A0A077Z866_TRITR Loading...

Sushi domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z866, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 645 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	52.9	Low	63.6	Low	207 Å²	207	135.2 Å²	135.2	100%	1.02	67%	0.673	S	S	*	*				0	-55	0	-72.1	-131.4	-87.7	0	0	113.4	R3 L4 I5	M1-R3 VanDerWaalsContact C-N 3.33Å; M1-R3 PolarHBondContact O-N 3.34Å; M1-L4 WeakPolarHBondContact O-CB 3.39Å; M1-L4 PolarHBondContact O-N 3.3Å; M1-I5 PolarHBondContact O-N 3.3Å
2	A	62.8	Low	61.8	Low	77 Å²	77	142.4 Å²	142.4	64%	0.636	69%	0.687	S	S	*	*	H	α-helix	trans	-57.4	-35.4	-178.3	0	0	0	0	0	115.6	L4	A2-L4 VanDerWaalsContact C-N 3.33Å; A2-L4 PolarHBondContact O-N 3.45Å
3	R	67	Low	60.6	Low	228 Å²	228	140.6 Å²	140.6	86%	0.86	69%	0.689	S	S	*	*	H	α-helix	trans	-69.1	-26.2	175.1	-71.1	-174.4	178.2	176.5	-0.5	114	M1 F7	M1-R3 VanDerWaalsContact C-N 3.33Å; M1-R3 PolarHBondContact O-N 3.34Å; R3-F7 PolarHBondContact O-N 3.38Å
4	L	71	Confident	59.1	Low	122 Å²	122	139.6 Å²	139.6	64%	0.639	69%	0.687	S	S	*	*	H	α-helix	trans	-75.9	-35.1	179.4	-154.3	88.9	0	0	0	111.1	M1 A2 F7 L8	M1-L4 WeakPolarHBondContact O-CB 3.39Å; M1-L4 PolarHBondContact O-N 3.3Å; A2-L4 VanDerWaalsContact C-N 3.33Å; A2-L4 PolarHBondContact O-N 3.45Å; L4-F7 PolarHBondContact O-N 3.41Å; L4-L8 WeakPolarHBondContact O-CG 3.32Å; L4-L8 PolarHBondContact O-N 3.15Å
5	I	77.4	Confident	57.2	Low	119 Å²	119	143.1 Å²	143.1	61%	0.61	70%	0.697	S	S	*	*	H	α-helix	trans	-67.3	-39.1	179	-60.7	171	0	0	0	110.7	M1 A9	M1-I5 PolarHBondContact O-N 3.3Å; I5-A9 PolarHBondContact O-N 3.28Å; I5-A9 VanDerWaalsContact O-N 3.13Å
6	F	67.4	Low	55.8	Low	157 Å²	157	141.6 Å²	141.6	69%	0.689	70%	0.703	S	S	*	*	H	α-helix	trans	-67.4	-38.7	176.6	-109.9	-86.6	0	0	0	113.1	A9 F10	F6-A9 PolarHBondContact O-N 3.08Å; F6-F10 PolarHBondContact O-N 3.45Å; F6-F10 VanDerWaalsContact O-N 3.08Å
7	F	68.7	Low	54.4	Low	150 Å²	150	142.2 Å²	142.2	66%	0.658	71%	0.71	S	S	*	*	H	α-helix	trans	-67.7	-38.1	178	-113.1	-85.3	0	0	0	112.5	R3 L4 F10 L11	R3-F7 PolarHBondContact O-N 3.38Å; L4-F7 PolarHBondContact O-N 3.41Å; F7-F10 PolarHBondContact O-N 3.09Å; F7-L11 WeakPolarHBondContact O-CG 3.5Å; F7-L11 PolarHBondContact O-N 2.96Å; F7-L11 VanDerWaalsContact O-N 3.15Å
8	L	66.8	Low	53	Low	109 Å²	109	143.1 Å²	143.1	57%	0.571	72%	0.716	S	S	*	*	H	α-helix	trans	-70.6	-31.2	176.2	-68.2	172.4	0	0	0	112.7	L4	L4-L8 WeakPolarHBondContact O-CG 3.32Å; L4-L8 PolarHBondContact O-N 3.15Å
9	A	60.8	Low	52.1	Low	57 Å²	57	140.9 Å²	140.9	47%	0.471	72%	0.716	S	S	.	*	H	α-helix	trans	-70.6	-38.5	174	0	0	0	0	0	112.2	I5 F6 R12	I5-A9 PolarHBondContact O-N 3.28Å; I5-A9 VanDerWaalsContact O-N 3.13Å; F6-A9 PolarHBondContact O-N 3.08Å; A9-R12 PolarHBondContact O-N 3.47Å
10	F	56.3	Low	51.1	Low	138 Å²	138	140.7 Å²	140.7	61%	0.605	72%	0.716	S	S	*	*	H	α-helix	trans	-69.9	-35.5	178.6	-133.1	-93.9	0	0	0	112.6	F6 F7 R12 V13 I14	F6-F10 PolarHBondContact O-N 3.45Å; F6-F10 VanDerWaalsContact O-N 3.08Å; F7-F10 PolarHBondContact O-N 3.09Å; F10-R12 PolarHBondContact O-N 3.35Å; F10-V13 PolarHBondContact O-N 3.19Å; F10-I14 HydrophobicContact CD1-CD1 3.8Å; F10-I14 HydrophobicContact CE1-CD1 3.9Å
11	L	49	Very low	50.1	Low	123 Å²	123	142.9 Å²	142.9	64%	0.644	72%	0.724	S	S	*	*	H	α-helix	trans	-67.6	-17.6	175.6	-74.2	169.5	0	0	0	113.8	F7	F7-L11 WeakPolarHBondContact O-CG 3.5Å; F7-L11 PolarHBondContact O-N 2.96Å; F7-L11 VanDerWaalsContact O-N 3.15Å
12	R	41.9	Very low	49.2	Very low	222 Å²	222	138.6 Å²	138.6	84%	0.838	71%	0.71	S	S	*	*	H	α-helix	trans	-83.8	-18.5	173.9	-76.6	-168.8	178.8	-169.3	0.3	114.2	A9 F10	A9-R12 PolarHBondContact O-N 3.47Å; F10-R12 PolarHBondContact O-N 3.35Å
13	V	46.3	Very low	47.6	Very low	119 Å²	119	142.4 Å²	142.4	72%	0.721	72%	0.718	S	S	*	*	H	α-helix	trans	-95.1	-15.7	-174.4	-179.4	0	0	0	0	112.7	F10	F10-V13 PolarHBondContact O-N 3.19Å
14	I	39.7	Very low	45.9	Very low	127 Å²	127	138.5 Å²	138.5	65%	0.651	72%	0.715	S	S	*	*	S	Bend	trans	-95.4	5.7	-177.4	-61.8	174.1	0	0	0	113.1	F10 C16	F10-I14 HydrophobicContact CD1-CD1 3.8Å; F10-I14 HydrophobicContact CE1-CD1 3.9Å; I14-C16 PolarHBondContact O-N 3.47Å
15	K	30.4	Very low	43.8	Very low	192 Å²	192	139.8 Å²	139.8	84%	0.835	72%	0.722	S	S	*	*			trans	-92.1	68.3	168.3	-111.9	-174.5	178.2	-177.5	0	111
16	C	34.5	Very low	41.5	Very low	118 Å²	118	143.4 Å²	143.4	80%	0.797	74%	0.737	S	S	*	*			trans	-111	102.5	152.3	-85.7	0	0	0	0	106.7	I14 L18	I14-C16 PolarHBondContact O-N 3.47Å; C16-L18 PolarHBondContact O-N 2.95Å
17	D	32.3	Very low	39.7	Very low	153 Å²	153	139.2 Å²	139.2	82%	0.818	74%	0.738	S	S	*	*			trans	-57.5	111.7	179	-138.7	-20.6	0	0	0	109.1	S19	D17-S19 VanDerWaalsContact C-N 3.27Å; D17-S19 PolarHBondContact O-N 3.45Å
18	L	29.7	Very low	37.9	Very low	158 Å²	158	138.3 Å²	138.3	83%	0.827	75%	0.75	S	S	*	*			trans	-88.7	72.4	169.9	-139.4	101.8	0	0	0	106	C16 N20	C16-L18 PolarHBondContact O-N 2.95Å; L18-N20 PolarHBondContact O-N 3.35Å; L18-N20 VanDerWaalsContact O-N 3.16Å
19	S	35.4	Very low	36.1	Very low	101 Å²	101	137 Å²	137	71%	0.706	76%	0.762	S	S	*	*			trans	-79.5	98.2	172.4	59.8	0	0	0	0	108.9	D17	D17-S19 VanDerWaalsContact C-N 3.27Å; D17-S19 PolarHBondContact O-N 3.45Å
20	N	31	Very low	34.7	Very low	136 Å²	136	138.8 Å²	138.8	73%	0.727	78%	0.777	S	S	*	*			trans	-37.4	129.6	170.1	-82	-25.2	0	0	0	113.5	L18 T22	L18-N20 PolarHBondContact O-N 3.35Å; L18-N20 VanDerWaalsContact O-N 3.16Å; N20-T22 PolarHBondContact O-N 3.05Å
21	E	31.2	Very low	33.6	Very low	187 Å²	187	140.3 Å²	140.3	87%	0.874	79%	0.786	S	S	*	*			trans	-60.3	110.8	151.3	-69.4	178.6	146.2	0	0	108.4	L23	E21-L23 PolarHBondContact O-N 3.47Å
22	T	33.4	Very low	33.1	Very low	118 Å²	118	140.6 Å²	140.6	72%	0.724	80%	0.795	S	S	*	*			trans	-75.8	101.9	167.7	46.3	0	0	0	0	108.7	N20 D24	N20-T22 PolarHBondContact O-N 3.05Å; T22-D24 VanDerWaalsContact C-N 3.32Å; T22-D24 PolarHBondContact O-N 2.93Å; T22-D24 VanDerWaalsContact O-N 3.11Å
23	L	28.7	Very low	32.9	Very low	157 Å²	157	140 Å²	140	82%	0.822	80%	0.799	S	S	*	*			trans	-66.2	87.6	159.6	-92	145.2	0	0	0	108.9	E21	E21-L23 PolarHBondContact O-N 3.47Å
24	D	32	Very low	32.7	Very low	146 Å²	146	138.4 Å²	138.4	78%	0.781	80%	0.798	S	S	*	*			trans	-101.5	101.5	161.8	-72.8	-27.1	0	0	0	108.9	T22 E26	T22-D24 VanDerWaalsContact C-N 3.32Å; T22-D24 PolarHBondContact O-N 2.93Å; T22-D24 VanDerWaalsContact O-N 3.11Å; D24-E26 PolarHBondContact O-N 3.31Å
25	N	26	Very low	33.1	Very low	149 Å²	149	136.9 Å²	136.9	80%	0.797	79%	0.794	S	S	*	*			trans	-52.8	124	152.1	-81.7	-35.3	0	0	0	108.9
26	E	30.2	Very low	34.2	Very low	195 Å²	195	134.2 Å²	134.2	91%	0.911	79%	0.794	S	S	*	*				174.5	143.1	124.4	-98.5	-178.1	-179.3	0	0	111.1	D24	D24-E26 PolarHBondContact O-N 3.31Å
27	G	30.2	Very low	35.5	Very low	69 Å²	69	134.9 Å²	134.9	71%	0.711	79%	0.79	S	S	*	*			trans	101.1	76	148.8	0	0	0	0	0	117	G29	G27-G29 PolarHBondContact O-N 2.95Å
28	S	29.6	Very low	37.2	Very low	131 Å²	131	129 Å²	129	92%	0.916	76%	0.761	S	S	*	*			trans	-11.8	119.3	145	52.8	0	0	0	0	116.8
29	G	29	Very low	39.4	Very low	80 Å²	80	128.6 Å²	128.6	83%	0.825	76%	0.759	S	S	*	*			trans	134.8	69.8	156	0	0	0	0	0	115.7	G27	G27-G29 PolarHBondContact O-N 2.95Å
30	A	32.2	Very low	41.3	Very low	95 Å²	95	131.2 Å²	131.2	79%	0.785	76%	0.758	S	S	*	*			trans	-168	119.1	151.3	0	0	0	0	0	110.9
31	H	33.7	Very low	43.5	Very low	170 Å²	170	124.9 Å²	124.9	79%	0.787	72%	0.724	S	S	*	*			trans	9.6	134.5	159.8	-68.3	-77.1	0	0	0	120.7	K33	H31-K33 PolarHBondContact O-N 3.5Å
32	P	38.1	Very low	45.8	Very low	130 Å²	130	126 Å²	126	84%	0.844	72%	0.72	S	S	*	*			trans	-64.1	104.6	175.4	26.7	-31.6	0	0	0	111.3	A34	P32-A34 PolarHBondContact O-N 3.27Å
33	K	38.3	Very low	47.9	Very low	210 Å²	210	120.9 Å²	120.9	91%	0.913	69%	0.689	S	S	*	*			trans	-77.5	84.8	165.4	-74.1	179.7	176.8	175.3	0	109.4	H31	H31-K33 PolarHBondContact O-N 3.5Å
34	A	40.5	Very low	50.3	Low	85 Å²	85	116 Å²	116	70%	0.702	67%	0.666	S	S	*	*			trans	-162.1	51.9	166.7	0	0	0	0	0	114.2	P32	P32-A34 PolarHBondContact O-N 3.27Å
35	V	48.4	Very low	52.6	Low	95 Å²	95	112.5 Å²	112.5	58%	0.576	65%	0.648	S	S	*	*			trans	-144.9	78.6	163.5	-168.1	0	0	0	0	109.8	C75	V35-C75 HydrophobicContact CG1-CB 4.48Å
36	T	53.5	Low	55.3	Low	136 Å²	136	106 Å²	106	83%	0.834	62%	0.615	S	S	*	*			trans	-119.9	6.2	176.3	46.1	0	0	0	0	114.9
37	N	62.7	Low	57.9	Low	132 Å²	132	101.5 Å²	101.5	71%	0.706	60%	0.598	S	S	*	*	S	Bend	trans	-113.8	9.3	-173.2	-80.1	17.9	0	0	0	116.1	G78	N37-G78 WeakPolarHBondContact O-CA 3.35Å
38	C	66.5	Low	60.3	Low	30 Å²	30	100.6 Å²	100.6	20%	0.203	58%	0.576	C	S	.	*			trans	-116.9	121.2	170.7	-68.8	0	0	0	0	110.2	C75 G78 W80	C38-C75 HydrophobicContact CB-CB 3.71Å; C38-C75 WeakPolarHBondContact CB-SG 3.5Å; C38-C75 WeakPolarHBondContact SG-CB 3.4Å; C38-C75 CovalentContact SG-SG 2.02Å; C38-C75 PolarHBondContact SG-SG 3.15Å; C38-G78 VanDerWaalsContact SG-CA 3.53Å; C38-W80 HydrophobicContact CB-CH2 4.22Å; C38-W80 HydrophobicContact CB-CZ2 3.62Å
39	D	76	Confident	62.5	Low	148 Å²	148	102.5 Å²	102.5	79%	0.791	56%	0.563	S	S	*	*			trans	-62.1	158.4	167.5	-68	-37.9	0	0	0	110.6	P41 W80	D39-P41 VanDerWaalsContact O-N 3.12Å; D39-W80 VanDerWaalsContact O-CZ2 3.24Å; D39-W80 WeakPolarHBondContact O-CZ2 3.42Å; D39-W80 PolarHBondContact O-NE1 3.46Å
40	K	76.2	Confident	64.8	Low	156 Å²	156	103 Å²	103	68%	0.678	55%	0.55	S	S	*	*			trans	-45.6	122.9	177.3	-176.4	-178	179.7	-179.5	0	109.4	R42 W57	K40-R42 PolarHBondContact O-N 3.06Å; K40-W57 HydrophobicContact CG-CH2 4.26Å
41	P	76.3	Confident	66.7	Low	3 Å²	3	101.2 Å²	101.2	2%	0.019	54%	0.536	C	S	.	.			trans	-60.9	141.7	-178.3	12	-12.5	0	0	0	109.6	D39 L48 W57 I73 W80 T84	D39-P41 VanDerWaalsContact O-N 3.12Å; P41-L48 HydrophobicContact CB-CD2 4.23Å; P41-L48 HydrophobicContact CG-CD2 3.74Å; P41-L48 WeakPolarHBondContact O-CD1 3.4Å; P41-W57 HydrophobicContact CG-CB 4Å; P41-W57 HydrophobicContact CG-CD2 3.78Å; P41-W57 HydrophobicContact CG-CE3 4.35Å; P41-W57 HydrophobicContact CG-CG 3.61Å; P41-I73 HydrophobicContact CB-CD1 3.29Å; P41-I73 HydrophobicContact CG-CD1 3.58Å; P41-I73 HydrophobicContact CG-CG1 4.47Å; P41-W80 HydrophobicContact CB-CD2 3.78Å; P41-W80 VanDerWaalsContact CB-CE2 3.44Å; P41-W80 HydrophobicContact CB-CE3 4.27Å; P41-W80 HydrophobicContact CB-CG 4.28Å; P41-W80 HydrophobicContact CB-CH2 4.23Å; P41-W80 HydrophobicContact CB-CZ2 3.72Å; P41-W80 HydrophobicContact CB-CZ3 4.47Å; P41-W80 HydrophobicContact CG-CD2 4.19Å; P41-W80 HydrophobicContact CG-CE3 4.28Å; P41-W80 HydrophobicContact CG-CH2 3.57Å; P41-W80 HydrophobicContact CG-CZ2 3.42Å; P41-W80 VanDerWaalsContact CG-CZ2 3.42Å; P41-W80 HydrophobicContact CG-CZ3 3.99Å; P41-T84 HydrophobicContact CB-CG2 4.46Å
42	R	79.5	Confident	68.7	Low	211 Å²	211	96.3 Å²	96.3	80%	0.796	52%	0.515	S	S	*	.			trans	-112.7	112.5	171.9	-173	177.8	-177.5	-178.1	-0.5	107.4	K40 P44 T84	K40-R42 PolarHBondContact O-N 3.06Å; R42-P44 WeakPolarHBondContact O-CD 3.5Å; R42-T84 VanDerWaalsContact O-CB 3.29Å; R42-T84 WeakPolarHBondContact O-CB 3.2Å
43	V	79.2	Confident	70	Confident	10 Å²	10	98.2 Å²	98.2	6%	0.061	52%	0.518	C	S	.	.			trans	-98.6	112.5	175.8	-177	0	0	0	0	107.7	L48 Y59 I73 L87	V43-L48 HydrophobicContact CG2-CD2 4.43Å; V43-L48 HydrophobicContact CG2-CG 4.5Å; V43-Y59 HydrophobicContact CG1-CD2 4.17Å; V43-Y59 HydrophobicContact CG2-CG 4.24Å; V43-I73 HydrophobicContact CG2-CD1 4.3Å; V43-L87 HydrophobicContact CG1-CB 4.2Å; V43-L87 HydrophobicContact CG1-CD1 4.13Å; V43-L87 HydrophobicContact CG2-CD1 3.94Å
44	P	78.7	Confident	71.4	Confident	54 Å²	54	94 Å²	94	35%	0.351	51%	0.505	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	137.9	173.1	-19.1	32.6	0	0	0	110.7	R42 G46 T84	R42-P44 WeakPolarHBondContact O-CD 3.5Å; P44-G46 PolarHBondContact O-N 3.09Å; P44-T84 WeakPolarHBondContact CD-O 3.12Å
45	N	80.2	Confident	72.9	Confident	74 Å²	74	90.9 Å²	90.9	40%	0.396	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	57	29.6	-179.3	-45.5	-49.1	0	0	0	114.5	E62 F65 C88	N45-E62 WeakPolarHBondContact O-CB 3.49Å; N45-E62 WeakPolarHBondContact O-CG 3.46Å; N45-E62 PolarHBondContact O-N 3.48Å; N45-F65 HydrophobicContact CB-CD1 3.6Å; N45-F65 HydrophobicContact CB-CD2 4.14Å; N45-F65 HydrophobicContact CB-CE1 3.33Å; N45-F65 HydrophobicContact CB-CE2 3.94Å; N45-F65 HydrophobicContact CB-CG 3.99Å; N45-F65 HydrophobicContact CB-CZ 3.53Å; N45-F65 VanDerWaalsContact CG-CZ 3.44Å; N45-F65 WeakPolarHBondContact ND2-CE1 3.4Å; N45-C88 HydrophobicContact CB-CB 4.34Å
46	G	83.1	Confident	74.4	Confident	11 Å²	11	88 Å²	88	11%	0.113	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	154.6	179.5	0	0	0	0	0	112.8	P44 T60	P44-G46 PolarHBondContact O-N 3.09Å; G46-T60 CarbonylContact C-O 3.59Å; G46-T60 WeakPolarHBondContact CA-O 3.41Å
47	N	83.2	Confident	75.7	Confident	101 Å²	101	84.7 Å²	84.7	54%	0.54	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	131.6	178.6	-69.8	-46.1	0	0	0	110.9	Y59 T60	N47-Y59 CarbonylContact O-C 3.46Å; N47-Y59 WeakPolarHBondContact O-CA 3.34Å; N47-T60 PolarHBondContact N-O 2.87Å; N47-T60 PolarHBondContact O-N 3.5Å; N47-T60 PolarHBondContact O-OG1 2.9Å
48	L	82.1	Confident	76.8	Confident	51 Å²	51	79.2 Å²	79.2	27%	0.267	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	127.5	172.3	-71.8	132.8	0	0	0	109.9	P41 V43 W57	P41-L48 HydrophobicContact CB-CD2 4.23Å; P41-L48 HydrophobicContact CG-CD2 3.74Å; P41-L48 WeakPolarHBondContact O-CD1 3.4Å; V43-L48 HydrophobicContact CG2-CD2 4.43Å; V43-L48 HydrophobicContact CG2-CG 4.5Å; L48-W57 HydrophobicContact CD2-CB 4.25Å; L48-W57 HydrophobicContact CD2-CD2 4.37Å; L48-W57 HydrophobicContact CD2-CE3 3.8Å
49	R	76	Confident	77.7	Confident	171 Å²	171	77.9 Å²	77.9	65%	0.645	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.8	-70.7	-177	-72.4	-168.5	166.2	-166.8	-2.3	112.1	S58 T60	R49-S58 PolarHBondContact N-O 3.37Å; R49-T60 HydrophobicContact CG-CG2 4.25Å; R49-T60 PolarHBondContact NE-OG1 3.4Å
50	T	75.6	Confident	78	Confident	89 Å²	89	72.9 Å²	72.9	55%	0.546	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	145.6	-174	50.6	0	0	0	0	111.2	S58	T50-S58 PolarHBondContact O-N 3Å
51	A	72.7	Confident	78.4	Confident	59 Å²	59	66.8 Å²	66.8	49%	0.488	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	122.6	166.5	0	0	0	0	0	108.4	W57	A51-W57 HydrophobicContact CB-CD2 4.18Å; A51-W57 HydrophobicContact CB-CE3 4.27Å; A51-W57 HydrophobicContact CB-CH2 4.17Å; A51-W57 HydrophobicContact CB-CZ2 4.07Å; A51-W57 HydrophobicContact CB-CZ3 4.26Å
52	L	75.7	Confident	78.7	Confident	67 Å²	67	70.8 Å²	70.8	35%	0.351	37%	0.369	S	S	.	.			trans	-82.5	149.8	170.5	-69.4	95.4	0	0	0	109.5	D54 G55 N56 F72	L52-D54 PolarHBondContact O-N 3.48Å; L52-G55 PolarHBondContact O-N 3.21Å; L52-N56 HydrophobicContact CB-CB 4.31Å; L52-N56 HydrophobicContact CD1-CB 4.45Å; L52-N56 PolarHBondContact N-O 2.96Å; L52-F72 HydrophobicContact CD1-CD1 4Å; L52-F72 HydrophobicContact CD1-CE1 3.98Å; L52-F72 HydrophobicContact CD2-CE1 4.44Å
53	N	65.1	Low	78.5	Confident	169 Å²	169	69.8 Å²	69.8	90%	0.904	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-17.3	-175.5	-70.2	-15.4	0	0	0	114.6
54	D	68.7	Low	78.1	Confident	121 Å²	121	74.6 Å²	74.6	65%	0.647	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	10.9	-176.1	-59.8	-32.1	0	0	0	114.6	L52 N56	L52-D54 PolarHBondContact O-N 3.48Å; D54-N56 VanDerWaalsContact C-N 3.31Å
55	G	70.6	Confident	78.1	Confident	20 Å²	20	73.9 Å²	73.9	21%	0.206	39%	0.387	C	S	.	.	S	Bend	trans	80	12.9	-175	0	0	0	0	0	114.1	L52	L52-G55 PolarHBondContact O-N 3.21Å
56	N	81.3	Confident	77.9	Confident	35 Å²	35	71.9 Å²	71.9	19%	0.187	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	142.8	174.3	-63.1	-17.4	0	0	0	110.3	L52 D54 I73 R74	L52-N56 HydrophobicContact CB-CB 4.31Å; L52-N56 HydrophobicContact CD1-CB 4.45Å; L52-N56 PolarHBondContact N-O 2.96Å; D54-N56 VanDerWaalsContact C-N 3.31Å; N56-I73 CarbonylContact C-O 3.55Å; N56-I73 WeakPolarHBondContact CA-O 3.43Å; N56-R74 WeakPolarHBondContact OD1-CB 3.3Å; N56-R74 WeakPolarHBondContact OD1-CD 3.4Å; N56-R74 VanDerWaalsContact OD1-CG 3.26Å; N56-R74 WeakPolarHBondContact OD1-CG 3.37Å
57	W	81.2	Confident	77.7	Confident	66 Å²	66	73.2 Å²	73.2	25%	0.25	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	133.1	171.6	-73.3	73.5	0	0	0	110	K40 P41 L48 A51 F72 I73 W80	K40-W57 HydrophobicContact CG-CH2 4.26Å; P41-W57 HydrophobicContact CG-CB 4Å; P41-W57 HydrophobicContact CG-CD2 3.78Å; P41-W57 HydrophobicContact CG-CE3 4.35Å; P41-W57 HydrophobicContact CG-CG 3.61Å; L48-W57 HydrophobicContact CD2-CB 4.25Å; L48-W57 HydrophobicContact CD2-CD2 4.37Å; L48-W57 HydrophobicContact CD2-CE3 3.8Å; A51-W57 HydrophobicContact CB-CD2 4.18Å; A51-W57 HydrophobicContact CB-CE3 4.27Å; A51-W57 HydrophobicContact CB-CH2 4.17Å; A51-W57 HydrophobicContact CB-CZ2 4.07Å; A51-W57 HydrophobicContact CB-CZ3 4.26Å; W57-F72 WeakPolarHBondContact O-CA 3.42Å; W57-I73 HydrophobicContact CB-CD1 4.18Å; W57-I73 HydrophobicContact CB-CG1 3.73Å; W57-I73 PolarHBondContact N-O 3.08Å; W57-I73 PolarHBondContact O-N 3.47Å; W57-W80 AromaticContact CD1-CH2 3.3Å; W57-W80 AromaticContact CD1-CZ3 3.55Å; W57-W80 HydrophobicContact CG-CH2 4.2Å; W57-W80 HydrophobicContact CG-CZ3 4.32Å; W57-W80 AromaticContact NE1-CH2 3.54Å
58	S	84.1	Confident	77.3	Confident	18 Å²	18	70.5 Å²	70.5	13%	0.126	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	131.8	168.8	178.2	0	0	0	0	110.1	R49 T50 G71	R49-S58 PolarHBondContact N-O 3.37Å; T50-S58 PolarHBondContact O-N 3Å; S58-G71 VanDerWaalsContact CA-O 3.31Å; S58-G71 WeakPolarHBondContact CA-O 3.43Å
59	Y	86.1	Confident	76.7	Confident	1 Å²	1	68.7 Å²	68.7	0%	0.004	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	158.3	172.4	70.4	-86.3	0	0	0	110.3	V43 N47 D67 G71 I73 L87	V43-Y59 HydrophobicContact CG1-CD2 4.17Å; V43-Y59 HydrophobicContact CG2-CG 4.24Å; N47-Y59 CarbonylContact O-C 3.46Å; N47-Y59 WeakPolarHBondContact O-CA 3.34Å; Y59-D67 WeakPolarHBondContact CE2-OD1 3.3Å; Y59-D67 VanDerWaalsContact CZ-OD1 3.28Å; Y59-D67 PolarHBondContact OH-OD1 3.09Å; Y59-G71 VanDerWaalsContact CE1-C 3.41Å; Y59-G71 PolarHBondContact N-O 3.15Å; Y59-I73 HydrophobicContact CD1-CG2 3.84Å; Y59-I73 HydrophobicContact CE1-CG2 3.59Å; Y59-L87 HydrophobicContact CD1-CD1 4.31Å; Y59-L87 HydrophobicContact CE1-CD1 3.99Å; Y59-L87 HydrophobicContact CE1-CD2 4.19Å; Y59-L87 HydrophobicContact CE1-CG 4.49Å; Y59-L87 HydrophobicContact CE2-CB 3.86Å; Y59-L87 HydrophobicContact CE2-CD1 4.44Å
60	T	82.7	Confident	76.7	Confident	43 Å²	43	67 Å²	67	26%	0.264	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	130.2	170	42.3	0	0	0	0	110	G46 N47 R49	G46-T60 CarbonylContact C-O 3.59Å; G46-T60 WeakPolarHBondContact CA-O 3.41Å; N47-T60 PolarHBondContact N-O 2.87Å; N47-T60 PolarHBondContact O-N 3.5Å; N47-T60 PolarHBondContact O-OG1 2.9Å; R49-T60 HydrophobicContact CG-CG2 4.25Å; R49-T60 PolarHBondContact NE-OG1 3.4Å
61	C	83.9	Confident	77	Confident	29 Å²	29	63.2 Å²	63.2	20%	0.196	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	154.8	177.3	-61	0	0	0	0	112	F65 C88	C61-F65 HydrophobicContact CB-CB 3.82Å; C61-C88 WeakPolarHBondContact CA-SG 3.43Å; C61-C88 HydrophobicContact CB-CB 3.8Å; C61-C88 WeakPolarHBondContact CB-SG 3.33Å; C61-C88 WeakPolarHBondContact SG-CA 3.26Å; C61-C88 WeakPolarHBondContact SG-CB 3.28Å; C61-C88 CovalentContact SG-SG 2.05Å; C61-C88 PolarHBondContact SG-SG 3.07Å
62	E	82.3	Confident	77.5	Confident	87 Å²	87	65.3 Å²	65.3	41%	0.407	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-66.1	166.6	173.3	-72	173.5	-160.5	0	0	111.7	N45 N64 F65	N45-E62 WeakPolarHBondContact O-CB 3.49Å; N45-E62 WeakPolarHBondContact O-CG 3.46Å; N45-E62 PolarHBondContact O-N 3.48Å; E62-N64 PolarHBondContact O-N 3.43Å; E62-F65 HydrophobicContact CB-CD2 3.97Å; E62-F65 HydrophobicContact CB-CE2 4.49Å; E62-F65 WeakPolarHBondContact O-CB 3.49Å; E62-F65 PolarHBondContact O-N 3.03Å; E62-F65 VanDerWaalsContact O-N 3.12Å
63	K	76.4	Confident	78	Confident	189 Å²	189	62.2 Å²	62.2	82%	0.822	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	135.6	174.5	-169.2	178.9	178.6	-177.4	0	109.5
64	N	70.8	Confident	78.9	Confident	112 Å²	112	60.8 Å²	60.8	60%	0.599	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	74	16.3	-173.2	-45.3	-29.3	0	0	0	115.6	E62 T91	E62-N64 PolarHBondContact O-N 3.43Å; N64-T91 VanDerWaalsContact C-OG1 3.3Å; N64-T91 PolarHBondContact O-N 3.43Å; N64-T91 PolarHBondContact O-OG1 3.01Å
65	F	77.5	Confident	79.4	Confident	38 Å²	38	56.2 Å²	56.2	17%	0.167	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	129	171.7	-70.3	-98.6	0	0	0	110.1	N45 C61 E62 C88 L89 R90	N45-F65 HydrophobicContact CB-CD1 3.6Å; N45-F65 HydrophobicContact CB-CD2 4.14Å; N45-F65 HydrophobicContact CB-CE1 3.33Å; N45-F65 HydrophobicContact CB-CE2 3.94Å; N45-F65 HydrophobicContact CB-CG 3.99Å; N45-F65 HydrophobicContact CB-CZ 3.53Å; N45-F65 VanDerWaalsContact CG-CZ 3.44Å; N45-F65 WeakPolarHBondContact ND2-CE1 3.4Å; C61-F65 HydrophobicContact CB-CB 3.82Å; E62-F65 HydrophobicContact CB-CD2 3.97Å; E62-F65 HydrophobicContact CB-CE2 4.49Å; E62-F65 WeakPolarHBondContact O-CB 3.49Å; E62-F65 PolarHBondContact O-N 3.03Å; E62-F65 VanDerWaalsContact O-N 3.12Å; F65-C88 HydrophobicContact CB-CB 4.16Å; F65-C88 HydrophobicContact CD1-CB 4.28Å; F65-L89 CarbonylContact C-O 3.38Å; F65-L89 WeakPolarHBondContact CA-O 3.19Å; F65-R90 HydrophobicContact CD1-CB 4.47Å; F65-R90 HydrophobicContact CD1-CG 3.72Å; F65-R90 HydrophobicContact CE1-CB 4.27Å; F65-R90 HydrophobicContact CE1-CG 3.12Å; F65-R90 HydrophobicContact CE2-CG 4.4Å; F65-R90 HydrophobicContact CZ-CG 3.52Å
66	F	76.9	Confident	79.9	Confident	32 Å²	32	58 Å²	58	14%	0.14	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	135.3	178	-171.3	-94.6	0	0	0	109.6	S68 L89 T91 T109 K111 A121	F66-S68 PolarHBondContact O-N 3.11Å; F66-L89 PolarHBondContact N-O 3.21Å; F66-L89 PolarHBondContact O-N 3.36Å; F66-T91 HydrophobicContact CB-CG2 3.37Å; F66-T109 HydrophobicContact CD1-CG2 3.85Å; F66-T109 HydrophobicContact CE1-CG2 3.62Å; F66-K111 HydrophobicContact CZ-CD 4.11Å; F66-A121 HydrophobicContact CB-CB 4.41Å; F66-A121 HydrophobicContact CD1-CB 4.23Å; F66-A121 HydrophobicContact CG-CB 4.49Å
67	D	78.4	Confident	79.6	Confident	40 Å²	40	62.7 Å²	62.7	21%	0.214	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	110	173.8	-175.9	8.3	0	0	0	110	Y59 G69 G71	Y59-D67 WeakPolarHBondContact CE2-OD1 3.3Å; Y59-D67 VanDerWaalsContact CZ-OD1 3.28Å; Y59-D67 PolarHBondContact OH-OD1 3.09Å; D67-G69 PolarHBondContact O-N 3.16Å; D67-G69 WeakPolarHBondContact OD1-CA 3.28Å; D67-G69 PolarHBondContact OD1-N 2.95Å; D67-G71 WeakPolarHBondContact OD2-CA 3.39Å; D67-G71 PolarHBondContact OD2-N 3.35Å
68	S	74.5	Confident	79.4	Confident	43 Å²	43	61.6 Å²	61.6	30%	0.301	34%	0.337	S	S	.	.	S	Bend	trans	-72.3	-18	174.7	75.1	0	0	0	0	112.6	F66 G86 L87	F66-S68 PolarHBondContact O-N 3.11Å; S68-G86 PolarHBondContact OG-O 3.28Å; S68-L87 PolarHBondContact N-O 3.46Å; S68-L87 PolarHBondContact OG-O 3.46Å
69	G	71.3	Confident	79.1	Confident	14 Å²	14	63.8 Å²	63.8	14%	0.144	35%	0.353	C	S	.	.	S	Bend	trans	-101.8	-151.3	178.8	0	0	0	0	0	113.4	D67	D67-G69 PolarHBondContact O-N 3.16Å; D67-G69 WeakPolarHBondContact OD1-CA 3.28Å; D67-G69 PolarHBondContact OD1-N 2.95Å
70	N	75.7	Confident	78.8	Confident	135 Å²	135	65.6 Å²	65.6	72%	0.722	36%	0.36	S	S	*	.			trans	-109.7	13.6	178.9	-68.3	-22.3	0	0	0	112.5	F72	N70-F72 VanDerWaalsContact C-N 3.26Å; N70-F72 HydrophobicContact CB-CD2 4.36Å; N70-F72 WeakPolarHBondContact O-CD2 3.27Å; N70-F72 WeakPolarHBondContact O-CE2 3.47Å; N70-F72 PolarHBondContact O-N 3.34Å
71	G	81.2	Confident	78.7	Confident	9 Å²	9	67.3 Å²	67.3	9%	0.093	37%	0.37	C	S	.	.	S	Bend	trans	77.2	9.6	-174.2	0	0	0	0	0	114.5	S58 Y59 D67	S58-G71 VanDerWaalsContact CA-O 3.31Å; S58-G71 WeakPolarHBondContact CA-O 3.43Å; Y59-G71 VanDerWaalsContact CE1-C 3.41Å; Y59-G71 PolarHBondContact N-O 3.15Å; D67-G71 WeakPolarHBondContact OD2-CA 3.39Å; D67-G71 PolarHBondContact OD2-N 3.35Å
72	F	83.6	Confident	78.4	Confident	103 Å²	103	68.3 Å²	68.3	45%	0.452	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	138.7	180	-56.7	-80.6	0	0	0	111.5	L52 W57 N70	L52-F72 HydrophobicContact CD1-CD1 4Å; L52-F72 HydrophobicContact CD1-CE1 3.98Å; L52-F72 HydrophobicContact CD2-CE1 4.44Å; W57-F72 WeakPolarHBondContact O-CA 3.42Å; N70-F72 VanDerWaalsContact C-N 3.26Å; N70-F72 HydrophobicContact CB-CD2 4.36Å; N70-F72 WeakPolarHBondContact O-CD2 3.27Å; N70-F72 WeakPolarHBondContact O-CE2 3.47Å; N70-F72 PolarHBondContact O-N 3.34Å
73	I	85.5	Confident	78.2	Confident	2 Å²	2	68.7 Å²	68.7	1%	0.01	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	143.6	171	58.3	-177.9	0	0	0	110.6	P41 V43 N56 W57 Y59 W80 L87	P41-I73 HydrophobicContact CB-CD1 3.29Å; P41-I73 HydrophobicContact CG-CD1 3.58Å; P41-I73 HydrophobicContact CG-CG1 4.47Å; V43-I73 HydrophobicContact CG2-CD1 4.3Å; N56-I73 CarbonylContact C-O 3.55Å; N56-I73 WeakPolarHBondContact CA-O 3.43Å; W57-I73 HydrophobicContact CB-CD1 4.18Å; W57-I73 HydrophobicContact CB-CG1 3.73Å; W57-I73 PolarHBondContact N-O 3.08Å; W57-I73 PolarHBondContact O-N 3.47Å; Y59-I73 HydrophobicContact CD1-CG2 3.84Å; Y59-I73 HydrophobicContact CE1-CG2 3.59Å; I73-W80 HydrophobicContact CB-CE3 4.06Å; I73-W80 HydrophobicContact CD1-CD2 4.16Å; I73-W80 HydrophobicContact CD1-CE3 3.82Å; I73-W80 HydrophobicContact CD1-CZ3 4.3Å; I73-W80 HydrophobicContact CG1-CE3 3.78Å; I73-W80 HydrophobicContact CG1-CZ3 4.08Å; I73-L87 HydrophobicContact CG2-CD1 3.47Å; I73-L87 VanDerWaalsContact CG2-CD1 3.47Å; I73-L87 HydrophobicContact CG2-CD2 4.02Å; I73-L87 HydrophobicContact CG2-CG 4.41Å
74	R	83.7	Confident	78.2	Confident	140 Å²	140	61 Å²	61	53%	0.528	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	136.9	179.6	-177.2	171.9	-179.2	144	4	110.3	N56 T76 V81	N56-R74 WeakPolarHBondContact OD1-CB 3.3Å; N56-R74 WeakPolarHBondContact OD1-CD 3.4Å; N56-R74 VanDerWaalsContact OD1-CG 3.26Å; N56-R74 WeakPolarHBondContact OD1-CG 3.37Å; R74-T76 HydrophobicContact CG-CG2 4.24Å; R74-T76 PolarHBondContact O-N 3Å; R74-V81 PolarHBondContact N-O 3.1Å; R74-V81 PolarHBondContact O-N 3.44Å
75	C	80	Confident	78.3	Confident	24 Å²	24	62.4 Å²	62.4	16%	0.162	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	118.1	169.2	171.7	0	0	0	0	109.2	V35 C38 W80	V35-C75 HydrophobicContact CG1-CB 4.48Å; C38-C75 HydrophobicContact CB-CB 3.71Å; C38-C75 WeakPolarHBondContact CB-SG 3.5Å; C38-C75 WeakPolarHBondContact SG-CB 3.4Å; C38-C75 CovalentContact SG-SG 2.02Å; C38-C75 PolarHBondContact SG-SG 3.15Å; C75-W80 HydrophobicContact CB-CE3 4.22Å; C75-W80 HydrophobicContact CB-CH2 3.95Å; C75-W80 HydrophobicContact CB-CZ2 4.48Å; C75-W80 HydrophobicContact CB-CZ3 3.82Å
76	T	80.9	Confident	78.1	Confident	57 Å²	57	62.2 Å²	62.2	35%	0.35	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	117.1	169.7	54.2	0	0	0	0	108.9	R74 G78 S79 V81	R74-T76 HydrophobicContact CG-CG2 4.24Å; R74-T76 PolarHBondContact O-N 3Å; T76-G78 VanDerWaalsContact C-N 3.3Å; T76-G78 PolarHBondContact O-N 3.33Å; T76-S79 PolarHBondContact N-O 3.45Å; T76-S79 PolarHBondContact O-N 3.45Å; T76-S79 PolarHBondContact O-OG 3.01Å; T76-V81 WeakPolarHBondContact OG1-CG2 3.31Å
77	S	75.6	Confident	78.1	Confident	135 Å²	135	60.8 Å²	60.8	94%	0.944	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.6	42.8	174.6	-55.4	0	0	0	0	114.7
78	G	77.3	Confident	78.1	Confident	43 Å²	43	59.5 Å²	59.5	44%	0.443	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.1	1.6	177.7	0	0	0	0	0	115.6	N37 C38 T76	N37-G78 WeakPolarHBondContact O-CA 3.35Å; C38-G78 VanDerWaalsContact SG-CA 3.53Å; T76-G78 VanDerWaalsContact C-N 3.3Å; T76-G78 PolarHBondContact O-N 3.33Å
79	S	77.2	Confident	78.2	Confident	64 Å²	64	59.1 Å²	59.1	45%	0.448	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	145.3	177.8	62.2	0	0	0	0	111.8	T76	T76-S79 PolarHBondContact N-O 3.45Å; T76-S79 PolarHBondContact O-N 3.45Å; T76-S79 PolarHBondContact O-OG 3.01Å
80	W	80.4	Confident	78.5	Confident	39 Å²	39	63 Å²	63	15%	0.148	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	128	175.6	-67.7	106.7	0	0	0	110.5	C38 D39 P41 W57 I73 C75 P82 P83 T84	C38-W80 HydrophobicContact CB-CH2 4.22Å; C38-W80 HydrophobicContact CB-CZ2 3.62Å; D39-W80 VanDerWaalsContact O-CZ2 3.24Å; D39-W80 WeakPolarHBondContact O-CZ2 3.42Å; D39-W80 PolarHBondContact O-NE1 3.46Å; P41-W80 HydrophobicContact CB-CD2 3.78Å; P41-W80 VanDerWaalsContact CB-CE2 3.44Å; P41-W80 HydrophobicContact CB-CE3 4.27Å; P41-W80 HydrophobicContact CB-CG 4.28Å; P41-W80 HydrophobicContact CB-CH2 4.23Å; P41-W80 HydrophobicContact CB-CZ2 3.72Å; P41-W80 HydrophobicContact CB-CZ3 4.47Å; P41-W80 HydrophobicContact CG-CD2 4.19Å; P41-W80 HydrophobicContact CG-CE3 4.28Å; P41-W80 HydrophobicContact CG-CH2 3.57Å; P41-W80 HydrophobicContact CG-CZ2 3.42Å; P41-W80 VanDerWaalsContact CG-CZ2 3.42Å; P41-W80 HydrophobicContact CG-CZ3 3.99Å; W57-W80 AromaticContact CD1-CH2 3.3Å; W57-W80 AromaticContact CD1-CZ3 3.55Å; W57-W80 HydrophobicContact CG-CH2 4.2Å; W57-W80 HydrophobicContact CG-CZ3 4.32Å; W57-W80 AromaticContact NE1-CH2 3.54Å; I73-W80 HydrophobicContact CB-CE3 4.06Å; I73-W80 HydrophobicContact CD1-CD2 4.16Å; I73-W80 HydrophobicContact CD1-CE3 3.82Å; I73-W80 HydrophobicContact CD1-CZ3 4.3Å; I73-W80 HydrophobicContact CG1-CE3 3.78Å; I73-W80 HydrophobicContact CG1-CZ3 4.08Å; C75-W80 HydrophobicContact CB-CE3 4.22Å; C75-W80 HydrophobicContact CB-CH2 3.95Å; C75-W80 HydrophobicContact CB-CZ2 4.48Å; C75-W80 HydrophobicContact CB-CZ3 3.82Å; W80-P82 CarbonylContact C-O 3.55Å; W80-P82 CarbonylContact O-C 3.52Å; W80-P82 VanDerWaalsContact O-C 3.26Å; W80-P83 WeakPolarHBondContact O-CA 3.38Å; W80-T84 HydrophobicContact CB-CG2 3.93Å; W80-T84 HydrophobicContact CG-CG2 4.01Å
81	V	80.1	Confident	78.6	Confident	79 Å²	79	57.6 Å²	57.6	48%	0.479	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	120	175.8	178.5	0	0	0	0	109	R74 T76	R74-V81 PolarHBondContact N-O 3.1Å; R74-V81 PolarHBondContact O-N 3.44Å; T76-V81 WeakPolarHBondContact OG1-CG2 3.31Å
82	P	76.7	Confident	78.5	Confident	49 Å²	49	57.3 Å²	57.3	32%	0.318	33%	0.332	S	S	.	.	S	Bend	cis	-65.8	162	-6.1	1.2	10.1	0	0	0	113.3	W80 L87	W80-P82 CarbonylContact C-O 3.55Å; W80-P82 CarbonylContact O-C 3.52Å; W80-P82 VanDerWaalsContact O-C 3.26Å; P82-L87 HydrophobicContact CB-CD2 3.89Å; P82-L87 HydrophobicContact CG-CD2 3.8Å
83	P	78.4	Confident	78.3	Confident	96 Å²	96	59 Å²	59	62%	0.623	34%	0.341	S	S	*	.			trans	-57.2	140.2	178.1	-20.5	30.9	0	0	0	112.2	W80 D85 L87	W80-P83 WeakPolarHBondContact O-CA 3.38Å; P83-D85 VanDerWaalsContact C-N 3.34Å; P83-D85 PolarHBondContact O-N 2.84Å; P83-L87 WeakPolarHBondContact O-CG 3.36Å
84	T	75.5	Confident	77.8	Confident	26 Å²	26	61 Å²	61	16%	0.16	35%	0.352	C	S	.	.	G	3₁₀ helix	trans	-66.9	-29.4	-173.6	47.1	0	0	0	0	114.9	P41 R42 P44 W80 G86 L87	P41-T84 HydrophobicContact CB-CG2 4.46Å; R42-T84 VanDerWaalsContact O-CB 3.29Å; R42-T84 WeakPolarHBondContact O-CB 3.2Å; P44-T84 WeakPolarHBondContact CD-O 3.12Å; W80-T84 HydrophobicContact CB-CG2 3.93Å; W80-T84 HydrophobicContact CG-CG2 4.01Å; T84-G86 PolarHBondContact O-N 3.42Å; T84-L87 HydrophobicContact CG2-CD1 4.37Å
85	D	74.6	Confident	77.3	Confident	143 Å²	143	54.5 Å²	54.5	77%	0.765	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-73.8	-8.8	-169.2	-59.9	-23.2	0	0	0	114.3	P83	P83-D85 VanDerWaalsContact C-N 3.34Å; P83-D85 PolarHBondContact O-N 2.84Å
86	G	72	Confident	76.7	Confident	34 Å²	34	57.8 Å²	57.8	35%	0.351	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-128.8	12.8	-178	0	0	0	0	0	115.2	S68 T84	S68-G86 PolarHBondContact OG-O 3.28Å; T84-G86 PolarHBondContact O-N 3.42Å
87	L	76.9	Confident	76.1	Confident	1 Å²	1	55.5 Å²	55.5	1%	0.005	34%	0.337	C	S	.	.	S	Bend	trans	-71.3	-40.1	-177.4	-64.1	170.5	0	0	0	112.5	V43 Y59 S68 I73 P82 P83 T84	V43-L87 HydrophobicContact CG1-CB 4.2Å; V43-L87 HydrophobicContact CG1-CD1 4.13Å; V43-L87 HydrophobicContact CG2-CD1 3.94Å; Y59-L87 HydrophobicContact CD1-CD1 4.31Å; Y59-L87 HydrophobicContact CE1-CD1 3.99Å; Y59-L87 HydrophobicContact CE1-CD2 4.19Å; Y59-L87 HydrophobicContact CE1-CG 4.49Å; Y59-L87 HydrophobicContact CE2-CB 3.86Å; Y59-L87 HydrophobicContact CE2-CD1 4.44Å; S68-L87 PolarHBondContact N-O 3.46Å; S68-L87 PolarHBondContact OG-O 3.46Å; I73-L87 HydrophobicContact CG2-CD1 3.47Å; I73-L87 VanDerWaalsContact CG2-CD1 3.47Å; I73-L87 HydrophobicContact CG2-CD2 4.02Å; I73-L87 HydrophobicContact CG2-CG 4.41Å; P82-L87 HydrophobicContact CB-CD2 3.89Å; P82-L87 HydrophobicContact CG-CD2 3.8Å; P83-L87 WeakPolarHBondContact O-CG 3.36Å; T84-L87 HydrophobicContact CG2-CD1 4.37Å
88	C	79.4	Confident	75.5	Confident	13 Å²	13	54.4 Å²	54.4	9%	0.088	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	95.1	-178.6	-64.4	0	0	0	0	110	N45 C61 F65	N45-C88 HydrophobicContact CB-CB 4.34Å; C61-C88 WeakPolarHBondContact CA-SG 3.43Å; C61-C88 HydrophobicContact CB-CB 3.8Å; C61-C88 WeakPolarHBondContact CB-SG 3.33Å; C61-C88 WeakPolarHBondContact SG-CA 3.26Å; C61-C88 WeakPolarHBondContact SG-CB 3.28Å; C61-C88 CovalentContact SG-SG 2.05Å; C61-C88 PolarHBondContact SG-SG 3.07Å; F65-C88 HydrophobicContact CB-CB 4.16Å; F65-C88 HydrophobicContact CD1-CB 4.28Å
89	L	76.9	Confident	74.9	Confident	35 Å²	35	55 Å²	55	18%	0.183	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	139	178.1	-64.4	178	0	0	0	109.8	F65 F66 P108 A121	F65-L89 CarbonylContact C-O 3.38Å; F65-L89 WeakPolarHBondContact CA-O 3.19Å; F66-L89 PolarHBondContact N-O 3.21Å; F66-L89 PolarHBondContact O-N 3.36Å; L89-P108 HydrophobicContact CD1-CB 4.31Å; L89-P108 HydrophobicContact CD1-CG 4.2Å; L89-A121 HydrophobicContact CB-CB 4.45Å; L89-A121 HydrophobicContact CD1-CB 4.19Å
90	R	77.5	Confident	74.7	Confident	97 Å²	97	53.2 Å²	53.2	37%	0.366	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	151.3	173	-81.6	-166.5	62.9	-161.1	-0.5	110.1	F65 S122 T147 D148	F65-R90 HydrophobicContact CD1-CB 4.47Å; F65-R90 HydrophobicContact CD1-CG 3.72Å; F65-R90 HydrophobicContact CE1-CB 4.27Å; F65-R90 HydrophobicContact CE1-CG 3.12Å; F65-R90 HydrophobicContact CE2-CG 4.4Å; F65-R90 HydrophobicContact CZ-CG 3.52Å; R90-S122 WeakPolarHBondContact O-CA 3.21Å; R90-S122 WeakPolarHBondContact O-CB 3.43Å; R90-S122 PolarHBondContact O-N 3.4Å; R90-S122 PolarHBondContact O-OG 3.09Å; R90-T147 VanDerWaalsContact CD-O 3.26Å; R90-T147 WeakPolarHBondContact CD-O 3.37Å; R90-T147 PolarHBondContact NH1-O 2.75Å; R90-D148 PolarHBondContact NH1-O 3.23Å; R90-D148 VanDerWaalsContact NH2-C 3.31Å; R90-D148 PolarHBondContact NH2-O 3.18Å
91	T	76.9	Confident	74.4	Confident	21 Å²	21	55.3 Å²	55.3	13%	0.129	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	150	-179.2	65.1	0	0	0	0	114.3	N64 F66 V119 F120	N64-T91 VanDerWaalsContact C-OG1 3.3Å; N64-T91 PolarHBondContact O-N 3.43Å; N64-T91 PolarHBondContact O-OG1 3.01Å; F66-T91 HydrophobicContact CB-CG2 3.37Å; T91-V119 HydrophobicContact CG2-CG1 3.41Å; T91-V119 VanDerWaalsContact CG2-CG1 3.41Å; T91-V119 WeakPolarHBondContact OG1-CG1 3.46Å; T91-F120 CarbonylContact C-O 3.45Å; T91-F120 WeakPolarHBondContact CA-O 3.2Å; T91-F120 WeakPolarHBondContact CB-O 3.39Å
92	C	80.1	Confident	74.3	Confident	2 Å²	2	54.1 Å²	54.1	1%	0.014	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	144	164.8	-57.5	0	0	0	0	109.8	F120 C145 G149 W151	C92-F120 PolarHBondContact N-O 2.99Å; C92-F120 PolarHBondContact O-N 3.18Å; C92-C145 HydrophobicContact CB-CB 3.85Å; C92-C145 WeakPolarHBondContact CB-SG 3.04Å; C92-C145 PolarHBondContact N-SG 3.46Å; C92-C145 WeakPolarHBondContact SG-CA 3.4Å; C92-C145 WeakPolarHBondContact SG-CB 3.07Å; C92-C145 CovalentContact SG-SG 2.03Å; C92-C145 PolarHBondContact SG-SG 3.35Å; C92-G149 VanDerWaalsContact SG-C 3.52Å; C92-W151 HydrophobicContact CB-CD2 3.89Å; C92-W151 HydrophobicContact CB-CE3 4.43Å; C92-W151 HydrophobicContact CB-CG 4.43Å; C92-W151 HydrophobicContact CB-CH2 4.14Å; C92-W151 HydrophobicContact CB-CZ2 3.49Å; C92-W151 VanDerWaalsContact CB-CZ2 3.49Å
93	E	78.5	Confident	74.1	Confident	140 Å²	140	55.6 Å²	55.6	65%	0.654	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.5	141.1	177.6	-170	168.3	-160	0	0	111.1	W151 A166	E93-W151 VanDerWaalsContact O-CZ2 3.3Å; E93-W151 WeakPolarHBondContact O-CZ2 3.38Å; E93-W151 PolarHBondContact O-NE1 3.42Å; E93-A166 HydrophobicContact CB-CB 3.92Å; E93-A166 HydrophobicContact CG-CB 4.3Å
94	D	74.1	Confident	74	Confident	43 Å²	43	54 Å²	54	23%	0.23	31%	0.313	C	S	.	.			trans	-67.5	154.4	176.5	-168	2.6	0	0	0	111.5	G118 F120	D94-G118 WeakPolarHBondContact CB-O 3.39Å; D94-G118 PolarHBondContact N-O 3.44Å; D94-F120 HydrophobicContact CB-CD2 4.17Å; D94-F120 HydrophobicContact CB-CE2 3.91Å; D94-F120 WeakPolarHBondContact OD1-CE2 3.49Å
95	F	73.5	Confident	74	Confident	3 Å²	3	56.4 Å²	56.4	1%	0.013	33%	0.328	C	S	.	.			trans	-144.7	139.1	-177.2	67	-79.9	0	0	0	110	P97 I102 F120 L126 V128 V143 W151 L169	F95-P97 HydrophobicContact CD2-CG 3.89Å; F95-P97 HydrophobicContact CE2-CG 4.17Å; F95-I102 HydrophobicContact CD2-CD1 4Å; F95-I102 HydrophobicContact CE2-CD1 3.63Å; F95-I102 HydrophobicContact CE2-CG1 4.25Å; F95-I102 HydrophobicContact CZ-CD1 4.08Å; F95-I102 WeakPolarHBondContact O-CD1 3.45Å; F95-F120 HydrophobicContact CD1-CE2 4.2Å; F95-F120 HydrophobicContact CE1-CE2 4.24Å; F95-L126 HydrophobicContact CE1-CD1 3.44Å; F95-L126 VanDerWaalsContact CE1-CD1 3.44Å; F95-L126 HydrophobicContact CZ-CD1 3.63Å; F95-V128 HydrophobicContact CE2-CG2 4.01Å; F95-V128 HydrophobicContact CZ-CG2 4.06Å; F95-V143 HydrophobicContact CE1-CG1 4.41Å; F95-V143 HydrophobicContact CZ-CG1 4.18Å; F95-W151 HydrophobicContact CD1-CH2 4.4Å; F95-W151 AromaticContact CD1-CZ2 3.84Å; F95-W151 HydrophobicContact CD1-CZ2 3.84Å; F95-W151 HydrophobicContact CE1-CD2 4.47Å; F95-W151 AromaticContact CE1-CH2 3.85Å; F95-W151 HydrophobicContact CE1-CH2 3.85Å; F95-W151 AromaticContact CE1-CZ2 3.74Å; F95-W151 HydrophobicContact CE1-CZ2 3.74Å; F95-W151 HydrophobicContact CE1-CZ3 4.28Å; F95-L169 HydrophobicContact CB-CB 4.12Å; F95-L169 HydrophobicContact CB-CD2 3.96Å; F95-L169 HydrophobicContact CB-CG 4.34Å; F95-L169 HydrophobicContact CD1-CD2 3.18Å; F95-L169 HydrophobicContact CD1-CG 4.17Å; F95-L169 HydrophobicContact CD2-CB 4.11Å; F95-L169 HydrophobicContact CD2-CD2 3.55Å; F95-L169 HydrophobicContact CD2-CG 3.58Å; F95-L169 HydrophobicContact CE1-CD2 3.35Å; F95-L169 HydrophobicContact CE1-CG 4.34Å; F95-L169 HydrophobicContact CE2-CD2 3.74Å; F95-L169 HydrophobicContact CE2-CG 3.82Å; F95-L169 HydrophobicContact CG-CB 4.11Å; F95-L169 HydrophobicContact CG-CD2 3.28Å; F95-L169 HydrophobicContact CG-CG 3.78Å; F95-L169 HydrophobicContact CZ-CD2 3.64Å; F95-L169 HydrophobicContact CZ-CG 4.19Å
96	S	68.2	Low	74	Confident	93 Å²	93	54.8 Å²	54.8	65%	0.65	32%	0.319	S	S	*	.			trans	-130.8	91.8	177.3	63.5	0	0	0	0	110.8
97	P	67.3	Low	74	Confident	10 Å²	10	55 Å²	55	7%	0.065	32%	0.315	C	S	.	.			trans	-71.4	137.1	177.2	-2.7	16.4	0	0	0	109.5	F95 S99 A100 I102	F95-P97 HydrophobicContact CD2-CG 3.89Å; F95-P97 HydrophobicContact CE2-CG 4.17Å; P97-S99 VanDerWaalsContact C-N 3.25Å; P97-S99 PolarHBondContact O-N 3.23Å; P97-A100 HydrophobicContact CB-CB 3.62Å; P97-A100 HydrophobicContact CG-CB 3.51Å; P97-A100 PolarHBondContact O-N 3.39Å; P97-I102 HydrophobicContact CG-CD1 4.46Å
98	P	63.3	Low	73.5	Confident	111 Å²	111	58.1 Å²	58.1	72%	0.721	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-27.9	-172.4	23.2	-33.5	0	0	0	113.9
99	S	65	Low	72.8	Confident	57 Å²	57	58.4 Å²	58.4	40%	0.399	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.3	31.9	-176.6	-51.8	0	0	0	0	113	P97 K131	P97-S99 VanDerWaalsContact C-N 3.25Å; P97-S99 PolarHBondContact O-N 3.23Å; S99-K131 PolarHBondContact O-N 3.42Å
100	A	73.6	Confident	72.1	Confident	25 Å²	25	62.5 Å²	62.5	21%	0.207	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	143.3	178.5	0	0	0	0	0	112.8	P97 V128 I129 C173	P97-A100 HydrophobicContact CB-CB 3.62Å; P97-A100 HydrophobicContact CG-CB 3.51Å; P97-A100 PolarHBondContact O-N 3.39Å; A100-V128 HydrophobicContact CB-CG1 3.68Å; A100-I129 WeakPolarHBondContact CA-O 3.47Å; A100-C173 VanDerWaalsContact CB-SG 3.51Å
101	V	74.6	Confident	71.3	Confident	84 Å²	84	63.3 Å²	63.3	51%	0.509	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	114	158.3	-178.1	0	0	0	0	107.6	L103 I129	V101-L103 HydrophobicContact CG1-CD2 4.15Å; V101-L103 HydrophobicContact CG1-CG 4.35Å; V101-I129 HydrophobicContact CB-CB 4.32Å; V101-I129 PolarHBondContact N-O 3.2Å; V101-I129 PolarHBondContact O-N 3.05Å
102	I	77.1	Confident	70.3	Confident	53 Å²	53	69.9 Å²	69.9	27%	0.272	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	123.5	174.6	-57.9	170.3	0	0	0	108.6	F95 P97 L126 V128	F95-I102 HydrophobicContact CD2-CD1 4Å; F95-I102 HydrophobicContact CE2-CD1 3.63Å; F95-I102 HydrophobicContact CE2-CG1 4.25Å; F95-I102 HydrophobicContact CZ-CD1 4.08Å; F95-I102 WeakPolarHBondContact O-CD1 3.45Å; P97-I102 HydrophobicContact CG-CD1 4.46Å; I102-L126 HydrophobicContact CG2-CB 4.14Å; I102-L126 HydrophobicContact CG2-CD1 4.2Å; I102-L126 HydrophobicContact CG2-CD2 4.19Å; I102-L126 HydrophobicContact CG2-CG 4.41Å; I102-V128 HydrophobicContact CG1-CG1 4.43Å; I102-V128 HydrophobicContact CG1-CG2 4.29Å
103	L	73.7	Confident	69.4	Low	80 Å²	80	70.5 Å²	70.5	42%	0.419	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	125.4	173.2	-60.7	174.6	0	0	0	108.9	V101 V105 L126 R127 I129	V101-L103 HydrophobicContact CG1-CD2 4.15Å; V101-L103 HydrophobicContact CG1-CG 4.35Å; L103-V105 PolarHBondContact O-N 2.95Å; L103-L126 CarbonylContact O-C 3.26Å; L103-L126 WeakPolarHBondContact O-CA 3.44Å; L103-R127 HydrophobicContact CB-CB 4.33Å; L103-R127 PolarHBondContact N-O 3.41Å; L103-R127 PolarHBondContact O-N 2.99Å; L103-I129 HydrophobicContact CD1-CD1 3.79Å
104	V	74.4	Confident	68.2	Low	62 Å²	62	65.3 Å²	65.3	38%	0.376	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	116.5	171	-173.9	0	0	0	0	108	P113 T124 L126	V104-P113 HydrophobicContact CG1-CG 3.71Å; V104-P113 HydrophobicContact CG2-CG 4.16Å; V104-T124 HydrophobicContact CG1-CG2 4.45Å; V104-L126 HydrophobicContact CB-CD2 4.12Å; V104-L126 HydrophobicContact CG1-CD2 4.18Å; V104-L126 HydrophobicContact CG2-CD2 3.72Å
105	V	75.5	Confident	67.2	Low	77 Å²	77	69 Å²	69	47%	0.467	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	-51.3	178.4	-179.2	0	0	0	0	109.5	L103 R125 R127	L103-V105 PolarHBondContact O-N 2.95Å; V105-R125 HydrophobicContact CB-CB 4.22Å; V105-R125 WeakPolarHBondContact CB-O 3.35Å; V105-R125 PolarHBondContact N-O 3.45Å; V105-R127 HydrophobicContact CG2-CB 3.55Å
106	N	75.2	Confident	66.3	Low	109 Å²	109	72.2 Å²	72.2	58%	0.583	46%	0.459	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-152.2	143.5	178.4	-83.8	-24	0	0	0	110.2	R125	N106-R125 PolarHBondContact N-O 3.33Å; N106-R125 PolarHBondContact O-N 3.48Å
107	S	72.1	Confident	66	Low	38 Å²	38	73.4 Å²	73.4	27%	0.266	46%	0.458	S	S	.	.			trans	-127.1	138.9	173.4	-173.1	0	0	0	0	110.5	T109 P113	S107-T109 PolarHBondContact O-N 3.48Å; S107-T109 PolarHBondContact OG-N 3.06Å; S107-T109 PolarHBondContact OG-OG1 3.32Å; S107-P113 WeakPolarHBondContact OG-CG 3.21Å
108	P	66.5	Low	65.9	Low	68 Å²	68	74.4 Å²	74.4	44%	0.442	47%	0.47	S	S	.	.	S	Bend	trans	-70.2	-11	171.9	28.3	-32.6	0	0	0	113	L89 A121 S122	L89-P108 HydrophobicContact CD1-CB 4.31Å; L89-P108 HydrophobicContact CD1-CG 4.2Å; P108-A121 HydrophobicContact CG-CB 4.12Å; P108-S122 WeakPolarHBondContact CG-O 3.45Å
109	T	64.8	Low	66.4	Low	18 Å²	18	71.4 Å²	71.4	11%	0.11	45%	0.45	C	S	.	.	S	Bend	trans	-107.4	147.3	-177.9	62.8	0	0	0	0	111.5	F66 S107 K111 A121	F66-T109 HydrophobicContact CD1-CG2 3.85Å; F66-T109 HydrophobicContact CE1-CG2 3.62Å; S107-T109 PolarHBondContact O-N 3.48Å; S107-T109 PolarHBondContact OG-N 3.06Å; S107-T109 PolarHBondContact OG-OG1 3.32Å; T109-K111 VanDerWaalsContact C-N 3.27Å; T109-K111 PolarHBondContact O-N 3.41Å; T109-K111 PolarHBondContact OG1-O 3.15Å; T109-A121 HydrophobicContact CG2-CB 3.94Å
110	S	61.9	Low	67.1	Low	121 Å²	121	69 Å²	69	85%	0.846	43%	0.432	S	S	*	.	S	Bend	trans	-69.8	-24.3	173.8	58.9	0	0	0	0	113.2
111	K	60.1	Low	67.2	Low	114 Å²	114	67.9 Å²	67.9	50%	0.496	42%	0.423	S	S	.	.	S	Bend	trans	-70.7	132.3	169.2	-67.3	177.6	-179.2	173.7	0	108.8	F66 T109 P113	F66-K111 HydrophobicContact CZ-CD 4.11Å; T109-K111 VanDerWaalsContact C-N 3.27Å; T109-K111 PolarHBondContact O-N 3.41Å; T109-K111 PolarHBondContact OG1-O 3.15Å; K111-P113 VanDerWaalsContact O-CD 3.31Å; K111-P113 WeakPolarHBondContact O-CD 3.34Å
112	L	56.7	Low	67.3	Low	160 Å²	160	64.6 Å²	64.6	84%	0.838	40%	0.404	S	S	*	.	P	Polyproline II helix	trans	-57.1	121.1	168.7	-91.3	97.7	0	0	0	108.1	G114	L112-G114 PolarHBondContact O-N 3.39Å
113	P	60.2	Low	67.4	Low	15 Å²	15	63.9 Å²	63.9	10%	0.097	41%	0.41	C	S	.	.	P	Polyproline II helix	trans	-72.2	125.5	171.6	31.8	-34	0	0	0	108.7	V104 S107 K111 F120 T124	V104-P113 HydrophobicContact CG1-CG 3.71Å; V104-P113 HydrophobicContact CG2-CG 4.16Å; S107-P113 WeakPolarHBondContact OG-CG 3.21Å; K111-P113 VanDerWaalsContact O-CD 3.31Å; K111-P113 WeakPolarHBondContact O-CD 3.34Å; P113-F120 HydrophobicContact CB-CD1 3.58Å; P113-F120 HydrophobicContact CB-CE1 3.83Å; P113-F120 HydrophobicContact CG-CD1 4.31Å; P113-F120 HydrophobicContact CG-CE1 4.37Å; P113-T124 HydrophobicContact CB-CG2 4.25Å; P113-T124 HydrophobicContact CG-CG2 3.78Å
114	G	53.2	Low	67.7	Low	30 Å²	30	60.1 Å²	60.1	31%	0.309	39%	0.39	S	S	.	.	S	Bend	trans	165.4	-173.1	-172.2	0	0	0	0	0	112.4	L112 G116	L112-G114 PolarHBondContact O-N 3.39Å; G114-G116 PolarHBondContact O-N 3.13Å
115	S	54.2	Low	67.9	Low	121 Å²	121	64 Å²	64	85%	0.846	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	37.6	-166.1	77.9	0	0	0	0	117.1
116	G	54.9	Low	68.1	Low	70 Å²	70	60.3 Å²	60.3	72%	0.722	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-46.3	163.1	0	0	0	0	0	111.9	G114	G114-G116 PolarHBondContact O-N 3.13Å
117	D	60.8	Low	68.3	Low	118 Å²	118	59.2 Å²	59.2	63%	0.631	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.8	-3.1	-174.3	-69.6	-29	0	0	0	114.2	V119	D117-V119 VanDerWaalsContact C-N 3.33Å; D117-V119 PolarHBondContact O-N 3.08Å
118	G	65.8	Low	68.8	Low	31 Å²	31	57.4 Å²	57.4	32%	0.32	35%	0.351	S	S	.	.	S	Bend	trans	69.2	23.3	175	0	0	0	0	0	115.2	D94	D94-G118 WeakPolarHBondContact CB-O 3.39Å; D94-G118 PolarHBondContact N-O 3.44Å
119	V	73.7	Confident	69.2	Low	48 Å²	48	55.5 Å²	55.5	29%	0.291	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	136.9	-172.3	-177.1	0	0	0	0	111.4	T91 D117	T91-V119 HydrophobicContact CG2-CG1 3.41Å; T91-V119 VanDerWaalsContact CG2-CG1 3.41Å; T91-V119 WeakPolarHBondContact OG1-CG1 3.46Å; D117-V119 VanDerWaalsContact C-N 3.33Å; D117-V119 PolarHBondContact O-N 3.08Å
120	F	79	Confident	69.8	Low	6 Å²	6	54.6 Å²	54.6	3%	0.026	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	138	178	-70.9	-87.3	0	0	0	112.4	T91 C92 D94 F95 P113 T124 L126 W151	T91-F120 CarbonylContact C-O 3.45Å; T91-F120 WeakPolarHBondContact CA-O 3.2Å; T91-F120 WeakPolarHBondContact CB-O 3.39Å; C92-F120 PolarHBondContact N-O 2.99Å; C92-F120 PolarHBondContact O-N 3.18Å; D94-F120 HydrophobicContact CB-CD2 4.17Å; D94-F120 HydrophobicContact CB-CE2 3.91Å; D94-F120 WeakPolarHBondContact OD1-CE2 3.49Å; F95-F120 HydrophobicContact CD1-CE2 4.2Å; F95-F120 HydrophobicContact CE1-CE2 4.24Å; P113-F120 HydrophobicContact CB-CD1 3.58Å; P113-F120 HydrophobicContact CB-CE1 3.83Å; P113-F120 HydrophobicContact CG-CD1 4.31Å; P113-F120 HydrophobicContact CG-CE1 4.37Å; F120-T124 HydrophobicContact CD1-CG2 3.91Å; F120-L126 HydrophobicContact CD1-CD1 4.16Å; F120-L126 HydrophobicContact CD1-CD2 4.35Å; F120-L126 HydrophobicContact CE1-CD1 3.75Å; F120-L126 HydrophobicContact CE1-CD2 3.77Å; F120-L126 HydrophobicContact CE1-CG 4.3Å; F120-L126 HydrophobicContact CE2-CD1 4.15Å; F120-L126 HydrophobicContact CZ-CD1 3.72Å; F120-L126 HydrophobicContact CZ-CD2 4.38Å; F120-W151 HydrophobicContact CB-CH2 3.61Å; F120-W151 HydrophobicContact CB-CZ2 3.89Å; F120-W151 HydrophobicContact CD1-CH2 4.12Å; F120-W151 AromaticContact CD2-CH2 3.47Å; F120-W151 HydrophobicContact CD2-CH2 3.47Å; F120-W151 VanDerWaalsContact CD2-CH2 3.47Å; F120-W151 AromaticContact CD2-CZ2 3.35Å; F120-W151 HydrophobicContact CD2-CZ2 3.35Å; F120-W151 HydrophobicContact CE2-CH2 4.05Å; F120-W151 HydrophobicContact CE2-CZ2 4Å; F120-W151 AromaticContact CG-CH2 3.48Å; F120-W151 HydrophobicContact CG-CH2 3.48Å; F120-W151 VanDerWaalsContact CG-CH2 3.48Å; F120-W151 AromaticContact CG-CZ2 3.8Å; F120-W151 HydrophobicContact CG-CZ2 3.8Å
121	A	77.6	Confident	70	Confident	3 Å²	3	55.7 Å²	55.7	3%	0.025	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	146.4	174.8	0	0	0	0	0	112.4	F66 L89 P108 T109 G123 T124	F66-A121 HydrophobicContact CB-CB 4.41Å; F66-A121 HydrophobicContact CD1-CB 4.23Å; F66-A121 HydrophobicContact CG-CB 4.49Å; L89-A121 HydrophobicContact CB-CB 4.45Å; L89-A121 HydrophobicContact CD1-CB 4.19Å; P108-A121 HydrophobicContact CG-CB 4.12Å; T109-A121 HydrophobicContact CG2-CB 3.94Å; A121-G123 PolarHBondContact O-N 2.85Å; A121-T124 VanDerWaalsContact O-CB 3.32Å; A121-T124 WeakPolarHBondContact O-CB 3.37Å; A121-T124 PolarHBondContact O-N 3.31Å; A121-T124 PolarHBondContact O-OG1 3.48Å
122	S	76.6	Confident	70.4	Confident	15 Å²	15	51.2 Å²	51.2	11%	0.105	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	129.4	174.6	61.3	0	0	0	0	111	R90 P108 C145	R90-S122 WeakPolarHBondContact O-CA 3.21Å; R90-S122 WeakPolarHBondContact O-CB 3.43Å; R90-S122 PolarHBondContact O-N 3.4Å; R90-S122 PolarHBondContact O-OG 3.09Å; P108-S122 WeakPolarHBondContact CG-O 3.45Å; S122-C145 VanDerWaalsContact CA-SG 3.59Å
123	G	78.4	Confident	70.4	Confident	38 Å²	38	52 Å²	52	39%	0.392	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	98	-8.8	-173.5	0	0	0	0	0	114.2	A121 R125 C145	A121-G123 PolarHBondContact O-N 2.85Å; G123-R125 PolarHBondContact O-N 2.95Å; G123-C145 PolarHBondContact N-O 2.91Å
124	T	79.2	Confident	70.3	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	34%	0.339	C	S	.	.			trans	-63.1	131.6	174.6	-53.9	0	0	0	0	110.4	V104 P113 F120 A121 L126 V144 C145	V104-T124 HydrophobicContact CG1-CG2 4.45Å; P113-T124 HydrophobicContact CB-CG2 4.25Å; P113-T124 HydrophobicContact CG-CG2 3.78Å; F120-T124 HydrophobicContact CD1-CG2 3.91Å; A121-T124 VanDerWaalsContact O-CB 3.32Å; A121-T124 WeakPolarHBondContact O-CB 3.37Å; A121-T124 PolarHBondContact O-N 3.31Å; A121-T124 PolarHBondContact O-OG1 3.48Å; T124-L126 HydrophobicContact CG2-CD2 3.93Å; T124-L126 HydrophobicContact CG2-CG 4.28Å; T124-V144 WeakPolarHBondContact O-CA 3.32Å; T124-C145 PolarHBondContact O-N 2.88Å
125	R	78.6	Confident	70.4	Confident	143 Å²	143	59.2 Å²	59.2	54%	0.54	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	123.3	176.3	-57.5	-171	179.4	-156.8	-1.9	109.6	V105 N106 G123 V144	V105-R125 HydrophobicContact CB-CB 4.22Å; V105-R125 WeakPolarHBondContact CB-O 3.35Å; V105-R125 PolarHBondContact N-O 3.45Å; N106-R125 PolarHBondContact N-O 3.33Å; N106-R125 PolarHBondContact O-N 3.48Å; G123-R125 PolarHBondContact O-N 2.95Å; R125-V144 HydrophobicContact CG-CG1 4.27Å; R125-V144 HydrophobicContact CG-CG2 4.04Å
126	L	81.6	Confident	70.3	Confident	0 Å²	0	63 Å²	63	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	145.2	178.5	-55.4	174.6	0	0	0	109.1	F95 I102 L103 V104 F120 T124 S142 V143 W151	F95-L126 HydrophobicContact CE1-CD1 3.44Å; F95-L126 VanDerWaalsContact CE1-CD1 3.44Å; F95-L126 HydrophobicContact CZ-CD1 3.63Å; I102-L126 HydrophobicContact CG2-CB 4.14Å; I102-L126 HydrophobicContact CG2-CD1 4.2Å; I102-L126 HydrophobicContact CG2-CD2 4.19Å; I102-L126 HydrophobicContact CG2-CG 4.41Å; L103-L126 CarbonylContact O-C 3.26Å; L103-L126 WeakPolarHBondContact O-CA 3.44Å; V104-L126 HydrophobicContact CB-CD2 4.12Å; V104-L126 HydrophobicContact CG1-CD2 4.18Å; V104-L126 HydrophobicContact CG2-CD2 3.72Å; F120-L126 HydrophobicContact CD1-CD1 4.16Å; F120-L126 HydrophobicContact CD1-CD2 4.35Å; F120-L126 HydrophobicContact CE1-CD1 3.75Å; F120-L126 HydrophobicContact CE1-CD2 3.77Å; F120-L126 HydrophobicContact CE1-CG 4.3Å; F120-L126 HydrophobicContact CE2-CD1 4.15Å; F120-L126 HydrophobicContact CZ-CD1 3.72Å; F120-L126 HydrophobicContact CZ-CD2 4.38Å; T124-L126 HydrophobicContact CG2-CD2 3.93Å; T124-L126 HydrophobicContact CG2-CG 4.28Å; L126-S142 CarbonylContact O-C 3.53Å; L126-S142 WeakPolarHBondContact O-CA 3.31Å; L126-V143 HydrophobicContact CB-CB 4.31Å; L126-V143 PolarHBondContact N-O 3.41Å; L126-V143 PolarHBondContact O-N 3.34Å; L126-W151 HydrophobicContact CD1-CH2 3.68Å; L126-W151 HydrophobicContact CD1-CZ3 3.9Å
127	R	78.4	Confident	70.5	Confident	87 Å²	87	66 Å²	66	33%	0.328	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	115.1	169.8	-172	176.4	-163.3	-161.3	0.1	108.2	L103 V105 Y141 E156	L103-R127 HydrophobicContact CB-CB 4.33Å; L103-R127 PolarHBondContact N-O 3.41Å; L103-R127 PolarHBondContact O-N 2.99Å; V105-R127 HydrophobicContact CG2-CB 3.55Å; R127-Y141 CarbonylContact C-O 3.55Å; R127-Y141 WeakPolarHBondContact CA-O 3.2Å; R127-E156 IonicContact CZ-OE1 2.7Å; R127-E156 IonicContact CZ-OE2 3.69Å; R127-E156 IonicContact NE-OE1 3.97Å; R127-E156 PolarHBondContact NE-OE1 3.45Å; R127-E156 IonicContact NE-OE2 3.18Å; R127-E156 PolarHBondContact NE-OE2 3.27Å; R127-E156 IonicContact NH2-OE1 2.75Å; R127-E156 IonicContact NH2-OE2 3.61Å; R127-E156 PolarHBondContact NH2-OE2 3.22Å
128	V	82.4	Confident	70.8	Confident	0 Å²	0	68.3 Å²	68.3	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	118	-178	-173.3	0	0	0	0	108.2	F95 A100 I102 Y141 V143	F95-V128 HydrophobicContact CE2-CG2 4.01Å; F95-V128 HydrophobicContact CZ-CG2 4.06Å; A100-V128 HydrophobicContact CB-CG1 3.68Å; I102-V128 HydrophobicContact CG1-CG1 4.43Å; I102-V128 HydrophobicContact CG1-CG2 4.29Å; V128-Y141 PolarHBondContact N-O 3.28Å; V128-Y141 PolarHBondContact O-N 3.32Å; V128-V143 HydrophobicContact CB-CG2 4.48Å; V128-V143 HydrophobicContact CG2-CB 4.32Å; V128-V143 HydrophobicContact CG2-CG2 3.62Å
129	I	74.6	Confident	70.9	Confident	27 Å²	27	67.9 Å²	67.9	14%	0.138	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	107.7	177	-51.6	176.8	0	0	0	107.8	A100 V101 L103 R138 L139 F140	A100-I129 WeakPolarHBondContact CA-O 3.47Å; V101-I129 HydrophobicContact CB-CB 4.32Å; V101-I129 PolarHBondContact N-O 3.2Å; V101-I129 PolarHBondContact O-N 3.05Å; L103-I129 HydrophobicContact CD1-CD1 3.79Å; I129-R138 HydrophobicContact CG2-CB 4.28Å; I129-L139 WeakPolarHBondContact CA-O 3.3Å; I129-F140 HydrophobicContact CD1-CD1 4.39Å; I129-F140 HydrophobicContact CD1-CE1 4.15Å; I129-F140 HydrophobicContact CG1-CD1 3.91Å; I129-F140 HydrophobicContact CG1-CE1 4.1Å; I129-F140 HydrophobicContact CG2-CD1 4.32Å; I129-F140 HydrophobicContact CG2-CE1 4.1Å
130	C	77.8	Confident	71	Confident	0 Å²	0	69 Å²	69	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	127.4	174.7	-65.9	0	0	0	0	110.5	L139 Y141 C173	C130-L139 HydrophobicContact CB-CB 4.31Å; C130-L139 PolarHBondContact N-O 3.3Å; C130-L139 PolarHBondContact O-N 3.16Å; C130-Y141 HydrophobicContact CB-CE2 4.39Å; C130-Y141 VanDerWaalsContact SG-CE2 3.57Å; C130-C173 WeakPolarHBondContact CA-SG 3.48Å; C130-C173 HydrophobicContact CB-CB 3.73Å; C130-C173 WeakPolarHBondContact CB-SG 3.49Å; C130-C173 WeakPolarHBondContact SG-CA 3.37Å; C130-C173 WeakPolarHBondContact SG-CB 3.24Å; C130-C173 CovalentContact SG-SG 2.04Å; C130-C173 PolarHBondContact SG-SG 2.95Å
131	K	66.6	Low	71	Confident	143 Å²	143	68.8 Å²	68.8	62%	0.622	34%	0.339	S	S	*	.			trans	-100.4	103	168.2	-174.1	-174.5	176	-167.2	0	108.2	S99	S99-K131 PolarHBondContact O-N 3.42Å
132	I	67.4	Low	71	Confident	20 Å²	20	70.1 Å²	70.1	10%	0.103	35%	0.349	C	S	.	.			trans	-88.4	121.9	177.1	-55.5	168.1	0	0	0	108.7	G134 L135 L139	I132-G134 PolarHBondContact O-N 3.19Å; I132-L135 HydrophobicContact CB-CB 4.4Å; I132-L135 HydrophobicContact CB-CD1 4.35Å; I132-L135 HydrophobicContact CD1-CD1 4.1Å; I132-L135 HydrophobicContact CG2-CD1 3.96Å; I132-L135 PolarHBondContact O-N 2.96Å; I132-L139 HydrophobicContact CD1-CD1 3.66Å; I132-L139 HydrophobicContact CD1-CG 4.27Å
133	E	57.9	Low	71.4	Confident	176 Å²	176	69.4 Å²	69.4	82%	0.822	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	119.4	172.9	-66.3	-168.8	157.3	0	0	109.9
134	G	58.7	Low	71.6	Confident	87 Å²	87	68.9 Å²	68.9	90%	0.897	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	108.9	-15.3	-179.8	0	0	0	0	0	115.6	I132	I132-G134 PolarHBondContact O-N 3.19Å
135	L	54	Low	71.7	Confident	110 Å²	110	69 Å²	69	58%	0.576	33%	0.333	S	S	*	.			trans	-109.9	130.1	174.7	-80.3	155	0	0	0	110	I132 K137	I132-L135 HydrophobicContact CB-CB 4.4Å; I132-L135 HydrophobicContact CB-CD1 4.35Å; I132-L135 HydrophobicContact CD1-CD1 4.1Å; I132-L135 HydrophobicContact CG2-CD1 3.96Å; I132-L135 PolarHBondContact O-N 2.96Å; L135-K137 PolarHBondContact O-N 3.24Å; L135-K137 VanDerWaalsContact O-N 3.12Å
136	Q	52.7	Low	71.7	Confident	202 Å²	202	63 Å²	63	94%	0.944	31%	0.313	S	S	*	.	S	Bend	trans	-69.6	-1	172.2	-69	-67.7	-31.7	0	0	112.9
137	K	59.8	Low	71.4	Confident	132 Å²	132	68.1 Å²	68.1	57%	0.574	34%	0.344	S	S	*	.			trans	-104.3	127.7	-176.1	-163.8	178.9	-179.7	-169.8	0	110.2	L135	L135-K137 PolarHBondContact O-N 3.24Å; L135-K137 VanDerWaalsContact O-N 3.12Å
138	R	66.6	Low	71.2	Confident	166 Å²	166	68.9 Å²	68.9	63%	0.626	36%	0.355	S	S	*	.			trans	-86.1	138.3	168.1	-61.6	-179.3	-175.5	-175	0.8	108.7	I129 F140	I129-R138 HydrophobicContact CG2-CB 4.28Å; R138-F140 HydrophobicContact CB-CE2 4.28Å; R138-F140 HydrophobicContact CB-CZ 4.22Å
139	L	68.5	Low	70.7	Confident	23 Å²	23	69.9 Å²	69.9	12%	0.12	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	140.8	171.9	-65.3	174.6	0	0	0	109.3	I129 C130 I132 Y141 N178	I129-L139 WeakPolarHBondContact CA-O 3.3Å; C130-L139 HydrophobicContact CB-CB 4.31Å; C130-L139 PolarHBondContact N-O 3.3Å; C130-L139 PolarHBondContact O-N 3.16Å; I132-L139 HydrophobicContact CD1-CD1 3.66Å; I132-L139 HydrophobicContact CD1-CG 4.27Å; L139-Y141 HydrophobicContact CB-CD2 4.41Å; L139-Y141 HydrophobicContact CB-CE2 3.68Å; L139-Y141 HydrophobicContact CD1-CE2 4.31Å; L139-N178 WeakPolarHBondContact CD1-OD1 3.46Å
140	F	75.2	Confident	70.8	Confident	72 Å²	72	75.6 Å²	75.6	32%	0.316	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	123.3	179.5	-56.7	-90.2	0	0	0	108.8	I129 R138 E156	I129-F140 HydrophobicContact CD1-CD1 4.39Å; I129-F140 HydrophobicContact CD1-CE1 4.15Å; I129-F140 HydrophobicContact CG1-CD1 3.91Å; I129-F140 HydrophobicContact CG1-CE1 4.1Å; I129-F140 HydrophobicContact CG2-CD1 4.32Å; I129-F140 HydrophobicContact CG2-CE1 4.1Å; R138-F140 HydrophobicContact CB-CE2 4.28Å; R138-F140 HydrophobicContact CB-CZ 4.22Å; F140-E156 HydrophobicContact CB-CB 3.98Å; F140-E156 VanDerWaalsContact CB-CD 3.49Å; F140-E156 HydrophobicContact CB-CG 3.97Å; F140-E156 WeakPolarHBondContact CB-OE2 3.24Å; F140-E156 WeakPolarHBondContact O-CB 3.38Å; F140-E156 PolarHBondContact O-N 3.22Å
141	Y	77.9	Confident	70.9	Confident	0 Å²	0	75.8 Å²	75.8	0%	0	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	134.3	174.5	-59.9	-96.2	0	0	0	109.1	R127 V128 C130 L139 V153 T154 R155 L172 N178	R127-Y141 CarbonylContact C-O 3.55Å; R127-Y141 WeakPolarHBondContact CA-O 3.2Å; V128-Y141 PolarHBondContact N-O 3.28Å; V128-Y141 PolarHBondContact O-N 3.32Å; C130-Y141 HydrophobicContact CB-CE2 4.39Å; C130-Y141 VanDerWaalsContact SG-CE2 3.57Å; L139-Y141 HydrophobicContact CB-CD2 4.41Å; L139-Y141 HydrophobicContact CB-CE2 3.68Å; L139-Y141 HydrophobicContact CD1-CE2 4.31Å; Y141-V153 HydrophobicContact CD1-CG1 3.74Å; Y141-V153 HydrophobicContact CG-CG1 4.36Å; Y141-T154 CarbonylContact C-O 3.6Å; Y141-T154 VanDerWaalsContact CA-O 3.25Å; Y141-T154 WeakPolarHBondContact CA-O 3.35Å; Y141-R155 HydrophobicContact CD1-CB 4.24Å; Y141-R155 HydrophobicContact CD1-CG 3.81Å; Y141-R155 HydrophobicContact CE1-CB 4.25Å; Y141-R155 HydrophobicContact CE1-CG 3.52Å; Y141-L172 HydrophobicContact CD1-CD2 4.07Å; Y141-L172 HydrophobicContact CE1-CD2 3.97Å; Y141-L172 HydrophobicContact CG-CD2 4.45Å; Y141-N178 PolarHBondContact OH-OD1 2.71Å
142	S	78.5	Confident	71.4	Confident	32 Å²	32	70.8 Å²	70.8	22%	0.224	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	121.6	167.2	152.2	0	0	0	0	108.2	L126 T154	L126-S142 CarbonylContact O-C 3.53Å; L126-S142 WeakPolarHBondContact O-CA 3.31Å; S142-T154 WeakPolarHBondContact CB-OG1 3.2Å; S142-T154 PolarHBondContact N-O 3.24Å; S142-T154 PolarHBondContact O-N 3.22Å; S142-T154 PolarHBondContact O-OG1 3.12Å; S142-T154 PolarHBondContact OG-OG1 3.29Å; S142-T154 VanDerWaalsContact OG-OG1 3.08Å
143	V	83.7	Confident	72	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	123	-174.4	-178.7	0	0	0	0	108.4	F95 L126 V128 W151 Q152 V153 L169	F95-V143 HydrophobicContact CE1-CG1 4.41Å; F95-V143 HydrophobicContact CZ-CG1 4.18Å; L126-V143 HydrophobicContact CB-CB 4.31Å; L126-V143 PolarHBondContact N-O 3.41Å; L126-V143 PolarHBondContact O-N 3.34Å; V128-V143 HydrophobicContact CB-CG2 4.48Å; V128-V143 HydrophobicContact CG2-CB 4.32Å; V128-V143 HydrophobicContact CG2-CG2 3.62Å; V143-W151 HydrophobicContact CG1-CB 4.36Å; V143-W151 HydrophobicContact CG1-CD2 4.04Å; V143-W151 HydrophobicContact CG1-CE3 3.38Å; V143-W151 HydrophobicContact CG1-CZ3 3.86Å; V143-Q152 CarbonylContact C-O 3.53Å; V143-Q152 WeakPolarHBondContact CA-O 3.32Å; V143-V153 HydrophobicContact CG1-CG2 4.34Å; V143-V153 HydrophobicContact CG2-CG1 4.2Å; V143-V153 HydrophobicContact CG2-CG2 4.15Å; V143-L169 HydrophobicContact CG1-CD1 4.32Å; V143-L169 HydrophobicContact CG1-CD2 4.19Å
144	V	84.2	Confident	72.7	Confident	27 Å²	27	62.7 Å²	62.7	16%	0.164	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	129.6	-175.8	-174.4	0	0	0	0	109.9	T124 R125 T146 Q152	T124-V144 WeakPolarHBondContact O-CA 3.32Å; R125-V144 HydrophobicContact CG-CG1 4.27Å; R125-V144 HydrophobicContact CG-CG2 4.04Å; V144-T146 PolarHBondContact O-N 3.31Å; V144-Q152 PolarHBondContact N-O 2.85Å; V144-Q152 PolarHBondContact O-N 2.82Å
145	C	81.6	Confident	73.1	Confident	1 Å²	1	59.6 Å²	59.6	1%	0.007	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	116.3	171.2	178.6	0	0	0	0	109.1	C92 S122 G123 T124 W151	C92-C145 HydrophobicContact CB-CB 3.85Å; C92-C145 WeakPolarHBondContact CB-SG 3.04Å; C92-C145 PolarHBondContact N-SG 3.46Å; C92-C145 WeakPolarHBondContact SG-CA 3.4Å; C92-C145 WeakPolarHBondContact SG-CB 3.07Å; C92-C145 CovalentContact SG-SG 2.03Å; C92-C145 PolarHBondContact SG-SG 3.35Å; S122-C145 VanDerWaalsContact CA-SG 3.59Å; G123-C145 PolarHBondContact N-O 2.91Å; T124-C145 PolarHBondContact O-N 2.88Å; C145-W151 HydrophobicContact CB-CE3 3.96Å; C145-W151 HydrophobicContact CB-CH2 4.12Å; C145-W151 HydrophobicContact CB-CZ3 3.67Å
146	T	77.9	Confident	73.7	Confident	19 Å²	19	58.3 Å²	58.3	12%	0.117	28%	0.28	C	S	.	.			trans	-80.7	166.5	-178.5	66.3	0	0	0	0	112.4	V144 D148 G149 R150 Q152 F163	V144-T146 PolarHBondContact O-N 3.31Å; T146-D148 PolarHBondContact O-N 3.27Å; T146-D148 VanDerWaalsContact O-N 3.15Å; T146-D148 PolarHBondContact OG1-N 3.43Å; T146-G149 PolarHBondContact O-N 3.41Å; T146-R150 PolarHBondContact N-O 3.16Å; T146-R150 PolarHBondContact OG1-N 3.22Å; T146-R150 PolarHBondContact OG1-O 3.47Å; T146-R150 VanDerWaalsContact OG1-O 3.11Å; T146-Q152 HydrophobicContact CG2-CB 3.96Å; T146-F163 HydrophobicContact CG2-CE1 3.95Å
147	T	75.1	Confident	73.9	Confident	107 Å²	107	52.1 Å²	52.1	66%	0.656	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-20.7	170.4	51.3	0	0	0	0	112.2	R90 G149	R90-T147 VanDerWaalsContact CD-O 3.26Å; R90-T147 WeakPolarHBondContact CD-O 3.37Å; R90-T147 PolarHBondContact NH1-O 2.75Å; T147-G149 VanDerWaalsContact C-N 3.25Å; T147-G149 PolarHBondContact O-N 2.88Å
148	D	73.4	Confident	73.7	Confident	102 Å²	102	48.4 Å²	48.4	55%	0.545	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	4.9	177.2	-64.9	-21.6	0	0	0	113.5	R90 T146 R150	R90-D148 PolarHBondContact NH1-O 3.23Å; R90-D148 VanDerWaalsContact NH2-C 3.31Å; R90-D148 PolarHBondContact NH2-O 3.18Å; T146-D148 PolarHBondContact O-N 3.27Å; T146-D148 VanDerWaalsContact O-N 3.15Å; T146-D148 PolarHBondContact OG1-N 3.43Å; D148-R150 PolarHBondContact O-N 3.01Å
149	G	73.6	Confident	73.2	Confident	21 Å²	21	42.7 Å²	42.7	22%	0.216	23%	0.233	C	C	.	.	S	Bend	trans	65.8	23.8	-178.7	0	0	0	0	0	113.5	C92 T146 T147	C92-G149 VanDerWaalsContact SG-C 3.52Å; T146-G149 PolarHBondContact O-N 3.41Å; T147-G149 VanDerWaalsContact C-N 3.25Å; T147-G149 PolarHBondContact O-N 2.88Å
150	R	76.4	Confident	72.6	Confident	147 Å²	147	43.2 Å²	43.2	56%	0.555	24%	0.236	S	C	*	.			trans	-111.3	152.8	175.6	-69.1	-176.1	176.2	178.1	-1.7	110.2	T146 D148	T146-R150 PolarHBondContact N-O 3.16Å; T146-R150 PolarHBondContact OG1-N 3.22Å; T146-R150 PolarHBondContact OG1-O 3.47Å; T146-R150 VanDerWaalsContact OG1-O 3.11Å; D148-R150 PolarHBondContact O-N 3.01Å
151	W	80.2	Confident	71.8	Confident	4 Å²	4	40.9 Å²	40.9	2%	0.015	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	122.8	173.9	-69.6	113.1	0	0	0	110.5	C92 E93 F95 F120 L126 V143 C145 F163 V164 L169	C92-W151 HydrophobicContact CB-CD2 3.89Å; C92-W151 HydrophobicContact CB-CE3 4.43Å; C92-W151 HydrophobicContact CB-CG 4.43Å; C92-W151 HydrophobicContact CB-CH2 4.14Å; C92-W151 HydrophobicContact CB-CZ2 3.49Å; C92-W151 VanDerWaalsContact CB-CZ2 3.49Å; E93-W151 VanDerWaalsContact O-CZ2 3.3Å; E93-W151 WeakPolarHBondContact O-CZ2 3.38Å; E93-W151 PolarHBondContact O-NE1 3.42Å; F95-W151 HydrophobicContact CD1-CH2 4.4Å; F95-W151 AromaticContact CD1-CZ2 3.84Å; F95-W151 HydrophobicContact CD1-CZ2 3.84Å; F95-W151 HydrophobicContact CE1-CD2 4.47Å; F95-W151 AromaticContact CE1-CH2 3.85Å; F95-W151 HydrophobicContact CE1-CH2 3.85Å; F95-W151 AromaticContact CE1-CZ2 3.74Å; F95-W151 HydrophobicContact CE1-CZ2 3.74Å; F95-W151 HydrophobicContact CE1-CZ3 4.28Å; F120-W151 HydrophobicContact CB-CH2 3.61Å; F120-W151 HydrophobicContact CB-CZ2 3.89Å; F120-W151 HydrophobicContact CD1-CH2 4.12Å; F120-W151 AromaticContact CD2-CH2 3.47Å; F120-W151 HydrophobicContact CD2-CH2 3.47Å; F120-W151 VanDerWaalsContact CD2-CH2 3.47Å; F120-W151 AromaticContact CD2-CZ2 3.35Å; F120-W151 HydrophobicContact CD2-CZ2 3.35Å; F120-W151 HydrophobicContact CE2-CH2 4.05Å; F120-W151 HydrophobicContact CE2-CZ2 4Å; F120-W151 AromaticContact CG-CH2 3.48Å; F120-W151 HydrophobicContact CG-CH2 3.48Å; F120-W151 VanDerWaalsContact CG-CH2 3.48Å; F120-W151 AromaticContact CG-CZ2 3.8Å; F120-W151 HydrophobicContact CG-CZ2 3.8Å; L126-W151 HydrophobicContact CD1-CH2 3.68Å; L126-W151 HydrophobicContact CD1-CZ3 3.9Å; V143-W151 HydrophobicContact CG1-CB 4.36Å; V143-W151 HydrophobicContact CG1-CD2 4.04Å; V143-W151 HydrophobicContact CG1-CE3 3.38Å; V143-W151 HydrophobicContact CG1-CZ3 3.86Å; C145-W151 HydrophobicContact CB-CE3 3.96Å; C145-W151 HydrophobicContact CB-CH2 4.12Å; C145-W151 HydrophobicContact CB-CZ3 3.67Å; W151-F163 WeakPolarHBondContact O-CA 3.41Å; W151-V164 PolarHBondContact N-O 3.15Å; W151-V164 PolarHBondContact O-N 3.11Å; W151-L169 HydrophobicContact CB-CD1 4.32Å; W151-L169 HydrophobicContact CB-CD2 4.04Å; W151-L169 HydrophobicContact CD2-CD2 3.86Å; W151-L169 HydrophobicContact CG-CD2 3.58Å
152	Q	77.1	Confident	71.4	Confident	39 Å²	39	43.4 Å²	43.4	18%	0.182	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	117	168.2	-173.5	-178.6	0.6	0	0	108.6	V143 V144 T146 S161 I162 F163	V143-Q152 CarbonylContact C-O 3.53Å; V143-Q152 WeakPolarHBondContact CA-O 3.32Å; V144-Q152 PolarHBondContact N-O 2.85Å; V144-Q152 PolarHBondContact O-N 2.82Å; T146-Q152 HydrophobicContact CG2-CB 3.96Å; Q152-S161 PolarHBondContact NE2-OG 3.4Å; Q152-S161 VanDerWaalsContact NE2-OG 3.11Å; Q152-I162 WeakPolarHBondContact CA-O 3.1Å; Q152-F163 HydrophobicContact CB-CD1 4.19Å; Q152-F163 HydrophobicContact CB-CE1 4.06Å; Q152-F163 HydrophobicContact CG-CD1 4.48Å; Q152-F163 HydrophobicContact CG-CE1 4.17Å
153	V	79.3	Confident	70.9	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	122.2	179.4	-177.5	0	0	0	0	108.8	Y141 V143 S161 I162 V164 L169 L172 W181	Y141-V153 HydrophobicContact CD1-CG1 3.74Å; Y141-V153 HydrophobicContact CG-CG1 4.36Å; V143-V153 HydrophobicContact CG1-CG2 4.34Å; V143-V153 HydrophobicContact CG2-CG1 4.2Å; V143-V153 HydrophobicContact CG2-CG2 4.15Å; V153-S161 CarbonylContact O-C 3.53Å; V153-S161 VanDerWaalsContact O-CA 3.25Å; V153-S161 WeakPolarHBondContact O-CA 3.28Å; V153-I162 PolarHBondContact N-O 3.44Å; V153-I162 PolarHBondContact O-N 3.44Å; V153-V164 HydrophobicContact CB-CG2 4.1Å; V153-V164 HydrophobicContact CG2-CB 4.1Å; V153-V164 HydrophobicContact CG2-CG2 3.68Å; V153-L169 HydrophobicContact CG2-CD1 3.32Å; V153-L172 HydrophobicContact CG1-CD1 4.34Å; V153-L172 HydrophobicContact CG1-CD2 3.94Å; V153-L172 HydrophobicContact CG2-CD1 4.28Å; V153-W181 HydrophobicContact CB-CH2 4.48Å; V153-W181 HydrophobicContact CG1-CH2 4.31Å
154	T	71.8	Confident	70.1	Confident	26 Å²	26	48 Å²	48	16%	0.16	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	127.3	176.2	48.5	0	0	0	0	109.7	Y141 S142 L160	Y141-T154 CarbonylContact C-O 3.6Å; Y141-T154 VanDerWaalsContact CA-O 3.25Å; Y141-T154 WeakPolarHBondContact CA-O 3.35Å; S142-T154 WeakPolarHBondContact CB-OG1 3.2Å; S142-T154 PolarHBondContact N-O 3.24Å; S142-T154 PolarHBondContact O-N 3.22Å; S142-T154 PolarHBondContact O-OG1 3.12Å; S142-T154 PolarHBondContact OG-OG1 3.29Å; S142-T154 VanDerWaalsContact OG-OG1 3.08Å; T154-L160 CarbonylContact C-O 3.58Å; T154-L160 VanDerWaalsContact CA-O 3.29Å; T154-L160 WeakPolarHBondContact CA-O 3.29Å
155	R	67.2	Low	69.3	Low	22 Å²	22	51.4 Å²	51.4	8%	0.083	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	120.7	172.6	-144.5	173.2	65.5	-174	6.1	109.1	Y141 D157 N158 G159 L160	Y141-R155 HydrophobicContact CD1-CB 4.24Å; Y141-R155 HydrophobicContact CD1-CG 3.81Å; Y141-R155 HydrophobicContact CE1-CB 4.25Å; Y141-R155 HydrophobicContact CE1-CG 3.52Å; R155-D157 WeakPolarHBondContact CB-OD1 3.5Å; R155-D157 VanDerWaalsContact CD-OD1 3.29Å; R155-D157 WeakPolarHBondContact CD-OD1 3.11Å; R155-D157 WeakPolarHBondContact CG-OD1 3.47Å; R155-D157 IonicContact CZ-OD1 2.68Å; R155-D157 IonicContact CZ-OD2 3.19Å; R155-D157 VanDerWaalsContact NE-CG 3.31Å; R155-D157 IonicContact NE-OD1 3.8Å; R155-D157 PolarHBondContact NE-OD1 3.43Å; R155-D157 IonicContact NE-OD2 3.65Å; R155-D157 PolarHBondContact NE-OD2 3.11Å; R155-D157 IonicContact NH2-OD1 3.83Å; R155-D157 IonicContact NH2-OD2 3.66Å; R155-D157 PolarHBondContact O-N 3.25Å; R155-N158 PolarHBondContact NH2-ND2 3.47Å; R155-N158 PolarHBondContact NH2-OD1 2.99Å; R155-N158 PolarHBondContact O-N 3.44Å; R155-G159 WeakPolarHBondContact O-CA 3.45Å; R155-G159 PolarHBondContact O-N 2.98Å; R155-L160 PolarHBondContact N-O 3.24Å
156	E	66.9	Low	68.6	Low	82 Å²	82	52 Å²	52	38%	0.383	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-21	-173.9	-68.3	-175.9	-178.4	0	0	113.3	R127 F140	R127-E156 IonicContact CZ-OE1 2.7Å; R127-E156 IonicContact CZ-OE2 3.69Å; R127-E156 IonicContact NE-OE1 3.97Å; R127-E156 PolarHBondContact NE-OE1 3.45Å; R127-E156 IonicContact NE-OE2 3.18Å; R127-E156 PolarHBondContact NE-OE2 3.27Å; R127-E156 IonicContact NH2-OE1 2.75Å; R127-E156 IonicContact NH2-OE2 3.61Å; R127-E156 PolarHBondContact NH2-OE2 3.22Å; F140-E156 HydrophobicContact CB-CB 3.98Å; F140-E156 VanDerWaalsContact CB-CD 3.49Å; F140-E156 HydrophobicContact CB-CG 3.97Å; F140-E156 WeakPolarHBondContact CB-OE2 3.24Å; F140-E156 WeakPolarHBondContact O-CB 3.38Å; F140-E156 PolarHBondContact O-N 3.22Å
157	D	56.7	Low	68	Low	72 Å²	72	54.9 Å²	54.9	39%	0.385	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77	-35.4	179.6	60.1	-7.3	0	0	0	113.4	R155	R155-D157 WeakPolarHBondContact CB-OD1 3.5Å; R155-D157 VanDerWaalsContact CD-OD1 3.29Å; R155-D157 WeakPolarHBondContact CD-OD1 3.11Å; R155-D157 WeakPolarHBondContact CG-OD1 3.47Å; R155-D157 IonicContact CZ-OD1 2.68Å; R155-D157 IonicContact CZ-OD2 3.19Å; R155-D157 VanDerWaalsContact NE-CG 3.31Å; R155-D157 IonicContact NE-OD1 3.8Å; R155-D157 PolarHBondContact NE-OD1 3.43Å; R155-D157 IonicContact NE-OD2 3.65Å; R155-D157 PolarHBondContact NE-OD2 3.11Å; R155-D157 IonicContact NH2-OD1 3.83Å; R155-D157 IonicContact NH2-OD2 3.66Å; R155-D157 PolarHBondContact O-N 3.25Å
158	N	55	Low	67.6	Low	54 Å²	54	53.2 Å²	53.2	29%	0.289	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.7	-10.7	-173.2	-70.3	47.2	0	0	0	113.7	R155 L160	R155-N158 PolarHBondContact NH2-ND2 3.47Å; R155-N158 PolarHBondContact NH2-OD1 2.99Å; R155-N158 PolarHBondContact O-N 3.44Å; N158-L160 PolarHBondContact O-N 3.02Å
159	G	57.8	Low	67.3	Low	46 Å²	46	48.4 Å²	48.4	47%	0.474	26%	0.262	S	S	.	.			trans	70.3	5.4	-175.8	0	0	0	0	0	114.9	R155 S161	R155-G159 WeakPolarHBondContact O-CA 3.45Å; R155-G159 PolarHBondContact O-N 2.98Å; G159-S161 PolarHBondContact O-N 3.16Å
160	L	54.7	Low	66.9	Low	35 Å²	35	52 Å²	52	18%	0.183	27%	0.274	C	S	.	.			trans	-65.9	120.2	179	-173.5	77.6	0	0	0	109.7	T154 R155 N158 W181 I184 P191	T154-L160 CarbonylContact C-O 3.58Å; T154-L160 VanDerWaalsContact CA-O 3.29Å; T154-L160 WeakPolarHBondContact CA-O 3.29Å; R155-L160 PolarHBondContact N-O 3.24Å; N158-L160 PolarHBondContact O-N 3.02Å; L160-W181 HydrophobicContact CD2-CE3 4.02Å; L160-W181 HydrophobicContact CD2-CZ3 4.05Å; L160-I184 HydrophobicContact CD2-CG2 4.2Å; L160-P191 HydrophobicContact CD1-CB 3.9Å
161	S	58.2	Low	66.4	Low	22 Å²	22	47.1 Å²	47.1	15%	0.154	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	135.6	172.7	102.3	0	0	0	0	111	Q152 V153 G159 D194	Q152-S161 PolarHBondContact NE2-OG 3.4Å; Q152-S161 VanDerWaalsContact NE2-OG 3.11Å; V153-S161 CarbonylContact O-C 3.53Å; V153-S161 VanDerWaalsContact O-CA 3.25Å; V153-S161 WeakPolarHBondContact O-CA 3.28Å; G159-S161 PolarHBondContact O-N 3.16Å; S161-D194 VanDerWaalsContact CB-OD1 3.3Å; S161-D194 WeakPolarHBondContact CB-OD1 3.35Å; S161-D194 PolarHBondContact OG-OD1 3.04Å
162	I	70.4	Confident	65.7	Low	53 Å²	53	47 Å²	47	27%	0.272	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	156.5	166.6	63.5	162.2	0	0	0	110.4	Q152 V153 V164 W181	Q152-I162 WeakPolarHBondContact CA-O 3.1Å; V153-I162 PolarHBondContact N-O 3.44Å; V153-I162 PolarHBondContact O-N 3.44Å; I162-V164 HydrophobicContact CD1-CG2 3.51Å; I162-V164 HydrophobicContact CG1-CG2 3.52Å; I162-W181 HydrophobicContact CB-CH2 4.46Å; I162-W181 HydrophobicContact CD1-CE3 4.25Å; I162-W181 HydrophobicContact CD1-CH2 2.96Å; I162-W181 HydrophobicContact CD1-CZ2 3.4Å; I162-W181 HydrophobicContact CD1-CZ3 3.38Å; I162-W181 HydrophobicContact CG1-CH2 3.1Å; I162-W181 HydrophobicContact CG1-CZ2 4Å; I162-W181 HydrophobicContact CG1-CZ3 3.48Å; I162-W181 VanDerWaalsContact CG1-CZ3 3.48Å; I162-W181 HydrophobicContact CG2-CZ3 4.24Å
163	F	67.7	Low	65.4	Low	118 Å²	118	45.5 Å²	45.5	52%	0.518	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	128.9	170.7	-62.7	-80.7	0	0	0	109.3	T146 W151 Q152	T146-F163 HydrophobicContact CG2-CE1 3.95Å; W151-F163 WeakPolarHBondContact O-CA 3.41Å; Q152-F163 HydrophobicContact CB-CD1 4.19Å; Q152-F163 HydrophobicContact CB-CE1 4.06Å; Q152-F163 HydrophobicContact CG-CD1 4.48Å; Q152-F163 HydrophobicContact CG-CE1 4.17Å
164	V	68	Low	64.7	Low	10 Å²	10	47.8 Å²	47.8	6%	0.061	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	141.7	-172.9	-165	0	0	0	0	108.9	W151 V153 I162 L168 L169	W151-V164 PolarHBondContact N-O 3.15Å; W151-V164 PolarHBondContact O-N 3.11Å; V153-V164 HydrophobicContact CB-CG2 4.1Å; V153-V164 HydrophobicContact CG2-CB 4.1Å; V153-V164 HydrophobicContact CG2-CG2 3.68Å; I162-V164 HydrophobicContact CD1-CG2 3.51Å; I162-V164 HydrophobicContact CG1-CG2 3.52Å; V164-L168 HydrophobicContact CG1-CB 3.2Å; V164-L168 HydrophobicContact CG1-CD1 4.02Å; V164-L168 HydrophobicContact CG1-CG 4.23Å; V164-L169 HydrophobicContact CB-CD1 4.48Å
165	D	67.1	Low	63.9	Low	99 Å²	99	55.6 Å²	55.6	53%	0.529	29%	0.294	S	S	.	.			trans	-76.9	156.3	170.8	-65.8	-36.4	0	0	0	110.4	S167 L168 L169	D165-S167 PolarHBondContact O-N 3.31Å; D165-L168 PolarHBondContact O-N 3.48Å; D165-L168 VanDerWaalsContact O-N 3.15Å; D165-L169 PolarHBondContact O-N 3.47Å
166	A	65.4	Low	63.1	Low	13 Å²	13	62.6 Å²	62.6	11%	0.107	33%	0.328	C	S	.	.	H	α-helix	trans	-58.9	-33	-175.6	0	0	0	0	0	113.6	E93 L168 L169 E170	E93-A166 HydrophobicContact CB-CB 3.92Å; E93-A166 HydrophobicContact CG-CB 4.3Å; A166-L168 PolarHBondContact O-N 3.34Å; A166-L169 WeakPolarHBondContact O-CA 3.31Å; A166-L169 WeakPolarHBondContact O-CB 3.31Å; A166-L169 PolarHBondContact O-N 3.27Å; A166-E170 PolarHBondContact O-N 3.35Å
167	S	66.9	Low	62.2	Low	81 Å²	81	61.2 Å²	61.2	57%	0.566	32%	0.321	S	S	*	.	H	α-helix	trans	-62.7	-39	177.3	53	0	0	0	0	113.6	D165 L169	D165-S167 PolarHBondContact O-N 3.31Å; S167-L169 PolarHBondContact O-N 3.31Å
168	L	65.2	Low	61.8	Low	72 Å²	72	58.4 Å²	58.4	38%	0.377	31%	0.306	S	S	.	.	H	α-helix	trans	-74.7	-17.1	174.9	-78.7	157.2	0	0	0	111.8	V164 D165 A166 T171 L172 E177	V164-L168 HydrophobicContact CG1-CB 3.2Å; V164-L168 HydrophobicContact CG1-CD1 4.02Å; V164-L168 HydrophobicContact CG1-CG 4.23Å; D165-L168 PolarHBondContact O-N 3.48Å; D165-L168 VanDerWaalsContact O-N 3.15Å; A166-L168 PolarHBondContact O-N 3.34Å; L168-T171 WeakPolarHBondContact CA-OG1 3.26Å; L168-T171 PolarHBondContact O-N 3.43Å; L168-T171 PolarHBondContact O-OG1 3.16Å; L168-L172 PolarHBondContact O-N 3.18Å; L168-E177 WeakPolarHBondContact CD2-OE1 3.32Å
169	L	67	Low	61.3	Low	0 Å²	0	61.9 Å²	61.9	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-75.9	-29.9	177.5	-143.7	68	0	0	0	111.6	F95 V143 W151 V153 V164 D165 A166 S167 T171 L172	F95-L169 HydrophobicContact CB-CB 4.12Å; F95-L169 HydrophobicContact CB-CD2 3.96Å; F95-L169 HydrophobicContact CB-CG 4.34Å; F95-L169 HydrophobicContact CD1-CD2 3.18Å; F95-L169 HydrophobicContact CD1-CG 4.17Å; F95-L169 HydrophobicContact CD2-CB 4.11Å; F95-L169 HydrophobicContact CD2-CD2 3.55Å; F95-L169 HydrophobicContact CD2-CG 3.58Å; F95-L169 HydrophobicContact CE1-CD2 3.35Å; F95-L169 HydrophobicContact CE1-CG 4.34Å; F95-L169 HydrophobicContact CE2-CD2 3.74Å; F95-L169 HydrophobicContact CE2-CG 3.82Å; F95-L169 HydrophobicContact CG-CB 4.11Å; F95-L169 HydrophobicContact CG-CD2 3.28Å; F95-L169 HydrophobicContact CG-CG 3.78Å; F95-L169 HydrophobicContact CZ-CD2 3.64Å; F95-L169 HydrophobicContact CZ-CG 4.19Å; V143-L169 HydrophobicContact CG1-CD1 4.32Å; V143-L169 HydrophobicContact CG1-CD2 4.19Å; W151-L169 HydrophobicContact CB-CD1 4.32Å; W151-L169 HydrophobicContact CB-CD2 4.04Å; W151-L169 HydrophobicContact CD2-CD2 3.86Å; W151-L169 HydrophobicContact CG-CD2 3.58Å; V153-L169 HydrophobicContact CG2-CD1 3.32Å; V164-L169 HydrophobicContact CB-CD1 4.48Å; D165-L169 PolarHBondContact O-N 3.47Å; A166-L169 WeakPolarHBondContact O-CA 3.31Å; A166-L169 WeakPolarHBondContact O-CB 3.31Å; A166-L169 PolarHBondContact O-N 3.27Å; S167-L169 PolarHBondContact O-N 3.31Å; L169-T171 PolarHBondContact O-N 2.83Å; L169-L172 HydrophobicContact CB-CD1 4.42Å; L169-L172 HydrophobicContact CD1-CD1 3.24Å; L169-L172 HydrophobicContact CD1-CG 4.23Å; L169-L172 HydrophobicContact CG-CD1 3.68Å; L169-L172 WeakPolarHBondContact O-CB 3.32Å; L169-L172 PolarHBondContact O-N 2.98Å
170	E	65.7	Low	60.6	Low	98 Å²	98	65 Å²	65	46%	0.458	32%	0.323	S	S	.	.	H	α-helix	trans	-65.4	-30.8	171.5	-62.2	-172.8	161	0	0	111.9	A166	A166-E170 PolarHBondContact O-N 3.35Å
171	T	65.6	Low	60.1	Low	43 Å²	43	64 Å²	64	26%	0.264	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-4.1	-179.5	55.1	0	0	0	0	114.1	L168 L169 C173 T174 E177	L168-T171 WeakPolarHBondContact CA-OG1 3.26Å; L168-T171 PolarHBondContact O-N 3.43Å; L168-T171 PolarHBondContact O-OG1 3.16Å; L169-T171 PolarHBondContact O-N 2.83Å; T171-C173 PolarHBondContact O-N 3.38Å; T171-C173 VanDerWaalsContact O-N 3.08Å; T171-T174 HydrophobicContact CG2-CG2 4.5Å; T171-T174 WeakPolarHBondContact O-CB 3.37Å; T171-T174 PolarHBondContact O-N 3.47Å; T171-T174 PolarHBondContact O-OG1 3.3Å; T171-E177 VanDerWaalsContact CB-OE2 3.24Å; T171-E177 WeakPolarHBondContact CB-OE2 3.45Å; T171-E177 PolarHBondContact OG1-OE2 2.8Å
172	L	66.8	Low	59.3	Low	1 Å²	1	67.3 Å²	67.3	1%	0.005	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.3	-39.8	-178.9	-98.9	166.9	0	0	0	114.9	Y141 V153 L168 L169 W181	Y141-L172 HydrophobicContact CD1-CD2 4.07Å; Y141-L172 HydrophobicContact CE1-CD2 3.97Å; Y141-L172 HydrophobicContact CG-CD2 4.45Å; V153-L172 HydrophobicContact CG1-CD1 4.34Å; V153-L172 HydrophobicContact CG1-CD2 3.94Å; V153-L172 HydrophobicContact CG2-CD1 4.28Å; L168-L172 PolarHBondContact O-N 3.18Å; L169-L172 HydrophobicContact CB-CD1 4.42Å; L169-L172 HydrophobicContact CD1-CD1 3.24Å; L169-L172 HydrophobicContact CD1-CG 4.23Å; L169-L172 HydrophobicContact CG-CD1 3.68Å; L169-L172 WeakPolarHBondContact O-CB 3.32Å; L169-L172 PolarHBondContact O-N 2.98Å; L172-W181 HydrophobicContact CD2-CZ2 4.11Å
173	C	69.1	Low	57.9	Low	8 Å²	8	74.1 Å²	74.1	5%	0.054	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	8.4	-178.7	-59	0	0	0	0	113.5	A100 C130 T171	A100-C173 VanDerWaalsContact CB-SG 3.51Å; C130-C173 WeakPolarHBondContact CA-SG 3.48Å; C130-C173 HydrophobicContact CB-CB 3.73Å; C130-C173 WeakPolarHBondContact CB-SG 3.49Å; C130-C173 WeakPolarHBondContact SG-CA 3.37Å; C130-C173 WeakPolarHBondContact SG-CB 3.24Å; C130-C173 CovalentContact SG-SG 2.04Å; C130-C173 PolarHBondContact SG-SG 2.95Å; T171-C173 PolarHBondContact O-N 3.38Å; T171-C173 VanDerWaalsContact O-N 3.08Å
174	T	65	Low	56.8	Low	49 Å²	49	72.1 Å²	72.1	30%	0.301	35%	0.349	S	S	.	.			trans	-81.7	147.7	176.8	69.3	0	0	0	0	111.1	T171 E176 N178	T171-T174 HydrophobicContact CG2-CG2 4.5Å; T171-T174 WeakPolarHBondContact O-CB 3.37Å; T171-T174 PolarHBondContact O-N 3.47Å; T171-T174 PolarHBondContact O-OG1 3.3Å; T174-E176 PolarHBondContact O-N 3.36Å; T174-N178 PolarHBondContact O-N 3.43Å; T174-N178 PolarHBondContact O-ND2 3.23Å
175	R	54.7	Low	55.7	Low	190 Å²	190	75.5 Å²	75.5	72%	0.717	37%	0.366	S	S	*	.	H	α-helix	trans	-67.9	-33.4	-173.7	-167.9	-179.6	68.8	163.4	2	113	N178	R175-N178 PolarHBondContact O-N 3.3Å
176	E	50.2	Low	54.6	Low	168 Å²	168	74.5 Å²	74.5	79%	0.785	36%	0.361	S	S	*	.	H	α-helix	trans	-71.2	-37.3	-174	-68.5	-177.8	170.1	0	0	112.7	T174 E179	T174-E176 PolarHBondContact O-N 3.36Å; E176-E179 PolarHBondContact O-N 3.06Å
177	E	49.4	Very low	54	Low	54 Å²	54	82.6 Å²	82.6	25%	0.252	39%	0.389	S	S	.	.	H	α-helix	trans	-83.5	-22.7	175.4	-73.1	-169.8	158.8	0	0	113.4	L168 T171 E179 H180 W181	L168-E177 WeakPolarHBondContact CD2-OE1 3.32Å; T171-E177 VanDerWaalsContact CB-OE2 3.24Å; T171-E177 WeakPolarHBondContact CB-OE2 3.45Å; T171-E177 PolarHBondContact OG1-OE2 2.8Å; E177-E179 PolarHBondContact O-N 3.43Å; E177-E179 VanDerWaalsContact O-N 3.15Å; E177-H180 WeakPolarHBondContact O-CA 3.07Å; E177-H180 WeakPolarHBondContact O-CB 3.36Å; E177-H180 PolarHBondContact O-N 3.04Å; E177-W181 PolarHBondContact O-N 3.09Å
178	N	48.3	Very low	53.4	Low	13 Å²	13	83 Å²	83	7%	0.07	39%	0.385	C	S	.	.	H	α-helix	trans	-54.2	-32.2	166.7	-83.9	-57.6	0	0	0	111.1	L139 Y141 T174 R175 N182	L139-N178 WeakPolarHBondContact CD1-OD1 3.46Å; Y141-N178 PolarHBondContact OH-OD1 2.71Å; T174-N178 PolarHBondContact O-N 3.43Å; T174-N178 PolarHBondContact O-ND2 3.23Å; R175-N178 PolarHBondContact O-N 3.3Å; N178-N182 VanDerWaalsContact O-CB 3.28Å; N178-N182 WeakPolarHBondContact O-CB 3.06Å; N178-N182 PolarHBondContact O-N 3.37Å; N178-N182 PolarHBondContact O-ND2 2.85Å; N178-N182 PolarHBondContact O-OD1 3.2Å
179	E	44.9	Very low	53.5	Low	126 Å²	126	82.9 Å²	82.9	59%	0.589	38%	0.381	S	S	*	.	H	α-helix	trans	-71.3	-30.3	170	-68.5	-163.3	175.7	0	0	113.9	E176 E177 N182 R183	E176-E179 PolarHBondContact O-N 3.06Å; E177-E179 PolarHBondContact O-N 3.43Å; E177-E179 VanDerWaalsContact O-N 3.15Å; E179-N182 CarbonylContact O-C 3.29Å; E179-N182 VanDerWaalsContact O-C 3.29Å; E179-N182 PolarHBondContact O-N 3.47Å; E179-R183 VanDerWaalsContact O-CB 3.3Å; E179-R183 WeakPolarHBondContact O-CB 2.98Å; E179-R183 WeakPolarHBondContact O-CG 3.33Å; E179-R183 PolarHBondContact O-N 3.03Å
180	H	43.1	Very low	53.9	Low	111 Å²	111	83.1 Å²	83.1	51%	0.514	38%	0.383	S	S	.	.	H	α-helix	trans	-68.5	-43.2	173.9	-166.1	76.3	0	0	0	111.4	E177 N182 R183 I184	E177-H180 WeakPolarHBondContact O-CA 3.07Å; E177-H180 WeakPolarHBondContact O-CB 3.36Å; E177-H180 PolarHBondContact O-N 3.04Å; H180-N182 VanDerWaalsContact C-N 3.29Å; H180-N182 PolarHBondContact O-N 2.89Å; H180-R183 CarbonylContact O-C 3.57Å; H180-R183 WeakPolarHBondContact O-CA 3.43Å; H180-R183 WeakPolarHBondContact O-CB 3.1Å; H180-R183 PolarHBondContact O-N 3.41Å; H180-I184 WeakPolarHBondContact O-CG1 3.03Å; H180-I184 PolarHBondContact O-N 2.78Å
181	W	43.2	Very low	54.5	Low	15 Å²	15	80 Å²	80	6%	0.057	37%	0.371	C	S	.	.	H	α-helix	trans	-65.1	-32.7	170.4	-65.4	101.4	0	0	0	112.6	V153 L160 I162 L172 E177 R183 I184	V153-W181 HydrophobicContact CB-CH2 4.48Å; V153-W181 HydrophobicContact CG1-CH2 4.31Å; L160-W181 HydrophobicContact CD2-CE3 4.02Å; L160-W181 HydrophobicContact CD2-CZ3 4.05Å; I162-W181 HydrophobicContact CB-CH2 4.46Å; I162-W181 HydrophobicContact CD1-CE3 4.25Å; I162-W181 HydrophobicContact CD1-CH2 2.96Å; I162-W181 HydrophobicContact CD1-CZ2 3.4Å; I162-W181 HydrophobicContact CD1-CZ3 3.38Å; I162-W181 HydrophobicContact CG1-CH2 3.1Å; I162-W181 HydrophobicContact CG1-CZ2 4Å; I162-W181 HydrophobicContact CG1-CZ3 3.48Å; I162-W181 VanDerWaalsContact CG1-CZ3 3.48Å; I162-W181 HydrophobicContact CG2-CZ3 4.24Å; L172-W181 HydrophobicContact CD2-CZ2 4.11Å; E177-W181 PolarHBondContact O-N 3.09Å; W181-R183 VanDerWaalsContact C-N 3.3Å; W181-I184 HydrophobicContact CE3-CD1 4.36Å
182	N	40.7	Very low	55	Low	92 Å²	92	82.1 Å²	82.1	49%	0.492	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-7	169.7	-62.7	-22.9	0	0	0	113.3	N178 E179 H180 D185	N178-N182 VanDerWaalsContact O-CB 3.28Å; N178-N182 WeakPolarHBondContact O-CB 3.06Å; N178-N182 PolarHBondContact O-N 3.37Å; N178-N182 PolarHBondContact O-ND2 2.85Å; N178-N182 PolarHBondContact O-OD1 3.2Å; E179-N182 CarbonylContact O-C 3.29Å; E179-N182 VanDerWaalsContact O-C 3.29Å; E179-N182 PolarHBondContact O-N 3.47Å; H180-N182 VanDerWaalsContact C-N 3.29Å; H180-N182 PolarHBondContact O-N 2.89Å; N182-D185 WeakPolarHBondContact O-CB 3.36Å
183	R	41.3	Very low	55.5	Low	196 Å²	196	83.5 Å²	83.5	74%	0.74	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	-25.8	171.8	-94.9	-177.6	175.6	174.9	2	112.2	E179 H180 W181 D185	E179-R183 VanDerWaalsContact O-CB 3.3Å; E179-R183 WeakPolarHBondContact O-CB 2.98Å; E179-R183 WeakPolarHBondContact O-CG 3.33Å; E179-R183 PolarHBondContact O-N 3.03Å; H180-R183 CarbonylContact O-C 3.57Å; H180-R183 WeakPolarHBondContact O-CA 3.43Å; H180-R183 WeakPolarHBondContact O-CB 3.1Å; H180-R183 PolarHBondContact O-N 3.41Å; W181-R183 VanDerWaalsContact C-N 3.3Å; R183-D185 PolarHBondContact O-N 2.99Å
184	I	45.8	Very low	55.5	Low	75 Å²	75	86.4 Å²	86.4	39%	0.385	41%	0.406	S	S	.	.	S	Bend	trans	-65.1	-14.5	163	-62	163.8	0	0	0	110.1	L160 H180 W181 N186	L160-I184 HydrophobicContact CD2-CG2 4.2Å; H180-I184 WeakPolarHBondContact O-CG1 3.03Å; H180-I184 PolarHBondContact O-N 2.78Å; W181-I184 HydrophobicContact CE3-CD1 4.36Å; I184-N186 PolarHBondContact O-N 3.45Å
185	D	45.1	Very low	55.7	Low	81 Å²	81	94.4 Å²	94.4	43%	0.433	44%	0.437	S	S	.	.			trans	-62.6	53.2	158	-148.4	33	0	0	0	111.4	N182 R183 R187	N182-D185 WeakPolarHBondContact O-CB 3.36Å; R183-D185 PolarHBondContact O-N 2.99Å; D185-R187 PolarHBondContact O-N 3.46Å; D185-R187 IonicContact OD2-NE 3.43Å
186	N	43.5	Very low	56.6	Low	79 Å²	79	90.1 Å²	90.1	42%	0.422	43%	0.425	S	S	.	.			trans	-59.5	89.4	145	-100.8	-39.3	0	0	0	104.8	I184 D188 K189	I184-N186 PolarHBondContact O-N 3.45Å; N186-D188 PolarHBondContact O-N 2.8Å; N186-K189 HydrophobicContact CB-CB 4.05Å; N186-K189 HydrophobicContact CB-CD 3.73Å; N186-K189 HydrophobicContact CB-CG 4.02Å; N186-K189 PolarHBondContact ND2-NZ 3.34Å; N186-K189 VanDerWaalsContact ND2-NZ 3.11Å; N186-K189 PolarHBondContact O-N 2.94Å
187	R	52.5	Low	58.1	Low	182 Å²	182	91 Å²	91	69%	0.687	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.6	-13.5	173	-82.8	179.7	167.1	-166	-6.1	113.5	D185 N241 G242	D185-R187 PolarHBondContact O-N 3.46Å; D185-R187 IonicContact OD2-NE 3.43Å; R187-N241 CarbonylContact O-C 3.31Å; R187-N241 VanDerWaalsContact O-C 3.31Å; R187-G242 PolarHBondContact O-N 3.2Å
188	D	54.9	Low	59.7	Low	90 Å²	90	90.6 Å²	90.6	48%	0.481	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	1.7	179.3	-51.9	-39.4	0	0	0	113.4	N186 P213	N186-D188 PolarHBondContact O-N 2.8Å; D188-P213 HydrophobicContact CB-CG 4.33Å; D188-P213 WeakPolarHBondContact O-CD 3.42Å; D188-P213 WeakPolarHBondContact O-CG 3.02Å
189	K	66.7	Low	61.6	Low	70 Å²	70	90.6 Å²	90.6	30%	0.304	43%	0.432	S	S	.	.			trans	-126.6	122.8	-173.7	-66.5	172.6	177.1	163.7	0	112.6	N186 P210 I211	N186-K189 HydrophobicContact CB-CB 4.05Å; N186-K189 HydrophobicContact CB-CD 3.73Å; N186-K189 HydrophobicContact CB-CG 4.02Å; N186-K189 PolarHBondContact ND2-NZ 3.34Å; N186-K189 VanDerWaalsContact ND2-NZ 3.11Å; N186-K189 PolarHBondContact O-N 2.94Å; K189-P210 HydrophobicContact CD-CB 3.82Å; K189-P210 HydrophobicContact CD-CG 4.28Å; K189-I211 VanDerWaalsContact CA-O 3.26Å; K189-I211 WeakPolarHBondContact CA-O 3.02Å; K189-I211 VanDerWaalsContact CB-O 3.3Å; K189-I211 WeakPolarHBondContact CB-O 3.37Å; K189-I211 WeakPolarHBondContact CG-O 3.41Å
190	C	76.1	Confident	63.6	Low	5 Å²	5	86.4 Å²	86.4	3%	0.034	42%	0.417	C	S	.	.	P	Polyproline II helix	trans	-75	143.9	176.4	-61	0	0	0	0	112.1	I211 C238 G242 F243 W244	C190-I211 HydrophobicContact CB-CG2 4.13Å; C190-I211 WeakPolarHBondContact O-CB 3.49Å; C190-C238 HydrophobicContact CB-CB 3.76Å; C190-C238 WeakPolarHBondContact CB-SG 3.47Å; C190-C238 WeakPolarHBondContact SG-CA 3.48Å; C190-C238 WeakPolarHBondContact SG-CB 3.01Å; C190-C238 CovalentContact SG-SG 2.02Å; C190-C238 PolarHBondContact SG-SG 2.86Å; C190-G242 WeakPolarHBondContact CA-O 3.32Å; C190-F243 VanDerWaalsContact SG-C 3.6Å; C190-W244 HydrophobicContact CB-CD2 4.3Å; C190-W244 HydrophobicContact CB-CZ2 4.05Å
191	P	77.3	Confident	65.7	Low	32 Å²	32	82.9 Å²	82.9	21%	0.208	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-68.6	146.7	176	28.6	-34.3	0	0	0	110.9	L160 W244	L160-P191 HydrophobicContact CD1-CB 3.9Å; P191-W244 PolarHBondContact O-NE1 2.93Å
192	P	75.5	Confident	67.7	Low	87 Å²	87	85.9 Å²	85.9	57%	0.565	42%	0.423	S	S	*	.	P	Polyproline II helix	trans	-65.7	146.3	167.3	29.7	-33	0	0	0	110.2	Y203 I211	P192-Y203 VanDerWaalsContact CA-OH 3.3Å; P192-Y203 WeakPolarHBondContact CA-OH 3.07Å; P192-I211 HydrophobicContact CB-CD1 4.24Å
193	F	77.2	Confident	69.7	Low	30 Å²	30	84.4 Å²	84.4	13%	0.132	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-63.3	137.1	168.4	-67.7	-83.1	0	0	0	110.7	V201 Y203 A217 I219 R236 W244	F193-V201 HydrophobicContact CB-CB 4.37Å; F193-V201 HydrophobicContact CB-CG1 4.37Å; F193-V201 HydrophobicContact CB-CG2 3.78Å; F193-V201 HydrophobicContact CD2-CG1 3.66Å; F193-V201 HydrophobicContact CD2-CG2 4.33Å; F193-V201 HydrophobicContact CE2-CG1 4.35Å; F193-V201 HydrophobicContact CG-CG1 4.23Å; F193-V201 HydrophobicContact CG-CG2 4.06Å; F193-Y203 HydrophobicContact CD2-CE1 4.03Å; F193-Y203 PolarHBondContact N-OH 3.4Å; F193-A217 HydrophobicContact CD2-CB 4.19Å; F193-A217 HydrophobicContact CE2-CB 3.65Å; F193-I219 HydrophobicContact CD1-CD1 4.27Å; F193-I219 HydrophobicContact CE1-CD1 4.03Å; F193-I219 HydrophobicContact CZ-CD1 4.16Å; F193-R236 VanDerWaalsContact CE1-NH1 3.31Å; F193-R236 HydrophobicContact CZ-CB 4.15Å; F193-R236 VanDerWaalsContact CZ-CD 3.45Å; F193-R236 HydrophobicContact CZ-CG 4.4Å; F193-W244 HydrophobicContact CD2-CZ2 4.4Å; F193-W244 AromaticContact CE2-CD2 3.69Å; F193-W244 HydrophobicContact CE2-CD2 3.69Å; F193-W244 AromaticContact CE2-CE2 3.48Å; F193-W244 VanDerWaalsContact CE2-CE2 3.48Å; F193-W244 HydrophobicContact CE2-CE3 4.15Å; F193-W244 HydrophobicContact CE2-CG 4.1Å; F193-W244 HydrophobicContact CE2-CH2 4.31Å; F193-W244 AromaticContact CE2-CZ2 3.82Å; F193-W244 HydrophobicContact CE2-CZ2 3.82Å; F193-W244 HydrophobicContact CE2-CZ3 4.45Å; F193-W244 AromaticContact CE2-NE1 3.72Å; F193-W244 HydrophobicContact CZ-CB 4.29Å; F193-W244 AromaticContact CZ-CD1 3.78Å; F193-W244 AromaticContact CZ-CD2 3.73Å; F193-W244 HydrophobicContact CZ-CD2 3.73Å; F193-W244 AromaticContact CZ-CE2 3.91Å; F193-W244 HydrophobicContact CZ-CE3 4.32Å; F193-W244 AromaticContact CZ-CG 3.68Å; F193-W244 HydrophobicContact CZ-CG 3.68Å; F193-W244 AromaticContact CZ-NE1 3.89Å
194	D	70.6	Confident	71.9	Confident	69 Å²	69	78.9 Å²	78.9	37%	0.369	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-62.3	144.4	173.4	-68	-30.9	0	0	0	111.3	S161 H196	S161-D194 VanDerWaalsContact CB-OD1 3.3Å; S161-D194 WeakPolarHBondContact CB-OD1 3.35Å; S161-D194 PolarHBondContact OG-OD1 3.04Å; D194-H196 PolarHBondContact O-N 2.82Å
195	F	67.7	Low	73.4	Confident	217 Å²	217	80.1 Å²	80.1	95%	0.952	40%	0.395	S	S	*	.	P	Polyproline II helix	trans	-67.8	125.5	172.2	-73.6	-82.2	0	0	0	109.9
196	H	75.6	Confident	74.5	Confident	100 Å²	100	81.4 Å²	81.4	46%	0.463	42%	0.418	S	S	.	.	B	Isolated β-bridge	trans	-131.8	146.4	174.4	-158.3	-86.1	0	0	0	109.2	D194 S198 F199	D194-H196 PolarHBondContact O-N 2.82Å; H196-S198 PolarHBondContact CE1-OG 3.45Å; H196-S198 VanDerWaalsContact CE1-OG 3.26Å; H196-S198 PolarHBondContact ND1-N 2.04Å; H196-S198 PolarHBondContact ND1-OG 2.96Å; H196-S198 PolarHBondContact O-N 3.48Å; H196-S198 VanDerWaalsContact O-N 3.17Å; H196-F199 HydrophobicContact CB-CD1 3.86Å; H196-F199 HydrophobicContact CB-CD2 4.45Å; H196-F199 HydrophobicContact CB-CE1 3.26Å; H196-F199 HydrophobicContact CB-CE2 3.91Å; H196-F199 HydrophobicContact CB-CG 4.42Å; H196-F199 HydrophobicContact CB-CZ 3.28Å; H196-F199 AromaticContact CG-CE1 3.57Å; H196-F199 AromaticContact ND1-CE1 3.96Å
197	E	79.8	Confident	75.3	Confident	186 Å²	186	85.6 Å²	85.6	87%	0.869	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-12.6	-176.3	-63.1	177.8	176.7	0	0	113.6	L222	E197-L222 VanDerWaalsContact O-CD1 3.25Å; E197-L222 WeakPolarHBondContact O-CD1 3.26Å
198	S	82.8	Confident	75.6	Confident	47 Å²	47	81.6 Å²	81.6	33%	0.329	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.2	-22.2	-171.4	-41.8	0	0	0	0	113.7	H196 L222 C252	H196-S198 PolarHBondContact CE1-OG 3.45Å; H196-S198 VanDerWaalsContact CE1-OG 3.26Å; H196-S198 PolarHBondContact ND1-N 2.04Å; H196-S198 PolarHBondContact ND1-OG 2.96Å; H196-S198 PolarHBondContact O-N 3.48Å; H196-S198 VanDerWaalsContact O-N 3.17Å; S198-L222 PolarHBondContact O-N 2.79Å; S198-C252 PolarHBondContact O-SG 3.44Å
199	F	89.9	Confident	76.2	Confident	13 Å²	13	79.2 Å²	79.2	6%	0.057	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	151	-177.6	59.3	-98	0	0	0	111.2	H196 V201 I219 T220 V249 P250	H196-F199 HydrophobicContact CB-CD1 3.86Å; H196-F199 HydrophobicContact CB-CD2 4.45Å; H196-F199 HydrophobicContact CB-CE1 3.26Å; H196-F199 HydrophobicContact CB-CE2 3.91Å; H196-F199 HydrophobicContact CB-CG 4.42Å; H196-F199 HydrophobicContact CB-CZ 3.28Å; H196-F199 AromaticContact CG-CE1 3.57Å; H196-F199 AromaticContact ND1-CE1 3.96Å; F199-V201 HydrophobicContact CD2-CG2 3.92Å; F199-V201 HydrophobicContact CE2-CG2 4.08Å; F199-I219 HydrophobicContact CB-CG2 4.15Å; F199-I219 HydrophobicContact CD2-CG2 4.27Å; F199-I219 HydrophobicContact CG-CG2 4.42Å; F199-T220 CarbonylContact C-O 3.36Å; F199-T220 WeakPolarHBondContact CA-O 2.84Å; F199-V249 HydrophobicContact CE1-CG1 4.44Å; F199-P250 HydrophobicContact CD1-CB 3.75Å; F199-P250 HydrophobicContact CD1-CG 4.18Å; F199-P250 WeakPolarHBondContact CD1-O 3.33Å; F199-P250 HydrophobicContact CD2-CB 4.29Å; F199-P250 HydrophobicContact CD2-CG 4.08Å; F199-P250 HydrophobicContact CE1-CB 3.95Å; F199-P250 HydrophobicContact CE1-CG 3.99Å; F199-P250 HydrophobicContact CE2-CB 4.49Å; F199-P250 HydrophobicContact CE2-CG 3.91Å; F199-P250 HydrophobicContact CG-CB 3.93Å; F199-P250 HydrophobicContact CG-CG 4.22Å; F199-P250 HydrophobicContact CZ-CB 4.33Å; F199-P250 HydrophobicContact CZ-CG 3.87Å
200	S	85.8	Confident	76.3	Confident	38 Å²	38	79.5 Å²	79.5	27%	0.266	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	144.8	171.6	59.8	0	0	0	0	110	T220	S200-T220 PolarHBondContact N-O 2.89Å; S200-T220 PolarHBondContact O-N 3.3Å; S200-T220 PolarHBondContact OG-O 3.04Å; S200-T220 PolarHBondContact OG-OG1 3.25Å
201	V	86.8	Confident	76.2	Confident	37 Å²	37	79.9 Å²	79.9	22%	0.224	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	125.8	177.7	-174.7	0	0	0	0	109.9	F193 F199 Y203 A217 I219	F193-V201 HydrophobicContact CB-CB 4.37Å; F193-V201 HydrophobicContact CB-CG1 4.37Å; F193-V201 HydrophobicContact CB-CG2 3.78Å; F193-V201 HydrophobicContact CD2-CG1 3.66Å; F193-V201 HydrophobicContact CD2-CG2 4.33Å; F193-V201 HydrophobicContact CE2-CG1 4.35Å; F193-V201 HydrophobicContact CG-CG1 4.23Å; F193-V201 HydrophobicContact CG-CG2 4.06Å; F199-V201 HydrophobicContact CD2-CG2 3.92Å; F199-V201 HydrophobicContact CE2-CG2 4.08Å; V201-Y203 HydrophobicContact CG1-CE1 4.14Å; V201-Y203 HydrophobicContact CG1-CE2 4.17Å; V201-A217 HydrophobicContact CG1-CB 3.88Å; V201-I219 HydrophobicContact CG1-CG1 4.36Å; V201-I219 HydrophobicContact CG2-CD1 4.41Å; V201-I219 HydrophobicContact CG2-CG1 4.1Å
202	V	86	Confident	76.2	Confident	78 Å²	78	82.1 Å²	82.1	47%	0.473	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	117.4	175.5	-179.8	0	0	0	0	109.1	L204 A217 R218	V202-L204 HydrophobicContact CG1-CD2 4.4Å; V202-A217 WeakPolarHBondContact O-CA 3.21Å; V202-R218 PolarHBondContact N-O 3.17Å; V202-R218 PolarHBondContact O-N 3.4Å
203	Y	83.8	Confident	76.5	Confident	61 Å²	61	80.5 Å²	80.5	24%	0.239	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	116.9	175.7	-58.4	-83.1	0	0	0	110.4	P192 F193 V201 R205 I211 A217 W244	P192-Y203 VanDerWaalsContact CA-OH 3.3Å; P192-Y203 WeakPolarHBondContact CA-OH 3.07Å; F193-Y203 HydrophobicContact CD2-CE1 4.03Å; F193-Y203 PolarHBondContact N-OH 3.4Å; V201-Y203 HydrophobicContact CG1-CE1 4.14Å; V201-Y203 HydrophobicContact CG1-CE2 4.17Å; Y203-R205 PolarHBondContact O-N 3.14Å; Y203-I211 HydrophobicContact CD1-CD1 3.96Å; Y203-I211 HydrophobicContact CE1-CD1 3.57Å; Y203-A217 HydrophobicContact CD1-CB 3.81Å; Y203-A217 HydrophobicContact CE1-CB 3.93Å; Y203-W244 HydrophobicContact CD1-CH2 4.12Å; Y203-W244 HydrophobicContact CD1-CZ2 4.31Å; Y203-W244 HydrophobicContact CE1-CH2 4.09Å; Y203-W244 AromaticContact CE1-CZ2 3.86Å; Y203-W244 HydrophobicContact CE1-CZ2 3.86Å
204	L	85.7	Confident	76.9	Confident	80 Å²	80	81.4 Å²	81.4	42%	0.419	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	81	177.8	-57	176.1	0	0	0	109.3	V202 R216 R218 L235	V202-L204 HydrophobicContact CG1-CD2 4.4Å; L204-R216 HydrophobicContact CB-CB 4.35Å; L204-R216 HydrophobicContact CD1-CB 4.46Å; L204-R216 PolarHBondContact N-O 3.4Å; L204-R218 HydrophobicContact CD1-CB 4.32Å; L204-R218 HydrophobicContact CG-CB 4.5Å; L204-L235 HydrophobicContact CD1-CD1 3.9Å
205	R	77.7	Confident	77.7	Confident	100 Å²	100	79.9 Å²	79.9	38%	0.377	45%	0.454	S	S	.	.			trans	-132.4	149.2	-176.4	62.1	-175.6	-176.5	172.8	5.1	112.2	Y203 Q207 G209	Y203-R205 PolarHBondContact O-N 3.14Å; R205-Q207 WeakPolarHBondContact CD-O 3.2Å; R205-G209 PolarHBondContact NH1-O 3.44Å
206	A	68.6	Low	78.7	Confident	109 Å²	109	75.8 Å²	75.8	90%	0.901	43%	0.433	S	S	*	.	S	Bend	trans	-80.6	-24.1	-178.9	0	0	0	0	0	113.6
207	Q	60.2	Low	79.3	Confident	166 Å²	166	71 Å²	71	78%	0.776	41%	0.411	S	S	*	.	S	Bend	trans	-132.2	146.3	-174.1	-65.5	179.2	-7.9	0	0	111.6	R205	R205-Q207 WeakPolarHBondContact CD-O 3.2Å
208	A	60	Low	79.8	Confident	98 Å²	98	68.5 Å²	68.5	81%	0.81	39%	0.393	S	S	*	.	S	Bend	trans	-79.6	128.2	172.8	0	0	0	0	0	110.1
209	G	66	Low	80.2	Confident	40 Å²	40	66.4 Å²	66.4	41%	0.412	38%	0.378	S	S	.	.	S	Bend	trans	164.6	-165.8	-176.2	0	0	0	0	0	113.2	R205	R205-G209 PolarHBondContact NH1-O 3.44Å
210	P	68.3	Low	80.3	Confident	77 Å²	77	68.6 Å²	68.6	50%	0.5	39%	0.393	S	S	.	.	S	Bend	trans	-69.8	145.7	171.1	27.4	-31.7	0	0	0	111.9	K189 Q212	K189-P210 HydrophobicContact CD-CB 3.82Å; K189-P210 HydrophobicContact CD-CG 4.28Å; P210-Q212 PolarHBondContact O-N 3.44Å; P210-Q212 PolarHBondContact O-NE2 3.14Å
211	I	74.7	Confident	80.6	Confident	12 Å²	12	67.9 Å²	67.9	6%	0.062	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-68.4	124.9	-176	-51.8	-179.4	0	0	0	110	K189 C190 P192 Y203 D215 C238 W244	K189-I211 VanDerWaalsContact CA-O 3.26Å; K189-I211 WeakPolarHBondContact CA-O 3.02Å; K189-I211 VanDerWaalsContact CB-O 3.3Å; K189-I211 WeakPolarHBondContact CB-O 3.37Å; K189-I211 WeakPolarHBondContact CG-O 3.41Å; C190-I211 HydrophobicContact CB-CG2 4.13Å; C190-I211 WeakPolarHBondContact O-CB 3.49Å; P192-I211 HydrophobicContact CB-CD1 4.24Å; Y203-I211 HydrophobicContact CD1-CD1 3.96Å; Y203-I211 HydrophobicContact CE1-CD1 3.57Å; I211-D215 HydrophobicContact CG2-CB 3.82Å; I211-C238 HydrophobicContact CG2-CB 4.13Å; I211-W244 HydrophobicContact CD1-CZ2 3.85Å; I211-W244 HydrophobicContact CG2-CH2 3.94Å; I211-W244 HydrophobicContact CG2-CZ2 3.88Å
212	Q	77	Confident	80.7	Confident	79 Å²	79	70.6 Å²	70.6	37%	0.369	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-102.3	161.6	-178	-59	-62.6	-42.9	0	0	111.7	P210 G214 D215 C238	P210-Q212 PolarHBondContact O-N 3.44Å; P210-Q212 PolarHBondContact O-NE2 3.14Å; Q212-G214 PolarHBondContact O-N 2.92Å; Q212-D215 PolarHBondContact N-OD2 3.29Å; Q212-D215 VanDerWaalsContact O-CB 3.27Å; Q212-D215 WeakPolarHBondContact O-CB 3.19Å; Q212-D215 PolarHBondContact O-N 3.37Å; Q212-D215 VanDerWaalsContact O-N 3.11Å; Q212-C238 WeakPolarHBondContact O-CB 3.24Å; Q212-C238 PolarHBondContact O-SG 3.2Å; Q212-C238 VanDerWaalsContact O-SG 3.33Å
213	P	81.7	Confident	80.7	Confident	53 Å²	53	72.4 Å²	72.4	34%	0.344	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	132.3	172.6	-21.5	37.8	0	0	0	110.4	D188	D188-P213 HydrophobicContact CB-CG 4.33Å; D188-P213 WeakPolarHBondContact O-CD 3.42Å; D188-P213 WeakPolarHBondContact O-CG 3.02Å
214	G	85.9	Confident	80.6	Confident	49 Å²	49	76.5 Å²	76.5	51%	0.505	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	97.1	-17	-174.3	0	0	0	0	0	114.3	Q212 C238	Q212-G214 PolarHBondContact O-N 2.92Å; G214-C238 PolarHBondContact N-O 3.22Å
215	D	86.8	Confident	80.4	Confident	37 Å²	37	73.5 Å²	73.5	20%	0.198	42%	0.419	C	S	.	.			trans	-62.3	145.5	172.9	-75.2	-17.3	0	0	0	110.7	I211 Q212 C238	I211-D215 HydrophobicContact CG2-CB 3.82Å; Q212-D215 PolarHBondContact N-OD2 3.29Å; Q212-D215 VanDerWaalsContact O-CB 3.27Å; Q212-D215 WeakPolarHBondContact O-CB 3.19Å; Q212-D215 PolarHBondContact O-N 3.37Å; Q212-D215 VanDerWaalsContact O-N 3.11Å; D215-C238 HydrophobicContact CB-CB 4.46Å; D215-C238 WeakPolarHBondContact O-CB 3.21Å; D215-C238 PolarHBondContact O-N 3.45Å
216	R	88.9	Confident	80.9	Confident	131 Å²	131	71.2 Å²	71.2	49%	0.494	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	138.9	-178.3	-60.4	-179.5	-178.9	-178.3	-0.1	110.8	L204 L235 R236 T237	L204-R216 HydrophobicContact CB-CB 4.35Å; L204-R216 HydrophobicContact CD1-CB 4.46Å; L204-R216 PolarHBondContact N-O 3.4Å; R216-L235 HydrophobicContact CB-CD1 4.01Å; R216-R236 CarbonylContact C-O 3.52Å; R216-R236 WeakPolarHBondContact CA-O 3.07Å; R216-T237 HydrophobicContact CG-CG2 4.13Å
217	A	88.4	Confident	81.8	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	127.8	172	0	0	0	0	0	109.2	F193 V201 V202 Y203 R236 W244	F193-A217 HydrophobicContact CD2-CB 4.19Å; F193-A217 HydrophobicContact CE2-CB 3.65Å; V201-A217 HydrophobicContact CG1-CB 3.88Å; V202-A217 WeakPolarHBondContact O-CA 3.21Å; Y203-A217 HydrophobicContact CD1-CB 3.81Å; Y203-A217 HydrophobicContact CE1-CB 3.93Å; A217-R236 PolarHBondContact N-O 3.38Å; A217-R236 PolarHBondContact O-N 3.38Å; A217-W244 HydrophobicContact CB-CE3 4.33Å; A217-W244 HydrophobicContact CB-CH2 3.56Å; A217-W244 HydrophobicContact CB-CZ2 4.25Å; A217-W244 HydrophobicContact CB-CZ3 3.61Å
218	R	91	Very high	83.3	Confident	133 Å²	133	61.3 Å²	61.3	50%	0.502	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	120	171.4	-177.8	178.5	-72.8	176.9	-2.9	108.9	V202 L204 T220 S234 L235	V202-R218 PolarHBondContact N-O 3.17Å; V202-R218 PolarHBondContact O-N 3.4Å; L204-R218 HydrophobicContact CD1-CB 4.32Å; L204-R218 HydrophobicContact CG-CB 4.5Å; R218-T220 HydrophobicContact CG-CG2 4.21Å; R218-S234 CarbonylContact C-O 3.56Å; R218-S234 WeakPolarHBondContact CA-O 3.33Å; R218-L235 HydrophobicContact CB-CD1 4.48Å
219	I	91.8	Very high	84.7	Confident	3 Å²	3	57.9 Å²	57.9	2%	0.015	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	130.5	175.9	-52.8	-168.6	0	0	0	108.4	F193 F199 V201 L228 S234 R236 P250	F193-I219 HydrophobicContact CD1-CD1 4.27Å; F193-I219 HydrophobicContact CE1-CD1 4.03Å; F193-I219 HydrophobicContact CZ-CD1 4.16Å; F199-I219 HydrophobicContact CB-CG2 4.15Å; F199-I219 HydrophobicContact CD2-CG2 4.27Å; F199-I219 HydrophobicContact CG-CG2 4.42Å; V201-I219 HydrophobicContact CG1-CG1 4.36Å; V201-I219 HydrophobicContact CG2-CD1 4.41Å; V201-I219 HydrophobicContact CG2-CG1 4.1Å; I219-L228 HydrophobicContact CB-CD1 4.37Å; I219-L228 HydrophobicContact CG2-CD1 4.42Å; I219-L228 HydrophobicContact CG2-CD2 4.22Å; I219-S234 PolarHBondContact N-O 2.95Å; I219-R236 HydrophobicContact CD1-CG 4.27Å; I219-P250 HydrophobicContact CD1-CB 4.4Å; I219-P250 HydrophobicContact CD1-CG 3.56Å; I219-P250 HydrophobicContact CG2-CB 3.89Å; I219-P250 HydrophobicContact CG2-CG 3.99Å
220	T	91.1	Very high	85.6	Confident	59 Å²	59	59.8 Å²	59.8	36%	0.362	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	140.3	176.8	52.2	0	0	0	0	109.4	F199 S200 R218	F199-T220 CarbonylContact C-O 3.36Å; F199-T220 WeakPolarHBondContact CA-O 2.84Å; S200-T220 PolarHBondContact N-O 2.89Å; S200-T220 PolarHBondContact O-N 3.3Å; S200-T220 PolarHBondContact OG-O 3.04Å; S200-T220 PolarHBondContact OG-OG1 3.25Å; R218-T220 HydrophobicContact CG-CG2 4.21Å
221	C	91.2	Very high	86.4	Confident	23 Å²	23	63.4 Å²	63.4	16%	0.155	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	139.6	173.3	-64.9	0	0	0	0	110.1	H226 C252	C221-H226 HydrophobicContact CB-CB 3.9Å; C221-H226 WeakPolarHBondContact CB-O 3.31Å; C221-C252 WeakPolarHBondContact CA-SG 3.36Å; C221-C252 HydrophobicContact CB-CB 3.8Å; C221-C252 WeakPolarHBondContact CB-SG 3.03Å; C221-C252 VanDerWaalsContact SG-CA 3.57Å; C221-C252 WeakPolarHBondContact SG-CB 3.31Å; C221-C252 CovalentContact SG-SG 2.04Å; C221-C252 PolarHBondContact SG-SG 3.09Å
222	L	88.8	Confident	87.1	Confident	95 Å²	95	64.1 Å²	64.1	50%	0.497	34%	0.344	S	S	.	.	S	Bend	trans	-77.4	-31	-178.3	-84	157.8	0	0	0	112.1	E197 S198	E197-L222 VanDerWaalsContact O-CD1 3.25Å; E197-L222 WeakPolarHBondContact O-CD1 3.26Å; S198-L222 PolarHBondContact O-N 2.79Å
223	Q	86	Confident	87.5	Confident	116 Å²	116	65.9 Å²	65.9	54%	0.542	35%	0.352	S	S	.	.	S	Bend	trans	-80	133.1	178	-69.6	179.6	-19.3	0	0	110.9	H226	Q223-H226 HydrophobicContact CB-CB 4.2Å; Q223-H226 WeakPolarHBondContact CB-ND1 3.26Å; Q223-H226 WeakPolarHBondContact O-CB 3.49Å; Q223-H226 PolarHBondContact O-N 2.79Å; Q223-H226 PolarHBondContact OE1-CE1 3.47Å; Q223-H226 PolarHBondContact OE1-NE2 3.45Å
224	N	82.6	Confident	87.9	Confident	146 Å²	146	66.6 Å²	66.6	78%	0.781	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	142.1	173.9	-71	-19.9	0	0	0	110.8	H226	N224-H226 PolarHBondContact O-N 2.95Å; N224-H226 PolarHBondContact O-ND1 3.16Å; N224-H226 VanDerWaalsContact O-ND1 3.08Å
225	G	81.9	Confident	88.3	Confident	18 Å²	18	66.9 Å²	66.9	19%	0.186	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.9	15	-177.9	0	0	0	0	0	114.5	E255	G225-E255 WeakPolarHBondContact O-CB 3.45Å; G225-E255 PolarHBondContact O-N 2.96Å
226	H	87.3	Confident	88.5	Confident	52 Å²	52	65.2 Å²	65.2	24%	0.241	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	139.3	172.9	-68	63.3	0	0	0	110.2	C221 Q223 N224 C252 V253 A254	C221-H226 HydrophobicContact CB-CB 3.9Å; C221-H226 WeakPolarHBondContact CB-O 3.31Å; Q223-H226 HydrophobicContact CB-CB 4.2Å; Q223-H226 WeakPolarHBondContact CB-ND1 3.26Å; Q223-H226 WeakPolarHBondContact O-CB 3.49Å; Q223-H226 PolarHBondContact O-N 2.79Å; Q223-H226 PolarHBondContact OE1-CE1 3.47Å; Q223-H226 PolarHBondContact OE1-NE2 3.45Å; N224-H226 PolarHBondContact O-N 2.95Å; N224-H226 PolarHBondContact O-ND1 3.16Å; N224-H226 VanDerWaalsContact O-ND1 3.08Å; H226-C252 HydrophobicContact CB-CB 4.43Å; H226-V253 CarbonylContact C-O 3.56Å; H226-V253 VanDerWaalsContact CA-O 3.27Å; H226-V253 WeakPolarHBondContact CA-O 3.37Å; H226-A254 PolarHBondContact CD2-N 3.26Å
227	V	89.1	Confident	88.5	Confident	43 Å²	43	60.8 Å²	60.8	26%	0.261	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	165	177.6	-62.2	0	0	0	0	109.5	V253 E255 N290	V227-V253 PolarHBondContact N-O 2.94Å; V227-V253 PolarHBondContact O-N 3.29Å; V227-V253 VanDerWaalsContact O-O 3.09Å; V227-E255 HydrophobicContact CG1-CB 4.06Å; V227-E255 HydrophobicContact CG1-CG 4.02Å; V227-E255 WeakPolarHBondContact CG1-OE2 3.05Å; V227-E255 HydrophobicContact CG2-CB 3.92Å; V227-E255 HydrophobicContact CG2-CG 4.04Å; V227-N290 WeakPolarHBondContact CG2-ND2 3.29Å
228	L	90.1	Very high	88.4	Confident	23 Å²	23	60.9 Å²	60.9	12%	0.12	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	148.2	176.6	-69.2	167.8	0	0	0	110.3	I219 Q232 S234 P250	I219-L228 HydrophobicContact CB-CD1 4.37Å; I219-L228 HydrophobicContact CG2-CD1 4.42Å; I219-L228 HydrophobicContact CG2-CD2 4.22Å; L228-Q232 HydrophobicContact CB-CB 4.22Å; L228-S234 VanDerWaalsContact CD1-CA 3.4Å; L228-P250 HydrophobicContact CD2-CB 3.81Å
229	S	90.4	Very high	88.2	Confident	26 Å²	26	58.4 Å²	58.4	18%	0.182	32%	0.321	C	S	.	.			trans	-49.5	146.5	171.1	-176	0	0	0	0	111.2	N231 Q232 I251	S229-N231 PolarHBondContact O-N 3.29Å; S229-Q232 PolarHBondContact O-N 3.44Å; S229-I251 PolarHBondContact N-O 3.3Å
230	P	84.7	Confident	87.7	Confident	81 Å²	81	62.9 Å²	62.9	53%	0.526	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-14.2	-166.1	12.7	-11.1	0	0	0	114.1	N290	P230-N290 WeakPolarHBondContact CD-OD1 3.13Å; P230-N290 WeakPolarHBondContact CG-OD1 3.39Å
231	N	84.7	Confident	87.1	Confident	153 Å²	153	63.9 Å²	63.9	82%	0.818	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.5	4.7	177.2	-64.4	-22.3	0	0	0	113.9	S229	S229-N231 PolarHBondContact O-N 3.29Å
232	Q	88.7	Confident	86.5	Confident	27 Å²	27	63.2 Å²	63.2	13%	0.126	35%	0.353	C	S	.	.	S	Bend	trans	-113.1	138.9	-177	-67	-172.3	-41.5	0	0	111.6	L228 S229 S248 V249	L228-Q232 HydrophobicContact CB-CB 4.22Å; S229-Q232 PolarHBondContact O-N 3.44Å; Q232-S248 PolarHBondContact NE2-OG 2.83Å; Q232-V249 PolarHBondContact NE2-O 2.77Å
233	Q	87.1	Confident	86.3	Confident	116 Å²	116	63.1 Å²	63.1	54%	0.542	35%	0.349	S	S	.	.			trans	-92.5	132.7	179.2	-64.5	-179.1	1.8	0	0	110.8	L235	Q233-L235 VanDerWaalsContact C-N 3.28Å; Q233-L235 PolarHBondContact O-N 3.35Å
234	S	90	Very high	86.2	Confident	67 Å²	67	58 Å²	58	47%	0.469	32%	0.324	S	S	.	.	S	Bend	trans	-68.2	-28.6	172.9	62.8	0	0	0	0	112.7	R218 I219 L228	R218-S234 CarbonylContact C-O 3.56Å; R218-S234 WeakPolarHBondContact CA-O 3.33Å; I219-S234 PolarHBondContact N-O 2.95Å; L228-S234 VanDerWaalsContact CD1-CA 3.4Å
235	L	93.1	Very high	86.4	Confident	56 Å²	56	53.9 Å²	53.9	29%	0.293	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	114.5	177.3	-170.3	69.7	0	0	0	109.4	L204 R216 R218 Q233	L204-L235 HydrophobicContact CD1-CD1 3.9Å; R216-L235 HydrophobicContact CB-CD1 4.01Å; R218-L235 HydrophobicContact CB-CD1 4.48Å; Q233-L235 VanDerWaalsContact C-N 3.28Å; Q233-L235 PolarHBondContact O-N 3.35Å
236	R	91.1	Very high	86.6	Confident	1 Å²	1	54.2 Å²	54.2	0%	0.004	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	137.2	176.2	-59.7	-172.6	174.8	-172.1	3.3	109.1	F193 R216 A217 I219 W244 T245 D246 S248	F193-R236 VanDerWaalsContact CE1-NH1 3.31Å; F193-R236 HydrophobicContact CZ-CB 4.15Å; F193-R236 VanDerWaalsContact CZ-CD 3.45Å; F193-R236 HydrophobicContact CZ-CG 4.4Å; R216-R236 CarbonylContact C-O 3.52Å; R216-R236 WeakPolarHBondContact CA-O 3.07Å; A217-R236 PolarHBondContact N-O 3.38Å; A217-R236 PolarHBondContact O-N 3.38Å; I219-R236 HydrophobicContact CD1-CG 4.27Å; R236-W244 HydrophobicContact CB-CD2 4.47Å; R236-W244 HydrophobicContact CB-CE3 3.81Å; R236-W244 HydrophobicContact CB-CZ3 4.49Å; R236-W244 VanDerWaalsContact O-CZ3 3.31Å; R236-W244 WeakPolarHBondContact O-CZ3 3.1Å; R236-T245 WeakPolarHBondContact CA-OG1 3.48Å; R236-D246 WeakPolarHBondContact CD-O 3.15Å; R236-D246 HydrophobicContact CG-CB 4.32Å; R236-D246 VanDerWaalsContact CZ-O 3.26Å; R236-D246 IonicContact CZ-OD1 3.73Å; R236-D246 IonicContact CZ-OD2 2.91Å; R236-D246 PolarHBondContact NE-O 2.68Å; R236-D246 IonicContact NE-OD2 3.66Å; R236-D246 PolarHBondContact NE-OD2 3.03Å; R236-D246 PolarHBondContact NH1-O 2.86Å; R236-D246 IonicContact NH2-OD1 3.34Å; R236-D246 IonicContact NH2-OD2 3.42Å; R236-D246 PolarHBondContact NH2-OD2 2.97Å; R236-S248 PolarHBondContact NH1-O 2.81Å; R236-S248 PolarHBondContact NH2-O 2.96Å; R236-S248 PolarHBondContact NH2-OG 3.19Å
237	T	90.5	Very high	86.3	Confident	39 Å²	39	55.8 Å²	55.8	24%	0.239	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	134.5	-179.7	-54	0	0	0	0	109.8	R216 Q239 W244 T245	R216-T237 HydrophobicContact CG-CG2 4.13Å; T237-Q239 PolarHBondContact O-N 2.96Å; T237-W244 CarbonylContact O-C 3.53Å; T237-W244 WeakPolarHBondContact O-CA 2.95Å; T237-T245 PolarHBondContact N-OG1 3.27Å; T237-T245 WeakPolarHBondContact O-CG2 3.43Å; T237-T245 PolarHBondContact O-N 2.84Å
238	C	86.3	Confident	86	Confident	2 Å²	2	55.9 Å²	55.9	1%	0.014	31%	0.314	C	S	.	.	B	Isolated β-bridge	trans	-72.4	120.3	173.4	178.4	0	0	0	0	109.1	C190 I211 Q212 G214 D215 W244	C190-C238 HydrophobicContact CB-CB 3.76Å; C190-C238 WeakPolarHBondContact CB-SG 3.47Å; C190-C238 WeakPolarHBondContact SG-CA 3.48Å; C190-C238 WeakPolarHBondContact SG-CB 3.01Å; C190-C238 CovalentContact SG-SG 2.02Å; C190-C238 PolarHBondContact SG-SG 2.86Å; I211-C238 HydrophobicContact CG2-CB 4.13Å; Q212-C238 WeakPolarHBondContact O-CB 3.24Å; Q212-C238 PolarHBondContact O-SG 3.2Å; Q212-C238 VanDerWaalsContact O-SG 3.33Å; G214-C238 PolarHBondContact N-O 3.22Å; D215-C238 HydrophobicContact CB-CB 4.46Å; D215-C238 WeakPolarHBondContact O-CB 3.21Å; D215-C238 PolarHBondContact O-N 3.45Å; C238-W244 HydrophobicContact CB-CE3 4.21Å; C238-W244 HydrophobicContact CB-CH2 4.16Å; C238-W244 HydrophobicContact CB-CZ3 3.98Å
239	Q	85.9	Confident	85.6	Confident	80 Å²	80	59.7 Å²	59.7	37%	0.374	34%	0.338	S	S	.	.			trans	-88.4	162.4	178.7	-61.6	177.9	-39	0	0	110.6	T237 N241 G242 F243 T245	T237-Q239 PolarHBondContact O-N 2.96Å; Q239-N241 WeakPolarHBondContact CB-OD1 3.24Å; Q239-N241 PolarHBondContact O-N 3.32Å; Q239-N241 VanDerWaalsContact O-N 3.11Å; Q239-N241 PolarHBondContact OE1-ND2 3.48Å; Q239-G242 PolarHBondContact O-N 3.23Å; Q239-G242 VanDerWaalsContact O-N 3.1Å; Q239-F243 VanDerWaalsContact CB-O 3.23Å; Q239-F243 WeakPolarHBondContact CB-O 3.16Å; Q239-F243 WeakPolarHBondContact CG-O 3.28Å; Q239-F243 PolarHBondContact N-O 3.05Å; Q239-T245 HydrophobicContact CG-CG2 4.09Å
240	S	81	Confident	85.5	Confident	97 Å²	97	58.9 Å²	58.9	68%	0.678	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-8.4	178.9	54.3	0	0	0	0	115	G242	S240-G242 VanDerWaalsContact C-N 3.31Å
241	N	78.6	Confident	85.7	Confident	81 Å²	81	59.6 Å²	59.6	43%	0.433	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	5	174.2	61.5	6.2	0	0	0	112.7	R187 Q239 F243	R187-N241 CarbonylContact O-C 3.31Å; R187-N241 VanDerWaalsContact O-C 3.31Å; Q239-N241 WeakPolarHBondContact CB-OD1 3.24Å; Q239-N241 PolarHBondContact O-N 3.32Å; Q239-N241 VanDerWaalsContact O-N 3.11Å; Q239-N241 PolarHBondContact OE1-ND2 3.48Å; N241-F243 VanDerWaalsContact C-N 3.31Å; N241-F243 HydrophobicContact CB-CD2 4.09Å; N241-F243 VanDerWaalsContact O-CD2 3.22Å; N241-F243 WeakPolarHBondContact O-CD2 3.48Å; N241-F243 WeakPolarHBondContact O-CE2 3.42Å; N241-F243 PolarHBondContact O-N 3.07Å; N241-F243 WeakPolarHBondContact OD1-CB 3.23Å; N241-F243 PolarHBondContact OD1-N 3.46Å
242	G	78.9	Confident	86	Confident	9 Å²	9	53.6 Å²	53.6	9%	0.093	30%	0.3	C	S	.	.	S	Bend	trans	79.3	9	-177.2	0	0	0	0	0	114.3	R187 C190 Q239 S240	R187-G242 PolarHBondContact O-N 3.2Å; C190-G242 WeakPolarHBondContact CA-O 3.32Å; Q239-G242 PolarHBondContact O-N 3.23Å; Q239-G242 VanDerWaalsContact O-N 3.1Å; S240-G242 VanDerWaalsContact C-N 3.31Å
243	F	83.9	Confident	86	Confident	92 Å²	92	53.8 Å²	53.8	40%	0.404	30%	0.303	S	S	.	.			trans	-112.6	144.9	179.7	-61.8	-73.3	0	0	0	112.5	C190 Q239 N241 M247	C190-F243 VanDerWaalsContact SG-C 3.6Å; Q239-F243 VanDerWaalsContact CB-O 3.23Å; Q239-F243 WeakPolarHBondContact CB-O 3.16Å; Q239-F243 WeakPolarHBondContact CG-O 3.28Å; Q239-F243 PolarHBondContact N-O 3.05Å; N241-F243 VanDerWaalsContact C-N 3.31Å; N241-F243 HydrophobicContact CB-CD2 4.09Å; N241-F243 VanDerWaalsContact O-CD2 3.22Å; N241-F243 WeakPolarHBondContact O-CD2 3.48Å; N241-F243 WeakPolarHBondContact O-CE2 3.42Å; N241-F243 PolarHBondContact O-N 3.07Å; N241-F243 WeakPolarHBondContact OD1-CB 3.23Å; N241-F243 PolarHBondContact OD1-N 3.46Å; F243-M247 HydrophobicContact CB-CE 3.5Å; F243-M247 VanDerWaalsContact CB-CE 3.5Å; F243-M247 HydrophobicContact CD1-CE 3.53Å; F243-M247 HydrophobicContact CG-CE 3.99Å
244	W	84.9	Confident	85.9	Confident	8 Å²	8	50 Å²	50	3%	0.03	29%	0.292	C	S	.	.	B	Isolated β-bridge	trans	-69.9	148.6	167	-66.4	100	0	0	0	111.2	C190 P191 F193 Y203 I211 A217 R236 T237 C238 D246 M247	C190-W244 HydrophobicContact CB-CD2 4.3Å; C190-W244 HydrophobicContact CB-CZ2 4.05Å; P191-W244 PolarHBondContact O-NE1 2.93Å; F193-W244 HydrophobicContact CD2-CZ2 4.4Å; F193-W244 AromaticContact CE2-CD2 3.69Å; F193-W244 HydrophobicContact CE2-CD2 3.69Å; F193-W244 AromaticContact CE2-CE2 3.48Å; F193-W244 VanDerWaalsContact CE2-CE2 3.48Å; F193-W244 HydrophobicContact CE2-CE3 4.15Å; F193-W244 HydrophobicContact CE2-CG 4.1Å; F193-W244 HydrophobicContact CE2-CH2 4.31Å; F193-W244 AromaticContact CE2-CZ2 3.82Å; F193-W244 HydrophobicContact CE2-CZ2 3.82Å; F193-W244 HydrophobicContact CE2-CZ3 4.45Å; F193-W244 AromaticContact CE2-NE1 3.72Å; F193-W244 HydrophobicContact CZ-CB 4.29Å; F193-W244 AromaticContact CZ-CD1 3.78Å; F193-W244 AromaticContact CZ-CD2 3.73Å; F193-W244 HydrophobicContact CZ-CD2 3.73Å; F193-W244 AromaticContact CZ-CE2 3.91Å; F193-W244 HydrophobicContact CZ-CE3 4.32Å; F193-W244 AromaticContact CZ-CG 3.68Å; F193-W244 HydrophobicContact CZ-CG 3.68Å; F193-W244 AromaticContact CZ-NE1 3.89Å; Y203-W244 HydrophobicContact CD1-CH2 4.12Å; Y203-W244 HydrophobicContact CD1-CZ2 4.31Å; Y203-W244 HydrophobicContact CE1-CH2 4.09Å; Y203-W244 AromaticContact CE1-CZ2 3.86Å; Y203-W244 HydrophobicContact CE1-CZ2 3.86Å; I211-W244 HydrophobicContact CD1-CZ2 3.85Å; I211-W244 HydrophobicContact CG2-CH2 3.94Å; I211-W244 HydrophobicContact CG2-CZ2 3.88Å; A217-W244 HydrophobicContact CB-CE3 4.33Å; A217-W244 HydrophobicContact CB-CH2 3.56Å; A217-W244 HydrophobicContact CB-CZ2 4.25Å; A217-W244 HydrophobicContact CB-CZ3 3.61Å; R236-W244 HydrophobicContact CB-CD2 4.47Å; R236-W244 HydrophobicContact CB-CE3 3.81Å; R236-W244 HydrophobicContact CB-CZ3 4.49Å; R236-W244 VanDerWaalsContact O-CZ3 3.31Å; R236-W244 WeakPolarHBondContact O-CZ3 3.1Å; T237-W244 CarbonylContact O-C 3.53Å; T237-W244 WeakPolarHBondContact O-CA 2.95Å; C238-W244 HydrophobicContact CB-CE3 4.21Å; C238-W244 HydrophobicContact CB-CH2 4.16Å; C238-W244 HydrophobicContact CB-CZ3 3.98Å; W244-D246 PolarHBondContact O-N 3.11Å; W244-D246 VanDerWaalsContact O-N 3.11Å; W244-M247 HydrophobicContact CB-CE 4.03Å; W244-M247 HydrophobicContact CB-SD 4.09Å; W244-M247 HydrophobicContact CG-SD 4.41Å
245	T	85.9	Confident	85.7	Confident	60 Å²	60	51 Å²	51	37%	0.368	29%	0.289	S	S	.	.	S	Bend	trans	-52	-32.4	174.2	47.6	0	0	0	0	113.8	R236 T237 Q239	R236-T245 WeakPolarHBondContact CA-OG1 3.48Å; T237-T245 PolarHBondContact N-OG1 3.27Å; T237-T245 WeakPolarHBondContact O-CG2 3.43Å; T237-T245 PolarHBondContact O-N 2.84Å; Q239-T245 HydrophobicContact CG-CG2 4.09Å
246	D	86.3	Confident	85.4	Confident	26 Å²	26	48.7 Å²	48.7	14%	0.139	28%	0.278	C	S	.	.			trans	-133.5	113.8	174.1	175.7	10.4	0	0	0	108.7	R236 W244 S248	R236-D246 WeakPolarHBondContact CD-O 3.15Å; R236-D246 HydrophobicContact CG-CB 4.32Å; R236-D246 VanDerWaalsContact CZ-O 3.26Å; R236-D246 IonicContact CZ-OD1 3.73Å; R236-D246 IonicContact CZ-OD2 2.91Å; R236-D246 PolarHBondContact NE-O 2.68Å; R236-D246 IonicContact NE-OD2 3.66Å; R236-D246 PolarHBondContact NE-OD2 3.03Å; R236-D246 PolarHBondContact NH1-O 2.86Å; R236-D246 IonicContact NH2-OD1 3.34Å; R236-D246 IonicContact NH2-OD2 3.42Å; R236-D246 PolarHBondContact NH2-OD2 2.97Å; W244-D246 PolarHBondContact O-N 3.11Å; W244-D246 VanDerWaalsContact O-N 3.11Å; D246-S248 VanDerWaalsContact CG-OG 3.28Å; D246-S248 VanDerWaalsContact OD1-CB 3.24Å; D246-S248 WeakPolarHBondContact OD1-CB 3.31Å; D246-S248 PolarHBondContact OD1-N 3.03Å; D246-S248 PolarHBondContact OD1-OG 3.04Å; D246-S248 PolarHBondContact OD2-OG 3.47Å
247	M	80.7	Confident	85.3	Confident	84 Å²	84	48.6 Å²	48.6	41%	0.414	28%	0.278	S	S	.	.			trans	-94.7	0.9	179.5	-148.5	68.4	65.6	0	0	113.2	F243 W244	F243-M247 HydrophobicContact CB-CE 3.5Å; F243-M247 VanDerWaalsContact CB-CE 3.5Å; F243-M247 HydrophobicContact CD1-CE 3.53Å; F243-M247 HydrophobicContact CG-CE 3.99Å; W244-M247 HydrophobicContact CB-CE 4.03Å; W244-M247 HydrophobicContact CB-SD 4.09Å; W244-M247 HydrophobicContact CG-SD 4.41Å
248	S	82.5	Confident	85.1	Confident	46 Å²	46	52.3 Å²	52.3	32%	0.322	30%	0.296	S	S	.	.	S	Bend	trans	-66.4	143.2	-178.7	65.7	0	0	0	0	111.3	Q232 R236 D246 P250	Q232-S248 PolarHBondContact NE2-OG 2.83Å; R236-S248 PolarHBondContact NH1-O 2.81Å; R236-S248 PolarHBondContact NH2-O 2.96Å; R236-S248 PolarHBondContact NH2-OG 3.19Å; D246-S248 VanDerWaalsContact CG-OG 3.28Å; D246-S248 VanDerWaalsContact OD1-CB 3.24Å; D246-S248 WeakPolarHBondContact OD1-CB 3.31Å; D246-S248 PolarHBondContact OD1-N 3.03Å; D246-S248 PolarHBondContact OD1-OG 3.04Å; D246-S248 PolarHBondContact OD2-OG 3.47Å; S248-P250 WeakPolarHBondContact O-CD 3.04Å
249	V	83.7	Confident	84.9	Confident	103 Å²	103	55.9 Å²	55.9	62%	0.624	32%	0.32	S	S	*	.	P	Polyproline II helix	trans	-59.8	126.4	173.3	178	0	0	0	0	108.7	F199 Q232 I251	F199-V249 HydrophobicContact CE1-CG1 4.44Å; Q232-V249 PolarHBondContact NE2-O 2.77Å; V249-I251 WeakPolarHBondContact O-CG1 3.49Å; V249-I251 PolarHBondContact O-N 3.23Å
250	P	87.3	Confident	84.7	Confident	9 Å²	9	52.9 Å²	52.9	6%	0.058	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-62.3	122.9	-179.9	-20.5	31.3	0	0	0	111.9	F199 I219 L228 S248	F199-P250 HydrophobicContact CD1-CB 3.75Å; F199-P250 HydrophobicContact CD1-CG 4.18Å; F199-P250 WeakPolarHBondContact CD1-O 3.33Å; F199-P250 HydrophobicContact CD2-CB 4.29Å; F199-P250 HydrophobicContact CD2-CG 4.08Å; F199-P250 HydrophobicContact CE1-CB 3.95Å; F199-P250 HydrophobicContact CE1-CG 3.99Å; F199-P250 HydrophobicContact CE2-CB 4.49Å; F199-P250 HydrophobicContact CE2-CG 3.91Å; F199-P250 HydrophobicContact CG-CB 3.93Å; F199-P250 HydrophobicContact CG-CG 4.22Å; F199-P250 HydrophobicContact CZ-CB 4.33Å; F199-P250 HydrophobicContact CZ-CG 3.87Å; I219-P250 HydrophobicContact CD1-CB 4.4Å; I219-P250 HydrophobicContact CD1-CG 3.56Å; I219-P250 HydrophobicContact CG2-CB 3.89Å; I219-P250 HydrophobicContact CG2-CG 3.99Å; L228-P250 HydrophobicContact CD2-CB 3.81Å; S248-P250 WeakPolarHBondContact O-CD 3.04Å
251	I	88.5	Confident	84.7	Confident	96 Å²	96	51.6 Å²	51.6	49%	0.492	30%	0.296	S	S	.	.			trans	-107.4	113.4	178.4	-56.4	176.3	0	0	0	107.7	S229 V249 V253	S229-I251 PolarHBondContact N-O 3.3Å; V249-I251 WeakPolarHBondContact O-CG1 3.49Å; V249-I251 PolarHBondContact O-N 3.23Å; I251-V253 HydrophobicContact CG2-CG1 4.08Å
252	C	90.2	Very high	84.4	Confident	27 Å²	27	54.9 Å²	54.9	18%	0.182	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	118.8	175.2	-71.5	0	0	0	0	110	S198 C221 H226	S198-C252 PolarHBondContact O-SG 3.44Å; C221-C252 WeakPolarHBondContact CA-SG 3.36Å; C221-C252 HydrophobicContact CB-CB 3.8Å; C221-C252 WeakPolarHBondContact CB-SG 3.03Å; C221-C252 VanDerWaalsContact SG-CA 3.57Å; C221-C252 WeakPolarHBondContact SG-CB 3.31Å; C221-C252 CovalentContact SG-SG 2.04Å; C221-C252 PolarHBondContact SG-SG 3.09Å; H226-C252 HydrophobicContact CB-CB 4.43Å
253	V	88.7	Confident	84.1	Confident	30 Å²	30	57 Å²	57	18%	0.182	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	152.9	175.8	-62.4	0	0	0	0	109.4	H226 V227 I251 E255 N290	H226-V253 CarbonylContact C-O 3.56Å; H226-V253 VanDerWaalsContact CA-O 3.27Å; H226-V253 WeakPolarHBondContact CA-O 3.37Å; V227-V253 PolarHBondContact N-O 2.94Å; V227-V253 PolarHBondContact O-N 3.29Å; V227-V253 VanDerWaalsContact O-O 3.09Å; I251-V253 HydrophobicContact CG2-CG1 4.08Å; V253-E255 PolarHBondContact O-N 3.23Å; V253-N290 VanDerWaalsContact CG2-ND2 3.32Å; V253-N290 WeakPolarHBondContact CG2-ND2 3.36Å
254	A	86	Confident	83.8	Confident	38 Å²	38	59.5 Å²	59.5	31%	0.314	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	128.3	173.6	0	0	0	0	0	109.8	H226 G256 T288	H226-A254 PolarHBondContact CD2-N 3.26Å; A254-G256 VanDerWaalsContact C-N 3.28Å; A254-T288 WeakPolarHBondContact O-CB 3.41Å
255	E	85.2	Confident	83.6	Confident	87 Å²	87	62.7 Å²	62.7	41%	0.407	36%	0.361	S	S	.	.			trans	-61.2	-43.3	175.2	-168.7	166.8	-162.5	0	0	109.8	G225 V227 V253 T288	G225-E255 WeakPolarHBondContact O-CB 3.45Å; G225-E255 PolarHBondContact O-N 2.96Å; V227-E255 HydrophobicContact CG1-CB 4.06Å; V227-E255 HydrophobicContact CG1-CG 4.02Å; V227-E255 WeakPolarHBondContact CG1-OE2 3.05Å; V227-E255 HydrophobicContact CG2-CB 3.92Å; V227-E255 HydrophobicContact CG2-CG 4.04Å; V253-E255 PolarHBondContact O-N 3.23Å; E255-T288 PolarHBondContact O-OG1 2.03Å
256	G	86.6	Confident	83.5	Confident	7 Å²	7	60.8 Å²	60.8	7%	0.072	35%	0.348	C	S	.	.			trans	78.5	179.2	-171	0	0	0	0	0	111.1	A254 I293 G323	A254-G256 VanDerWaalsContact C-N 3.28Å; G256-I293 CarbonylContact C-O 3.59Å; G256-I293 WeakPolarHBondContact CA-O 3.45Å; G256-G323 WeakPolarHBondContact O-CA 3.03Å
257	C	88.8	Confident	83.5	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	36%	0.364	C	S	.	.	B	Isolated β-bridge	trans	-89.6	142.9	175.9	-57.1	0	0	0	0	111	I293 C319 G323 W325	C257-I293 PolarHBondContact N-O 3.49Å; C257-I293 PolarHBondContact O-N 2.95Å; C257-C319 HydrophobicContact CB-CB 3.92Å; C257-C319 WeakPolarHBondContact CB-SG 3.44Å; C257-C319 PolarHBondContact N-SG 3.23Å; C257-C319 VanDerWaalsContact N-SG 3.39Å; C257-C319 WeakPolarHBondContact SG-CA 3Å; C257-C319 WeakPolarHBondContact SG-CB 3.32Å; C257-C319 CovalentContact SG-SG 2.04Å; C257-C319 PolarHBondContact SG-SG 2.7Å; C257-G323 WeakPolarHBondContact CA-O 3.26Å; C257-W325 HydrophobicContact CB-CD2 3.98Å; C257-W325 VanDerWaalsContact CB-CE2 3.44Å; C257-W325 HydrophobicContact CB-CG 4.18Å; C257-W325 HydrophobicContact CB-CZ2 3.8Å
258	D	86.2	Confident	83.8	Confident	117 Å²	117	63.2 Å²	63.2	63%	0.626	36%	0.36	S	S	*	.	P	Polyproline II helix	trans	-60.9	144.6	174.3	-71	-36.3	0	0	0	111.3	W325	D258-W325 PolarHBondContact O-NE1 2.91Å
259	P	83.9	Confident	84.1	Confident	77 Å²	77	63.5 Å²	63.5	50%	0.5	36%	0.36	S	S	.	.	P	Polyproline II helix	trans	-54.3	142.1	168.8	-23.8	33.8	0	0	0	111
260	P	80.9	Confident	84.3	Confident	17 Å²	17	61 Å²	61	11%	0.11	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-57	146.7	175.5	26.8	-34	0	0	0	110	P268 Y270 L299 F301 W330	P260-P268 HydrophobicContact CG-CB 4.17Å; P260-P268 HydrophobicContact CG-CG 4.45Å; P260-Y270 WeakPolarHBondContact CD-OH 3.44Å; P260-Y270 VanDerWaalsContact CG-OH 3.32Å; P260-Y270 WeakPolarHBondContact CG-OH 3.5Å; P260-L299 HydrophobicContact CB-CD2 4.36Å; P260-L299 HydrophobicContact CG-CD2 4.14Å; P260-F301 HydrophobicContact CB-CE1 4.42Å; P260-F301 HydrophobicContact CB-CZ 3.84Å; P260-F301 HydrophobicContact CG-CE1 4.48Å; P260-F301 HydrophobicContact CG-CZ 4.19Å; P260-W330 HydrophobicContact CB-CE3 4.42Å; P260-W330 HydrophobicContact CB-CH2 3.69Å; P260-W330 HydrophobicContact CB-CZ3 3.49Å; P260-W330 VanDerWaalsContact CB-CZ3 3.49Å
261	P	80.3	Confident	84.3	Confident	69 Å²	69	62.8 Å²	62.8	45%	0.448	35%	0.347	S	S	.	.	P	Polyproline II helix	trans	-56.9	152.9	176.4	24.2	-31.8	0	0	0	110.2	L263 W330	P261-L263 VanDerWaalsContact C-N 3.34Å; P261-L263 HydrophobicContact CG-CD1 4.27Å; P261-L263 HydrophobicContact CG-CD2 4.46Å; P261-L263 HydrophobicContact CG-CG 4.16Å; P261-L263 WeakPolarHBondContact O-CG 3.43Å; P261-L263 PolarHBondContact O-N 3.41Å; P261-W330 HydrophobicContact CG-CD2 4.41Å; P261-W330 HydrophobicContact CG-CZ2 4.25Å
262	V	71.9	Confident	84.1	Confident	150 Å²	150	58.8 Å²	58.8	91%	0.909	33%	0.327	S	S	*	.			trans	-64.4	97.9	175.2	-177.4	0	0	0	0	108
263	L	73.5	Confident	83.6	Confident	53 Å²	53	59.2 Å²	59.2	28%	0.277	33%	0.327	S	S	.	.			trans	-99.3	122.7	-179.6	-70.3	162.3	0	0	0	109	P261 Q265 L266 W330	P261-L263 VanDerWaalsContact C-N 3.34Å; P261-L263 HydrophobicContact CG-CD1 4.27Å; P261-L263 HydrophobicContact CG-CD2 4.46Å; P261-L263 HydrophobicContact CG-CG 4.16Å; P261-L263 WeakPolarHBondContact O-CG 3.43Å; P261-L263 PolarHBondContact O-N 3.41Å; L263-Q265 PolarHBondContact O-N 2.63Å; L263-L266 HydrophobicContact CB-CB 3.9Å; L263-L266 HydrophobicContact CB-CD1 3.56Å; L263-L266 HydrophobicContact CB-CG 4.26Å; L263-L266 HydrophobicContact CD1-CD1 3.69Å; L263-L266 HydrophobicContact CG-CD1 4.16Å; L263-L266 PolarHBondContact O-N 2.88Å; L263-L266 VanDerWaalsContact O-N 3.15Å; L263-W330 HydrophobicContact CD1-CB 4.23Å; L263-W330 HydrophobicContact CD1-CD2 4.17Å; L263-W330 HydrophobicContact CD1-CE3 3.86Å; L263-W330 HydrophobicContact CD1-CG 4.34Å
264	D	77.3	Confident	83.1	Confident	145 Å²	145	59.8 Å²	59.8	78%	0.775	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	136.4	-179.8	-85.2	-28	0	0	0	111.3	L266	D264-L266 PolarHBondContact O-N 3.05Å; D264-L266 VanDerWaalsContact O-N 3.1Å
265	Q	80.2	Confident	82.4	Confident	75 Å²	75	62.9 Å²	62.9	35%	0.35	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.5	-0.7	-176.6	-50.3	-59.4	-30	0	0	116.1	L263 C303 K304 F309 C333	L263-Q265 PolarHBondContact O-N 2.63Å; Q265-C303 CarbonylContact O-C 3.53Å; Q265-C303 WeakPolarHBondContact O-CA 3.45Å; Q265-K304 WeakPolarHBondContact O-CB 3.03Å; Q265-K304 PolarHBondContact O-N 2.91Å; Q265-F309 HydrophobicContact CG-CE1 4.43Å; Q265-F309 HydrophobicContact CG-CZ 4.48Å; Q265-C333 HydrophobicContact CB-CB 3.98Å
266	L	84.8	Confident	81.9	Confident	21 Å²	21	63.6 Å²	63.6	11%	0.11	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	132.5	176.7	-78.8	168.7	0	0	0	111.5	L263 D264 F301 L311 P331 C333	L263-L266 HydrophobicContact CB-CB 3.9Å; L263-L266 HydrophobicContact CB-CD1 3.56Å; L263-L266 HydrophobicContact CB-CG 4.26Å; L263-L266 HydrophobicContact CD1-CD1 3.69Å; L263-L266 HydrophobicContact CG-CD1 4.16Å; L263-L266 PolarHBondContact O-N 2.88Å; L263-L266 VanDerWaalsContact O-N 3.15Å; D264-L266 PolarHBondContact O-N 3.05Å; D264-L266 VanDerWaalsContact O-N 3.1Å; L266-F301 HydrophobicContact CB-CD1 4.04Å; L266-F301 HydrophobicContact CB-CE1 4.39Å; L266-F301 HydrophobicContact CD1-CD1 4.43Å; L266-F301 HydrophobicContact CD2-CB 3.89Å; L266-F301 HydrophobicContact CD2-CD1 3.94Å; L266-F301 HydrophobicContact CD2-CG 4.17Å; L266-F301 HydrophobicContact CG-CD1 4.39Å; L266-L311 HydrophobicContact CD2-CD1 3.46Å; L266-L311 VanDerWaalsContact CD2-CD1 3.46Å; L266-P331 HydrophobicContact CD1-CG 4.35Å; L266-P331 WeakPolarHBondContact CD1-O 3.09Å; L266-P331 HydrophobicContact CD2-CG 4.48Å; L266-C333 WeakPolarHBondContact CD2-SG 3.31Å
267	K	86	Confident	81.4	Confident	110 Å²	110	68.8 Å²	68.8	48%	0.478	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	112.2	173.3	-177	-171.4	171.2	-158.5	0	108.6	E302	K267-E302 HydrophobicContact CB-CB 4.44Å; K267-E302 WeakPolarHBondContact CB-O 3.37Å; K267-E302 PolarHBondContact N-O 3.28Å; K267-E302 IonicContact NZ-OE2 3.31Å; K267-E302 PolarHBondContact O-N 2.9Å
268	P	87.1	Confident	80.7	Confident	51 Å²	51	71.4 Å²	71.4	33%	0.331	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	139	173.8	30.6	-32.9	0	0	0	111	P260 Y270 L299 F300 F301	P260-P268 HydrophobicContact CG-CB 4.17Å; P260-P268 HydrophobicContact CG-CG 4.45Å; P268-Y270 HydrophobicContact CB-CE2 4.1Å; P268-Y270 HydrophobicContact CG-CE2 4.35Å; P268-L299 HydrophobicContact CB-CD1 3.52Å; P268-F300 CarbonylContact C-O 3.54Å; P268-F301 HydrophobicContact CB-CD1 4.37Å; P268-F301 HydrophobicContact CB-CE1 3.99Å
269	V	88	Confident	80.4	Confident	51 Å²	51	75.1 Å²	75.1	31%	0.309	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	125.9	174.1	-178.8	0	0	0	0	108.3	L299 F300 E302	V269-L299 WeakPolarHBondContact O-CA 3.49Å; V269-F300 HydrophobicContact CB-CB 4.41Å; V269-F300 PolarHBondContact N-O 2.81Å; V269-F300 PolarHBondContact O-N 2.85Å; V269-E302 HydrophobicContact CG2-CG 4.45Å
270	Y	88.5	Confident	80.2	Confident	51 Å²	51	75.3 Å²	75.3	20%	0.2	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	135.7	-177	-55.9	-81	0	0	0	111.1	P260 P268 I293 V297 R298 L299 W325	P260-Y270 WeakPolarHBondContact CD-OH 3.44Å; P260-Y270 VanDerWaalsContact CG-OH 3.32Å; P260-Y270 WeakPolarHBondContact CG-OH 3.5Å; P268-Y270 HydrophobicContact CB-CE2 4.1Å; P268-Y270 HydrophobicContact CG-CE2 4.35Å; Y270-I293 HydrophobicContact CD1-CD1 3.97Å; Y270-I293 HydrophobicContact CE1-CD1 3.29Å; Y270-I293 HydrophobicContact CE1-CG1 4.37Å; Y270-V297 HydrophobicContact CD1-CG1 4.32Å; Y270-R298 WeakPolarHBondContact CA-O 3.49Å; Y270-L299 HydrophobicContact CD1-CB 4.32Å; Y270-L299 HydrophobicContact CD1-CD1 3.93Å; Y270-L299 HydrophobicContact CE1-CB 4.36Å; Y270-L299 HydrophobicContact CE1-CD1 3.57Å; Y270-L299 HydrophobicContact CE1-CD2 4.31Å; Y270-L299 HydrophobicContact CE1-CG 4.29Å; Y270-W325 HydrophobicContact CD1-CH2 4.44Å; Y270-W325 HydrophobicContact CE1-CH2 4.27Å; Y270-W325 HydrophobicContact CE1-CZ2 4.44Å
271	E	88.1	Confident	80	Confident	47 Å²	47	75 Å²	75	22%	0.22	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	143.3	173	63.6	175.8	-158.5	0	0	111.4	I273 V280 V297 R298 F300	E271-I273 HydrophobicContact CG-CG1 4.41Å; E271-I273 WeakPolarHBondContact OE1-CD1 3.09Å; E271-V280 HydrophobicContact CB-CG1 4.34Å; E271-V280 HydrophobicContact CB-CG2 4.49Å; E271-V297 WeakPolarHBondContact O-CA 3.36Å; E271-V297 WeakPolarHBondContact O-CG1 3.5Å; E271-R298 HydrophobicContact CG-CB 3.88Å; E271-R298 PolarHBondContact N-O 3.19Å; E271-R298 PolarHBondContact O-N 2.91Å; E271-R298 IonicContact OE1-NH1 2.72Å; E271-F300 HydrophobicContact CG-CD2 4.11Å; E271-F300 HydrophobicContact CG-CE2 3.53Å; E271-F300 HydrophobicContact CG-CZ 4.48Å; E271-F300 WeakPolarHBondContact OE1-CE2 3.3Å; E271-F300 WeakPolarHBondContact OE1-CZ 3.42Å
272	N	84.7	Confident	79.8	Confident	11 Å²	11	83.3 Å²	83.3	6%	0.059	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	125.4	171.4	-166.1	-75	0	0	0	108.4	V280 S281 K284	N272-V280 CarbonylContact O-C 3.48Å; N272-V280 VanDerWaalsContact O-CA 3.28Å; N272-V280 WeakPolarHBondContact O-CA 3.43Å; N272-S281 PolarHBondContact O-N 2.93Å; N272-K284 HydrophobicContact CB-CB 4.45Å; N272-K284 WeakPolarHBondContact OD1-CD 3.37Å
273	I	79.9	Confident	80.2	Confident	36 Å²	36	87.8 Å²	87.8	19%	0.185	45%	0.448	C	S	.	.	B	Isolated β-bridge	trans	-104.8	131.8	176.7	-59.9	-161.8	0	0	0	110.4	E271 A275 W279 R298	E271-I273 HydrophobicContact CG-CG1 4.41Å; E271-I273 WeakPolarHBondContact OE1-CD1 3.09Å; I273-A275 PolarHBondContact O-N 2.95Å; I273-W279 WeakPolarHBondContact CA-O 3.3Å; I273-R298 HydrophobicContact CD1-CG 4.41Å; I273-R298 HydrophobicContact CG1-CG 4.46Å
274	D	77.5	Confident	80.6	Confident	43 Å²	43	90.2 Å²	90.2	23%	0.23	46%	0.456	C	S	.	.			trans	-74.9	109.9	168.1	-76.3	-36	0	0	0	110.3	S276 N277 G278 W279 S281 K284	D274-S276 PolarHBondContact O-N 3.25Å; D274-N277 PolarHBondContact O-N 2.02Å; D274-N277 VanDerWaalsContact O-N 3.11Å; D274-G278 PolarHBondContact O-N 2.88Å; D274-W279 PolarHBondContact N-O 3.45Å; D274-S281 VanDerWaalsContact CG-OG 3.23Å; D274-S281 VanDerWaalsContact OD1-CB 3.31Å; D274-S281 WeakPolarHBondContact OD1-CB 3.34Å; D274-S281 PolarHBondContact OD1-OG 3.41Å; D274-S281 WeakPolarHBondContact OD2-CB 3.21Å; D274-S281 PolarHBondContact OD2-OG 3Å; D274-K284 WeakPolarHBondContact OD1-CE 3.18Å; D274-K284 IonicContact OD1-NZ 2.78Å; D274-K284 PolarHBondContact OD1-NZ 3.13Å
275	A	70.3	Confident	80.8	Confident	103 Å²	103	87.1 Å²	87.1	85%	0.851	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-24.1	179.8	0	0	0	0	0	114	I273	I273-A275 PolarHBondContact O-N 2.95Å
276	S	75.9	Confident	81.1	Confident	101 Å²	101	86 Å²	86	71%	0.706	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-33.7	179.7	64.3	0	0	0	0	113.4	D274	D274-S276 PolarHBondContact O-N 3.25Å
277	N	75.3	Confident	81.2	Confident	117 Å²	117	90.8 Å²	90.8	63%	0.626	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.2	-10.6	-170.3	-54.4	18.5	0	0	0	113.4	D274 W279	D274-N277 PolarHBondContact O-N 2.02Å; D274-N277 VanDerWaalsContact O-N 3.11Å; N277-W279 VanDerWaalsContact C-N 3.29Å; N277-W279 PolarHBondContact O-N 2.97Å
278	G	75	Confident	81.2	Confident	54 Å²	54	86.6 Å²	86.6	56%	0.557	44%	0.444	S	S	*	.			trans	76.2	8.5	-178	0	0	0	0	0	115.3	D274	D274-G278 PolarHBondContact O-N 2.88Å
279	W	79	Confident	80.9	Confident	195 Å²	195	89.7 Å²	89.7	74%	0.739	46%	0.461	S	S	*	.			trans	-92.6	154.9	-179.6	-67.4	81.2	0	0	0	112.3	I273 D274 N277 S281	I273-W279 WeakPolarHBondContact CA-O 3.3Å; D274-W279 PolarHBondContact N-O 3.45Å; N277-W279 VanDerWaalsContact C-N 3.29Å; N277-W279 PolarHBondContact O-N 2.97Å; W279-S281 PolarHBondContact O-N 2.85Å
280	V	79.4	Confident	80.6	Confident	82 Å²	82	89.8 Å²	89.8	50%	0.497	46%	0.46	S	S	.	.	B	Isolated β-bridge	trans	-66	114.5	173.8	-178.4	0	0	0	0	110.1	E271 N272	E271-V280 HydrophobicContact CB-CG1 4.34Å; E271-V280 HydrophobicContact CB-CG2 4.49Å; N272-V280 CarbonylContact O-C 3.48Å; N272-V280 VanDerWaalsContact O-CA 3.28Å; N272-V280 WeakPolarHBondContact O-CA 3.43Å
281	S	77.5	Confident	80.3	Confident	10 Å²	10	89.6 Å²	89.6	7%	0.07	47%	0.473	C	S	.	.			trans	-79.6	121.7	176.4	-155.4	0	0	0	0	110.7	N272 D274 W279	N272-S281 PolarHBondContact O-N 2.93Å; D274-S281 VanDerWaalsContact CG-OG 3.23Å; D274-S281 VanDerWaalsContact OD1-CB 3.31Å; D274-S281 WeakPolarHBondContact OD1-CB 3.34Å; D274-S281 PolarHBondContact OD1-OG 3.41Å; D274-S281 WeakPolarHBondContact OD2-CB 3.21Å; D274-S281 PolarHBondContact OD2-OG 3Å; W279-S281 PolarHBondContact O-N 2.85Å
282	R	76.3	Confident	80.2	Confident	243 Å²	243	87.7 Å²	87.7	92%	0.917	47%	0.466	S	S	*	.	S	Bend	trans	-90.8	-7.3	172.1	-74.3	-169.6	-91.2	-149.5	-5.3	113.9
283	R	81.2	Confident	80.4	Confident	244 Å²	244	87.2 Å²	87.2	92%	0.921	46%	0.464	S	S	*	.	S	Bend	trans	-92.9	-21.5	-174.8	-63.8	-174	-170.6	180	3.6	113.6
284	K	80.9	Confident	80.8	Confident	104 Å²	104	86.5 Å²	86.5	45%	0.452	46%	0.464	S	S	.	.	S	Bend	trans	-90.1	139.7	-178	-75.2	169.2	174.5	164	0	110.7	N272 D274	N272-K284 HydrophobicContact CB-CB 4.45Å; N272-K284 WeakPolarHBondContact OD1-CD 3.37Å; D274-K284 WeakPolarHBondContact OD1-CE 3.18Å; D274-K284 IonicContact OD1-NZ 2.78Å; D274-K284 PolarHBondContact OD1-NZ 3.13Å
285	S	82.2	Confident	81.2	Confident	80 Å²	80	87 Å²	87	56%	0.559	47%	0.474	S	S	*	.			trans	-65.6	138.6	172.4	-176.6	0	0	0	0	110.2	Y287	S285-Y287 VanDerWaalsContact C-N 3.33Å; S285-Y287 PolarHBondContact OG-N 3.17Å; S285-Y287 PolarHBondContact OG-O 2.93Å
286	L	85.9	Confident	81.9	Confident	53 Å²	53	84.2 Å²	84.2	28%	0.277	46%	0.455	S	S	.	.	S	Bend	trans	-76	-26.8	171.5	-83	68	0	0	0	111.6	A294	L286-A294 PolarHBondContact O-N 3.02Å
287	Y	87	Confident	82.5	Confident	120 Å²	120	79.4 Å²	79.4	47%	0.471	42%	0.421	S	S	.	.	B	Isolated β-bridge	trans	-113.4	147	-172.6	-54.5	-81.3	0	0	0	111.6	S285 G292 I293	S285-Y287 VanDerWaalsContact C-N 3.33Å; S285-Y287 PolarHBondContact OG-N 3.17Å; S285-Y287 PolarHBondContact OG-O 2.93Å; Y287-G292 CarbonylContact C-O 3.58Å; Y287-G292 WeakPolarHBondContact CA-O 3.35Å; Y287-I293 HydrophobicContact CD1-CG1 4.16Å; Y287-I293 HydrophobicContact CE1-CG1 4.19Å
288	T	85.1	Confident	83.2	Confident	23 Å²	23	78 Å²	78	14%	0.141	41%	0.407	C	S	.	.			trans	-77.6	164.6	169.9	68.6	0	0	0	0	110.2	A254 E255 N290 G291 G292 A294	A254-T288 WeakPolarHBondContact O-CB 3.41Å; E255-T288 PolarHBondContact O-OG1 2.03Å; T288-N290 PolarHBondContact O-N 3.46Å; T288-G291 PolarHBondContact O-N 3.11Å; T288-G292 PolarHBondContact N-O 3.41Å; T288-G292 WeakPolarHBondContact OG1-CA 3.37Å; T288-G292 PolarHBondContact OG1-N 3.43Å; T288-G292 VanDerWaalsContact OG1-N 3.1Å; T288-G292 PolarHBondContact OG1-O 2.82Å; T288-A294 HydrophobicContact CG2-CB 4.26Å
289	V	81	Confident	83.9	Confident	116 Å²	116	75.4 Å²	75.4	70%	0.703	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-23.2	177	-176.7	0	0	0	0	111.7	G291	V289-G291 VanDerWaalsContact C-N 3.32Å
290	N	81.6	Confident	84.4	Confident	52 Å²	52	68.6 Å²	68.6	28%	0.278	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	0.6	176.2	-69.3	-18.6	0	0	0	114	V227 P230 V253 T288 G292	V227-N290 WeakPolarHBondContact CG2-ND2 3.29Å; P230-N290 WeakPolarHBondContact CD-OD1 3.13Å; P230-N290 WeakPolarHBondContact CG-OD1 3.39Å; V253-N290 VanDerWaalsContact CG2-ND2 3.32Å; V253-N290 WeakPolarHBondContact CG2-ND2 3.36Å; T288-N290 PolarHBondContact O-N 3.46Å; N290-G292 VanDerWaalsContact C-N 3.31Å
291	G	83	Confident	84.8	Confident	47 Å²	47	65.2 Å²	65.2	49%	0.485	34%	0.335	S	S	.	.	S	Bend	trans	84.7	-1.1	-177.9	0	0	0	0	0	114.9	T288 V289	T288-G291 PolarHBondContact O-N 3.11Å; V289-G291 VanDerWaalsContact C-N 3.32Å
292	G	86.1	Confident	85.3	Confident	7 Å²	7	69.4 Å²	69.4	7%	0.072	35%	0.353	C	S	.	.	S	Bend	trans	-73.8	173.6	169.8	0	0	0	0	0	112	Y287 T288 N290	Y287-G292 CarbonylContact C-O 3.58Å; Y287-G292 WeakPolarHBondContact CA-O 3.35Å; T288-G292 PolarHBondContact N-O 3.41Å; T288-G292 WeakPolarHBondContact OG1-CA 3.37Å; T288-G292 PolarHBondContact OG1-N 3.43Å; T288-G292 VanDerWaalsContact OG1-N 3.1Å; T288-G292 PolarHBondContact OG1-O 2.82Å; N290-G292 VanDerWaalsContact C-N 3.31Å
293	I	89	Confident	85.9	Confident	2 Å²	2	58.5 Å²	58.5	1%	0.01	31%	0.314	C	S	.	.	B	Isolated β-bridge	trans	-92.8	130.8	178.4	-67.7	159.8	0	0	0	109.8	G256 C257 Y270 Y287 V297 C319 W325	G256-I293 CarbonylContact C-O 3.59Å; G256-I293 WeakPolarHBondContact CA-O 3.45Å; C257-I293 PolarHBondContact N-O 3.49Å; C257-I293 PolarHBondContact O-N 2.95Å; Y270-I293 HydrophobicContact CD1-CD1 3.97Å; Y270-I293 HydrophobicContact CE1-CD1 3.29Å; Y270-I293 HydrophobicContact CE1-CG1 4.37Å; Y287-I293 HydrophobicContact CD1-CG1 4.16Å; Y287-I293 HydrophobicContact CE1-CG1 4.19Å; I293-V297 HydrophobicContact CG2-CB 3.64Å; I293-V297 HydrophobicContact CG2-CG1 3.62Å; I293-V297 HydrophobicContact CG2-CG2 4.13Å; I293-C319 PolarHBondContact O-SG 2.9Å; I293-C319 VanDerWaalsContact O-SG 3.33Å; I293-W325 HydrophobicContact CB-CH2 4.24Å; I293-W325 HydrophobicContact CB-CZ2 3.98Å; I293-W325 HydrophobicContact CD1-CH2 4.08Å; I293-W325 HydrophobicContact CD1-CZ2 3.52Å; I293-W325 HydrophobicContact CG1-CZ2 4.35Å; I293-W325 HydrophobicContact CG2-CH2 3.71Å; I293-W325 HydrophobicContact CG2-CZ2 3.99Å
294	A	88.2	Confident	86.2	Confident	21 Å²	21	54.5 Å²	54.5	17%	0.174	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-65.1	145.5	-173.4	0	0	0	0	0	112.5	L286 T288 G296 V297	L286-A294 PolarHBondContact O-N 3.02Å; T288-A294 HydrophobicContact CG2-CB 4.26Å; A294-G296 PolarHBondContact O-N 2.86Å; A294-V297 HydrophobicContact CB-CG2 4.11Å; A294-V297 VanDerWaalsContact O-CB 3.29Å; A294-V297 WeakPolarHBondContact O-CB 3.35Å; A294-V297 VanDerWaalsContact O-CG2 3.22Å; A294-V297 WeakPolarHBondContact O-CG2 3.43Å; A294-V297 PolarHBondContact O-N 3.01Å; A294-V297 VanDerWaalsContact O-N 3.17Å
295	A	84.8	Confident	86.4	Confident	53 Å²	53	52 Å²	52	44%	0.438	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	137.5	176	0	0	0	0	0	111.4	V297	A295-V297 VanDerWaalsContact C-N 3.34Å
296	G	85.8	Confident	86.4	Confident	44 Å²	44	52.6 Å²	52.6	45%	0.454	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.5	-5.9	-175.7	0	0	0	0	0	115.2	A294 C319	A294-G296 PolarHBondContact O-N 2.86Å; G296-C319 PolarHBondContact N-O 2.97Å
297	V	89.2	Confident	86.1	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	136.3	170	174.4	0	0	0	0	109.6	Y270 E271 I293 A294 A295 C319	Y270-V297 HydrophobicContact CD1-CG1 4.32Å; E271-V297 WeakPolarHBondContact O-CA 3.36Å; E271-V297 WeakPolarHBondContact O-CG1 3.5Å; I293-V297 HydrophobicContact CG2-CB 3.64Å; I293-V297 HydrophobicContact CG2-CG1 3.62Å; I293-V297 HydrophobicContact CG2-CG2 4.13Å; A294-V297 HydrophobicContact CB-CG2 4.11Å; A294-V297 VanDerWaalsContact O-CB 3.29Å; A294-V297 WeakPolarHBondContact O-CB 3.35Å; A294-V297 VanDerWaalsContact O-CG2 3.22Å; A294-V297 WeakPolarHBondContact O-CG2 3.43Å; A294-V297 PolarHBondContact O-N 3.01Å; A294-V297 VanDerWaalsContact O-N 3.17Å; A295-V297 VanDerWaalsContact C-N 3.34Å; V297-C319 PolarHBondContact O-N 3.07Å
298	R	89.2	Confident	85.8	Confident	87 Å²	87	55 Å²	55	33%	0.328	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	141	175.1	-60.8	177.8	79.5	179.8	10.2	110.5	Y270 E271 I273 F300 Y317	Y270-R298 WeakPolarHBondContact CA-O 3.49Å; E271-R298 HydrophobicContact CG-CB 3.88Å; E271-R298 PolarHBondContact N-O 3.19Å; E271-R298 PolarHBondContact O-N 2.91Å; E271-R298 IonicContact OE1-NH1 2.72Å; I273-R298 HydrophobicContact CD1-CG 4.41Å; I273-R298 HydrophobicContact CG1-CG 4.46Å; R298-F300 HydrophobicContact CB-CD2 4.43Å; R298-F300 HydrophobicContact CB-CE2 3.61Å; R298-F300 HydrophobicContact CB-CZ 4.32Å; R298-Y317 CarbonylContact C-O 3.55Å; R298-Y317 VanDerWaalsContact CA-O 3.3Å; R298-Y317 WeakPolarHBondContact CA-O 3.47Å
299	L	89.8	Confident	85.8	Confident	1 Å²	1	56.1 Å²	56.1	1%	0.005	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	125	-179.7	169	57.4	0	0	0	109.1	P260 P268 V269 Y270 F301 V316 Y317 W325	P260-L299 HydrophobicContact CB-CD2 4.36Å; P260-L299 HydrophobicContact CG-CD2 4.14Å; P268-L299 HydrophobicContact CB-CD1 3.52Å; V269-L299 WeakPolarHBondContact O-CA 3.49Å; Y270-L299 HydrophobicContact CD1-CB 4.32Å; Y270-L299 HydrophobicContact CD1-CD1 3.93Å; Y270-L299 HydrophobicContact CE1-CB 4.36Å; Y270-L299 HydrophobicContact CE1-CD1 3.57Å; Y270-L299 HydrophobicContact CE1-CD2 4.31Å; Y270-L299 HydrophobicContact CE1-CG 4.29Å; L299-F301 HydrophobicContact CD1-CE2 4.41Å; L299-F301 HydrophobicContact CD1-CZ 4.35Å; L299-F301 HydrophobicContact CD2-CE2 3.69Å; L299-F301 HydrophobicContact CD2-CZ 3.77Å; L299-F301 HydrophobicContact CG-CD2 4.36Å; L299-F301 HydrophobicContact CG-CE2 3.91Å; L299-F301 HydrophobicContact CG-CZ 4.22Å; L299-V316 WeakPolarHBondContact O-CA 3.41Å; L299-Y317 PolarHBondContact N-O 2.85Å; L299-Y317 PolarHBondContact O-N 2.92Å; L299-W325 HydrophobicContact CB-CE3 4.27Å; L299-W325 HydrophobicContact CB-CH2 3.82Å; L299-W325 HydrophobicContact CB-CZ3 3.56Å; L299-W325 HydrophobicContact CD2-CD2 4.5Å; L299-W325 HydrophobicContact CD2-CE3 4.39Å; L299-W325 HydrophobicContact CD2-CH2 4.15Å; L299-W325 HydrophobicContact CD2-CZ2 4.26Å; L299-W325 HydrophobicContact CD2-CZ3 4.21Å
300	F	89.1	Confident	86	Confident	52 Å²	52	53.1 Å²	53.1	23%	0.228	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	136	174.9	-62.3	-103.2	0	0	0	109.4	P268 V269 E271 R298 R315 V316	P268-F300 CarbonylContact C-O 3.54Å; V269-F300 HydrophobicContact CB-CB 4.41Å; V269-F300 PolarHBondContact N-O 2.81Å; V269-F300 PolarHBondContact O-N 2.85Å; E271-F300 HydrophobicContact CG-CD2 4.11Å; E271-F300 HydrophobicContact CG-CE2 3.53Å; E271-F300 HydrophobicContact CG-CZ 4.48Å; E271-F300 WeakPolarHBondContact OE1-CE2 3.3Å; E271-F300 WeakPolarHBondContact OE1-CZ 3.42Å; R298-F300 HydrophobicContact CB-CD2 4.43Å; R298-F300 HydrophobicContact CB-CE2 3.61Å; R298-F300 HydrophobicContact CB-CZ 4.32Å; F300-R315 WeakPolarHBondContact CA-O 3.45Å; F300-V316 HydrophobicContact CD1-CB 4.19Å; F300-V316 HydrophobicContact CD1-CG1 4Å; F300-V316 HydrophobicContact CD1-CG2 3.51Å; F300-V316 HydrophobicContact CE1-CB 3.91Å; F300-V316 HydrophobicContact CE1-CG1 3.42Å; F300-V316 VanDerWaalsContact CE1-CG1 3.42Å; F300-V316 HydrophobicContact CE1-CG2 3.26Å; F300-V316 HydrophobicContact CE2-CG1 3.98Å; F300-V316 HydrophobicContact CZ-CB 4.38Å; F300-V316 HydrophobicContact CZ-CG1 3.4Å; F300-V316 HydrophobicContact CZ-CG2 4.16Å
301	F	88.4	Confident	86.3	Confident	10 Å²	10	51.4 Å²	51.4	4%	0.044	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	132.6	175.2	-78	-73.9	0	0	0	111.6	P260 L266 P268 L299 L311 R315 Y317 W330 P331	P260-F301 HydrophobicContact CB-CE1 4.42Å; P260-F301 HydrophobicContact CB-CZ 3.84Å; P260-F301 HydrophobicContact CG-CE1 4.48Å; P260-F301 HydrophobicContact CG-CZ 4.19Å; L266-F301 HydrophobicContact CB-CD1 4.04Å; L266-F301 HydrophobicContact CB-CE1 4.39Å; L266-F301 HydrophobicContact CD1-CD1 4.43Å; L266-F301 HydrophobicContact CD2-CB 3.89Å; L266-F301 HydrophobicContact CD2-CD1 3.94Å; L266-F301 HydrophobicContact CD2-CG 4.17Å; L266-F301 HydrophobicContact CG-CD1 4.39Å; P268-F301 HydrophobicContact CB-CD1 4.37Å; P268-F301 HydrophobicContact CB-CE1 3.99Å; L299-F301 HydrophobicContact CD1-CE2 4.41Å; L299-F301 HydrophobicContact CD1-CZ 4.35Å; L299-F301 HydrophobicContact CD2-CE2 3.69Å; L299-F301 HydrophobicContact CD2-CZ 3.77Å; L299-F301 HydrophobicContact CG-CD2 4.36Å; L299-F301 HydrophobicContact CG-CE2 3.91Å; L299-F301 HydrophobicContact CG-CZ 4.22Å; F301-L311 HydrophobicContact CB-CD1 4.25Å; F301-L311 HydrophobicContact CB-CD2 4.36Å; F301-L311 WeakPolarHBondContact O-CD2 3.22Å; F301-R315 PolarHBondContact N-O 3.4Å; F301-Y317 AromaticContact CD2-CD2 3.93Å; F301-Y317 HydrophobicContact CD2-CD2 3.93Å; F301-Y317 AromaticContact CD2-CE2 3.82Å; F301-Y317 HydrophobicContact CD2-CE2 3.82Å; F301-Y317 AromaticContact CE2-CD2 3.94Å; F301-Y317 HydrophobicContact CE2-CD2 3.94Å; F301-Y317 HydrophobicContact CE2-CE2 4.01Å; F301-W330 HydrophobicContact CE2-CE3 4.08Å; F301-W330 AromaticContact CE2-CZ3 3.97Å; F301-W330 HydrophobicContact CE2-CZ3 3.97Å; F301-W330 AromaticContact CZ-CE3 3.96Å; F301-W330 HydrophobicContact CZ-CE3 3.96Å; F301-W330 AromaticContact CZ-CZ3 3.76Å; F301-W330 HydrophobicContact CZ-CZ3 3.76Å; F301-P331 HydrophobicContact CB-CG 4.02Å; F301-P331 HydrophobicContact CD2-CG 3.52Å; F301-P331 HydrophobicContact CE2-CG 4.07Å; F301-P331 HydrophobicContact CG-CG 3.81Å
302	E	87.6	Confident	86.5	Confident	98 Å²	98	51.7 Å²	51.7	46%	0.458	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	144.2	169.9	-65	179.5	165	0	0	109.2	K267 V269	K267-E302 HydrophobicContact CB-CB 4.44Å; K267-E302 WeakPolarHBondContact CB-O 3.37Å; K267-E302 PolarHBondContact N-O 3.28Å; K267-E302 IonicContact NZ-OE2 3.31Å; K267-E302 PolarHBondContact O-N 2.9Å; V269-E302 HydrophobicContact CG2-CG 4.45Å
303	C	89.2	Confident	86.6	Confident	14 Å²	14	53.9 Å²	53.9	10%	0.095	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	134.1	167.4	-62.1	0	0	0	0	109.2	Q265 D305 F309 C333	Q265-C303 CarbonylContact O-C 3.53Å; Q265-C303 WeakPolarHBondContact O-CA 3.45Å; C303-D305 PolarHBondContact O-N 2.71Å; C303-F309 HydrophobicContact CB-CB 3.99Å; C303-C333 WeakPolarHBondContact CA-SG 3.37Å; C303-C333 HydrophobicContact CB-CB 4.07Å; C303-C333 WeakPolarHBondContact CB-SG 3.18Å; C303-C333 WeakPolarHBondContact SG-CB 3.29Å; C303-C333 CovalentContact SG-SG 2.05Å; C303-C333 PolarHBondContact SG-SG 2.81Å
304	K	86.7	Confident	86.6	Confident	160 Å²	160	58.4 Å²	58.4	70%	0.696	32%	0.32	S	S	*	.	S	Bend	trans	-53.4	-38.4	179.2	-175.7	179	179.9	179.6	0	111.9	Q265	Q265-K304 WeakPolarHBondContact O-CB 3.03Å; Q265-K304 PolarHBondContact O-N 2.91Å
305	D	86	Confident	86.5	Confident	52 Å²	52	64.7 Å²	64.7	28%	0.278	34%	0.339	S	S	.	.			trans	-118.1	94.8	170.6	-176.1	-7.8	0	0	0	110.5	C303 L307 H308 F309	C303-D305 PolarHBondContact O-N 2.71Å; D305-L307 PolarHBondContact O-N 3.04Å; D305-L307 WeakPolarHBondContact OD1-CA 3.42Å; D305-L307 WeakPolarHBondContact OD1-CB 2.89Å; D305-L307 PolarHBondContact OD1-N 3.46Å; D305-H308 PolarHBondContact OD1-N 3.39Å; D305-H308 IonicContact OD1-ND1 3.63Å; D305-H308 IonicContact OD2-CE1 3.89Å; D305-H308 IonicContact OD2-CG 3.59Å; D305-H308 IonicContact OD2-ND1 3.71Å; D305-H308 PolarHBondContact OD2-ND1 3.03Å; D305-F309 HydrophobicContact CB-CD2 4.03Å; D305-F309 HydrophobicContact CB-CE2 4.46Å; D305-F309 WeakPolarHBondContact O-CB 3.41Å; D305-F309 PolarHBondContact O-N 3.21Å
306	P	82.2	Confident	86.7	Confident	92 Å²	92	64.1 Å²	64.1	60%	0.597	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-10	179.1	30.1	-34.9	0	0	0	113.1	K336	P306-K336 PolarHBondContact O-NZ 2.05Å
307	L	79.2	Confident	87	Confident	128 Å²	128	62.1 Å²	62.1	67%	0.67	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-42.9	179.1	-165.2	71.7	0	0	0	110.8	D305 K336	D305-L307 PolarHBondContact O-N 3.04Å; D305-L307 WeakPolarHBondContact OD1-CA 3.42Å; D305-L307 WeakPolarHBondContact OD1-CB 2.89Å; D305-L307 PolarHBondContact OD1-N 3.46Å; L307-K336 VanDerWaalsContact O-CD 3.32Å; L307-K336 WeakPolarHBondContact O-CD 3.46Å
308	H	80.5	Confident	87	Confident	96 Å²	96	64 Å²	64	44%	0.444	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.6	-16.2	-176.3	-58.2	101	0	0	0	114.4	D305 L335 K336	D305-H308 PolarHBondContact OD1-N 3.39Å; D305-H308 IonicContact OD1-ND1 3.63Å; D305-H308 IonicContact OD2-CE1 3.89Å; D305-H308 IonicContact OD2-CG 3.59Å; D305-H308 IonicContact OD2-ND1 3.71Å; D305-H308 PolarHBondContact OD2-ND1 3.03Å; H308-L335 HydrophobicContact CB-CD1 4.23Å; H308-L335 WeakPolarHBondContact O-CD1 3.36Å; H308-K336 VanDerWaalsContact O-CB 3.23Å; H308-K336 WeakPolarHBondContact O-CB 3.05Å; H308-K336 PolarHBondContact O-N 3.35Å
309	F	85.9	Confident	87.1	Confident	46 Å²	46	60 Å²	60	20%	0.202	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	153.2	-178.9	-61.9	-96.3	0	0	0	111.8	Q265 C303 D305 C333 K334 L335 K336	Q265-F309 HydrophobicContact CG-CE1 4.43Å; Q265-F309 HydrophobicContact CG-CZ 4.48Å; C303-F309 HydrophobicContact CB-CB 3.99Å; D305-F309 HydrophobicContact CB-CD2 4.03Å; D305-F309 HydrophobicContact CB-CE2 4.46Å; D305-F309 WeakPolarHBondContact O-CB 3.41Å; D305-F309 PolarHBondContact O-N 3.21Å; F309-C333 HydrophobicContact CB-CB 4.29Å; F309-K334 CarbonylContact C-O 3.57Å; F309-K334 VanDerWaalsContact CA-O 3.26Å; F309-K334 WeakPolarHBondContact CA-O 3.35Å; F309-L335 HydrophobicContact CD1-CB 4.36Å; F309-L335 HydrophobicContact CD1-CD1 4.31Å; F309-L335 HydrophobicContact CE1-CB 4.14Å; F309-L335 HydrophobicContact CE1-CD1 3.83Å; F309-L335 HydrophobicContact CE2-CD1 4.18Å; F309-L335 HydrophobicContact CZ-CD1 3.76Å; F309-K336 VanDerWaalsContact O-CE 3.24Å; F309-K336 WeakPolarHBondContact O-CE 3.21Å
310	Y	84.5	Confident	87	Confident	53 Å²	53	64.3 Å²	64.3	21%	0.208	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	144.6	172.8	72.4	-77.3	0	0	0	110.1	V312 C333 K334 K336 E385	Y310-V312 HydrophobicContact CD2-CG2 3.69Å; Y310-V312 HydrophobicContact CE2-CG2 3.21Å; Y310-C333 WeakPolarHBondContact O-CA 3.4Å; Y310-K334 HydrophobicContact CD1-CB 4.27Å; Y310-K334 WeakPolarHBondContact CD1-O 3.05Å; Y310-K334 HydrophobicContact CE1-CB 3.67Å; Y310-K334 PolarHBondContact N-O 3.28Å; Y310-K334 PolarHBondContact O-N 2.93Å; Y310-K336 HydrophobicContact CD1-CG 3.77Å; Y310-K336 HydrophobicContact CG-CG 4.35Å; Y310-E385 HydrophobicContact CD1-CB 3.7Å; Y310-E385 HydrophobicContact CD2-CB 3.77Å; Y310-E385 HydrophobicContact CD2-CG 4.48Å; Y310-E385 HydrophobicContact CE1-CB 4.12Å; Y310-E385 HydrophobicContact CE2-CB 4.17Å; Y310-E385 HydrophobicContact CG-CB 3.51Å; Y310-E385 HydrophobicContact CG-CG 4.13Å
311	L	88.1	Confident	86.7	Confident	17 Å²	17	65.5 Å²	65.5	9%	0.089	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	126.1	-178.1	-169.3	74.8	0	0	0	110.1	L266 F301 R315 P331	L266-L311 HydrophobicContact CD2-CD1 3.46Å; L266-L311 VanDerWaalsContact CD2-CD1 3.46Å; F301-L311 HydrophobicContact CB-CD1 4.25Å; F301-L311 HydrophobicContact CB-CD2 4.36Å; F301-L311 WeakPolarHBondContact O-CD2 3.22Å; L311-R315 HydrophobicContact CD2-CB 4.1Å; L311-R315 HydrophobicContact CD2-CG 3.63Å; L311-P331 HydrophobicContact CD1-CB 3.81Å; L311-P331 HydrophobicContact CD1-CG 4.3Å; L311-P331 HydrophobicContact CG-CB 4.22Å
312	V	87.2	Confident	86.3	Confident	53 Å²	53	67.4 Å²	67.4	32%	0.321	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	124.4	174.6	-179.9	0	0	0	0	108.4	Y310 P331 E332 K334	Y310-V312 HydrophobicContact CD2-CG2 3.69Å; Y310-V312 HydrophobicContact CE2-CG2 3.21Å; V312-P331 CarbonylContact O-C 3.56Å; V312-P331 VanDerWaalsContact O-CA 3.3Å; V312-P331 WeakPolarHBondContact O-CA 3.05Å; V312-E332 PolarHBondContact N-O 3.29Å; V312-E332 PolarHBondContact O-N 2.96Å; V312-K334 HydrophobicContact CG2-CB 4.29Å; V312-K334 HydrophobicContact CG2-CD 4.06Å; V312-K334 HydrophobicContact CG2-CG 4.16Å
313	G	88	Confident	86.1	Confident	53 Å²	53	63.7 Å²	63.7	55%	0.546	36%	0.36	S	S	.	.	S	Bend	trans	119.3	-172.7	-177.7	0	0	0	0	0	112.9
314	E	89.3	Confident	86	Confident	96 Å²	96	69.6 Å²	69.6	45%	0.449	39%	0.386	S	S	.	.			trans	-70	139.3	175.6	176.9	169.9	-150.1	0	0	110.3	Y317	E314-Y317 HydrophobicContact CB-CE1 3.83Å; E314-Y317 HydrophobicContact CB-CE2 4.48Å; E314-Y317 WeakPolarHBondContact CB-OH 3.19Å; E314-Y317 HydrophobicContact CG-CD1 4.3Å; E314-Y317 HydrophobicContact CG-CE1 3.73Å; E314-Y317 HydrophobicContact CG-CE2 4.46Å; E314-Y317 WeakPolarHBondContact O-CE2 3.39Å; E314-Y317 PolarHBondContact O-OH 2.97Å; E314-Y317 VanDerWaalsContact O-OH 3.05Å; E314-Y317 WeakPolarHBondContact OE2-CE1 3.38Å
315	R	85.9	Confident	86.1	Confident	153 Å²	153	62.7 Å²	62.7	58%	0.577	36%	0.356	S	S	*	.			trans	-96.9	-21.6	-172.6	-53.5	-155.5	173.8	-160.1	-1.1	113.5	F300 F301 L311	F300-R315 WeakPolarHBondContact CA-O 3.45Å; F301-R315 PolarHBondContact N-O 3.4Å; L311-R315 HydrophobicContact CD2-CB 4.1Å; L311-R315 HydrophobicContact CD2-CG 3.63Å
316	V	89.5	Confident	86.2	Confident	42 Å²	42	62.4 Å²	62.4	26%	0.255	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	121.2	-166.6	-168.6	0	0	0	0	109.4	L299 F300	L299-V316 WeakPolarHBondContact O-CA 3.41Å; F300-V316 HydrophobicContact CD1-CB 4.19Å; F300-V316 HydrophobicContact CD1-CG1 4Å; F300-V316 HydrophobicContact CD1-CG2 3.51Å; F300-V316 HydrophobicContact CE1-CB 3.91Å; F300-V316 HydrophobicContact CE1-CG1 3.42Å; F300-V316 VanDerWaalsContact CE1-CG1 3.42Å; F300-V316 HydrophobicContact CE1-CG2 3.26Å; F300-V316 HydrophobicContact CE2-CG1 3.98Å; F300-V316 HydrophobicContact CZ-CB 4.38Å; F300-V316 HydrophobicContact CZ-CG1 3.4Å; F300-V316 HydrophobicContact CZ-CG2 4.16Å
317	Y	90.9	Very high	86.4	Confident	1 Å²	1	59.6 Å²	59.6	0%	0.004	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	154.1	178.8	-57.2	-81.1	0	0	0	109.5	R298 L299 F301 E314 I327 E329 P331	R298-Y317 CarbonylContact C-O 3.55Å; R298-Y317 VanDerWaalsContact CA-O 3.3Å; R298-Y317 WeakPolarHBondContact CA-O 3.47Å; L299-Y317 PolarHBondContact N-O 2.85Å; L299-Y317 PolarHBondContact O-N 2.92Å; F301-Y317 AromaticContact CD2-CD2 3.93Å; F301-Y317 HydrophobicContact CD2-CD2 3.93Å; F301-Y317 AromaticContact CD2-CE2 3.82Å; F301-Y317 HydrophobicContact CD2-CE2 3.82Å; F301-Y317 AromaticContact CE2-CD2 3.94Å; F301-Y317 HydrophobicContact CE2-CD2 3.94Å; F301-Y317 HydrophobicContact CE2-CE2 4.01Å; E314-Y317 HydrophobicContact CB-CE1 3.83Å; E314-Y317 HydrophobicContact CB-CE2 4.48Å; E314-Y317 WeakPolarHBondContact CB-OH 3.19Å; E314-Y317 HydrophobicContact CG-CD1 4.3Å; E314-Y317 HydrophobicContact CG-CE1 3.73Å; E314-Y317 HydrophobicContact CG-CE2 4.46Å; E314-Y317 WeakPolarHBondContact O-CE2 3.39Å; E314-Y317 PolarHBondContact O-OH 2.97Å; E314-Y317 VanDerWaalsContact O-OH 3.05Å; E314-Y317 WeakPolarHBondContact OE2-CE1 3.38Å; Y317-I327 HydrophobicContact CD1-CB 3.67Å; Y317-I327 HydrophobicContact CD1-CD1 3.86Å; Y317-I327 HydrophobicContact CD1-CG1 3.74Å; Y317-I327 HydrophobicContact CD2-CD1 4.24Å; Y317-I327 HydrophobicContact CE1-CB 3.85Å; Y317-I327 HydrophobicContact CE1-CD1 3.63Å; Y317-I327 HydrophobicContact CE1-CG1 3.4Å; Y317-I327 HydrophobicContact CE2-CD1 4.03Å; Y317-I327 HydrophobicContact CG-CB 4.4Å; Y317-I327 HydrophobicContact CG-CD1 4.13Å; Y317-I327 HydrophobicContact CG-CG1 4.47Å; Y317-E329 PolarHBondContact OH-O 3.45Å; Y317-P331 HydrophobicContact CE2-CG 4.14Å; Y317-P331 WeakPolarHBondContact OH-CD 3.42Å
318	S	90.6	Very high	86.7	Confident	40 Å²	40	59 Å²	59	28%	0.28	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	138.5	-179.9	-55.1	0	0	0	0	110.4	L320 S326	S318-L320 PolarHBondContact O-N 3.21Å; S318-S326 PolarHBondContact N-OG 2.85Å; S318-S326 PolarHBondContact O-N 3.37Å; S318-S326 PolarHBondContact O-OG 2.83Å
319	C	90.1	Very high	87	Confident	3 Å²	3	61.6 Å²	61.6	2%	0.02	36%	0.357	C	S	.	.	B	Isolated β-bridge	trans	-77.8	117	174.4	179.5	0	0	0	0	109.9	C257 I293 G296 V297 W325	C257-C319 HydrophobicContact CB-CB 3.92Å; C257-C319 WeakPolarHBondContact CB-SG 3.44Å; C257-C319 PolarHBondContact N-SG 3.23Å; C257-C319 VanDerWaalsContact N-SG 3.39Å; C257-C319 WeakPolarHBondContact SG-CA 3Å; C257-C319 WeakPolarHBondContact SG-CB 3.32Å; C257-C319 CovalentContact SG-SG 2.04Å; C257-C319 PolarHBondContact SG-SG 2.7Å; I293-C319 PolarHBondContact O-SG 2.9Å; I293-C319 VanDerWaalsContact O-SG 3.33Å; G296-C319 PolarHBondContact N-O 2.97Å; V297-C319 PolarHBondContact O-N 3.07Å; C319-W325 HydrophobicContact CB-CE3 4.04Å; C319-W325 HydrophobicContact CB-CH2 3.98Å; C319-W325 HydrophobicContact CB-CZ2 4.46Å; C319-W325 HydrophobicContact CB-CZ3 3.75Å
320	L	88.2	Confident	87	Confident	91 Å²	91	63.5 Å²	63.5	48%	0.476	36%	0.363	S	S	.	.			trans	-80.6	157.8	-180	-59	168	0	0	0	110.8	S318 G322 G323 Q324	S318-L320 PolarHBondContact O-N 3.21Å; L320-G322 PolarHBondContact O-N 2.77Å; L320-G323 PolarHBondContact O-N 3.04Å; L320-Q324 VanDerWaalsContact CB-O 3.22Å; L320-Q324 WeakPolarHBondContact CB-O 3.44Å; L320-Q324 WeakPolarHBondContact CG-O 3.31Å; L320-Q324 PolarHBondContact N-O 3.04Å
321	A	82.5	Confident	87.2	Confident	78 Å²	78	61.1 Å²	61.1	65%	0.645	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-18.5	178.3	0	0	0	0	0	114.1	G323	A321-G323 VanDerWaalsContact C-N 3.29Å; A321-G323 PolarHBondContact O-N 2.75Å
322	G	80.7	Confident	87.2	Confident	49 Å²	49	65.2 Å²	65.2	51%	0.505	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	6.9	175.3	0	0	0	0	0	115.3	L320 Q324	L320-G322 PolarHBondContact O-N 2.77Å; G322-Q324 VanDerWaalsContact C-N 3.26Å; G322-Q324 PolarHBondContact O-N 2.73Å
323	G	83.6	Confident	87.3	Confident	20 Å²	20	63.8 Å²	63.8	21%	0.206	36%	0.364	C	S	.	.	S	Bend	trans	76.3	11.7	-176.8	0	0	0	0	0	114.2	G256 C257 L320 A321	G256-G323 WeakPolarHBondContact O-CA 3.03Å; C257-G323 WeakPolarHBondContact CA-O 3.26Å; L320-G323 PolarHBondContact O-N 3.04Å; A321-G323 VanDerWaalsContact C-N 3.29Å; A321-G323 PolarHBondContact O-N 2.75Å
324	Q	87.4	Confident	87.2	Confident	138 Å²	138	65.5 Å²	65.5	65%	0.645	36%	0.356	S	S	*	.			trans	-112.1	136.7	179.4	-162.5	178.6	-31.2	0	0	110.9	L320 G322	L320-Q324 VanDerWaalsContact CB-O 3.22Å; L320-Q324 WeakPolarHBondContact CB-O 3.44Å; L320-Q324 WeakPolarHBondContact CG-O 3.31Å; L320-Q324 PolarHBondContact N-O 3.04Å; G322-Q324 VanDerWaalsContact C-N 3.26Å; G322-Q324 PolarHBondContact O-N 2.73Å
325	W	88.5	Confident	86.9	Confident	16 Å²	16	65.7 Å²	65.7	6%	0.061	36%	0.36	C	S	.	.	B	Isolated β-bridge	trans	-65.8	145.4	169.4	-71.4	106.1	0	0	0	110.8	C257 D258 Y270 I293 L299 C319 I327	C257-W325 HydrophobicContact CB-CD2 3.98Å; C257-W325 VanDerWaalsContact CB-CE2 3.44Å; C257-W325 HydrophobicContact CB-CG 4.18Å; C257-W325 HydrophobicContact CB-CZ2 3.8Å; D258-W325 PolarHBondContact O-NE1 2.91Å; Y270-W325 HydrophobicContact CD1-CH2 4.44Å; Y270-W325 HydrophobicContact CE1-CH2 4.27Å; Y270-W325 HydrophobicContact CE1-CZ2 4.44Å; I293-W325 HydrophobicContact CB-CH2 4.24Å; I293-W325 HydrophobicContact CB-CZ2 3.98Å; I293-W325 HydrophobicContact CD1-CH2 4.08Å; I293-W325 HydrophobicContact CD1-CZ2 3.52Å; I293-W325 HydrophobicContact CG1-CZ2 4.35Å; I293-W325 HydrophobicContact CG2-CH2 3.71Å; I293-W325 HydrophobicContact CG2-CZ2 3.99Å; L299-W325 HydrophobicContact CB-CE3 4.27Å; L299-W325 HydrophobicContact CB-CH2 3.82Å; L299-W325 HydrophobicContact CB-CZ3 3.56Å; L299-W325 HydrophobicContact CD2-CD2 4.5Å; L299-W325 HydrophobicContact CD2-CE3 4.39Å; L299-W325 HydrophobicContact CD2-CH2 4.15Å; L299-W325 HydrophobicContact CD2-CZ2 4.26Å; L299-W325 HydrophobicContact CD2-CZ3 4.21Å; C319-W325 HydrophobicContact CB-CE3 4.04Å; C319-W325 HydrophobicContact CB-CH2 3.98Å; C319-W325 HydrophobicContact CB-CZ2 4.46Å; C319-W325 HydrophobicContact CB-CZ3 3.75Å; W325-I327 HydrophobicContact CB-CB 4.03Å; W325-I327 HydrophobicContact CB-CG2 3.51Å; W325-I327 PolarHBondContact O-N 2.94Å
326	S	88.6	Confident	86.7	Confident	46 Å²	46	61.2 Å²	61.2	32%	0.322	35%	0.345	S	S	.	.	S	Bend	trans	-70.4	39.2	169.3	73.6	0	0	0	0	112.5	S318	S318-S326 PolarHBondContact N-OG 2.85Å; S318-S326 PolarHBondContact O-N 3.37Å; S318-S326 PolarHBondContact O-OG 2.83Å
327	I	85.5	Confident	86.5	Confident	33 Å²	33	67.5 Å²	67.5	17%	0.169	36%	0.364	C	S	.	.			trans	-106	128	-173.5	-167.3	152.2	0	0	0	110.3	Y317 W325 E329 W330	Y317-I327 HydrophobicContact CD1-CB 3.67Å; Y317-I327 HydrophobicContact CD1-CD1 3.86Å; Y317-I327 HydrophobicContact CD1-CG1 3.74Å; Y317-I327 HydrophobicContact CD2-CD1 4.24Å; Y317-I327 HydrophobicContact CE1-CB 3.85Å; Y317-I327 HydrophobicContact CE1-CD1 3.63Å; Y317-I327 HydrophobicContact CE1-CG1 3.4Å; Y317-I327 HydrophobicContact CE2-CD1 4.03Å; Y317-I327 HydrophobicContact CG-CB 4.4Å; Y317-I327 HydrophobicContact CG-CD1 4.13Å; Y317-I327 HydrophobicContact CG-CG1 4.47Å; W325-I327 HydrophobicContact CB-CB 4.03Å; W325-I327 HydrophobicContact CB-CG2 3.51Å; W325-I327 PolarHBondContact O-N 2.94Å; I327-E329 WeakPolarHBondContact CG1-O 3.46Å; I327-W330 HydrophobicContact CD1-CD2 3.41Å; I327-W330 VanDerWaalsContact CD1-CD2 3.41Å; I327-W330 HydrophobicContact CD1-CE3 3.16Å; I327-W330 HydrophobicContact CD1-CG 4.06Å; I327-W330 HydrophobicContact CD1-CH2 3.82Å; I327-W330 HydrophobicContact CD1-CZ2 4.07Å; I327-W330 HydrophobicContact CD1-CZ3 3.36Å; I327-W330 HydrophobicContact CG1-CD2 4.43Å; I327-W330 HydrophobicContact CG2-CZ2 4.32Å
328	S	85.2	Confident	86.1	Confident	116 Å²	116	70.4 Å²	70.4	81%	0.811	38%	0.384	S	S	*	.	S	Bend	trans	-96.7	-40	169.1	52.7	0	0	0	0	111.5
329	E	87.2	Confident	85.9	Confident	149 Å²	149	68.5 Å²	68.5	70%	0.696	37%	0.371	S	S	*	.	S	Bend	trans	-143.6	138.7	-179.8	-170.3	170.7	-160.3	0	0	109.7	Y317 I327	Y317-E329 PolarHBondContact OH-O 3.45Å; I327-E329 WeakPolarHBondContact CG1-O 3.46Å
330	W	86.4	Confident	85.6	Confident	87 Å²	87	75.9 Å²	75.9	33%	0.33	41%	0.405	S	S	.	.			trans	-73.2	138.9	177.5	-66.7	99.2	0	0	0	110.7	P260 P261 L263 F301 I327	P260-W330 HydrophobicContact CB-CE3 4.42Å; P260-W330 HydrophobicContact CB-CH2 3.69Å; P260-W330 HydrophobicContact CB-CZ3 3.49Å; P260-W330 VanDerWaalsContact CB-CZ3 3.49Å; P261-W330 HydrophobicContact CG-CD2 4.41Å; P261-W330 HydrophobicContact CG-CZ2 4.25Å; L263-W330 HydrophobicContact CD1-CB 4.23Å; L263-W330 HydrophobicContact CD1-CD2 4.17Å; L263-W330 HydrophobicContact CD1-CE3 3.86Å; L263-W330 HydrophobicContact CD1-CG 4.34Å; F301-W330 HydrophobicContact CE2-CE3 4.08Å; F301-W330 AromaticContact CE2-CZ3 3.97Å; F301-W330 HydrophobicContact CE2-CZ3 3.97Å; F301-W330 AromaticContact CZ-CE3 3.96Å; F301-W330 HydrophobicContact CZ-CE3 3.96Å; F301-W330 AromaticContact CZ-CZ3 3.76Å; F301-W330 HydrophobicContact CZ-CZ3 3.76Å; I327-W330 HydrophobicContact CD1-CD2 3.41Å; I327-W330 VanDerWaalsContact CD1-CD2 3.41Å; I327-W330 HydrophobicContact CD1-CE3 3.16Å; I327-W330 HydrophobicContact CD1-CG 4.06Å; I327-W330 HydrophobicContact CD1-CH2 3.82Å; I327-W330 HydrophobicContact CD1-CZ2 4.07Å; I327-W330 HydrophobicContact CD1-CZ3 3.36Å; I327-W330 HydrophobicContact CG1-CD2 4.43Å; I327-W330 HydrophobicContact CG2-CZ2 4.32Å
331	P	88.7	Confident	85.3	Confident	2 Å²	2	76.1 Å²	76.1	1%	0.013	40%	0.402	C	S	.	.			trans	-70.6	157.9	177.4	31.7	-32.2	0	0	0	110	L266 F301 L311 V312 Y317	L266-P331 HydrophobicContact CD1-CG 4.35Å; L266-P331 WeakPolarHBondContact CD1-O 3.09Å; L266-P331 HydrophobicContact CD2-CG 4.48Å; F301-P331 HydrophobicContact CB-CG 4.02Å; F301-P331 HydrophobicContact CD2-CG 3.52Å; F301-P331 HydrophobicContact CE2-CG 4.07Å; F301-P331 HydrophobicContact CG-CG 3.81Å; L311-P331 HydrophobicContact CD1-CB 3.81Å; L311-P331 HydrophobicContact CD1-CG 4.3Å; L311-P331 HydrophobicContact CG-CB 4.22Å; V312-P331 CarbonylContact O-C 3.56Å; V312-P331 VanDerWaalsContact O-CA 3.3Å; V312-P331 WeakPolarHBondContact O-CA 3.05Å; Y317-P331 HydrophobicContact CE2-CG 4.14Å; Y317-P331 WeakPolarHBondContact OH-CD 3.42Å
332	E	87.5	Confident	85.3	Confident	104 Å²	104	72.9 Å²	72.9	49%	0.486	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	137.4	176.7	-67.5	-177.8	167.6	0	0	110	V312 K334	V312-E332 PolarHBondContact N-O 3.29Å; V312-E332 PolarHBondContact O-N 2.96Å; E332-K334 WeakPolarHBondContact OE2-CE 3.22Å; E332-K334 IonicContact OE2-NZ 3.32Å; E332-K334 PolarHBondContact OE2-NZ 2.78Å
333	C	88.9	Confident	85.4	Confident	22 Å²	22	72.5 Å²	72.5	15%	0.149	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	108.3	168.5	-76.4	0	0	0	0	109.7	Q265 L266 C303 F309 Y310	Q265-C333 HydrophobicContact CB-CB 3.98Å; L266-C333 WeakPolarHBondContact CD2-SG 3.31Å; C303-C333 WeakPolarHBondContact CA-SG 3.37Å; C303-C333 HydrophobicContact CB-CB 4.07Å; C303-C333 WeakPolarHBondContact CB-SG 3.18Å; C303-C333 WeakPolarHBondContact SG-CB 3.29Å; C303-C333 CovalentContact SG-SG 2.05Å; C303-C333 PolarHBondContact SG-SG 2.81Å; F309-C333 HydrophobicContact CB-CB 4.29Å; Y310-C333 WeakPolarHBondContact O-CA 3.4Å
334	K	86.4	Confident	85.4	Confident	89 Å²	89	76.8 Å²	76.8	39%	0.387	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	147.6	177.2	-67	-171	179.7	171.5	0	110.9	F309 Y310 V312 E332 K336	F309-K334 CarbonylContact C-O 3.57Å; F309-K334 VanDerWaalsContact CA-O 3.26Å; F309-K334 WeakPolarHBondContact CA-O 3.35Å; Y310-K334 HydrophobicContact CD1-CB 4.27Å; Y310-K334 WeakPolarHBondContact CD1-O 3.05Å; Y310-K334 HydrophobicContact CE1-CB 3.67Å; Y310-K334 PolarHBondContact N-O 3.28Å; Y310-K334 PolarHBondContact O-N 2.93Å; V312-K334 HydrophobicContact CG2-CB 4.29Å; V312-K334 HydrophobicContact CG2-CD 4.06Å; V312-K334 HydrophobicContact CG2-CG 4.16Å; E332-K334 WeakPolarHBondContact OE2-CE 3.22Å; E332-K334 IonicContact OE2-NZ 3.32Å; E332-K334 PolarHBondContact OE2-NZ 2.78Å; K334-K336 PolarHBondContact O-N 2.89Å
335	L	82.8	Confident	85.2	Confident	100 Å²	100	70.7 Å²	70.7	52%	0.524	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	128	176.9	-171.6	75.1	0	0	0	109.6	H308 F309 R337	H308-L335 HydrophobicContact CB-CD1 4.23Å; H308-L335 WeakPolarHBondContact O-CD1 3.36Å; F309-L335 HydrophobicContact CD1-CB 4.36Å; F309-L335 HydrophobicContact CD1-CD1 4.31Å; F309-L335 HydrophobicContact CE1-CB 4.14Å; F309-L335 HydrophobicContact CE1-CD1 3.83Å; F309-L335 HydrophobicContact CE2-CD1 4.18Å; F309-L335 HydrophobicContact CZ-CD1 3.76Å; L335-R337 PolarHBondContact O-N 3.4Å
336	K	82.3	Confident	85	Confident	60 Å²	60	75.6 Å²	75.6	26%	0.261	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-61.3	123.5	170.8	-79.3	177	175.4	174.8	0	109.5	P306 L307 H308 F309 Y310 K334 P361 E385	P306-K336 PolarHBondContact O-NZ 2.05Å; L307-K336 VanDerWaalsContact O-CD 3.32Å; L307-K336 WeakPolarHBondContact O-CD 3.46Å; H308-K336 VanDerWaalsContact O-CB 3.23Å; H308-K336 WeakPolarHBondContact O-CB 3.05Å; H308-K336 PolarHBondContact O-N 3.35Å; F309-K336 VanDerWaalsContact O-CE 3.24Å; F309-K336 WeakPolarHBondContact O-CE 3.21Å; Y310-K336 HydrophobicContact CD1-CG 3.77Å; Y310-K336 HydrophobicContact CG-CG 4.35Å; K334-K336 PolarHBondContact O-N 2.89Å; K336-P361 HydrophobicContact CB-CG 4Å; K336-P361 HydrophobicContact CD-CG 4.47Å; K336-P361 HydrophobicContact CG-CG 4.33Å; K336-E385 WeakPolarHBondContact CA-O 3.32Å; K336-E385 HydrophobicContact CG-CB 4.23Å; K336-E385 HydrophobicContact CG-CG 4.37Å
337	R	84.1	Confident	84.9	Confident	174 Å²	174	76.9 Å²	76.9	66%	0.657	40%	0.395	S	S	*	.	P	Polyproline II helix	trans	-99.8	135.6	175.6	-70	-175.5	-178.4	173.5	0.8	109.7	L335 P361 E385 G387	L335-R337 PolarHBondContact O-N 3.4Å; R337-P361 WeakPolarHBondContact O-CG 3.2Å; R337-E385 PolarHBondContact N-O 2.83Å; R337-G387 VanDerWaalsContact O-CA 3.31Å; R337-G387 WeakPolarHBondContact O-CA 3.08Å; R337-G387 PolarHBondContact O-N 2.77Å
338	S	83.7	Confident	85	Confident	61 Å²	61	76.1 Å²	76.1	43%	0.427	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-68.8	139	170.3	-52.3	0	0	0	0	110	F359	S338-F359 CarbonylContact C-O 3.56Å; S338-F359 WeakPolarHBondContact CA-O 3.33Å; S338-F359 WeakPolarHBondContact CB-O 3.43Å
339	C	85.2	Confident	85	Confident	0 Å²	0	76.2 Å²	76.2	0%	0	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	139.8	172.9	-56.9	0	0	0	0	110.2	F359 C383 G387 W389	C339-F359 HydrophobicContact CB-CB 4.28Å; C339-F359 PolarHBondContact N-O 3.19Å; C339-F359 PolarHBondContact O-N 3.35Å; C339-C383 HydrophobicContact CB-CB 3.91Å; C339-C383 WeakPolarHBondContact CB-SG 3.34Å; C339-C383 PolarHBondContact N-SG 3.25Å; C339-C383 VanDerWaalsContact N-SG 3.43Å; C339-C383 WeakPolarHBondContact SG-CA 3Å; C339-C383 WeakPolarHBondContact SG-CB 3.45Å; C339-C383 CovalentContact SG-SG 2.03Å; C339-C383 PolarHBondContact SG-SG 3.45Å; C339-G387 PolarHBondContact SG-O 2.85Å; C339-W389 HydrophobicContact CB-CD2 4.19Å; C339-W389 HydrophobicContact CB-CH2 4.23Å; C339-W389 HydrophobicContact CB-CZ2 3.53Å
340	E	84.4	Confident	84.9	Confident	158 Å²	158	70.1 Å²	70.1	74%	0.738	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.3	154.2	170.2	-69.8	-177.6	176.6	0	0	110.8	P342 W389	E340-P342 WeakPolarHBondContact O-CD 3.2Å; E340-W389 PolarHBondContact O-NE1 2.82Å
341	K	82.8	Confident	84.5	Confident	97 Å²	97	72.2 Å²	72.2	42%	0.422	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-56.6	119.9	177.2	-177.9	178	-179.4	173.3	0	110.3	Y350 F359	K341-Y350 WeakPolarHBondContact CE-OH 3.49Å; K341-Y350 VanDerWaalsContact CG-OH 3.24Å; K341-Y350 WeakPolarHBondContact CG-OH 3.46Å; K341-F359 HydrophobicContact CB-CE2 4.25Å; K341-F359 HydrophobicContact CG-CE2 4.4Å
342	P	81.3	Confident	83.8	Confident	10 Å²	10	74.6 Å²	74.6	7%	0.065	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-67.6	147.4	174.5	25.7	-27.8	0	0	0	109.4	E340 Y350 L365 F367 W389 I393	E340-P342 WeakPolarHBondContact O-CD 3.2Å; P342-Y350 PolarHBondContact O-OH 3.46Å; P342-L365 HydrophobicContact CG-CD1 3.33Å; P342-F367 HydrophobicContact CB-CZ 4.39Å; P342-F367 HydrophobicContact CG-CZ 4.19Å; P342-W389 HydrophobicContact CG-CZ2 4.06Å; P342-I393 HydrophobicContact CB-CD1 4.35Å; P342-I393 HydrophobicContact CB-CG1 4.19Å
343	G	83.2	Confident	83	Confident	40 Å²	40	73.8 Å²	73.8	41%	0.412	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-55.7	154.1	170.5	0	0	0	0	0	111.5
344	L	83.5	Confident	82	Confident	111 Å²	111	77.4 Å²	77.4	58%	0.581	40%	0.401	S	S	*	.	P	Polyproline II helix	trans	-80.7	137.3	172.9	-75.1	147.5	0	0	0	109.4	Y350	L344-Y350 HydrophobicContact CD2-CD1 3.84Å; L344-Y350 HydrophobicContact CD2-CE1 3.58Å; L344-Y350 HydrophobicContact CG-CE1 3.91Å
345	P	82.8	Confident	81.3	Confident	10 Å²	10	80 Å²	80	7%	0.065	42%	0.419	C	S	.	.	P	Polyproline II helix	trans	-61.5	143.6	167.7	-12.8	26.1	0	0	0	109.6	N347 G348 F367 I393 P394	P345-N347 PolarHBondContact O-N 3.05Å; P345-G348 PolarHBondContact O-N 2.84Å; P345-F367 HydrophobicContact CG-CD1 3.55Å; P345-F367 HydrophobicContact CG-CE1 3.92Å; P345-I393 HydrophobicContact CG-CG2 4.15Å; P345-P394 VanDerWaalsContact CB-O 3.31Å; P345-P394 WeakPolarHBondContact CB-O 3.42Å; P345-P394 HydrophobicContact CG-CG 4.48Å
346	V	85.3	Confident	80.9	Confident	118 Å²	118	78 Å²	78	72%	0.715	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	123.7	168.9	-178.1	0	0	0	0	108	G348 C396	V346-G348 PolarHBondContact O-N 2.88Å; V346-C396 WeakPolarHBondContact O-CB 3.44Å
347	N	85.8	Confident	80.5	Confident	74 Å²	74	78.7 Å²	78.7	40%	0.396	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	61	24.9	-172.3	-50.8	-49.1	0	0	0	114.8	P345 A370 Y373 C396	P345-N347 PolarHBondContact O-N 3.05Å; N347-A370 HydrophobicContact CB-CB 4.45Å; N347-A370 WeakPolarHBondContact O-CB 3.48Å; N347-A370 PolarHBondContact O-N 2.92Å; N347-Y373 HydrophobicContact CB-CD1 3.81Å; N347-Y373 HydrophobicContact CB-CD2 4Å; N347-Y373 HydrophobicContact CB-CE1 3.69Å; N347-Y373 HydrophobicContact CB-CE2 3.89Å; N347-Y373 HydrophobicContact CB-CG 3.98Å; N347-Y373 VanDerWaalsContact CG-CZ 3.44Å; N347-Y373 WeakPolarHBondContact ND2-CE1 3.13Å; N347-Y373 PolarHBondContact ND2-OH 2.94Å; N347-C396 HydrophobicContact CB-CB 4.45Å
348	G	86.7	Confident	80.2	Confident	16 Å²	16	77.5 Å²	77.5	17%	0.165	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	170	172.2	0	0	0	0	0	113.3	P345 V346 G368 C396	P345-G348 PolarHBondContact O-N 2.84Å; V346-G348 PolarHBondContact O-N 2.88Å; G348-G368 CarbonylContact C-O 3.49Å; G348-G368 WeakPolarHBondContact CA-O 3.37Å; G348-C396 VanDerWaalsContact CA-SG 3.59Å
349	F	85.3	Confident	80.1	Confident	119 Å²	119	74.8 Å²	74.8	52%	0.522	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	165.8	175.6	59.1	-90.7	0	0	0	108.9	F367 G368 C369	F349-F367 CarbonylContact O-C 3.41Å; F349-F367 WeakPolarHBondContact O-CA 3.26Å; F349-G368 PolarHBondContact N-O 2.86Å; F349-G368 PolarHBondContact O-N 3.47Å; F349-C369 VanDerWaalsContact CE1-O 3.31Å; F349-C369 WeakPolarHBondContact CE1-O 3.4Å
350	Y	85	Confident	80	Confident	21 Å²	21	77.5 Å²	77.5	8%	0.082	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	152.1	168.1	56.1	-96.1	0	0	0	110.2	K341 P342 L344 Y352 L365 T366 F367	K341-Y350 WeakPolarHBondContact CE-OH 3.49Å; K341-Y350 VanDerWaalsContact CG-OH 3.24Å; K341-Y350 WeakPolarHBondContact CG-OH 3.46Å; P342-Y350 PolarHBondContact O-OH 3.46Å; L344-Y350 HydrophobicContact CD2-CD1 3.84Å; L344-Y350 HydrophobicContact CD2-CE1 3.58Å; L344-Y350 HydrophobicContact CG-CE1 3.91Å; Y350-Y352 HydrophobicContact CD2-CG 4.5Å; Y350-Y352 AromaticContact CE2-CD1 3.94Å; Y350-Y352 HydrophobicContact CE2-CD1 3.94Å; Y350-Y352 HydrophobicContact CE2-CG 4.06Å; Y350-Y352 PolarHBondContact O-N 2.89Å; Y350-L365 HydrophobicContact CD2-CD1 4.32Å; Y350-L365 HydrophobicContact CD2-CD2 3.83Å; Y350-L365 HydrophobicContact CE2-CD1 4.3Å; Y350-L365 HydrophobicContact CE2-CD2 4.16Å; Y350-T366 CarbonylContact C-O 3.44Å; Y350-T366 WeakPolarHBondContact CA-O 3.46Å; Y350-T366 VanDerWaalsContact CB-O 3.26Å; Y350-T366 WeakPolarHBondContact CB-O 3.25Å; Y350-F367 HydrophobicContact CD1-CD1 4.05Å; Y350-F367 AromaticContact CD1-CE1 3.56Å; Y350-F367 HydrophobicContact CD1-CE1 3.56Å; Y350-F367 AromaticContact CD1-CZ 3.97Å; Y350-F367 HydrophobicContact CD1-CZ 3.97Å; Y350-F367 HydrophobicContact CE1-CE1 4.31Å; Y350-F367 HydrophobicContact CG-CD1 4.4Å; Y350-F367 HydrophobicContact CG-CE1 4.14Å; Y350-F367 HydrophobicContact CG-CZ 4.29Å
351	N	79.3	Confident	79.8	Confident	131 Å²	131	71.6 Å²	71.6	70%	0.701	40%	0.402	S	S	*	.	S	Bend	trans	-70.2	99.9	178.8	179.8	-2.7	0	0	0	109.7	T366	N351-T366 PolarHBondContact N-O 2.85Å
352	Y	72.7	Confident	79.7	Confident	51 Å²	51	68.8 Å²	68.8	20%	0.2	40%	0.401	C	S	.	.			trans	-164.1	153.6	174.3	-178.7	-115.4	0	0	0	113.8	Y350 V356 F359 L365	Y350-Y352 HydrophobicContact CD2-CG 4.5Å; Y350-Y352 AromaticContact CE2-CD1 3.94Å; Y350-Y352 HydrophobicContact CE2-CD1 3.94Å; Y350-Y352 HydrophobicContact CE2-CG 4.06Å; Y350-Y352 PolarHBondContact O-N 2.89Å; Y352-V356 HydrophobicContact CE1-CB 4.48Å; Y352-V356 HydrophobicContact CE1-CG2 4.04Å; Y352-V356 WeakPolarHBondContact CE1-O 3.41Å; Y352-V356 HydrophobicContact CE2-CB 4.4Å; Y352-V356 HydrophobicContact CE2-CG1 4.5Å; Y352-V356 HydrophobicContact CE2-CG2 3.56Å; Y352-V356 VanDerWaalsContact CZ-O 3.28Å; Y352-V356 WeakPolarHBondContact OH-CA 3.43Å; Y352-V356 WeakPolarHBondContact OH-CB 3.35Å; Y352-V356 WeakPolarHBondContact OH-CG1 3.32Å; Y352-V356 WeakPolarHBondContact OH-CG2 3.42Å; Y352-V356 PolarHBondContact OH-O 2.73Å; Y352-F359 HydrophobicContact CD1-CE1 4.15Å; Y352-F359 AromaticContact CD1-CZ 3.58Å; Y352-F359 HydrophobicContact CD1-CZ 3.58Å; Y352-F359 HydrophobicContact CD2-CD1 4.41Å; Y352-F359 AromaticContact CD2-CE1 3.31Å; Y352-F359 HydrophobicContact CD2-CE1 3.31Å; Y352-F359 AromaticContact CD2-CZ 3.67Å; Y352-F359 HydrophobicContact CD2-CZ 3.67Å; Y352-F359 AromaticContact CE1-CE1 3.89Å; Y352-F359 HydrophobicContact CE1-CE1 3.89Å; Y352-F359 AromaticContact CE1-CE2 3.97Å; Y352-F359 HydrophobicContact CE1-CE2 3.97Å; Y352-F359 AromaticContact CE1-CZ 3.28Å; Y352-F359 HydrophobicContact CE1-CZ 3.28Å; Y352-F359 AromaticContact CE2-CD1 3.86Å; Y352-F359 HydrophobicContact CE2-CD1 3.86Å; Y352-F359 AromaticContact CE2-CE1 3.03Å; Y352-F359 HydrophobicContact CE2-CE1 3.03Å; Y352-F359 HydrophobicContact CE2-CE2 4.45Å; Y352-F359 AromaticContact CE2-CZ 3.42Å; Y352-F359 HydrophobicContact CE2-CZ 3.42Å; Y352-F359 VanDerWaalsContact CE2-CZ 3.42Å; Y352-F359 AromaticContact CG-CE1 3.81Å; Y352-F359 HydrophobicContact CG-CE1 3.81Å; Y352-F359 AromaticContact CG-CZ 3.68Å; Y352-F359 HydrophobicContact CG-CZ 3.68Å; Y352-F359 AromaticContact CZ-CE1 3.27Å; Y352-F359 AromaticContact CZ-CE2 3.84Å; Y352-F359 AromaticContact CZ-CZ 3.11Å; Y352-F359 WeakPolarHBondContact OH-CZ 3.16Å; Y352-L365 HydrophobicContact CD2-CD2 4.26Å; Y352-L365 HydrophobicContact CG-CD2 4.23Å
353	N	71.1	Confident	79.9	Confident	87 Å²	87	72.8 Å²	72.8	47%	0.465	42%	0.419	S	S	.	.			trans	-75.4	117.4	173.5	-177.5	-12.3	0	0	0	110.7	N355 V356	N353-N355 PolarHBondContact O-N 2.51Å; N353-N355 WeakPolarHBondContact OD1-CB 3.27Å; N353-N355 PolarHBondContact OD1-N 3.44Å; N353-N355 VanDerWaalsContact OD1-N 3.11Å; N353-V356 HydrophobicContact CB-CG2 4.05Å; N353-V356 PolarHBondContact O-N 3.19Å
354	P	68	Low	80.1	Confident	99 Å²	99	74.8 Å²	74.8	64%	0.643	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-18.6	-176.6	23.3	-33.9	0	0	0	114.8
355	N	71.8	Confident	80.3	Confident	143 Å²	143	69.6 Å²	69.6	77%	0.765	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-11.8	-176.2	-66.4	-24.6	0	0	0	115.4	N353	N353-N355 PolarHBondContact O-N 2.51Å; N353-N355 WeakPolarHBondContact OD1-CB 3.27Å; N353-N355 PolarHBondContact OD1-N 3.44Å; N353-N355 VanDerWaalsContact OD1-N 3.11Å
356	V	74.2	Confident	80.7	Confident	59 Å²	59	71.8 Å²	71.8	36%	0.358	41%	0.409	S	S	.	.			trans	-102.3	120.8	-178.2	167.1	0	0	0	0	111	Y352 N353 K358	Y352-V356 HydrophobicContact CE1-CB 4.48Å; Y352-V356 HydrophobicContact CE1-CG2 4.04Å; Y352-V356 WeakPolarHBondContact CE1-O 3.41Å; Y352-V356 HydrophobicContact CE2-CB 4.4Å; Y352-V356 HydrophobicContact CE2-CG1 4.5Å; Y352-V356 HydrophobicContact CE2-CG2 3.56Å; Y352-V356 VanDerWaalsContact CZ-O 3.28Å; Y352-V356 WeakPolarHBondContact OH-CA 3.43Å; Y352-V356 WeakPolarHBondContact OH-CB 3.35Å; Y352-V356 WeakPolarHBondContact OH-CG1 3.32Å; Y352-V356 WeakPolarHBondContact OH-CG2 3.42Å; Y352-V356 PolarHBondContact OH-O 2.73Å; N353-V356 HydrophobicContact CB-CG2 4.05Å; N353-V356 PolarHBondContact O-N 3.19Å; V356-K358 VanDerWaalsContact CG1-O 3.26Å; V356-K358 WeakPolarHBondContact CG1-O 3.46Å
357	A	74.1	Confident	80.9	Confident	73 Å²	73	66.7 Å²	66.7	60%	0.603	38%	0.377	S	S	*	.			trans	-87.3	-20.7	-172.5	0	0	0	0	0	113.8
358	K	79	Confident	81	Confident	149 Å²	149	63.8 Å²	63.8	65%	0.648	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.1	136.8	-173.4	-66.6	-174.7	179.5	-177.9	0	110.8	V356	V356-K358 VanDerWaalsContact CG1-O 3.26Å; V356-K358 WeakPolarHBondContact CG1-O 3.46Å
359	F	81.5	Confident	81.2	Confident	4 Å²	4	64.1 Å²	64.1	2%	0.018	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	125.9	-179.2	-67.6	-93.5	0	0	0	110.6	S338 C339 K341 Y352 H363 L365 W389	S338-F359 CarbonylContact C-O 3.56Å; S338-F359 WeakPolarHBondContact CA-O 3.33Å; S338-F359 WeakPolarHBondContact CB-O 3.43Å; C339-F359 HydrophobicContact CB-CB 4.28Å; C339-F359 PolarHBondContact N-O 3.19Å; C339-F359 PolarHBondContact O-N 3.35Å; K341-F359 HydrophobicContact CB-CE2 4.25Å; K341-F359 HydrophobicContact CG-CE2 4.4Å; Y352-F359 HydrophobicContact CD1-CE1 4.15Å; Y352-F359 AromaticContact CD1-CZ 3.58Å; Y352-F359 HydrophobicContact CD1-CZ 3.58Å; Y352-F359 HydrophobicContact CD2-CD1 4.41Å; Y352-F359 AromaticContact CD2-CE1 3.31Å; Y352-F359 HydrophobicContact CD2-CE1 3.31Å; Y352-F359 AromaticContact CD2-CZ 3.67Å; Y352-F359 HydrophobicContact CD2-CZ 3.67Å; Y352-F359 AromaticContact CE1-CE1 3.89Å; Y352-F359 HydrophobicContact CE1-CE1 3.89Å; Y352-F359 AromaticContact CE1-CE2 3.97Å; Y352-F359 HydrophobicContact CE1-CE2 3.97Å; Y352-F359 AromaticContact CE1-CZ 3.28Å; Y352-F359 HydrophobicContact CE1-CZ 3.28Å; Y352-F359 AromaticContact CE2-CD1 3.86Å; Y352-F359 HydrophobicContact CE2-CD1 3.86Å; Y352-F359 AromaticContact CE2-CE1 3.03Å; Y352-F359 HydrophobicContact CE2-CE1 3.03Å; Y352-F359 HydrophobicContact CE2-CE2 4.45Å; Y352-F359 AromaticContact CE2-CZ 3.42Å; Y352-F359 HydrophobicContact CE2-CZ 3.42Å; Y352-F359 VanDerWaalsContact CE2-CZ 3.42Å; Y352-F359 AromaticContact CG-CE1 3.81Å; Y352-F359 HydrophobicContact CG-CE1 3.81Å; Y352-F359 AromaticContact CG-CZ 3.68Å; Y352-F359 HydrophobicContact CG-CZ 3.68Å; Y352-F359 AromaticContact CZ-CE1 3.27Å; Y352-F359 AromaticContact CZ-CE2 3.84Å; Y352-F359 AromaticContact CZ-CZ 3.11Å; Y352-F359 WeakPolarHBondContact OH-CZ 3.16Å; F359-H363 HydrophobicContact CB-CB 4.46Å; F359-H363 HydrophobicContact CD1-CB 4.21Å; F359-L365 HydrophobicContact CD1-CD2 4.33Å; F359-L365 HydrophobicContact CE1-CD1 4.02Å; F359-L365 HydrophobicContact CE1-CD2 3.42Å; F359-L365 VanDerWaalsContact CE1-CD2 3.42Å; F359-L365 HydrophobicContact CE1-CG 3.95Å; F359-L365 HydrophobicContact CE2-CD1 4.37Å; F359-L365 HydrophobicContact CZ-CD1 3.87Å; F359-L365 HydrophobicContact CZ-CD2 3.81Å; F359-L365 HydrophobicContact CZ-CG 4.28Å; F359-W389 HydrophobicContact CB-CH2 3.81Å; F359-W389 HydrophobicContact CB-CZ2 4.01Å; F359-W389 AromaticContact CD1-CH2 3.95Å; F359-W389 HydrophobicContact CD1-CH2 3.95Å; F359-W389 HydrophobicContact CD1-CZ2 4.48Å; F359-W389 AromaticContact CD2-CH2 3.92Å; F359-W389 HydrophobicContact CD2-CH2 3.92Å; F359-W389 AromaticContact CD2-CZ2 3.62Å; F359-W389 HydrophobicContact CD2-CZ2 3.62Å; F359-W389 HydrophobicContact CE1-CH2 4.44Å; F359-W389 HydrophobicContact CE2-CH2 4.47Å; F359-W389 HydrophobicContact CE2-CZ2 4.19Å; F359-W389 AromaticContact CG-CH2 3.61Å; F359-W389 HydrophobicContact CG-CH2 3.61Å; F359-W389 AromaticContact CG-CZ2 3.78Å; F359-W389 HydrophobicContact CG-CZ2 3.78Å
360	S	81.4	Confident	81.3	Confident	58 Å²	58	60.2 Å²	60.2	41%	0.406	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-66.7	150.7	171.5	75.9	0	0	0	0	111.6	G362 H363	S360-G362 PolarHBondContact O-N 3.43Å; S360-H363 PolarHBondContact N-CD2 2.77Å; S360-H363 PolarHBondContact O-CD2 2.76Å; S360-H363 VanDerWaalsContact O-CD2 3.23Å; S360-H363 PolarHBondContact O-N 2.82Å; S360-H363 PolarHBondContact OG-CD2 3.15Å; S360-H363 PolarHBondContact OG-NE2 3.1Å; S360-H363 VanDerWaalsContact OG-NE2 3.09Å
361	P	80.3	Confident	81.3	Confident	33 Å²	33	68.7 Å²	68.7	21%	0.214	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	138.1	175.3	-30.3	39.6	0	0	0	112.6	K336 R337 E385	K336-P361 HydrophobicContact CB-CG 4Å; K336-P361 HydrophobicContact CD-CG 4.47Å; K336-P361 HydrophobicContact CG-CG 4.33Å; R337-P361 WeakPolarHBondContact O-CG 3.2Å; P361-E385 HydrophobicContact CB-CB 4.48Å; P361-E385 HydrophobicContact CB-CG 4.16Å
362	G	82.4	Confident	81.5	Confident	38 Å²	38	64.5 Å²	64.5	39%	0.392	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.8	-14.6	-175.8	0	0	0	0	0	114.8	S360 C383	S360-G362 PolarHBondContact O-N 3.43Å; G362-C383 PolarHBondContact N-O 2.75Å
363	H	84.8	Confident	82.2	Confident	95 Å²	95	65.1 Å²	65.1	44%	0.44	38%	0.384	S	S	.	.			trans	-63	139.9	172	-84.5	-75.1	0	0	0	111.8	F359 S360 K382 C383	F359-H363 HydrophobicContact CB-CB 4.46Å; F359-H363 HydrophobicContact CD1-CB 4.21Å; S360-H363 PolarHBondContact N-CD2 2.77Å; S360-H363 PolarHBondContact O-CD2 2.76Å; S360-H363 VanDerWaalsContact O-CD2 3.23Å; S360-H363 PolarHBondContact O-N 2.82Å; S360-H363 PolarHBondContact OG-CD2 3.15Å; S360-H363 PolarHBondContact OG-NE2 3.1Å; S360-H363 VanDerWaalsContact OG-NE2 3.09Å; H363-K382 CarbonylContact O-C 3.57Å; H363-K382 WeakPolarHBondContact O-CA 3.41Å; H363-C383 PolarHBondContact O-N 2.91Å
364	V	87.5	Confident	83	Confident	81 Å²	81	65.4 Å²	65.4	49%	0.491	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	123	177.1	-176.8	0	0	0	0	109.5	H380 L381 K382	V364-H380 HydrophobicContact CG1-CB 4.14Å; V364-L381 CarbonylContact C-O 3.44Å; V364-L381 WeakPolarHBondContact CA-O 3.03Å; V364-K382 HydrophobicContact CG2-CB 4.24Å; V364-K382 HydrophobicContact CG2-CG 4.14Å
365	L	88.4	Confident	84	Confident	3 Å²	3	63 Å²	63	2%	0.016	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	135.4	172.6	-71.8	179.2	0	0	0	110	P342 Y350 Y352 F359 F367 H380 L381 W389	P342-L365 HydrophobicContact CG-CD1 3.33Å; Y350-L365 HydrophobicContact CD2-CD1 4.32Å; Y350-L365 HydrophobicContact CD2-CD2 3.83Å; Y350-L365 HydrophobicContact CE2-CD1 4.3Å; Y350-L365 HydrophobicContact CE2-CD2 4.16Å; Y352-L365 HydrophobicContact CD2-CD2 4.26Å; Y352-L365 HydrophobicContact CG-CD2 4.23Å; F359-L365 HydrophobicContact CD1-CD2 4.33Å; F359-L365 HydrophobicContact CE1-CD1 4.02Å; F359-L365 HydrophobicContact CE1-CD2 3.42Å; F359-L365 VanDerWaalsContact CE1-CD2 3.42Å; F359-L365 HydrophobicContact CE1-CG 3.95Å; F359-L365 HydrophobicContact CE2-CD1 4.37Å; F359-L365 HydrophobicContact CZ-CD1 3.87Å; F359-L365 HydrophobicContact CZ-CD2 3.81Å; F359-L365 HydrophobicContact CZ-CG 4.28Å; L365-F367 HydrophobicContact CB-CE2 4.01Å; L365-H380 CarbonylContact O-C 3.48Å; L365-H380 VanDerWaalsContact O-CA 3.28Å; L365-H380 WeakPolarHBondContact O-CA 3.3Å; L365-L381 HydrophobicContact CB-CB 4.43Å; L365-L381 PolarHBondContact N-O 2.98Å; L365-L381 PolarHBondContact O-N 3.4Å; L365-W389 HydrophobicContact CD1-CH2 3.4Å; L365-W389 VanDerWaalsContact CD1-CH2 3.4Å; L365-W389 HydrophobicContact CD1-CZ2 3.84Å; L365-W389 HydrophobicContact CD1-CZ3 3.83Å; L365-W389 HydrophobicContact CG-CH2 3.84Å; L365-W389 HydrophobicContact CG-CZ3 4.02Å
366	T	89.3	Confident	84.7	Confident	56 Å²	56	60.7 Å²	60.7	34%	0.344	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	118.5	174.4	-57.8	0	0	0	0	109.8	Y350 N351 M379 H380	Y350-T366 CarbonylContact C-O 3.44Å; Y350-T366 WeakPolarHBondContact CA-O 3.46Å; Y350-T366 VanDerWaalsContact CB-O 3.26Å; Y350-T366 WeakPolarHBondContact CB-O 3.25Å; N351-T366 PolarHBondContact N-O 2.85Å; T366-M379 CarbonylContact C-O 3.6Å; T366-M379 WeakPolarHBondContact CA-O 3.17Å; T366-H380 PolarHBondContact OG1-ND1 3.17Å
367	F	89.7	Confident	85.4	Confident	10 Å²	10	60.4 Å²	60.4	4%	0.044	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	147.5	178.7	-72.6	-101.6	0	0	0	111.4	P342 P345 F349 Y350 L365 L375 M379 L381 I393 P394	P342-F367 HydrophobicContact CB-CZ 4.39Å; P342-F367 HydrophobicContact CG-CZ 4.19Å; P345-F367 HydrophobicContact CG-CD1 3.55Å; P345-F367 HydrophobicContact CG-CE1 3.92Å; F349-F367 CarbonylContact O-C 3.41Å; F349-F367 WeakPolarHBondContact O-CA 3.26Å; Y350-F367 HydrophobicContact CD1-CD1 4.05Å; Y350-F367 AromaticContact CD1-CE1 3.56Å; Y350-F367 HydrophobicContact CD1-CE1 3.56Å; Y350-F367 AromaticContact CD1-CZ 3.97Å; Y350-F367 HydrophobicContact CD1-CZ 3.97Å; Y350-F367 HydrophobicContact CE1-CE1 4.31Å; Y350-F367 HydrophobicContact CG-CD1 4.4Å; Y350-F367 HydrophobicContact CG-CE1 4.14Å; Y350-F367 HydrophobicContact CG-CZ 4.29Å; L365-F367 HydrophobicContact CB-CE2 4.01Å; F367-L375 HydrophobicContact CB-CD1 3.65Å; F367-M379 PolarHBondContact N-O 3.3Å; F367-L381 HydrophobicContact CD2-CD1 3.79Å; F367-L381 HydrophobicContact CE2-CB 4.03Å; F367-L381 HydrophobicContact CE2-CD1 3.58Å; F367-L381 HydrophobicContact CE2-CD2 3.72Å; F367-L381 HydrophobicContact CE2-CG 3.96Å; F367-L381 HydrophobicContact CZ-CD1 4.46Å; F367-L381 HydrophobicContact CZ-CD2 4Å; F367-I393 HydrophobicContact CE1-CG2 4.17Å; F367-P394 HydrophobicContact CB-CG 3.7Å; F367-P394 HydrophobicContact CD1-CG 3.72Å; F367-P394 HydrophobicContact CD2-CG 4.24Å; F367-P394 HydrophobicContact CE1-CG 4.39Å; F367-P394 HydrophobicContact CG-CG 3.61Å
368	G	88.4	Confident	86.1	Confident	14 Å²	14	58.6 Å²	58.6	14%	0.144	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	161.1	173.5	0	0	0	0	0	110.4	G348 F349	G348-G368 CarbonylContact C-O 3.49Å; G348-G368 WeakPolarHBondContact CA-O 3.37Å; F349-G368 PolarHBondContact N-O 2.86Å; F349-G368 PolarHBondContact O-N 3.47Å
369	C	90.3	Very high	86.6	Confident	23 Å²	23	56.5 Å²	56.5	16%	0.155	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	151.3	175.8	-64.8	0	0	0	0	110.8	F349 L375 C396	F349-C369 VanDerWaalsContact CE1-O 3.31Å; F349-C369 WeakPolarHBondContact CE1-O 3.4Å; C369-L375 WeakPolarHBondContact SG-CA 2.98Å; C369-L375 VanDerWaalsContact SG-CB 3.53Å; C369-L375 PolarHBondContact SG-N 2.8Å; C369-C396 VanDerWaalsContact CA-SG 3.53Å; C369-C396 HydrophobicContact CB-CB 3.8Å; C369-C396 WeakPolarHBondContact CB-SG 3.5Å; C369-C396 WeakPolarHBondContact SG-CB 3.1Å; C369-C396 CovalentContact SG-SG 2.04Å; C369-C396 PolarHBondContact SG-SG 3.42Å
370	A	88.3	Confident	87	Confident	37 Å²	37	60.5 Å²	60.5	31%	0.306	36%	0.356	S	S	.	.			trans	-58.7	159.1	173.3	0	0	0	0	0	111.1	N347 G372 Y373	N347-A370 HydrophobicContact CB-CB 4.45Å; N347-A370 WeakPolarHBondContact O-CB 3.48Å; N347-A370 PolarHBondContact O-N 2.92Å; A370-G372 PolarHBondContact O-N 3.45Å; A370-Y373 HydrophobicContact CB-CD2 4.12Å; A370-Y373 WeakPolarHBondContact O-CB 3.5Å; A370-Y373 PolarHBondContact O-N 3.18Å
371	E	85	Confident	87.4	Confident	199 Å²	199	57.8 Å²	57.8	93%	0.93	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	131.4	178.7	-172.3	173	-171.7	0	0	111.1
372	G	83.5	Confident	87.8	Confident	42 Å²	42	61 Å²	61	43%	0.433	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.2	1.8	-175.1	0	0	0	0	0	115.2	A370 V399	A370-G372 PolarHBondContact O-N 3.45Å; G372-V399 WeakPolarHBondContact O-CB 3.25Å; G372-V399 WeakPolarHBondContact O-CG2 3.34Å; G372-V399 PolarHBondContact O-N 3.42Å
373	Y	87.7	Confident	88	Confident	64 Å²	64	59.1 Å²	59.1	25%	0.251	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	148.7	174.1	-66.2	-101.7	0	0	0	111.5	N347 A370 C396 H397 L398	N347-Y373 HydrophobicContact CB-CD1 3.81Å; N347-Y373 HydrophobicContact CB-CD2 4Å; N347-Y373 HydrophobicContact CB-CE1 3.69Å; N347-Y373 HydrophobicContact CB-CE2 3.89Å; N347-Y373 HydrophobicContact CB-CG 3.98Å; N347-Y373 VanDerWaalsContact CG-CZ 3.44Å; N347-Y373 WeakPolarHBondContact ND2-CE1 3.13Å; N347-Y373 PolarHBondContact ND2-OH 2.94Å; A370-Y373 HydrophobicContact CB-CD2 4.12Å; A370-Y373 WeakPolarHBondContact O-CB 3.5Å; A370-Y373 PolarHBondContact O-N 3.18Å; Y373-C396 HydrophobicContact CD1-CB 4.28Å; Y373-H397 CarbonylContact C-O 3.51Å; Y373-H397 WeakPolarHBondContact CA-O 3.32Å; Y373-L398 HydrophobicContact CD1-CD2 4.13Å; Y373-L398 HydrophobicContact CD1-CG 4.12Å; Y373-L398 HydrophobicContact CD2-CD2 4.37Å; Y373-L398 HydrophobicContact CE1-CB 4.44Å; Y373-L398 HydrophobicContact CE1-CD2 3.51Å; Y373-L398 HydrophobicContact CE1-CG 3.51Å; Y373-L398 HydrophobicContact CE2-CD2 3.78Å; Y373-L398 WeakPolarHBondContact OH-CD2 3.24Å
374	H	87.4	Confident	88.1	Confident	94 Å²	94	57.3 Å²	57.3	44%	0.435	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	145.9	172.2	68.9	-76.8	0	0	0	110.7	C396 H397 V399	H374-C396 WeakPolarHBondContact O-CA 3.38Å; H374-H397 WeakPolarHBondContact CE1-CB 3.02Å; H374-H397 PolarHBondContact N-O 2.87Å; H374-H397 PolarHBondContact ND1-O 3Å; H374-H397 PolarHBondContact O-N 2.95Å; H374-V399 HydrophobicContact CB-CG2 3.93Å
375	L	88.3	Confident	87.9	Confident	47 Å²	47	57.1 Å²	57.1	25%	0.246	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	124.5	-177.8	-168.7	137.2	0	0	0	110.2	F367 C369 G377 M379 P394	F367-L375 HydrophobicContact CB-CD1 3.65Å; C369-L375 WeakPolarHBondContact SG-CA 2.98Å; C369-L375 VanDerWaalsContact SG-CB 3.53Å; C369-L375 PolarHBondContact SG-N 2.8Å; L375-G377 WeakPolarHBondContact CD2-O 3.46Å; L375-M379 HydrophobicContact CD2-CB 4.19Å; L375-P394 HydrophobicContact CD1-CB 4.18Å; L375-P394 HydrophobicContact CD1-CG 3.99Å; L375-P394 HydrophobicContact CD2-CB 3.81Å; L375-P394 HydrophobicContact CD2-CG 4.33Å; L375-P394 HydrophobicContact CG-CB 3.88Å; L375-P394 HydrophobicContact CG-CG 4.26Å
376	D	87.7	Confident	87.6	Confident	95 Å²	95	60.4 Å²	60.4	51%	0.508	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	117.1	173.2	-172.8	25.2	0	0	0	109.7	P394 S395 H397	D376-P394 CarbonylContact O-C 3.51Å; D376-P394 WeakPolarHBondContact O-CA 3.1Å; D376-P394 VanDerWaalsContact O-CB 3.31Å; D376-P394 WeakPolarHBondContact O-CB 3.46Å; D376-S395 PolarHBondContact N-O 3.44Å; D376-S395 PolarHBondContact O-N 2.85Å; D376-H397 IonicContact OD2-NE2 3.57Å
377	G	88.8	Confident	87.3	Confident	53 Å²	53	58.7 Å²	58.7	55%	0.546	33%	0.326	S	S	.	.	S	Bend	trans	114.6	-166.4	-172.7	0	0	0	0	0	114.3	L375 M379	L375-G377 WeakPolarHBondContact CD2-O 3.46Å; G377-M379 PolarHBondContact O-N 2.95Å
378	S	88.5	Confident	87.1	Confident	36 Å²	36	62 Å²	62	25%	0.252	35%	0.347	S	S	.	.			trans	-74	121.3	-177.9	54	0	0	0	0	111.7	H380 L381 S391	S378-H380 PolarHBondContact O-N 2.79Å; S378-L381 WeakPolarHBondContact OG-CD1 3.05Å; S378-S391 WeakPolarHBondContact OG-CB 3.09Å
379	M	88.7	Confident	87.1	Confident	104 Å²	104	63.2 Å²	63.2	51%	0.512	35%	0.348	S	S	.	.	S	Bend	trans	-70.5	-19.6	174.3	70.5	175.9	69.1	0	0	113.4	T366 F367 L375 G377	T366-M379 CarbonylContact C-O 3.6Å; T366-M379 WeakPolarHBondContact CA-O 3.17Å; F367-M379 PolarHBondContact N-O 3.3Å; L375-M379 HydrophobicContact CD2-CB 4.19Å; G377-M379 PolarHBondContact O-N 2.95Å
380	H	90.5	Very high	87	Confident	88 Å²	88	65.1 Å²	65.1	41%	0.407	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	125.8	-178.5	-57.8	-56.5	0	0	0	110.8	V364 L365 T366 S378	V364-H380 HydrophobicContact CG1-CB 4.14Å; L365-H380 CarbonylContact O-C 3.48Å; L365-H380 VanDerWaalsContact O-CA 3.28Å; L365-H380 WeakPolarHBondContact O-CA 3.3Å; T366-H380 PolarHBondContact OG1-ND1 3.17Å; S378-H380 PolarHBondContact O-N 2.79Å
381	L	89.8	Confident	86.9	Confident	1 Å²	1	65.7 Å²	65.7	1%	0.005	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	123.6	171.7	-85.8	65.5	0	0	0	108.7	V364 L365 F367 S378 W389 S391	V364-L381 CarbonylContact C-O 3.44Å; V364-L381 WeakPolarHBondContact CA-O 3.03Å; L365-L381 HydrophobicContact CB-CB 4.43Å; L365-L381 PolarHBondContact N-O 2.98Å; L365-L381 PolarHBondContact O-N 3.4Å; F367-L381 HydrophobicContact CD2-CD1 3.79Å; F367-L381 HydrophobicContact CE2-CB 4.03Å; F367-L381 HydrophobicContact CE2-CD1 3.58Å; F367-L381 HydrophobicContact CE2-CD2 3.72Å; F367-L381 HydrophobicContact CE2-CG 3.96Å; F367-L381 HydrophobicContact CZ-CD1 4.46Å; F367-L381 HydrophobicContact CZ-CD2 4Å; S378-L381 WeakPolarHBondContact OG-CD1 3.05Å; L381-W389 HydrophobicContact CB-CD2 4.48Å; L381-W389 HydrophobicContact CB-CE3 3.82Å; L381-W389 HydrophobicContact CB-CZ3 4.38Å; L381-W389 HydrophobicContact CD2-CB 4.17Å; L381-W389 HydrophobicContact CD2-CG 4.35Å; L381-S391 WeakPolarHBondContact CD2-O 3.47Å
382	K	89.1	Confident	87	Confident	100 Å²	100	61 Å²	61	44%	0.435	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	135.3	174.8	-177.5	178.6	178.4	-177.8	0	109.8	H363 V364 L384 T390	H363-K382 CarbonylContact O-C 3.57Å; H363-K382 WeakPolarHBondContact O-CA 3.41Å; V364-K382 HydrophobicContact CG2-CB 4.24Å; V364-K382 HydrophobicContact CG2-CG 4.14Å; K382-L384 PolarHBondContact O-N 2.75Å; K382-T390 HydrophobicContact CB-CG2 3.84Å; K382-T390 PolarHBondContact N-OG1 2.05Å; K382-T390 WeakPolarHBondContact O-CG2 3.46Å; K382-T390 PolarHBondContact O-N 3.39Å
383	C	87	Confident	87.2	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	35%	0.347	C	S	.	.	B	Isolated β-bridge	trans	-76	116	172.7	179.3	0	0	0	0	109.4	C339 G362 H363 W389	C339-C383 HydrophobicContact CB-CB 3.91Å; C339-C383 WeakPolarHBondContact CB-SG 3.34Å; C339-C383 PolarHBondContact N-SG 3.25Å; C339-C383 VanDerWaalsContact N-SG 3.43Å; C339-C383 WeakPolarHBondContact SG-CA 3Å; C339-C383 WeakPolarHBondContact SG-CB 3.45Å; C339-C383 CovalentContact SG-SG 2.03Å; C339-C383 PolarHBondContact SG-SG 3.45Å; G362-C383 PolarHBondContact N-O 2.75Å; H363-C383 PolarHBondContact O-N 2.91Å; C383-W389 HydrophobicContact CB-CE3 4.1Å; C383-W389 HydrophobicContact CB-CH2 3.96Å; C383-W389 HydrophobicContact CB-CZ3 3.69Å
384	L	86.8	Confident	87.3	Confident	57 Å²	57	59.7 Å²	59.7	30%	0.298	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-77	159.7	174.9	-63.4	170.9	0	0	0	110.8	K382 N386 G387 V388 T390	K382-L384 PolarHBondContact O-N 2.75Å; L384-N386 WeakPolarHBondContact CB-OD1 3.37Å; L384-N386 PolarHBondContact O-N 3.19Å; L384-N386 VanDerWaalsContact O-N 3.17Å; L384-G387 PolarHBondContact O-N 2.91Å; L384-V388 WeakPolarHBondContact CB-O 3.39Å; L384-V388 WeakPolarHBondContact CG-O 3.34Å; L384-V388 PolarHBondContact N-O 2.78Å; L384-T390 HydrophobicContact CD1-CG2 4.3Å; L384-T390 HydrophobicContact CD2-CG2 3.68Å; L384-T390 HydrophobicContact CG-CG2 3.86Å
385	E	82.6	Confident	87.4	Confident	76 Å²	76	58.2 Å²	58.2	36%	0.355	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-23.8	-179.7	-65	82.7	-179	0	0	113.9	Y310 K336 R337 P361 G387	Y310-E385 HydrophobicContact CD1-CB 3.7Å; Y310-E385 HydrophobicContact CD2-CB 3.77Å; Y310-E385 HydrophobicContact CD2-CG 4.48Å; Y310-E385 HydrophobicContact CE1-CB 4.12Å; Y310-E385 HydrophobicContact CE2-CB 4.17Å; Y310-E385 HydrophobicContact CG-CB 3.51Å; Y310-E385 HydrophobicContact CG-CG 4.13Å; K336-E385 WeakPolarHBondContact CA-O 3.32Å; K336-E385 HydrophobicContact CG-CB 4.23Å; K336-E385 HydrophobicContact CG-CG 4.37Å; R337-E385 PolarHBondContact N-O 2.83Å; P361-E385 HydrophobicContact CB-CB 4.48Å; P361-E385 HydrophobicContact CB-CG 4.16Å; E385-G387 PolarHBondContact O-N 2.84Å
386	N	81.8	Confident	87.5	Confident	72 Å²	72	56.7 Å²	56.7	39%	0.385	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-1.9	176.1	67.3	-3.2	0	0	0	113.9	L384 V388	L384-N386 WeakPolarHBondContact CB-OD1 3.37Å; L384-N386 PolarHBondContact O-N 3.19Å; L384-N386 VanDerWaalsContact O-N 3.17Å; N386-V388 VanDerWaalsContact OD1-CB 3.31Å; N386-V388 WeakPolarHBondContact OD1-CB 3.44Å; N386-V388 PolarHBondContact OD1-N 3.33Å
387	G	82.8	Confident	87.5	Confident	20 Å²	20	56.4 Å²	56.4	21%	0.206	33%	0.326	C	S	.	.	S	Bend	trans	83.2	12.5	-176.9	0	0	0	0	0	114.5	R337 C339 L384 E385	R337-G387 VanDerWaalsContact O-CA 3.31Å; R337-G387 WeakPolarHBondContact O-CA 3.08Å; R337-G387 PolarHBondContact O-N 2.77Å; C339-G387 PolarHBondContact SG-O 2.85Å; L384-G387 PolarHBondContact O-N 2.91Å; E385-G387 PolarHBondContact O-N 2.84Å
388	V	85.8	Confident	87.2	Confident	80 Å²	80	59.5 Å²	59.5	49%	0.485	33%	0.329	S	S	.	.			trans	-106.2	145.3	178.2	-174.3	0	0	0	0	110.1	L384 N386	L384-V388 WeakPolarHBondContact CB-O 3.39Å; L384-V388 WeakPolarHBondContact CG-O 3.34Å; L384-V388 PolarHBondContact N-O 2.78Å; N386-V388 VanDerWaalsContact OD1-CB 3.31Å; N386-V388 WeakPolarHBondContact OD1-CB 3.44Å; N386-V388 PolarHBondContact OD1-N 3.33Å
389	W	88.9	Confident	86.8	Confident	39 Å²	39	60.5 Å²	60.5	15%	0.148	33%	0.333	C	S	.	.	B	Isolated β-bridge	trans	-77.3	142.3	173.6	-65.4	103.6	0	0	0	111.1	C339 E340 P342 F359 L365 L381 C383 S391	C339-W389 HydrophobicContact CB-CD2 4.19Å; C339-W389 HydrophobicContact CB-CH2 4.23Å; C339-W389 HydrophobicContact CB-CZ2 3.53Å; E340-W389 PolarHBondContact O-NE1 2.82Å; P342-W389 HydrophobicContact CG-CZ2 4.06Å; F359-W389 HydrophobicContact CB-CH2 3.81Å; F359-W389 HydrophobicContact CB-CZ2 4.01Å; F359-W389 AromaticContact CD1-CH2 3.95Å; F359-W389 HydrophobicContact CD1-CH2 3.95Å; F359-W389 HydrophobicContact CD1-CZ2 4.48Å; F359-W389 AromaticContact CD2-CH2 3.92Å; F359-W389 HydrophobicContact CD2-CH2 3.92Å; F359-W389 AromaticContact CD2-CZ2 3.62Å; F359-W389 HydrophobicContact CD2-CZ2 3.62Å; F359-W389 HydrophobicContact CE1-CH2 4.44Å; F359-W389 HydrophobicContact CE2-CH2 4.47Å; F359-W389 HydrophobicContact CE2-CZ2 4.19Å; F359-W389 AromaticContact CG-CH2 3.61Å; F359-W389 HydrophobicContact CG-CH2 3.61Å; F359-W389 AromaticContact CG-CZ2 3.78Å; F359-W389 HydrophobicContact CG-CZ2 3.78Å; L365-W389 HydrophobicContact CD1-CH2 3.4Å; L365-W389 VanDerWaalsContact CD1-CH2 3.4Å; L365-W389 HydrophobicContact CD1-CZ2 3.84Å; L365-W389 HydrophobicContact CD1-CZ3 3.83Å; L365-W389 HydrophobicContact CG-CH2 3.84Å; L365-W389 HydrophobicContact CG-CZ3 4.02Å; L381-W389 HydrophobicContact CB-CD2 4.48Å; L381-W389 HydrophobicContact CB-CE3 3.82Å; L381-W389 HydrophobicContact CB-CZ3 4.38Å; L381-W389 HydrophobicContact CD2-CB 4.17Å; L381-W389 HydrophobicContact CD2-CG 4.35Å; C383-W389 HydrophobicContact CB-CE3 4.1Å; C383-W389 HydrophobicContact CB-CH2 3.96Å; C383-W389 HydrophobicContact CB-CZ3 3.69Å; W389-S391 PolarHBondContact O-N 2.72Å; W389-S391 VanDerWaalsContact O-N 3.13Å
390	T	87.5	Confident	85.9	Confident	64 Å²	64	62 Å²	62	39%	0.393	34%	0.339	S	S	.	.	S	Bend	trans	-58.1	-25.7	178.9	47.8	0	0	0	0	114.5	K382 L384	K382-T390 HydrophobicContact CB-CG2 3.84Å; K382-T390 PolarHBondContact N-OG1 2.05Å; K382-T390 WeakPolarHBondContact O-CG2 3.46Å; K382-T390 PolarHBondContact O-N 3.39Å; L384-T390 HydrophobicContact CD1-CG2 4.3Å; L384-T390 HydrophobicContact CD2-CG2 3.68Å; L384-T390 HydrophobicContact CG-CG2 3.86Å
391	S	87.8	Confident	84.6	Confident	48 Å²	48	67 Å²	67	34%	0.336	35%	0.354	S	S	.	.	S	Bend	trans	-147.5	157.6	-173.4	-54.8	0	0	0	0	110.3	S378 L381 W389	S378-S391 WeakPolarHBondContact OG-CB 3.09Å; L381-S391 WeakPolarHBondContact CD2-O 3.47Å; W389-S391 PolarHBondContact O-N 2.72Å; W389-S391 VanDerWaalsContact O-N 3.13Å
392	S	87.4	Confident	83.2	Confident	102 Å²	102	70 Å²	70	71%	0.713	38%	0.376	S	S	*	.	P	Polyproline II helix	trans	-70.4	159.5	175	54.6	0	0	0	0	111.6
393	I	87.2	Confident	81.9	Confident	74 Å²	74	70.6 Å²	70.6	38%	0.379	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-60.4	128.5	177.6	-58.6	164.7	0	0	0	109.1	P342 P345 F367	P342-I393 HydrophobicContact CB-CD1 4.35Å; P342-I393 HydrophobicContact CB-CG1 4.19Å; P345-I393 HydrophobicContact CG-CG2 4.15Å; F367-I393 HydrophobicContact CE1-CG2 4.17Å
394	P	89.4	Confident	80.9	Confident	4 Å²	4	77.6 Å²	77.6	3%	0.026	41%	0.414	C	S	.	.	P	Polyproline II helix	trans	-71.8	156.3	178.5	29.8	-34.7	0	0	0	111.7	P345 F367 L375 D376	P345-P394 VanDerWaalsContact CB-O 3.31Å; P345-P394 WeakPolarHBondContact CB-O 3.42Å; P345-P394 HydrophobicContact CG-CG 4.48Å; F367-P394 HydrophobicContact CB-CG 3.7Å; F367-P394 HydrophobicContact CD1-CG 3.72Å; F367-P394 HydrophobicContact CD2-CG 4.24Å; F367-P394 HydrophobicContact CE1-CG 4.39Å; F367-P394 HydrophobicContact CG-CG 3.61Å; L375-P394 HydrophobicContact CD1-CB 4.18Å; L375-P394 HydrophobicContact CD1-CG 3.99Å; L375-P394 HydrophobicContact CD2-CB 3.81Å; L375-P394 HydrophobicContact CD2-CG 4.33Å; L375-P394 HydrophobicContact CG-CB 3.88Å; L375-P394 HydrophobicContact CG-CG 4.26Å; D376-P394 CarbonylContact O-C 3.51Å; D376-P394 WeakPolarHBondContact O-CA 3.1Å; D376-P394 VanDerWaalsContact O-CB 3.31Å; D376-P394 WeakPolarHBondContact O-CB 3.46Å
395	S	90.1	Very high	80	Confident	63 Å²	63	83.5 Å²	83.5	44%	0.441	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	146.8	176.9	-64.2	0	0	0	0	111.2	D376	D376-S395 PolarHBondContact N-O 3.44Å; D376-S395 PolarHBondContact O-N 2.85Å
396	C	90.5	Very high	79.5	Confident	15 Å²	15	86 Å²	86	10%	0.101	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	118.6	176.2	-67	0	0	0	0	110.4	V346 N347 G348 C369 Y373 H374	V346-C396 WeakPolarHBondContact O-CB 3.44Å; N347-C396 HydrophobicContact CB-CB 4.45Å; G348-C396 VanDerWaalsContact CA-SG 3.59Å; C369-C396 VanDerWaalsContact CA-SG 3.53Å; C369-C396 HydrophobicContact CB-CB 3.8Å; C369-C396 WeakPolarHBondContact CB-SG 3.5Å; C369-C396 WeakPolarHBondContact SG-CB 3.1Å; C369-C396 CovalentContact SG-SG 2.04Å; C369-C396 PolarHBondContact SG-SG 3.42Å; Y373-C396 HydrophobicContact CD1-CB 4.28Å; H374-C396 WeakPolarHBondContact O-CA 3.38Å
397	H	87.3	Confident	79.1	Confident	89 Å²	89	87.9 Å²	87.9	41%	0.412	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	143.3	-179.7	-67.8	-79.1	0	0	0	111.3	Y373 H374 D376 V399	Y373-H397 CarbonylContact C-O 3.51Å; Y373-H397 WeakPolarHBondContact CA-O 3.32Å; H374-H397 WeakPolarHBondContact CE1-CB 3.02Å; H374-H397 PolarHBondContact N-O 2.87Å; H374-H397 PolarHBondContact ND1-O 3Å; H374-H397 PolarHBondContact O-N 2.95Å; D376-H397 IonicContact OD2-NE2 3.57Å; H397-V399 PolarHBondContact O-N 3.3Å
398	L	82.9	Confident	78.9	Confident	118 Å²	118	89.3 Å²	89.3	62%	0.618	46%	0.461	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58	131.6	176.3	-78.4	164.4	0	0	0	110.5	Y373 E400	Y373-L398 HydrophobicContact CD1-CD2 4.13Å; Y373-L398 HydrophobicContact CD1-CG 4.12Å; Y373-L398 HydrophobicContact CD2-CD2 4.37Å; Y373-L398 HydrophobicContact CE1-CB 4.44Å; Y373-L398 HydrophobicContact CE1-CD2 3.51Å; Y373-L398 HydrophobicContact CE1-CG 3.51Å; Y373-L398 HydrophobicContact CE2-CD2 3.78Å; Y373-L398 WeakPolarHBondContact OH-CD2 3.24Å; L398-E400 PolarHBondContact O-N 3.32Å; L398-E400 VanDerWaalsContact O-N 3.16Å
399	V	78.9	Confident	78.8	Confident	57 Å²	57	89.5 Å²	89.5	35%	0.345	46%	0.462	S	S	.	.			trans	-76.8	97.7	171.6	-179.7	0	0	0	0	107.6	G372 H374 H397 W401	G372-V399 WeakPolarHBondContact O-CB 3.25Å; G372-V399 WeakPolarHBondContact O-CG2 3.34Å; G372-V399 PolarHBondContact O-N 3.42Å; H374-V399 HydrophobicContact CB-CG2 3.93Å; H397-V399 PolarHBondContact O-N 3.3Å; V399-W401 HydrophobicContact CG1-CB 4.17Å; V399-W401 PolarHBondContact O-N 3.4Å
400	E	70.7	Confident	78.4	Confident	134 Å²	134	92 Å²	92	63%	0.626	48%	0.476	S	S	*	.			trans	-73.5	11.5	177.6	-143	-175.6	151.8	0	0	113.8	L398 K404	L398-E400 PolarHBondContact O-N 3.32Å; L398-E400 VanDerWaalsContact O-N 3.16Å; E400-K404 IonicContact OE1-NZ 2.71Å; E400-K404 PolarHBondContact OE1-NZ 3.04Å
401	W	62.7	Low	78.4	Confident	193 Å²	193	92 Å²	92	73%	0.731	48%	0.479	S	S	*	.	S	Bend	trans	-115.1	61.7	-172.7	-59.3	89.4	0	0	0	112.9	V399	V399-W401 HydrophobicContact CG1-CB 4.17Å; V399-W401 PolarHBondContact O-N 3.4Å
402	S	59.5	Low	78.4	Confident	65 Å²	65	94.6 Å²	94.6	46%	0.455	49%	0.488	S	S	.	.	S	Bend	trans	-148.9	-46.6	161.7	63.6	0	0	0	0	112.9	F406	S402-F406 WeakPolarHBondContact O-CB 3.41Å; S402-F406 PolarHBondContact O-N 3.44Å; S402-F406 VanDerWaalsContact O-N 3.09Å
403	N	62.9	Low	78.5	Confident	112 Å²	112	93.7 Å²	93.7	60%	0.599	48%	0.478	S	S	*	.	H	α-helix	trans	-71.9	-42.7	-170.1	-64.3	-16.5	0	0	0	112.9	R405 F406 I407	N403-R405 PolarHBondContact O-N 3.45Å; N403-F406 PolarHBondContact O-N 3.03Å; N403-I407 HydrophobicContact CB-CD1 4.15Å; N403-I407 VanDerWaalsContact O-CB 3.26Å; N403-I407 WeakPolarHBondContact O-CB 3.29Å; N403-I407 WeakPolarHBondContact O-CD1 3.2Å; N403-I407 WeakPolarHBondContact O-CG1 3.3Å; N403-I407 PolarHBondContact O-N 3.41Å
404	K	66.4	Low	78.7	Confident	147 Å²	147	93.8 Å²	93.8	64%	0.639	49%	0.485	S	S	*	.	H	α-helix	trans	-63.3	-42.7	-176.3	-73.1	175.4	178.3	165.8	0	112.5	E400 A408	E400-K404 IonicContact OE1-NZ 2.71Å; E400-K404 PolarHBondContact OE1-NZ 3.04Å; K404-A408 WeakPolarHBondContact O-CB 3.25Å; K404-A408 PolarHBondContact O-N 3.43Å
405	R	68.2	Low	78.9	Confident	181 Å²	181	98.3 Å²	98.3	68%	0.683	51%	0.508	S	S	*	.	H	α-helix	trans	-75.7	-42.5	179	-71.6	-174.3	177.2	178.8	-1.9	112.1	N403 A408 V409	N403-R405 PolarHBondContact O-N 3.45Å; R405-A408 PolarHBondContact O-N 3.12Å; R405-V409 VanDerWaalsContact O-CG2 3.31Å; R405-V409 WeakPolarHBondContact O-CG2 3.35Å; R405-V409 PolarHBondContact O-N 2.99Å
406	F	71.1	Confident	79	Confident	129 Å²	129	100 Å²	100	57%	0.566	51%	0.512	S	S	*	.	H	α-helix	trans	-66.2	-43.1	-178.8	-171.5	-99.3	0	0	0	112.4	S402 N403 A408 V409 M410	S402-F406 WeakPolarHBondContact O-CB 3.41Å; S402-F406 PolarHBondContact O-N 3.44Å; S402-F406 VanDerWaalsContact O-N 3.09Å; N403-F406 PolarHBondContact O-N 3.03Å; F406-A408 PolarHBondContact O-N 2.04Å; F406-V409 PolarHBondContact O-N 2.77Å; F406-M410 HydrophobicContact CD1-CG 4.12Å; F406-M410 HydrophobicContact CE1-CE 3.9Å; F406-M410 HydrophobicContact CE1-CG 3.82Å; F406-M410 HydrophobicContact CE2-CE 3.73Å; F406-M410 HydrophobicContact CE2-CG 4.47Å; F406-M410 HydrophobicContact CZ-CE 3.23Å; F406-M410 HydrophobicContact CZ-CG 4.03Å; F406-M410 HydrophobicContact CZ-SD 4.47Å; F406-M410 WeakPolarHBondContact O-CB 3.47Å; F406-M410 WeakPolarHBondContact O-CG 3.5Å; F406-M410 PolarHBondContact O-N 2.95Å
407	I	74.2	Confident	79.1	Confident	111 Å²	111	100.8 Å²	100.8	57%	0.569	52%	0.522	S	S	*	.	H	α-helix	trans	-63.9	-41.6	177	-64.7	166.9	0	0	0	110.8	N403 V409 M410 S411	N403-I407 HydrophobicContact CB-CD1 4.15Å; N403-I407 VanDerWaalsContact O-CB 3.26Å; N403-I407 WeakPolarHBondContact O-CB 3.29Å; N403-I407 WeakPolarHBondContact O-CD1 3.2Å; N403-I407 WeakPolarHBondContact O-CG1 3.3Å; N403-I407 PolarHBondContact O-N 3.41Å; I407-V409 PolarHBondContact O-N 3.17Å; I407-M410 PolarHBondContact O-N 3.1Å; I407-S411 WeakPolarHBondContact O-CB 3.46Å; I407-S411 PolarHBondContact O-N 3.4Å
408	A	77.7	Confident	79.4	Confident	50 Å²	50	103 Å²	103	41%	0.413	54%	0.535	S	S	.	.	H	α-helix	trans	-61	-44.6	176.9	0	0	0	0	0	111.9	K404 R405 F406 I412	K404-A408 WeakPolarHBondContact O-CB 3.25Å; K404-A408 PolarHBondContact O-N 3.43Å; R405-A408 PolarHBondContact O-N 3.12Å; F406-A408 PolarHBondContact O-N 2.04Å; A408-I412 WeakPolarHBondContact O-CD1 3.48Å; A408-I412 VanDerWaalsContact O-CG1 3.27Å; A408-I412 WeakPolarHBondContact O-CG1 3.06Å; A408-I412 PolarHBondContact O-N 2.91Å
409	V	83.4	Confident	80	Confident	84 Å²	84	102.1 Å²	102.1	51%	0.509	53%	0.53	S	S	.	.	H	α-helix	trans	-66.8	-44.8	178.8	174.9	0	0	0	0	111.5	R405 F406 I407 S411 I412 V413	R405-V409 VanDerWaalsContact O-CG2 3.31Å; R405-V409 WeakPolarHBondContact O-CG2 3.35Å; R405-V409 PolarHBondContact O-N 2.99Å; F406-V409 PolarHBondContact O-N 2.77Å; I407-V409 PolarHBondContact O-N 3.17Å; V409-S411 VanDerWaalsContact C-N 3.33Å; V409-S411 PolarHBondContact O-N 3.34Å; V409-I412 PolarHBondContact O-N 3.3Å; V409-V413 HydrophobicContact CG1-CG2 4.44Å; V409-V413 WeakPolarHBondContact O-CG2 3.14Å; V409-V413 PolarHBondContact O-N 3.46Å
410	M	81.2	Confident	80.6	Confident	91 Å²	91	104.9 Å²	104.9	45%	0.448	54%	0.542	S	S	.	.	H	α-helix	trans	-66	-34.5	-179.6	-72.8	-59.2	-160.3	0	0	113.1	F406 I407 V413 S414	F406-M410 HydrophobicContact CD1-CG 4.12Å; F406-M410 HydrophobicContact CE1-CE 3.9Å; F406-M410 HydrophobicContact CE1-CG 3.82Å; F406-M410 HydrophobicContact CE2-CE 3.73Å; F406-M410 HydrophobicContact CE2-CG 4.47Å; F406-M410 HydrophobicContact CZ-CE 3.23Å; F406-M410 HydrophobicContact CZ-CG 4.03Å; F406-M410 HydrophobicContact CZ-SD 4.47Å; F406-M410 WeakPolarHBondContact O-CB 3.47Å; F406-M410 WeakPolarHBondContact O-CG 3.5Å; F406-M410 PolarHBondContact O-N 2.95Å; I407-M410 PolarHBondContact O-N 3.1Å; M410-V413 PolarHBondContact O-N 2.89Å; M410-S414 WeakPolarHBondContact O-CB 3.3Å; M410-S414 PolarHBondContact O-N 3.23Å; M410-S414 PolarHBondContact O-OG 2.71Å
411	S	86.4	Confident	81.7	Confident	65 Å²	65	104 Å²	104	46%	0.455	54%	0.542	S	S	.	.	H	α-helix	trans	-62.3	-45.5	172.9	-173.5	0	0	0	0	111.3	I407 V409 V413 S414 I415	I407-S411 WeakPolarHBondContact O-CB 3.46Å; I407-S411 PolarHBondContact O-N 3.4Å; V409-S411 VanDerWaalsContact C-N 3.33Å; V409-S411 PolarHBondContact O-N 3.34Å; S411-V413 PolarHBondContact O-N 3.31Å; S411-S414 PolarHBondContact O-N 2.86Å; S411-I415 WeakPolarHBondContact O-CD1 3.47Å; S411-I415 VanDerWaalsContact O-CG1 3.28Å; S411-I415 WeakPolarHBondContact O-CG1 3.47Å; S411-I415 PolarHBondContact O-N 3.39Å; S411-I415 VanDerWaalsContact O-N 3.1Å
412	I	89.4	Confident	83.1	Confident	102 Å²	102	97.1 Å²	97.1	52%	0.523	53%	0.526	S	S	.	.	H	α-helix	trans	-61.1	-45.7	177.2	-65.3	163.8	0	0	0	111	A408 V409 S414 I415 L416	A408-I412 WeakPolarHBondContact O-CD1 3.48Å; A408-I412 VanDerWaalsContact O-CG1 3.27Å; A408-I412 WeakPolarHBondContact O-CG1 3.06Å; A408-I412 PolarHBondContact O-N 2.91Å; V409-I412 PolarHBondContact O-N 3.3Å; I412-S414 PolarHBondContact O-N 2.82Å; I412-I415 PolarHBondContact O-N 2.67Å; I412-L416 HydrophobicContact CG2-CD1 4.02Å; I412-L416 VanDerWaalsContact O-CG 3.3Å; I412-L416 WeakPolarHBondContact O-CG 3.29Å; I412-L416 PolarHBondContact O-N 3.05Å; I412-L416 VanDerWaalsContact O-N 3.15Å
413	V	89.6	Confident	84.6	Confident	83 Å²	83	99 Å²	99	50%	0.503	53%	0.53	S	S	.	.	H	α-helix	trans	-63.4	-40.9	179.6	175.2	0	0	0	0	111.7	V409 M410 S411 L416 G417	V409-V413 HydrophobicContact CG1-CG2 4.44Å; V409-V413 WeakPolarHBondContact O-CG2 3.14Å; V409-V413 PolarHBondContact O-N 3.46Å; M410-V413 PolarHBondContact O-N 2.89Å; S411-V413 PolarHBondContact O-N 3.31Å; V413-L416 PolarHBondContact O-N 3.38Å; V413-G417 PolarHBondContact O-N 2.75Å
414	S	89.7	Confident	85.9	Confident	76 Å²	76	97.8 Å²	97.8	53%	0.531	53%	0.526	S	S	.	.	H	α-helix	trans	-65.7	-41.3	-179.6	-59.5	0	0	0	0	112.2	M410 S411 I412 L416 G417 M418	M410-S414 WeakPolarHBondContact O-CB 3.3Å; M410-S414 PolarHBondContact O-N 3.23Å; M410-S414 PolarHBondContact O-OG 2.71Å; S411-S414 PolarHBondContact O-N 2.86Å; I412-S414 PolarHBondContact O-N 2.82Å; S414-L416 VanDerWaalsContact C-N 3.35Å; S414-G417 PolarHBondContact O-N 3.26Å; S414-M418 WeakPolarHBondContact O-CG 2.98Å; S414-M418 PolarHBondContact O-N 3.04Å; S414-M418 VanDerWaalsContact O-N 3.08Å
415	I	93.3	Very high	86.9	Confident	99 Å²	99	94 Å²	94	51%	0.508	52%	0.518	S	S	.	.	H	α-helix	trans	-62.5	-44	176.4	-66.2	164.3	0	0	0	110.5	S411 I412 M418 L419	S411-I415 WeakPolarHBondContact O-CD1 3.47Å; S411-I415 VanDerWaalsContact O-CG1 3.28Å; S411-I415 WeakPolarHBondContact O-CG1 3.47Å; S411-I415 PolarHBondContact O-N 3.39Å; S411-I415 VanDerWaalsContact O-N 3.1Å; I412-I415 PolarHBondContact O-N 2.67Å; I415-M418 PolarHBondContact O-N 3.08Å; I415-L419 HydrophobicContact CG2-CD1 4.25Å; I415-L419 PolarHBondContact O-N 3.28Å; I415-L419 VanDerWaalsContact O-N 3.16Å
416	L	93.9	Very high	87.9	Confident	99 Å²	99	90.9 Å²	90.9	52%	0.518	52%	0.515	S	S	.	.	H	α-helix	trans	-65.3	-38.6	177.8	-67.7	172.3	0	0	0	112.4	I412 V413 S414 L419 L420	I412-L416 HydrophobicContact CG2-CD1 4.02Å; I412-L416 VanDerWaalsContact O-CG 3.3Å; I412-L416 WeakPolarHBondContact O-CG 3.29Å; I412-L416 PolarHBondContact O-N 3.05Å; I412-L416 VanDerWaalsContact O-N 3.15Å; V413-L416 PolarHBondContact O-N 3.38Å; S414-L416 VanDerWaalsContact C-N 3.35Å; L416-L419 PolarHBondContact O-N 2.78Å; L416-L420 PolarHBondContact O-N 3.32Å; L416-L420 VanDerWaalsContact O-N 3.11Å
417	G	92.3	Very high	88.7	Confident	31 Å²	31	89.3 Å²	89.3	32%	0.32	52%	0.515	S	S	.	.	H	α-helix	trans	-64.1	-42.9	176.8	0	0	0	0	0	113.2	V413 S414 L420 L421	V413-G417 PolarHBondContact O-N 2.75Å; S414-G417 PolarHBondContact O-N 3.26Å; G417-L420 PolarHBondContact O-N 3.18Å; G417-L421 PolarHBondContact O-N 3.03Å; G417-L421 VanDerWaalsContact O-N 3.09Å
418	M	93.1	Very high	89.1	Confident	136 Å²	136	90.8 Å²	90.8	67%	0.67	52%	0.518	S	S	*	.	H	α-helix	trans	-65.3	-40.4	177.3	-70	-66.8	-73.6	0	0	112.2	S414 I415 L420 L421 A422	S414-M418 WeakPolarHBondContact O-CG 2.98Å; S414-M418 PolarHBondContact O-N 3.04Å; S414-M418 VanDerWaalsContact O-N 3.08Å; I415-M418 PolarHBondContact O-N 3.08Å; M418-L420 VanDerWaalsContact C-N 3.33Å; M418-L420 PolarHBondContact O-N 2.83Å; M418-L421 PolarHBondContact O-N 3.15Å; M418-A422 WeakPolarHBondContact O-CB 3.33Å; M418-A422 PolarHBondContact O-N 3.42Å
419	L	94.6	Very high	89.3	Confident	100 Å²	100	94 Å²	94	52%	0.524	53%	0.528	S	S	.	.	H	α-helix	trans	-59.4	-42.1	173.6	-95.4	155.6	0	0	0	112	I415 L416 A422 L423	I415-L419 HydrophobicContact CG2-CD1 4.25Å; I415-L419 PolarHBondContact O-N 3.28Å; I415-L419 VanDerWaalsContact O-N 3.16Å; L416-L419 PolarHBondContact O-N 2.78Å; L419-A422 PolarHBondContact O-N 2.7Å; L419-L423 VanDerWaalsContact O-CG 3.28Å; L419-L423 WeakPolarHBondContact O-CG 3.41Å; L419-L423 PolarHBondContact O-N 2.94Å
420	L	93.2	Very high	89.4	Confident	114 Å²	114	97.3 Å²	97.3	60%	0.597	54%	0.535	S	S	*	.	H	α-helix	trans	-64.5	-44.2	176.7	-84.7	164.8	0	0	0	112.8	L416 G417 M418 A422 L423 V424	L416-L420 PolarHBondContact O-N 3.32Å; L416-L420 VanDerWaalsContact O-N 3.11Å; G417-L420 PolarHBondContact O-N 3.18Å; M418-L420 VanDerWaalsContact C-N 3.33Å; M418-L420 PolarHBondContact O-N 2.83Å; L420-A422 VanDerWaalsContact C-N 3.35Å; L420-A422 PolarHBondContact O-N 3.47Å; L420-L423 PolarHBondContact O-N 2.98Å; L420-V424 WeakPolarHBondContact O-CG2 3.49Å; L420-V424 PolarHBondContact O-N 3.04Å
421	L	92	Very high	89.3	Confident	117 Å²	117	97.9 Å²	97.9	61%	0.613	54%	0.536	S	S	*	.	H	α-helix	trans	-64.8	-38.6	178.2	-69.4	174.2	0	0	0	112.3	G417 M418 L423 V424 S425	G417-L421 PolarHBondContact O-N 3.03Å; G417-L421 VanDerWaalsContact O-N 3.09Å; M418-L421 PolarHBondContact O-N 3.15Å; L421-L423 VanDerWaalsContact C-N 3.33Å; L421-L423 PolarHBondContact O-N 2.03Å; L421-V424 PolarHBondContact O-N 3.28Å; L421-S425 PolarHBondContact O-N 2.85Å; L421-S425 PolarHBondContact O-OG 3.49Å
422	A	92.5	Very high	88.7	Confident	48 Å²	48	100.3 Å²	100.3	40%	0.397	54%	0.542	S	S	.	.	H	α-helix	trans	-61.9	-41.5	173.5	0	0	0	0	0	111.4	M418 L419 L420 S425 L426	M418-A422 WeakPolarHBondContact O-CB 3.33Å; M418-A422 PolarHBondContact O-N 3.42Å; L419-A422 PolarHBondContact O-N 2.7Å; L420-A422 VanDerWaalsContact C-N 3.35Å; L420-A422 PolarHBondContact O-N 3.47Å; A422-S425 WeakPolarHBondContact CA-OG 3.35Å; A422-S425 PolarHBondContact O-OG 2.74Å; A422-L426 VanDerWaalsContact O-CG 3.3Å; A422-L426 WeakPolarHBondContact O-CG 3.24Å; A422-L426 PolarHBondContact O-N 3.02Å; A422-L426 VanDerWaalsContact O-N 3.09Å
423	L	92.3	Very high	88	Confident	103 Å²	103	100.8 Å²	100.8	54%	0.539	55%	0.545	S	S	.	.	H	α-helix	trans	-64.9	-43.1	175.8	-70.6	169.1	0	0	0	112.3	L419 L420 L421 L426 V427	L419-L423 VanDerWaalsContact O-CG 3.28Å; L419-L423 WeakPolarHBondContact O-CG 3.41Å; L419-L423 PolarHBondContact O-N 2.94Å; L420-L423 PolarHBondContact O-N 2.98Å; L421-L423 VanDerWaalsContact C-N 3.33Å; L421-L423 PolarHBondContact O-N 2.03Å; L423-L426 PolarHBondContact O-N 2.79Å; L423-V427 WeakPolarHBondContact O-CG2 3.31Å; L423-V427 PolarHBondContact O-N 3.27Å
424	V	89.4	Confident	87.4	Confident	87 Å²	87	101.1 Å²	101.1	53%	0.527	55%	0.547	S	S	.	.	H	α-helix	trans	-63.4	-44	178.6	173	0	0	0	0	111.5	L420 L421 V427 F428	L420-V424 WeakPolarHBondContact O-CG2 3.49Å; L420-V424 PolarHBondContact O-N 3.04Å; L421-V424 PolarHBondContact O-N 3.28Å; V424-V427 PolarHBondContact O-N 2.91Å; V424-F428 PolarHBondContact O-N 2.84Å
425	S	87.3	Confident	86.2	Confident	68 Å²	68	105.7 Å²	105.7	48%	0.476	55%	0.553	S	S	.	*	H	α-helix	trans	-64.7	-39.5	178.6	49.2	0	0	0	0	112.3	L421 A422 V427 F428 L429	L421-S425 PolarHBondContact O-N 2.85Å; L421-S425 PolarHBondContact O-OG 3.49Å; A422-S425 WeakPolarHBondContact CA-OG 3.35Å; A422-S425 PolarHBondContact O-OG 2.74Å; S425-V427 PolarHBondContact O-N 3.04Å; S425-F428 PolarHBondContact O-N 3.47Å; S425-L429 WeakPolarHBondContact O-CB 3.42Å; S425-L429 PolarHBondContact O-N 3.17Å
426	L	89	Confident	84.4	Confident	115 Å²	115	110 Å²	110	60%	0.602	57%	0.568	S	S	*	*	H	α-helix	trans	-61.5	-41.6	172.6	-74.8	168.1	0	0	0	112.7	A422 L423 L429 K430	A422-L426 VanDerWaalsContact O-CG 3.3Å; A422-L426 WeakPolarHBondContact O-CG 3.24Å; A422-L426 PolarHBondContact O-N 3.02Å; A422-L426 VanDerWaalsContact O-N 3.09Å; L423-L426 PolarHBondContact O-N 2.79Å; L426-L429 PolarHBondContact O-N 3.46Å; L426-K430 WeakPolarHBondContact O-CB 3.49Å; L426-K430 PolarHBondContact O-N 2.04Å
427	V	87.3	Confident	82.4	Confident	96 Å²	96	114.2 Å²	114.2	58%	0.582	58%	0.582	S	S	*	*	H	α-helix	trans	-64.9	-42.4	176.1	172.8	0	0	0	0	111.1	L423 V424 S425 K430 H431	L423-V427 WeakPolarHBondContact O-CG2 3.31Å; L423-V427 PolarHBondContact O-N 3.27Å; V424-V427 PolarHBondContact O-N 2.91Å; S425-V427 PolarHBondContact O-N 3.04Å; V427-K430 WeakPolarHBondContact O-CB 3.37Å; V427-K430 PolarHBondContact O-N 3.04Å; V427-H431 WeakPolarHBondContact O-CB 3.46Å; V427-H431 PolarHBondContact O-N 2.8Å
428	F	83.5	Confident	80.3	Confident	143 Å²	143	118.1 Å²	118.1	63%	0.627	60%	0.6	S	S	*	*	H	α-helix	trans	-64.1	-42.6	177.9	-128.3	-86.4	0	0	0	112	V424 S425 K430 H431 M432	V424-F428 PolarHBondContact O-N 2.84Å; S425-F428 PolarHBondContact O-N 3.47Å; F428-K430 VanDerWaalsContact C-N 3.33Å; F428-K430 PolarHBondContact O-N 2.85Å; F428-H431 PolarHBondContact O-N 3.43Å; F428-M432 HydrophobicContact CD1-CG 4.47Å; F428-M432 WeakPolarHBondContact O-CG 3.34Å; F428-M432 PolarHBondContact O-N 3.11Å
429	L	82.6	Confident	78	Confident	117 Å²	117	117.1 Å²	117.1	61%	0.613	61%	0.607	S	S	*	*	H	α-helix	trans	-60.8	-44.9	176.8	-144.8	102.1	0	0	0	110.8	S425 L426 H431 M432 L433	S425-L429 WeakPolarHBondContact O-CB 3.42Å; S425-L429 PolarHBondContact O-N 3.17Å; L426-L429 PolarHBondContact O-N 3.46Å; L429-H431 VanDerWaalsContact C-N 3.34Å; L429-H431 PolarHBondContact O-N 2.89Å; L429-M432 PolarHBondContact O-N 2.95Å; L429-L433 VanDerWaalsContact O-CG 3.32Å; L429-L433 WeakPolarHBondContact O-CG 3.22Å; L429-L433 PolarHBondContact O-N 3.36Å; L429-L433 VanDerWaalsContact O-N 3.08Å
430	K	84.2	Confident	75.7	Confident	153 Å²	153	117.7 Å²	117.7	67%	0.665	62%	0.619	S	S	*	*	H	α-helix	trans	-59.1	-44.6	174.4	-171.9	-178.3	-179.7	-179.3	0	111.5	L426 V427 F428 M432 L433 V434	L426-K430 WeakPolarHBondContact O-CB 3.49Å; L426-K430 PolarHBondContact O-N 2.04Å; V427-K430 WeakPolarHBondContact O-CB 3.37Å; V427-K430 PolarHBondContact O-N 3.04Å; F428-K430 VanDerWaalsContact C-N 3.33Å; F428-K430 PolarHBondContact O-N 2.85Å; K430-M432 PolarHBondContact O-N 3.45Å; K430-L433 PolarHBondContact O-N 3.44Å; K430-V434 WeakPolarHBondContact O-CG2 3.43Å; K430-V434 PolarHBondContact O-N 3.36Å; K430-V434 VanDerWaalsContact O-N 3.09Å
431	H	80.2	Confident	72.8	Confident	103 Å²	103	120.2 Å²	120.2	48%	0.477	63%	0.633	S	S	.	*	H	α-helix	trans	-66.4	-36.3	-178.8	-155	-64	0	0	0	112.7	V427 F428 L429 R435	V427-H431 WeakPolarHBondContact O-CB 3.46Å; V427-H431 PolarHBondContact O-N 2.8Å; F428-H431 PolarHBondContact O-N 3.43Å; L429-H431 VanDerWaalsContact C-N 3.34Å; L429-H431 PolarHBondContact O-N 2.89Å; H431-R435 PolarHBondContact CE1-NE 2.79Å; H431-R435 PolarHBondContact O-N 2.84Å; H431-R435 VanDerWaalsContact O-N 3.15Å
432	M	74.1	Confident	70.1	Confident	117 Å²	117	126 Å²	126	58%	0.576	65%	0.647	S	S	*	*	H	α-helix	trans	-67	-38.8	174.5	-73	-69.6	-78.1	0	0	112	F428 L429 K430 R435 K436	F428-M432 HydrophobicContact CD1-CG 4.47Å; F428-M432 WeakPolarHBondContact O-CG 3.34Å; F428-M432 PolarHBondContact O-N 3.11Å; L429-M432 PolarHBondContact O-N 2.95Å; K430-M432 PolarHBondContact O-N 3.45Å; M432-R435 PolarHBondContact O-N 2.76Å; M432-K436 PolarHBondContact O-N 2.78Å
433	L	74.8	Confident	67.2	Low	111 Å²	111	129.3 Å²	129.3	58%	0.581	66%	0.662	S	S	*	*	H	α-helix	trans	-66	-39.6	176.9	-69.4	170.6	0	0	0	112.1	L429 K430 K436	L429-L433 VanDerWaalsContact O-CG 3.32Å; L429-L433 WeakPolarHBondContact O-CG 3.22Å; L429-L433 PolarHBondContact O-N 3.36Å; L429-L433 VanDerWaalsContact O-N 3.08Å; K430-L433 PolarHBondContact O-N 3.44Å; L433-K436 PolarHBondContact O-N 3.32Å
434	V	75.9	Confident	64.2	Low	91 Å²	91	132.7 Å²	132.7	55%	0.552	68%	0.675	S	S	*	*	H	α-helix	trans	-66.6	-40.8	176.6	175.5	0	0	0	0	111.8	K430 K436 F437	K430-V434 WeakPolarHBondContact O-CG2 3.43Å; K430-V434 PolarHBondContact O-N 3.36Å; K430-V434 VanDerWaalsContact O-N 3.09Å; V434-K436 VanDerWaalsContact C-N 3.28Å; V434-K436 PolarHBondContact O-N 2.77Å; V434-F437 PolarHBondContact O-N 2.72Å
435	R	63.8	Low	61.3	Low	171 Å²	171	140 Å²	140	65%	0.645	69%	0.693	S	S	*	*	H	α-helix	trans	-64.8	-29.2	179.3	-79.4	-174.4	175.1	178	2.4	113.4	H431 M432 F437	H431-R435 PolarHBondContact CE1-NE 2.79Å; H431-R435 PolarHBondContact O-N 2.84Å; H431-R435 VanDerWaalsContact O-N 3.15Å; M432-R435 PolarHBondContact O-N 2.76Å; R435-F437 VanDerWaalsContact C-N 3.27Å; R435-F437 PolarHBondContact O-N 2.91Å
436	K	55.6	Low	58.5	Low	189 Å²	189	145.1 Å²	145.1	82%	0.822	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.5	-16.6	179.8	-111.8	179.5	178.5	-178.8	0	114.1	M432 L433 V434	M432-K436 PolarHBondContact O-N 2.78Å; L433-K436 PolarHBondContact O-N 3.32Å; V434-K436 VanDerWaalsContact C-N 3.28Å; V434-K436 PolarHBondContact O-N 2.77Å
437	F	53	Low	55.6	Low	189 Å²	189	144.4 Å²	144.4	83%	0.829	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.1	-1.7	-174.6	-100.9	-83.7	0	0	0	115.7	V434 R435	V434-F437 PolarHBondContact O-N 2.72Å; R435-F437 VanDerWaalsContact C-N 3.27Å; R435-F437 PolarHBondContact O-N 2.91Å
438	T	47.4	Very low	52.8	Low	112 Å²	112	144.3 Å²	144.3	69%	0.687	73%	0.728	S	S	*	*	S	Bend	trans	-138.7	56.9	-172.7	53.2	0	0	0	0	113.7
439	S	45.3	Very low	50.3	Low	116 Å²	116	144.9 Å²	144.9	81%	0.811	74%	0.743	S	S	*	*			trans	-166.6	63.5	168	173.3	0	0	0	0	112.2
440	S	45.8	Very low	47.7	Very low	112 Å²	112	150 Å²	150	78%	0.783	75%	0.754	S	S	*	*			trans	-142.2	78.3	160.9	-170.2	0	0	0	0	108.5
441	N	33.7	Very low	45	Very low	167 Å²	167	147.7 Å²	147.7	89%	0.893	76%	0.757	S	S	*	*			trans	-174.8	139.7	154.9	-100.6	-23.9	0	0	0	111.4
442	R	35.1	Very low	42.6	Very low	238 Å²	238	147.8 Å²	147.8	90%	0.898	77%	0.769	S	S	*	*			trans	103.5	78.3	165.5	-150.8	178.4	-68.7	-165.3	-0.2	118.2
443	V	30.8	Very low	40.5	Very low	117 Å²	117	149.9 Å²	149.9	71%	0.709	78%	0.783	S	S	*	*				3.7	140.9	120.5	179.8	0	0	0	0	119.6
444	Q	30.3	Very low	38.2	Very low	175 Å²	175	149 Å²	149	82%	0.818	79%	0.792	S	S	*	*			trans	95	108.8	150.6	-92.2	163.7	2.8	0	0	122
445	R	27.2	Very low	35.9	Very low	241 Å²	241	155.8 Å²	155.8	91%	0.909	81%	0.807	S	S	*	*			trans	17.8	126.4	133.6	-65.4	-177	-178.3	172.9	0.7	118.6
446	L	30	Very low	34.2	Very low	175 Å²	175	154.5 Å²	154.5	92%	0.916	81%	0.812	S	S	*	*			trans	-155.6	147.9	130.4	-101.9	156.6	0	0	0	110.3
447	S	27.8	Very low	32.7	Very low	100 Å²	100	149.8 Å²	149.8	70%	0.699	80%	0.803	S	S	*	*			trans	-84.2	152.6	-169.8	44.9	0	0	0	0	114.6
448	A	27.5	Very low	31.5	Very low	94 Å²	94	148.4 Å²	148.4	78%	0.777	80%	0.804	S	S	*	*			trans	50.5	116.3	141.7	0	0	0	0	0	120.1
449	V	32.4	Very low	30.7	Very low	154 Å²	154	149.3 Å²	149.3	93%	0.933	81%	0.808	S	S	*	*				-158.6	149.7	124.3	166	0	0	0	0	109.4
450	R	26.5	Very low	29.9	Very low	226 Å²	226	151.1 Å²	151.1	85%	0.853	81%	0.809	S	S	*	*			trans	-66.4	150.9	-169.8	-115.8	167.7	179.2	133.4	-2.7	118
451	S	27.2	Very low	29	Very low	103 Å²	103	151.3 Å²	151.3	72%	0.72	81%	0.81	S	S	*	*			trans	42.1	123.9	134	68.6	0	0	0	0	122.4
452	S	31.6	Very low	28.6	Very low	106 Å²	106	147.9 Å²	147.9	74%	0.741	81%	0.805	S	S	*	*				-168.9	122.9	117.2	47.6	0	0	0	0	111.6
453	D	29.8	Very low	28.3	Very low	161 Å²	161	141.9 Å²	141.9	86%	0.861	81%	0.806	S	S	*	*			trans	62.4	98	144.7	-56.6	-30.6	0	0	0	121.8
454	A	26.3	Very low	28	Very low	93 Å²	93	140.1 Å²	140.1	77%	0.769	81%	0.812	S	S	*	*			trans	-87.5	126.1	141.8	0	0	0	0	0	109.1
455	R	27.9	Very low	27.8	Very low	233 Å²	233	141.5 Å²	141.5	88%	0.879	82%	0.818	S	S	*	*			trans	-178	139.3	140	-106.9	169.3	-169.3	-156.2	2.5	114.5
456	L	26.7	Very low	27.7	Very low	144 Å²	144	133.2 Å²	133.2	75%	0.754	81%	0.808	S	S	*	*			trans	66.8	105	157.3	-78.1	129.9	0	0	0	116.5
457	S	25.3	Very low	27.5	Very low	89 Å²	89	133.4 Å²	133.4	62%	0.622	81%	0.806	S	S	*	*				65.8	112.1	59.5	100.8	0	0	0	0	115.2
458	L	27.6	Very low	27.5	Very low	161 Å²	161	139.3 Å²	139.3	84%	0.843	82%	0.82	S	S	*	*			trans	45.4	103.7	142.6	-66.6	158.9	0	0	0	118.2
459	V	30.1	Very low	27.3	Very low	130 Å²	130	138.5 Å²	138.5	79%	0.788	82%	0.82	S	S	*	*			trans	-125.1	106.8	146.5	-178.1	0	0	0	0	108.9	S461	V459-S461 PolarHBondContact O-N 2.76Å
460	N	28.1	Very low	26.9	Very low	155 Å²	155	135.2 Å²	135.2	83%	0.829	82%	0.818	S	S	*	*			trans	-53.3	125	160.4	-97.5	-12.1	0	0	0	109.2
461	S	28.3	Very low	27.1	Very low	115 Å²	115	129.3 Å²	129.3	80%	0.804	82%	0.817	S	S	*	*			trans	-119.6	85.6	168.7	-55	0	0	0	0	108.2	V459	V459-S461 PolarHBondContact O-N 2.76Å
462	A	25.2	Very low	26.9	Very low	95 Å²	95	127.6 Å²	127.6	79%	0.785	82%	0.816	S	S	*	*			trans	-90.6	148.6	156.5	0	0	0	0	0	108
463	A	27.3	Very low	26.9	Very low	112 Å²	112	128.9 Å²	128.9	93%	0.926	82%	0.822	S	S	*	*			trans	84.8	93.2	179.5	0	0	0	0	0	116.1
464	G	26	Very low	26.8	Very low	80 Å²	80	126.1 Å²	126.1	83%	0.825	82%	0.815	S	S	*	*			trans	-148.2	68.2	165	0	0	0	0	0	110.2
465	H	25	Very low	26.8	Very low	204 Å²	204	127.2 Å²	127.2	94%	0.944	81%	0.814	S	S	*	*			trans	-67.9	128.8	158	-90.6	-76.3	0	0	0	108.5
466	G	24.5	Very low	26.8	Very low	68 Å²	68	120 Å²	120	70%	0.701	80%	0.799	S	S	*	*			trans	163.3	95.2	167.9	0	0	0	0	0	116.2
467	M	26.2	Very low	26.7	Very low	178 Å²	178	121.6 Å²	121.6	88%	0.877	81%	0.805	S	S	*	*			trans	41.7	107.4	140.7	-61.2	-157	-162.5	0	0	120.7
468	F	28.8	Very low	26.8	Very low	225 Å²	225	125.1 Å²	125.1	99%	0.987	81%	0.805	S	S	*	*				-160.8	126.6	128.2	-79	-73.1	0	0	0	104.5
469	G	22.9	Very low	26.8	Very low	76 Å²	76	122.7 Å²	122.7	78%	0.784	80%	0.802	S	S	*	*			cis	122.3	87.7	30.4	0	0	0	0	0	108.1
470	G	24.2	Very low	27	Very low	85 Å²	85	120 Å²	120	88%	0.876	79%	0.788	S	S	*	*			trans	77.3	91.6	152.9	0	0	0	0	0	119.5
471	A	29.6	Very low	27.1	Very low	102 Å²	102	119.1 Å²	119.1	84%	0.843	78%	0.784	S	S	*	*			trans	-146.3	124.6	147	0	0	0	0	0	108.8
472	G	24.7	Very low	27.6	Very low	68 Å²	68	117.7 Å²	117.7	70%	0.701	77%	0.77	S	S	*	*			trans	-61.9	164.9	-165	0	0	0	0	0	115.9	S474	G472-S474 PolarHBondContact O-N 2.89Å; G472-S474 VanDerWaalsContact O-N 3.15Å
473	P	30.2	Very low	28.2	Very low	133 Å²	133	117 Å²	117	86%	0.864	75%	0.754	S	S	*	*			trans	-67.5	114.9	-169.5	27	-32.5	0	0	0	110.7
474	S	27.7	Very low	28.4	Very low	102 Å²	102	121 Å²	121	71%	0.713	74%	0.744	S	S	*	*			trans	-56	133.7	165.5	35.8	0	0	0	0	110.2	G472 C476	G472-S474 PolarHBondContact O-N 2.89Å; G472-S474 VanDerWaalsContact O-N 3.15Å; S474-C476 PolarHBondContact O-N 2.92Å
475	P	26.7	Very low	28.9	Very low	116 Å²	116	121.6 Å²	121.6	75%	0.753	73%	0.729	S	S	*	*			trans	-67.9	126.7	-173.1	26.7	-32.7	0	0	0	111	M477	P475-M477 PolarHBondContact O-N 2.78Å
476	C	27.7	Very low	29.5	Very low	82 Å²	82	114.7 Å²	114.7	55%	0.554	71%	0.706	S	S	*	*			trans	-62.9	105.1	174.2	-52.1	0	0	0	0	109.7	S474 Y478	S474-C476 PolarHBondContact O-N 2.92Å; C476-Y478 HydrophobicContact CB-CD2 4.46Å; C476-Y478 HydrophobicContact CB-CE2 4.15Å; C476-Y478 PolarHBondContact O-N 2.75Å
477	M	23.8	Very low	30.1	Very low	178 Å²	178	116.2 Å²	116.2	88%	0.877	70%	0.698	S	S	*	*			trans	-79.1	101.5	167.5	-72.3	-168.5	89.1	0	0	108.6	P475 S479	P475-M477 PolarHBondContact O-N 2.78Å; M477-S479 PolarHBondContact O-N 2.67Å
478	Y	28.7	Very low	30.8	Very low	163 Å²	163	112.9 Å²	112.9	64%	0.639	68%	0.683	S	S	*	*			trans	-74.1	113	165	-74.9	-86.5	0	0	0	108.4	C476	C476-Y478 HydrophobicContact CB-CD2 4.46Å; C476-Y478 HydrophobicContact CB-CE2 4.15Å; C476-Y478 PolarHBondContact O-N 2.75Å
479	S	26.9	Very low	31.5	Very low	109 Å²	109	109.8 Å²	109.8	76%	0.762	66%	0.664	S	S	*	*			trans	-134.1	78.7	176.3	170.4	0	0	0	0	109.6	M477	M477-S479 PolarHBondContact O-N 2.67Å
480	S	34.2	Very low	32.6	Very low	73 Å²	73	111.4 Å²	111.4	51%	0.51	65%	0.65	S	S	.	*			trans	-178.3	141.6	144.2	46.2	0	0	0	0	110.9	T482 D483	S480-T482 PolarHBondContact O-N 2.78Å; S480-T482 PolarHBondContact OG-OG1 2.85Å; S480-D483 PolarHBondContact O-N 3.11Å
481	D	31.2	Very low	33.3	Very low	137 Å²	137	109.4 Å²	109.4	73%	0.733	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.3	-6.4	175.6	-70.7	-55.9	0	0	0	114.7	D483 R484 L485	D481-D483 VanDerWaalsContact C-N 3.32Å; D481-D483 PolarHBondContact O-N 3.38Å; D481-R484 PolarHBondContact O-N 2.94Å; D481-L485 PolarHBondContact O-N 3.19Å
482	T	39	Very low	33.8	Very low	85 Å²	85	111 Å²	111	52%	0.521	62%	0.62	S	S	.	*	H	α-helix	trans	-61.4	-35	177.6	52.7	0	0	0	0	113.3	S480 L485 A486	S480-T482 PolarHBondContact O-N 2.78Å; S480-T482 PolarHBondContact OG-OG1 2.85Å; T482-L485 PolarHBondContact O-N 3.08Å; T482-A486 PolarHBondContact O-N 3.04Å; T482-A486 VanDerWaalsContact O-N 3.16Å
483	D	36	Very low	34.6	Very low	81 Å²	81	114.7 Å²	114.7	43%	0.433	62%	0.624	S	S	.	*	H	α-helix	trans	-79.9	-27.8	-176.1	-68	-7.2	0	0	0	112.2	S480 D481 L487	S480-D483 PolarHBondContact O-N 3.11Å; D481-D483 VanDerWaalsContact C-N 3.32Å; D481-D483 PolarHBondContact O-N 3.38Å; D483-L487 PolarHBondContact O-N 3.45Å
484	R	32.8	Very low	35.1	Very low	195 Å²	195	114 Å²	114	74%	0.736	61%	0.612	S	S	*	*	H	α-helix	trans	-68.6	-38.9	172.6	-123.6	-179.7	175.9	-169.3	-3.1	110.8	D481 L487 I488	D481-R484 PolarHBondContact O-N 2.94Å; R484-L487 PolarHBondContact O-N 3.5Å; R484-I488 WeakPolarHBondContact O-CG1 3.13Å; R484-I488 PolarHBondContact O-N 2.9Å
485	L	35.7	Very low	35.5	Very low	94 Å²	94	116 Å²	116	49%	0.492	61%	0.61	S	S	.	*	H	α-helix	trans	-69.6	-36.2	177.9	-143	78.3	0	0	0	112.2	D481 T482 L487 I488 R489	D481-L485 PolarHBondContact O-N 3.19Å; T482-L485 PolarHBondContact O-N 3.08Å; L485-L487 VanDerWaalsContact C-N 3.35Å; L485-I488 PolarHBondContact O-N 3.36Å; L485-R489 WeakPolarHBondContact O-CG 3.49Å; L485-R489 PolarHBondContact O-N 3.01Å
486	A	37.8	Very low	36.2	Very low	58 Å²	58	116.3 Å²	116.3	48%	0.479	61%	0.612	S	S	.	*	H	α-helix	trans	-64.8	-37.5	176.3	0	0	0	0	0	112.6	T482 R489 F490	T482-A486 PolarHBondContact O-N 3.04Å; T482-A486 VanDerWaalsContact O-N 3.16Å; A486-R489 PolarHBondContact O-N 2.95Å; A486-F490 WeakPolarHBondContact O-CB 3.23Å; A486-F490 PolarHBondContact O-N 2.88Å
487	L	37.9	Very low	36.8	Very low	101 Å²	101	120.9 Å²	120.9	53%	0.529	63%	0.625	S	S	.	*	H	α-helix	trans	-69.3	-36.5	174.9	-108.1	143.3	0	0	0	112.8	D483 R484 L485 A491	D483-L487 PolarHBondContact O-N 3.45Å; R484-L487 PolarHBondContact O-N 3.5Å; L485-L487 VanDerWaalsContact C-N 3.35Å; L487-A491 PolarHBondContact O-N 2.87Å
488	I	41	Very low	37.4	Very low	108 Å²	108	118.6 Å²	118.6	55%	0.554	62%	0.616	S	S	*	*	H	α-helix	trans	-66.1	-43.9	173.3	-66.2	165.7	0	0	0	110.1	R484 L485 F490 A491 D492	R484-I488 WeakPolarHBondContact O-CG1 3.13Å; R484-I488 PolarHBondContact O-N 2.9Å; L485-I488 PolarHBondContact O-N 3.36Å; I488-F490 PolarHBondContact O-N 2.93Å; I488-A491 PolarHBondContact O-N 2.92Å; I488-D492 PolarHBondContact O-N 3.24Å
489	R	43.3	Very low	37.7	Very low	159 Å²	159	116 Å²	116	60%	0.6	62%	0.619	S	S	*	*	H	α-helix	trans	-65.7	-35.3	178.2	-73.5	-172.5	-176	-175.4	1.4	113.6	L485 A486 A491 D492 D493	L485-R489 WeakPolarHBondContact O-CG 3.49Å; L485-R489 PolarHBondContact O-N 3.01Å; A486-R489 PolarHBondContact O-N 2.95Å; R489-A491 VanDerWaalsContact C-N 3.3Å; R489-A491 PolarHBondContact O-N 2.59Å; R489-D492 PolarHBondContact O-N 3.34Å; R489-D493 PolarHBondContact O-N 3.18Å
490	F	45	Very low	38.5	Very low	110 Å²	110	114.1 Å²	114.1	48%	0.482	61%	0.606	S	S	.	*	H	α-helix	trans	-68	-29.9	177.6	-170.8	-98.7	0	0	0	112.8	A486 I488 L494	A486-F490 WeakPolarHBondContact O-CB 3.23Å; A486-F490 PolarHBondContact O-N 2.88Å; I488-F490 PolarHBondContact O-N 2.93Å; F490-L494 HydrophobicContact CD1-CD1 4.06Å; F490-L494 HydrophobicContact CE1-CD1 3.52Å; F490-L494 HydrophobicContact CE2-CD1 4.5Å; F490-L494 HydrophobicContact CZ-CD1 3.78Å
491	A	38.7	Very low	39	Very low	44 Å²	44	118.4 Å²	118.4	36%	0.364	61%	0.612	S	S	.	*	H	α-helix	trans	-71.2	-30.4	175.1	0	0	0	0	0	112.6	L487 I488 R489	L487-A491 PolarHBondContact O-N 2.87Å; I488-A491 PolarHBondContact O-N 2.92Å; R489-A491 VanDerWaalsContact C-N 3.3Å; R489-A491 PolarHBondContact O-N 2.59Å
492	D	40.5	Very low	39.5	Very low	135 Å²	135	117.4 Å²	117.4	72%	0.722	61%	0.606	S	S	*	*	H	α-helix	trans	-73.5	-33.3	179	-102.9	-1.2	0	0	0	113.3	I488 R489	I488-D492 PolarHBondContact O-N 3.24Å; R489-D492 PolarHBondContact O-N 3.34Å
493	D	41.6	Very low	39.8	Very low	145 Å²	145	117.5 Å²	117.5	78%	0.775	60%	0.601	S	S	*	*	H	α-helix	trans	-76.6	-19.5	-178	-93.5	-10.3	0	0	0	113.6	R489 Q495	R489-D493 PolarHBondContact O-N 3.18Å; D493-Q495 VanDerWaalsContact C-N 3.31Å; D493-Q495 PolarHBondContact O-N 2.04Å
494	L	40.7	Very low	40	Very low	118 Å²	118	116.2 Å²	116.2	62%	0.618	60%	0.601	S	S	*	*	S	Bend	trans	-82.6	78.5	173	-91.2	123.8	0	0	0	110.5	F490	F490-L494 HydrophobicContact CD1-CD1 4.06Å; F490-L494 HydrophobicContact CE1-CD1 3.52Å; F490-L494 HydrophobicContact CE2-CD1 4.5Å; F490-L494 HydrophobicContact CZ-CD1 3.78Å
495	Q	36.5	Very low	40.4	Very low	144 Å²	144	109.9 Å²	109.9	67%	0.673	58%	0.582	S	S	*	*			trans	20.8	117.7	159.9	-77.8	173.6	-22	0	0	117.8	D493 H497	D493-Q495 VanDerWaalsContact C-N 3.31Å; D493-Q495 PolarHBondContact O-N 2.04Å; Q495-H497 PolarHBondContact O-N 3.23Å
496	P	40.3	Very low	40.8	Very low	124 Å²	124	109.1 Å²	109.1	81%	0.805	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	17.2	-174.5	30.9	-35.9	0	0	0	115.8
497	H	42	Very low	40.7	Very low	178 Å²	178	114.2 Å²	114.2	82%	0.824	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.2	19.2	-177.1	-72.1	-60.1	0	0	0	114.4	Q495	Q495-H497 PolarHBondContact O-N 3.23Å
498	L	35.2	Very low	40.7	Very low	129 Å²	129	114.1 Å²	114.1	68%	0.675	59%	0.589	S	S	*	*	S	Bend	trans	-104.9	148.3	176	-81.7	90.2	0	0	0	112.7	S500	L498-S500 PolarHBondContact O-N 3.41Å
499	P	36.1	Very low	40.6	Very low	108 Å²	108	113.2 Å²	113.2	70%	0.701	59%	0.588	S	S	*	*	S	Bend	trans	-70.5	118.9	-170.6	26.7	-28.5	0	0	0	110.9
500	S	43.8	Very low	40.2	Very low	70 Å²	70	109.1 Å²	109.1	49%	0.49	59%	0.588	S	S	.	*			trans	51.2	106.5	176.2	66.5	0	0	0	0	116.4	L498 D502 E503	L498-S500 PolarHBondContact O-N 3.41Å; S500-D502 PolarHBondContact O-N 2.97Å; S500-E503 PolarHBondContact O-N 3.26Å
501	Y	42.8	Very low	39.8	Very low	164 Å²	164	111.6 Å²	111.6	64%	0.643	60%	0.602	S	S	*	*	H	α-helix	trans	-40	-38	168.6	178.9	-101.3	0	0	0	114	E503 A504 I505	Y501-E503 PolarHBondContact O-N 2.81Å; Y501-A504 PolarHBondContact O-N 2.71Å; Y501-I505 HydrophobicContact CD1-CD1 3.71Å; Y501-I505 HydrophobicContact CD2-CD1 4.47Å; Y501-I505 HydrophobicContact CE1-CD1 3.22Å; Y501-I505 HydrophobicContact CE1-CG1 4.48Å; Y501-I505 HydrophobicContact CE2-CD1 4.06Å; Y501-I505 HydrophobicContact CG-CD1 4.32Å; Y501-I505 VanDerWaalsContact CZ-CD1 3.42Å; Y501-I505 WeakPolarHBondContact O-CG1 3.49Å; Y501-I505 PolarHBondContact O-N 2.91Å; Y501-I505 VanDerWaalsContact O-N 3.16Å
502	D	43.1	Very low	39.5	Very low	115 Å²	115	117.3 Å²	117.3	62%	0.615	61%	0.614	S	S	*	*	H	α-helix	trans	-68.2	-31.4	-179.1	-67.5	-39.6	0	0	0	114.1	S500 S506	S500-D502 PolarHBondContact O-N 2.97Å; D502-S506 VanDerWaalsContact O-CB 3.24Å; D502-S506 WeakPolarHBondContact O-CB 3.32Å; D502-S506 PolarHBondContact O-N 3.42Å; D502-S506 PolarHBondContact O-OG 2.82Å
503	E	44.1	Very low	38.8	Very low	87 Å²	87	122.6 Å²	122.6	41%	0.407	62%	0.623	S	S	.	*	H	α-helix	trans	-74.8	-36.6	177.4	-167.4	172.4	179.5	0	0	111.3	S500 Y501 S506 R507	S500-E503 PolarHBondContact O-N 3.26Å; Y501-E503 PolarHBondContact O-N 2.81Å; E503-S506 PolarHBondContact O-N 2.83Å; E503-R507 WeakPolarHBondContact O-CB 3.35Å; E503-R507 WeakPolarHBondContact O-CG 3.28Å; E503-R507 PolarHBondContact O-N 3.38Å; E503-R507 IonicContact OE1-CZ 2.68Å; E503-R507 VanDerWaalsContact OE1-CZ 3.31Å; E503-R507 IonicContact OE1-NE 3.81Å; E503-R507 PolarHBondContact OE1-NE 3.45Å; E503-R507 IonicContact OE1-NH2 3.29Å; E503-R507 PolarHBondContact OE1-NH2 3.43Å
504	A	40.8	Very low	38.2	Very low	54 Å²	54	120 Å²	120	45%	0.446	62%	0.617	S	S	.	*	H	α-helix	trans	-64	-43.7	175.4	0	0	0	0	0	111.7	Y501 M508	Y501-A504 PolarHBondContact O-N 2.71Å; A504-M508 WeakPolarHBondContact O-CB 3.42Å; A504-M508 WeakPolarHBondContact O-CE 2.98Å; A504-M508 WeakPolarHBondContact O-CG 2.97Å; A504-M508 PolarHBondContact O-N 3.37Å
505	I	42.6	Very low	37.4	Very low	63 Å²	63	126.1 Å²	126.1	32%	0.323	63%	0.632	S	S	.	*	H	α-helix	trans	-65.4	-45.7	174.7	-67.7	176.7	0	0	0	110.6	Y501 R507 M508 V509	Y501-I505 HydrophobicContact CD1-CD1 3.71Å; Y501-I505 HydrophobicContact CD2-CD1 4.47Å; Y501-I505 HydrophobicContact CE1-CD1 3.22Å; Y501-I505 HydrophobicContact CE1-CG1 4.48Å; Y501-I505 HydrophobicContact CE2-CD1 4.06Å; Y501-I505 HydrophobicContact CG-CD1 4.32Å; Y501-I505 VanDerWaalsContact CZ-CD1 3.42Å; Y501-I505 WeakPolarHBondContact O-CG1 3.49Å; Y501-I505 PolarHBondContact O-N 2.91Å; Y501-I505 VanDerWaalsContact O-N 3.16Å; I505-R507 VanDerWaalsContact C-N 3.32Å; I505-R507 PolarHBondContact O-N 3.49Å; I505-M508 PolarHBondContact O-N 3.42Å; I505-V509 HydrophobicContact CG2-CG2 4.1Å; I505-V509 WeakPolarHBondContact O-CB 3.27Å; I505-V509 VanDerWaalsContact O-CG2 3.3Å; I505-V509 WeakPolarHBondContact O-CG2 3.5Å; I505-V509 PolarHBondContact O-N 2.94Å
506	S	42.8	Very low	37	Very low	77 Å²	77	123 Å²	123	54%	0.538	62%	0.624	S	S	.	*	H	α-helix	trans	-60.9	-40.3	180	-65.5	0	0	0	0	112.1	D502 E503 A510	D502-S506 VanDerWaalsContact O-CB 3.24Å; D502-S506 WeakPolarHBondContact O-CB 3.32Å; D502-S506 PolarHBondContact O-N 3.42Å; D502-S506 PolarHBondContact O-OG 2.82Å; E503-S506 PolarHBondContact O-N 2.83Å; S506-A510 WeakPolarHBondContact O-CB 3.43Å; S506-A510 PolarHBondContact O-N 2.54Å
507	R	36.5	Very low	36.4	Very low	165 Å²	165	122.2 Å²	122.2	62%	0.623	62%	0.62	S	S	*	*	H	α-helix	trans	-68.2	-40.3	175.1	-72.3	-178.3	-175.6	-172	3.2	112.5	E503 I505 A510 Q511	E503-R507 WeakPolarHBondContact O-CB 3.35Å; E503-R507 WeakPolarHBondContact O-CG 3.28Å; E503-R507 PolarHBondContact O-N 3.38Å; E503-R507 IonicContact OE1-CZ 2.68Å; E503-R507 VanDerWaalsContact OE1-CZ 3.31Å; E503-R507 IonicContact OE1-NE 3.81Å; E503-R507 PolarHBondContact OE1-NE 3.45Å; E503-R507 IonicContact OE1-NH2 3.29Å; E503-R507 PolarHBondContact OE1-NH2 3.43Å; I505-R507 VanDerWaalsContact C-N 3.32Å; I505-R507 PolarHBondContact O-N 3.49Å; R507-A510 PolarHBondContact O-N 2.77Å; R507-Q511 PolarHBondContact O-N 3.46Å
508	M	37.6	Very low	35.8	Very low	100 Å²	100	118.3 Å²	118.3	49%	0.493	60%	0.601	S	S	.	*	H	α-helix	trans	-65.9	-38.7	175.7	-81.2	-171.2	-76.4	0	0	112.5	A504 I505	A504-M508 WeakPolarHBondContact O-CB 3.42Å; A504-M508 WeakPolarHBondContact O-CE 2.98Å; A504-M508 WeakPolarHBondContact O-CG 2.97Å; A504-M508 PolarHBondContact O-N 3.37Å; I505-M508 PolarHBondContact O-N 3.42Å
509	V	38.2	Very low	35.6	Very low	88 Å²	88	119 Å²	119	53%	0.533	61%	0.605	S	S	.	*	H	α-helix	trans	-73.3	-37.6	177.4	175.8	0	0	0	0	111	I505 Q511 R512	I505-V509 HydrophobicContact CG2-CG2 4.1Å; I505-V509 WeakPolarHBondContact O-CB 3.27Å; I505-V509 VanDerWaalsContact O-CG2 3.3Å; I505-V509 WeakPolarHBondContact O-CG2 3.5Å; I505-V509 PolarHBondContact O-N 2.94Å; V509-Q511 VanDerWaalsContact C-N 3.3Å; V509-Q511 PolarHBondContact O-N 3.29Å; V509-R512 WeakPolarHBondContact O-CB 3.47Å; V509-R512 PolarHBondContact O-N 2.92Å; V509-R512 VanDerWaalsContact O-N 3.15Å
510	A	34.9	Very low	35.3	Very low	73 Å²	73	117.8 Å²	117.8	60%	0.603	60%	0.599	S	S	*	*	H	α-helix	trans	-62.8	-32.5	177.8	0	0	0	0	0	113.3	S506 R507 R512	S506-A510 WeakPolarHBondContact O-CB 3.43Å; S506-A510 PolarHBondContact O-N 2.54Å; R507-A510 PolarHBondContact O-N 2.77Å; A510-R512 VanDerWaalsContact C-N 3.31Å; A510-R512 PolarHBondContact O-N 2.84Å
511	Q	36.2	Very low	34.7	Very low	163 Å²	163	122.1 Å²	122.1	76%	0.762	62%	0.616	S	S	*	*	G	3₁₀ helix	trans	-75.5	-12	176.8	-74.8	-174	-14.9	0	0	114.3	R507 V509 R513	R507-Q511 PolarHBondContact O-N 3.46Å; V509-Q511 VanDerWaalsContact C-N 3.3Å; V509-Q511 PolarHBondContact O-N 3.29Å; Q511-R513 PolarHBondContact O-N 3.15Å
512	R	32.9	Very low	34.3	Very low	164 Å²	164	118.2 Å²	118.2	62%	0.619	61%	0.613	S	S	*	*	G	3₁₀ helix	trans	-73.3	12.2	-177.1	-75.8	-173.5	177.9	-166.6	-0.3	115.9	V509 A510 S514	V509-R512 WeakPolarHBondContact O-CB 3.47Å; V509-R512 PolarHBondContact O-N 2.92Å; V509-R512 VanDerWaalsContact O-N 3.15Å; A510-R512 VanDerWaalsContact C-N 3.31Å; A510-R512 PolarHBondContact O-N 2.84Å; R512-S514 PolarHBondContact O-N 2.79Å
513	R	25.6	Very low	33.9	Very low	245 Å²	245	115.4 Å²	115.4	93%	0.925	60%	0.6	S	S	*	*	G	3₁₀ helix	trans	-72	-7.6	177.2	-75	-170.2	177.9	-175.6	0.8	114.8	Q511	Q511-R513 PolarHBondContact O-N 3.15Å
514	S	29.4	Very low	33.4	Very low	91 Å²	91	116.1 Å²	116.1	64%	0.636	61%	0.606	S	S	*	*	S	Bend	trans	-125.6	109.7	172	57.7	0	0	0	0	111	R512 P516	R512-S514 PolarHBondContact O-N 2.79Å; S514-P516 WeakPolarHBondContact O-CD 3.45Å
515	R	25.1	Very low	33	Very low	247 Å²	247	117.5 Å²	117.5	93%	0.932	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-69.2	116.9	177.2	-63.1	179.9	177.3	-165.9	-0.9	110.8
516	P	27.4	Very low	32.3	Very low	79 Å²	79	116 Å²	116	51%	0.513	61%	0.612	S	S	.	*	P	Polyproline II helix	trans	-99.2	128.4	163.4	10.5	11.7	0	0	0	109.4	S514 F518	S514-P516 WeakPolarHBondContact O-CD 3.45Å; P516-F518 HydrophobicContact CB-CE2 4.26Å; P516-F518 HydrophobicContact CB-CZ 4.23Å; P516-F518 HydrophobicContact CG-CE2 4.15Å; P516-F518 HydrophobicContact CG-CZ 4.12Å; P516-F518 WeakPolarHBondContact O-CD2 3.35Å; P516-F518 WeakPolarHBondContact O-CE2 3.35Å
517	C	27.5	Very low	31.8	Very low	106 Å²	106	118.6 Å²	118.6	72%	0.716	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-74.3	131.6	170.3	-62.6	0	0	0	0	109.2
518	F	30.3	Very low	31.7	Very low	96 Å²	96	113.1 Å²	113.1	42%	0.421	60%	0.597	S	S	.	*			trans	-112.8	111.2	179.8	-66.8	-81.9	0	0	0	110	P516	P516-F518 HydrophobicContact CB-CE2 4.26Å; P516-F518 HydrophobicContact CB-CZ 4.23Å; P516-F518 HydrophobicContact CG-CE2 4.15Å; P516-F518 HydrophobicContact CG-CZ 4.12Å; P516-F518 WeakPolarHBondContact O-CD2 3.35Å; P516-F518 WeakPolarHBondContact O-CE2 3.35Å
519	D	29.7	Very low	31.4	Very low	145 Å²	145	111.9 Å²	111.9	78%	0.775	60%	0.596	S	S	*	*			trans	-93.8	106.5	165.7	-73.1	-34.4	0	0	0	108.1
520	S	30.6	Very low	31	Very low	82 Å²	82	114.6 Å²	114.6	57%	0.573	60%	0.596	S	S	*	*	S	Bend	trans	76.1	139.2	175.6	84.2	0	0	0	0	118.3	S522 T523	S520-S522 PolarHBondContact O-N 2.83Å; S520-S522 PolarHBondContact OG-OG 3.19Å; S520-T523 PolarHBondContact O-N 3.25Å; S520-T523 VanDerWaalsContact O-N 3.12Å; S520-T523 PolarHBondContact O-OG1 3.08Å
521	L	31.6	Very low	30.7	Very low	160 Å²	160	114.2 Å²	114.2	84%	0.838	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-49.9	-16.5	176.2	-80.5	147.6	0	0	0	115	T523 L524	L521-T523 PolarHBondContact O-N 2.87Å; L521-L524 PolarHBondContact O-N 2.79Å
522	S	32.6	Very low	30.5	Very low	82 Å²	82	112.2 Å²	112.2	57%	0.573	59%	0.587	S	S	*	*	H	α-helix	trans	-65.8	-23.6	176.6	67.5	0	0	0	0	113.3	S520 S525	S520-S522 PolarHBondContact O-N 2.83Å; S520-S522 PolarHBondContact OG-OG 3.19Å; S522-S525 PolarHBondContact O-OG 3.39Å
523	T	34.8	Very low	30.4	Very low	56 Å²	56	114.5 Å²	114.5	34%	0.344	60%	0.596	S	S	.	*	H	α-helix	trans	-83.9	-14.1	179.7	50.7	0	0	0	0	113.9	S520 L521 G526 Y527	S520-T523 PolarHBondContact O-N 3.25Å; S520-T523 VanDerWaalsContact O-N 3.12Å; S520-T523 PolarHBondContact O-OG1 3.08Å; L521-T523 PolarHBondContact O-N 2.87Å; T523-G526 PolarHBondContact O-N 3.11Å; T523-Y527 PolarHBondContact O-N 2.68Å
524	L	34	Very low	30.5	Very low	103 Å²	103	113.3 Å²	113.3	54%	0.539	59%	0.591	S	S	.	*	H	α-helix	trans	-67.4	-38.7	176	-161.3	76.7	0	0	0	111.3	L521 Y527 C528	L521-L524 PolarHBondContact O-N 2.79Å; L524-Y527 PolarHBondContact O-N 3.37Å; L524-C528 PolarHBondContact O-N 3.42Å
525	S	32.3	Very low	30.3	Very low	83 Å²	83	114.7 Å²	114.7	58%	0.58	59%	0.591	S	S	*	*	H	α-helix	trans	-69.8	-33.9	178	79.8	0	0	0	0	112.4	S522 C528 T529	S522-S525 PolarHBondContact O-OG 3.39Å; S525-C528 PolarHBondContact O-N 2.99Å; S525-T529 PolarHBondContact O-N 2.68Å; S525-T529 VanDerWaalsContact O-N 3.11Å; S525-T529 PolarHBondContact O-OG1 2.62Å; S525-T529 VanDerWaalsContact O-OG1 3.06Å
526	G	28.5	Very low	30.3	Very low	31 Å²	31	107.3 Å²	107.3	32%	0.32	58%	0.575	S	S	.	*	H	α-helix	trans	-69.5	-30.5	177.6	0	0	0	0	0	113.9	T523 T529 R530	T523-G526 PolarHBondContact O-N 3.11Å; G526-T529 PolarHBondContact O-OG1 2.92Å; G526-R530 PolarHBondContact O-N 3.05Å
527	Y	31.5	Very low	30.3	Very low	132 Å²	132	106.8 Å²	106.8	52%	0.518	57%	0.573	S	S	.	*	H	α-helix	trans	-86.8	-30.4	172.2	-95.9	-80.5	0	0	0	113.3	T523 L524 T529 R530 A531	T523-Y527 PolarHBondContact O-N 2.68Å; L524-Y527 PolarHBondContact O-N 3.37Å; Y527-T529 VanDerWaalsContact C-N 3.26Å; Y527-T529 PolarHBondContact O-N 2.76Å; Y527-R530 HydrophobicContact CD1-CB 4.35Å; Y527-R530 CarbonylContact O-C 3.57Å; Y527-R530 PolarHBondContact O-N 2.76Å; Y527-R530 VanDerWaalsContact O-N 3.09Å; Y527-A531 WeakPolarHBondContact O-CB 3.05Å; Y527-A531 PolarHBondContact O-N 3.12Å
528	C	34.2	Very low	30.3	Very low	49 Å²	49	110.3 Å²	110.3	33%	0.331	58%	0.584	S	S	.	*	H	α-helix	trans	-57.7	-40.6	169	-83.1	0	0	0	0	111.4	L524 S525 L532	L524-C528 PolarHBondContact O-N 3.42Å; S525-C528 PolarHBondContact O-N 2.99Å; C528-L532 WeakPolarHBondContact O-CB 3.3Å; C528-L532 WeakPolarHBondContact O-CD1 3.27Å; C528-L532 WeakPolarHBondContact O-CG 3.26Å; C528-L532 PolarHBondContact O-N 3.29Å
529	T	33	Very low	30.3	Very low	75 Å²	75	110.6 Å²	110.6	46%	0.46	60%	0.598	S	S	.	*	H	α-helix	trans	-69.2	-31.3	174.6	47	0	0	0	0	113.3	S525 G526 Y527 R533	S525-T529 PolarHBondContact O-N 2.68Å; S525-T529 VanDerWaalsContact O-N 3.11Å; S525-T529 PolarHBondContact O-OG1 2.62Å; S525-T529 VanDerWaalsContact O-OG1 3.06Å; G526-T529 PolarHBondContact O-OG1 2.92Å; Y527-T529 VanDerWaalsContact C-N 3.26Å; Y527-T529 PolarHBondContact O-N 2.76Å; T529-R533 WeakPolarHBondContact O-CB 3.48Å; T529-R533 WeakPolarHBondContact O-CG 3.3Å; T529-R533 PolarHBondContact O-N 2.79Å
530	R	29	Very low	30.1	Very low	145 Å²	145	107.1 Å²	107.1	55%	0.547	59%	0.585	S	S	.	*	H	α-helix	trans	-75.8	-37	172.8	-84.4	-177.9	-163	155.5	7.3	114.2	G526 Y527 R533 R534	G526-R530 PolarHBondContact O-N 3.05Å; Y527-R530 HydrophobicContact CD1-CB 4.35Å; Y527-R530 CarbonylContact O-C 3.57Å; Y527-R530 PolarHBondContact O-N 2.76Å; Y527-R530 VanDerWaalsContact O-N 3.09Å; R530-R533 PolarHBondContact O-N 2.66Å; R530-R534 PolarHBondContact O-N 3.2Å
531	A	29.5	Very low	29.8	Very low	64 Å²	64	110.4 Å²	110.4	53%	0.529	60%	0.595	S	S	.	*	H	α-helix	trans	-68.7	-41	178.4	0	0	0	0	0	110.6	Y527 R533 R534 L535	Y527-A531 WeakPolarHBondContact O-CB 3.05Å; Y527-A531 PolarHBondContact O-N 3.12Å; A531-R533 VanDerWaalsContact C-N 3.31Å; A531-R533 PolarHBondContact O-N 2.85Å; A531-R534 PolarHBondContact O-N 3.45Å; A531-R534 VanDerWaalsContact O-N 3.14Å; A531-L535 PolarHBondContact O-N 2.94Å
532	L	31	Very low	29.5	Very low	122 Å²	122	113.6 Å²	113.6	64%	0.639	60%	0.596	S	S	*	*	H	α-helix	trans	-66.2	-31.6	173.5	-67.9	171.2	0	0	0	112.5	C528 R534 L535	C528-L532 WeakPolarHBondContact O-CB 3.3Å; C528-L532 WeakPolarHBondContact O-CD1 3.27Å; C528-L532 WeakPolarHBondContact O-CG 3.26Å; C528-L532 PolarHBondContact O-N 3.29Å; L532-R534 VanDerWaalsContact C-N 3.28Å; L532-R534 PolarHBondContact O-N 2.91Å; L532-L535 HydrophobicContact CD2-CD1 3.95Å
533	R	31.7	Very low	29.2	Very low	212 Å²	212	115.1 Å²	115.1	80%	0.8	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	-15.7	172.6	-78.8	176.3	-173.4	-176.3	3.5	114.5	T529 R530 A531	T529-R533 WeakPolarHBondContact O-CB 3.48Å; T529-R533 WeakPolarHBondContact O-CG 3.3Å; T529-R533 PolarHBondContact O-N 2.79Å; R530-R533 PolarHBondContact O-N 2.66Å; A531-R533 VanDerWaalsContact C-N 3.31Å; A531-R533 PolarHBondContact O-N 2.85Å
534	R	26.7	Very low	28.8	Very low	220 Å²	220	123.8 Å²	123.8	83%	0.83	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.1	-0.5	179.4	-74	-159.2	179.9	-163.5	1.3	114.3	R530 A531 L532 P536	R530-R534 PolarHBondContact O-N 3.2Å; A531-R534 PolarHBondContact O-N 3.45Å; A531-R534 VanDerWaalsContact O-N 3.14Å; L532-R534 VanDerWaalsContact C-N 3.28Å; L532-R534 PolarHBondContact O-N 2.91Å; R534-P536 VanDerWaalsContact O-CD 3.29Å; R534-P536 WeakPolarHBondContact O-CD 3.04Å
535	L	25.8	Very low	28.5	Very low	119 Å²	119	128.4 Å²	128.4	62%	0.623	65%	0.652	S	S	*	*	S	Bend	trans	-71.8	114.6	164.4	-72.3	162.2	0	0	0	107	A531 L532 S537	A531-L535 PolarHBondContact O-N 2.94Å; L532-L535 HydrophobicContact CD2-CD1 3.95Å; L535-S537 PolarHBondContact O-N 3.49Å
536	P	23.9	Very low	28.1	Very low	92 Å²	92	131.8 Å²	131.8	60%	0.597	66%	0.659	S	S	*	*			trans	-59.7	125.4	167.6	2.5	8.8	0	0	0	106.5	R534 L538	R534-P536 VanDerWaalsContact O-CD 3.29Å; R534-P536 WeakPolarHBondContact O-CD 3.04Å; P536-L538 PolarHBondContact O-N 2.82Å
537	S	27.7	Very low	27.9	Very low	68 Å²	68	140.9 Å²	140.9	48%	0.476	68%	0.683	S	S	.	*			trans	-52.4	131	170.5	52.7	0	0	0	0	108.5	L535 S539 S540	L535-S537 PolarHBondContact O-N 3.49Å; S537-S539 PolarHBondContact O-N 3.17Å; S537-S540 PolarHBondContact O-N 3.46Å; S537-S540 PolarHBondContact O-OG 3.49Å; S537-S540 VanDerWaalsContact O-OG 3.07Å; S537-S540 PolarHBondContact OG-OG 3.38Å
538	L	28.5	Very low	27.5	Very low	180 Å²	180	141.7 Å²	141.7	94%	0.942	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.6	-4	178.4	-87.9	137.6	0	0	0	113.9	P536	P536-L538 PolarHBondContact O-N 2.82Å
539	S	29.4	Very low	26.9	Very low	102 Å²	102	144.6 Å²	144.6	71%	0.713	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.2	-6	173.9	45.6	0	0	0	0	115.2	S537	S537-S539 PolarHBondContact O-N 3.17Å
540	S	24.9	Very low	26.4	Very low	72 Å²	72	146.3 Å²	146.3	50%	0.503	73%	0.732	S	S	.	*	S	Bend	trans	-100.8	1.3	-178.6	64.2	0	0	0	0	115.7	S537 R542	S537-S540 PolarHBondContact O-N 3.46Å; S537-S540 PolarHBondContact O-OG 3.49Å; S537-S540 VanDerWaalsContact O-OG 3.07Å; S537-S540 PolarHBondContact OG-OG 3.38Å; S540-R542 VanDerWaalsContact C-N 3.28Å; S540-R542 PolarHBondContact O-N 2.8Å
541	L	25	Very low	26.1	Very low	152 Å²	152	147.7 Å²	147.7	80%	0.796	75%	0.751	S	S	*	*	S	Bend	trans	-85	8.1	173.2	-82.3	164.5	0	0	0	114.3
542	R	25.9	Very low	25.8	Very low	227 Å²	227	149.6 Å²	149.6	86%	0.857	76%	0.76	S	S	*	*	S	Bend	trans	-121.1	96.7	165.9	-87.1	-179.5	172.5	162.7	-2.6	109	S540	S540-R542 VanDerWaalsContact C-N 3.28Å; S540-R542 PolarHBondContact O-N 2.8Å
543	S	26.8	Very low	25.2	Very low	114 Å²	114	149.4 Å²	149.4	80%	0.797	77%	0.769	S	S	*	*	S	Bend	trans	128.7	55.5	158.1	70.4	0	0	0	0	116.2
544	R	24.6	Very low	24.8	Very low	237 Å²	237	145.7 Å²	145.7	89%	0.894	77%	0.769	S	S	*	*			trans	-159.4	62.9	152.2	-135.7	167.4	164.4	169	-6.1	115.4
545	E	28	Very low	24.6	Very low	201 Å²	201	140.3 Å²	140.3	94%	0.939	77%	0.766	S	S	*	*			trans	-92.4	77.4	151.3	-93.6	175.8	154.4	0	0	108.3
546	Q	24.8	Very low	24.4	Very low	154 Å²	154	143 Å²	143	72%	0.72	78%	0.781	S	S	*	*			trans	-163.6	123.9	152.9	-111.4	179.5	13.4	0	0	110.9
547	R	24.1	Very low	24.2	Very low	221 Å²	221	142.1 Å²	142.1	83%	0.834	79%	0.788	S	S	*	*			trans	88.9	96.2	164.4	-55.7	-175.1	-161.8	-173.7	4.9	118.1
548	N	22.7	Very low	24	Very low	149 Å²	149	143.4 Å²	143.4	80%	0.797	80%	0.803	S	S	*	*				41.2	113.9	108.9	-72	2.1	0	0	0	118.8
549	S	22	Very low	23.8	Very low	110 Å²	110	141.8 Å²	141.8	77%	0.769	80%	0.8	S	S	*	*			trans	50.9	105.1	131.6	60.9	0	0	0	0	118.8
550	S	23.1	Very low	23.4	Very low	111 Å²	111	140.6 Å²	140.6	78%	0.776	80%	0.804	S	S	*	*			trans	-168.5	120	131.6	47.4	0	0	0	0	111	S552	S550-S552 PolarHBondContact O-N 3.15Å
551	N	21.8	Very low	23.3	Very low	175 Å²	175	142 Å²	142	94%	0.936	81%	0.813	S	S	*	*			trans	-49	127.1	161.7	-78	-27.5	0	0	0	110.5
552	S	22.4	Very low	23.3	Very low	103 Å²	103	139.2 Å²	139.2	72%	0.72	81%	0.813	S	S	*	*			trans	-137.8	107.6	155	48.9	0	0	0	0	109.2	S550	S550-S552 PolarHBondContact O-N 3.15Å
553	S	19.9	Very low	23.1	Very low	119 Å²	119	135.1 Å²	135.1	83%	0.832	81%	0.808	S	S	*	*			trans	-60.6	125.8	158.5	48.8	0	0	0	0	108.9
554	V	23.2	Very low	22.9	Very low	133 Å²	133	135.7 Å²	135.7	81%	0.806	81%	0.807	S	S	*	*			trans	-125.5	115.3	164.8	-177.6	0	0	0	0	108.8
555	S	21.3	Very low	22.8	Very low	107 Å²	107	130.5 Å²	130.5	75%	0.748	80%	0.801	S	S	*	*			trans	-66.9	148.9	178.1	37.7	0	0	0	0	113	G557	S555-G557 PolarHBondContact O-N 3.44Å
556	N	21.6	Very low	22.5	Very low	177 Å²	177	127.1 Å²	127.1	95%	0.947	79%	0.794	S	S	*	*			trans	-50.7	113.5	169.9	-67.8	-35.8	0	0	0	111.3
557	G	21.4	Very low	22.4	Very low	73 Å²	73	126.7 Å²	126.7	75%	0.753	80%	0.796	S	S	*	*			trans	-137.4	130	174.3	0	0	0	0	0	109.6	S555	S555-G557 PolarHBondContact O-N 3.44Å
558	A	22.2	Very low	22.4	Very low	94 Å²	94	121.5 Å²	121.5	78%	0.777	79%	0.793	S	S	*	*			trans	-69	149.5	-171.1	0	0	0	0	0	114
559	V	23.9	Very low	22.6	Very low	147 Å²	147	121.5 Å²	121.5	89%	0.891	79%	0.793	S	S	*	*	S	Bend	trans	50.7	113.4	141	-175.5	0	0	0	0	118.3
560	G	22.3	Very low	22.8	Very low	77 Å²	77	121.2 Å²	121.2	79%	0.794	80%	0.797	S	S	*	*			trans	95.6	83.8	142.3	0	0	0	0	0	117.5
561	S	22.8	Very low	23.1	Very low	100 Å²	100	120.7 Å²	120.7	70%	0.699	79%	0.794	S	S	*	*			trans	-156.5	129.2	141.4	64.6	0	0	0	0	109.8	D563	S561-D563 PolarHBondContact O-N 2.95Å
562	A	23.9	Very low	23.4	Very low	95 Å²	95	118.6 Å²	118.6	79%	0.785	79%	0.787	S	S	*	*			trans	-81.9	101.4	175.6	0	0	0	0	0	108.6	T564	A562-T564 PolarHBondContact O-N 2.94Å
563	D	22.7	Very low	23.4	Very low	140 Å²	140	118.4 Å²	118.4	75%	0.749	79%	0.792	S	S	*	*			trans	-89	101.3	169.7	-72.4	-22	0	0	0	109	S561 V565	S561-D563 PolarHBondContact O-N 2.95Å; D563-V565 PolarHBondContact O-N 3.34Å
564	T	22.8	Very low	23.7	Very low	127 Å²	127	118.2 Å²	118.2	78%	0.779	79%	0.786	S	S	*	*			trans	-69.7	114.5	172.2	47.9	0	0	0	0	110	A562	A562-T564 PolarHBondContact O-N 2.94Å
565	V	21.2	Very low	23.7	Very low	128 Å²	128	117.8 Å²	117.8	78%	0.776	78%	0.783	S	S	*	*			trans	-103.7	106.4	166.2	-179.9	0	0	0	0	108.2	D563 I567	D563-V565 PolarHBondContact O-N 3.34Å; V565-I567 HydrophobicContact CG1-CG1 4.48Å; V565-I567 PolarHBondContact O-N 3.45Å
566	T	21.7	Very low	23.8	Very low	129 Å²	129	119.8 Å²	119.8	79%	0.791	79%	0.785	S	S	*	*			trans	-74.3	115.2	172.4	49.5	0	0	0	0	109.5
567	I	23.7	Very low	23.8	Very low	146 Å²	146	119.6 Å²	119.6	75%	0.749	78%	0.778	S	S	*	*			trans	-106.2	108.1	160	-58	176.7	0	0	0	105.9	V565 D569	V565-I567 HydrophobicContact CG1-CG1 4.48Å; V565-I567 PolarHBondContact O-N 3.45Å; I567-D569 PolarHBondContact O-N 3.31Å
568	S	22.9	Very low	24	Very low	111 Å²	111	122.3 Å²	122.3	78%	0.776	78%	0.781	S	S	*	*			trans	-72	101.1	168.6	46.1	0	0	0	0	108.5
569	D	27.5	Very low	24	Very low	150 Å²	150	123.7 Å²	123.7	80%	0.802	78%	0.779	S	S	*	*			trans	-142.7	126.4	143.6	-88.6	-33.7	0	0	0	107	I567 S571	I567-D569 PolarHBondContact O-N 3.31Å; D569-S571 PolarHBondContact O-N 2.02Å
570	A	27.7	Very low	23.9	Very low	103 Å²	103	120.1 Å²	120.1	85%	0.851	77%	0.772	S	S	*	*	S	Bend	trans	-63.6	101.6	-169.6	0	0	0	0	0	111.5
571	S	27.5	Very low	24	Very low	101 Å²	101	122 Å²	122	71%	0.706	77%	0.773	S	S	*	*	S	Bend	trans	152.1	131	142.2	53.6	0	0	0	0	109.1	D569	D569-S571 PolarHBondContact O-N 2.02Å
572	T	28.4	Very low	24	Very low	131 Å²	131	120.5 Å²	120.5	80%	0.804	77%	0.774	S	S	*	*			trans	79.6	74.4	-179.2	74.7	0	0	0	0	116.3	V574	T572-V574 PolarHBondContact O-N 3.33Å
573	A	23.8	Very low	23.9	Very low	99 Å²	99	126.9 Å²	126.9	82%	0.818	78%	0.779	S	S	*	*			trans	-74.3	108.1	156.8	0	0	0	0	0	108.8
574	V	24.4	Very low	23.9	Very low	115 Å²	115	125.4 Å²	125.4	70%	0.697	78%	0.78	S	S	*	*			trans	-94.2	102.2	171.8	-179.2	0	0	0	0	108	T572 L576	T572-V574 PolarHBondContact O-N 3.33Å; V574-L576 HydrophobicContact CG1-CD1 3.87Å; V574-L576 HydrophobicContact CG1-CG 4.43Å
575	T	23.4	Very low	23.9	Very low	124 Å²	124	126.9 Å²	126.9	76%	0.761	78%	0.782	S	S	*	*			trans	-86.4	107.2	171.5	51.2	0	0	0	0	109.1
576	L	23.2	Very low	24.2	Very low	148 Å²	148	126.7 Å²	126.7	78%	0.775	78%	0.782	S	S	*	*			trans	-89.3	97.6	167.7	-79.8	116.4	0	0	0	109.1	V574 T578	V574-L576 HydrophobicContact CG1-CD1 3.87Å; V574-L576 HydrophobicContact CG1-CG 4.43Å; L576-T578 PolarHBondContact O-N 3.42Å
577	E	21.8	Very low	24.5	Very low	174 Å²	174	126.8 Å²	126.8	81%	0.813	79%	0.788	S	S	*	*			trans	-79.4	101.6	165.7	-72	-168.1	163.4	0	0	109.4	V579	E577-V579 PolarHBondContact O-N 2.81Å
578	T	25.3	Very low	24.7	Very low	130 Å²	130	124.2 Å²	124.2	80%	0.798	78%	0.783	S	S	*	*			trans	-81.7	91	166.3	51.6	0	0	0	0	108.9	L576 G580	L576-T578 PolarHBondContact O-N 3.42Å; T578-G580 PolarHBondContact O-N 2.78Å
579	V	22.3	Very low	24.8	Very low	122 Å²	122	127.8 Å²	127.8	74%	0.739	79%	0.793	S	S	*	*			trans	-77.8	107.2	166.9	-172.4	0	0	0	0	107.6	E577 S581	E577-V579 PolarHBondContact O-N 2.81Å; V579-S581 PolarHBondContact O-N 3.45Å
580	G	22.3	Very low	24.6	Very low	73 Å²	73	130.6 Å²	130.6	75%	0.753	79%	0.793	S	S	*	*			trans	-64	115.2	174.4	0	0	0	0	0	110.4	T578 G582	T578-G580 PolarHBondContact O-N 2.78Å; G580-G582 PolarHBondContact O-N 2.85Å
581	S	24.2	Very low	24.4	Very low	116 Å²	116	131.7 Å²	131.7	81%	0.811	79%	0.791	S	S	*	*			trans	-75.9	105.9	170.6	42.2	0	0	0	0	109.6	V579	V579-S581 PolarHBondContact O-N 3.45Å
582	G	22.6	Very low	24.1	Very low	69 Å²	69	135.7 Å²	135.7	71%	0.711	80%	0.798	S	S	*	*			trans	-63.3	139.7	167.5	0	0	0	0	0	111.2	G580 S584	G580-G582 PolarHBondContact O-N 2.85Å; G582-S584 PolarHBondContact O-N 2.85Å
583	Y	22.7	Very low	23.9	Very low	229 Å²	229	134.3 Å²	134.3	90%	0.898	80%	0.801	S	S	*	*			trans	-60.3	110.9	175.3	-78.2	-97	0	0	0	111
584	S	22.7	Very low	23.8	Very low	109 Å²	109	132.9 Å²	132.9	76%	0.762	80%	0.795	S	S	*	*			trans	-99.5	107.2	160.6	59.5	0	0	0	0	109.7	G582 T586	G582-S584 PolarHBondContact O-N 2.85Å; S584-T586 PolarHBondContact O-N 3.11Å
585	N	23.5	Very low	23.8	Very low	157 Å²	157	132.4 Å²	132.4	84%	0.84	80%	0.797	S	S	*	*			trans	-59.3	104.7	170.5	-81.7	-29.8	0	0	0	111.1
586	T	25.7	Very low	23.8	Very low	124 Å²	124	134.6 Å²	134.6	76%	0.761	80%	0.803	S	S	*	*			trans	-144.9	121.8	151.1	46.5	0	0	0	0	110.2	S584 S588	S584-T586 PolarHBondContact O-N 3.11Å; T586-S588 PolarHBondContact O-N 3.27Å
587	S	28.2	Very low	23.8	Very low	131 Å²	131	133.6 Å²	133.6	92%	0.916	81%	0.807	S	S	*	*			trans	-57.2	94	174.9	52.7	0	0	0	0	112
588	S	28.6	Very low	23.8	Very low	93 Å²	93	129.6 Å²	129.6	65%	0.65	80%	0.798	S	S	*	*			trans	-147.1	114.9	151.3	78.3	0	0	0	0	108.7	T586 R590	T586-S588 PolarHBondContact O-N 3.27Å; S588-R590 PolarHBondContact O-N 3.45Å
589	N	25.6	Very low	23.6	Very low	185 Å²	185	130.2 Å²	130.2	99%	0.989	80%	0.802	S	S	*	*			trans	-72.1	69.3	176.9	-82	-28.5	0	0	0	110.3
590	R	21.8	Very low	23.6	Very low	210 Å²	210	129.3 Å²	129.3	79%	0.792	80%	0.797	S	S	*	*			trans	-138.7	115.6	161.5	-160.3	170.7	-168.3	156.3	2.9	108.6	S588 Q592	S588-R590 PolarHBondContact O-N 3.45Å; R590-Q592 PolarHBondContact O-N 3.03Å
591	P	23.8	Very low	23.6	Very low	125 Å²	125	131 Å²	131	81%	0.812	80%	0.797	S	S	*	*			trans	-63.8	107.1	171.4	26	-29.8	0	0	0	107.3	A593	P591-A593 PolarHBondContact O-N 2.76Å
592	Q	21.3	Very low	23.5	Very low	185 Å²	185	131 Å²	131	86%	0.864	79%	0.792	S	S	*	*			trans	-67.6	119.2	159.7	-76.6	-176.1	-21	0	0	105.9	R590 G594	R590-Q592 PolarHBondContact O-N 3.03Å; Q592-G594 VanDerWaalsContact C-N 3.25Å; Q592-G594 PolarHBondContact O-N 3.11Å
593	A	23.7	Very low	23.6	Very low	103 Å²	103	133.1 Å²	133.1	85%	0.851	79%	0.793	S	S	*	*			trans	-60.2	94.7	169.1	0	0	0	0	0	107.6	P591 S595	P591-A593 PolarHBondContact O-N 2.76Å; A593-S595 PolarHBondContact O-N 2.74Å
594	G	23.1	Very low	23.7	Very low	69 Å²	69	132.2 Å²	132.2	71%	0.711	79%	0.794	S	S	*	*			trans	-61.4	105.3	167.6	0	0	0	0	0	107.9	Q592 L596	Q592-G594 VanDerWaalsContact C-N 3.25Å; Q592-G594 PolarHBondContact O-N 3.11Å; G594-L596 PolarHBondContact O-N 2.98Å; G594-L596 VanDerWaalsContact O-N 3.16Å
595	S	23.2	Very low	23.7	Very low	105 Å²	105	132.5 Å²	132.5	73%	0.734	80%	0.796	S	S	*	*			trans	10.1	93.8	149.7	169.6	0	0	0	0	114.3	A593 C597	A593-S595 PolarHBondContact O-N 2.74Å; S595-C597 PolarHBondContact O-N 2.78Å
596	L	25	Very low	23.5	Very low	169 Å²	169	128.4 Å²	128.4	89%	0.885	79%	0.791	S	S	*	*			trans	-54.1	131.2	162.4	-79.5	150.4	0	0	0	109	G594 S598	G594-L596 PolarHBondContact O-N 2.98Å; G594-L596 VanDerWaalsContact O-N 3.16Å; L596-S598 PolarHBondContact O-N 2.85Å; L596-S598 VanDerWaalsContact O-N 3.14Å
597	C	23	Very low	23.5	Very low	127 Å²	127	128.3 Å²	128.3	86%	0.858	80%	0.796	S	S	*	*			trans	-39.2	113.9	-179.9	-53.6	0	0	0	0	112.7	S595	S595-C597 PolarHBondContact O-N 2.78Å
598	S	20.5	Very low	23.1	Very low	90 Å²	90	127.1 Å²	127.1	63%	0.629	79%	0.787	S	S	*	*			trans	-94.8	111.5	158.2	52.9	0	0	0	0	108.5	L596 T600	L596-S598 PolarHBondContact O-N 2.85Å; L596-S598 VanDerWaalsContact O-N 3.14Å; S598-T600 PolarHBondContact O-N 3.2Å; S598-T600 PolarHBondContact O-OG1 2.86Å
599	V	22.1	Very low	22.7	Very low	144 Å²	144	128.8 Å²	128.8	87%	0.873	79%	0.793	S	S	*	*			trans	-66.5	102.4	165.1	178.7	0	0	0	0	106.1
600	T	21.7	Very low	22.5	Very low	102 Å²	102	126 Å²	126	63%	0.626	78%	0.783	S	S	*	*			trans	-107.7	101.1	177.7	-21.9	0	0	0	0	107.4	S598 T602	S598-T600 PolarHBondContact O-N 3.2Å; S598-T600 PolarHBondContact O-OG1 2.86Å; T600-T602 HydrophobicContact CG2-CG2 4.43Å; T600-T602 PolarHBondContact O-N 3.1Å
601	S	22.4	Very low	22.4	Very low	108 Å²	108	119.7 Å²	119.7	76%	0.755	78%	0.784	S	S	*	*			trans	-72.9	99.5	164.5	54.6	0	0	0	0	107.5	P603	S601-P603 VanDerWaalsContact O-CD 3.32Å; S601-P603 WeakPolarHBondContact O-CD 2.98Å
602	T	22.9	Very low	22.4	Very low	116 Å²	116	120.3 Å²	120.3	71%	0.712	79%	0.785	S	S	*	*			trans	-91.6	114.6	170	46.1	0	0	0	0	109.2	T600 F604	T600-T602 HydrophobicContact CG2-CG2 4.43Å; T600-T602 PolarHBondContact O-N 3.1Å; T602-F604 PolarHBondContact O-N 3.38Å
603	P	25.1	Very low	22.5	Very low	114 Å²	114	116.3 Å²	116.3	74%	0.74	78%	0.775	S	S	*	*			trans	-72.1	123.6	165	27.9	-29.1	0	0	0	108.1	S601 S605	S601-P603 VanDerWaalsContact O-CD 3.32Å; S601-P603 WeakPolarHBondContact O-CD 2.98Å; P603-S605 PolarHBondContact O-N 3.11Å
604	F	23.9	Very low	22.3	Very low	210 Å²	210	117.6 Å²	117.6	92%	0.921	77%	0.766	S	S	*	*			trans	-57.7	112.7	170.4	-112.2	-90.1	0	0	0	109	T602	T602-F604 PolarHBondContact O-N 3.38Å
605	S	22.1	Very low	22.3	Very low	115 Å²	115	121.1 Å²	121.1	80%	0.804	77%	0.773	S	S	*	*			trans	-90	121.7	167.7	42.6	0	0	0	0	109.2	P603	P603-S605 PolarHBondContact O-N 3.11Å
606	G	20.9	Very low	22.2	Very low	71 Å²	71	120.9 Å²	120.9	73%	0.732	77%	0.768	S	S	*	*			trans	100.6	91.8	160	0	0	0	0	0	116.1
607	S	23.8	Very low	22.4	Very low	123 Å²	123	118.2 Å²	118.2	86%	0.86	76%	0.763	S	S	*	*				-158.7	122	122.3	39.7	0	0	0	0	110
608	S	20.6	Very low	22.4	Very low	105 Å²	105	118.1 Å²	118.1	73%	0.734	75%	0.754	S	S	*	*			trans	-67.4	147.2	171.8	51.1	0	0	0	0	111.7
609	V	19.8	Very low	22.7	Very low	128 Å²	128	121.3 Å²	121.3	78%	0.776	76%	0.764	S	S	*	*			trans	71	109.7	146.6	-178.8	0	0	0	0	116.3
610	T	22.9	Very low	22.6	Very low	127 Å²	127	121.7 Å²	121.7	78%	0.779	76%	0.759	S	S	*	*				-174.7	124.8	103.8	30.7	0	0	0	0	108.5
611	G	19.3	Very low	22.9	Very low	78 Å²	78	122.8 Å²	122.8	80%	0.804	77%	0.767	S	S	*	*			trans	-72.7	143.8	166	0	0	0	0	0	110.7
612	V	23.6	Very low	22.8	Very low	137 Å²	137	123.2 Å²	123.2	83%	0.83	76%	0.761	S	S	*	*			trans	-143.7	141.2	158.6	176.8	0	0	0	0	106.5
613	P	22.8	Very low	23.1	Very low	101 Å²	101	122.7 Å²	122.7	66%	0.656	77%	0.769	S	S	*	*			trans	-110.8	172.2	-137.1	42.4	-35.7	0	0	0	114.6
614	I	19.2	Very low	23	Very low	131 Å²	131	123.3 Å²	123.3	67%	0.672	77%	0.765	S	S	*	*			trans	50.1	111.9	145.1	-58.7	154	0	0	0	117.3
615	V	23.7	Very low	23.2	Very low	142 Å²	142	123.3 Å²	123.3	86%	0.861	77%	0.766	S	S	*	*				-131.5	98.8	123.7	-179	0	0	0	0	107.3
616	T	21.3	Very low	23.3	Very low	101 Å²	101	126.4 Å²	126.4	62%	0.62	77%	0.767	S	S	*	*			trans	-73.9	117.2	161.4	42	0	0	0	0	107.5
617	S	28.9	Very low	23.5	Very low	113 Å²	113	128 Å²	128	79%	0.79	77%	0.768	S	S	*	*			trans	-102.3	99.9	157.7	58.6	0	0	0	0	107.5
618	D	22.8	Very low	23.9	Very low	125 Å²	125	128.1 Å²	128.1	67%	0.668	77%	0.765	S	S	*	*			trans	-53.5	132.6	164.9	-58.2	-58.6	0	0	0	110.6
619	N	26.8	Very low	24.6	Very low	157 Å²	157	128.5 Å²	128.5	84%	0.84	77%	0.765	S	S	*	*				164.1	115.2	116.2	-84.3	-34.5	0	0	0	111.6
620	M	20.9	Very low	25	Very low	152 Å²	152	133.8 Å²	133.8	75%	0.749	77%	0.773	S	S	*	*			trans	-14.3	155.5	137.1	-89.5	171.8	174	0	0	116.7
621	P	26.6	Very low	25.1	Very low	125 Å²	125	131.1 Å²	131.1	81%	0.812	77%	0.771	S	S	*	*			cis	-138.8	153.5	44.4	32.1	-10.6	0	0	0	118.4
622	N	21.4	Very low	25.5	Very low	117 Å²	117	133.6 Å²	133.6	63%	0.626	77%	0.77	S	S	*	*			trans	-40.2	137.5	160.5	-66.2	-21.1	0	0	0	113.7
623	A	29.4	Very low	25.4	Very low	105 Å²	105	138 Å²	138	87%	0.868	77%	0.772	S	S	*	*			trans	-122.4	98.2	144.7	0	0	0	0	0	107.1
624	D	22.3	Very low	25.8	Very low	126 Å²	126	139.8 Å²	139.8	67%	0.674	78%	0.78	S	S	*	*			trans	-56.9	128.8	164	-74.1	-58.4	0	0	0	110
625	F	27.8	Very low	26	Very low	211 Å²	211	139.6 Å²	139.6	93%	0.925	78%	0.78	S	S	*	*			trans	-136.5	124.1	142.9	-110.9	-83.2	0	0	0	109.7
626	Q	25.2	Very low	26	Very low	179 Å²	179	141.4 Å²	141.4	84%	0.836	78%	0.779	S	S	*	*			trans	-69.5	157.7	-171	-73.3	157.3	-37.5	0	0	113.4
627	S	23.9	Very low	26.4	Very low	106 Å²	106	142.5 Å²	142.5	74%	0.741	79%	0.791	S	S	*	*			trans	-63.1	172.7	171.5	56.7	0	0	0	0	113.7
628	P	33.7	Very low	26.2	Very low	125 Å²	125	143.5 Å²	143.5	81%	0.812	79%	0.793	S	S	*	*				-140.6	175	80	30.3	-8.7	0	0	0	114.9
629	P	35.1	Very low	26.4	Very low	112 Å²	112	144.8 Å²	144.8	73%	0.727	80%	0.799	S	S	*	*			trans	-114.2	159.9	-152.2	39.5	-28.5	0	0	0	114.7
630	Y	26.7	Very low	26.6	Very low	240 Å²	240	142.3 Å²	142.3	94%	0.941	79%	0.794	S	S	*	*			trans	-112.7	100.5	151.1	-92.9	-84.7	0	0	0	108.4
631	G	26.3	Very low	26.8	Very low	71 Å²	71	141 Å²	141	73%	0.732	80%	0.795	S	S	*	*			trans	-99.2	117.6	166.4	0	0	0	0	0	109.3
632	V	26.4	Very low	27.1	Very low	130 Å²	130	142.2 Å²	142.2	79%	0.788	80%	0.795	S	S	*	*			trans	-101.3	106.8	160.2	176.8	0	0	0	0	106.3
633	R	22.9	Very low	27.3	Very low	230 Å²	230	145.6 Å²	145.6	87%	0.868	80%	0.804	S	S	*	*			trans	-67.4	131.8	165.5	-88.8	177.3	169.1	150.1	-4	108.4
634	V	29.4	Very low	27.2	Very low	138 Å²	138	149.1 Å²	149.1	84%	0.836	80%	0.802	S	S	*	*			trans	-116.1	130.2	152.7	177.1	0	0	0	0	106.3
635	D	25.2	Very low	28.1	Very low	126 Å²	126	154.3 Å²	154.3	67%	0.674	83%	0.83	S	S	*	*			trans	-69.9	144.6	-166.1	-74.4	-53	0	0	0	114.8
636	Q	23.2	Very low	28.1	Very low	180 Å²	180	151.5 Å²	151.5	84%	0.841	83%	0.825	S	S	*	*			trans	23.1	117.2	134.6	-57.8	-179.3	-9.4	0	0	118.5
637	S	29	Very low	28.3	Very low	124 Å²	124	150.1 Å²	150.1	87%	0.867	83%	0.825	S	S	*	*				-157.5	117.2	116	49.5	0	0	0	0	110.4
638	V	24.5	Very low	28.5	Very low	135 Å²	135	152.5 Å²	152.5	82%	0.818	83%	0.829	S	S	*	*			trans	-94.6	123.6	161.9	170.6	0	0	0	0	105.4
639	D	28.7	Very low	28.2	Very low	151 Å²	151	154.1 Å²	154.1	81%	0.807	83%	0.83	S	S	*	*			trans	161.9	136.6	151.7	-89.2	-17.8	0	0	0	106.1
640	S	30.3	Very low	27.8	Very low	105 Å²	105	156.8 Å²	156.8	73%	0.734	84%	0.837	S	S	*	*			cis	-168	153.3	2	34.3	0	0	0	0	106.1
641	T	25.9	Very low	27.8	Very low	124 Å²	124	151.2 Å²	151.2	76%	0.761	83%	0.83	S	S	*	*			trans	-60.2	136.5	171.2	42.4	0	0	0	0	113
642	N	31.6	Very low	27.9	Very low	151 Å²	151	156.9 Å²	156.9	81%	0.807	84%	0.837	S	S	*	*			trans	167.1	114.1	136.3	-85.3	-18.5	0	0	0	107.5
643	K	25.5	Very low	28.1	Very low	189 Å²	189	159 Å²	159	82%	0.822	84%	0.841	S	S	*	*				50.8	127	75.6	-101.9	-171.6	-179.5	-177.9	0	115.2
644	Q	28.5	Very low	28.5	Very low	179 Å²	179	153.1 Å²	153.1	84%	0.836	84%	0.838	S	S	*	*			trans	81.7	123.3	172.1	-66	163.4	-57.6	0	0	114.1
645	D	40.2	Very low	28.4	Very low	235 Å²	235	154.5 Å²	154.5	100%	1.257	84%	0.839	S	S	*	*			cis	-130.5	0	20.6	-78.1	-44.8	0	0	0	113.5

Retrieved 645 of 645 residues in 218.1 ms (Link to these results)

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