N 2.81Å; L370-R372 VanDerWaalsContact C-N 3.3Å; L370-R372 PolarHBondContact O-N 2.87Å; R372-T375 WeakPolarHBondContact O-CB 3.44Å; R372-T375 PolarHBondContact O-N 3.46Å; R372-T375 VanDerWaalsContact O-N 3.17Å; R372-M376 HydrophobicContact CG-SD 4.32Å; R372-M376 WeakPolarHBondContact O-CG 3.28Å; R372-M376 PolarHBondContact O-N 3.4Å; R372-D437 IonicContact CZ-OD1 2.8Å; R372-D437 IonicContact NE-OD1 3.42Å; R372-D437 IonicContact NH2-OD1 3.32Å; R372-D437 PolarHBondContact NH2-OD1 3.41Å; R372-D437 IonicContact NH2-OD2 2.66Å; R372-D437 PolarHBondContact NH2-OD2 2.83Å; R372-Y440 HydrophobicContact CB-CE1 4.1Å; R372-Y440 HydrophobicContact CG-CD1 4.41Å; R372-Y440 HydrophobicContact CG-CE1 3.89Å; R372-Y440 HydrophobicContact CG-CE2 4.08Å
373	L	85.9	Confident	81.3	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-63.2	-44	-179	-164.6	151	0	0	0	111.3	L347 M351 P369 L370 T375 M376 Y377 V427 Y440 I444	L347-L373 HydrophobicContact CD1-CD1 4.31Å; L347-L373 HydrophobicContact CD1-CD2 4.1Å; L347-L373 HydrophobicContact CD2-CD1 4.42Å; L347-L373 HydrophobicContact CD2-CD2 4.17Å; L347-L373 HydrophobicContact CG-CD2 4.41Å; M351-L373 HydrophobicContact CE-CD2 3.83Å; M351-L373 HydrophobicContact CG-CD2 4.24Å; M351-L373 HydrophobicContact SD-CD2 3.3Å; M351-L373 WeakPolarHBondContact SD-CD2 3.3Å; P369-L373 WeakPolarHBondContact O-CB 3.41Å; P369-L373 PolarHBondContact O-N 3.36Å; L370-L373 PolarHBondContact O-N 2.78Å; L370-L373 VanDerWaalsContact O-N 3.16Å; L373-T375 PolarHBondContact O-N 2.91Å; L373-M376 PolarHBondContact O-N 2.84Å; L373-Y377 WeakPolarHBondContact O-CB 3.49Å; L373-Y377 PolarHBondContact O-N 2.83Å; L373-V427 HydrophobicContact CD1-CG1 4.31Å; L373-Y440 HydrophobicContact CB-CD1 3.95Å; L373-Y440 HydrophobicContact CB-CE1 4.4Å; L373-Y440 HydrophobicContact CD1-CD1 4.02Å; L373-Y440 HydrophobicContact CG-CD1 4.23Å; L373-I444 HydrophobicContact CD1-CD1 4.33Å; L373-I444 HydrophobicContact CD1-CG1 4.32Å; L373-I444 HydrophobicContact CD2-CD1 3.67Å; L373-I444 HydrophobicContact CD2-CG1 4.06Å; L373-I444 HydrophobicContact CG-CD1 3.93Å; L373-I444 HydrophobicContact CG-CG1 4.41Å
374	Q	85.5	Confident	80	Confident	5 Å²	5	62.8 Å²	62.8	2%	0.023	31%	0.306	C	S	.	.	H	α-helix	trans	-58.7	-44.7	170.7	-77.8	-176.7	-10.5	0	0	112.4	M351 L370 Y377 R378	M351-Q374 HydrophobicContact CE-CB 4.48Å; M351-Q374 HydrophobicContact CE-CG 4.04Å; M351-Q374 PolarHBondContact O-NE2 3.33Å; M351-Q374 HydrophobicContact SD-CB 4.14Å; M351-Q374 HydrophobicContact SD-CG 3.27Å; M351-Q374 WeakPolarHBondContact SD-CG 3.48Å; L370-Q374 HydrophobicContact CD1-CG 4.29Å; L370-Q374 WeakPolarHBondContact O-CB 3.22Å; L370-Q374 WeakPolarHBondContact O-CG 3.4Å; L370-Q374 PolarHBondContact O-N 2.9Å; Q374-Y377 PolarHBondContact O-N 2.83Å; Q374-R378 WeakPolarHBondContact O-CB 3.31Å; Q374-R378 WeakPolarHBondContact O-CG 3.47Å; Q374-R378 PolarHBondContact O-N 2.92Å
375	T	85.2	Confident	78.3	Confident	51 Å²	51	63.4 Å²	63.4	31%	0.313	31%	0.312	S	S	.	.	H	α-helix	trans	-64.1	-42.7	178.7	-60.4	0	0	0	0	111.1	K371 R372 L373 K379	K371-T375 VanDerWaalsContact O-CB 3.31Å; K371-T375 WeakPolarHBondContact O-CB 3.34Å; K371-T375 PolarHBondContact O-N 2.81Å; K371-T375 PolarHBondContact O-OG1 2.93Å; R372-T375 WeakPolarHBondContact O-CB 3.44Å; R372-T375 PolarHBondContact O-N 3.46Å; R372-T375 VanDerWaalsContact O-N 3.17Å; L373-T375 PolarHBondContact O-N 2.91Å; T375-K379 HydrophobicContact CG2-CD 3.92Å; T375-K379 HydrophobicContact CG2-CG 4.43Å; T375-K379 WeakPolarHBondContact O-CB 3.27Å; T375-K379 VanDerWaalsContact O-CG 3.23Å; T375-K379 WeakPolarHBondContact O-CG 3.47Å; T375-K379 PolarHBondContact O-N 3.41Å
376	M	83	Confident	76.5	Confident	14 Å²	14	64.3 Å²	64.3	7%	0.069	32%	0.321	C	S	.	.	H	α-helix	trans	-63.1	-46.8	175.7	-74.3	-176.5	65.8	0	0	111.4	R372 L373 R378 K379 N380 F384 D437 Y440	R372-M376 HydrophobicContact CG-SD 4.32Å; R372-M376 WeakPolarHBondContact O-CG 3.28Å; R372-M376 PolarHBondContact O-N 3.4Å; L373-M376 PolarHBondContact O-N 2.84Å; M376-R378 PolarHBondContact O-N 3.17Å; M376-K379 PolarHBondContact O-N 2.95Å; M376-N380 PolarHBondContact O-N 2.8Å; M376-F384 HydrophobicContact CB-CE2 4.5Å; M376-F384 HydrophobicContact CB-CZ 4.17Å; M376-F384 WeakPolarHBondContact O-CE2 3.36Å; M376-D437 HydrophobicContact CE-CB 3.41Å; M376-D437 VanDerWaalsContact CE-CB 3.41Å; M376-D437 VanDerWaalsContact CE-CG 3.43Å; M376-D437 HydrophobicContact SD-CB 4.3Å; M376-Y440 HydrophobicContact SD-CD2 4.16Å; M376-Y440 HydrophobicContact SD-CG 3.94Å
377	Y	77.8	Confident	74.8	Confident	97 Å²	97	66.1 Å²	66.1	38%	0.38	33%	0.328	S	S	.	.	H	α-helix	trans	-56	-48.2	177.1	-173.8	-93.2	0	0	0	112.1	M351 L373 Q374 K379 N380 P381 F384	M351-Y377 HydrophobicContact CE-CD1 3.97Å; M351-Y377 HydrophobicContact CE-CD2 4.17Å; M351-Y377 HydrophobicContact CE-CG 3.62Å; L373-Y377 WeakPolarHBondContact O-CB 3.49Å; L373-Y377 PolarHBondContact O-N 2.83Å; Q374-Y377 PolarHBondContact O-N 2.83Å; Y377-K379 PolarHBondContact O-N 3.43Å; Y377-N380 CarbonylContact O-C 3.52Å; Y377-P381 WeakPolarHBondContact O-CA 3.28Å; Y377-F384 HydrophobicContact CD2-CB 3.75Å; Y377-F384 HydrophobicContact CD2-CD1 4.29Å; Y377-F384 AromaticContact CD2-CD2 3.64Å; Y377-F384 HydrophobicContact CD2-CD2 3.64Å; Y377-F384 HydrophobicContact CD2-CE2 4.38Å; Y377-F384 AromaticContact CD2-CG 3.6Å; Y377-F384 HydrophobicContact CD2-CG 3.6Å; Y377-F384 HydrophobicContact CE2-CB 3.66Å; Y377-F384 HydrophobicContact CE2-CD2 4.34Å; Y377-F384 HydrophobicContact CE2-CG 4.07Å; Y377-F384 HydrophobicContact CG-CD2 4.25Å
378	R	79.8	Confident	72.6	Confident	180 Å²	180	74 Å²	74	68%	0.679	36%	0.364	S	S	*	.	H	α-helix	trans	-66.1	-36.6	177.4	-71.4	177.8	-177.1	176.2	2.7	113.1	Q374 M376	Q374-R378 WeakPolarHBondContact O-CB 3.31Å; Q374-R378 WeakPolarHBondContact O-CG 3.47Å; Q374-R378 PolarHBondContact O-N 2.92Å; M376-R378 PolarHBondContact O-N 3.17Å
379	K	80.9	Confident	70.2	Confident	140 Å²	140	70.9 Å²	70.9	61%	0.609	36%	0.363	S	S	*	.	H	α-helix	trans	-73.4	-33.9	-179.1	-77.7	178.2	179.6	-178.9	0	112.9	T375 M376 Y377	T375-K379 HydrophobicContact CG2-CD 3.92Å; T375-K379 HydrophobicContact CG2-CG 4.43Å; T375-K379 WeakPolarHBondContact O-CB 3.27Å; T375-K379 VanDerWaalsContact O-CG 3.23Å; T375-K379 WeakPolarHBondContact O-CG 3.47Å; T375-K379 PolarHBondContact O-N 3.41Å; M376-K379 PolarHBondContact O-N 2.95Å; Y377-K379 PolarHBondContact O-N 3.43Å
380	N	73.4	Confident	68	Low	93 Å²	93	80.5 Å²	80.5	50%	0.497	40%	0.4	S	S	.	.			trans	-135.9	64.6	-175	-66.4	-62.1	0	0	0	111.5	M376 Y377 G382 F383 F384	M376-N380 PolarHBondContact O-N 2.8Å; Y377-N380 CarbonylContact O-C 3.52Å; N380-G382 PolarHBondContact O-N 3.5Å; N380-G382 VanDerWaalsContact O-N 3.13Å; N380-F383 HydrophobicContact CB-CB 3.95Å; N380-F383 WeakPolarHBondContact O-CB 3.31Å; N380-F383 PolarHBondContact O-N 3.45Å; N380-F384 WeakPolarHBondContact O-CD2 3.04Å; N380-F384 WeakPolarHBondContact O-CE2 3.29Å
381	P	68	Low	65.8	Low	80 Å²	80	84.3 Å²	84.3	52%	0.519	42%	0.415	S	S	.	.	G	3₁₀ helix	trans	-57.2	-34.8	-176.5	22.3	-32.6	0	0	0	111.8	Y377 F383 F384 G385	Y377-P381 WeakPolarHBondContact O-CA 3.28Å; P381-F383 VanDerWaalsContact C-N 3.35Å; P381-F383 PolarHBondContact O-N 2.61Å; P381-F384 CarbonylContact O-C 3.6Å; P381-F384 VanDerWaalsContact O-C 3.26Å; P381-F384 WeakPolarHBondContact O-CA 3.33Å; P381-F384 PolarHBondContact O-N 2.72Å; P381-F384 VanDerWaalsContact O-N 3.09Å; P381-G385 PolarHBondContact O-N 2.93Å
382	G	61.4	Low	63.8	Low	43 Å²	43	85.6 Å²	85.6	44%	0.443	42%	0.422	S	S	.	.	G	3₁₀ helix	trans	-64.8	-30.8	176.5	0	0	0	0	0	114.4	N380 F384 G385 V386	N380-G382 PolarHBondContact O-N 3.5Å; N380-G382 VanDerWaalsContact O-N 3.13Å; G382-F384 PolarHBondContact O-N 2.97Å; G382-G385 PolarHBondContact O-N 2.96Å; G382-V386 WeakPolarHBondContact O-CG2 3.05Å; G382-V386 PolarHBondContact O-N 3.13Å
383	F	60.8	Low	61.8	Low	130 Å²	130	87.6 Å²	87.6	57%	0.57	44%	0.437	S	S	*	.	G	3₁₀ helix	trans	-64.8	-24.4	174.6	-136.2	-94.5	0	0	0	112	N380 P381	N380-F383 HydrophobicContact CB-CB 3.95Å; N380-F383 WeakPolarHBondContact O-CB 3.31Å; N380-F383 PolarHBondContact O-N 3.45Å; P381-F383 VanDerWaalsContact C-N 3.35Å; P381-F383 PolarHBondContact O-N 2.61Å
384	F	60.3	Low	60.1	Low	8 Å²	8	91.8 Å²	91.8	4%	0.035	46%	0.457	C	S	.	.	G	3₁₀ helix	trans	-104.2	-0.8	172.8	-48.1	-77.4	0	0	0	112.2	M376 Y377 N380 P381 G382 C441 I444 R448	M376-F384 HydrophobicContact CB-CE2 4.5Å; M376-F384 HydrophobicContact CB-CZ 4.17Å; M376-F384 WeakPolarHBondContact O-CE2 3.36Å; Y377-F384 HydrophobicContact CD2-CB 3.75Å; Y377-F384 HydrophobicContact CD2-CD1 4.29Å; Y377-F384 AromaticContact CD2-CD2 3.64Å; Y377-F384 HydrophobicContact CD2-CD2 3.64Å; Y377-F384 HydrophobicContact CD2-CE2 4.38Å; Y377-F384 AromaticContact CD2-CG 3.6Å; Y377-F384 HydrophobicContact CD2-CG 3.6Å; Y377-F384 HydrophobicContact CE2-CB 3.66Å; Y377-F384 HydrophobicContact CE2-CD2 4.34Å; Y377-F384 HydrophobicContact CE2-CG 4.07Å; Y377-F384 HydrophobicContact CG-CD2 4.25Å; N380-F384 WeakPolarHBondContact O-CD2 3.04Å; N380-F384 WeakPolarHBondContact O-CE2 3.29Å; P381-F384 CarbonylContact O-C 3.6Å; P381-F384 VanDerWaalsContact O-C 3.26Å; P381-F384 WeakPolarHBondContact O-CA 3.33Å; P381-F384 PolarHBondContact O-N 2.72Å; P381-F384 VanDerWaalsContact O-N 3.09Å; G382-F384 PolarHBondContact O-N 2.97Å; F384-C441 HydrophobicContact CE1-CB 4.46Å; F384-I444 HydrophobicContact CD1-CB 4.22Å; F384-I444 HydrophobicContact CD1-CD1 3.39Å; F384-I444 HydrophobicContact CD1-CG1 4.4Å; F384-I444 HydrophobicContact CD1-CG2 3.99Å; F384-I444 HydrophobicContact CE1-CD1 3.18Å; F384-I444 HydrophobicContact CE1-CG1 4.41Å; F384-I444 HydrophobicContact CG-CD1 4.4Å; F384-I444 HydrophobicContact CZ-CD1 4.07Å; F384-R448 PolarHBondContact O-NH1 2.77Å; F384-R448 PolarHBondContact O-NH2 3.34Å
385	G	48.3	Very low	58.8	Low	49 Å²	49	93.2 Å²	93.2	51%	0.505	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102	-29.4	180	0	0	0	0	0	112.5	P381 G382 F387	P381-G385 PolarHBondContact O-N 2.93Å; G382-G385 PolarHBondContact O-N 2.96Å; G385-F387 PolarHBondContact O-N 3.37Å
386	V	46.8	Very low	57.5	Low	117 Å²	117	98 Å²	98	71%	0.709	48%	0.481	S	S	*	.			trans	-81.7	65.4	-176.3	-175.3	0	0	0	0	110.6	G382	G382-V386 WeakPolarHBondContact O-CG2 3.05Å; G382-V386 PolarHBondContact O-N 3.13Å
387	F	47.3	Very low	56.4	Low	48 Å²	48	102 Å²	102	21%	0.211	51%	0.506	C	S	.	.			trans	-115	11.2	167.9	-116.8	-99	0	0	0	113.4	G385 S389 Y391 K445	G385-F387 PolarHBondContact O-N 3.37Å; F387-S389 PolarHBondContact O-N 2.85Å; F387-Y391 HydrophobicContact CD1-CD2 4.04Å; F387-Y391 HydrophobicContact CD1-CG 4.45Å; F387-Y391 AromaticContact CE1-CD2 3.17Å; F387-Y391 HydrophobicContact CE1-CD2 3.17Å; F387-Y391 AromaticContact CE1-CE2 3.87Å; F387-Y391 HydrophobicContact CE1-CE2 3.87Å; F387-Y391 AromaticContact CE1-CG 3.63Å; F387-Y391 HydrophobicContact CE1-CG 3.63Å; F387-Y391 HydrophobicContact CE2-CD2 4.4Å; F387-Y391 AromaticContact CZ-CD2 3.41Å; F387-Y391 HydrophobicContact CZ-CD2 3.41Å; F387-Y391 VanDerWaalsContact CZ-CD2 3.41Å; F387-Y391 AromaticContact CZ-CE2 3.6Å; F387-Y391 HydrophobicContact CZ-CE2 3.6Å; F387-Y391 HydrophobicContact CZ-CG 4.23Å; F387-K445 HydrophobicContact CD2-CG 4.42Å; F387-K445 HydrophobicContact CE2-CB 4.18Å; F387-K445 HydrophobicContact CE2-CD 3.66Å; F387-K445 HydrophobicContact CE2-CG 3.47Å; F387-K445 VanDerWaalsContact CE2-CG 3.47Å; F387-K445 HydrophobicContact CZ-CB 4.05Å; F387-K445 HydrophobicContact CZ-CD 4.03Å; F387-K445 HydrophobicContact CZ-CG 3.85Å
388	E	41.1	Very low	55.8	Low	167 Å²	167	101 Å²	101	78%	0.78	51%	0.51	S	S	*	.	S	Bend	trans	-68.2	128	164.9	-70.8	-179.8	168.9	0	0	110
389	S	38.8	Very low	55.3	Low	70 Å²	70	92.5 Å²	92.5	49%	0.49	48%	0.478	S	S	.	.	S	Bend	trans	93.6	-27.8	153.6	87.7	0	0	0	0	122.1	F387	F387-S389 PolarHBondContact O-N 2.85Å
390	R	38.9	Very low	54.9	Low	202 Å²	202	87.7 Å²	87.7	76%	0.762	46%	0.457	S	S	*	.	S	Bend	trans	-88	-43.7	175.6	-101.6	-173.2	-177.6	178.7	1.3	113.7	E394	R390-E394 WeakPolarHBondContact O-CB 3.18Å; R390-E394 WeakPolarHBondContact O-CG 3.35Å; R390-E394 PolarHBondContact O-N 3.36Å
391	Y	42.1	Very low	55.1	Low	81 Å²	81	85.5 Å²	85.5	32%	0.318	45%	0.445	S	S	.	.	H	α-helix	trans	-81.7	-28.2	-178.3	-79.8	-78.6	0	0	0	114.1	F387 M393 E394 L395 R449	F387-Y391 HydrophobicContact CD1-CD2 4.04Å; F387-Y391 HydrophobicContact CD1-CG 4.45Å; F387-Y391 AromaticContact CE1-CD2 3.17Å; F387-Y391 HydrophobicContact CE1-CD2 3.17Å; F387-Y391 AromaticContact CE1-CE2 3.87Å; F387-Y391 HydrophobicContact CE1-CE2 3.87Å; F387-Y391 AromaticContact CE1-CG 3.63Å; F387-Y391 HydrophobicContact CE1-CG 3.63Å; F387-Y391 HydrophobicContact CE2-CD2 4.4Å; F387-Y391 AromaticContact CZ-CD2 3.41Å; F387-Y391 HydrophobicContact CZ-CD2 3.41Å; F387-Y391 VanDerWaalsContact CZ-CD2 3.41Å; F387-Y391 AromaticContact CZ-CE2 3.6Å; F387-Y391 HydrophobicContact CZ-CE2 3.6Å; F387-Y391 HydrophobicContact CZ-CG 4.23Å; Y391-M393 VanDerWaalsContact C-N 3.32Å; Y391-E394 WeakPolarHBondContact CD1-OE2 3.34Å; Y391-E394 VanDerWaalsContact CE1-OE2 3.22Å; Y391-E394 WeakPolarHBondContact CE1-OE2 3.1Å; Y391-E394 PolarHBondContact O-N 3.23Å; Y391-L395 WeakPolarHBondContact O-CA 3.49Å; Y391-L395 WeakPolarHBondContact O-CB 3.43Å; Y391-L395 WeakPolarHBondContact O-CD1 3.31Å; Y391-L395 WeakPolarHBondContact O-CG 3.49Å; Y391-L395 PolarHBondContact O-N 3.34Å; Y391-R449 PolarHBondContact OH-NH2 3.29Å
392	E	47.4	Very low	55.7	Low	131 Å²	131	90.7 Å²	90.7	61%	0.612	46%	0.459	S	S	*	.	H	α-helix	trans	-64.5	-38.8	168.3	-83.4	-179.7	131.8	0	0	111.7	K396	E392-K396 WeakPolarHBondContact O-CB 3.29Å; E392-K396 PolarHBondContact O-N 3.44Å
393	M	45.9	Very low	56.3	Low	133 Å²	133	95.1 Å²	95.1	66%	0.655	47%	0.468	S	S	*	.	H	α-helix	trans	-72.5	-39.5	174.6	-78.8	-143.9	-106.1	0	0	112.5	Y391 K396 T397	Y391-M393 VanDerWaalsContact C-N 3.32Å; M393-K396 PolarHBondContact O-N 2.9Å; M393-T397 PolarHBondContact O-N 3.49Å; M393-T397 PolarHBondContact O-OG1 3.01Å
394	E	50.7	Low	56.9	Low	89 Å²	89	91.2 Å²	91.2	42%	0.416	46%	0.464	S	S	.	.	H	α-helix	trans	-66	-42.8	172.5	-79.8	178.4	177	0	0	111.4	R390 Y391 K396 T397 V398	R390-E394 WeakPolarHBondContact O-CB 3.18Å; R390-E394 WeakPolarHBondContact O-CG 3.35Å; R390-E394 PolarHBondContact O-N 3.36Å; Y391-E394 WeakPolarHBondContact CD1-OE2 3.34Å; Y391-E394 VanDerWaalsContact CE1-OE2 3.22Å; Y391-E394 WeakPolarHBondContact CE1-OE2 3.1Å; Y391-E394 PolarHBondContact O-N 3.23Å; E394-K396 VanDerWaalsContact C-N 3.35Å; E394-K396 PolarHBondContact O-N 3.36Å; E394-T397 WeakPolarHBondContact CA-OG1 3.41Å; E394-T397 PolarHBondContact O-N 3.49Å; E394-T397 PolarHBondContact O-OG1 2.95Å; E394-V398 WeakPolarHBondContact O-CB 3.42Å; E394-V398 WeakPolarHBondContact O-CG2 3.23Å; E394-V398 PolarHBondContact O-N 2.7Å
395	L	58	Low	57.4	Low	34 Å²	34	97.4 Å²	97.4	18%	0.178	49%	0.493	C	S	.	.	H	α-helix	trans	-58.1	-48.7	173.1	-80.8	159.3	0	0	0	109.2	Y391 T397 V398 L399 A452 M453	Y391-L395 WeakPolarHBondContact O-CA 3.49Å; Y391-L395 WeakPolarHBondContact O-CB 3.43Å; Y391-L395 WeakPolarHBondContact O-CD1 3.31Å; Y391-L395 WeakPolarHBondContact O-CG 3.49Å; Y391-L395 PolarHBondContact O-N 3.34Å; L395-T397 PolarHBondContact O-N 3.32Å; L395-V398 PolarHBondContact O-N 3.3Å; L395-L399 HydrophobicContact CB-CD1 4.02Å; L395-L399 HydrophobicContact CB-CG 4.46Å; L395-L399 HydrophobicContact CD2-CD1 3.6Å; L395-L399 HydrophobicContact CD2-CG 4.05Å; L395-L399 HydrophobicContact CG-CD1 4.44Å; L395-L399 WeakPolarHBondContact O-CA 3.27Å; L395-L399 WeakPolarHBondContact O-CB 3.3Å; L395-L399 WeakPolarHBondContact O-CG 3.25Å; L395-L399 PolarHBondContact O-N 2.67Å; L395-A452 HydrophobicContact CD1-CB 4.05Å; L395-M453 HydrophobicContact CD2-CE 3.4Å; L395-M453 HydrophobicContact CD2-SD 4.36Å
396	K	56.9	Low	58.6	Low	151 Å²	151	96.9 Å²	96.9	66%	0.657	48%	0.479	S	S	*	.	H	α-helix	trans	-60	-42	176.8	-83.4	-176.9	174.9	176.7	0	113.8	E392 M393 E394 Y400	E392-K396 WeakPolarHBondContact O-CB 3.29Å; E392-K396 PolarHBondContact O-N 3.44Å; M393-K396 PolarHBondContact O-N 2.9Å; E394-K396 VanDerWaalsContact C-N 3.35Å; E394-K396 PolarHBondContact O-N 3.36Å; K396-Y400 WeakPolarHBondContact O-CB 3.26Å; K396-Y400 WeakPolarHBondContact O-CD2 3.33Å; K396-Y400 PolarHBondContact O-N 2.86Å; K396-Y400 VanDerWaalsContact O-N 3.12Å
397	T	59.6	Low	59.9	Low	99 Å²	99	96.9 Å²	96.9	61%	0.607	47%	0.469	S	S	*	.	H	α-helix	trans	-78.4	-31.7	-178	42.9	0	0	0	0	114	M393 E394 L395 K407	M393-T397 PolarHBondContact O-N 3.49Å; M393-T397 PolarHBondContact O-OG1 3.01Å; E394-T397 WeakPolarHBondContact CA-OG1 3.41Å; E394-T397 PolarHBondContact O-N 3.49Å; E394-T397 PolarHBondContact O-OG1 2.95Å; L395-T397 PolarHBondContact O-N 3.32Å; T397-K407 PolarHBondContact O-NZ 2.75Å
398	V	65.7	Low	61.1	Low	75 Å²	75	97.8 Å²	97.8	46%	0.455	47%	0.474	S	S	.	.	H	α-helix	trans	-78.1	-48	176.4	173.7	0	0	0	0	109.8	E394 L395 H408	E394-V398 WeakPolarHBondContact O-CB 3.42Å; E394-V398 WeakPolarHBondContact O-CG2 3.23Å; E394-V398 PolarHBondContact O-N 2.7Å; L395-V398 PolarHBondContact O-N 3.3Å; V398-H408 PolarHBondContact O-CD2 2.97Å; V398-H408 PolarHBondContact O-NE2 3.17Å
399	L	70.2	Confident	62.7	Low	2 Å²	2	93.5 Å²	93.5	1%	0.01	46%	0.456	C	S	.	.	H	α-helix	trans	-71.1	-36.9	-175.3	-65.4	179.9	0	0	0	113.2	L395 L406 K407 H408 L412 M453 C456	L395-L399 HydrophobicContact CB-CD1 4.02Å; L395-L399 HydrophobicContact CB-CG 4.46Å; L395-L399 HydrophobicContact CD2-CD1 3.6Å; L395-L399 HydrophobicContact CD2-CG 4.05Å; L395-L399 HydrophobicContact CG-CD1 4.44Å; L395-L399 WeakPolarHBondContact O-CA 3.27Å; L395-L399 WeakPolarHBondContact O-CB 3.3Å; L395-L399 WeakPolarHBondContact O-CG 3.25Å; L395-L399 PolarHBondContact O-N 2.67Å; L399-L406 HydrophobicContact CB-CD1 3.75Å; L399-L406 HydrophobicContact CD2-CD1 4.5Å; L399-L406 HydrophobicContact CG-CD1 4.5Å; L399-L406 CarbonylContact O-C 3.55Å; L399-L406 VanDerWaalsContact O-CA 3.32Å; L399-L406 WeakPolarHBondContact O-CA 3.37Å; L399-K407 WeakPolarHBondContact O-CB 3.3Å; L399-K407 PolarHBondContact O-N 3.13Å; L399-H408 HydrophobicContact CD2-CB 4.42Å; L399-L412 HydrophobicContact CD2-CD2 3.27Å; L399-M453 HydrophobicContact CD1-CE 4.43Å; L399-M453 HydrophobicContact CD1-SD 4.04Å; L399-M453 HydrophobicContact CD2-CE 3.95Å; L399-M453 HydrophobicContact CD2-SD 3.69Å; L399-M453 HydrophobicContact CG-SD 4.48Å; L399-C456 HydrophobicContact CD1-CB 4.3Å
400	Y	71.6	Confident	64.7	Low	40 Å²	40	90.2 Å²	90.2	16%	0.157	43%	0.433	C	S	.	.	B	Isolated β-bridge	trans	-109.2	142.8	-173.3	-58.8	-93.8	0	0	0	111.6	K396 G404 Q405 L406 K407 C456 E460	K396-Y400 WeakPolarHBondContact O-CB 3.26Å; K396-Y400 WeakPolarHBondContact O-CD2 3.33Å; K396-Y400 PolarHBondContact O-N 2.86Å; K396-Y400 VanDerWaalsContact O-N 3.12Å; Y400-G404 WeakPolarHBondContact CD1-O 3.43Å; Y400-Q405 CarbonylContact C-O 3.57Å; Y400-Q405 VanDerWaalsContact CA-O 3.26Å; Y400-Q405 WeakPolarHBondContact CA-O 3.02Å; Y400-L406 HydrophobicContact CD1-CD1 4.29Å; Y400-L406 HydrophobicContact CE1-CB 4.41Å; Y400-L406 HydrophobicContact CE1-CD1 3.84Å; Y400-L406 HydrophobicContact CE2-CD1 4.16Å; Y400-K407 PolarHBondContact O-NZ 2.85Å; Y400-C456 PolarHBondContact OH-SG 3.42Å; Y400-E460 HydrophobicContact CE1-CG 4.12Å; Y400-E460 VanDerWaalsContact OH-CG 3.26Å; Y400-E460 WeakPolarHBondContact OH-CG 3.33Å; Y400-E460 PolarHBondContact OH-OE1 3.09Å; Y400-E460 VanDerWaalsContact OH-OE1 3.12Å
401	D	76.9	Confident	66.7	Low	47 Å²	47	82.8 Å²	82.8	25%	0.251	42%	0.416	S	S	.	.			trans	-77.5	178.3	172.3	78.7	-0.8	0	0	0	112	H403 G404 Q405 K407	D401-H403 PolarHBondContact O-N 3.47Å; D401-H403 VanDerWaalsContact OD1-C 3.3Å; D401-H403 VanDerWaalsContact OD1-CA 3.23Å; D401-H403 WeakPolarHBondContact OD1-CA 3.49Å; D401-H403 VanDerWaalsContact OD1-CB 3.28Å; D401-H403 WeakPolarHBondContact OD1-CB 3.48Å; D401-H403 PolarHBondContact OD1-N 3.11Å; D401-H403 IonicContact OD2-CD2 3.58Å; D401-G404 PolarHBondContact O-N 2.85Å; D401-G404 PolarHBondContact OD1-N 2.88Å; D401-Q405 PolarHBondContact N-O 3.27Å; D401-Q405 PolarHBondContact OD1-N 3.46Å; D401-K407 VanDerWaalsContact CA-CE 3.44Å; D401-K407 HydrophobicContact CB-CD 4.31Å; D401-K407 HydrophobicContact CB-CG 3.75Å
402	K	80.4	Confident	68.6	Low	188 Å²	188	80.6 Å²	80.6	82%	0.817	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-11.8	178.2	66.3	-176.2	-177.7	-177.9	0	113.4
403	H	75.9	Confident	70.4	Confident	137 Å²	137	74.4 Å²	74.4	63%	0.634	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.2	1.3	177.2	-56.1	-64.1	0	0	0	112.5	D401 Q405	D401-H403 PolarHBondContact O-N 3.47Å; D401-H403 VanDerWaalsContact OD1-C 3.3Å; D401-H403 VanDerWaalsContact OD1-CA 3.23Å; D401-H403 WeakPolarHBondContact OD1-CA 3.49Å; D401-H403 VanDerWaalsContact OD1-CB 3.28Å; D401-H403 WeakPolarHBondContact OD1-CB 3.48Å; D401-H403 PolarHBondContact OD1-N 3.11Å; D401-H403 IonicContact OD2-CD2 3.58Å; H403-Q405 VanDerWaalsContact C-N 3.32Å
404	G	71.9	Confident	72.4	Confident	48 Å²	48	68.1 Å²	68.1	50%	0.495	35%	0.349	S	S	.	.	S	Bend	trans	76.5	17.6	-176.6	0	0	0	0	0	113.5	Y400 D401	Y400-G404 WeakPolarHBondContact CD1-O 3.43Å; D401-G404 PolarHBondContact O-N 2.85Å; D401-G404 PolarHBondContact OD1-N 2.88Å
405	Q	72.2	Confident	74.2	Confident	137 Å²	137	69.1 Å²	69.1	64%	0.64	35%	0.354	S	S	*	.			trans	-93.6	141.5	173.9	-64.6	-151.6	-13.5	0	0	111.6	Y400 D401 H403 K407	Y400-Q405 CarbonylContact C-O 3.57Å; Y400-Q405 VanDerWaalsContact CA-O 3.26Å; Y400-Q405 WeakPolarHBondContact CA-O 3.02Å; D401-Q405 PolarHBondContact N-O 3.27Å; D401-Q405 PolarHBondContact OD1-N 3.46Å; H403-Q405 VanDerWaalsContact C-N 3.32Å; Q405-K407 PolarHBondContact O-N 3.23Å
406	L	72.7	Confident	75.6	Confident	39 Å²	39	68.4 Å²	68.4	20%	0.204	35%	0.351	C	S	.	.	B	Isolated β-bridge	trans	-62.5	117.2	175.9	-160.2	80.5	0	0	0	110.7	L399 Y400 H408 F457 E460 V462	L399-L406 HydrophobicContact CB-CD1 3.75Å; L399-L406 HydrophobicContact CD2-CD1 4.5Å; L399-L406 HydrophobicContact CG-CD1 4.5Å; L399-L406 CarbonylContact O-C 3.55Å; L399-L406 VanDerWaalsContact O-CA 3.32Å; L399-L406 WeakPolarHBondContact O-CA 3.37Å; Y400-L406 HydrophobicContact CD1-CD1 4.29Å; Y400-L406 HydrophobicContact CE1-CB 4.41Å; Y400-L406 HydrophobicContact CE1-CD1 3.84Å; Y400-L406 HydrophobicContact CE2-CD1 4.16Å; L406-H408 VanDerWaalsContact C-N 3.34Å; L406-H408 VanDerWaalsContact CD2-O 3.29Å; L406-H408 WeakPolarHBondContact CD2-O 3.31Å; L406-F457 HydrophobicContact CD2-CD1 4.28Å; L406-F457 HydrophobicContact CD2-CE1 4.07Å; L406-E460 HydrophobicContact CD1-CG 4.34Å; L406-E460 HydrophobicContact CD2-CB 4.33Å; L406-V462 HydrophobicContact CD2-CG2 3.26Å
407	K	74.3	Confident	77.3	Confident	117 Å²	117	61.2 Å²	61.2	51%	0.509	32%	0.32	S	S	.	.			trans	-73.6	-22.1	178.4	-70.5	-172.1	-179	113.7	0	113.9	T397 L399 Y400 D401 Q405	T397-K407 PolarHBondContact O-NZ 2.75Å; L399-K407 WeakPolarHBondContact O-CB 3.3Å; L399-K407 PolarHBondContact O-N 3.13Å; Y400-K407 PolarHBondContact O-NZ 2.85Å; D401-K407 VanDerWaalsContact CA-CE 3.44Å; D401-K407 HydrophobicContact CB-CD 4.31Å; D401-K407 HydrophobicContact CB-CG 3.75Å; Q405-K407 PolarHBondContact O-N 3.23Å
408	H	71.4	Confident	78.8	Confident	67 Å²	67	60.8 Å²	60.8	31%	0.31	31%	0.307	S	S	.	.			trans	-115.4	143.2	-165.2	-67.7	-65.7	0	0	0	111.6	V398 L399 L406 L412	V398-H408 PolarHBondContact O-CD2 2.97Å; V398-H408 PolarHBondContact O-NE2 3.17Å; L399-H408 HydrophobicContact CD2-CB 4.42Å; L406-H408 VanDerWaalsContact C-N 3.34Å; L406-H408 VanDerWaalsContact CD2-O 3.29Å; L406-H408 WeakPolarHBondContact CD2-O 3.31Å; H408-L412 HydrophobicContact CB-CB 3.96Å; H408-L412 HydrophobicContact CB-CD2 3.67Å; H408-L412 HydrophobicContact CB-CG 4.48Å
409	N	76.1	Confident	80.1	Confident	76 Å²	76	61.5 Å²	61.5	41%	0.406	30%	0.302	S	S	.	.			trans	-100.7	-171.1	173.6	68.5	-20	0	0	0	111.1	A411 L412 F457 D466	N409-A411 PolarHBondContact O-N 3.29Å; N409-A411 VanDerWaalsContact OD1-CB 3.26Å; N409-A411 WeakPolarHBondContact OD1-CB 3.41Å; N409-A411 PolarHBondContact OD1-N 2.81Å; N409-L412 PolarHBondContact O-N 3.4Å; N409-L412 VanDerWaalsContact O-N 3.08Å; N409-F457 WeakPolarHBondContact O-CE2 3.48Å; N409-F457 WeakPolarHBondContact O-CZ 3.24Å; N409-D466 PolarHBondContact ND2-OD2 3.01Å
410	S	79.5	Confident	81.1	Confident	1 Å²	1	61.4 Å²	61.4	1%	0.007	30%	0.302	C	S	.	.	H	α-helix	trans	-48.5	-26	176.6	66.2	0	0	0	0	114.6	L412 L413 V414 D466	S410-L412 PolarHBondContact O-N 3.3Å; S410-L413 WeakPolarHBondContact O-CB 3.4Å; S410-L413 PolarHBondContact O-N 3.35Å; S410-V414 PolarHBondContact O-N 3.17Å; S410-D466 WeakPolarHBondContact CB-OD1 3.47Å; S410-D466 VanDerWaalsContact OG-CG 3.24Å; S410-D466 PolarHBondContact OG-OD1 2.85Å; S410-D466 PolarHBondContact OG-OD2 2.7Å
411	A	82.3	Confident	82.2	Confident	47 Å²	47	60.4 Å²	60.4	39%	0.388	30%	0.299	S	S	.	.	H	α-helix	trans	-59.5	-33.2	178.7	0	0	0	0	0	113.2	N409 V414 H415	N409-A411 PolarHBondContact O-N 3.29Å; N409-A411 VanDerWaalsContact OD1-CB 3.26Å; N409-A411 WeakPolarHBondContact OD1-CB 3.41Å; N409-A411 PolarHBondContact OD1-N 2.81Å; A411-V414 PolarHBondContact O-N 2.93Å; A411-H415 WeakPolarHBondContact O-CB 3.45Å; A411-H415 PolarHBondContact O-N 2.91Å
412	L	81.8	Confident	83	Confident	34 Å²	34	66.2 Å²	66.2	18%	0.178	32%	0.317	C	S	.	.	H	α-helix	trans	-69.2	-41.3	175.5	179.3	60.4	0	0	0	111.3	L399 H408 N409 S410 V414 H415 C416 M453 F457	L399-L412 HydrophobicContact CD2-CD2 3.27Å; H408-L412 HydrophobicContact CB-CB 3.96Å; H408-L412 HydrophobicContact CB-CD2 3.67Å; H408-L412 HydrophobicContact CB-CG 4.48Å; N409-L412 PolarHBondContact O-N 3.4Å; N409-L412 VanDerWaalsContact O-N 3.08Å; S410-L412 PolarHBondContact O-N 3.3Å; L412-V414 VanDerWaalsContact C-N 3.32Å; L412-V414 PolarHBondContact O-N 2.94Å; L412-H415 WeakPolarHBondContact O-CB 3.35Å; L412-H415 PolarHBondContact O-N 3.17Å; L412-H415 VanDerWaalsContact O-N 3.12Å; L412-C416 PolarHBondContact O-N 3.46Å; L412-C416 PolarHBondContact O-SG 3.09Å; L412-M453 HydrophobicContact CD1-CE 4.48Å; L412-M453 HydrophobicContact CD2-CE 3.56Å; L412-M453 HydrophobicContact CD2-SD 3.75Å; L412-M453 HydrophobicContact CG-CE 3.82Å; L412-M453 HydrophobicContact CG-SD 4.09Å; L412-F457 HydrophobicContact CB-CZ 4.39Å
413	L	84	Confident	83.6	Confident	1 Å²	1	58 Å²	58	1%	0.005	28%	0.283	C	S	.	.	H	α-helix	trans	-58.3	-46.4	173.8	175.4	64.3	0	0	0	110.8	F288 L292 S410 H415 C416 A417 L450 M453 C454 F457 L464	F288-L413 HydrophobicContact CD1-CD1 4.18Å; F288-L413 HydrophobicContact CD1-CD2 4.25Å; F288-L413 HydrophobicContact CD1-CG 3.98Å; L292-L413 HydrophobicContact CD2-CD2 3.66Å; S410-L413 WeakPolarHBondContact O-CB 3.4Å; S410-L413 PolarHBondContact O-N 3.35Å; L413-H415 VanDerWaalsContact C-N 3.3Å; L413-H415 PolarHBondContact O-N 3.19Å; L413-C416 PolarHBondContact O-N 3.12Å; L413-A417 PolarHBondContact O-N 3.33Å; L413-L450 HydrophobicContact CD1-CD1 3.55Å; L413-M453 HydrophobicContact CD1-CB 4.47Å; L413-M453 HydrophobicContact CD1-CG 4.28Å; L413-C454 WeakPolarHBondContact CD1-SG 3.36Å; L413-F457 HydrophobicContact CB-CD2 4.33Å; L413-F457 HydrophobicContact CB-CE2 3.95Å; L413-L464 HydrophobicContact CD2-CD2 3.75Å
414	V	88.1	Confident	84.4	Confident	2 Å²	2	51.4 Å²	51.4	1%	0.012	25%	0.253	C	S	.	.	H	α-helix	trans	-61.1	-39.1	175.5	174.2	0	0	0	0	111.5	L342 S410 A411 L412 R418 D467 L470	L342-V414 HydrophobicContact CD1-CG1 4.07Å; L342-V414 HydrophobicContact CD2-CG1 4.02Å; S410-V414 PolarHBondContact O-N 3.17Å; A411-V414 PolarHBondContact O-N 2.93Å; L412-V414 VanDerWaalsContact C-N 3.32Å; L412-V414 PolarHBondContact O-N 2.94Å; V414-R418 VanDerWaalsContact O-CB 3.27Å; V414-R418 WeakPolarHBondContact O-CB 3.45Å; V414-R418 PolarHBondContact O-N 3.01Å; V414-D467 HydrophobicContact CG2-CB 4.26Å; V414-L470 HydrophobicContact CG2-CD1 3.75Å; V414-L470 HydrophobicContact CG2-CD2 3.91Å; V414-L470 HydrophobicContact CG2-CG 3.79Å
415	H	88.5	Confident	85.4	Confident	109 Å²	109	49.6 Å²	49.6	51%	0.505	23%	0.233	S	C	.	.	H	α-helix	trans	-62.8	-47.5	175.4	-174.2	86.9	0	0	0	111.9	A411 L412 L413 A417 R418 Y419	A411-H415 WeakPolarHBondContact O-CB 3.45Å; A411-H415 PolarHBondContact O-N 2.91Å; L412-H415 WeakPolarHBondContact O-CB 3.35Å; L412-H415 PolarHBondContact O-N 3.17Å; L412-H415 VanDerWaalsContact O-N 3.12Å; L413-H415 VanDerWaalsContact C-N 3.3Å; L413-H415 PolarHBondContact O-N 3.19Å; H415-A417 PolarHBondContact O-N 2.97Å; H415-R418 PolarHBondContact O-N 3.33Å; H415-Y419 WeakPolarHBondContact O-CB 3.24Å; H415-Y419 PolarHBondContact O-N 3.29Å
416	C	88.1	Confident	86.3	Confident	19 Å²	19	50.8 Å²	50.8	13%	0.128	23%	0.231	C	C	.	.	H	α-helix	trans	-59.3	-46.5	176.7	-71.7	0	0	0	0	111.7	L412 L413 R418 Y419 F420 L450	L412-C416 PolarHBondContact O-N 3.46Å; L412-C416 PolarHBondContact O-SG 3.09Å; L413-C416 PolarHBondContact O-N 3.12Å; C416-R418 PolarHBondContact O-N 2.95Å; C416-Y419 PolarHBondContact O-N 2.77Å; C416-F420 WeakPolarHBondContact O-CB 3.14Å; C416-F420 PolarHBondContact O-N 3.33Å; C416-L450 HydrophobicContact CB-CD1 4.24Å
417	A	91.4	Very high	87.2	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-64.8	-38.8	177.5	0	0	0	0	0	112.5	F288 L342 V344 L413 H415 Y419 F420 H421 L450	F288-A417 HydrophobicContact CD1-CB 3.74Å; F288-A417 HydrophobicContact CE1-CB 3.07Å; F288-A417 HydrophobicContact CZ-CB 3.72Å; L342-A417 HydrophobicContact CD2-CB 4.42Å; V344-A417 HydrophobicContact CG2-CB 4.4Å; L413-A417 PolarHBondContact O-N 3.33Å; H415-A417 PolarHBondContact O-N 2.97Å; A417-Y419 VanDerWaalsContact C-N 3.33Å; A417-Y419 PolarHBondContact O-N 3.15Å; A417-F420 PolarHBondContact O-N 3.13Å; A417-H421 WeakPolarHBondContact O-CB 3.38Å; A417-H421 PolarHBondContact O-N 3.21Å; A417-L450 HydrophobicContact CB-CD1 3.98Å; A417-L450 HydrophobicContact CB-CD2 4.29Å
418	R	92.5	Very high	88.1	Confident	91 Å²	91	43.3 Å²	43.3	34%	0.343	20%	0.198	S	C	.	.	H	α-helix	trans	-63.8	-40.7	174.9	-167.4	177.8	-67.9	124.6	-2.3	111.7	L342 V414 H415 C416 R422	L342-R418 HydrophobicContact CD2-CB 3.6Å; L342-R418 HydrophobicContact CD2-CG 4.18Å; V414-R418 VanDerWaalsContact O-CB 3.27Å; V414-R418 WeakPolarHBondContact O-CB 3.45Å; V414-R418 PolarHBondContact O-N 3.01Å; H415-R418 PolarHBondContact O-N 3.33Å; C416-R418 PolarHBondContact O-N 2.95Å; R418-R422 WeakPolarHBondContact O-CG 3.3Å; R418-R422 PolarHBondContact O-N 3.34Å; R418-R422 VanDerWaalsContact O-N 3.1Å
419	Y	91.8	Very high	88.9	Confident	89 Å²	89	43.7 Å²	43.7	35%	0.349	20%	0.2	S	C	.	.	H	α-helix	trans	-65.7	-48.5	177	-174	-96.9	0	0	0	111	H415 C416 A417 R422 C423 E442	H415-Y419 WeakPolarHBondContact O-CB 3.24Å; H415-Y419 PolarHBondContact O-N 3.29Å; C416-Y419 PolarHBondContact O-N 2.77Å; A417-Y419 VanDerWaalsContact C-N 3.33Å; A417-Y419 PolarHBondContact O-N 3.15Å; Y419-R422 PolarHBondContact O-N 3.39Å; Y419-C423 PolarHBondContact O-N 3.4Å; Y419-E442 HydrophobicContact CE1-CG 4.03Å; Y419-E442 WeakPolarHBondContact CE1-OE1 3.4Å; Y419-E442 VanDerWaalsContact OH-CG 3.26Å; Y419-E442 WeakPolarHBondContact OH-CG 3.43Å; Y419-E442 PolarHBondContact OH-OE1 2.92Å; Y419-E442 VanDerWaalsContact OH-OE1 3.13Å
420	F	92.3	Very high	89.5	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-55.4	-53.7	174.3	168.9	-115	0	0	0	111.8	V344 F345 C416 A417 R422 C423 F424 E447 L450	V344-F420 HydrophobicContact CB-CE1 4.44Å; V344-F420 HydrophobicContact CG1-CD1 4.19Å; V344-F420 HydrophobicContact CG1-CE1 3.84Å; F345-F420 HydrophobicContact CB-CZ 4.5Å; C416-F420 WeakPolarHBondContact O-CB 3.14Å; C416-F420 PolarHBondContact O-N 3.33Å; A417-F420 PolarHBondContact O-N 3.13Å; F420-R422 VanDerWaalsContact C-N 3.27Å; F420-R422 PolarHBondContact O-N 3.21Å; F420-C423 PolarHBondContact O-N 3.18Å; F420-F424 HydrophobicContact CE2-CB 4.11Å; F420-F424 AromaticContact CE2-CD2 3.84Å; F420-F424 HydrophobicContact CE2-CD2 3.84Å; F420-F424 HydrophobicContact CE2-CG 4.4Å; F420-F424 HydrophobicContact CZ-CB 4.2Å; F420-F424 AromaticContact CZ-CD2 3.63Å; F420-F424 HydrophobicContact CZ-CD2 3.63Å; F420-F424 HydrophobicContact CZ-CE2 4.39Å; F420-F424 HydrophobicContact CZ-CG 4.19Å; F420-F424 WeakPolarHBondContact O-CB 3.4Å; F420-F424 PolarHBondContact O-N 3.1Å; F420-E447 HydrophobicContact CD2-CB 3.84Å; F420-E447 HydrophobicContact CE2-CB 3.53Å; F420-E447 HydrophobicContact CE2-CG 4.02Å; F420-E447 HydrophobicContact CZ-CB 4.21Å; F420-E447 HydrophobicContact CZ-CG 4.18Å; F420-L450 HydrophobicContact CD1-CD2 4.02Å; F420-L450 HydrophobicContact CG-CD2 4.47Å
421	H	94.7	Very high	89.7	Confident	20 Å²	20	43.5 Å²	43.5	9%	0.093	20%	0.201	C	C	.	.	H	α-helix	trans	-54.2	-43.8	178.9	176.8	-90.6	0	0	0	112	L338 V340 A343 A417 F424 A425	L338-H421 PolarHBondContact O-CE1 3.37Å; L338-H421 PolarHBondContact O-NE2 3.21Å; V340-H421 PolarHBondContact O-CD2 3.36Å; V340-H421 PolarHBondContact O-NE2 3.33Å; A343-H421 PolarHBondContact O-CD2 3.05Å; A343-H421 VanDerWaalsContact O-CD2 3.32Å; A417-H421 WeakPolarHBondContact O-CB 3.38Å; A417-H421 PolarHBondContact O-N 3.21Å; H421-F424 PolarHBondContact O-N 3.18Å; H421-A425 WeakPolarHBondContact O-CB 3.36Å; H421-A425 PolarHBondContact O-N 3.25Å
422	R	93.8	Very high	89.9	Confident	169 Å²	169	44.3 Å²	44.3	64%	0.638	20%	0.204	S	C	*	.	H	α-helix	trans	-62.2	-44.5	177.4	-77.4	176.8	-179.1	-179.4	1	112.2	R418 Y419 F420 R426	R418-R422 WeakPolarHBondContact O-CG 3.3Å; R418-R422 PolarHBondContact O-N 3.34Å; R418-R422 VanDerWaalsContact O-N 3.1Å; Y419-R422 PolarHBondContact O-N 3.39Å; F420-R422 VanDerWaalsContact C-N 3.27Å; F420-R422 PolarHBondContact O-N 3.21Å; R422-R426 WeakPolarHBondContact O-CB 3.34Å; R422-R426 PolarHBondContact O-N 3.31Å; R422-R426 VanDerWaalsContact O-N 3.12Å
423	C	91.7	Very high	89.9	Confident	14 Å²	14	44.5 Å²	44.5	10%	0.095	21%	0.208	C	C	.	.	H	α-helix	trans	-65.5	-45.8	177	-71	0	0	0	0	111.2	Y419 F420 R426 V427 C443	Y419-C423 PolarHBondContact O-N 3.4Å; F420-C423 PolarHBondContact O-N 3.18Å; C423-R426 PolarHBondContact O-N 3.31Å; C423-V427 WeakPolarHBondContact O-CG2 3.29Å; C423-V427 PolarHBondContact O-N 2.9Å; C423-C443 HydrophobicContact CB-CB 4.3Å
424	F	94	Very high	90	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-61.4	-54.9	179.9	-168.4	-79.4	0	0	0	111.9	F334 L338 F345 L347 L350 F420 H421 R426 V427 F428	F334-F424 HydrophobicContact CZ-CE1 4.17Å; F334-F424 HydrophobicContact CZ-CZ 4.34Å; L338-F424 HydrophobicContact CD2-CD1 3.85Å; L338-F424 HydrophobicContact CD2-CE1 3.68Å; F345-F424 HydrophobicContact CB-CD1 4.11Å; F345-F424 HydrophobicContact CB-CD2 4Å; F345-F424 HydrophobicContact CB-CE1 3.66Å; F345-F424 HydrophobicContact CB-CE2 3.52Å; F345-F424 HydrophobicContact CB-CG 4.28Å; F345-F424 HydrophobicContact CB-CZ 3.34Å; F345-F424 AromaticContact CD1-CE1 3.95Å; F345-F424 HydrophobicContact CD1-CE1 3.95Å; F345-F424 HydrophobicContact CD1-CZ 4.25Å; F345-F424 AromaticContact CD2-CD1 3.35Å; F345-F424 HydrophobicContact CD2-CD1 3.35Å; F345-F424 HydrophobicContact CD2-CD2 4.46Å; F345-F424 AromaticContact CD2-CE1 3.5Å; F345-F424 HydrophobicContact CD2-CE1 3.5Å; F345-F424 AromaticContact CD2-CG 3.89Å; F345-F424 HydrophobicContact CD2-CG 3.89Å; F345-F424 HydrophobicContact CD2-CZ 4.13Å; F345-F424 HydrophobicContact CE1-CE1 4.5Å; F345-F424 AromaticContact CE2-CD1 3.9Å; F345-F424 HydrophobicContact CE2-CD1 3.9Å; F345-F424 HydrophobicContact CE2-CE1 4.12Å; F345-F424 AromaticContact CG-CD1 3.78Å; F345-F424 HydrophobicContact CG-CD1 3.78Å; F345-F424 AromaticContact CG-CE1 3.4Å; F345-F424 HydrophobicContact CG-CE1 3.4Å; F345-F424 VanDerWaalsContact CG-CE1 3.4Å; F345-F424 HydrophobicContact CG-CE2 4.22Å; F345-F424 HydrophobicContact CG-CG 4.34Å; F345-F424 AromaticContact CG-CZ 3.66Å; F345-F424 HydrophobicContact CG-CZ 3.66Å; L347-F424 HydrophobicContact CB-CE2 4.48Å; L347-F424 HydrophobicContact CD1-CE2 3.99Å; L350-F424 HydrophobicContact CD1-CE2 4.32Å; L350-F424 HydrophobicContact CD1-CZ 3.8Å; F420-F424 HydrophobicContact CE2-CB 4.11Å; F420-F424 AromaticContact CE2-CD2 3.84Å; F420-F424 HydrophobicContact CE2-CD2 3.84Å; F420-F424 HydrophobicContact CE2-CG 4.4Å; F420-F424 HydrophobicContact CZ-CB 4.2Å; F420-F424 AromaticContact CZ-CD2 3.63Å; F420-F424 HydrophobicContact CZ-CD2 3.63Å; F420-F424 HydrophobicContact CZ-CE2 4.39Å; F420-F424 HydrophobicContact CZ-CG 4.19Å; F420-F424 WeakPolarHBondContact O-CB 3.4Å; F420-F424 PolarHBondContact O-N 3.1Å; H421-F424 PolarHBondContact O-N 3.18Å; F424-R426 VanDerWaalsContact C-N 3.28Å; F424-R426 PolarHBondContact O-N 3.28Å; F424-V427 PolarHBondContact O-N 2.92Å; F424-V427 VanDerWaalsContact O-N 3.11Å; F424-F428 HydrophobicContact CD1-CB 4.33Å; F424-F428 AromaticContact CD1-CD2 3.76Å; F424-F428 HydrophobicContact CD1-CD2 3.76Å; F424-F428 HydrophobicContact CD1-CE2 4.37Å; F424-F428 HydrophobicContact CD1-CG 4.17Å; F424-F428 HydrophobicContact CD2-CD2 4.09Å; F424-F428 AromaticContact CD2-CE2 3.95Å; F424-F428 HydrophobicContact CD2-CE2 3.95Å; F424-F428 HydrophobicContact CE1-CB 4.07Å; F424-F428 HydrophobicContact CE1-CD1 4.16Å; F424-F428 AromaticContact CE1-CD2 3.46Å; F424-F428 HydrophobicContact CE1-CD2 3.46Å; F424-F428 VanDerWaalsContact CE1-CD2 3.46Å; F424-F428 HydrophobicContact CE1-CE1 4.49Å; F424-F428 AromaticContact CE1-CE2 3.87Å; F424-F428 HydrophobicContact CE1-CE2 3.87Å; F424-F428 AromaticContact CE1-CG 3.63Å; F424-F428 HydrophobicContact CE1-CG 3.63Å; F424-F428 HydrophobicContact CE1-CZ 4.37Å; F424-F428 AromaticContact CE2-CD2 3.83Å; F424-F428 HydrophobicContact CE2-CD2 3.83Å; F424-F428 AromaticContact CE2-CE2 3.42Å; F424-F428 HydrophobicContact CE2-CE2 3.42Å; F424-F428 VanDerWaalsContact CE2-CE2 3.42Å; F424-F428 AromaticContact CE2-CZ 3.95Å; F424-F428 HydrophobicContact CE2-CZ 3.95Å; F424-F428 HydrophobicContact CG-CD2 4.06Å; F424-F428 HydrophobicContact CG-CE2 4.4Å; F424-F428 HydrophobicContact CZ-CD1 4.17Å; F424-F428 AromaticContact CZ-CD2 3.5Å; F424-F428 HydrophobicContact CZ-CD2 3.5Å; F424-F428 VanDerWaalsContact CZ-CD2 3.5Å; F424-F428 HydrophobicContact CZ-CE1 4.04Å; F424-F428 AromaticContact CZ-CE2 3.36Å; F424-F428 HydrophobicContact CZ-CE2 3.36Å; F424-F428 AromaticContact CZ-CG 3.91Å; F424-F428 HydrophobicContact CZ-CG 3.91Å; F424-F428 AromaticContact CZ-CZ 3.65Å; F424-F428 HydrophobicContact CZ-CZ 3.65Å; F424-F428 PolarHBondContact O-N 3.02Å
425	A	92.8	Very high	89.9	Confident	10 Å²	10	54 Å²	54	8%	0.083	25%	0.253	C	S	.	.	H	α-helix	trans	-56.8	-43.1	178.5	0	0	0	0	0	111.4	L338 H421 V427 F428 M429	L338-A425 WeakPolarHBondContact O-CB 3.48Å; H421-A425 WeakPolarHBondContact O-CB 3.36Å; H421-A425 PolarHBondContact O-N 3.25Å; A425-V427 VanDerWaalsContact C-N 3.35Å; A425-V427 PolarHBondContact O-N 3.4Å; A425-F428 PolarHBondContact O-N 2.9Å; A425-M429 HydrophobicContact CB-CE 4.04Å; A425-M429 VanDerWaalsContact O-CB 3.23Å; A425-M429 WeakPolarHBondContact O-CB 3.24Å; A425-M429 WeakPolarHBondContact O-CG 3.32Å; A425-M429 PolarHBondContact O-N 3.06Å
426	R	91.4	Very high	89.7	Confident	161 Å²	161	53.3 Å²	53.3	61%	0.608	25%	0.253	S	S	*	.	H	α-helix	trans	-62.8	-40.9	178.2	-168.4	170.8	-174.1	173	1.7	112.3	R422 C423 F424 D430 L435 L439	R422-R426 WeakPolarHBondContact O-CB 3.34Å; R422-R426 PolarHBondContact O-N 3.31Å; R422-R426 VanDerWaalsContact O-N 3.12Å; C423-R426 PolarHBondContact O-N 3.31Å; F424-R426 VanDerWaalsContact C-N 3.28Å; F424-R426 PolarHBondContact O-N 3.28Å; R426-D430 PolarHBondContact O-N 3.32Å; R426-L435 HydrophobicContact CG-CD1 4.43Å; R426-L435 WeakPolarHBondContact O-CD1 2.93Å; R426-L439 HydrophobicContact CB-CD2 4.3Å; R426-L439 HydrophobicContact CG-CD2 3.99Å
427	V	91.5	Very high	89.5	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-66.6	-52.1	175.3	168	0	0	0	0	111.3	P369 L373 C423 F424 A425 M429 D430 L435 L439 Y440 C443	P369-V427 HydrophobicContact CB-CG1 4.01Å; P369-V427 WeakPolarHBondContact CB-O 3.43Å; P369-V427 VanDerWaalsContact CG-O 3.22Å; P369-V427 WeakPolarHBondContact CG-O 3.48Å; L373-V427 HydrophobicContact CD1-CG1 4.31Å; C423-V427 WeakPolarHBondContact O-CG2 3.29Å; C423-V427 PolarHBondContact O-N 2.9Å; F424-V427 PolarHBondContact O-N 2.92Å; F424-V427 VanDerWaalsContact O-N 3.11Å; A425-V427 VanDerWaalsContact C-N 3.35Å; A425-V427 PolarHBondContact O-N 3.4Å; V427-M429 VanDerWaalsContact C-N 3.33Å; V427-M429 PolarHBondContact O-N 2.88Å; V427-D430 PolarHBondContact O-N 3.49Å; V427-D430 VanDerWaalsContact O-N 3.14Å; V427-L435 HydrophobicContact CG2-CD1 4.34Å; V427-L439 HydrophobicContact CG2-CD2 3.84Å; V427-Y440 HydrophobicContact CG1-CD1 3.65Å; V427-Y440 HydrophobicContact CG1-CE1 3.46Å; V427-Y440 VanDerWaalsContact CG1-CE1 3.46Å; V427-Y440 HydrophobicContact CG2-CD1 4.4Å; V427-C443 HydrophobicContact CG2-CB 3.95Å
428	F	91.4	Very high	89.2	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-78.1	-14.1	-171.3	-83.6	-100.7	0	0	0	114.5	F334 L338 L347 L350 S366 L370 F424 A425	F334-F428 HydrophobicContact CZ-CD1 4.39Å; L338-F428 HydrophobicContact CD1-CB 4.37Å; L338-F428 HydrophobicContact CD2-CB 4.05Å; L347-F428 HydrophobicContact CD1-CE2 4.01Å; L347-F428 HydrophobicContact CD1-CZ 3.89Å; L350-F428 HydrophobicContact CD1-CE1 4.12Å; L350-F428 HydrophobicContact CD1-CZ 4.05Å; S366-F428 PolarHBondContact OG-O 2.64Å; L370-F428 HydrophobicContact CB-CE1 3.9Å; L370-F428 HydrophobicContact CB-CZ 4.23Å; L370-F428 HydrophobicContact CD1-CE1 4.48Å; L370-F428 HydrophobicContact CD1-CZ 4.18Å; F424-F428 HydrophobicContact CD1-CB 4.33Å; F424-F428 AromaticContact CD1-CD2 3.76Å; F424-F428 HydrophobicContact CD1-CD2 3.76Å; F424-F428 HydrophobicContact CD1-CE2 4.37Å; F424-F428 HydrophobicContact CD1-CG 4.17Å; F424-F428 HydrophobicContact CD2-CD2 4.09Å; F424-F428 AromaticContact CD2-CE2 3.95Å; F424-F428 HydrophobicContact CD2-CE2 3.95Å; F424-F428 HydrophobicContact CE1-CB 4.07Å; F424-F428 HydrophobicContact CE1-CD1 4.16Å; F424-F428 AromaticContact CE1-CD2 3.46Å; F424-F428 HydrophobicContact CE1-CD2 3.46Å; F424-F428 VanDerWaalsContact CE1-CD2 3.46Å; F424-F428 HydrophobicContact CE1-CE1 4.49Å; F424-F428 AromaticContact CE1-CE2 3.87Å; F424-F428 HydrophobicContact CE1-CE2 3.87Å; F424-F428 AromaticContact CE1-CG 3.63Å; F424-F428 HydrophobicContact CE1-CG 3.63Å; F424-F428 HydrophobicContact CE1-CZ 4.37Å; F424-F428 AromaticContact CE2-CD2 3.83Å; F424-F428 HydrophobicContact CE2-CD2 3.83Å; F424-F428 AromaticContact CE2-CE2 3.42Å; F424-F428 HydrophobicContact CE2-CE2 3.42Å; F424-F428 VanDerWaalsContact CE2-CE2 3.42Å; F424-F428 AromaticContact CE2-CZ 3.95Å; F424-F428 HydrophobicContact CE2-CZ 3.95Å; F424-F428 HydrophobicContact CG-CD2 4.06Å; F424-F428 HydrophobicContact CG-CE2 4.4Å; F424-F428 HydrophobicContact CZ-CD1 4.17Å; F424-F428 AromaticContact CZ-CD2 3.5Å; F424-F428 HydrophobicContact CZ-CD2 3.5Å; F424-F428 VanDerWaalsContact CZ-CD2 3.5Å; F424-F428 HydrophobicContact CZ-CE1 4.04Å; F424-F428 AromaticContact CZ-CE2 3.36Å; F424-F428 HydrophobicContact CZ-CE2 3.36Å; F424-F428 AromaticContact CZ-CG 3.91Å; F424-F428 HydrophobicContact CZ-CG 3.91Å; F424-F428 AromaticContact CZ-CZ 3.65Å; F424-F428 HydrophobicContact CZ-CZ 3.65Å; F424-F428 PolarHBondContact O-N 3.02Å; A425-F428 PolarHBondContact O-N 2.9Å
429	M	89.8	Confident	88.8	Confident	74 Å²	74	59.9 Å²	59.9	37%	0.365	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-9.8	167.7	-65.4	-179.4	-166.1	0	0	113.3	L338 H339 A425 V427 V431	L338-M429 HydrophobicContact CB-CE 3.43Å; L338-M429 VanDerWaalsContact CB-CE 3.43Å; L338-M429 HydrophobicContact CD1-CG 4.35Å; L338-M429 WeakPolarHBondContact O-CE 3.42Å; H339-M429 WeakPolarHBondContact CE1-CE 3.29Å; H339-M429 VanDerWaalsContact ND1-CE 3.31Å; H339-M429 WeakPolarHBondContact ND1-CE 3.28Å; A425-M429 HydrophobicContact CB-CE 4.04Å; A425-M429 VanDerWaalsContact O-CB 3.23Å; A425-M429 WeakPolarHBondContact O-CB 3.24Å; A425-M429 WeakPolarHBondContact O-CG 3.32Å; A425-M429 PolarHBondContact O-N 3.06Å; V427-M429 VanDerWaalsContact C-N 3.33Å; V427-M429 PolarHBondContact O-N 2.88Å; M429-V431 VanDerWaalsContact C-N 3.33Å; M429-V431 PolarHBondContact O-N 2.96Å
430	D	88.6	Confident	88.5	Confident	25 Å²	25	55.7 Å²	55.7	13%	0.134	27%	0.272	C	S	.	.			trans	-81.5	76.6	177.5	-179.9	29.2	0	0	0	112.1	P369 R426 V427 S432 C433 Q434 L435	P369-D430 WeakPolarHBondContact CG-O 3.35Å; R426-D430 PolarHBondContact O-N 3.32Å; V427-D430 PolarHBondContact O-N 3.49Å; V427-D430 VanDerWaalsContact O-N 3.14Å; D430-S432 PolarHBondContact O-N 3.06Å; D430-S432 VanDerWaalsContact O-N 3.09Å; D430-S432 WeakPolarHBondContact OD1-CB 3.48Å; D430-S432 PolarHBondContact OD1-N 3.33Å; D430-S432 PolarHBondContact OD1-OG 3.39Å; D430-C433 PolarHBondContact O-N 2.67Å; D430-C433 PolarHBondContact OD1-N 3.42Å; D430-C433 WeakPolarHBondContact OD2-CA 3.27Å; D430-C433 PolarHBondContact OD2-N 3.18Å; D430-Q434 PolarHBondContact OD2-N 3.32Å; D430-L435 HydrophobicContact CB-CD1 3.48Å; D430-L435 VanDerWaalsContact CB-CD1 3.48Å; D430-L435 HydrophobicContact CB-CG 3.9Å; D430-L435 VanDerWaalsContact OD2-CG 3.23Å; D430-L435 WeakPolarHBondContact OD2-CG 3.25Å; D430-L435 PolarHBondContact OD2-N 2.96Å
431	V	83.2	Confident	88	Confident	48 Å²	48	56 Å²	56	29%	0.291	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-22.4	177.2	-166.7	0	0	0	0	112.3	D365 M429 C433	D365-V431 HydrophobicContact CB-CB 4.45Å; D365-V431 HydrophobicContact CB-CG1 3.8Å; D365-V431 HydrophobicContact CB-CG2 3.77Å; M429-V431 VanDerWaalsContact C-N 3.33Å; M429-V431 PolarHBondContact O-N 2.96Å; V431-C433 VanDerWaalsContact C-N 3.31Å
432	S	86.6	Confident	87.6	Confident	65 Å²	65	56.7 Å²	56.7	46%	0.455	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-21.1	177.6	82.2	0	0	0	0	113.1	D430 Q434	D430-S432 PolarHBondContact O-N 3.06Å; D430-S432 VanDerWaalsContact O-N 3.09Å; D430-S432 WeakPolarHBondContact OD1-CB 3.48Å; D430-S432 PolarHBondContact OD1-N 3.33Å; D430-S432 PolarHBondContact OD1-OG 3.39Å; S432-Q434 PolarHBondContact O-N 3Å; S432-Q434 WeakPolarHBondContact OG-CB 3.42Å; S432-Q434 WeakPolarHBondContact OG-CG 3.36Å; S432-Q434 PolarHBondContact OG-N 2.92Å
433	C	82.2	Confident	87.3	Confident	38 Å²	38	48.6 Å²	48.6	26%	0.257	25%	0.247	S	C	.	.			trans	52.6	37.1	-174.8	-61.8	0	0	0	0	112.9	R368 D430 V431	R368-C433 VanDerWaalsContact C-SG 3.53Å; D430-C433 PolarHBondContact O-N 2.67Å; D430-C433 PolarHBondContact OD1-N 3.42Å; D430-C433 WeakPolarHBondContact OD2-CA 3.27Å; D430-C433 PolarHBondContact OD2-N 3.18Å; V431-C433 VanDerWaalsContact C-N 3.31Å
434	Q	86.2	Confident	86.9	Confident	165 Å²	165	48.4 Å²	48.4	77%	0.771	25%	0.245	S	C	*	.			trans	-100	-2.8	-179.5	-65.8	-177.2	4.2	0	0	112.8	D430 S432	D430-Q434 PolarHBondContact OD2-N 3.32Å; S432-Q434 PolarHBondContact O-N 3Å; S432-Q434 WeakPolarHBondContact OG-CB 3.42Å; S432-Q434 WeakPolarHBondContact OG-CG 3.36Å; S432-Q434 PolarHBondContact OG-N 2.92Å
435	L	84.5	Confident	86.3	Confident	37 Å²	37	51.1 Å²	51.1	19%	0.194	26%	0.257	C	S	.	.	S	Bend	trans	-57.3	145	172.2	-73	170.3	0	0	0	111.9	R426 V427 D430 L439 Y440	R426-L435 HydrophobicContact CG-CD1 4.43Å; R426-L435 WeakPolarHBondContact O-CD1 2.93Å; V427-L435 HydrophobicContact CG2-CD1 4.34Å; D430-L435 HydrophobicContact CB-CD1 3.48Å; D430-L435 VanDerWaalsContact CB-CD1 3.48Å; D430-L435 HydrophobicContact CB-CG 3.9Å; D430-L435 VanDerWaalsContact OD2-CG 3.23Å; D430-L435 WeakPolarHBondContact OD2-CG 3.25Å; D430-L435 PolarHBondContact OD2-N 2.96Å; L435-L439 HydrophobicContact CD1-CD2 3.69Å; L435-L439 HydrophobicContact CD2-CD2 4.01Å; L435-L439 HydrophobicContact CG-CD2 4.29Å; L435-Y440 HydrophobicContact CB-CD2 4.35Å; L435-Y440 HydrophobicContact CB-CE2 3.78Å
436	N	85.3	Confident	86	Confident	94 Å²	94	50.7 Å²	50.7	50%	0.503	25%	0.253	S	S	.	.			trans	-59.1	140.3	174	-177.1	0.3	0	0	0	110.2	E438 L439	N436-E438 PolarHBondContact ND2-OE2 2.88Å; N436-E438 VanDerWaalsContact ND2-OE2 3.1Å; N436-E438 PolarHBondContact O-N 3.13Å; N436-E438 VanDerWaalsContact O-N 3.11Å; N436-E438 PolarHBondContact OD1-N 2.91Å; N436-L439 WeakPolarHBondContact O-CB 3.31Å; N436-L439 PolarHBondContact O-N 3.27Å
437	D	84.2	Confident	85.8	Confident	68 Å²	68	43.7 Å²	43.7	36%	0.364	23%	0.227	S	C	.	.	H	α-helix	trans	-50.4	-33.2	173.2	-79	0.4	0	0	0	112.2	R372 M376 L439 Y440 C441	R372-D437 IonicContact CZ-OD1 2.8Å; R372-D437 IonicContact NE-OD1 3.42Å; R372-D437 IonicContact NH2-OD1 3.32Å; R372-D437 PolarHBondContact NH2-OD1 3.41Å; R372-D437 IonicContact NH2-OD2 2.66Å; R372-D437 PolarHBondContact NH2-OD2 2.83Å; M376-D437 HydrophobicContact CE-CB 3.41Å; M376-D437 VanDerWaalsContact CE-CB 3.41Å; M376-D437 VanDerWaalsContact CE-CG 3.43Å; M376-D437 HydrophobicContact SD-CB 4.3Å; D437-L439 VanDerWaalsContact C-N 3.27Å; D437-L439 PolarHBondContact O-N 3.25Å; D437-Y440 PolarHBondContact O-N 3.4Å; D437-C441 PolarHBondContact O-N 2.94Å; D437-C441 PolarHBondContact O-SG 2.83Å
438	E	84.1	Confident	85.3	Confident	140 Å²	140	47.6 Å²	47.6	65%	0.654	24%	0.242	S	C	*	.	H	α-helix	trans	-58.4	-35.9	173.4	-70.2	-179.2	161.5	0	0	113.1	N436 C441 E442	N436-E438 PolarHBondContact ND2-OE2 2.88Å; N436-E438 VanDerWaalsContact ND2-OE2 3.1Å; N436-E438 PolarHBondContact O-N 3.13Å; N436-E438 VanDerWaalsContact O-N 3.11Å; N436-E438 PolarHBondContact OD1-N 2.91Å; E438-C441 WeakPolarHBondContact O-CB 3.31Å; E438-C441 PolarHBondContact O-N 3.43Å; E438-E442 WeakPolarHBondContact O-CB 3.48Å; E438-E442 PolarHBondContact O-N 2.9Å
439	L	84.9	Confident	84.7	Confident	40 Å²	40	50 Å²	50	21%	0.209	25%	0.251	C	S	.	.	H	α-helix	trans	-75	-37.5	-178.2	-153.6	117.2	0	0	0	111.8	R426 V427 L435 N436 D437 C441 E442 C443	R426-L439 HydrophobicContact CB-CD2 4.3Å; R426-L439 HydrophobicContact CG-CD2 3.99Å; V427-L439 HydrophobicContact CG2-CD2 3.84Å; L435-L439 HydrophobicContact CD1-CD2 3.69Å; L435-L439 HydrophobicContact CD2-CD2 4.01Å; L435-L439 HydrophobicContact CG-CD2 4.29Å; N436-L439 WeakPolarHBondContact O-CB 3.31Å; N436-L439 PolarHBondContact O-N 3.27Å; D437-L439 VanDerWaalsContact C-N 3.27Å; D437-L439 PolarHBondContact O-N 3.25Å; L439-C441 VanDerWaalsContact C-N 3.31Å; L439-E442 PolarHBondContact O-N 2.6Å; L439-C443 PolarHBondContact O-N 3.26Å
440	Y	84.6	Confident	84.5	Confident	1 Å²	1	46.5 Å²	46.5	0%	0.004	23%	0.234	C	C	.	.	H	α-helix	trans	-60.5	-43.3	169.3	-76	-87.8	0	0	0	111	P369 R372 L373 M376 V427 L435 D437 C443 I444	P369-Y440 HydrophobicContact CB-CE1 4.31Å; R372-Y440 HydrophobicContact CB-CE1 4.1Å; R372-Y440 HydrophobicContact CG-CD1 4.41Å; R372-Y440 HydrophobicContact CG-CE1 3.89Å; R372-Y440 HydrophobicContact CG-CE2 4.08Å; L373-Y440 HydrophobicContact CB-CD1 3.95Å; L373-Y440 HydrophobicContact CB-CE1 4.4Å; L373-Y440 HydrophobicContact CD1-CD1 4.02Å; L373-Y440 HydrophobicContact CG-CD1 4.23Å; M376-Y440 HydrophobicContact SD-CD2 4.16Å; M376-Y440 HydrophobicContact SD-CG 3.94Å; V427-Y440 HydrophobicContact CG1-CD1 3.65Å; V427-Y440 HydrophobicContact CG1-CE1 3.46Å; V427-Y440 VanDerWaalsContact CG1-CE1 3.46Å; V427-Y440 HydrophobicContact CG2-CD1 4.4Å; L435-Y440 HydrophobicContact CB-CD2 4.35Å; L435-Y440 HydrophobicContact CB-CE2 3.78Å; D437-Y440 PolarHBondContact O-N 3.4Å; Y440-C443 WeakPolarHBondContact O-CB 3.43Å; Y440-C443 PolarHBondContact O-N 3.24Å; Y440-I444 PolarHBondContact O-N 3.37Å
441	C	82.3	Confident	84.2	Confident	6 Å²	6	47.8 Å²	47.8	4%	0.041	24%	0.242	C	C	.	.	H	α-helix	trans	-62.6	-43.3	175	-65	0	0	0	0	111.4	F384 D437 E438 L439 C443 I444 K445	F384-C441 HydrophobicContact CE1-CB 4.46Å; D437-C441 PolarHBondContact O-N 2.94Å; D437-C441 PolarHBondContact O-SG 2.83Å; E438-C441 WeakPolarHBondContact O-CB 3.31Å; E438-C441 PolarHBondContact O-N 3.43Å; L439-C441 VanDerWaalsContact C-N 3.31Å; C441-C443 VanDerWaalsContact C-N 3.29Å; C441-C443 PolarHBondContact O-N 3.06Å; C441-I444 PolarHBondContact O-N 3.19Å; C441-K445 VanDerWaalsContact O-CG 3.27Å; C441-K445 WeakPolarHBondContact O-CG 3.4Å; C441-K445 PolarHBondContact O-N 3.38Å
442	E	85.5	Confident	84	Confident	35 Å²	35	47 Å²	47	16%	0.164	24%	0.241	C	C	.	.	H	α-helix	trans	-65.7	-31.9	179.9	-164.7	58.2	-155.1	0	0	112.7	Y419 E438 L439 K445 S446 R449	Y419-E442 HydrophobicContact CE1-CG 4.03Å; Y419-E442 WeakPolarHBondContact CE1-OE1 3.4Å; Y419-E442 VanDerWaalsContact OH-CG 3.26Å; Y419-E442 WeakPolarHBondContact OH-CG 3.43Å; Y419-E442 PolarHBondContact OH-OE1 2.92Å; Y419-E442 VanDerWaalsContact OH-OE1 3.13Å; E438-E442 WeakPolarHBondContact O-CB 3.48Å; E438-E442 PolarHBondContact O-N 2.9Å; L439-E442 PolarHBondContact O-N 2.6Å; E442-K445 PolarHBondContact O-N 3.13Å; E442-S446 VanDerWaalsContact O-CB 3.25Å; E442-S446 WeakPolarHBondContact O-CB 3.48Å; E442-S446 PolarHBondContact O-N 2.89Å; E442-S446 PolarHBondContact O-OG 3.48Å; E442-R449 IonicContact OE1-CZ 3.32Å; E442-R449 VanDerWaalsContact OE1-CZ 3.32Å; E442-R449 IonicContact OE1-NH1 2.66Å; E442-R449 PolarHBondContact OE1-NH1 3.09Å; E442-R449 IonicContact OE1-NH2 3.11Å; E442-R449 PolarHBondContact OE1-NH2 2.69Å; E442-R449 VanDerWaalsContact OE1-NH2 3.11Å; E442-R449 IonicContact OE2-NH2 3.81Å
443	C	87.9	Confident	83.8	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-57.6	-51.4	170.1	-176.2	0	0	0	0	111.4	C423 V427 L439 Y440 C441 K445 S446 E447	C423-C443 HydrophobicContact CB-CB 4.3Å; V427-C443 HydrophobicContact CG2-CB 3.95Å; L439-C443 PolarHBondContact O-N 3.26Å; Y440-C443 WeakPolarHBondContact O-CB 3.43Å; Y440-C443 PolarHBondContact O-N 3.24Å; C441-C443 VanDerWaalsContact C-N 3.29Å; C441-C443 PolarHBondContact O-N 3.06Å; C443-K445 PolarHBondContact O-N 3.37Å; C443-S446 PolarHBondContact O-N 3.44Å; C443-S446 PolarHBondContact O-OG 2.71Å; C443-E447 PolarHBondContact O-N 3.01Å; C443-E447 VanDerWaalsContact O-N 3.14Å
444	I	84.2	Confident	83.7	Confident	9 Å²	9	42.6 Å²	42.6	5%	0.046	21%	0.21	C	C	.	.	H	α-helix	trans	-64.9	-42.5	177.9	-67.1	159.4	0	0	0	111.5	L347 L373 F384 Y440 C441 S446 E447 R448	L347-I444 HydrophobicContact CD2-CB 4.47Å; L347-I444 HydrophobicContact CD2-CG1 3.58Å; L373-I444 HydrophobicContact CD1-CD1 4.33Å; L373-I444 HydrophobicContact CD1-CG1 4.32Å; L373-I444 HydrophobicContact CD2-CD1 3.67Å; L373-I444 HydrophobicContact CD2-CG1 4.06Å; L373-I444 HydrophobicContact CG-CD1 3.93Å; L373-I444 HydrophobicContact CG-CG1 4.41Å; F384-I444 HydrophobicContact CD1-CB 4.22Å; F384-I444 HydrophobicContact CD1-CD1 3.39Å; F384-I444 HydrophobicContact CD1-CG1 4.4Å; F384-I444 HydrophobicContact CD1-CG2 3.99Å; F384-I444 HydrophobicContact CE1-CD1 3.18Å; F384-I444 HydrophobicContact CE1-CG1 4.41Å; F384-I444 HydrophobicContact CG-CD1 4.4Å; F384-I444 HydrophobicContact CZ-CD1 4.07Å; Y440-I444 PolarHBondContact O-N 3.37Å; C441-I444 PolarHBondContact O-N 3.19Å; I444-S446 VanDerWaalsContact C-N 3.34Å; I444-S446 PolarHBondContact O-N 3.2Å; I444-E447 PolarHBondContact O-N 2.95Å; I444-R448 PolarHBondContact O-N 3.49Å
445	K	80.7	Confident	83.4	Confident	57 Å²	57	40 Å²	40	25%	0.248	20%	0.198	C	C	.	.	H	α-helix	trans	-62.5	-42.5	179	-69	178.9	-176.6	177.8	0	111.6	F387 C441 E442 C443 R448 R449	F387-K445 HydrophobicContact CD2-CG 4.42Å; F387-K445 HydrophobicContact CE2-CB 4.18Å; F387-K445 HydrophobicContact CE2-CD 3.66Å; F387-K445 HydrophobicContact CE2-CG 3.47Å; F387-K445 VanDerWaalsContact CE2-CG 3.47Å; F387-K445 HydrophobicContact CZ-CB 4.05Å; F387-K445 HydrophobicContact CZ-CD 4.03Å; F387-K445 HydrophobicContact CZ-CG 3.85Å; C441-K445 VanDerWaalsContact O-CG 3.27Å; C441-K445 WeakPolarHBondContact O-CG 3.4Å; C441-K445 PolarHBondContact O-N 3.38Å; E442-K445 PolarHBondContact O-N 3.13Å; C443-K445 PolarHBondContact O-N 3.37Å; K445-R448 PolarHBondContact O-N 3.24Å; K445-R449 WeakPolarHBondContact O-CG 3.39Å; K445-R449 PolarHBondContact O-N 2.94Å
446	S	86.8	Confident	83	Confident	2 Å²	2	38.9 Å²	38.9	1%	0.014	19%	0.193	C	C	.	.	H	α-helix	trans	-67.9	-35.3	-179.9	55.8	0	0	0	0	113	E442 C443 I444 R449 L450	E442-S446 VanDerWaalsContact O-CB 3.25Å; E442-S446 WeakPolarHBondContact O-CB 3.48Å; E442-S446 PolarHBondContact O-N 2.89Å; E442-S446 PolarHBondContact O-OG 3.48Å; C443-S446 PolarHBondContact O-N 3.44Å; C443-S446 PolarHBondContact O-OG 2.71Å; I444-S446 VanDerWaalsContact C-N 3.34Å; I444-S446 PolarHBondContact O-N 3.2Å; S446-R449 PolarHBondContact O-N 2.77Å; S446-L450 PolarHBondContact O-N 2.86Å
447	E	87	Confident	82.7	Confident	14 Å²	14	34.6 Å²	34.6	7%	0.065	17%	0.17	C	C	.	.	H	α-helix	trans	-58.1	-49	170.7	-172.9	-171.9	-154.9	0	0	111	L347 F420 C443 I444 R449 L450 V451	L347-E447 VanDerWaalsContact CB-OE1 3.3Å; L347-E447 WeakPolarHBondContact CB-OE1 3.36Å; L347-E447 WeakPolarHBondContact CB-OE2 3.21Å; L347-E447 PolarHBondContact N-OE1 2.89Å; L347-E447 VanDerWaalsContact N-OE1 3.16Å; F420-E447 HydrophobicContact CD2-CB 3.84Å; F420-E447 HydrophobicContact CE2-CB 3.53Å; F420-E447 HydrophobicContact CE2-CG 4.02Å; F420-E447 HydrophobicContact CZ-CB 4.21Å; F420-E447 HydrophobicContact CZ-CG 4.18Å; C443-E447 PolarHBondContact O-N 3.01Å; C443-E447 VanDerWaalsContact O-N 3.14Å; I444-E447 PolarHBondContact O-N 2.95Å; E447-R449 PolarHBondContact O-N 3.37Å; E447-L450 WeakPolarHBondContact O-CB 3.49Å; E447-L450 PolarHBondContact O-N 3.14Å; E447-L450 VanDerWaalsContact O-N 3.13Å; E447-V451 WeakPolarHBondContact O-CG2 2.95Å; E447-V451 PolarHBondContact O-N 2.9Å
448	R	80.6	Confident	82.3	Confident	82 Å²	82	33.7 Å²	33.7	31%	0.309	17%	0.167	S	C	.	.	H	α-helix	trans	-65.5	-38.3	-179.5	-68.4	179.7	178.5	-174.5	2.5	113.1	F384 I444 K445 L450 V451 A452	F384-R448 PolarHBondContact O-NH1 2.77Å; F384-R448 PolarHBondContact O-NH2 3.34Å; I444-R448 PolarHBondContact O-N 3.49Å; K445-R448 PolarHBondContact O-N 3.24Å; R448-L450 VanDerWaalsContact C-N 3.26Å; R448-L450 PolarHBondContact O-N 2.97Å; R448-V451 PolarHBondContact O-N 3.25Å; R448-A452 WeakPolarHBondContact O-CB 3.46Å; R448-A452 PolarHBondContact O-N 3.29Å
449	R	80.5	Confident	82	Confident	50 Å²	50	33.9 Å²	33.9	19%	0.189	17%	0.168	C	C	.	.	H	α-helix	trans	-60.1	-40.1	172.7	-72.4	-177.8	-163.6	135.4	6.7	111.2	Y391 E442 K445 S446 E447 M453	Y391-R449 PolarHBondContact OH-NH2 3.29Å; E442-R449 IonicContact OE1-CZ 3.32Å; E442-R449 VanDerWaalsContact OE1-CZ 3.32Å; E442-R449 IonicContact OE1-NH1 2.66Å; E442-R449 PolarHBondContact OE1-NH1 3.09Å; E442-R449 IonicContact OE1-NH2 3.11Å; E442-R449 PolarHBondContact OE1-NH2 2.69Å; E442-R449 VanDerWaalsContact OE1-NH2 3.11Å; E442-R449 IonicContact OE2-NH2 3.81Å; K445-R449 WeakPolarHBondContact O-CG 3.39Å; K445-R449 PolarHBondContact O-N 2.94Å; S446-R449 PolarHBondContact O-N 2.77Å; E447-R449 PolarHBondContact O-N 3.37Å; R449-M453 WeakPolarHBondContact O-CB 3.47Å; R449-M453 PolarHBondContact O-N 2.72Å
450	L	85.3	Confident	81.6	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-64.1	-45.8	175.5	176.4	62.3	0	0	0	111.2	F288 V344 L413 C416 A417 F420 S446 E447 R448 M453 C454	F288-L450 HydrophobicContact CD1-CD1 4.36Å; V344-L450 HydrophobicContact CB-CD2 4.41Å; V344-L450 HydrophobicContact CG1-CD2 3.61Å; V344-L450 HydrophobicContact CG2-CD2 3.83Å; L413-L450 HydrophobicContact CD1-CD1 3.55Å; C416-L450 HydrophobicContact CB-CD1 4.24Å; A417-L450 HydrophobicContact CB-CD1 3.98Å; A417-L450 HydrophobicContact CB-CD2 4.29Å; F420-L450 HydrophobicContact CD1-CD2 4.02Å; F420-L450 HydrophobicContact CG-CD2 4.47Å; S446-L450 PolarHBondContact O-N 2.86Å; E447-L450 WeakPolarHBondContact O-CB 3.49Å; E447-L450 PolarHBondContact O-N 3.14Å; E447-L450 VanDerWaalsContact O-N 3.13Å; R448-L450 VanDerWaalsContact C-N 3.26Å; R448-L450 PolarHBondContact O-N 2.97Å; L450-M453 PolarHBondContact O-N 3.33Å; L450-C454 PolarHBondContact O-N 3.39Å; L450-C454 PolarHBondContact O-SG 2.91Å
451	V	82.6	Confident	81.3	Confident	52 Å²	52	44 Å²	44	32%	0.315	21%	0.214	S	C	.	.	H	α-helix	trans	-58.6	-51.2	176.7	174.3	0	0	0	0	111.3	E447 R448 M453 C454 E455	E447-V451 WeakPolarHBondContact O-CG2 2.95Å; E447-V451 PolarHBondContact O-N 2.9Å; R448-V451 PolarHBondContact O-N 3.25Å; V451-M453 VanDerWaalsContact C-N 3.28Å; V451-M453 PolarHBondContact O-N 2.91Å; V451-C454 WeakPolarHBondContact O-CB 3.39Å; V451-C454 PolarHBondContact O-N 3.15Å; V451-C454 VanDerWaalsContact O-N 3.13Å; V451-E455 WeakPolarHBondContact O-CG 3.41Å; V451-E455 PolarHBondContact O-N 2.83Å
452	A	78.9	Confident	80.8	Confident	31 Å²	31	45.2 Å²	45.2	26%	0.256	22%	0.221	S	C	.	.	H	α-helix	trans	-61.4	-35.6	179	0	0	0	0	0	112.7	L395 R448 C456	L395-A452 HydrophobicContact CD1-CB 4.05Å; R448-A452 WeakPolarHBondContact O-CB 3.46Å; R448-A452 PolarHBondContact O-N 3.29Å; A452-C456 WeakPolarHBondContact O-CB 3.29Å; A452-C456 PolarHBondContact O-N 3.37Å
453	M	81.3	Confident	80.2	Confident	7 Å²	7	46.6 Å²	46.6	3%	0.034	24%	0.238	C	C	.	.	H	α-helix	trans	-66.5	-43	175.5	-166.1	64	65	0	0	111.7	L395 L399 L412 L413 R449 L450 V451 C456 F457	L395-M453 HydrophobicContact CD2-CE 3.4Å; L395-M453 HydrophobicContact CD2-SD 4.36Å; L399-M453 HydrophobicContact CD1-CE 4.43Å; L399-M453 HydrophobicContact CD1-SD 4.04Å; L399-M453 HydrophobicContact CD2-CE 3.95Å; L399-M453 HydrophobicContact CD2-SD 3.69Å; L399-M453 HydrophobicContact CG-SD 4.48Å; L412-M453 HydrophobicContact CD1-CE 4.48Å; L412-M453 HydrophobicContact CD2-CE 3.56Å; L412-M453 HydrophobicContact CD2-SD 3.75Å; L412-M453 HydrophobicContact CG-CE 3.82Å; L412-M453 HydrophobicContact CG-SD 4.09Å; L413-M453 HydrophobicContact CD1-CB 4.47Å; L413-M453 HydrophobicContact CD1-CG 4.28Å; R449-M453 WeakPolarHBondContact O-CB 3.47Å; R449-M453 PolarHBondContact O-N 2.72Å; L450-M453 PolarHBondContact O-N 3.33Å; V451-M453 VanDerWaalsContact C-N 3.28Å; V451-M453 PolarHBondContact O-N 2.91Å; M453-C456 PolarHBondContact O-N 2.91Å; M453-F457 HydrophobicContact CG-CD1 4.24Å; M453-F457 HydrophobicContact CG-CE1 3.97Å; M453-F457 HydrophobicContact CG-CZ 4.36Å; M453-F457 VanDerWaalsContact O-CD1 3.25Å; M453-F457 WeakPolarHBondContact O-CD1 3.39Å; M453-F457 PolarHBondContact O-N 3.11Å; M453-F457 HydrophobicContact SD-CD1 4.04Å; M453-F457 HydrophobicContact SD-CE1 3.44Å; M453-F457 WeakPolarHBondContact SD-CE1 3.47Å; M453-F457 HydrophobicContact SD-CZ 4.1Å
454	C	81.1	Confident	79.5	Confident	5 Å²	5	48.2 Å²	48.2	3%	0.034	25%	0.247	C	C	.	.	H	α-helix	trans	-60.3	-47.9	175.3	-71.3	0	0	0	0	111.5	F288 Y289 L413 L450 V451 C456 F457 V458	F288-C454 PolarHBondContact O-SG 3.42Å; Y289-C454 HydrophobicContact CD2-CB 4.16Å; Y289-C454 HydrophobicContact CG-CB 4.35Å; L413-C454 WeakPolarHBondContact CD1-SG 3.36Å; L450-C454 PolarHBondContact O-N 3.39Å; L450-C454 PolarHBondContact O-SG 2.91Å; V451-C454 WeakPolarHBondContact O-CB 3.39Å; V451-C454 PolarHBondContact O-N 3.15Å; V451-C454 VanDerWaalsContact O-N 3.13Å; C454-C456 PolarHBondContact O-N 3.08Å; C454-F457 PolarHBondContact O-N 3.48Å; C454-V458 WeakPolarHBondContact O-CG2 3.45Å; C454-V458 PolarHBondContact O-N 3.42Å; C454-V458 VanDerWaalsContact O-N 3.14Å
455	E	78.5	Confident	78.8	Confident	110 Å²	110	54.5 Å²	54.5	51%	0.514	28%	0.281	S	S	.	.	H	α-helix	trans	-58	-48.1	177.6	-71.5	170.4	169.9	0	0	111.2	V451 F457 V458 E459	V451-E455 WeakPolarHBondContact O-CG 3.41Å; V451-E455 PolarHBondContact O-N 2.83Å; E455-F457 VanDerWaalsContact C-N 3.33Å; E455-F457 PolarHBondContact O-N 3.24Å; E455-V458 WeakPolarHBondContact O-CB 3.3Å; E455-V458 PolarHBondContact O-N 2.85Å; E455-E459 WeakPolarHBondContact O-CG 3.24Å; E455-E459 PolarHBondContact O-N 3.3Å
456	C	77.3	Confident	78.6	Confident	14 Å²	14	55.8 Å²	55.8	10%	0.095	29%	0.29	C	S	.	.	H	α-helix	trans	-59.2	-42.2	177.7	-176.3	0	0	0	0	112.6	L399 Y400 A452 M453 C454 V458 E459 E460	L399-C456 HydrophobicContact CD1-CB 4.3Å; Y400-C456 PolarHBondContact OH-SG 3.42Å; A452-C456 WeakPolarHBondContact O-CB 3.29Å; A452-C456 PolarHBondContact O-N 3.37Å; M453-C456 PolarHBondContact O-N 2.91Å; C454-C456 PolarHBondContact O-N 3.08Å; C456-V458 PolarHBondContact O-N 3.19Å; C456-E459 PolarHBondContact O-N 3.31Å; C456-E460 WeakPolarHBondContact O-CB 3.29Å; C456-E460 VanDerWaalsContact O-CG 3.28Å; C456-E460 WeakPolarHBondContact O-CG 3.47Å; C456-E460 PolarHBondContact O-N 2.96Å
457	F	78.4	Confident	78.3	Confident	4 Å²	4	56.9 Å²	56.9	2%	0.018	30%	0.296	C	S	.	.	H	α-helix	trans	-69.7	-27.8	-177.6	-83.2	34	0	0	0	112.2	L406 N409 L412 L413 M453 C454 E455 H461 V462 L464	L406-F457 HydrophobicContact CD2-CD1 4.28Å; L406-F457 HydrophobicContact CD2-CE1 4.07Å; N409-F457 WeakPolarHBondContact O-CE2 3.48Å; N409-F457 WeakPolarHBondContact O-CZ 3.24Å; L412-F457 HydrophobicContact CB-CZ 4.39Å; L413-F457 HydrophobicContact CB-CD2 4.33Å; L413-F457 HydrophobicContact CB-CE2 3.95Å; M453-F457 HydrophobicContact CG-CD1 4.24Å; M453-F457 HydrophobicContact CG-CE1 3.97Å; M453-F457 HydrophobicContact CG-CZ 4.36Å; M453-F457 VanDerWaalsContact O-CD1 3.25Å; M453-F457 WeakPolarHBondContact O-CD1 3.39Å; M453-F457 PolarHBondContact O-N 3.11Å; M453-F457 HydrophobicContact SD-CD1 4.04Å; M453-F457 HydrophobicContact SD-CE1 3.44Å; M453-F457 WeakPolarHBondContact SD-CE1 3.47Å; M453-F457 HydrophobicContact SD-CZ 4.1Å; C454-F457 PolarHBondContact O-N 3.48Å; E455-F457 VanDerWaalsContact C-N 3.33Å; E455-F457 PolarHBondContact O-N 3.24Å; F457-H461 PolarHBondContact O-N 2.89Å; F457-H461 VanDerWaalsContact O-N 3.15Å; F457-V462 HydrophobicContact CB-CB 4.19Å; F457-V462 HydrophobicContact CB-CG2 4.17Å; F457-V462 HydrophobicContact CD1-CG2 4.39Å; F457-V462 HydrophobicContact CD2-CB 4.01Å; F457-V462 HydrophobicContact CD2-CG1 3.93Å; F457-V462 HydrophobicContact CD2-CG2 4.24Å; F457-V462 HydrophobicContact CE2-CG1 4.17Å; F457-V462 HydrophobicContact CG-CB 4.18Å; F457-V462 HydrophobicContact CG-CG2 4.03Å; F457-V462 PolarHBondContact O-N 3.18Å; F457-L464 HydrophobicContact CD2-CD2 3.8Å; F457-L464 HydrophobicContact CE2-CD2 4.39Å
458	V	76.4	Confident	78.3	Confident	49 Å²	49	61 Å²	61	30%	0.297	32%	0.324	S	S	.	.	H	α-helix	trans	-72.9	-46.8	175.6	171	0	0	0	0	110.7	Y289 C454 E455 C456 E460 H461	Y289-V458 HydrophobicContact CD1-CG2 3.48Å; Y289-V458 VanDerWaalsContact CD1-CG2 3.48Å; Y289-V458 HydrophobicContact CD2-CG2 3.88Å; Y289-V458 HydrophobicContact CE1-CB 4.34Å; Y289-V458 HydrophobicContact CE1-CG1 4.29Å; Y289-V458 HydrophobicContact CE1-CG2 3.14Å; Y289-V458 HydrophobicContact CE2-CG2 3.57Å; Y289-V458 HydrophobicContact CG-CG2 3.84Å; Y289-V458 WeakPolarHBondContact OH-CG1 3.39Å; C454-V458 WeakPolarHBondContact O-CG2 3.45Å; C454-V458 PolarHBondContact O-N 3.42Å; C454-V458 VanDerWaalsContact O-N 3.14Å; E455-V458 WeakPolarHBondContact O-CB 3.3Å; E455-V458 PolarHBondContact O-N 2.85Å; C456-V458 PolarHBondContact O-N 3.19Å; V458-E460 PolarHBondContact O-N 3.36Å; V458-H461 PolarHBondContact O-N 3.22Å; V458-H461 PolarHBondContact O-ND1 2.56Å
459	E	78.3	Confident	78.6	Confident	144 Å²	144	60.4 Å²	60.4	67%	0.673	33%	0.327	S	S	*	.	H	α-helix	trans	-59.5	-38.6	176	-70.9	179.8	170.1	0	0	111.5	E455 C456 H461	E455-E459 WeakPolarHBondContact O-CG 3.24Å; E455-E459 PolarHBondContact O-N 3.3Å; C456-E459 PolarHBondContact O-N 3.31Å; E459-H461 VanDerWaalsContact C-N 3.33Å
460	E	76.3	Confident	78.9	Confident	83 Å²	83	58.7 Å²	58.7	39%	0.388	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	3.4	-179.3	-65	-66.2	143	0	0	113.9	Y400 L406 C456 V458 V462	Y400-E460 HydrophobicContact CE1-CG 4.12Å; Y400-E460 VanDerWaalsContact OH-CG 3.26Å; Y400-E460 WeakPolarHBondContact OH-CG 3.33Å; Y400-E460 PolarHBondContact OH-OE1 3.09Å; Y400-E460 VanDerWaalsContact OH-OE1 3.12Å; L406-E460 HydrophobicContact CD1-CG 4.34Å; L406-E460 HydrophobicContact CD2-CB 4.33Å; C456-E460 WeakPolarHBondContact O-CB 3.29Å; C456-E460 VanDerWaalsContact O-CG 3.28Å; C456-E460 WeakPolarHBondContact O-CG 3.47Å; C456-E460 PolarHBondContact O-N 2.96Å; V458-E460 PolarHBondContact O-N 3.36Å; E460-V462 HydrophobicContact CB-CG2 3.93Å; E460-V462 PolarHBondContact O-N 3.23Å
461	H	77.3	Confident	78.9	Confident	171 Å²	171	60 Å²	60	79%	0.792	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.7	40.3	-179.9	-58.3	-55.5	0	0	0	114.2	F457 V458 E459 A463	F457-H461 PolarHBondContact O-N 2.89Å; F457-H461 VanDerWaalsContact O-N 3.15Å; V458-H461 PolarHBondContact O-N 3.22Å; V458-H461 PolarHBondContact O-ND1 2.56Å; E459-H461 VanDerWaalsContact C-N 3.33Å; H461-A463 PolarHBondContact O-N 3.45Å
462	V	73.1	Confident	78.8	Confident	30 Å²	30	64.6 Å²	64.6	18%	0.182	34%	0.342	C	S	.	.			trans	-68.2	130.1	-178.6	-176.5	0	0	0	0	110	L406 F457 E460 L464	L406-V462 HydrophobicContact CD2-CG2 3.26Å; F457-V462 HydrophobicContact CB-CB 4.19Å; F457-V462 HydrophobicContact CB-CG2 4.17Å; F457-V462 HydrophobicContact CD1-CG2 4.39Å; F457-V462 HydrophobicContact CD2-CB 4.01Å; F457-V462 HydrophobicContact CD2-CG1 3.93Å; F457-V462 HydrophobicContact CD2-CG2 4.24Å; F457-V462 HydrophobicContact CE2-CG1 4.17Å; F457-V462 HydrophobicContact CG-CB 4.18Å; F457-V462 HydrophobicContact CG-CG2 4.03Å; F457-V462 PolarHBondContact O-N 3.18Å; E460-V462 HydrophobicContact CB-CG2 3.93Å; E460-V462 PolarHBondContact O-N 3.23Å; V462-L464 PolarHBondContact O-N 3.04Å
463	A	71.6	Confident	78.6	Confident	65 Å²	65	64.5 Å²	64.5	54%	0.537	34%	0.337	S	S	.	.			trans	-68.1	128.9	170.4	0	0	0	0	0	110	H461	H461-A463 PolarHBondContact O-N 3.45Å
464	L	73.8	Confident	77.7	Confident	33 Å²	33	68 Å²	68	17%	0.173	36%	0.357	C	S	.	.			trans	-112.6	4.2	-172.7	-71.4	168.6	0	0	0	113	L292 L413 F457 V462	L292-L464 HydrophobicContact CD1-CB 4.11Å; L292-L464 HydrophobicContact CD2-CB 4.33Å; L292-L464 HydrophobicContact CD2-CD1 3.79Å; L292-L464 HydrophobicContact CD2-CD2 4.34Å; L292-L464 HydrophobicContact CD2-CG 4.38Å; L413-L464 HydrophobicContact CD2-CD2 3.75Å; F457-L464 HydrophobicContact CD2-CD2 3.8Å; F457-L464 HydrophobicContact CE2-CD2 4.39Å; V462-L464 PolarHBondContact O-N 3.04Å
465	D	69.9	Low	76.2	Confident	142 Å²	142	73.6 Å²	73.6	76%	0.759	38%	0.382	S	S	*	.			trans	-87.1	-2.6	-175.6	59.7	-27.7	0	0	0	113.9
466	D	75.1	Confident	74.3	Confident	84 Å²	84	74.6 Å²	74.6	45%	0.449	39%	0.391	S	S	.	.	S	Bend	trans	-83.5	-18.5	-178.6	66	-31	0	0	0	114.5	N409 S410	N409-D466 PolarHBondContact ND2-OD2 3.01Å; S410-D466 WeakPolarHBondContact CB-OD1 3.47Å; S410-D466 VanDerWaalsContact OG-CG 3.24Å; S410-D466 PolarHBondContact OG-OD1 2.85Å; S410-D466 PolarHBondContact OG-OD2 2.7Å
467	D	82.1	Confident	72.4	Confident	25 Å²	25	76.4 Å²	76.4	13%	0.134	40%	0.401	C	S	.	.			trans	-94.1	122.4	178.7	-166.4	-62.7	0	0	0	112.8	V414 N469 L470	V414-D467 HydrophobicContact CG2-CB 4.26Å; D467-N469 PolarHBondContact O-N 3.49Å; D467-N469 VanDerWaalsContact O-N 3.11Å; D467-N469 WeakPolarHBondContact OD1-CB 3.47Å; D467-N469 PolarHBondContact OD1-N 3.09Å; D467-N469 PolarHBondContact OD1-ND2 3.01Å; D467-L470 HydrophobicContact CB-CD1 4.04Å; D467-L470 HydrophobicContact CB-CG 4.1Å; D467-L470 PolarHBondContact O-N 3.45Å; D467-L470 VanDerWaalsContact O-N 3.09Å
468	P	85.6	Confident	70.3	Confident	100 Å²	100	81.8 Å²	81.8	65%	0.649	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-12.3	-175.8	28.8	-36.9	0	0	0	114.9
469	N	87.8	Confident	68.4	Low	70 Å²	70	81.7 Å²	81.7	37%	0.374	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-14.9	176.6	-54.8	-72.6	0	0	0	112.6	K295 L342 D467	K295-N469 WeakPolarHBondContact CB-O 3.31Å; K295-N469 PolarHBondContact N-O 3.48Å; L342-N469 HydrophobicContact CD1-CB 3.68Å; D467-N469 PolarHBondContact O-N 3.49Å; D467-N469 VanDerWaalsContact O-N 3.11Å; D467-N469 WeakPolarHBondContact OD1-CB 3.47Å; D467-N469 PolarHBondContact OD1-N 3.09Å; D467-N469 PolarHBondContact OD1-ND2 3.01Å
470	L	86	Confident	66.3	Low	14 Å²	14	78.7 Å²	78.7	7%	0.073	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	150.2	178.2	-59.5	-178.5	0	0	0	110	F288 L292 W293 V414 D467	F288-L470 HydrophobicContact CD1-CD2 4.4Å; F288-L470 HydrophobicContact CD2-CD2 4.47Å; F288-L470 HydrophobicContact CE1-CD2 3.83Å; F288-L470 HydrophobicContact CE2-CD2 4Å; F288-L470 HydrophobicContact CZ-CD2 3.6Å; L292-L470 HydrophobicContact CD1-CB 4.04Å; L292-L470 HydrophobicContact CD1-CD1 4.37Å; L292-L470 HydrophobicContact CD2-CD1 4.03Å; L292-L470 HydrophobicContact CD2-CD2 4.49Å; W293-L470 WeakPolarHBondContact O-CA 3.48Å; V414-L470 HydrophobicContact CG2-CD1 3.75Å; V414-L470 HydrophobicContact CG2-CD2 3.91Å; V414-L470 HydrophobicContact CG2-CG 3.79Å; D467-L470 HydrophobicContact CB-CD1 4.04Å; D467-L470 HydrophobicContact CB-CG 4.1Å; D467-L470 PolarHBondContact O-N 3.45Å; D467-L470 VanDerWaalsContact O-N 3.09Å
471	C	86.3	Confident	64.4	Low	26 Å²	26	82.9 Å²	82.9	18%	0.176	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	128.4	167.3	58.9	0	0	0	0	109.7	W293 K295	W293-C471 PolarHBondContact N-O 3.2Å; W293-C471 PolarHBondContact O-N 2.75Å; K295-C471 HydrophobicContact CB-CB 4.43Å
472	Y	79.6	Confident	62.3	Low	149 Å²	149	79.5 Å²	79.5	58%	0.584	43%	0.432	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.2	116.2	168.4	-161.9	-89.2	0	0	0	108.1	N291 L292	N291-Y472 HydrophobicContact CB-CD1 4.47Å; N291-Y472 HydrophobicContact CB-CD2 4.49Å; N291-Y472 HydrophobicContact CB-CE1 4.09Å; N291-Y472 HydrophobicContact CB-CE2 4.12Å; L292-Y472 HydrophobicContact CB-CD2 4.43Å; L292-Y472 HydrophobicContact CD1-CD2 4.32Å
473	L	74.8	Confident	60.6	Low	29 Å²	29	86.1 Å²	86.1	15%	0.152	46%	0.461	C	S	.	.			trans	-98.2	105.8	-179.3	-64.3	177.6	0	0	0	109.2	K181 N291 W293 V298	K181-L473 HydrophobicContact CB-CB 4.35Å; K181-L473 HydrophobicContact CB-CD1 3.54Å; N291-L473 VanDerWaalsContact CB-O 3.23Å; N291-L473 WeakPolarHBondContact CB-O 3.43Å; N291-L473 PolarHBondContact O-N 3.25Å; N291-L473 VanDerWaalsContact O-N 3.1Å; W293-L473 HydrophobicContact CG-CD1 4.39Å; V298-L473 HydrophobicContact CG1-CD1 4.04Å; V298-L473 HydrophobicContact CG2-CD1 3.73Å
474	D	63	Low	59.1	Low	82 Å²	82	85.2 Å²	85.2	44%	0.439	45%	0.451	S	S	.	.			trans	-75.7	148.6	175.8	-163.9	16.4	0	0	0	111	N476	D474-N476 PolarHBondContact O-N 3.31Å; D474-N476 PolarHBondContact OD2-ND2 3.05Å
475	E	48.8	Very low	57.3	Low	122 Å²	122	85.8 Å²	85.8	57%	0.57	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-13.5	-175.9	-64.6	-176.6	169.4	0	0	112.8
476	N	37.8	Very low	55.8	Low	130 Å²	130	87.8 Å²	87.8	70%	0.695	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	5.4	-172.7	-65	-53	0	0	0	115.5	D474 E478	D474-N476 PolarHBondContact O-N 3.31Å; D474-N476 PolarHBondContact OD2-ND2 3.05Å; N476-E478 VanDerWaalsContact C-N 3.26Å; N476-E478 PolarHBondContact O-N 2.93Å
477	V	37.7	Very low	54.1	Low	52 Å²	52	87.2 Å²	87.2	32%	0.315	45%	0.453	S	S	.	.			trans	-80.9	79.2	176.4	-168.3	0	0	0	0	109.6	L479 F485	V477-L479 VanDerWaalsContact C-N 3.26Å; V477-L479 HydrophobicContact CG1-CG 4.12Å; V477-L479 PolarHBondContact O-N 3.1Å; V477-F485 HydrophobicContact CG1-CE1 4.04Å; V477-F485 HydrophobicContact CG1-CE2 3.77Å; V477-F485 HydrophobicContact CG1-CZ 3.24Å
478	E	34.4	Very low	51.9	Low	118 Å²	118	90.6 Å²	90.6	55%	0.551	47%	0.468	S	S	*	.			trans	-61.9	91.2	162.9	-73	-157.3	146.3	0	0	108.8	K254 N476 S480	K254-E478 WeakPolarHBondContact CE-OE1 3.46Å; K254-E478 IonicContact NZ-OE1 2.72Å; K254-E478 PolarHBondContact NZ-OE1 3.14Å; K254-E478 IonicContact NZ-OE2 2.96Å; K254-E478 PolarHBondContact NZ-OE2 3.24Å; K254-E478 VanDerWaalsContact NZ-OE2 3.12Å; N476-E478 VanDerWaalsContact C-N 3.26Å; N476-E478 PolarHBondContact O-N 2.93Å; E478-S480 PolarHBondContact O-N 3.41Å
479	L	37.3	Very low	49.7	Very low	46 Å²	46	88.4 Å²	88.4	24%	0.241	45%	0.45	C	S	.	.			trans	-68.3	73.7	163.3	-77	167.2	0	0	0	109.1	F179 V477 F485	F179-L479 VanDerWaalsContact O-CD1 3.29Å; F179-L479 WeakPolarHBondContact O-CD1 3.38Å; V477-L479 VanDerWaalsContact C-N 3.26Å; V477-L479 HydrophobicContact CG1-CG 4.12Å; V477-L479 PolarHBondContact O-N 3.1Å; L479-F485 HydrophobicContact CD2-CB 3.78Å; L479-F485 HydrophobicContact CD2-CD1 3.24Å; L479-F485 HydrophobicContact CD2-CD2 3.6Å; L479-F485 HydrophobicContact CD2-CE1 3.61Å; L479-F485 HydrophobicContact CD2-CE2 3.95Å; L479-F485 HydrophobicContact CD2-CG 3.22Å; L479-F485 HydrophobicContact CD2-CZ 3.96Å
480	S	34.8	Very low	47.3	Very low	82 Å²	82	89.2 Å²	89.2	57%	0.573	46%	0.462	S	S	*	.			trans	-58	141.9	154.4	54	0	0	0	0	108.1	E478 D482	E478-S480 PolarHBondContact O-N 3.41Å; S480-D482 PolarHBondContact O-N 2.82Å
481	N	35.3	Very low	44.9	Very low	170 Å²	170	92.2 Å²	92.2	91%	0.909	48%	0.484	S	S	*	.	S	Bend	trans	-59.6	54	-178.6	-73.9	-35.3	0	0	0	114.7
482	D	33.9	Very low	42.4	Very low	100 Å²	100	97.4 Å²	97.4	54%	0.535	51%	0.509	S	S	.	.			trans	-103.7	110.9	179.3	-146.9	27.9	0	0	0	106.5	S480 S484 F485	S480-D482 PolarHBondContact O-N 2.82Å; D482-S484 WeakPolarHBondContact CB-OG 3.24Å; D482-S484 VanDerWaalsContact CG-OG 3.26Å; D482-S484 PolarHBondContact O-N 2.91Å; D482-S484 PolarHBondContact OD2-OG 3.31Å; D482-F485 PolarHBondContact O-N 3.33Å
483	E	37.6	Very low	40.1	Very low	169 Å²	169	94.2 Å²	94.2	79%	0.79	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-13.8	177.3	-68.6	-167.2	154.3	0	0	112.4	F485 Y486	E483-F485 PolarHBondContact O-N 3.28Å; E483-Y486 PolarHBondContact O-N 3.09Å
484	S	39.2	Very low	37.9	Very low	46 Å²	46	98.9 Å²	98.9	32%	0.322	54%	0.538	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-25.9	170.6	71.1	0	0	0	0	113.6	D482 Y486 S487 Q488	D482-S484 WeakPolarHBondContact CB-OG 3.24Å; D482-S484 VanDerWaalsContact CG-OG 3.26Å; D482-S484 PolarHBondContact O-N 2.91Å; D482-S484 PolarHBondContact OD2-OG 3.31Å; S484-Y486 VanDerWaalsContact C-N 3.31Å; S484-Y486 PolarHBondContact O-N 3.2Å; S484-S487 WeakPolarHBondContact O-CB 3.02Å; S484-S487 PolarHBondContact O-N 2.96Å; S484-S487 PolarHBondContact O-OG 3.2Å; S484-Q488 PolarHBondContact O-N 3.37Å
485	F	36.6	Very low	36.2	Very low	46 Å²	46	100.7 Å²	100.7	20%	0.202	56%	0.557	C	S	.	*	H	α-helix	trans	-70.9	-26.2	-177.9	-144	-82.4	0	0	0	113.5	V477 L479 D482 E483 S487 Q488 L489	V477-F485 HydrophobicContact CG1-CE1 4.04Å; V477-F485 HydrophobicContact CG1-CE2 3.77Å; V477-F485 HydrophobicContact CG1-CZ 3.24Å; L479-F485 HydrophobicContact CD2-CB 3.78Å; L479-F485 HydrophobicContact CD2-CD1 3.24Å; L479-F485 HydrophobicContact CD2-CD2 3.6Å; L479-F485 HydrophobicContact CD2-CE1 3.61Å; L479-F485 HydrophobicContact CD2-CE2 3.95Å; L479-F485 HydrophobicContact CD2-CG 3.22Å; L479-F485 HydrophobicContact CD2-CZ 3.96Å; D482-F485 PolarHBondContact O-N 3.33Å; E483-F485 PolarHBondContact O-N 3.28Å; F485-S487 PolarHBondContact O-N 3Å; F485-Q488 PolarHBondContact O-N 3.36Å; F485-Q488 VanDerWaalsContact O-N 3.1Å; F485-L489 HydrophobicContact CD1-CD1 4.07Å; F485-L489 HydrophobicContact CD1-CG 4.21Å; F485-L489 HydrophobicContact CE1-CD1 4.11Å; F485-L489 HydrophobicContact CE1-CG 4Å; F485-L489 PolarHBondContact O-N 3.41Å
486	Y	38.5	Very low	35.2	Very low	184 Å²	184	100.7 Å²	100.7	72%	0.722	57%	0.565	S	S	*	*	H	α-helix	trans	-60.7	-26.2	170.7	-70.1	-73.1	0	0	0	111.9	E483 S484 S490	E483-Y486 PolarHBondContact O-N 3.09Å; S484-Y486 VanDerWaalsContact C-N 3.31Å; S484-Y486 PolarHBondContact O-N 3.2Å; Y486-S490 PolarHBondContact O-OG 3.34Å
487	S	38.8	Very low	34.8	Very low	72 Å²	72	99.3 Å²	99.3	50%	0.503	57%	0.572	S	S	.	*	H	α-helix	trans	-83.9	-26.3	175.4	78.1	0	0	0	0	113.7	S484 F485 S490	S484-S487 WeakPolarHBondContact O-CB 3.02Å; S484-S487 PolarHBondContact O-N 2.96Å; S484-S487 PolarHBondContact O-OG 3.2Å; F485-S487 PolarHBondContact O-N 3Å; S487-S490 VanDerWaalsContact C-OG 3.29Å; S487-S490 PolarHBondContact O-N 2.89Å; S487-S490 PolarHBondContact O-OG 3.16Å
488	Q	36.8	Very low	34.4	Very low	96 Å²	96	102.3 Å²	102.3	45%	0.449	59%	0.591	S	S	.	*	H	α-helix	trans	-82.4	-27.8	-176.6	-69.3	-173	0.6	0	0	113.7	S484 F485 S490 S491 L492	S484-Q488 PolarHBondContact O-N 3.37Å; F485-Q488 PolarHBondContact O-N 3.36Å; F485-Q488 VanDerWaalsContact O-N 3.1Å; Q488-S490 PolarHBondContact O-N 2.98Å; Q488-S491 WeakPolarHBondContact CA-OG 3.31Å; Q488-S491 PolarHBondContact O-N 2.91Å; Q488-S491 PolarHBondContact O-OG 2.95Å; Q488-L492 PolarHBondContact O-N 3.5Å
489	L	38.6	Very low	34	Very low	54 Å²	54	102.8 Å²	102.8	28%	0.283	61%	0.607	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.6	-16.6	171.3	-81.3	163.7	0	0	0	113.3	F485 L492	F485-L489 HydrophobicContact CD1-CD1 4.07Å; F485-L489 HydrophobicContact CD1-CG 4.21Å; F485-L489 HydrophobicContact CE1-CD1 4.11Å; F485-L489 HydrophobicContact CE1-CG 4Å; F485-L489 PolarHBondContact O-N 3.41Å; L489-L492 HydrophobicContact CD2-CD1 4.22Å
490	S	37.8	Very low	33.7	Very low	87 Å²	87	104.8 Å²	104.8	61%	0.608	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	-14	166.2	23.7	0	0	0	0	113.8	Y486 S487 Q488	Y486-S490 PolarHBondContact O-OG 3.34Å; S487-S490 VanDerWaalsContact C-OG 3.29Å; S487-S490 PolarHBondContact O-N 2.89Å; S487-S490 PolarHBondContact O-OG 3.16Å; Q488-S490 PolarHBondContact O-N 2.98Å
491	S	35.9	Very low	33.3	Very low	77 Å²	77	107.4 Å²	107.4	54%	0.538	63%	0.632	S	S	.	*	T	Hydrogen-bonded Turn	trans	-105.3	-2	-179.9	64.1	0	0	0	0	114.9	Q488 S493	Q488-S491 WeakPolarHBondContact CA-OG 3.31Å; Q488-S491 PolarHBondContact O-N 2.91Å; Q488-S491 PolarHBondContact O-OG 2.95Å; S491-S493 PolarHBondContact O-N 3.21Å
492	L	32.6	Very low	33.1	Very low	135 Å²	135	105.4 Å²	105.4	71%	0.707	63%	0.631	S	S	*	*			trans	-77.5	39.2	171.5	-79.8	165.2	0	0	0	113.2	Q488 L489	Q488-L492 PolarHBondContact O-N 3.5Å; L489-L492 HydrophobicContact CD2-CD1 4.22Å
493	S	32	Very low	33	Very low	82 Å²	82	107.7 Å²	107.7	57%	0.573	64%	0.643	S	S	*	*	S	Bend	trans	-125.3	123.3	161	48	0	0	0	0	107.4	S491	S491-S493 PolarHBondContact O-N 3.21Å
494	V	27.9	Very low	32.7	Very low	127 Å²	127	106 Å²	106	77%	0.77	64%	0.644	S	S	*	*			trans	87.6	101.1	171.5	-167.1	0	0	0	0	115.9
495	S	28.6	Very low	33	Very low	120 Å²	120	113.5 Å²	113.5	84%	0.839	69%	0.688	S	S	*	*				-160	79.6	129.7	-73.4	0	0	0	0	109	A497	S495-A497 PolarHBondContact O-N 3.25Å; S495-A497 VanDerWaalsContact O-N 3.13Å
496	T	27.9	Very low	32.9	Very low	122 Å²	122	116.9 Å²	116.9	75%	0.748	71%	0.712	S	S	*	*			trans	-63.5	104.1	156.2	28.9	0	0	0	0	107.7	T498	T496-T498 PolarHBondContact O-N 2.67Å
497	A	28.9	Very low	32.6	Very low	101 Å²	101	113.3 Å²	113.3	84%	0.835	71%	0.712	S	S	*	*			trans	-74.4	85.4	160.7	0	0	0	0	0	107.7	S495 S499	S495-A497 PolarHBondContact O-N 3.25Å; S495-A497 VanDerWaalsContact O-N 3.13Å; A497-S499 PolarHBondContact O-N 2.86Å; A497-S499 VanDerWaalsContact O-N 3.09Å
498	T	29	Very low	32.2	Very low	115 Å²	115	115.6 Å²	115.6	71%	0.706	72%	0.723	S	S	*	*			trans	-62.7	103.5	162	27.9	0	0	0	0	108.6	T496 S500	T496-T498 PolarHBondContact O-N 2.67Å; T498-S500 PolarHBondContact O-N 3.49Å; T498-S500 VanDerWaalsContact O-N 3.12Å
499	S	27.1	Very low	32	Very low	127 Å²	127	116.8 Å²	116.8	89%	0.888	74%	0.739	S	S	*	*			trans	-71.8	93.7	160	59.3	0	0	0	0	108.3	A497	A497-S499 PolarHBondContact O-N 2.86Å; A497-S499 VanDerWaalsContact O-N 3.09Å
500	S	29.4	Very low	31.5	Very low	88 Å²	88	120.7 Å²	120.7	62%	0.615	77%	0.768	S	S	*	*			trans	-114.6	128.2	167.6	41.9	0	0	0	0	110.8	T498	T498-S500 PolarHBondContact O-N 3.49Å; T498-S500 VanDerWaalsContact O-N 3.12Å
501	N	26.9	Very low	31.1	Very low	138 Å²	138	122.9 Å²	122.9	74%	0.738	78%	0.779	S	S	*	*			trans	84.9	91.9	157.3	-58.6	-14.1	0	0	0	118.9
502	S	31	Very low	30.8	Very low	127 Å²	127	126.2 Å²	126.2	89%	0.888	80%	0.796	S	S	*	*				-114.1	96.2	123.5	51.7	0	0	0	0	108.7
503	L	32	Very low	30.6	Very low	148 Å²	148	125.5 Å²	125.5	78%	0.775	80%	0.803	S	S	*	*			trans	-80	124.2	164.2	-105.3	147.3	0	0	0	107.4
504	V	31.2	Very low	30.5	Very low	134 Å²	134	129.2 Å²	129.2	81%	0.812	82%	0.822	S	S	*	*			trans	-64	127.8	162.7	175.8	0	0	0	0	108.4
505	T	46.4	Very low	30.8	Very low	203 Å²	203	129.4 Å²	129.4	100%	1.245	83%	0.826	S	S	*	*			trans	-110.6	0	151.4	41.7	0	0	0	0	108.2

Retrieved 505 of 505 residues in 150.1 ms (Link to these results)

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