A0A077ZA48_TRITR Loading...

Arrestin C and Arrestin N domain containing prote in

AlphaFold DB , UniProt , Accession A0A077ZA48, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 611 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	39.4	Very low	39.8	Very low	206 Å²	206	117.7 Å²	117.7	100%	1.015	65%	0.654	S	S	*	*				0	-59.5	0	-80.9	-104.9	-166	0	0	111.9	V3 V4 K5	M1-V3 VanDerWaalsContact C-N 3.34Å; M1-V3 PolarHBondContact O-N 3.12Å; M1-V4 PolarHBondContact O-N 3.37Å; M1-V4 VanDerWaalsContact O-N 3.15Å; M1-K5 PolarHBondContact O-N 3.38Å; M1-K5 VanDerWaalsContact O-N 3.09Å
2	S	39.7	Very low	39.2	Very low	88 Å²	88	112.4 Å²	112.4	62%	0.615	64%	0.637	S	S	*	*	H	α-helix	trans	-51.4	-47.7	176.8	-171.2	0	0	0	0	113.7	V4 K5 E6	S2-V4 PolarHBondContact O-N 3.48Å; S2-K5 VanDerWaalsContact O-CB 3.27Å; S2-K5 WeakPolarHBondContact O-CB 3.41Å; S2-K5 PolarHBondContact O-N 3.2Å; S2-K5 VanDerWaalsContact O-N 3.1Å; S2-E6 PolarHBondContact O-N 3.02Å; S2-E6 VanDerWaalsContact O-N 3.1Å
3	V	41.9	Very low	39.1	Very low	111 Å²	111	109.2 Å²	109.2	67%	0.673	63%	0.625	S	S	*	*	H	α-helix	trans	-62.8	-38.6	179.8	-178.5	0	0	0	0	112.7	M1 K5 E6 A7	M1-V3 VanDerWaalsContact C-N 3.34Å; M1-V3 PolarHBondContact O-N 3.12Å; V3-K5 VanDerWaalsContact C-N 3.28Å; V3-K5 PolarHBondContact O-N 3.13Å; V3-E6 PolarHBondContact O-N 3.43Å; V3-A7 PolarHBondContact O-N 3.12Å
4	V	37.6	Very low	39.3	Very low	78 Å²	78	112.5 Å²	112.5	47%	0.473	63%	0.633	S	S	.	*	H	α-helix	trans	-66.5	-35.5	176.5	-178.8	0	0	0	0	110.3	M1 S2 A7 V8	M1-V4 PolarHBondContact O-N 3.37Å; M1-V4 VanDerWaalsContact O-N 3.15Å; S2-V4 PolarHBondContact O-N 3.48Å; V4-A7 PolarHBondContact O-N 3.45Å; V4-V8 WeakPolarHBondContact O-CG2 3.28Å; V4-V8 PolarHBondContact O-N 2.88Å; V4-V8 VanDerWaalsContact O-N 3.12Å
5	K	36.8	Very low	39.2	Very low	159 Å²	159	120.3 Å²	120.3	69%	0.691	65%	0.648	S	S	*	*	H	α-helix	trans	-65.6	-44.2	177.4	-156.3	-178.7	-177.3	-175.6	0	111.6	M1 S2 V3 V9	M1-K5 PolarHBondContact O-N 3.38Å; M1-K5 VanDerWaalsContact O-N 3.09Å; S2-K5 VanDerWaalsContact O-CB 3.27Å; S2-K5 WeakPolarHBondContact O-CB 3.41Å; S2-K5 PolarHBondContact O-N 3.2Å; S2-K5 VanDerWaalsContact O-N 3.1Å; V3-K5 VanDerWaalsContact C-N 3.28Å; V3-K5 PolarHBondContact O-N 3.13Å; K5-V9 VanDerWaalsContact O-CG2 3.22Å; K5-V9 WeakPolarHBondContact O-CG2 3.29Å; K5-V9 PolarHBondContact O-N 2.87Å; K5-V9 VanDerWaalsContact O-N 3.14Å
6	E	41.7	Very low	39.2	Very low	137 Å²	137	118.8 Å²	118.8	64%	0.64	64%	0.64	S	S	*	*	H	α-helix	trans	-65.4	-42.1	175.9	-80.1	178.8	156.6	0	0	112.4	S2 V3 V8 V9 S10	S2-E6 PolarHBondContact O-N 3.02Å; S2-E6 VanDerWaalsContact O-N 3.1Å; V3-E6 PolarHBondContact O-N 3.43Å; E6-V8 PolarHBondContact O-N 3.22Å; E6-V9 PolarHBondContact O-N 3.34Å; E6-S10 WeakPolarHBondContact O-CB 3.32Å; E6-S10 PolarHBondContact O-N 2.82Å
7	A	39	Very low	39.1	Very low	56 Å²	56	120.6 Å²	120.6	46%	0.463	64%	0.641	S	S	.	*	H	α-helix	trans	-60	-46.9	178.9	0	0	0	0	0	111.9	V3 V4 V9 S10 H11	V3-A7 PolarHBondContact O-N 3.12Å; V4-A7 PolarHBondContact O-N 3.45Å; A7-V9 PolarHBondContact O-N 3.5Å; A7-S10 PolarHBondContact O-N 2.91Å; A7-S10 PolarHBondContact O-OG 2.73Å; A7-H11 PolarHBondContact O-N 2.95Å
8	V	38.1	Very low	39	Very low	102 Å²	102	124.1 Å²	124.1	62%	0.618	65%	0.652	S	S	*	*	H	α-helix	trans	-65.8	-39.5	178.9	174.3	0	0	0	0	111.7	V4 E6 H11 A12	V4-V8 WeakPolarHBondContact O-CG2 3.28Å; V4-V8 PolarHBondContact O-N 2.88Å; V4-V8 VanDerWaalsContact O-N 3.12Å; E6-V8 PolarHBondContact O-N 3.22Å; V8-H11 PolarHBondContact O-N 3.2Å; V8-A12 PolarHBondContact O-N 3.24Å
9	V	44.1	Very low	38.8	Very low	104 Å²	104	126.3 Å²	126.3	63%	0.63	66%	0.658	S	S	*	*	H	α-helix	trans	-68.7	-35.1	178.6	173.3	0	0	0	0	111.6	K5 E6 A7 H11 A12	K5-V9 VanDerWaalsContact O-CG2 3.22Å; K5-V9 WeakPolarHBondContact O-CG2 3.29Å; K5-V9 PolarHBondContact O-N 2.87Å; K5-V9 VanDerWaalsContact O-N 3.14Å; E6-V9 PolarHBondContact O-N 3.34Å; A7-V9 PolarHBondContact O-N 3.5Å; V9-H11 VanDerWaalsContact C-N 3.25Å; V9-H11 PolarHBondContact O-N 3.2Å; V9-A12 PolarHBondContact O-N 2.85Å
10	S	42.2	Very low	38.4	Very low	84 Å²	84	130.1 Å²	130.1	59%	0.587	67%	0.669	S	S	*	*	H	α-helix	trans	-69.4	-20.3	-179.5	74.1	0	0	0	0	114.3	E6 A7	E6-S10 WeakPolarHBondContact O-CB 3.32Å; E6-S10 PolarHBondContact O-N 2.82Å; A7-S10 PolarHBondContact O-N 2.91Å; A7-S10 PolarHBondContact O-OG 2.73Å
11	H	37.3	Very low	38.1	Very low	170 Å²	170	128.6 Å²	128.6	79%	0.787	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.7	0.1	-179.9	-77.3	29.8	0	0	0	113.3	A7 V8 V9 S13	A7-H11 PolarHBondContact O-N 2.95Å; V8-H11 PolarHBondContact O-N 3.2Å; V9-H11 VanDerWaalsContact C-N 3.25Å; V9-H11 PolarHBondContact O-N 3.2Å; H11-S13 PolarHBondContact O-N 3.18Å
12	A	32.6	Very low	37.9	Very low	54 Å²	54	122.8 Å²	122.8	45%	0.446	65%	0.653	S	S	.	*			trans	-76.8	119.1	175.7	0	0	0	0	0	109.8	V8 V9 D16	V8-A12 PolarHBondContact O-N 3.24Å; V9-A12 PolarHBondContact O-N 2.85Å; A12-D16 HydrophobicContact CB-CB 4.48Å
13	S	37.6	Very low	37.7	Very low	70 Å²	70	127.8 Å²	127.8	49%	0.49	66%	0.659	S	S	.	*			trans	-67	154.9	174.6	75.3	0	0	0	0	110.1	H11 R15 D16	H11-S13 PolarHBondContact O-N 3.18Å; S13-R15 PolarHBondContact O-N 3.42Å; S13-D16 PolarHBondContact N-OD2 3.47Å; S13-D16 PolarHBondContact O-N 2.91Å; S13-D16 PolarHBondContact OG-OD2 3.49Å; S13-D16 VanDerWaalsContact OG-OD2 3.1Å
14	E	42.7	Very low	37.1	Very low	156 Å²	156	130.1 Å²	130.1	73%	0.729	66%	0.662	S	S	*	*	G	3₁₀ helix	trans	-59.7	-15.8	-176.3	-79.1	-156.6	133.1	0	0	114.8	D16 K17	E14-D16 VanDerWaalsContact C-N 3.25Å; E14-D16 PolarHBondContact O-N 2.85Å; E14-K17 IonicContact OE1-NZ 3.25Å
15	R	37.3	Very low	36.8	Very low	230 Å²	230	131.5 Å²	131.5	87%	0.868	67%	0.671	S	S	*	*	G	3₁₀ helix	trans	-70.7	-19.1	173.7	-81.2	-174.5	176.5	-178.2	-0.6	113.7	S13 K17	S13-R15 PolarHBondContact O-N 3.42Å; R15-K17 PolarHBondContact O-N 3.07Å
16	D	38.9	Very low	36.4	Very low	96 Å²	96	129.9 Å²	129.9	51%	0.513	67%	0.674	S	S	.	*	G	3₁₀ helix	trans	-88.7	-0.1	-175.3	-57.5	-47.4	0	0	0	113.6	A12 S13 E14	A12-D16 HydrophobicContact CB-CB 4.48Å; S13-D16 PolarHBondContact N-OD2 3.47Å; S13-D16 PolarHBondContact O-N 2.91Å; S13-D16 PolarHBondContact OG-OD2 3.49Å; S13-D16 VanDerWaalsContact OG-OD2 3.1Å; E14-D16 VanDerWaalsContact C-N 3.25Å; E14-D16 PolarHBondContact O-N 2.85Å
17	K	37.3	Very low	35.7	Very low	150 Å²	150	131.6 Å²	131.6	65%	0.652	69%	0.687	S	S	*	*	G	3₁₀ helix	trans	-78.2	-14.7	-179.2	-73.2	-180	-177	166.4	0	114.3	E14 R15	E14-K17 IonicContact OE1-NZ 3.25Å; R15-K17 PolarHBondContact O-N 3.07Å
18	H	38.7	Very low	35	Very low	182 Å²	182	131.9 Å²	131.9	84%	0.843	70%	0.695	S	S	*	*	S	Bend	trans	-104.8	-8.1	-174.8	-77.8	-63.7	0	0	0	115.3
19	E	33.6	Very low	34.4	Very low	166 Å²	166	134.9 Å²	134.9	78%	0.776	70%	0.702	S	S	*	*	S	Bend	trans	-102.8	135.9	171.2	-74.3	-173.6	159.9	0	0	110.6
20	K	31.8	Very low	33.7	Very low	202 Å²	202	137.1 Å²	137.1	88%	0.878	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-52.5	138.7	-174	-77.8	176.5	176.4	176.1	0	110.7	A22	K20-A22 PolarHBondContact O-N 3Å
21	P	32.8	Very low	33	Very low	99 Å²	99	135.1 Å²	135.1	64%	0.643	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-58.9	125.7	-171.1	-22.9	32.8	0	0	0	112.8	W23	P21-W23 PolarHBondContact O-N 2.84Å
22	A	34.8	Very low	32.7	Very low	85 Å²	85	132.7 Å²	132.7	70%	0.702	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.6	36.8	-174.1	0	0	0	0	0	116	K20	K20-A22 PolarHBondContact O-N 3Å
23	W	35.5	Very low	32.7	Very low	192 Å²	192	135.9 Å²	135.9	73%	0.727	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.1	-6.1	174.6	63.6	-92.9	0	0	0	113.9	P21	P21-W23 PolarHBondContact O-N 2.84Å
24	E	29.1	Very low	32.3	Very low	160 Å²	160	135.1 Å²	135.1	75%	0.748	73%	0.732	S	S	*	*	G	3₁₀ helix	trans	-80.3	-15	175.3	-78.1	-174.2	159.8	0	0	114.1	V26	E24-V26 VanDerWaalsContact C-N 3.34Å; E24-V26 PolarHBondContact O-N 3.09Å
25	T	30.4	Very low	31.8	Very low	107 Å²	107	135.8 Å²	135.8	66%	0.656	74%	0.741	S	S	*	*	G	3₁₀ helix	trans	-83.5	-5.5	-176.8	-28.5	0	0	0	0	114	L27	T25-L27 PolarHBondContact O-N 2.48Å
26	V	30.2	Very low	31.6	Very low	125 Å²	125	135.5 Å²	135.5	76%	0.758	74%	0.742	S	S	*	*	G	3₁₀ helix	trans	-83.5	-6.1	-173.1	-178	0	0	0	0	113.7	E24	E24-V26 VanDerWaalsContact C-N 3.34Å; E24-V26 PolarHBondContact O-N 3.09Å
27	L	25.5	Very low	31.3	Very low	174 Å²	174	133.8 Å²	133.8	91%	0.911	74%	0.736	S	S	*	*	G	3₁₀ helix	trans	-111.5	6.3	179.5	-82.1	161.2	0	0	0	115.1	T25	T25-L27 PolarHBondContact O-N 2.48Å
28	G	24.7	Very low	31.1	Very low	62 Å²	62	131.8 Å²	131.8	64%	0.639	74%	0.738	S	S	*	*			trans	-119	27.4	-167.3	0	0	0	0	0	117
29	H	26.3	Very low	30.8	Very low	164 Å²	164	132 Å²	132	76%	0.759	74%	0.737	S	S	*	*			trans	-129.7	66.3	177.4	-112.6	-67.7	0	0	0	112.7
30	T	29.1	Very low	30.7	Very low	151 Å²	151	129.1 Å²	129.1	93%	0.926	73%	0.734	S	S	*	*			trans	-100.9	71.8	158.5	54.8	0	0	0	0	108.3
31	G	27.6	Very low	30.6	Very low	43 Å²	43	127.3 Å²	127.3	44%	0.443	73%	0.729	S	S	.	*	S	Bend	trans	-167.9	124.3	-179.4	0	0	0	0	0	110
32	S	31.1	Very low	30.4	Very low	118 Å²	118	128.6 Å²	128.6	83%	0.825	73%	0.734	S	S	*	*			trans	56.6	78.7	170.6	60.3	0	0	0	0	116.5	G34	S32-G34 PolarHBondContact O-N 3.25Å; S32-G34 VanDerWaalsContact O-N 3.15Å
33	C	32.1	Very low	30	Very low	121 Å²	121	132.5 Å²	132.5	82%	0.818	74%	0.743	S	S	*	*			trans	-70.7	99.8	150.9	40	0	0	0	0	108.2
34	G	30	Very low	29.6	Very low	55 Å²	55	132.3 Å²	132.3	57%	0.567	75%	0.75	S	S	*	*			trans	-65.3	163.2	161.2	0	0	0	0	0	110.6	S32 Y36	S32-G34 PolarHBondContact O-N 3.25Å; S32-G34 VanDerWaalsContact O-N 3.15Å; G34-Y36 PolarHBondContact O-N 2.77Å
35	D	32.1	Very low	29.5	Very low	170 Å²	170	128.1 Å²	128.1	91%	0.909	75%	0.75	S	S	*	*	S	Bend	trans	-58	18.2	-160.1	-62.2	-47.2	0	0	0	119
36	Y	31.8	Very low	29.4	Very low	224 Å²	224	129.2 Å²	129.2	88%	0.878	76%	0.756	S	S	*	*			trans	-125.3	49.3	-178.1	-84.9	-89.6	0	0	0	113.1	G34 P38	G34-Y36 PolarHBondContact O-N 2.77Å; Y36-P38 WeakPolarHBondContact O-CD 3.45Å
37	C	32.8	Very low	29.2	Very low	59 Å²	59	128.4 Å²	128.4	40%	0.399	75%	0.751	S	S	.	*			trans	-90.8	106	170	-174.9	0	0	0	0	110.6	F39 C40	C37-F39 PolarHBondContact O-N 3.06Å; C37-C40 PolarHBondContact O-N 3.39Å
38	P	33.5	Very low	29.2	Very low	108 Å²	108	126 Å²	126	70%	0.701	74%	0.744	S	S	*	*	G	3₁₀ helix	trans	-66.1	-9.1	-179.6	23.6	-32	0	0	0	114.2	Y36	Y36-P38 WeakPolarHBondContact O-CD 3.45Å
39	F	32.6	Very low	29.5	Very low	187 Å²	187	132.8 Å²	132.8	82%	0.82	76%	0.756	S	S	*	*	G	3₁₀ helix	trans	-77.9	-17.9	172.2	-89.6	-87	0	0	0	113.9	C37 H41	C37-F39 PolarHBondContact O-N 3.06Å; F39-H41 VanDerWaalsContact C-N 3.31Å; F39-H41 PolarHBondContact O-N 3.02Å
40	C	30.6	Very low	29.5	Very low	105 Å²	105	132 Å²	132	71%	0.709	76%	0.757	S	S	*	*	G	3₁₀ helix	trans	-81.8	-7.3	179.4	-66.1	0	0	0	0	113.6	C37	C37-C40 PolarHBondContact O-N 3.39Å
41	H	29.6	Very low	29.4	Very low	165 Å²	165	132.3 Å²	132.3	76%	0.764	75%	0.753	S	S	*	*	G	3₁₀ helix	trans	-99.7	9.9	-173.7	-114.8	-1.2	0	0	0	116.1	F39	F39-H41 VanDerWaalsContact C-N 3.31Å; F39-H41 PolarHBondContact O-N 3.02Å
42	V	29.3	Very low	29.4	Very low	125 Å²	125	135.7 Å²	135.7	76%	0.758	77%	0.768	S	S	*	*	S	Bend	trans	-94.8	8.8	-175.5	-175.9	0	0	0	0	113.7
43	L	26.4	Very low	29.3	Very low	168 Å²	168	136.1 Å²	136.1	88%	0.88	77%	0.765	S	S	*	*	S	Bend	trans	-122.8	10.8	-175.9	-77.4	172.4	0	0	0	117.3
44	E	28	Very low	29.2	Very low	188 Å²	188	139.4 Å²	139.4	88%	0.879	77%	0.769	S	S	*	*			trans	-114.8	87.8	170.7	-75.3	-174	169	0	0	111.1
45	G	26.3	Very low	28.9	Very low	72 Å²	72	140.6 Å²	140.6	74%	0.742	78%	0.781	S	S	*	*			trans	-132.9	67.8	170.8	0	0	0	0	0	110.3
46	V	28.5	Very low	28.9	Very low	129 Å²	129	139.9 Å²	139.9	78%	0.782	78%	0.777	S	S	*	*			trans	-149	112.7	166.7	-170.5	0	0	0	0	110.4
47	T	26.3	Very low	28.7	Very low	108 Å²	108	134.4 Å²	134.4	66%	0.663	77%	0.772	S	S	*	*			trans	68.6	95.4	151.7	61.4	0	0	0	0	120.9
48	T	25	Very low	28.7	Very low	124 Å²	124	137.1 Å²	137.1	76%	0.761	79%	0.786	S	S	*	*				9.3	115.7	121.2	55	0	0	0	0	117.6
49	F	30.4	Very low	28.3	Very low	205 Å²	205	141.6 Å²	141.6	90%	0.899	80%	0.795	S	S	*	*			trans	-141.4	115.8	142.9	-100.7	-82.4	0	0	0	109.2
50	D	26.4	Very low	28.2	Very low	146 Å²	146	143.8 Å²	143.8	78%	0.781	80%	0.798	S	S	*	*			trans	-61.1	133.3	173.9	-63.2	-61.6	0	0	0	111.6
51	N	27.8	Very low	28.1	Very low	158 Å²	158	148.5 Å²	148.5	85%	0.845	81%	0.806	S	S	*	*				-166.1	127.5	128.4	-109.6	-27.5	0	0	0	112
52	P	26.6	Very low	27.9	Very low	114 Å²	114	148.7 Å²	148.7	74%	0.74	81%	0.812	S	S	*	*			trans	-92.5	126.3	178.9	34.2	-28.1	0	0	0	110.8
53	T	30.1	Very low	28	Very low	127 Å²	127	148.2 Å²	148.2	78%	0.779	81%	0.814	S	S	*	*			trans	-134.8	115.4	163.8	36.1	0	0	0	0	111.2
54	E	28.8	Very low	28	Very low	190 Å²	190	147.6 Å²	147.6	89%	0.888	81%	0.812	S	S	*	*			trans	58.2	106.3	144	-72.9	174.4	150.4	0	0	118.9
55	G	25.2	Very low	28.2	Very low	80 Å²	80	147.7 Å²	147.7	83%	0.825	81%	0.812	S	S	*	*			trans	-72.9	136.7	160.2	0	0	0	0	0	110.9
56	D	30.8	Very low	28.3	Very low	156 Å²	156	153.6 Å²	153.6	83%	0.834	82%	0.82	S	S	*	*			trans	-125.3	106.2	162.3	-125.3	-13.2	0	0	0	109	V58	D56-V58 PolarHBondContact O-N 2.99Å
57	S	28.7	Very low	28.5	Very low	109 Å²	109	152.2 Å²	152.2	76%	0.762	82%	0.822	S	S	*	*			trans	-83.5	95.4	-178.1	54.5	0	0	0	0	110.1
58	V	31.5	Very low	28.7	Very low	116 Å²	116	153.3 Å²	153.3	70%	0.703	83%	0.834	S	S	*	*			trans	-100.2	88.9	169.1	-177	0	0	0	0	109.6	D56 R60	D56-V58 PolarHBondContact O-N 2.99Å; V58-R60 PolarHBondContact O-N 3.23Å
59	K	26.6	Very low	29.1	Very low	201 Å²	201	151.1 Å²	151.1	87%	0.874	84%	0.836	S	S	*	*			trans	-68.8	108.9	164.4	-72.6	177.2	176.1	175.5	0	108.8
60	R	28.5	Very low	29.4	Very low	234 Å²	234	143.6 Å²	143.6	88%	0.883	82%	0.817	S	S	*	*			trans	-111.9	139	161.9	-94.8	-176.1	-175.8	157.8	2.9	111.2	V58	V58-R60 PolarHBondContact O-N 3.23Å
61	K	28.9	Very low	30.3	Very low	203 Å²	203	142.7 Å²	142.7	88%	0.883	82%	0.816	S	S	*	*			trans	-68.4	144	-161.8	-72.4	171.4	169.3	177.1	0	113
62	L	25.9	Very low	31.3	Very low	170 Å²	170	142.1 Å²	142.1	89%	0.89	81%	0.813	S	S	*	*			trans	-52.6	130.9	158.7	-70.2	130.3	0	0	0	111.2
63	S	30.8	Very low	32.2	Very low	114 Å²	114	144.4 Å²	144.4	80%	0.797	81%	0.814	S	S	*	*			trans	-125.7	113.1	153.1	51.9	0	0	0	0	107.5	E65	S63-E65 PolarHBondContact O-N 3.49Å
64	N	26.6	Very low	32.8	Very low	156 Å²	156	146 Å²	146	83%	0.834	81%	0.813	S	S	*	*			trans	-57.8	117.2	169.5	-80.9	-18.1	0	0	0	110
65	E	32	Very low	33.8	Very low	190 Å²	190	140 Å²	140	89%	0.888	80%	0.795	S	S	*	*			trans	-136.2	140.8	148.2	-78.2	-168.4	153.4	0	0	109.9	S63	S63-E65 PolarHBondContact O-N 3.49Å
66	Q	28.7	Very low	34.9	Very low	196 Å²	196	138.3 Å²	138.3	92%	0.916	77%	0.773	S	S	*	*			trans	-68.2	129.4	-167.3	-63	154	-63.2	0	0	111.7
67	A	32.8	Very low	35.7	Very low	99 Å²	99	135.1 Å²	135.1	82%	0.818	76%	0.757	S	S	*	*			trans	-151.7	84.1	151.6	0	0	0	0	0	108.8	G69	A67-G69 PolarHBondContact O-N 3.13Å
68	S	31.6	Very low	36.7	Very low	131 Å²	131	132.6 Å²	132.6	92%	0.916	74%	0.742	S	S	*	*			trans	-67.8	105	163.5	50.3	0	0	0	0	109.1
69	G	31.8	Very low	37.6	Very low	78 Å²	78	132.5 Å²	132.5	80%	0.804	73%	0.734	S	S	*	*			trans	159.3	84	173.8	0	0	0	0	0	111	A67	A67-G69 PolarHBondContact O-N 3.13Å
70	G	37.9	Very low	38.6	Very low	48 Å²	48	129 Å²	129	50%	0.495	72%	0.719	S	S	.	*			trans	170.3	-13.4	177.5	0	0	0	0	0	115.8	D72 E73	G70-D72 VanDerWaalsContact C-N 3.25Å; G70-D72 PolarHBondContact O-N 3.07Å; G70-E73 PolarHBondContact O-N 3.38Å
71	V	45.5	Very low	39.5	Very low	127 Å²	127	124.1 Å²	124.1	77%	0.77	71%	0.706	S	S	*	*	H	α-helix	trans	-69.6	-20.3	-174.7	-176.3	0	0	0	0	113.1
72	D	48.6	Very low	40.3	Very low	145 Å²	145	117.5 Å²	117.5	78%	0.775	69%	0.689	S	S	*	*	H	α-helix	trans	-84	-23.9	-179.7	-69.2	-31.6	0	0	0	114	G70 A76	G70-D72 VanDerWaalsContact C-N 3.25Å; G70-D72 PolarHBondContact O-N 3.07Å; D72-A76 VanDerWaalsContact O-CB 3.3Å; D72-A76 WeakPolarHBondContact O-CB 3.35Å; D72-A76 PolarHBondContact O-N 3.47Å
73	E	45	Very low	41.2	Very low	163 Å²	163	115.4 Å²	115.4	76%	0.762	67%	0.673	S	S	*	*	H	α-helix	trans	-77.6	-37.5	-180	-101.1	-176	163.1	0	0	112.6	G70 A76 N77	G70-E73 PolarHBondContact O-N 3.38Å; E73-A76 PolarHBondContact O-N 3.04Å; E73-N77 WeakPolarHBondContact O-CB 3.5Å; E73-N77 PolarHBondContact O-N 3.09Å
74	E	42.6	Very low	41.8	Very low	161 Å²	161	118 Å²	118	75%	0.752	67%	0.665	S	S	*	*	H	α-helix	trans	-71	-38.8	-178.4	-137.3	169.7	-163.9	0	0	111.4	N77 A78	E74-N77 PolarHBondContact O-N 3.32Å; E74-A78 WeakPolarHBondContact O-CB 3.18Å; E74-A78 PolarHBondContact O-N 3.47Å
75	A	48.9	Very low	42.4	Very low	62 Å²	62	113.1 Å²	113.1	51%	0.512	65%	0.647	S	S	.	*	H	α-helix	trans	-65.5	-40.9	172.7	0	0	0	0	0	112	N77 A78 E79	A75-N77 VanDerWaalsContact C-N 3.31Å; A75-N77 PolarHBondContact O-N 2.77Å; A75-A78 PolarHBondContact O-N 3.02Å; A75-E79 PolarHBondContact O-N 3.29Å
76	A	49.5	Very low	43	Very low	45 Å²	45	107.7 Å²	107.7	37%	0.372	63%	0.629	S	S	.	*	H	α-helix	trans	-66.1	-33.1	175.9	0	0	0	0	0	112.4	D72 E73 K80	D72-A76 VanDerWaalsContact O-CB 3.3Å; D72-A76 WeakPolarHBondContact O-CB 3.35Å; D72-A76 PolarHBondContact O-N 3.47Å; E73-A76 PolarHBondContact O-N 3.04Å; A76-K80 WeakPolarHBondContact O-CG 3.35Å; A76-K80 PolarHBondContact O-N 3.31Å; A76-K80 VanDerWaalsContact O-N 3.12Å
77	N	48	Very low	43.8	Very low	90 Å²	90	102 Å²	102	48%	0.481	61%	0.607	S	S	.	*	H	α-helix	trans	-74	-40.6	176.9	-153.3	44.8	0	0	0	111.7	E73 E74 A75 E79 K80 E81	E73-N77 WeakPolarHBondContact O-CB 3.5Å; E73-N77 PolarHBondContact O-N 3.09Å; E74-N77 PolarHBondContact O-N 3.32Å; A75-N77 VanDerWaalsContact C-N 3.31Å; A75-N77 PolarHBondContact O-N 2.77Å; N77-E79 VanDerWaalsContact C-N 3.33Å; N77-E79 PolarHBondContact O-N 2.94Å; N77-K80 WeakPolarHBondContact O-CB 3.19Å; N77-K80 PolarHBondContact O-N 3.23Å; N77-E81 PolarHBondContact O-N 3.41Å
78	A	49.6	Very low	44.5	Very low	56 Å²	56	102.9 Å²	102.9	46%	0.463	60%	0.597	S	S	.	*	H	α-helix	trans	-62.3	-39	173.7	0	0	0	0	0	112.2	E74 A75 K80 E81 A82	E74-A78 WeakPolarHBondContact O-CB 3.18Å; E74-A78 PolarHBondContact O-N 3.47Å; A75-A78 PolarHBondContact O-N 3.02Å; A78-K80 VanDerWaalsContact C-N 3.35Å; A78-E81 PolarHBondContact O-N 2.67Å; A78-A82 WeakPolarHBondContact O-CB 3.16Å; A78-A82 PolarHBondContact O-N 3.26Å
79	E	48.9	Very low	45.1	Very low	114 Å²	114	100.9 Å²	100.9	53%	0.533	58%	0.582	S	S	.	*	H	α-helix	trans	-68.2	-34.5	175.9	-152.2	-162.9	145.7	0	0	112.1	A75 N77 K83	A75-E79 PolarHBondContact O-N 3.29Å; N77-E79 VanDerWaalsContact C-N 3.33Å; N77-E79 PolarHBondContact O-N 2.94Å; E79-K83 WeakPolarHBondContact O-CG 3.45Å; E79-K83 PolarHBondContact O-N 2.73Å; E79-K83 VanDerWaalsContact O-N 3.15Å; E79-K83 WeakPolarHBondContact OE1-CE 3.24Å; E79-K83 IonicContact OE1-NZ 2.63Å; E79-K83 PolarHBondContact OE1-NZ 2.88Å
80	K	48.4	Very low	45.9	Very low	128 Å²	128	102.8 Å²	102.8	56%	0.557	57%	0.57	S	S	*	*	H	α-helix	trans	-66	-47	171.6	-78.6	176.4	-179	174.4	0	111.3	A76 N77 A78 A82 K83 W84	A76-K80 WeakPolarHBondContact O-CG 3.35Å; A76-K80 PolarHBondContact O-N 3.31Å; A76-K80 VanDerWaalsContact O-N 3.12Å; N77-K80 WeakPolarHBondContact O-CB 3.19Å; N77-K80 PolarHBondContact O-N 3.23Å; A78-K80 VanDerWaalsContact C-N 3.35Å; K80-A82 VanDerWaalsContact C-N 3.33Å; K80-A82 PolarHBondContact O-N 2.94Å; K80-K83 PolarHBondContact O-N 2.99Å; K80-K83 VanDerWaalsContact O-N 3.16Å; K80-W84 PolarHBondContact O-N 3.33Å
81	E	47.9	Very low	46.7	Very low	131 Å²	131	104 Å²	104	61%	0.612	57%	0.568	S	S	*	*	H	α-helix	trans	-60.1	-42	177.8	-76.4	-171	167.8	0	0	112.2	N77 A78 K83 W84 A85	N77-E81 PolarHBondContact O-N 3.41Å; A78-E81 PolarHBondContact O-N 2.67Å; E81-K83 VanDerWaalsContact C-N 3.33Å; E81-K83 PolarHBondContact O-N 3.36Å; E81-W84 PolarHBondContact O-N 2.69Å; E81-A85 PolarHBondContact O-N 3Å
82	A	46.2	Very low	47.1	Very low	64 Å²	64	101.5 Å²	101.5	53%	0.529	55%	0.55	S	S	.	*	H	α-helix	trans	-62.3	-38.6	175.4	0	0	0	0	0	112.4	A78 K80 C86	A78-A82 WeakPolarHBondContact O-CB 3.16Å; A78-A82 PolarHBondContact O-N 3.26Å; K80-A82 VanDerWaalsContact C-N 3.33Å; K80-A82 PolarHBondContact O-N 2.94Å; A82-C86 PolarHBondContact O-N 3.4Å
83	K	44.3	Very low	47.5	Very low	125 Å²	125	99.7 Å²	99.7	54%	0.543	54%	0.54	S	S	.	.	H	α-helix	trans	-65	-40.4	174.2	-76.8	172.6	-175	160.7	0	111.7	E79 K80 E81 C86 V87	E79-K83 WeakPolarHBondContact O-CG 3.45Å; E79-K83 PolarHBondContact O-N 2.73Å; E79-K83 VanDerWaalsContact O-N 3.15Å; E79-K83 WeakPolarHBondContact OE1-CE 3.24Å; E79-K83 IonicContact OE1-NZ 2.63Å; E79-K83 PolarHBondContact OE1-NZ 2.88Å; K80-K83 PolarHBondContact O-N 2.99Å; K80-K83 VanDerWaalsContact O-N 3.16Å; E81-K83 VanDerWaalsContact C-N 3.33Å; E81-K83 PolarHBondContact O-N 3.36Å; K83-C86 PolarHBondContact O-N 2.81Å; K83-V87 PolarHBondContact O-N 3.25Å
84	W	43.4	Very low	48.2	Very low	169 Å²	169	94.9 Å²	94.9	64%	0.64	52%	0.522	S	S	*	.	H	α-helix	trans	-69.9	-38.5	177.8	-72.1	112.7	0	0	0	113.2	K80 E81 C86 V87 I88	K80-W84 PolarHBondContact O-N 3.33Å; E81-W84 PolarHBondContact O-N 2.69Å; W84-C86 VanDerWaalsContact C-N 3.26Å; W84-C86 PolarHBondContact O-N 2.75Å; W84-V87 PolarHBondContact O-N 3.4Å; W84-V87 VanDerWaalsContact O-N 3.15Å; W84-I88 WeakPolarHBondContact O-CG1 3.2Å; W84-I88 PolarHBondContact O-N 2.95Å
85	A	39.8	Very low	48.9	Very low	54 Å²	54	93 Å²	93	45%	0.446	51%	0.511	S	S	.	.	H	α-helix	trans	-58.6	-40.1	175	0	0	0	0	0	111.6	E81 V87 I88 C89	E81-A85 PolarHBondContact O-N 3Å; A85-V87 PolarHBondContact O-N 2.9Å; A85-I88 PolarHBondContact O-N 3.23Å; A85-C89 PolarHBondContact O-N 2.97Å; A85-C89 VanDerWaalsContact O-N 3.1Å; A85-C89 PolarHBondContact O-SG 2.9Å
86	C	43.2	Very low	49.5	Very low	76 Å²	76	96 Å²	96	51%	0.514	51%	0.513	S	S	.	.	H	α-helix	trans	-63.5	-40.3	176.2	-168.6	0	0	0	0	112.5	A82 K83 W84 C89 Q90	A82-C86 PolarHBondContact O-N 3.4Å; K83-C86 PolarHBondContact O-N 2.81Å; W84-C86 VanDerWaalsContact C-N 3.26Å; W84-C86 PolarHBondContact O-N 2.75Å; C86-C89 PolarHBondContact O-N 2.68Å; C86-Q90 WeakPolarHBondContact O-CB 3.02Å; C86-Q90 WeakPolarHBondContact O-CG 2.92Å; C86-Q90 PolarHBondContact O-N 2.67Å
87	V	46.1	Very low	50.5	Low	75 Å²	75	98.1 Å²	98.1	46%	0.455	52%	0.521	S	S	.	.	H	α-helix	trans	-67.3	-41.4	178.1	177.7	0	0	0	0	111.5	K83 W84 A85 Q90 V91	K83-V87 PolarHBondContact O-N 3.25Å; W84-V87 PolarHBondContact O-N 3.4Å; W84-V87 VanDerWaalsContact O-N 3.15Å; A85-V87 PolarHBondContact O-N 2.9Å; V87-Q90 WeakPolarHBondContact O-CB 3.39Å; V87-Q90 PolarHBondContact O-N 3.02Å; V87-V91 HydrophobicContact CG1-CG2 4.43Å; V87-V91 WeakPolarHBondContact O-CG2 3.07Å; V87-V91 PolarHBondContact O-N 2.97Å
88	I	47.2	Very low	51.5	Low	118 Å²	118	97.6 Å²	97.6	61%	0.605	52%	0.52	S	S	*	.	H	α-helix	trans	-63.8	-43.8	178.1	-65.1	171.4	0	0	0	110.5	W84 A85 Q90 V91 D92	W84-I88 WeakPolarHBondContact O-CG1 3.2Å; W84-I88 PolarHBondContact O-N 2.95Å; A85-I88 PolarHBondContact O-N 3.23Å; I88-Q90 VanDerWaalsContact C-N 3.34Å; I88-Q90 PolarHBondContact O-N 2.83Å; I88-V91 PolarHBondContact O-N 2.82Å; I88-D92 PolarHBondContact O-N 2.84Å
89	C	44.5	Very low	52.2	Low	90 Å²	90	103.1 Å²	103.1	61%	0.608	53%	0.531	S	S	*	.	H	α-helix	trans	-62.5	-39	175.3	-72.5	0	0	0	0	112.5	A85 C86 D92 L93	A85-C89 PolarHBondContact O-N 2.97Å; A85-C89 VanDerWaalsContact O-N 3.1Å; A85-C89 PolarHBondContact O-SG 2.9Å; C86-C89 PolarHBondContact O-N 2.68Å; C89-D92 PolarHBondContact O-N 3.47Å; C89-L93 WeakPolarHBondContact O-CB 3.46Å; C89-L93 PolarHBondContact O-N 2.88Å
90	Q	48.9	Very low	53.4	Low	118 Å²	118	103.6 Å²	103.6	55%	0.551	54%	0.536	S	S	*	.	H	α-helix	trans	-63.6	-42.8	175.3	-75.9	-88.6	-15.9	0	0	112	C86 V87 I88 T94	C86-Q90 WeakPolarHBondContact O-CB 3.02Å; C86-Q90 WeakPolarHBondContact O-CG 2.92Å; C86-Q90 PolarHBondContact O-N 2.67Å; V87-Q90 WeakPolarHBondContact O-CB 3.39Å; V87-Q90 PolarHBondContact O-N 3.02Å; I88-Q90 VanDerWaalsContact C-N 3.34Å; I88-Q90 PolarHBondContact O-N 2.83Å; Q90-T94 WeakPolarHBondContact O-CB 3.13Å; Q90-T94 PolarHBondContact O-N 2.68Å; Q90-T94 PolarHBondContact O-OG1 2.87Å
91	V	53.4	Low	54.5	Low	73 Å²	73	99.9 Å²	99.9	44%	0.442	53%	0.526	S	S	.	.	H	α-helix	trans	-67.9	-40.8	178.5	175	0	0	0	0	111.3	V87 I88 T94 K95	V87-V91 HydrophobicContact CG1-CG2 4.43Å; V87-V91 WeakPolarHBondContact O-CG2 3.07Å; V87-V91 PolarHBondContact O-N 2.97Å; I88-V91 PolarHBondContact O-N 2.82Å; V91-T94 PolarHBondContact O-N 3.47Å; V91-K95 WeakPolarHBondContact O-CG 3.47Å; V91-K95 PolarHBondContact O-N 3.39Å
92	D	53.8	Low	55.6	Low	75 Å²	75	97.4 Å²	97.4	40%	0.401	52%	0.52	S	S	.	.	H	α-helix	trans	-67.5	-39.3	178.6	-164.9	46.4	0	0	0	111.9	I88 C89 T94 K95 K96	I88-D92 PolarHBondContact O-N 2.84Å; C89-D92 PolarHBondContact O-N 3.47Å; D92-T94 VanDerWaalsContact C-N 3.33Å; D92-T94 PolarHBondContact O-N 2.82Å; D92-K95 PolarHBondContact O-N 3.39Å; D92-K96 WeakPolarHBondContact O-CG 3.35Å; D92-K96 PolarHBondContact O-N 3.19Å; D92-K96 WeakPolarHBondContact OD2-CE 3.04Å; D92-K96 IonicContact OD2-NZ 2.7Å; D92-K96 PolarHBondContact OD2-NZ 2.99Å
93	L	57.1	Low	56.8	Low	107 Å²	107	96.5 Å²	96.5	56%	0.56	51%	0.513	S	S	*	.	H	α-helix	trans	-62.1	-42	172.1	-168.2	69.1	0	0	0	111.2	C89 K95 K96 V97	C89-L93 WeakPolarHBondContact O-CB 3.46Å; C89-L93 PolarHBondContact O-N 2.88Å; L93-K95 PolarHBondContact O-N 3.06Å; L93-K96 PolarHBondContact O-N 2.87Å; L93-V97 VanDerWaalsContact O-CG2 3.31Å; L93-V97 WeakPolarHBondContact O-CG2 3.36Å; L93-V97 PolarHBondContact O-N 2.94Å
94	T	60.7	Low	58.4	Low	62 Å²	62	93.9 Å²	93.9	38%	0.38	51%	0.507	S	S	.	.	H	α-helix	trans	-64.5	-41.7	177.8	-49.5	0	0	0	0	111.5	Q90 V91 D92 V97 V98	Q90-T94 WeakPolarHBondContact O-CB 3.13Å; Q90-T94 PolarHBondContact O-N 2.68Å; Q90-T94 PolarHBondContact O-OG1 2.87Å; V91-T94 PolarHBondContact O-N 3.47Å; D92-T94 VanDerWaalsContact C-N 3.33Å; D92-T94 PolarHBondContact O-N 2.82Å; T94-V97 PolarHBondContact O-N 3.39Å; T94-V98 VanDerWaalsContact O-CG2 3.3Å; T94-V98 WeakPolarHBondContact O-CG2 3.17Å; T94-V98 PolarHBondContact O-N 3.42Å
95	K	58	Low	60.3	Low	122 Å²	122	90.4 Å²	90.4	53%	0.53	50%	0.5	S	S	.	.	H	α-helix	trans	-60.4	-48.1	174	-76.5	-179.5	-179.4	178	0	110.9	V91 D92 L93 V97 V98 Y99	V91-K95 WeakPolarHBondContact O-CG 3.47Å; V91-K95 PolarHBondContact O-N 3.39Å; D92-K95 PolarHBondContact O-N 3.39Å; L93-K95 PolarHBondContact O-N 3.06Å; K95-V97 VanDerWaalsContact C-N 3.33Å; K95-V97 PolarHBondContact O-N 3.49Å; K95-V98 PolarHBondContact O-N 2.92Å; K95-V98 VanDerWaalsContact O-N 3.16Å; K95-Y99 HydrophobicContact CB-CD2 4.49Å; K95-Y99 WeakPolarHBondContact O-CD2 3.23Å; K95-Y99 PolarHBondContact O-N 2.99Å
96	K	61.6	Low	62.1	Low	124 Å²	124	93.9 Å²	93.9	54%	0.539	51%	0.508	S	S	.	.	H	α-helix	trans	-58.9	-42	178	-76.5	168	174.3	156.3	0	112.4	D92 L93 Y99 L100	D92-K96 WeakPolarHBondContact O-CG 3.35Å; D92-K96 PolarHBondContact O-N 3.19Å; D92-K96 WeakPolarHBondContact OD2-CE 3.04Å; D92-K96 IonicContact OD2-NZ 2.7Å; D92-K96 PolarHBondContact OD2-NZ 2.99Å; L93-K96 PolarHBondContact O-N 2.87Å; K96-Y99 PolarHBondContact O-N 2.94Å; K96-L100 WeakPolarHBondContact O-CB 3.18Å; K96-L100 PolarHBondContact O-N 3.45Å
97	V	69.7	Low	63.9	Low	90 Å²	90	95.9 Å²	95.9	55%	0.545	51%	0.513	S	S	.	.	H	α-helix	trans	-64.3	-40.4	175.8	172.4	0	0	0	0	111.8	L93 T94 K95 L100 S101	L93-V97 VanDerWaalsContact O-CG2 3.31Å; L93-V97 WeakPolarHBondContact O-CG2 3.36Å; L93-V97 PolarHBondContact O-N 2.94Å; T94-V97 PolarHBondContact O-N 3.39Å; K95-V97 VanDerWaalsContact C-N 3.33Å; K95-V97 PolarHBondContact O-N 3.49Å; V97-L100 PolarHBondContact O-N 3.28Å; V97-S101 PolarHBondContact O-N 3.45Å; V97-S101 PolarHBondContact O-OG 2.92Å
98	V	69.3	Low	65.8	Low	78 Å²	78	97.3 Å²	97.3	47%	0.473	52%	0.517	S	S	.	.	H	α-helix	trans	-67.7	-40.6	176.3	173.8	0	0	0	0	111.6	T94 K95 L100 S101 V102	T94-V98 VanDerWaalsContact O-CG2 3.3Å; T94-V98 WeakPolarHBondContact O-CG2 3.17Å; T94-V98 PolarHBondContact O-N 3.42Å; K95-V98 PolarHBondContact O-N 2.92Å; K95-V98 VanDerWaalsContact O-N 3.16Å; V98-L100 VanDerWaalsContact C-N 3.33Å; V98-L100 PolarHBondContact O-N 2.97Å; V98-S101 PolarHBondContact O-N 3.06Å; V98-S101 PolarHBondContact O-OG 3.32Å; V98-V102 HydrophobicContact CG1-CG2 4.5Å; V98-V102 WeakPolarHBondContact O-CG2 3.24Å; V98-V102 PolarHBondContact O-N 3.48Å
99	Y	64.9	Low	67.3	Low	173 Å²	173	96.5 Å²	96.5	68%	0.678	51%	0.513	S	S	*	.	H	α-helix	trans	-63.4	-40.7	174.6	-83.2	-69.7	0	0	0	111.7	K95 K96 V102 A103	K95-Y99 HydrophobicContact CB-CD2 4.49Å; K95-Y99 WeakPolarHBondContact O-CD2 3.23Å; K95-Y99 PolarHBondContact O-N 2.99Å; K96-Y99 PolarHBondContact O-N 2.94Å; Y99-V102 PolarHBondContact O-N 2.82Å; Y99-A103 WeakPolarHBondContact O-CB 3.23Å; Y99-A103 PolarHBondContact O-N 2.93Å
100	L	72.1	Confident	69	Low	123 Å²	123	96 Å²	96	64%	0.644	51%	0.51	S	S	*	.	H	α-helix	trans	-65.3	-40.6	177.5	-160	72.9	0	0	0	111.4	K96 V97 V98 A103 T104	K96-L100 WeakPolarHBondContact O-CB 3.18Å; K96-L100 PolarHBondContact O-N 3.45Å; V97-L100 PolarHBondContact O-N 3.28Å; V98-L100 VanDerWaalsContact C-N 3.33Å; V98-L100 PolarHBondContact O-N 2.97Å; L100-A103 PolarHBondContact O-N 3Å; L100-T104 WeakPolarHBondContact O-CG2 3.46Å; L100-T104 PolarHBondContact O-N 2.85Å; L100-T104 PolarHBondContact O-OG1 2.94Å
101	S	72.2	Confident	70.7	Confident	51 Å²	51	92 Å²	92	36%	0.357	50%	0.501	S	S	.	.	H	α-helix	trans	-66.5	-43.3	177.5	69.1	0	0	0	0	112.2	V97 V98 A103 T104 I105	V97-S101 PolarHBondContact O-N 3.45Å; V97-S101 PolarHBondContact O-OG 2.92Å; V98-S101 PolarHBondContact O-N 3.06Å; V98-S101 PolarHBondContact O-OG 3.32Å; S101-A103 VanDerWaalsContact C-N 3.34Å; S101-A103 PolarHBondContact O-N 3.32Å; S101-T104 WeakPolarHBondContact CA-OG1 3.49Å; S101-T104 PolarHBondContact O-N 3.43Å; S101-T104 PolarHBondContact O-OG1 3.46Å; S101-I105 VanDerWaalsContact O-CG1 3.32Å; S101-I105 WeakPolarHBondContact O-CG1 3.4Å; S101-I105 PolarHBondContact O-N 3.31Å
102	V	72.1	Confident	72.2	Confident	78 Å²	78	92.7 Å²	92.7	47%	0.473	50%	0.502	S	S	.	.	H	α-helix	trans	-62	-42.3	174.8	174	0	0	0	0	111.3	V98 Y99 T104 I105 M106	V98-V102 HydrophobicContact CG1-CG2 4.5Å; V98-V102 WeakPolarHBondContact O-CG2 3.24Å; V98-V102 PolarHBondContact O-N 3.48Å; Y99-V102 PolarHBondContact O-N 2.82Å; V102-T104 PolarHBondContact O-N 3.47Å; V102-I105 PolarHBondContact O-N 3.01Å; V102-M106 WeakPolarHBondContact O-CG 3.21Å; V102-M106 PolarHBondContact O-N 2.98Å
103	A	71.4	Confident	73.4	Confident	46 Å²	46	94.5 Å²	94.5	38%	0.38	51%	0.511	S	S	.	.	H	α-helix	trans	-61.9	-43.2	175.8	0	0	0	0	0	111.9	Y99 L100 S101 I105 M106 I107	Y99-A103 WeakPolarHBondContact O-CB 3.23Å; Y99-A103 PolarHBondContact O-N 2.93Å; L100-A103 PolarHBondContact O-N 3Å; S101-A103 VanDerWaalsContact C-N 3.34Å; S101-A103 PolarHBondContact O-N 3.32Å; A103-I105 PolarHBondContact O-N 3.36Å; A103-M106 WeakPolarHBondContact O-CB 3.42Å; A103-M106 PolarHBondContact O-N 3.14Å; A103-I107 VanDerWaalsContact O-CG1 3.31Å; A103-I107 WeakPolarHBondContact O-CG1 3.45Å; A103-I107 PolarHBondContact O-N 2.73Å
104	T	78	Confident	74.6	Confident	69 Å²	69	92.8 Å²	92.8	42%	0.423	51%	0.508	S	S	.	.	H	α-helix	trans	-64	-39	176.1	52.6	0	0	0	0	112.8	L100 S101 V102 I107 I108	L100-T104 WeakPolarHBondContact O-CG2 3.46Å; L100-T104 PolarHBondContact O-N 2.85Å; L100-T104 PolarHBondContact O-OG1 2.94Å; S101-T104 WeakPolarHBondContact CA-OG1 3.49Å; S101-T104 PolarHBondContact O-N 3.43Å; S101-T104 PolarHBondContact O-OG1 3.46Å; V102-T104 PolarHBondContact O-N 3.47Å; T104-I107 PolarHBondContact O-N 2.82Å; T104-I108 VanDerWaalsContact O-CG1 3.28Å; T104-I108 WeakPolarHBondContact O-CG1 3.3Å; T104-I108 PolarHBondContact O-N 3.3Å
105	I	82.6	Confident	75.5	Confident	96 Å²	96	93.8 Å²	93.8	49%	0.492	51%	0.513	S	S	.	.	H	α-helix	trans	-63.8	-42.8	176.2	-68.7	165.6	0	0	0	110.7	S101 V102 A103 I107 I108 L109	S101-I105 VanDerWaalsContact O-CG1 3.32Å; S101-I105 WeakPolarHBondContact O-CG1 3.4Å; S101-I105 PolarHBondContact O-N 3.31Å; V102-I105 PolarHBondContact O-N 3.01Å; A103-I105 PolarHBondContact O-N 3.36Å; I105-I107 VanDerWaalsContact C-N 3.35Å; I105-I107 PolarHBondContact O-N 2.99Å; I105-I108 PolarHBondContact O-N 3.09Å; I105-L109 HydrophobicContact CG2-CD1 3.89Å; I105-L109 HydrophobicContact CG2-CG 4.5Å; I105-L109 WeakPolarHBondContact O-CB 3.34Å; I105-L109 WeakPolarHBondContact O-CG 3.39Å; I105-L109 PolarHBondContact O-N 3.01Å
106	M	76.7	Confident	76.2	Confident	127 Å²	127	92 Å²	92	63%	0.626	51%	0.51	S	S	*	.	H	α-helix	trans	-60.9	-41.5	176.2	-76.4	-75.6	-62.1	0	0	112.3	V102 A103 L109 S110	V102-M106 WeakPolarHBondContact O-CG 3.21Å; V102-M106 PolarHBondContact O-N 2.98Å; A103-M106 WeakPolarHBondContact O-CB 3.42Å; A103-M106 PolarHBondContact O-N 3.14Å; M106-L109 PolarHBondContact O-N 2.88Å; M106-S110 WeakPolarHBondContact O-CB 3.31Å; M106-S110 PolarHBondContact O-N 3.29Å
107	I	82.2	Confident	76.8	Confident	119 Å²	119	91.9 Å²	91.9	61%	0.61	51%	0.512	S	S	*	.	H	α-helix	trans	-65.7	-43	177.1	-67.2	164.8	0	0	0	110.9	A103 T104 I105 S110 G111	A103-I107 VanDerWaalsContact O-CG1 3.31Å; A103-I107 WeakPolarHBondContact O-CG1 3.45Å; A103-I107 PolarHBondContact O-N 2.73Å; T104-I107 PolarHBondContact O-N 2.82Å; I105-I107 VanDerWaalsContact C-N 3.35Å; I105-I107 PolarHBondContact O-N 2.99Å; I107-S110 WeakPolarHBondContact O-CB 3.49Å; I107-S110 PolarHBondContact O-N 2.7Å; I107-G111 PolarHBondContact O-N 2.83Å
108	I	85.4	Confident	76.9	Confident	105 Å²	105	93.4 Å²	93.4	54%	0.538	51%	0.513	S	S	.	.	H	α-helix	trans	-63.1	-45.1	177.5	-67.2	165.2	0	0	0	110.6	T104 I105 S110 G111 I112	T104-I108 VanDerWaalsContact O-CG1 3.28Å; T104-I108 WeakPolarHBondContact O-CG1 3.3Å; T104-I108 PolarHBondContact O-N 3.3Å; I105-I108 PolarHBondContact O-N 3.09Å; I108-S110 VanDerWaalsContact C-N 3.34Å; I108-S110 PolarHBondContact O-N 2.57Å; I108-G111 PolarHBondContact O-N 2.87Å; I108-I112 HydrophobicContact CG2-CD1 3.79Å; I108-I112 HydrophobicContact CG2-CG1 4.4Å; I108-I112 VanDerWaalsContact O-CG1 3.32Å; I108-I112 WeakPolarHBondContact O-CG1 3.43Å; I108-I112 PolarHBondContact O-N 2.88Å
109	L	79.5	Confident	77	Confident	101 Å²	101	93.1 Å²	93.1	53%	0.529	51%	0.512	S	S	.	.	H	α-helix	trans	-62.5	-40.2	177.5	-77.4	166.5	0	0	0	112.3	I105 M106 I112 L113	I105-L109 HydrophobicContact CG2-CD1 3.89Å; I105-L109 HydrophobicContact CG2-CG 4.5Å; I105-L109 WeakPolarHBondContact O-CB 3.34Å; I105-L109 WeakPolarHBondContact O-CG 3.39Å; I105-L109 PolarHBondContact O-N 3.01Å; M106-L109 PolarHBondContact O-N 2.88Å; L109-I112 PolarHBondContact O-N 3.27Å; L109-L113 WeakPolarHBondContact O-CB 3.3Å; L109-L113 PolarHBondContact O-N 2.88Å
110	S	79	Confident	76.9	Confident	78 Å²	78	91.6 Å²	91.6	55%	0.545	51%	0.509	S	S	.	.	H	α-helix	trans	-59.4	-44.8	172.7	157.5	0	0	0	0	111.9	M106 I107 I108 L113 S114	M106-S110 WeakPolarHBondContact O-CB 3.31Å; M106-S110 PolarHBondContact O-N 3.29Å; I107-S110 WeakPolarHBondContact O-CB 3.49Å; I107-S110 PolarHBondContact O-N 2.7Å; I108-S110 VanDerWaalsContact C-N 3.34Å; I108-S110 PolarHBondContact O-N 2.57Å; S110-L113 PolarHBondContact O-N 3.24Å; S110-S114 PolarHBondContact O-N 3.05Å
111	G	84.7	Confident	76.4	Confident	34 Å²	34	89.6 Å²	89.6	35%	0.351	50%	0.502	S	S	.	.	H	α-helix	trans	-64.2	-43.1	176.8	0	0	0	0	0	113.3	I107 I108 S114 T115	I107-G111 PolarHBondContact O-N 2.83Å; I108-G111 PolarHBondContact O-N 2.87Å; G111-S114 PolarHBondContact O-N 3.07Å; G111-T115 PolarHBondContact O-N 2.98Å; G111-T115 PolarHBondContact O-OG1 2.72Å
112	I	85.1	Confident	75.8	Confident	89 Å²	89	92.1 Å²	92.1	46%	0.456	51%	0.511	S	S	.	.	H	α-helix	trans	-61.5	-45.2	175.2	-66.8	166.7	0	0	0	110.5	I108 L109 S114 T115 L116	I108-I112 HydrophobicContact CG2-CD1 3.79Å; I108-I112 HydrophobicContact CG2-CG1 4.4Å; I108-I112 VanDerWaalsContact O-CG1 3.32Å; I108-I112 WeakPolarHBondContact O-CG1 3.43Å; I108-I112 PolarHBondContact O-N 2.88Å; L109-I112 PolarHBondContact O-N 3.27Å; I112-S114 PolarHBondContact O-N 2.86Å; I112-T115 PolarHBondContact O-N 2.87Å; I112-L116 HydrophobicContact CG2-CD1 3.88Å; I112-L116 WeakPolarHBondContact O-CB 3.33Å; I112-L116 WeakPolarHBondContact O-CG 3.39Å; I112-L116 PolarHBondContact O-N 2.98Å
113	L	79.9	Confident	75	Confident	113 Å²	113	92.7 Å²	92.7	59%	0.592	51%	0.512	S	S	*	.	H	α-helix	trans	-63.3	-41.7	178.8	-172	68.3	0	0	0	112.1	L109 S110 L116 M117	L109-L113 WeakPolarHBondContact O-CB 3.3Å; L109-L113 PolarHBondContact O-N 2.88Å; S110-L113 PolarHBondContact O-N 3.24Å; L113-L116 PolarHBondContact O-N 3.31Å; L113-M117 WeakPolarHBondContact O-CG 3.32Å; L113-M117 PolarHBondContact O-N 3.47Å
114	S	81	Confident	74	Confident	71 Å²	71	98.5 Å²	98.5	50%	0.497	53%	0.525	S	S	.	.	H	α-helix	trans	-61.8	-43.7	175.1	-173.9	0	0	0	0	111.8	S110 G111 I112 M117 Q118	S110-S114 PolarHBondContact O-N 3.05Å; G111-S114 PolarHBondContact O-N 3.07Å; I112-S114 PolarHBondContact O-N 2.86Å; S114-M117 PolarHBondContact O-N 2.59Å; S114-Q118 PolarHBondContact O-N 3.26Å
115	T	79.3	Confident	72.7	Confident	82 Å²	82	99.3 Å²	99.3	50%	0.503	53%	0.53	S	S	.	.	H	α-helix	trans	-66.6	-41.3	179.5	-47.3	0	0	0	0	111	G111 I112 Q118 V119	G111-T115 PolarHBondContact O-N 2.98Å; G111-T115 PolarHBondContact O-OG1 2.72Å; I112-T115 PolarHBondContact O-N 2.87Å; T115-Q118 PolarHBondContact O-N 3.43Å; T115-V119 WeakPolarHBondContact O-CG2 3.47Å; T115-V119 PolarHBondContact O-N 3.22Å
116	L	73.5	Confident	71	Confident	86 Å²	86	104.1 Å²	104.1	45%	0.45	54%	0.542	S	S	.	.	H	α-helix	trans	-59.8	-46.7	173.3	-80.9	164.4	0	0	0	111.4	I112 L113 Q118 V119 F120	I112-L116 HydrophobicContact CG2-CD1 3.88Å; I112-L116 WeakPolarHBondContact O-CB 3.33Å; I112-L116 WeakPolarHBondContact O-CG 3.39Å; I112-L116 PolarHBondContact O-N 2.98Å; L113-L116 PolarHBondContact O-N 3.31Å; L116-Q118 VanDerWaalsContact C-N 3.27Å; L116-Q118 PolarHBondContact O-N 2.94Å; L116-V119 PolarHBondContact O-N 3.03Å; L116-F120 WeakPolarHBondContact O-CB 3.26Å; L116-F120 VanDerWaalsContact O-CD2 3.23Å; L116-F120 WeakPolarHBondContact O-CD2 3.42Å; L116-F120 PolarHBondContact O-N 3.32Å
117	M	74.1	Confident	69.5	Low	120 Å²	120	106.6 Å²	106.6	59%	0.591	55%	0.549	S	S	*	.	H	α-helix	trans	-61.6	-36.7	177.5	-72.5	-66.6	-84.1	0	0	112	L113 S114 F120 T121	L113-M117 WeakPolarHBondContact O-CG 3.32Å; L113-M117 PolarHBondContact O-N 3.47Å; S114-M117 PolarHBondContact O-N 2.59Å; M117-F120 PolarHBondContact O-N 2.99Å; M117-T121 WeakPolarHBondContact O-CB 3.47Å; M117-T121 PolarHBondContact O-N 3.47Å; M117-T121 PolarHBondContact O-OG1 3.45Å
118	Q	72	Confident	67.6	Low	122 Å²	122	104.6 Å²	104.6	57%	0.57	54%	0.542	S	S	*	.	H	α-helix	trans	-66.1	-45.5	174.7	-122.3	166.2	-18.6	0	0	112.2	S114 T115 L116 F120 T121 D122	S114-Q118 PolarHBondContact O-N 3.26Å; T115-Q118 PolarHBondContact O-N 3.43Å; L116-Q118 VanDerWaalsContact C-N 3.27Å; L116-Q118 PolarHBondContact O-N 2.94Å; Q118-F120 VanDerWaalsContact C-N 3.34Å; Q118-F120 PolarHBondContact O-N 3.5Å; Q118-T121 PolarHBondContact O-N 3.47Å; Q118-D122 PolarHBondContact O-N 3.32Å
119	V	71.1	Confident	65.3	Low	73 Å²	73	105.2 Å²	105.2	44%	0.442	54%	0.543	S	S	.	.	H	α-helix	trans	-63.3	-40.2	175.7	172.8	0	0	0	0	111.4	T115 L116 T121 N123	T115-V119 WeakPolarHBondContact O-CG2 3.47Å; T115-V119 PolarHBondContact O-N 3.22Å; L116-V119 PolarHBondContact O-N 3.03Å; V119-T121 VanDerWaalsContact C-N 3.35Å; V119-N123 WeakPolarHBondContact CG1-ND2 3.39Å; V119-N123 VanDerWaalsContact O-CB 3.28Å; V119-N123 WeakPolarHBondContact O-CB 3.47Å; V119-N123 PolarHBondContact O-N 3.48Å; V119-N123 PolarHBondContact O-ND2 2.68Å
120	F	62.3	Low	63.3	Low	141 Å²	141	104.9 Å²	104.9	62%	0.618	55%	0.547	S	S	*	.	H	α-helix	trans	-62.9	-42.4	173.6	-89.9	-72.1	0	0	0	111.6	L116 M117 Q118 N123 Y124	L116-F120 WeakPolarHBondContact O-CB 3.26Å; L116-F120 VanDerWaalsContact O-CD2 3.23Å; L116-F120 WeakPolarHBondContact O-CD2 3.42Å; L116-F120 PolarHBondContact O-N 3.32Å; M117-F120 PolarHBondContact O-N 2.99Å; Q118-F120 VanDerWaalsContact C-N 3.34Å; Q118-F120 PolarHBondContact O-N 3.5Å; F120-N123 PolarHBondContact O-N 3.42Å; F120-Y124 WeakPolarHBondContact O-CB 3.45Å; F120-Y124 PolarHBondContact O-N 3.23Å
121	T	63.2	Low	61.2	Low	81 Å²	81	109.8 Å²	109.8	50%	0.497	56%	0.56	S	S	.	*	H	α-helix	trans	-65.7	-46.7	178.5	-53.1	0	0	0	0	111.2	M117 Q118 V119 N123 Y124 V125	M117-T121 WeakPolarHBondContact O-CB 3.47Å; M117-T121 PolarHBondContact O-N 3.47Å; M117-T121 PolarHBondContact O-OG1 3.45Å; Q118-T121 PolarHBondContact O-N 3.47Å; V119-T121 VanDerWaalsContact C-N 3.35Å; T121-N123 PolarHBondContact O-N 2.96Å; T121-Y124 PolarHBondContact O-N 3.31Å; T121-V125 VanDerWaalsContact O-CG2 3.29Å; T121-V125 WeakPolarHBondContact O-CG2 3.28Å; T121-V125 PolarHBondContact O-N 3.21Å
122	D	58.7	Low	58.6	Low	104 Å²	104	111.6 Å²	111.6	56%	0.556	57%	0.568	S	S	*	*	H	α-helix	trans	-63.6	-40.7	178.1	-82.9	-9	0	0	0	112	Q118 R126	Q118-D122 PolarHBondContact O-N 3.32Å; D122-R126 WeakPolarHBondContact O-CG 3.39Å; D122-R126 PolarHBondContact O-N 2.66Å
123	N	56	Low	55.9	Low	90 Å²	90	113.9 Å²	113.9	48%	0.481	58%	0.579	S	S	.	*	H	α-helix	trans	-68.8	-37.7	175.2	-76.9	-32.9	0	0	0	111.8	V119 F120 T121 R126 F127	V119-N123 WeakPolarHBondContact CG1-ND2 3.39Å; V119-N123 VanDerWaalsContact O-CB 3.28Å; V119-N123 WeakPolarHBondContact O-CB 3.47Å; V119-N123 PolarHBondContact O-N 3.48Å; V119-N123 PolarHBondContact O-ND2 2.68Å; F120-N123 PolarHBondContact O-N 3.42Å; T121-N123 PolarHBondContact O-N 2.96Å; N123-R126 PolarHBondContact O-N 3.01Å; N123-F127 WeakPolarHBondContact O-CB 3.49Å; N123-F127 PolarHBondContact O-N 3.44Å
124	Y	49.1	Very low	53.6	Low	167 Å²	167	119.3 Å²	119.3	66%	0.655	59%	0.594	S	S	*	*	H	α-helix	trans	-65	-43.9	176.5	-165.9	-95.5	0	0	0	111.3	F120 T121 R126 F127 V128	F120-Y124 WeakPolarHBondContact O-CB 3.45Å; F120-Y124 PolarHBondContact O-N 3.23Å; T121-Y124 PolarHBondContact O-N 3.31Å; Y124-R126 VanDerWaalsContact C-N 3.33Å; Y124-R126 PolarHBondContact O-N 3.1Å; Y124-F127 PolarHBondContact O-N 2.88Å; Y124-V128 HydrophobicContact CD1-CG2 3.99Å; Y124-V128 HydrophobicContact CD2-CG2 4.45Å; Y124-V128 HydrophobicContact CE1-CG2 3.7Å; Y124-V128 HydrophobicContact CE2-CG2 4.2Å; Y124-V128 HydrophobicContact CG-CG2 4.36Å; Y124-V128 WeakPolarHBondContact O-CB 3.22Å; Y124-V128 WeakPolarHBondContact O-CG2 3.43Å; Y124-V128 PolarHBondContact O-N 2.8Å
125	V	51.2	Low	51	Low	86 Å²	86	121.1 Å²	121.1	52%	0.521	61%	0.607	S	S	.	*	H	α-helix	trans	-62.1	-40.4	175.2	174	0	0	0	0	111.1	T121 H129	T121-V125 VanDerWaalsContact O-CG2 3.29Å; T121-V125 WeakPolarHBondContact O-CG2 3.28Å; T121-V125 PolarHBondContact O-N 3.21Å; V125-H129 PolarHBondContact O-N 2.86Å; V125-H129 VanDerWaalsContact O-N 3.12Å
126	R	47.8	Very low	48.5	Very low	197 Å²	197	127.6 Å²	127.6	74%	0.743	62%	0.622	S	S	*	*	H	α-helix	trans	-66.9	-36.8	174.3	-76.8	-177.1	178.8	-172.8	1.4	113.3	D122 N123 Y124	D122-R126 WeakPolarHBondContact O-CG 3.39Å; D122-R126 PolarHBondContact O-N 2.66Å; N123-R126 PolarHBondContact O-N 3.01Å; Y124-R126 VanDerWaalsContact C-N 3.33Å; Y124-R126 PolarHBondContact O-N 3.1Å
127	F	44.4	Very low	46.2	Very low	180 Å²	180	134.5 Å²	134.5	79%	0.789	64%	0.643	S	S	*	*	H	α-helix	trans	-76.8	-35.6	-176.9	-146.5	-88.1	0	0	0	112.4	N123 Y124	N123-F127 WeakPolarHBondContact O-CB 3.49Å; N123-F127 PolarHBondContact O-N 3.44Å; Y124-F127 PolarHBondContact O-N 2.88Å
128	V	42.8	Very low	43.9	Very low	76 Å²	76	140 Å²	140	46%	0.461	66%	0.657	S	S	.	*	H	α-helix	trans	-86.1	-21.8	-178.3	-178.9	0	0	0	0	112.3	Y124	Y124-V128 HydrophobicContact CD1-CG2 3.99Å; Y124-V128 HydrophobicContact CD2-CG2 4.45Å; Y124-V128 HydrophobicContact CE1-CG2 3.7Å; Y124-V128 HydrophobicContact CE2-CG2 4.2Å; Y124-V128 HydrophobicContact CG-CG2 4.36Å; Y124-V128 WeakPolarHBondContact O-CB 3.22Å; Y124-V128 WeakPolarHBondContact O-CG2 3.43Å; Y124-V128 PolarHBondContact O-N 2.8Å
129	H	36.9	Very low	41.8	Very low	118 Å²	118	141.4 Å²	141.4	55%	0.546	67%	0.668	S	S	.	*			trans	-129.4	62.6	179	-79	-73.7	0	0	0	115.3	V125 H131	V125-H129 PolarHBondContact O-N 2.86Å; V125-H129 VanDerWaalsContact O-N 3.12Å; H129-H131 PolarHBondContact O-N 2.82Å
130	P	36.6	Very low	39.6	Very low	94 Å²	94	146.6 Å²	146.6	61%	0.61	69%	0.693	S	S	*	*	S	Bend	trans	-77.8	100	158.2	31.4	-26.5	0	0	0	107.8
131	H	35.9	Very low	37.8	Very low	181 Å²	181	142.9 Å²	142.9	84%	0.838	69%	0.694	S	S	*	*	S	Bend	trans	64.7	71.4	172.4	-61	-88.4	0	0	0	116.8	H129	H129-H131 PolarHBondContact O-N 2.82Å
132	S	30.3	Very low	36.2	Very low	72 Å²	72	146 Å²	146	50%	0.503	71%	0.713	S	S	.	*			trans	-125.8	85.1	155.2	-167.9	0	0	0	0	110.6	Y134	S132-Y134 PolarHBondContact O-N 2.73Å; S132-Y134 VanDerWaalsContact O-N 3.12Å
133	I	28.9	Very low	34.5	Very low	137 Å²	137	149.3 Å²	149.3	70%	0.703	73%	0.731	S	S	*	*				33	74.1	126	-50.8	166.6	0	0	0	113.9
134	Y	30	Very low	33.3	Very low	227 Å²	227	149.3 Å²	149.3	89%	0.89	74%	0.744	S	S	*	*			trans	-117.2	65.2	155.4	-98.1	-84.2	0	0	0	109.2	S132	S132-Y134 PolarHBondContact O-N 2.73Å; S132-Y134 VanDerWaalsContact O-N 3.12Å
135	S	27.3	Very low	32.1	Very low	110 Å²	110	152.8 Å²	152.8	77%	0.769	76%	0.756	S	S	*	*			trans	-148.3	66.8	159.6	78.8	0	0	0	0	110.5
136	R	26.9	Very low	31	Very low	217 Å²	217	155 Å²	155	82%	0.819	77%	0.769	S	S	*	*			trans	-131.3	47	169.4	-90.8	-160.4	-168.4	-173.6	5.9	112.3
137	Y	25.5	Very low	29.9	Very low	231 Å²	231	152.4 Å²	152.4	91%	0.906	77%	0.77	S	S	*	*			trans	-152.8	82	158.6	-82	-73.9	0	0	0	109.8
138	R	25	Very low	29.1	Very low	235 Å²	235	151.5 Å²	151.5	89%	0.887	77%	0.768	S	S	*	*	S	Bend	trans	-170.7	128.5	144.8	-111.7	173.5	-165.4	170.1	5.3	111.7
139	L	27.6	Very low	28.2	Very low	152 Å²	152	153.9 Å²	153.9	80%	0.796	78%	0.777	S	S	*	*			trans	78.2	83.8	149.6	-64	154.3	0	0	0	116.9
140	L	25	Very low	27.7	Very low	182 Å²	182	155.1 Å²	155.1	95%	0.953	79%	0.787	S	S	*	*			trans	-50.6	129.1	137.7	-80.8	144.3	0	0	0	109.7
141	G	24.7	Very low	27.3	Very low	64 Å²	64	157.4 Å²	157.4	66%	0.66	80%	0.8	S	S	*	*			trans	115.6	87.5	162.8	0	0	0	0	0	114.3
142	T	28.9	Very low	26.8	Very low	145 Å²	145	157.1 Å²	157.1	89%	0.89	80%	0.799	S	S	*	*				-178.1	130.9	112.2	35.3	0	0	0	0	109.7	A144	T142-A144 PolarHBondContact O-N 2.82Å
143	N	24.3	Very low	26.7	Very low	175 Å²	175	160.1 Å²	160.1	94%	0.936	81%	0.809	S	S	*	*			trans	-57.5	125.8	172.9	-74.5	-52.2	0	0	0	111.7
144	A	30.1	Very low	26.5	Very low	90 Å²	90	159.9 Å²	159.9	74%	0.744	81%	0.814	S	S	*	*			trans	-146.6	103.8	155.8	0	0	0	0	0	109.7	T142 V146	T142-A144 PolarHBondContact O-N 2.82Å; A144-V146 PolarHBondContact O-N 2.8Å
145	R	23.3	Very low	26.5	Very low	239 Å²	239	155.9 Å²	155.9	90%	0.902	81%	0.813	S	S	*	*			trans	-54.5	122.4	163.8	-83.1	170.5	160.9	154.8	-6.9	109.2
146	V	29.1	Very low	26.7	Very low	133 Å²	133	157.5 Å²	157.5	81%	0.806	82%	0.819	S	S	*	*			trans	-132.6	94.5	154	-176.9	0	0	0	0	107.5	A144	A144-V146 PolarHBondContact O-N 2.8Å
147	N	23.9	Very low	26.9	Very low	142 Å²	142	155.2 Å²	155.2	76%	0.759	82%	0.817	S	S	*	*			trans	-75.6	119.7	159	-77.6	-26.7	0	0	0	107.5
148	H	28	Very low	27.2	Very low	161 Å²	161	152.5 Å²	152.5	75%	0.745	81%	0.812	S	S	*	*			trans	-173.5	102.2	147.7	-118.3	-91.5	0	0	0	107.1
149	L	24.9	Very low	27.5	Very low	126 Å²	126	149.3 Å²	149.3	66%	0.66	81%	0.807	S	S	*	*				73.5	126.7	98.3	-97.4	104.6	0	0	0	114.3
150	L	24.6	Very low	27.7	Very low	145 Å²	145	151.2 Å²	151.2	76%	0.759	81%	0.809	S	S	*	*			trans	73.5	106.8	148.4	-59.9	156.7	0	0	0	116.6
151	T	28.4	Very low	28	Very low	142 Å²	142	147.9 Å²	147.9	87%	0.871	80%	0.796	S	S	*	*				-173.6	127.7	91.5	32.2	0	0	0	0	109.5
152	Q	26.8	Very low	28.2	Very low	174 Å²	174	153 Å²	153	81%	0.813	80%	0.801	S	S	*	*			trans	-73.2	156.4	174.4	-72.8	167.7	-37.6	0	0	111.3
153	D	26.6	Very low	28.4	Very low	135 Å²	135	152.5 Å²	152.5	72%	0.722	79%	0.792	S	S	*	*			trans	56.6	103.2	145.3	-59.1	-26.1	0	0	0	118.9
154	T	26.5	Very low	28.6	Very low	133 Å²	133	154.4 Å²	154.4	82%	0.816	79%	0.786	S	S	*	*				164.3	97.7	123.7	41.4	0	0	0	0	110.2
155	T	29.2	Very low	28.6	Very low	142 Å²	142	156.7 Å²	156.7	87%	0.871	79%	0.785	S	S	*	*			trans	179	47.1	156.1	24.5	0	0	0	0	112.5
156	V	32.1	Very low	28.9	Very low	145 Å²	145	149.9 Å²	149.9	88%	0.879	77%	0.77	S	S	*	*			trans	-87.4	-4.1	179.1	175.8	0	0	0	0	113.4
157	H	31	Very low	29.1	Very low	169 Å²	169	148.2 Å²	148.2	78%	0.782	77%	0.765	S	S	*	*	S	Bend	trans	-105.3	1.8	-166.5	-119.8	-58.9	0	0	0	119.1
158	H	30.8	Very low	29.4	Very low	174 Å²	174	150.4 Å²	150.4	81%	0.806	77%	0.767	S	S	*	*	S	Bend	trans	-121.9	-3.1	-177	-84.9	66.3	0	0	0	117.1
159	Q	31.2	Very low	29.7	Very low	168 Å²	168	149.6 Å²	149.6	79%	0.785	77%	0.767	S	S	*	*	S	Bend	trans	-92.9	-11.2	-178.4	-84.1	-176.7	-15.8	0	0	115.9
160	K	33.5	Very low	30.2	Very low	191 Å²	191	150.6 Å²	150.6	83%	0.83	77%	0.768	S	S	*	*	S	Bend	trans	-85.3	-11.8	-178.1	-85.9	-177.1	176.7	176.1	0	115.5
161	T	30.7	Very low	30.7	Very low	112 Å²	112	150.5 Å²	150.5	69%	0.687	77%	0.768	S	S	*	*	S	Bend	trans	-89.1	-24.8	-179.3	-45.9	0	0	0	0	112.7
162	F	29.4	Very low	31.3	Very low	173 Å²	173	150.6 Å²	150.6	76%	0.759	75%	0.753	S	S	*	*	G	3₁₀ helix	trans	-81.6	-20.1	-175.2	-145.1	-97.7	0	0	0	114.2
163	L	31.4	Very low	32.1	Very low	134 Å²	134	144.7 Å²	144.7	70%	0.702	73%	0.731	S	S	*	*	G	3₁₀ helix	trans	-88.4	0.1	-177.4	-88.5	156	0	0	0	115.2
164	R	30.2	Very low	33	Very low	215 Å²	215	143.2 Å²	143.2	81%	0.811	73%	0.729	S	S	*	*	G	3₁₀ helix	trans	-94.8	-9.3	175.5	-80.9	-171.3	178.5	-177.2	0.3	114.8
165	L	29.3	Very low	34.2	Very low	138 Å²	138	139.2 Å²	139.2	72%	0.723	71%	0.709	S	S	*	*	S	Bend	trans	-94	-18	179.5	-89.6	139.3	0	0	0	113.8
166	T	30.4	Very low	35.5	Very low	95 Å²	95	133.7 Å²	133.7	58%	0.583	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.4	-7.5	-177.5	52.6	0	0	0	0	114.9
167	S	32.3	Very low	36.6	Very low	99 Å²	99	127.1 Å²	127.1	69%	0.692	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.6	1.8	178.6	92	0	0	0	0	114.7
168	K	30.3	Very low	37.9	Very low	187 Å²	187	122.3 Å²	122.3	81%	0.813	63%	0.626	S	S	*	*	S	Bend	trans	-112.7	-5.2	-177.6	-88.9	-171.1	176.9	-176.2	0	115.3	H170	K168-H170 PolarHBondContact O-N 2.81Å; K168-H170 VanDerWaalsContact O-N 3.13Å
169	I	34.1	Very low	39.4	Very low	144 Å²	144	118.6 Å²	118.6	74%	0.738	62%	0.615	S	S	*	*			trans	-90.7	67.7	168.4	-50.4	176.6	0	0	0	106.4	D171	I169-D171 PolarHBondContact O-N 2.86Å
170	H	35.4	Very low	41.6	Very low	147 Å²	147	112.1 Å²	112.1	68%	0.681	59%	0.585	S	S	*	*			trans	-68.6	122.2	161.8	-152.2	45.6	0	0	0	105.4	K168 R172	K168-H170 PolarHBondContact O-N 2.81Å; K168-H170 VanDerWaalsContact O-N 3.13Å; H170-R172 PolarHBondContact O-N 2.92Å
171	D	36.3	Very low	43.8	Very low	144 Å²	144	103 Å²	103	77%	0.77	55%	0.545	S	S	*	.			trans	-67.3	51.4	-166.3	-149.3	4.2	0	0	0	113.3	I169 S173	I169-D171 PolarHBondContact O-N 2.86Å; D171-S173 VanDerWaalsContact C-N 3.29Å; D171-S173 PolarHBondContact O-N 3.49Å; D171-S173 VanDerWaalsContact O-N 3.07Å
172	R	40.7	Very low	46.4	Very low	143 Å²	143	103.7 Å²	103.7	54%	0.54	54%	0.541	S	S	.	.			trans	-86.1	71.8	-177.9	-66	-169.6	-178.5	-164.4	0.5	109.3	H170	H170-R172 PolarHBondContact O-N 2.92Å
173	S	41.8	Very low	49.2	Very low	51 Å²	51	100 Å²	100	36%	0.357	53%	0.526	S	S	.	.			trans	-94.3	156.1	172.6	78	0	0	0	0	110.1	D171 A175 S176	D171-S173 VanDerWaalsContact C-N 3.29Å; D171-S173 PolarHBondContact O-N 3.49Å; D171-S173 VanDerWaalsContact O-N 3.07Å; S173-A175 PolarHBondContact O-N 3.37Å; S173-A175 WeakPolarHBondContact OG-CB 3.41Å; S173-A175 PolarHBondContact OG-N 2.97Å; S173-S176 PolarHBondContact O-N 3.48Å; S173-S176 VanDerWaalsContact O-N 3.09Å
174	P	47.2	Very low	52.1	Low	104 Å²	104	94.3 Å²	94.3	68%	0.675	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	-6	172.1	17.8	-31.5	0	0	0	115	S176 T326	P174-S176 PolarHBondContact O-N 3.39Å; P174-T326 HydrophobicContact CB-CG2 4.26Å
175	A	50.8	Low	55.2	Low	49 Å²	49	87 Å²	87	41%	0.405	47%	0.468	S	S	.	.	H	α-helix	trans	-59.6	-19.9	168.5	0	0	0	0	0	113.9	S173 L177 A178 V179	S173-A175 PolarHBondContact O-N 3.37Å; S173-A175 WeakPolarHBondContact OG-CB 3.41Å; S173-A175 PolarHBondContact OG-N 2.97Å; A175-L177 PolarHBondContact O-N 3.48Å; A175-A178 PolarHBondContact O-N 3.01Å; A175-V179 VanDerWaalsContact O-CG2 3.31Å; A175-V179 WeakPolarHBondContact O-CG2 3.05Å; A175-V179 PolarHBondContact O-N 3.4Å
176	S	56	Low	58.5	Low	25 Å²	25	80.5 Å²	80.5	18%	0.175	44%	0.435	C	S	.	.	H	α-helix	trans	-61.6	-43.3	-174.9	97.1	0	0	0	0	112.9	S173 P174 A178 V179 M180 E319	S173-S176 PolarHBondContact O-N 3.48Å; S173-S176 VanDerWaalsContact O-N 3.09Å; P174-S176 PolarHBondContact O-N 3.39Å; S176-A178 VanDerWaalsContact C-N 3.33Å; S176-A178 PolarHBondContact O-N 2.94Å; S176-V179 PolarHBondContact O-N 2.94Å; S176-M180 WeakPolarHBondContact O-CE 3.07Å; S176-M180 WeakPolarHBondContact O-CG 3.24Å; S176-M180 PolarHBondContact O-N 2.81Å; S176-M180 VanDerWaalsContact OG-CE 3.24Å; S176-M180 WeakPolarHBondContact OG-CE 3.22Å; S176-E319 WeakPolarHBondContact CB-OE1 3.41Å; S176-E319 PolarHBondContact OG-OE1 3.11Å
177	L	54.9	Low	61.6	Low	7 Å²	7	79.2 Å²	79.2	4%	0.037	42%	0.422	C	S	.	.	H	α-helix	trans	-65	-40.7	178.4	-168.4	82	0	0	0	110.8	A175 V179 M180 V181 M315 R317 K328	A175-L177 PolarHBondContact O-N 3.48Å; L177-V179 VanDerWaalsContact C-N 3.26Å; L177-V179 PolarHBondContact O-N 2.8Å; L177-M180 PolarHBondContact O-N 3.37Å; L177-V181 HydrophobicContact CD1-CG2 4.37Å; L177-V181 HydrophobicContact CG-CG2 4.4Å; L177-V181 PolarHBondContact O-N 3.25Å; L177-M315 HydrophobicContact CD1-CE 3.9Å; L177-M315 HydrophobicContact CD2-CE 3.93Å; L177-M315 HydrophobicContact CG-CE 4.05Å; L177-R317 HydrophobicContact CD1-CB 3.72Å; L177-R317 VanDerWaalsContact CD1-CD 3.41Å; L177-R317 HydrophobicContact CD1-CG 4.22Å; L177-K328 HydrophobicContact CD2-CB 3.79Å
178	A	59.5	Low	64.7	Low	69 Å²	69	75.3 Å²	75.3	57%	0.57	39%	0.392	S	S	*	.	H	α-helix	trans	-63.3	-33.1	177.2	0	0	0	0	0	112	A175 S176	A175-A178 PolarHBondContact O-N 3.01Å; S176-A178 VanDerWaalsContact C-N 3.33Å; S176-A178 PolarHBondContact O-N 2.94Å
179	V	62.6	Low	67.8	Low	96 Å²	96	70.6 Å²	70.6	58%	0.582	38%	0.376	S	S	*	.	H	α-helix	trans	-78	-31.3	176.3	175.4	0	0	0	0	112.1	A175 S176 L177 S210	A175-V179 VanDerWaalsContact O-CG2 3.31Å; A175-V179 WeakPolarHBondContact O-CG2 3.05Å; A175-V179 PolarHBondContact O-N 3.4Å; S176-V179 PolarHBondContact O-N 2.94Å; L177-V179 VanDerWaalsContact C-N 3.26Å; L177-V179 PolarHBondContact O-N 2.8Å; V179-S210 PolarHBondContact O-OG 2.62Å
180	M	75.9	Confident	70.5	Confident	31 Å²	31	65.9 Å²	65.9	15%	0.153	35%	0.351	C	S	.	.	H	α-helix	trans	-84.5	-37.8	-177.2	-75.3	-179.2	-101.1	0	0	113.6	S176 L177 M209 S210 K211 R317	S176-M180 WeakPolarHBondContact O-CE 3.07Å; S176-M180 WeakPolarHBondContact O-CG 3.24Å; S176-M180 PolarHBondContact O-N 2.81Å; S176-M180 VanDerWaalsContact OG-CE 3.24Å; S176-M180 WeakPolarHBondContact OG-CE 3.22Å; L177-M180 PolarHBondContact O-N 3.37Å; M180-M209 CarbonylContact O-C 3.57Å; M180-M209 WeakPolarHBondContact O-CA 3.29Å; M180-S210 WeakPolarHBondContact CA-OG 3.5Å; M180-S210 PolarHBondContact O-N 3Å; M180-S210 PolarHBondContact O-OG 2.79Å; M180-K211 HydrophobicContact CG-CB 4.43Å; M180-R317 PolarHBondContact SD-NH1 2.97Å
181	V	80.7	Confident	73.1	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	105.2	175.2	-173.7	0	0	0	0	107.2	L177 E183 I207 V208 M209 M315 K328	L177-V181 HydrophobicContact CD1-CG2 4.37Å; L177-V181 HydrophobicContact CG-CG2 4.4Å; L177-V181 PolarHBondContact O-N 3.25Å; V181-E183 WeakPolarHBondContact CG1-O 3.31Å; V181-I207 HydrophobicContact CG1-CG2 3.88Å; V181-V208 CarbonylContact C-O 3.6Å; V181-M209 HydrophobicContact CB-SD 4.03Å; V181-M209 HydrophobicContact CG1-SD 4.04Å; V181-M209 HydrophobicContact CG2-CE 3.72Å; V181-M209 HydrophobicContact CG2-SD 3.43Å; V181-M209 WeakPolarHBondContact CG2-SD 3.28Å; V181-M315 HydrophobicContact CB-CE 4.09Å; V181-M315 HydrophobicContact CG1-CE 4.17Å; V181-M315 HydrophobicContact CG2-CE 3.26Å; V181-M315 HydrophobicContact CG2-SD 4.18Å; V181-K328 HydrophobicContact CB-CD 4.08Å; V181-K328 HydrophobicContact CG1-CD 3.95Å; V181-K328 PolarHBondContact O-NZ 3.31Å
182	E	84.6	Confident	75.8	Confident	127 Å²	127	58.6 Å²	58.6	59%	0.593	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.2	-50.2	178.9	-61.8	-175.1	160.9	0	0	109.4	V208 S210 K328	E182-V208 HydrophobicContact CB-CG1 4.34Å; E182-V208 PolarHBondContact N-O 2.72Å; E182-S210 WeakPolarHBondContact OE1-CB 3.27Å; E182-K328 PolarHBondContact O-NZ 2.91Å
183	E	89.4	Confident	78.4	Confident	96 Å²	96	52.5 Å²	52.5	45%	0.449	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	142.2	-174.9	-159.1	177.4	174.5	0	0	111.9	V181 R185 V208	V181-E183 WeakPolarHBondContact CG1-O 3.31Å; E183-R185 HydrophobicContact CG-CB 4.4Å; E183-R185 WeakPolarHBondContact OE1-CD 3.13Å; E183-V208 HydrophobicContact CB-CB 3.87Å; E183-V208 HydrophobicContact CB-CG2 3.93Å; E183-V208 PolarHBondContact N-O 2.93Å; E183-V208 PolarHBondContact O-N 2.91Å
184	L	92	Very high	81	Confident	14 Å²	14	50.1 Å²	50.1	7%	0.073	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	108	171.8	-179.2	67.6	0	0	0	107.3	L205 I207 M315 K328 T330	L184-L205 HydrophobicContact CD1-CD1 3.78Å; L184-L205 HydrophobicContact CD1-CD2 4.36Å; L184-L205 HydrophobicContact CD1-CG 4.22Å; L184-L205 HydrophobicContact CG-CD1 4.41Å; L184-I207 HydrophobicContact CD1-CD1 4.29Å; L184-I207 HydrophobicContact CD1-CG1 3.79Å; L184-I207 HydrophobicContact CD1-CG2 4.49Å; L184-M315 HydrophobicContact CD2-CB 4.48Å; L184-K328 HydrophobicContact CB-CD 4.21Å; L184-K328 HydrophobicContact CD2-CB 4.25Å; L184-K328 HydrophobicContact CD2-CD 4.4Å; L184-K328 HydrophobicContact CD2-CG 3.94Å; L184-T330 HydrophobicContact CD2-CG2 4.01Å; L184-T330 HydrophobicContact CG-CG2 3.67Å; L184-T330 WeakPolarHBondContact O-CB 3.18Å; L184-T330 PolarHBondContact O-OG1 2.92Å
185	R	94.8	Very high	83.3	Confident	60 Å²	60	45.6 Å²	45.6	23%	0.226	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	141.3	-170	68.9	-157.1	-170.8	81.3	10.5	111.3	E183 E187 V206 E283	E183-R185 HydrophobicContact CG-CB 4.4Å; E183-R185 WeakPolarHBondContact OE1-CD 3.13Å; R185-E187 IonicContact CZ-OE1 2.7Å; R185-E187 VanDerWaalsContact CZ-OE1 3.22Å; R185-E187 IonicContact NH1-OE1 3.22Å; R185-E187 PolarHBondContact NH1-OE1 3.45Å; R185-E187 IonicContact NH2-OE1 3.24Å; R185-E187 PolarHBondContact NH2-OE1 3.06Å; R185-E187 IonicContact NH2-OE2 3.3Å; R185-V206 HydrophobicContact CG-CB 3.73Å; R185-V206 HydrophobicContact CG-CG1 4.22Å; R185-V206 PolarHBondContact N-O 2.91Å; R185-V206 PolarHBondContact O-N 2.93Å; R185-E283 IonicContact NH2-OE1 2.75Å; R185-E283 PolarHBondContact NH2-OE1 2.9Å
186	I	97.7	Very high	85.4	Confident	3 Å²	3	44.4 Å²	44.4	2%	0.015	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	126.9	174.7	-66	162.2	0	0	0	107.7	Y188 L205 M220 F288 C311 A313 T330 R332	I186-Y188 HydrophobicContact CG2-CD1 4.37Å; I186-Y188 HydrophobicContact CG2-CE1 3.94Å; I186-Y188 HydrophobicContact CG2-CE2 4.45Å; I186-L205 HydrophobicContact CG1-CD1 3.99Å; I186-M220 HydrophobicContact CD1-CE 4.2Å; I186-M220 HydrophobicContact CG1-CE 4.25Å; I186-F288 HydrophobicContact CG2-CE1 3.89Å; I186-F288 HydrophobicContact CG2-CZ 3.71Å; I186-C311 HydrophobicContact CD1-CB 3.96Å; I186-C311 WeakPolarHBondContact CD1-O 3.15Å; I186-C311 HydrophobicContact CG2-CB 4.31Å; I186-A313 HydrophobicContact CD1-CB 4.37Å; I186-A313 HydrophobicContact CG1-CB 4.43Å; I186-T330 HydrophobicContact CD1-CG2 3.86Å; I186-T330 HydrophobicContact CG1-CG2 3.76Å; I186-R332 HydrophobicContact CB-CB 4.02Å; I186-R332 HydrophobicContact CD1-CB 4.35Å; I186-R332 HydrophobicContact CG2-CB 4.3Å; I186-R332 WeakPolarHBondContact O-CD 2.99Å; I186-R332 PolarHBondContact O-NH1 3.09Å
187	E	97.5	Very high	87.3	Confident	68 Å²	68	44.2 Å²	44.2	32%	0.318	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	130.4	170.6	-65.3	-169.7	135.2	0	0	109.8	R185 G203 H204 V206	R185-E187 IonicContact CZ-OE1 2.7Å; R185-E187 VanDerWaalsContact CZ-OE1 3.22Å; R185-E187 IonicContact NH1-OE1 3.22Å; R185-E187 PolarHBondContact NH1-OE1 3.45Å; R185-E187 IonicContact NH2-OE1 3.24Å; R185-E187 PolarHBondContact NH2-OE1 3.06Å; R185-E187 IonicContact NH2-OE2 3.3Å; E187-G203 CarbonylContact O-C 3.52Å; E187-G203 WeakPolarHBondContact O-CA 3.44Å; E187-H204 PolarHBondContact N-O 2.88Å; E187-H204 PolarHBondContact O-N 3.16Å; E187-V206 HydrophobicContact CG-CG2 4.28Å; E187-V206 WeakPolarHBondContact OE2-CG2 3.4Å
188	Y	97.4	Very high	89.2	Confident	17 Å²	17	46 Å²	46	7%	0.067	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	148.8	173.6	-66.4	-58.2	0	0	0	109.3	I186 H190 P193 L201 F288 C311 R332 F334	I186-Y188 HydrophobicContact CG2-CD1 4.37Å; I186-Y188 HydrophobicContact CG2-CE1 3.94Å; I186-Y188 HydrophobicContact CG2-CE2 4.45Å; Y188-H190 PolarHBondContact O-N 3.15Å; Y188-P193 HydrophobicContact CD2-CB 3.38Å; Y188-P193 HydrophobicContact CD2-CG 4.08Å; Y188-P193 HydrophobicContact CE2-CB 4.07Å; Y188-P193 HydrophobicContact CG-CB 3.96Å; Y188-L201 HydrophobicContact CD1-CD1 3.71Å; Y188-L201 HydrophobicContact CD1-CG 4.4Å; Y188-L201 HydrophobicContact CE1-CD1 3.86Å; Y188-L201 HydrophobicContact CE1-CD2 4.13Å; Y188-L201 HydrophobicContact CE1-CG 4.27Å; Y188-F288 HydrophobicContact CD1-CE2 4.43Å; Y188-F288 HydrophobicContact CD1-CZ 4.05Å; Y188-F288 HydrophobicContact CE1-CE2 4.25Å; Y188-F288 AromaticContact CE1-CZ 3.98Å; Y188-F288 HydrophobicContact CE1-CZ 3.98Å; Y188-C311 HydrophobicContact CE1-CB 4.13Å; Y188-C311 VanDerWaalsContact OH-CB 3.22Å; Y188-C311 WeakPolarHBondContact OH-CB 3.38Å; Y188-C311 PolarHBondContact OH-N 3.3Å; Y188-C311 PolarHBondContact OH-SG 3.36Å; Y188-R332 HydrophobicContact CD2-CG 4.32Å; Y188-R332 HydrophobicContact CE2-CB 3.96Å; Y188-R332 HydrophobicContact CE2-CG 3.7Å; Y188-R332 PolarHBondContact OH-O 3.11Å; Y188-F334 HydrophobicContact CE1-CD1 4.4Å; Y188-F334 HydrophobicContact CE2-CB 4.08Å; Y188-F334 AromaticContact CZ-CD1 3.91Å; Y188-F334 WeakPolarHBondContact OH-CD1 3.44Å
189	D	94.2	Very high	90.9	Very high	87 Å²	87	47.9 Å²	47.9	47%	0.465	25%	0.249	S	C	.	.	S	Bend	trans	-63.6	-27.1	178.3	-72.5	2.2	0	0	0	112.3	Y195 K202 G203 H204	D189-Y195 PolarHBondContact N-OH 3.26Å; D189-K202 PolarHBondContact N-O 3.3Å; D189-K202 WeakPolarHBondContact OD2-CB 3.31Å; D189-G203 WeakPolarHBondContact OD1-CA 3.29Å; D189-H204 IonicContact OD1-ND1 2.68Å
190	H	91.7	Very high	92.5	Very high	46 Å²	46	45.1 Å²	45.1	21%	0.213	23%	0.234	C	C	.	.	S	Bend	trans	-100.8	135.5	176.4	-62.5	172.2	0	0	0	111.7	Y188 P192 P193 V194 Y195 I524	Y188-H190 PolarHBondContact O-N 3.15Å; H190-P192 CarbonylContact C-O 3.42Å; H190-P192 CarbonylContact O-C 3.19Å; H190-P193 VanDerWaalsContact O-CA 3.27Å; H190-P193 WeakPolarHBondContact O-CA 3.37Å; H190-V194 PolarHBondContact ND1-O 3.07Å; H190-V194 VanDerWaalsContact ND1-O 3.09Å; H190-Y195 HydrophobicContact CB-CE1 4.44Å; H190-Y195 HydrophobicContact CB-CE2 4.24Å; H190-Y195 AromaticContact CE1-CE1 3.72Å; H190-Y195 AromaticContact CG-CE1 3.88Å; H190-Y195 AromaticContact CG-CZ 3.78Å; H190-Y195 PolarHBondContact N-OH 3.4Å; H190-Y195 AromaticContact ND1-CD1 3.78Å; H190-Y195 AromaticContact ND1-CE1 3.38Å; H190-Y195 WeakPolarHBondContact ND1-CE1 3.32Å; H190-Y195 AromaticContact ND1-CZ 3.67Å; H190-I524 HydrophobicContact CB-CD1 4.3Å; H190-I524 HydrophobicContact CB-CG1 4.01Å
191	N	90.1	Very high	93.5	Very high	115 Å²	115	43.6 Å²	43.6	62%	0.615	23%	0.226	S	C	*	.	S	Bend	trans	-131.4	110.7	169.5	-171.2	25.9	0	0	0	111
192	P	93	Very high	94.2	Very high	22 Å²	22	47.9 Å²	47.9	14%	0.143	25%	0.245	C	C	.	.	S	Bend	cis	-67.1	154.9	4.3	29.5	-36.3	0	0	0	112.8	H190 V194 I524 V540 H568	H190-P192 CarbonylContact C-O 3.42Å; H190-P192 CarbonylContact O-C 3.19Å; P192-V194 VanDerWaalsContact C-N 3.29Å; P192-V194 HydrophobicContact CB-CG2 4.15Å; P192-V194 HydrophobicContact CG-CG2 4.03Å; P192-V194 PolarHBondContact O-N 3.46Å; P192-I524 HydrophobicContact CG-CD1 4.23Å; P192-I524 WeakPolarHBondContact O-CD1 3.49Å; P192-V540 HydrophobicContact CG-CB 4.5Å; P192-V540 HydrophobicContact CG-CG1 3.74Å; P192-H568 WeakPolarHBondContact CB-NE2 3.25Å
193	P	94.9	Very high	94.8	Very high	16 Å²	16	42 Å²	42	10%	0.104	22%	0.218	C	C	.	.			trans	-77.5	80.9	-176.6	32.5	-36	0	0	0	110.6	Y188 H190 Y195 F334 T335	Y188-P193 HydrophobicContact CD2-CB 3.38Å; Y188-P193 HydrophobicContact CD2-CG 4.08Å; Y188-P193 HydrophobicContact CE2-CB 4.07Å; Y188-P193 HydrophobicContact CG-CB 3.96Å; H190-P193 VanDerWaalsContact O-CA 3.27Å; H190-P193 WeakPolarHBondContact O-CA 3.37Å; P193-Y195 HydrophobicContact CB-CE2 4.22Å; P193-F334 HydrophobicContact CB-CB 3.88Å; P193-F334 HydrophobicContact CG-CB 4.37Å; P193-F334 CarbonylContact O-C 3.57Å; P193-F334 WeakPolarHBondContact O-CA 3.33Å; P193-F334 WeakPolarHBondContact O-CB 3.4Å; P193-T335 PolarHBondContact O-N 2.62Å
194	V	96.1	Very high	95.2	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.006	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	130.7	-179.1	-176	0	0	0	0	109	H190 P192 T335 L337 I524 V540 H568	H190-V194 PolarHBondContact ND1-O 3.07Å; H190-V194 VanDerWaalsContact ND1-O 3.09Å; P192-V194 VanDerWaalsContact C-N 3.29Å; P192-V194 HydrophobicContact CB-CG2 4.15Å; P192-V194 HydrophobicContact CG-CG2 4.03Å; P192-V194 PolarHBondContact O-N 3.46Å; V194-T335 WeakPolarHBondContact CA-O 3.2Å; V194-L337 HydrophobicContact CG1-CB 3.96Å; V194-L337 HydrophobicContact CG1-CD2 4.46Å; V194-I524 HydrophobicContact CB-CG2 3.71Å; V194-I524 HydrophobicContact CG1-CG2 3.97Å; V194-V540 HydrophobicContact CG2-CG1 3.87Å; V194-H568 HydrophobicContact CG2-CB 3.63Å
195	Y	96.1	Very high	95.5	Very high	8 Å²	8	40.1 Å²	40.1	3%	0.031	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	155	-174.4	-65.5	-89.9	0	0	0	110.9	D189 H190 P193 L201 F334 T335 I336 L337	D189-Y195 PolarHBondContact N-OH 3.26Å; H190-Y195 HydrophobicContact CB-CE1 4.44Å; H190-Y195 HydrophobicContact CB-CE2 4.24Å; H190-Y195 AromaticContact CE1-CE1 3.72Å; H190-Y195 AromaticContact CG-CE1 3.88Å; H190-Y195 AromaticContact CG-CZ 3.78Å; H190-Y195 PolarHBondContact N-OH 3.4Å; H190-Y195 AromaticContact ND1-CD1 3.78Å; H190-Y195 AromaticContact ND1-CE1 3.38Å; H190-Y195 WeakPolarHBondContact ND1-CE1 3.32Å; H190-Y195 AromaticContact ND1-CZ 3.67Å; P193-Y195 HydrophobicContact CB-CE2 4.22Å; Y195-L201 HydrophobicContact CD1-CD1 4.08Å; Y195-L201 HydrophobicContact CD2-CD1 3.58Å; Y195-L201 HydrophobicContact CE1-CD1 3.78Å; Y195-L201 HydrophobicContact CE2-CD1 3.24Å; Y195-L201 HydrophobicContact CG-CD1 3.99Å; Y195-F334 HydrophobicContact CD2-CB 4.29Å; Y195-F334 HydrophobicContact CD2-CD2 4.03Å; Y195-F334 HydrophobicContact CD2-CG 4.45Å; Y195-F334 HydrophobicContact CE2-CB 4.5Å; Y195-T335 PolarHBondContact N-O 3.34Å; Y195-I336 WeakPolarHBondContact O-CA 3.5Å; Y195-L337 PolarHBondContact O-N 2.95Å
196	F	95.3	Very high	95.5	Very high	24 Å²	24	37.2 Å²	37.2	11%	0.105	20%	0.198	C	C	.	.			trans	-97.7	147.1	174.4	-75	-94.5	0	0	0	110.3	K199 L337 I524 P527 L528	F196-K199 HydrophobicContact CB-CG 4Å; F196-K199 WeakPolarHBondContact O-CB 3.41Å; F196-K199 PolarHBondContact O-N 3.39Å; F196-L337 VanDerWaalsContact CD1-O 3.22Å; F196-L337 WeakPolarHBondContact CD1-O 3.33Å; F196-L337 HydrophobicContact CE1-CB 4.29Å; F196-L337 HydrophobicContact CE1-CD2 4.03Å; F196-L337 HydrophobicContact CE1-CG 4.06Å; F196-L337 HydrophobicContact CE2-CD2 4.14Å; F196-L337 HydrophobicContact CZ-CB 4.29Å; F196-L337 HydrophobicContact CZ-CD2 3.5Å; F196-L337 HydrophobicContact CZ-CG 4.03Å; F196-I524 WeakPolarHBondContact CE2-O 3.48Å; F196-P527 HydrophobicContact CD2-CB 4.05Å; F196-P527 HydrophobicContact CD2-CG 3.77Å; F196-P527 HydrophobicContact CE2-CB 4.41Å; F196-P527 HydrophobicContact CE2-CG 4.25Å; F196-P527 HydrophobicContact CG-CB 4.11Å; F196-P527 HydrophobicContact CG-CG 4.22Å; F196-L528 HydrophobicContact CE1-CD1 3.81Å; F196-L528 HydrophobicContact CE1-CD2 3.8Å; F196-L528 HydrophobicContact CE1-CG 3.53Å; F196-L528 HydrophobicContact CZ-CD1 3.53Å; F196-L528 HydrophobicContact CZ-CD2 4.27Å; F196-L528 HydrophobicContact CZ-CG 3.48Å; F196-L528 VanDerWaalsContact CZ-CG 3.48Å
197	P	95.4	Very high	95.3	Very high	21 Å²	21	37.1 Å²	37.1	14%	0.136	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	149.3	170	-21	31.1	0	0	0	111.9	K199 P293 P294 C296 I336 L337 N338	P197-K199 PolarHBondContact O-N 3.49Å; P197-P293 WeakPolarHBondContact CB-O 3.24Å; P197-P294 VanDerWaalsContact CB-O 3.27Å; P197-P294 WeakPolarHBondContact CB-O 3.38Å; P197-C296 HydrophobicContact CB-CB 4.11Å; P197-C296 HydrophobicContact CG-CB 4.14Å; P197-C296 WeakPolarHBondContact CG-O 3.38Å; P197-I336 HydrophobicContact CG-CG2 3.75Å; P197-L337 WeakPolarHBondContact CD-O 2.81Å; P197-N338 HydrophobicContact CG-CB 3.53Å
198	G	95.2	Very high	95	Very high	44 Å²	44	35 Å²	35	45%	0.454	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.4	-2.1	178.8	0	0	0	0	0	114.8	L292 P293	G198-L292 WeakPolarHBondContact CA-O 3.49Å; G198-L292 PolarHBondContact N-O 3.1Å; G198-P293 PolarHBondContact N-O 2.87Å; G198-P293 VanDerWaalsContact N-O 3.09Å
199	K	94.4	Very high	94.5	Very high	110 Å²	110	34.4 Å²	34.4	48%	0.478	19%	0.186	S	C	.	.	S	Bend	trans	-100.1	163.7	177.1	-58.9	-59.4	-175.3	178.2	0	111.5	F196 P197 L292	F196-K199 HydrophobicContact CB-CG 4Å; F196-K199 WeakPolarHBondContact O-CB 3.41Å; F196-K199 PolarHBondContact O-N 3.39Å; P197-K199 PolarHBondContact O-N 3.49Å; K199-L292 WeakPolarHBondContact O-CB 3.42Å; K199-L292 WeakPolarHBondContact O-CG 3.45Å; K199-L292 PolarHBondContact O-N 3.42Å
200	S	95.4	Very high	94.1	Very high	37 Å²	37	31.8 Å²	31.8	26%	0.259	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	132.4	172.9	-59.9	0	0	0	0	111.3	E289 F290 H291	S200-E289 WeakPolarHBondContact CB-OE1 3.35Å; S200-E289 PolarHBondContact OG-OE1 3.19Å; S200-F290 CarbonylContact C-O 3.57Å; S200-F290 WeakPolarHBondContact CA-O 3.37Å; S200-H291 PolarHBondContact OG-CD2 2.79Å; S200-H291 VanDerWaalsContact OG-CD2 3.27Å; S200-H291 PolarHBondContact OG-NE2 2.85Å
201	L	96.7	Very high	93.8	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	116.3	163	174.5	66.4	0	0	0	108.2	Y188 Y195 E289 F290 L292 C311 F334	Y188-L201 HydrophobicContact CD1-CD1 3.71Å; Y188-L201 HydrophobicContact CD1-CG 4.4Å; Y188-L201 HydrophobicContact CE1-CD1 3.86Å; Y188-L201 HydrophobicContact CE1-CD2 4.13Å; Y188-L201 HydrophobicContact CE1-CG 4.27Å; Y195-L201 HydrophobicContact CD1-CD1 4.08Å; Y195-L201 HydrophobicContact CD2-CD1 3.58Å; Y195-L201 HydrophobicContact CE1-CD1 3.78Å; Y195-L201 HydrophobicContact CE2-CD1 3.24Å; Y195-L201 HydrophobicContact CG-CD1 3.99Å; L201-E289 CarbonylContact O-C 3.58Å; L201-E289 WeakPolarHBondContact O-CA 3.5Å; L201-F290 PolarHBondContact N-O 3.08Å; L201-F290 PolarHBondContact O-N 2.95Å; L201-L292 HydrophobicContact CB-CD1 4.22Å; L201-L292 HydrophobicContact CB-CD2 4.32Å; L201-L292 HydrophobicContact CB-CG 4.17Å; L201-C311 WeakPolarHBondContact CD2-SG 3.23Å; L201-F334 HydrophobicContact CD1-CG 4.49Å; L201-F334 HydrophobicContact CD2-CD1 4Å; L201-F334 HydrophobicContact CD2-CE1 3.49Å; L201-F334 VanDerWaalsContact CD2-CE1 3.49Å; L201-F334 HydrophobicContact CD2-CE2 4.18Å; L201-F334 HydrophobicContact CD2-CZ 3.59Å
202	K	96.6	Very high	93.3	Very high	90 Å²	90	32.2 Å²	32.2	39%	0.391	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	151.6	-179.9	-68	177.4	176.8	-179.2	0	111.1	D189 E289	D189-K202 PolarHBondContact N-O 3.3Å; D189-K202 WeakPolarHBondContact OD2-CB 3.31Å; K202-E289 WeakPolarHBondContact CE-OE1 3.27Å; K202-E289 VanDerWaalsContact CE-OE2 3.29Å; K202-E289 WeakPolarHBondContact CE-OE2 3.47Å; K202-E289 HydrophobicContact CG-CB 4.15Å; K202-E289 HydrophobicContact CG-CG 3.83Å; K202-E289 IonicContact NZ-OE1 2.82Å; K202-E289 IonicContact NZ-OE2 2.67Å
203	G	97.8	Very high	92.5	Very high	2 Å²	2	31.2 Å²	31.2	2%	0.021	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	178.3	-170.7	180	0	0	0	0	0	112.8	E187 D189 P287 F288	E187-G203 CarbonylContact O-C 3.52Å; E187-G203 WeakPolarHBondContact O-CA 3.44Å; D189-G203 WeakPolarHBondContact OD1-CA 3.29Å; G203-P287 CarbonylContact O-C 3.52Å; G203-P287 WeakPolarHBondContact O-CA 2.91Å; G203-F288 VanDerWaalsContact C-CE1 3.42Å; G203-F288 PolarHBondContact N-O 2.86Å; G203-F288 VanDerWaalsContact N-O 3.15Å; G203-F288 PolarHBondContact O-N 2.84Å
204	H	97.9	Very high	91.7	Very high	70 Å²	70	32.9 Å²	32.9	32%	0.324	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	136.9	-179.2	-62.2	78.9	0	0	0	110.5	E187 D189 V206 S285 F286 F288	E187-H204 PolarHBondContact N-O 2.88Å; E187-H204 PolarHBondContact O-N 3.16Å; D189-H204 IonicContact OD1-ND1 2.68Å; H204-V206 HydrophobicContact CB-CG2 4.49Å; H204-S285 WeakPolarHBondContact CB-OG 3.09Å; H204-S285 PolarHBondContact CD2-OG 3.39Å; H204-F286 CarbonylContact C-O 3.49Å; H204-F286 WeakPolarHBondContact CA-O 3.35Å; H204-F288 VanDerWaalsContact N-CE1 3.35Å
205	L	97.3	Very high	91	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.005	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	118	164	179.1	65.7	0	0	0	108.1	L184 I186 I207 V218 M220 L260 S285 F286 A313 T330	L184-L205 HydrophobicContact CD1-CD1 3.78Å; L184-L205 HydrophobicContact CD1-CD2 4.36Å; L184-L205 HydrophobicContact CD1-CG 4.22Å; L184-L205 HydrophobicContact CG-CD1 4.41Å; I186-L205 HydrophobicContact CG1-CD1 3.99Å; L205-I207 HydrophobicContact CD2-CD1 4.41Å; L205-I207 HydrophobicContact CG-CG1 4.3Å; L205-V218 HydrophobicContact CD2-CG1 3.27Å; L205-M220 HydrophobicContact CB-SD 4.28Å; L205-M220 HydrophobicContact CD1-SD 4.31Å; L205-M220 HydrophobicContact CD2-SD 4.12Å; L205-M220 HydrophobicContact CG-SD 4.48Å; L205-L260 HydrophobicContact CB-CD1 3.95Å; L205-L260 HydrophobicContact CD2-CD1 3.98Å; L205-S285 WeakPolarHBondContact O-CA 3.32Å; L205-F286 HydrophobicContact CB-CB 4.49Å; L205-F286 PolarHBondContact N-O 3.02Å; L205-F286 PolarHBondContact O-N 2.96Å; L205-A313 HydrophobicContact CD1-CB 3.44Å; L205-A313 VanDerWaalsContact CD1-CB 3.44Å; L205-A313 HydrophobicContact CD2-CB 3.79Å; L205-A313 HydrophobicContact CG-CB 4.26Å; L205-T330 HydrophobicContact CD1-CG2 4.18Å
206	V	95.5	Very high	90.4	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	127.3	179.3	177.6	0	0	0	0	109.8	R185 E187 H204 V208 E283 H284	R185-V206 HydrophobicContact CG-CB 3.73Å; R185-V206 HydrophobicContact CG-CG1 4.22Å; R185-V206 PolarHBondContact N-O 2.91Å; R185-V206 PolarHBondContact O-N 2.93Å; E187-V206 HydrophobicContact CG-CG2 4.28Å; E187-V206 WeakPolarHBondContact OE2-CG2 3.4Å; H204-V206 HydrophobicContact CB-CG2 4.49Å; V206-V208 HydrophobicContact CG1-CG2 4.25Å; V206-E283 HydrophobicContact CG1-CG 3.42Å; V206-E283 VanDerWaalsContact CG1-CG 3.42Å; V206-E283 WeakPolarHBondContact CG1-OE1 3.41Å; V206-H284 WeakPolarHBondContact CA-O 3.38Å
207	I	92.1	Very high	90	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.005	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	115.2	179.9	-45.3	-174.2	0	0	0	108.1	V181 L184 L205 M209 V218 H284 F286 M315	V181-I207 HydrophobicContact CG1-CG2 3.88Å; L184-I207 HydrophobicContact CD1-CD1 4.29Å; L184-I207 HydrophobicContact CD1-CG1 3.79Å; L184-I207 HydrophobicContact CD1-CG2 4.49Å; L205-I207 HydrophobicContact CD2-CD1 4.41Å; L205-I207 HydrophobicContact CG-CG1 4.3Å; I207-M209 HydrophobicContact CG2-CG 4.15Å; I207-M209 HydrophobicContact CG2-SD 3.53Å; I207-M209 VanDerWaalsContact CG2-SD 3.53Å; I207-V218 HydrophobicContact CD1-CG1 4.42Å; I207-V218 HydrophobicContact CD1-CG2 4.23Å; I207-H284 HydrophobicContact CB-CB 4.48Å; I207-H284 PolarHBondContact N-O 2.87Å; I207-H284 PolarHBondContact O-N 2.87Å; I207-F286 HydrophobicContact CD1-CD2 4.04Å; I207-F286 HydrophobicContact CD1-CE2 3.76Å; I207-F286 HydrophobicContact CG1-CD2 4.32Å; I207-F286 HydrophobicContact CG1-CE2 4.25Å; I207-M315 HydrophobicContact CD1-SD 4.4Å; I207-M315 HydrophobicContact CG2-SD 4.36Å
208	V	91.3	Very high	89.8	Confident	24 Å²	24	31.7 Å²	31.7	15%	0.145	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	119.7	177.6	-174.8	0	0	0	0	109.1	V181 E182 E183 V206 E283	V181-V208 CarbonylContact C-O 3.6Å; E182-V208 HydrophobicContact CB-CG1 4.34Å; E182-V208 PolarHBondContact N-O 2.72Å; E183-V208 HydrophobicContact CB-CB 3.87Å; E183-V208 HydrophobicContact CB-CG2 3.93Å; E183-V208 PolarHBondContact N-O 2.93Å; E183-V208 PolarHBondContact O-N 2.91Å; V206-V208 HydrophobicContact CG1-CG2 4.25Å; V208-E283 HydrophobicContact CG2-CG 4.33Å
209	M	87.5	Confident	89.8	Confident	3 Å²	3	32.2 Å²	32.2	2%	0.015	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	125.3	-172.2	-58.6	-63.3	-64.9	0	0	110.6	M180 V181 I207 K211 C213 L278 P281 G282	M180-M209 CarbonylContact O-C 3.57Å; M180-M209 WeakPolarHBondContact O-CA 3.29Å; V181-M209 HydrophobicContact CB-SD 4.03Å; V181-M209 HydrophobicContact CG1-SD 4.04Å; V181-M209 HydrophobicContact CG2-CE 3.72Å; V181-M209 HydrophobicContact CG2-SD 3.43Å; V181-M209 WeakPolarHBondContact CG2-SD 3.28Å; I207-M209 HydrophobicContact CG2-CG 4.15Å; I207-M209 HydrophobicContact CG2-SD 3.53Å; I207-M209 VanDerWaalsContact CG2-SD 3.53Å; M209-K211 VanDerWaalsContact C-N 3.31Å; M209-C213 HydrophobicContact CE-CB 3.28Å; M209-L278 HydrophobicContact CE-CD1 4.28Å; M209-L278 HydrophobicContact CG-CD1 3.97Å; M209-L278 HydrophobicContact SD-CD1 4.04Å; M209-P281 CarbonylContact O-C 3.55Å; M209-P281 WeakPolarHBondContact O-CA 3.38Å; M209-G282 PolarHBondContact N-O 2.92Å; M209-G282 PolarHBondContact O-N 3.38Å
210	S	86.9	Confident	89.9	Confident	33 Å²	33	27 Å²	27	23%	0.231	14%	0.142	C	C	.	.	S	Bend	trans	-73.5	-28	172.3	68.1	0	0	0	0	112	V179 M180 E182	V179-S210 PolarHBondContact O-OG 2.62Å; M180-S210 WeakPolarHBondContact CA-OG 3.5Å; M180-S210 PolarHBondContact O-N 3Å; M180-S210 PolarHBondContact O-OG 2.79Å; E182-S210 WeakPolarHBondContact OE1-CB 3.27Å
211	K	83.7	Confident	90.1	Very high	130 Å²	130	26.7 Å²	26.7	57%	0.565	14%	0.136	S	C	*	.	S	Bend	trans	-145.1	152.7	-176.5	-65.9	-177.3	-176.3	174.4	0	111.1	M180 M209 C213	M180-K211 HydrophobicContact CG-CB 4.43Å; M209-K211 VanDerWaalsContact C-N 3.31Å; K211-C213 PolarHBondContact O-N 2.7Å
212	A	80.1	Confident	90.2	Very high	39 Å²	39	26.7 Å²	26.7	32%	0.322	14%	0.136	S	C	.	.			trans	-56.8	136.6	172	0	0	0	0	0	111	F277 L278 Q279	A212-F277 HydrophobicContact CB-CE2 4.16Å; A212-F277 HydrophobicContact CB-CZ 3.93Å; A212-L278 CarbonylContact C-O 3.52Å; A212-L278 WeakPolarHBondContact CA-O 3.38Å; A212-Q279 VanDerWaalsContact CB-O 3.24Å; A212-Q279 WeakPolarHBondContact CB-O 3.32Å
213	C	76.7	Confident	90.2	Very high	2 Å²	2	23.9 Å²	23.9	1%	0.014	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	141.1	-169.1	179.4	0	0	0	0	111.6	M209 K211 L278 R317	M209-C213 HydrophobicContact CE-CB 3.28Å; K211-C213 PolarHBondContact O-N 2.7Å; C213-L278 PolarHBondContact N-O 3.46Å; C213-L278 PolarHBondContact O-N 3.25Å; C213-R317 PolarHBondContact SG-NE 3.31Å; C213-R317 PolarHBondContact SG-NH1 3.48Å
214	N	78.1	Confident	90.3	Very high	50 Å²	50	23.8 Å²	23.8	27%	0.267	12%	0.124	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	129.6	167.6	-72.1	-44.9	0	0	0	109.8	K275 L276 F277 R317	N214-K275 HydrophobicContact CB-CB 3.97Å; N214-K275 HydrophobicContact CB-CD 3.85Å; N214-L276 WeakPolarHBondContact CA-O 3.33Å; N214-F277 HydrophobicContact CB-CD2 4.5Å; N214-F277 WeakPolarHBondContact OD1-CA 3.35Å; N214-F277 VanDerWaalsContact OD1-CB 3.23Å; N214-F277 WeakPolarHBondContact OD1-CB 3.1Å; N214-F277 WeakPolarHBondContact OD1-CD2 3.27Å; N214-F277 WeakPolarHBondContact OD1-CG 3.35Å; N214-R317 VanDerWaalsContact O-CD 3.3Å; N214-R317 WeakPolarHBondContact O-CD 3.48Å; N214-R317 WeakPolarHBondContact O-CG 3.41Å; N214-R317 PolarHBondContact O-NE 3.14Å
215	V	81.1	Confident	90.3	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	132.1	173.5	-180	0	0	0	0	107.7	V218 L276 L278 M315	V215-V218 HydrophobicContact CG1-CG2 3.65Å; V215-L276 PolarHBondContact N-O 3.07Å; V215-L276 PolarHBondContact O-N 2.74Å; V215-L278 HydrophobicContact CG2-CD1 3.86Å; V215-L278 HydrophobicContact CG2-CG 4.26Å; V215-M315 HydrophobicContact CG1-CG 3.58Å; V215-M315 HydrophobicContact CG1-SD 4.14Å; V215-M315 HydrophobicContact CG2-SD 4.08Å
216	D	83	Confident	90.3	Very high	16 Å²	16	22.2 Å²	22.2	9%	0.086	12%	0.117	C	C	.	.	S	Bend	trans	-82.5	-45	-176.6	-56.1	-40.2	0	0	0	111.5	K275 Y316 R317 H318	D216-K275 WeakPolarHBondContact OD1-CD 3.48Å; D216-K275 WeakPolarHBondContact OD1-CE 3.37Å; D216-K275 VanDerWaalsContact OD1-CG 3.3Å; D216-K275 WeakPolarHBondContact OD1-CG 3.48Å; D216-K275 IonicContact OD1-NZ 3.39Å; D216-Y316 PolarHBondContact N-O 3.18Å; D216-R317 VanDerWaalsContact OD2-C 3.31Å; D216-R317 WeakPolarHBondContact OD2-CA 3.33Å; D216-H318 IonicContact OD2-CE1 3.69Å; D216-H318 IonicContact OD2-CG 2.68Å; D216-H318 PolarHBondContact OD2-N 2.99Å; D216-H318 IonicContact OD2-ND1 3.66Å; D216-H318 PolarHBondContact OD2-ND1 3.27Å
217	S	87.4	Confident	90.4	Very high	12 Å²	12	25.5 Å²	25.5	8%	0.084	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	150.3	176.4	61.2	0	0	0	0	111.9	V261 Y316	S217-V261 VanDerWaalsContact CA-O 3.26Å; S217-V261 WeakPolarHBondContact CA-O 3.02Å; S217-V261 WeakPolarHBondContact CB-O 3.41Å; S217-Y316 PolarHBondContact N-O 3.5Å; S217-Y316 PolarHBondContact O-N 3.48Å
218	V	91.7	Very high	90.6	Very high	1 Å²	1	25.5 Å²	25.5	1%	0.006	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	115.3	173.8	-177.4	0	0	0	0	107.6	L205 I207 V215 L260 V261 M315	L205-V218 HydrophobicContact CD2-CG1 3.27Å; I207-V218 HydrophobicContact CD1-CG1 4.42Å; I207-V218 HydrophobicContact CD1-CG2 4.23Å; V215-V218 HydrophobicContact CG1-CG2 3.65Å; V218-L260 HydrophobicContact CB-CB 4.44Å; V218-L260 HydrophobicContact CG1-CB 4.33Å; V218-L260 HydrophobicContact CG1-CD1 4.41Å; V218-L260 PolarHBondContact O-N 3.1Å; V218-V261 HydrophobicContact CB-CB 3.84Å; V218-V261 HydrophobicContact CB-CG2 3.85Å; V218-V261 HydrophobicContact CG2-CB 3.93Å; V218-V261 HydrophobicContact CG2-CG2 3.82Å; V218-V261 PolarHBondContact N-O 2.95Å; V218-V261 PolarHBondContact O-N 3.47Å; V218-M315 HydrophobicContact CG2-CG 4.25Å
219	K	94.8	Very high	90.8	Very high	56 Å²	56	30.6 Å²	30.6	24%	0.243	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	136.1	-171.6	-69.5	-179.4	-177.1	179.4	0	109.9	F221 F257 E259 A313 E314 Y316	K219-F221 HydrophobicContact CB-CE2 3.81Å; K219-F221 HydrophobicContact CB-CZ 4.22Å; K219-F257 HydrophobicContact CB-CE2 3.83Å; K219-F257 HydrophobicContact CD-CE2 3.87Å; K219-F257 HydrophobicContact CD-CZ 4.25Å; K219-F257 HydrophobicContact CG-CE2 3.74Å; K219-F257 HydrophobicContact CG-CZ 4.21Å; K219-E259 WeakPolarHBondContact CE-OE1 3.07Å; K219-E259 HydrophobicContact CG-CG 4.31Å; K219-A313 CarbonylContact O-C 3.54Å; K219-A313 VanDerWaalsContact O-CA 3.27Å; K219-A313 WeakPolarHBondContact O-CA 3.34Å; K219-E314 HydrophobicContact CB-CB 4.45Å; K219-E314 PolarHBondContact N-O 3.12Å; K219-E314 PolarHBondContact O-N 3.46Å; K219-Y316 HydrophobicContact CD-CD2 4.49Å; K219-Y316 HydrophobicContact CD-CE2 4.19Å
220	M	97.2	Very high	91.1	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	136.2	174.3	-78.6	-63.4	-65	0	0	110	I186 L205 F257 T258 L260 F288 F290 C311 M312 A313	I186-M220 HydrophobicContact CD1-CE 4.2Å; I186-M220 HydrophobicContact CG1-CE 4.25Å; L205-M220 HydrophobicContact CB-SD 4.28Å; L205-M220 HydrophobicContact CD1-SD 4.31Å; L205-M220 HydrophobicContact CD2-SD 4.12Å; L205-M220 HydrophobicContact CG-SD 4.48Å; M220-F257 CarbonylContact O-C 3.56Å; M220-F257 WeakPolarHBondContact O-CA 3.44Å; M220-T258 HydrophobicContact CB-CG2 3.68Å; M220-T258 PolarHBondContact N-O 3.29Å; M220-T258 PolarHBondContact O-N 2.81Å; M220-L260 HydrophobicContact CB-CG 4.43Å; M220-L260 HydrophobicContact CG-CD1 3.42Å; M220-L260 VanDerWaalsContact CG-CD1 3.42Å; M220-L260 HydrophobicContact CG-CD2 4.37Å; M220-L260 HydrophobicContact CG-CG 3.79Å; M220-F288 HydrophobicContact CE-CD1 3.69Å; M220-F288 HydrophobicContact CE-CD2 4.14Å; M220-F288 HydrophobicContact CE-CE1 3.72Å; M220-F288 HydrophobicContact CE-CE2 4.18Å; M220-F288 HydrophobicContact CE-CG 3.91Å; M220-F288 HydrophobicContact CE-CZ 3.98Å; M220-F288 HydrophobicContact CG-CB 4.42Å; M220-F290 HydrophobicContact CB-CE2 4.31Å; M220-F290 HydrophobicContact CB-CZ 4.03Å; M220-C311 HydrophobicContact CE-CB 3.86Å; M220-M312 WeakPolarHBondContact CA-O 3.38Å; M220-A313 HydrophobicContact SD-CB 3.32Å; M220-A313 WeakPolarHBondContact SD-CB 3.07Å
221	F	98	Very high	91.2	Very high	31 Å²	31	35.2 Å²	35.2	14%	0.136	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	144.9	175.5	-57.7	-91.2	0	0	0	109.4	K219 H255 F256 F257 C311 M312 E314	K219-F221 HydrophobicContact CB-CE2 3.81Å; K219-F221 HydrophobicContact CB-CZ 4.22Å; F221-H255 AromaticContact CD1-NE2 3.43Å; F221-H255 WeakPolarHBondContact CD1-NE2 3.33Å; F221-F256 CarbonylContact C-O 3.55Å; F221-F256 VanDerWaalsContact CA-O 3.25Å; F221-F256 WeakPolarHBondContact CA-O 3.31Å; F221-F257 HydrophobicContact CD1-CB 4.12Å; F221-F257 AromaticContact CD1-CD2 3.82Å; F221-F257 HydrophobicContact CD1-CD2 3.82Å; F221-F257 HydrophobicContact CD1-CG 4.43Å; F221-F257 HydrophobicContact CE1-CB 4.23Å; F221-F257 AromaticContact CE1-CD2 3.37Å; F221-F257 HydrophobicContact CE1-CD2 3.37Å; F221-F257 HydrophobicContact CE1-CE2 4.1Å; F221-F257 HydrophobicContact CE1-CG 4.13Å; F221-F257 HydrophobicContact CE2-CD2 4.41Å; F221-F257 AromaticContact CZ-CD2 3.71Å; F221-F257 HydrophobicContact CZ-CD2 3.71Å; F221-F257 AromaticContact CZ-CE2 4Å; F221-F257 HydrophobicContact CZ-CE2 4Å; F221-C311 CarbonylContact O-C 3.48Å; F221-C311 WeakPolarHBondContact O-CA 3.39Å; F221-M312 HydrophobicContact CB-CB 4.43Å; F221-M312 HydrophobicContact CD2-CE 3.94Å; F221-M312 HydrophobicContact CE2-CE 4.48Å; F221-M312 HydrophobicContact CG-CE 4.33Å; F221-M312 PolarHBondContact N-O 2.81Å; F221-M312 PolarHBondContact O-N 2.94Å; F221-E314 HydrophobicContact CD2-CG 4.2Å; F221-E314 HydrophobicContact CE2-CB 4.26Å; F221-E314 HydrophobicContact CE2-CG 3.78Å
222	C	98.6	Very high	91.4	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	122.3	169.5	-169.5	0	0	0	0	108.8	F254 F256 F290 C310	C222-F254 HydrophobicContact CB-CE2 4.32Å; C222-F254 WeakPolarHBondContact O-CD2 3.15Å; C222-F254 WeakPolarHBondContact O-CE2 2.91Å; C222-F256 HydrophobicContact CB-CB 4.29Å; C222-F256 HydrophobicContact CB-CD2 4.5Å; C222-F256 PolarHBondContact N-O 2.92Å; C222-F256 PolarHBondContact O-N 2.97Å; C222-F290 HydrophobicContact CB-CB 4.2Å; C222-F290 HydrophobicContact CB-CD1 3.93Å; C222-F290 HydrophobicContact CB-CD2 3.5Å; C222-F290 HydrophobicContact CB-CE1 4.1Å; C222-F290 HydrophobicContact CB-CE2 3.69Å; C222-F290 HydrophobicContact CB-CG 3.61Å; C222-F290 HydrophobicContact CB-CZ 3.97Å; C222-C310 WeakPolarHBondContact CA-O 3.46Å
223	L	98.1	Very high	91.5	Very high	31 Å²	31	33.7 Å²	33.7	16%	0.162	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	135.2	-169.8	178	77.1	0	0	0	109.5	E225 Q252 F254 H255 Y309 C310	L223-E225 HydrophobicContact CD2-CG 4.45Å; L223-E225 WeakPolarHBondContact CD2-OE2 3.34Å; L223-Q252 HydrophobicContact CD1-CG 4.17Å; L223-F254 WeakPolarHBondContact CD1-O 3.32Å; L223-H255 VanDerWaalsContact CD1-ND1 3.31Å; L223-H255 WeakPolarHBondContact CD1-ND1 3.42Å; L223-Y309 CarbonylContact O-C 3.51Å; L223-Y309 VanDerWaalsContact O-CA 3.28Å; L223-Y309 WeakPolarHBondContact O-CA 3.36Å; L223-C310 PolarHBondContact N-O 2.96Å; L223-C310 PolarHBondContact O-N 3.43Å
224	G	98.4	Very high	91.3	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	125.6	169.2	0	0	0	0	0	110.3	F253 F254 R308	G224-F253 PolarHBondContact O-N 3.06Å; G224-F254 PolarHBondContact N-O 3.32Å; G224-F254 PolarHBondContact O-N 2.85Å; G224-R308 WeakPolarHBondContact CA-O 3.44Å
225	E	97.9	Very high	90.8	Very high	37 Å²	37	45.1 Å²	45.1	17%	0.173	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	151.9	-178.7	63.5	-174.8	-137.1	0	0	113.8	L223 K250 E251 F253 R308	L223-E225 HydrophobicContact CD2-CG 4.45Å; L223-E225 WeakPolarHBondContact CD2-OE2 3.34Å; E225-K250 WeakPolarHBondContact OE1-CE 3.06Å; E225-K250 IonicContact OE1-NZ 3.1Å; E225-K250 PolarHBondContact OE1-NZ 3.41Å; E225-K250 WeakPolarHBondContact OE2-CE 3.29Å; E225-K250 IonicContact OE2-NZ 3.01Å; E225-K250 PolarHBondContact OE2-NZ 3.15Å; E225-E251 CarbonylContact C-O 3.55Å; E225-E251 WeakPolarHBondContact CA-O 3.31Å; E225-E251 WeakPolarHBondContact CB-O 3.3Å; E225-F253 VanDerWaalsContact C-CE2 3.49Å; E225-R308 PolarHBondContact N-O 2.89Å; E225-R308 PolarHBondContact O-N 2.76Å
226	A	98.2	Very high	89.8	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	143.9	163.4	0	0	0	0	0	110.6	K250 E251 F253 S306 I307 C467	A226-K250 WeakPolarHBondContact O-CA 3.42Å; A226-E251 HydrophobicContact CB-CB 4.38Å; A226-E251 PolarHBondContact N-O 3.09Å; A226-E251 PolarHBondContact O-N 3.32Å; A226-F253 HydrophobicContact CB-CE2 4.04Å; A226-F253 HydrophobicContact CB-CZ 3.68Å; A226-S306 CarbonylContact C-O 3.55Å; A226-S306 VanDerWaalsContact CA-O 3.23Å; A226-S306 WeakPolarHBondContact CA-O 3.36Å; A226-I307 HydrophobicContact CB-CG1 4.12Å; A226-C467 WeakPolarHBondContact CB-SG 3.29Å
227	F	97	Very high	89	Confident	70 Å²	70	59.3 Å²	59.3	31%	0.307	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	140.7	176.2	-177.8	-105.6	0	0	0	109.8	R229 A249 K250 G305 S306	F227-R229 HydrophobicContact CE1-CB 3.67Å; F227-R229 HydrophobicContact CZ-CB 4.05Å; F227-A249 WeakPolarHBondContact CA-O 3.46Å; F227-A249 VanDerWaalsContact CD2-O 3.24Å; F227-A249 WeakPolarHBondContact CD2-O 3.34Å; F227-K250 HydrophobicContact CD2-CB 4.15Å; F227-G305 CarbonylContact O-C 3.54Å; F227-G305 WeakPolarHBondContact O-CA 3.43Å; F227-S306 PolarHBondContact N-O 3.5Å; F227-S306 PolarHBondContact O-N 3.29Å
228	T	97.1	Very high	87.8	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	146.7	173.1	65.8	0	0	0	0	109.6	S248 A249 S304 Y410 V411 L469 L470	T228-S248 WeakPolarHBondContact O-CA 3.48Å; T228-S248 WeakPolarHBondContact O-CB 3.22Å; T228-A249 PolarHBondContact N-O 3.1Å; T228-A249 PolarHBondContact O-N 3.45Å; T228-A249 VanDerWaalsContact O-N 3.11Å; T228-A249 PolarHBondContact OG1-N 3.06Å; T228-S304 CarbonylContact C-O 3.6Å; T228-S304 VanDerWaalsContact CA-O 3.29Å; T228-S304 WeakPolarHBondContact CA-O 3.43Å; T228-Y410 HydrophobicContact CG2-CD1 3.93Å; T228-V411 WeakPolarHBondContact CB-O 3.49Å; T228-V411 PolarHBondContact OG1-O 3.07Å; T228-L469 HydrophobicContact CG2-CB 3.88Å; T228-L470 HydrophobicContact CG2-CB 4.33Å; T228-L470 HydrophobicContact CG2-CD2 4.35Å
229	R	94.5	Very high	86.8	Confident	132 Å²	132	70.3 Å²	70.3	50%	0.498	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	139.5	176.5	-177	179.1	176.1	-174	1.3	111.1	F227 Y247 S304	F227-R229 HydrophobicContact CE1-CB 3.67Å; F227-R229 HydrophobicContact CZ-CB 4.05Å; R229-Y247 CarbonylContact C-O 3.58Å; R229-Y247 VanDerWaalsContact CA-O 3.25Å; R229-Y247 WeakPolarHBondContact CA-O 3.46Å; R229-S304 PolarHBondContact N-O 3.22Å; R229-S304 WeakPolarHBondContact O-CA 3.36Å
230	K	93.9	Very high	85.3	Confident	61 Å²	61	70.6 Å²	70.6	27%	0.265	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	140.7	168	-166.8	-175.9	-169.8	-172	0	109.3	E232 Y247 W423	K230-E232 HydrophobicContact CD-CG 4.13Å; K230-E232 WeakPolarHBondContact CE-OE1 3.23Å; K230-E232 HydrophobicContact CG-CG 4.27Å; K230-E232 IonicContact NZ-OE1 3.38Å; K230-E232 PolarHBondContact NZ-OE1 3.27Å; K230-Y247 HydrophobicContact CB-CD2 4.39Å; K230-Y247 PolarHBondContact N-O 3.1Å; K230-Y247 PolarHBondContact O-N 3.41Å; K230-W423 HydrophobicContact CB-CD2 4.22Å; K230-W423 HydrophobicContact CB-CE3 4.49Å; K230-W423 HydrophobicContact CB-CH2 4.24Å; K230-W423 HydrophobicContact CB-CZ2 3.92Å; K230-W423 HydrophobicContact CB-CZ3 4.49Å; K230-W423 HydrophobicContact CD-CB 4.19Å; K230-W423 HydrophobicContact CD-CD2 3.88Å; K230-W423 HydrophobicContact CD-CE3 4.32Å; K230-W423 HydrophobicContact CD-CG 3.81Å
231	V	90.4	Very high	83.8	Confident	72 Å²	72	77.2 Å²	77.2	44%	0.436	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	127.9	171.6	-177.3	0	0	0	0	108.1	L244 N245	V231-L244 HydrophobicContact CG1-CB 4.43Å; V231-L244 HydrophobicContact CG1-CD2 3.85Å; V231-N245 WeakPolarHBondContact CA-O 3.3Å
232	E	87.1	Confident	82.4	Confident	67 Å²	67	81.9 Å²	81.9	31%	0.313	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	127.8	178.9	-65.9	-174.9	168.9	0	0	110.3	K230 L244 N245 Y247	K230-E232 HydrophobicContact CD-CG 4.13Å; K230-E232 WeakPolarHBondContact CE-OE1 3.23Å; K230-E232 HydrophobicContact CG-CG 4.27Å; K230-E232 IonicContact NZ-OE1 3.38Å; K230-E232 PolarHBondContact NZ-OE1 3.27Å; E232-L244 CarbonylContact O-C 3.59Å; E232-L244 WeakPolarHBondContact O-CA 3.43Å; E232-N245 PolarHBondContact N-O 3.15Å; E232-N245 PolarHBondContact O-N 2.78Å; E232-Y247 HydrophobicContact CB-CE2 4.41Å; E232-Y247 HydrophobicContact CG-CE2 4.22Å
233	A	82.3	Confident	81.4	Confident	69 Å²	69	84.3 Å²	84.3	57%	0.57	43%	0.431	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88	116.9	170.8	0	0	0	0	0	109.4	F242 L244	A233-F242 HydrophobicContact CB-CD1 4.41Å; A233-L244 HydrophobicContact CB-CD2 3.94Å
234	R	73.3	Confident	80.7	Confident	182 Å²	182	88.3 Å²	88.3	69%	0.687	45%	0.452	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.6	126.5	172.6	-168.8	172.2	178.9	172.7	-0.1	109.7	R236 V243	R234-R236 PolarHBondContact O-N 3.18Å; R234-V243 PolarHBondContact N-O 3.35Å; R234-V243 PolarHBondContact O-N 3.46Å
235	N	66.3	Low	80.2	Confident	111 Å²	111	89.1 Å²	89.1	59%	0.594	46%	0.456	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.8	129.6	169.2	-86.8	-41.9	0	0	0	109.6	F242	N235-F242 VanDerWaalsContact OD1-CD1 3.28Å; N235-F242 WeakPolarHBondContact OD1-CD1 3.43Å; N235-F242 WeakPolarHBondContact OD1-CE1 3.38Å; N235-F242 WeakPolarHBondContact OD1-CZ 3.42Å
236	R	60.6	Low	79.9	Confident	152 Å²	152	89.1 Å²	89.1	57%	0.574	46%	0.462	S	S	*	.			trans	-76.6	157.1	153.2	-77.9	-177	165	-179	-1.1	108.7	R234 S238 K241 V243	R234-R236 PolarHBondContact O-N 3.18Å; R236-S238 PolarHBondContact O-N 3.09Å; R236-K241 WeakPolarHBondContact CB-O 3.46Å; R236-K241 PolarHBondContact N-O 3.41Å; R236-K241 VanDerWaalsContact N-O 3.1Å; R236-V243 HydrophobicContact CG-CG2 3.9Å
237	T	65.5	Low	79.8	Confident	162 Å²	162	90.1 Å²	90.1	99%	0.994	47%	0.466	S	S	*	.	S	Bend	trans	-55.2	-13.7	174.8	24.2	0	0	0	0	114.2
238	S	63.7	Low	79.7	Confident	59 Å²	59	89.2 Å²	89.2	41%	0.413	47%	0.469	S	S	.	.	S	Bend	trans	-97	129	174.5	37	0	0	0	0	111.5	R236 G240 K241	R236-S238 PolarHBondContact O-N 3.09Å; S238-G240 PolarHBondContact O-N 2.79Å; S238-K241 PolarHBondContact O-N 3.39Å
239	I	69.2	Low	79.8	Confident	184 Å²	184	89.6 Å²	89.6	94%	0.944	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.4	119.5	175	-58.5	170.5	0	0	0	109.4
240	G	64.1	Low	79.9	Confident	62 Å²	62	89 Å²	89	64%	0.639	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.1	-3	170.6	0	0	0	0	0	117.1	S238	S238-G240 PolarHBondContact O-N 2.79Å
241	K	64.7	Low	80.1	Confident	140 Å²	140	88.3 Å²	88.3	61%	0.609	47%	0.471	S	S	*	.			trans	-105.1	100.8	171.7	-74.2	-173.6	179.8	179.6	0	111.1	R236 S238	R236-K241 WeakPolarHBondContact CB-O 3.46Å; R236-K241 PolarHBondContact N-O 3.41Å; R236-K241 VanDerWaalsContact N-O 3.1Å; S238-K241 PolarHBondContact O-N 3.39Å
242	F	69.3	Low	80.4	Confident	129 Å²	129	89.6 Å²	89.6	57%	0.566	47%	0.472	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.8	140	168.3	-64.2	-91.2	0	0	0	110	A233 N235	A233-F242 HydrophobicContact CB-CD1 4.41Å; N235-F242 VanDerWaalsContact OD1-CD1 3.28Å; N235-F242 WeakPolarHBondContact OD1-CD1 3.43Å; N235-F242 WeakPolarHBondContact OD1-CE1 3.38Å; N235-F242 WeakPolarHBondContact OD1-CZ 3.42Å
243	V	77.6	Confident	80.9	Confident	50 Å²	50	88.7 Å²	88.7	30%	0.303	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	123.7	164.9	176.4	0	0	0	0	107.1	R234 R236	R234-V243 PolarHBondContact N-O 3.35Å; R234-V243 PolarHBondContact O-N 3.46Å; R236-V243 HydrophobicContact CG-CG2 3.9Å
244	L	82.8	Confident	81.7	Confident	116 Å²	116	86 Å²	86	61%	0.607	44%	0.443	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87	115.2	171	-71.2	165	0	0	0	108	V231 E232 A233	V231-L244 HydrophobicContact CG1-CB 4.43Å; V231-L244 HydrophobicContact CG1-CD2 3.85Å; E232-L244 CarbonylContact O-C 3.59Å; E232-L244 WeakPolarHBondContact O-CA 3.43Å; A233-L244 HydrophobicContact CB-CD2 3.94Å
245	N	88.6	Confident	82.9	Confident	16 Å²	16	82.1 Å²	82.1	9%	0.086	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	126.5	167.8	-64	-48.3	0	0	0	108.2	V231 E232 Y247 K414	V231-N245 WeakPolarHBondContact CA-O 3.3Å; E232-N245 PolarHBondContact N-O 3.15Å; E232-N245 PolarHBondContact O-N 2.78Å; N245-Y247 HydrophobicContact CB-CE2 3.64Å; N245-K414 VanDerWaalsContact OD1-CE 3.31Å; N245-K414 WeakPolarHBondContact OD1-CE 3.47Å; N245-K414 PolarHBondContact OD1-NZ 3.18Å; N245-K414 VanDerWaalsContact OD1-NZ 3.11Å
246	A	91.8	Very high	84.4	Confident	37 Å²	37	80 Å²	80	31%	0.306	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	130.4	173.7	0	0	0	0	0	110	A415	A246-A415 PolarHBondContact O-N 3.3Å; A246-A415 VanDerWaalsContact O-N 3.07Å
247	Y	95.3	Very high	86.1	Confident	21 Å²	21	77.7 Å²	77.7	8%	0.082	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	135.4	175.9	-53.4	-92.4	0	0	0	108	R229 K230 E232 N245 Y413 K414 T421	R229-Y247 CarbonylContact C-O 3.58Å; R229-Y247 VanDerWaalsContact CA-O 3.25Å; R229-Y247 WeakPolarHBondContact CA-O 3.46Å; K230-Y247 HydrophobicContact CB-CD2 4.39Å; K230-Y247 PolarHBondContact N-O 3.1Å; K230-Y247 PolarHBondContact O-N 3.41Å; E232-Y247 HydrophobicContact CB-CE2 4.41Å; E232-Y247 HydrophobicContact CG-CE2 4.22Å; N245-Y247 HydrophobicContact CB-CE2 3.64Å; Y247-Y413 WeakPolarHBondContact CA-O 3.25Å; Y247-K414 HydrophobicContact CD1-CB 3.85Å; Y247-K414 HydrophobicContact CD1-CG 4.32Å; Y247-K414 HydrophobicContact CE1-CB 3.78Å; Y247-K414 HydrophobicContact CE1-CD 4.14Å; Y247-K414 HydrophobicContact CE1-CG 4Å; Y247-T421 HydrophobicContact CD1-CG2 4.07Å; Y247-T421 WeakPolarHBondContact CD1-OG1 3.25Å; Y247-T421 HydrophobicContact CE1-CG2 4.04Å; Y247-T421 WeakPolarHBondContact CE1-OG1 3.17Å
248	S	96.3	Very high	87.4	Confident	51 Å²	51	72.3 Å²	72.3	36%	0.357	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	152.5	174	58.6	0	0	0	0	111.8	T228 Y413	T228-S248 WeakPolarHBondContact O-CA 3.48Å; T228-S248 WeakPolarHBondContact O-CB 3.22Å; S248-Y413 PolarHBondContact N-O 3.49Å; S248-Y413 PolarHBondContact O-N 3.01Å
249	A	97.8	Very high	88.8	Confident	9 Å²	9	73.1 Å²	73.1	7%	0.074	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	153.9	165.9	0	0	0	0	0	110.1	F227 T228 Y413 L469	F227-A249 WeakPolarHBondContact CA-O 3.46Å; F227-A249 VanDerWaalsContact CD2-O 3.24Å; F227-A249 WeakPolarHBondContact CD2-O 3.34Å; T228-A249 PolarHBondContact N-O 3.1Å; T228-A249 PolarHBondContact O-N 3.45Å; T228-A249 VanDerWaalsContact O-N 3.11Å; T228-A249 PolarHBondContact OG1-N 3.06Å; A249-Y413 HydrophobicContact CB-CD2 3.77Å; A249-Y413 HydrophobicContact CB-CE2 3.92Å; A249-L469 HydrophobicContact CB-CD1 3.63Å; A249-L469 HydrophobicContact CB-CD2 3.57Å; A249-L469 HydrophobicContact CB-CG 4.19Å
250	K	97	Very high	89.7	Confident	119 Å²	119	66.2 Å²	66.2	52%	0.517	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	133.1	176.5	-179.6	167.4	166.8	147.9	0	109	E225 A226 F227 L469	E225-K250 WeakPolarHBondContact OE1-CE 3.06Å; E225-K250 IonicContact OE1-NZ 3.1Å; E225-K250 PolarHBondContact OE1-NZ 3.41Å; E225-K250 WeakPolarHBondContact OE2-CE 3.29Å; E225-K250 IonicContact OE2-NZ 3.01Å; E225-K250 PolarHBondContact OE2-NZ 3.15Å; A226-K250 WeakPolarHBondContact O-CA 3.42Å; F227-K250 HydrophobicContact CD2-CB 4.15Å; K250-L469 VanDerWaalsContact C-CD1 3.48Å
251	E	97.8	Very high	90.6	Very high	46 Å²	46	63.9 Å²	63.9	22%	0.215	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	120.4	177.2	171.8	178	-137.5	0	0	107.1	E225 A226 F253 C467 S468 L469	E225-E251 CarbonylContact C-O 3.55Å; E225-E251 WeakPolarHBondContact CA-O 3.31Å; E225-E251 WeakPolarHBondContact CB-O 3.3Å; A226-E251 HydrophobicContact CB-CB 4.38Å; A226-E251 PolarHBondContact N-O 3.09Å; A226-E251 PolarHBondContact O-N 3.32Å; E251-F253 HydrophobicContact CG-CD1 4.32Å; E251-F253 HydrophobicContact CG-CE1 3.89Å; E251-C467 PolarHBondContact OE2-SG 2.97Å; E251-S468 WeakPolarHBondContact OE1-CB 3.32Å; E251-S468 PolarHBondContact OE1-N 3.31Å; E251-S468 PolarHBondContact OE1-OG 3.43Å; E251-S468 PolarHBondContact OE2-N 3.18Å; E251-S468 PolarHBondContact OE2-OG 3.43Å; E251-S468 VanDerWaalsContact OE2-OG 3.14Å; E251-L469 HydrophobicContact CB-CD1 3.51Å; E251-L469 HydrophobicContact CB-CG 3.8Å
252	Q	97.9	Very high	90.9	Very high	100 Å²	100	60.6 Å²	60.6	47%	0.467	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	120.1	-178.8	-175.2	171.2	10.2	0	0	108.9	L223 H255	L223-Q252 HydrophobicContact CD1-CG 4.17Å; Q252-H255 PolarHBondContact NE2-ND1 2.69Å; Q252-H255 VanDerWaalsContact NE2-ND1 3.18Å
253	F	97.6	Very high	90.8	Very high	48 Å²	48	56.6 Å²	56.6	21%	0.211	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	-42.9	177.9	-52.7	-57.9	0	0	0	110.8	G224 E225 A226 E251 P297 I307 Y309 C467	G224-F253 PolarHBondContact O-N 3.06Å; E225-F253 VanDerWaalsContact C-CE2 3.49Å; A226-F253 HydrophobicContact CB-CE2 4.04Å; A226-F253 HydrophobicContact CB-CZ 3.68Å; E251-F253 HydrophobicContact CG-CD1 4.32Å; E251-F253 HydrophobicContact CG-CE1 3.89Å; F253-P297 HydrophobicContact CD1-CG 4.3Å; F253-P297 HydrophobicContact CE1-CG 3.77Å; F253-P297 HydrophobicContact CE2-CG 4.16Å; F253-P297 HydrophobicContact CZ-CB 4.46Å; F253-P297 HydrophobicContact CZ-CG 3.69Å; F253-I307 HydrophobicContact CE2-CG2 3.87Å; F253-I307 HydrophobicContact CZ-CG2 4.45Å; F253-Y309 HydrophobicContact CD2-CE1 4.12Å; F253-C467 HydrophobicContact CE1-CB 4.39Å; F253-C467 HydrophobicContact CZ-CB 4.13Å
254	F	98.2	Very high	89.8	Confident	13 Å²	13	58.2 Å²	58.2	6%	0.057	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	160.4	176.2	63.4	-92.6	0	0	0	112.4	C222 L223 G224 F256 L292 P293 C296 Y309	C222-F254 HydrophobicContact CB-CE2 4.32Å; C222-F254 WeakPolarHBondContact O-CD2 3.15Å; C222-F254 WeakPolarHBondContact O-CE2 2.91Å; L223-F254 WeakPolarHBondContact CD1-O 3.32Å; G224-F254 PolarHBondContact N-O 3.32Å; G224-F254 PolarHBondContact O-N 2.85Å; F254-F256 HydrophobicContact CB-CE1 4.15Å; F254-F256 HydrophobicContact CB-CE2 4.24Å; F254-F256 HydrophobicContact CB-CZ 3.91Å; F254-F256 AromaticContact CD2-CD2 3.57Å; F254-F256 HydrophobicContact CD2-CD2 3.57Å; F254-F256 AromaticContact CD2-CE2 3.53Å; F254-F256 HydrophobicContact CD2-CE2 3.53Å; F254-F256 HydrophobicContact CD2-CG 4.15Å; F254-F256 HydrophobicContact CD2-CZ 4.07Å; F254-F256 AromaticContact CE2-CD2 3.95Å; F254-F256 HydrophobicContact CE2-CD2 3.95Å; F254-F256 HydrophobicContact CE2-CE2 4.02Å; F254-F256 HydrophobicContact CG-CD2 4.42Å; F254-F256 AromaticContact CG-CE2 3.96Å; F254-F256 HydrophobicContact CG-CE2 3.96Å; F254-F256 HydrophobicContact CG-CZ 4.12Å; F254-L292 HydrophobicContact CE1-CD2 4.49Å; F254-L292 HydrophobicContact CE2-CD2 4.44Å; F254-L292 HydrophobicContact CZ-CD2 3.85Å; F254-P293 HydrophobicContact CB-CG 3.96Å; F254-P293 HydrophobicContact CD1-CG 3.67Å; F254-P293 HydrophobicContact CE1-CG 4.41Å; F254-P293 HydrophobicContact CG-CG 3.97Å; F254-C296 VanDerWaalsContact CE1-SG 3.58Å; F254-Y309 AromaticContact CE1-CD1 3.7Å; F254-Y309 HydrophobicContact CE1-CD1 3.7Å; F254-Y309 AromaticContact CE1-CE1 3.81Å; F254-Y309 HydrophobicContact CE1-CE1 3.81Å; F254-Y309 AromaticContact CZ-CD1 3.84Å; F254-Y309 HydrophobicContact CZ-CD1 3.84Å; F254-Y309 HydrophobicContact CZ-CE1 4.41Å
255	H	98.1	Very high	88.5	Confident	99 Å²	99	57.9 Å²	57.9	46%	0.458	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	108.9	167.9	-156.7	92.7	0	0	0	108.2	F221 L223 Q252	F221-H255 AromaticContact CD1-NE2 3.43Å; F221-H255 WeakPolarHBondContact CD1-NE2 3.33Å; L223-H255 VanDerWaalsContact CD1-ND1 3.31Å; L223-H255 WeakPolarHBondContact CD1-ND1 3.42Å; Q252-H255 PolarHBondContact NE2-ND1 2.69Å; Q252-H255 VanDerWaalsContact NE2-ND1 3.18Å
256	F	98.3	Very high	86.6	Confident	67 Å²	67	64 Å²	64	29%	0.294	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	151.3	172.4	-54.8	-42.4	0	0	0	110.4	F221 C222 F254 F290 H291 P293	F221-F256 CarbonylContact C-O 3.55Å; F221-F256 VanDerWaalsContact CA-O 3.25Å; F221-F256 WeakPolarHBondContact CA-O 3.31Å; C222-F256 HydrophobicContact CB-CB 4.29Å; C222-F256 HydrophobicContact CB-CD2 4.5Å; C222-F256 PolarHBondContact N-O 2.92Å; C222-F256 PolarHBondContact O-N 2.97Å; F254-F256 HydrophobicContact CB-CE1 4.15Å; F254-F256 HydrophobicContact CB-CE2 4.24Å; F254-F256 HydrophobicContact CB-CZ 3.91Å; F254-F256 AromaticContact CD2-CD2 3.57Å; F254-F256 HydrophobicContact CD2-CD2 3.57Å; F254-F256 AromaticContact CD2-CE2 3.53Å; F254-F256 HydrophobicContact CD2-CE2 3.53Å; F254-F256 HydrophobicContact CD2-CG 4.15Å; F254-F256 HydrophobicContact CD2-CZ 4.07Å; F254-F256 AromaticContact CE2-CD2 3.95Å; F254-F256 HydrophobicContact CE2-CD2 3.95Å; F254-F256 HydrophobicContact CE2-CE2 4.02Å; F254-F256 HydrophobicContact CG-CD2 4.42Å; F254-F256 AromaticContact CG-CE2 3.96Å; F254-F256 HydrophobicContact CG-CE2 3.96Å; F254-F256 HydrophobicContact CG-CZ 4.12Å; F256-F290 HydrophobicContact CB-CD1 3.47Å; F256-F290 VanDerWaalsContact CB-CD1 3.47Å; F256-F290 HydrophobicContact CB-CE1 3.66Å; F256-F290 HydrophobicContact CB-CG 4.46Å; F256-F290 HydrophobicContact CD2-CB 4.33Å; F256-F290 HydrophobicContact CD2-CD1 4.25Å; F256-F290 HydrophobicContact CG-CD1 4.28Å; F256-H291 WeakPolarHBondContact CE2-O 3.5Å; F256-P293 HydrophobicContact CE2-CG 4.34Å; F256-P293 HydrophobicContact CZ-CG 3.93Å
257	F	96	Very high	84.5	Confident	104 Å²	104	64.2 Å²	64.2	46%	0.456	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	138.2	-179.2	164.1	-105.6	0	0	0	108.3	K219 M220 F221 E259	K219-F257 HydrophobicContact CB-CE2 3.83Å; K219-F257 HydrophobicContact CD-CE2 3.87Å; K219-F257 HydrophobicContact CD-CZ 4.25Å; K219-F257 HydrophobicContact CG-CE2 3.74Å; K219-F257 HydrophobicContact CG-CZ 4.21Å; M220-F257 CarbonylContact O-C 3.56Å; M220-F257 WeakPolarHBondContact O-CA 3.44Å; F221-F257 HydrophobicContact CD1-CB 4.12Å; F221-F257 AromaticContact CD1-CD2 3.82Å; F221-F257 HydrophobicContact CD1-CD2 3.82Å; F221-F257 HydrophobicContact CD1-CG 4.43Å; F221-F257 HydrophobicContact CE1-CB 4.23Å; F221-F257 AromaticContact CE1-CD2 3.37Å; F221-F257 HydrophobicContact CE1-CD2 3.37Å; F221-F257 HydrophobicContact CE1-CE2 4.1Å; F221-F257 HydrophobicContact CE1-CG 4.13Å; F221-F257 HydrophobicContact CE2-CD2 4.41Å; F221-F257 AromaticContact CZ-CD2 3.71Å; F221-F257 HydrophobicContact CZ-CD2 3.71Å; F221-F257 AromaticContact CZ-CE2 4Å; F221-F257 HydrophobicContact CZ-CE2 4Å; F257-E259 HydrophobicContact CE1-CB 4.44Å; F257-E259 HydrophobicContact CZ-CB 3.89Å
258	T	94.4	Very high	82.2	Confident	48 Å²	48	67.8 Å²	67.8	29%	0.294	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	144.5	166.9	-169	0	0	0	0	109.2	M220 L260 F290	M220-T258 HydrophobicContact CB-CG2 3.68Å; M220-T258 PolarHBondContact N-O 3.29Å; M220-T258 PolarHBondContact O-N 2.81Å; T258-L260 HydrophobicContact CG2-CD2 4.02Å; T258-F290 HydrophobicContact CG2-CE1 3.94Å; T258-F290 HydrophobicContact CG2-CE2 4.39Å; T258-F290 HydrophobicContact CG2-CZ 3.62Å
259	E	91.1	Very high	80	Confident	76 Å²	76	70 Å²	70	36%	0.355	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	114.2	176.6	-166.9	160.1	-131	0	0	108.1	K219 F257 V261 S262	K219-E259 WeakPolarHBondContact CE-OE1 3.07Å; K219-E259 HydrophobicContact CG-CG 4.31Å; F257-E259 HydrophobicContact CE1-CB 4.44Å; F257-E259 HydrophobicContact CZ-CB 3.89Å; E259-V261 VanDerWaalsContact CG-O 3.24Å; E259-V261 WeakPolarHBondContact CG-O 3.47Å; E259-S262 VanDerWaalsContact OE2-CB 3.31Å; E259-S262 WeakPolarHBondContact OE2-CB 3.44Å
260	L	88.6	Confident	77.7	Confident	40 Å²	40	76.8 Å²	76.8	21%	0.209	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	-29.1	-180	-58.8	-173.9	0	0	0	111.3	L205 V218 M220 T258 F286 P287 F288	L205-L260 HydrophobicContact CB-CD1 3.95Å; L205-L260 HydrophobicContact CD2-CD1 3.98Å; V218-L260 HydrophobicContact CB-CB 4.44Å; V218-L260 HydrophobicContact CG1-CB 4.33Å; V218-L260 HydrophobicContact CG1-CD1 4.41Å; V218-L260 PolarHBondContact O-N 3.1Å; M220-L260 HydrophobicContact CB-CG 4.43Å; M220-L260 HydrophobicContact CG-CD1 3.42Å; M220-L260 VanDerWaalsContact CG-CD1 3.42Å; M220-L260 HydrophobicContact CG-CD2 4.37Å; M220-L260 HydrophobicContact CG-CG 3.79Å; T258-L260 HydrophobicContact CG2-CD2 4.02Å; L260-F286 HydrophobicContact CB-CB 4.37Å; L260-F286 HydrophobicContact CD1-CB 3.71Å; L260-P287 WeakPolarHBondContact CD2-O 3.43Å; L260-F288 HydrophobicContact CD2-CB 4.08Å
261	V	82.7	Confident	75.3	Confident	13 Å²	13	74.5 Å²	74.5	8%	0.079	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	118.4	178.2	179.5	0	0	0	0	107.3	S217 V218 E259 L276 F286	S217-V261 VanDerWaalsContact CA-O 3.26Å; S217-V261 WeakPolarHBondContact CA-O 3.02Å; S217-V261 WeakPolarHBondContact CB-O 3.41Å; V218-V261 HydrophobicContact CB-CB 3.84Å; V218-V261 HydrophobicContact CB-CG2 3.85Å; V218-V261 HydrophobicContact CG2-CB 3.93Å; V218-V261 HydrophobicContact CG2-CG2 3.82Å; V218-V261 PolarHBondContact N-O 2.95Å; V218-V261 PolarHBondContact O-N 3.47Å; E259-V261 VanDerWaalsContact CG-O 3.24Å; E259-V261 WeakPolarHBondContact CG-O 3.47Å; V261-L276 HydrophobicContact CB-CD2 4.12Å; V261-L276 HydrophobicContact CG1-CB 3.44Å; V261-L276 VanDerWaalsContact CG1-CB 3.44Å; V261-L276 HydrophobicContact CG1-CD2 3.51Å; V261-L276 HydrophobicContact CG1-CG 4.05Å; V261-L276 HydrophobicContact CG2-CD2 3.45Å; V261-L276 VanDerWaalsContact CG2-CD2 3.45Å; V261-F286 HydrophobicContact CG2-CD1 4.19Å; V261-F286 HydrophobicContact CG2-CE1 3.81Å; V261-F286 HydrophobicContact CG2-CZ 4.27Å
262	S	72.6	Confident	73	Confident	71 Å²	71	80.3 Å²	80.3	50%	0.497	45%	0.453	S	S	.	.			trans	-114.7	151	174.9	62	0	0	0	0	110.7	E259 D264	E259-S262 VanDerWaalsContact OE2-CB 3.31Å; E259-S262 WeakPolarHBondContact OE2-CB 3.44Å; S262-D264 PolarHBondContact O-N 2.99Å
263	P	65.8	Low	70.9	Confident	45 Å²	45	79.5 Å²	79.5	29%	0.292	45%	0.454	S	S	.	.			trans	-62.9	128.9	167.8	23	-30.7	0	0	0	110.5	V265 V273	P263-V265 PolarHBondContact O-N 3.27Å; P263-V273 HydrophobicContact CB-CB 4.48Å; P263-V273 HydrophobicContact CB-CG1 3.11Å; P263-V273 HydrophobicContact CG-CG1 4.4Å
264	D	57.5	Low	68.8	Low	84 Å²	84	81.4 Å²	81.4	45%	0.449	47%	0.467	S	S	.	.	B	Isolated β-bridge	trans	-70.5	107	178.3	-153.9	-19.4	0	0	0	109.9	S262 N266 D274	S262-D264 PolarHBondContact O-N 2.99Å; D264-N266 VanDerWaalsContact C-N 3.27Å; D264-N266 PolarHBondContact OD1-N 3.49Å; D264-D274 HydrophobicContact CB-CB 4.15Å
265	V	54.3	Low	67.1	Low	109 Å²	109	83.5 Å²	83.5	66%	0.661	48%	0.476	S	S	*	.	S	Bend	trans	-74.9	-22.5	-179.3	-171.1	0	0	0	0	110.9	P263 T268	P263-V265 PolarHBondContact O-N 3.27Å; V265-T268 WeakPolarHBondContact O-CG2 3.19Å; V265-T268 PolarHBondContact O-OG1 3.34Å
266	N	49.2	Very low	65.7	Low	143 Å²	143	81.7 Å²	81.7	77%	0.765	47%	0.469	S	S	*	.	S	Bend	trans	-86.3	-11.5	-175.1	-75.8	-17.5	0	0	0	114	D264 T268	D264-N266 VanDerWaalsContact C-N 3.27Å; D264-N266 PolarHBondContact OD1-N 3.49Å; N266-T268 PolarHBondContact O-N 2.82Å; N266-T268 PolarHBondContact O-OG1 2.85Å
267	S	48	Very low	64.1	Low	43 Å²	43	82.9 Å²	82.9	30%	0.301	48%	0.475	S	S	.	.			trans	-75.7	48	164.4	-74.7	0	0	0	0	111.4	A269 D274	S267-A269 VanDerWaalsContact C-N 3.26Å; S267-A269 PolarHBondContact O-N 2.91Å; S267-D274 WeakPolarHBondContact CB-OD2 3.28Å; S267-D274 PolarHBondContact OG-OD2 2.85Å
268	T	46.4	Very low	63.1	Low	96 Å²	96	78.3 Å²	78.3	59%	0.589	46%	0.455	S	S	*	.	G	3₁₀ helix	trans	-83.3	5.7	-175.3	5.3	0	0	0	0	113.9	V265 N266 N270	V265-T268 WeakPolarHBondContact O-CG2 3.19Å; V265-T268 PolarHBondContact O-OG1 3.34Å; N266-T268 PolarHBondContact O-N 2.82Å; N266-T268 PolarHBondContact O-OG1 2.85Å; T268-N270 PolarHBondContact O-N 3.3Å; T268-N270 VanDerWaalsContact O-N 3.09Å
269	A	50.7	Low	61.8	Low	96 Å²	96	82 Å²	82	79%	0.793	47%	0.469	S	S	*	.	G	3₁₀ helix	trans	-59.8	-25.8	-178.2	0	0	0	0	0	113.5	S267	S267-A269 VanDerWaalsContact C-N 3.26Å; S267-A269 PolarHBondContact O-N 2.91Å
270	N	49.3	Very low	61.2	Low	152 Å²	152	84.6 Å²	84.6	81%	0.813	48%	0.481	S	S	*	.	G	3₁₀ helix	trans	-132.5	16.4	180	-74.3	-33.4	0	0	0	114.7	T268 K272	T268-N270 PolarHBondContact O-N 3.3Å; T268-N270 VanDerWaalsContact O-N 3.09Å; N270-K272 PolarHBondContact O-N 2.97Å
271	G	46.7	Very low	61	Low	71 Å²	71	86.1 Å²	86.1	73%	0.732	49%	0.493	S	S	*	.	S	Bend	trans	60.9	14.5	180	0	0	0	0	0	114.8
272	K	50.3	Low	61.3	Low	168 Å²	168	87 Å²	87	73%	0.73	51%	0.505	S	S	*	.			trans	-103.8	115.6	179.4	-136.9	178.9	-175.1	-175.5	0	107.3	N270 D274	N270-K272 PolarHBondContact O-N 2.97Å; K272-D274 PolarHBondContact O-N 2.73Å
273	V	52.1	Low	62.2	Low	84 Å²	84	89.4 Å²	89.4	51%	0.509	51%	0.508	S	S	.	.			trans	-61.5	121.1	173.7	170.4	0	0	0	0	108.6	P263 K275	P263-V273 HydrophobicContact CB-CB 4.48Å; P263-V273 HydrophobicContact CB-CG1 3.11Å; P263-V273 HydrophobicContact CG-CG1 4.4Å; V273-K275 PolarHBondContact O-N 2.88Å
274	D	55.5	Low	63.3	Low	87 Å²	87	89.2 Å²	89.2	47%	0.465	50%	0.503	S	S	.	.	B	Isolated β-bridge	trans	-70.4	103.8	173.7	-82.2	-21.4	0	0	0	108.4	D264 S267 K272	D264-D274 HydrophobicContact CB-CB 4.15Å; S267-D274 WeakPolarHBondContact CB-OD2 3.28Å; S267-D274 PolarHBondContact OG-OD2 2.85Å; K272-D274 PolarHBondContact O-N 2.73Å
275	K	62.1	Low	65	Low	57 Å²	57	88.1 Å²	88.1	25%	0.248	50%	0.502	C	S	.	.			trans	-71.8	143.4	173.6	-58.8	-178.4	176.1	-176	0	108.5	N214 D216 V273 F277 H318 D320	N214-K275 HydrophobicContact CB-CB 3.97Å; N214-K275 HydrophobicContact CB-CD 3.85Å; D216-K275 WeakPolarHBondContact OD1-CD 3.48Å; D216-K275 WeakPolarHBondContact OD1-CE 3.37Å; D216-K275 VanDerWaalsContact OD1-CG 3.3Å; D216-K275 WeakPolarHBondContact OD1-CG 3.48Å; D216-K275 IonicContact OD1-NZ 3.39Å; V273-K275 PolarHBondContact O-N 2.88Å; K275-F277 PolarHBondContact O-N 2.91Å; K275-H318 PolarHBondContact NZ-O 2.95Å; K275-D320 IonicContact NZ-OD1 3.84Å; K275-D320 PolarHBondContact NZ-OD1 3.4Å
276	L	67.9	Low	66.9	Low	62 Å²	62	84.8 Å²	84.8	33%	0.325	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	111.5	169.6	178.4	68.1	0	0	0	108.5	N214 V215 V261 L278 F286	N214-L276 WeakPolarHBondContact CA-O 3.33Å; V215-L276 PolarHBondContact N-O 3.07Å; V215-L276 PolarHBondContact O-N 2.74Å; V261-L276 HydrophobicContact CB-CD2 4.12Å; V261-L276 HydrophobicContact CG1-CB 3.44Å; V261-L276 VanDerWaalsContact CG1-CB 3.44Å; V261-L276 HydrophobicContact CG1-CD2 3.51Å; V261-L276 HydrophobicContact CG1-CG 4.05Å; V261-L276 HydrophobicContact CG2-CD2 3.45Å; V261-L276 VanDerWaalsContact CG2-CD2 3.45Å; L276-L278 HydrophobicContact CD2-CD2 3.78Å; L276-L278 HydrophobicContact CG-CD2 4.11Å; L276-L278 PolarHBondContact O-N 3.47Å; L276-F286 HydrophobicContact CD2-CE1 4.15Å; L276-F286 HydrophobicContact CD2-CZ 3.97Å
277	F	65.6	Low	69.2	Low	92 Å²	92	82.2 Å²	82.2	40%	0.404	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	105.5	173.1	-167.8	-138.3	0	0	0	109.3	A212 N214 K275 Q279	A212-F277 HydrophobicContact CB-CE2 4.16Å; A212-F277 HydrophobicContact CB-CZ 3.93Å; N214-F277 HydrophobicContact CB-CD2 4.5Å; N214-F277 WeakPolarHBondContact OD1-CA 3.35Å; N214-F277 VanDerWaalsContact OD1-CB 3.23Å; N214-F277 WeakPolarHBondContact OD1-CB 3.1Å; N214-F277 WeakPolarHBondContact OD1-CD2 3.27Å; N214-F277 WeakPolarHBondContact OD1-CG 3.35Å; K275-F277 PolarHBondContact O-N 2.91Å; F277-Q279 HydrophobicContact CB-CG 4.2Å; F277-Q279 HydrophobicContact CD1-CB 3.85Å; F277-Q279 HydrophobicContact CD1-CG 3.36Å; F277-Q279 HydrophobicContact CE1-CB 3.91Å; F277-Q279 HydrophobicContact CE1-CG 3.93Å; F277-Q279 HydrophobicContact CG-CG 3.99Å; F277-Q279 WeakPolarHBondContact O-CG 3.37Å; F277-Q279 PolarHBondContact O-N 2.92Å
278	L	74.3	Confident	71.5	Confident	8 Å²	8	80.7 Å²	80.7	4%	0.042	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	86.8	165.8	-60.4	-178	0	0	0	107	M209 A212 C213 V215 L276 Q280 H284 F286	M209-L278 HydrophobicContact CE-CD1 4.28Å; M209-L278 HydrophobicContact CG-CD1 3.97Å; M209-L278 HydrophobicContact SD-CD1 4.04Å; A212-L278 CarbonylContact C-O 3.52Å; A212-L278 WeakPolarHBondContact CA-O 3.38Å; C213-L278 PolarHBondContact N-O 3.46Å; C213-L278 PolarHBondContact O-N 3.25Å; V215-L278 HydrophobicContact CG2-CD1 3.86Å; V215-L278 HydrophobicContact CG2-CG 4.26Å; L276-L278 HydrophobicContact CD2-CD2 3.78Å; L276-L278 HydrophobicContact CG-CD2 4.11Å; L276-L278 PolarHBondContact O-N 3.47Å; L278-Q280 PolarHBondContact O-N 2.83Å; L278-H284 HydrophobicContact CD2-CB 4.43Å; L278-F286 HydrophobicContact CD2-CZ 4.08Å
279	Q	67.1	Low	74	Confident	126 Å²	126	80 Å²	80	59%	0.589	45%	0.448	S	S	*	.			trans	-72	-18.5	-164.6	-42.6	-157.8	-28.4	0	0	113.9	A212 F277	A212-Q279 VanDerWaalsContact CB-O 3.24Å; A212-Q279 WeakPolarHBondContact CB-O 3.32Å; F277-Q279 HydrophobicContact CB-CG 4.2Å; F277-Q279 HydrophobicContact CD1-CB 3.85Å; F277-Q279 HydrophobicContact CD1-CG 3.36Å; F277-Q279 HydrophobicContact CE1-CB 3.91Å; F277-Q279 HydrophobicContact CE1-CG 3.93Å; F277-Q279 HydrophobicContact CG-CG 3.99Å; F277-Q279 WeakPolarHBondContact O-CG 3.37Å; F277-Q279 PolarHBondContact O-N 2.92Å
280	Q	78.8	Confident	76.3	Confident	130 Å²	130	76 Å²	76	61%	0.607	41%	0.413	S	S	*	.	S	Bend	trans	-119.2	132.9	-175.2	-63.9	-64.5	-33.7	0	0	109.6	L278 H284	L278-Q280 PolarHBondContact O-N 2.83Å; Q280-H284 PolarHBondContact O-NE2 2.8Å
281	P	83.8	Confident	78.6	Confident	72 Å²	72	74.7 Å²	74.7	47%	0.468	40%	0.401	S	S	.	.	S	Bend	trans	-52.3	153.2	158.4	-19.4	31.3	0	0	0	110.6	M209	M209-P281 CarbonylContact O-C 3.55Å; M209-P281 WeakPolarHBondContact O-CA 3.38Å
282	G	88.8	Confident	81	Confident	31 Å²	31	71.5 Å²	71.5	32%	0.32	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	116.6	-161.8	-179.7	0	0	0	0	0	113.4	M209 H284	M209-G282 PolarHBondContact N-O 2.92Å; M209-G282 PolarHBondContact O-N 3.38Å; G282-H284 PolarHBondContact O-CD2 2.73Å
283	E	91.8	Very high	83.3	Confident	122 Å²	122	64.6 Å²	64.6	57%	0.57	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.6	125.9	-171.6	-169.1	172.4	165.1	0	0	111.5	R185 V206 V208	R185-E283 IonicContact NH2-OE1 2.75Å; R185-E283 PolarHBondContact NH2-OE1 2.9Å; V206-E283 HydrophobicContact CG1-CG 3.42Å; V206-E283 VanDerWaalsContact CG1-CG 3.42Å; V206-E283 WeakPolarHBondContact CG1-OE1 3.41Å; V208-E283 HydrophobicContact CG2-CG 4.33Å
284	H	90.2	Very high	85.3	Confident	40 Å²	40	65.5 Å²	65.5	19%	0.185	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	130.5	173.1	-58.8	-91.5	0	0	0	108.5	V206 I207 L278 Q280 G282 F286	V206-H284 WeakPolarHBondContact CA-O 3.38Å; I207-H284 HydrophobicContact CB-CB 4.48Å; I207-H284 PolarHBondContact N-O 2.87Å; I207-H284 PolarHBondContact O-N 2.87Å; L278-H284 HydrophobicContact CD2-CB 4.43Å; Q280-H284 PolarHBondContact O-NE2 2.8Å; G282-H284 PolarHBondContact O-CD2 2.73Å; H284-F286 HydrophobicContact CB-CE2 3.81Å; H284-F286 HydrophobicContact CB-CZ 4.33Å
285	S	92.9	Very high	87.1	Confident	61 Å²	61	66.9 Å²	66.9	43%	0.427	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	128.1	-176.6	-175.5	0	0	0	0	110.6	H204 L205	H204-S285 WeakPolarHBondContact CB-OG 3.09Å; H204-S285 PolarHBondContact CD2-OG 3.39Å; L205-S285 WeakPolarHBondContact O-CA 3.32Å
286	F	94.1	Very high	88.8	Confident	39 Å²	39	64.2 Å²	64.2	17%	0.171	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	114.7	-178.8	-60.7	-90.2	0	0	0	109.9	H204 L205 I207 L260 V261 L276 L278 H284	H204-F286 CarbonylContact C-O 3.49Å; H204-F286 WeakPolarHBondContact CA-O 3.35Å; L205-F286 HydrophobicContact CB-CB 4.49Å; L205-F286 PolarHBondContact N-O 3.02Å; L205-F286 PolarHBondContact O-N 2.96Å; I207-F286 HydrophobicContact CD1-CD2 4.04Å; I207-F286 HydrophobicContact CD1-CE2 3.76Å; I207-F286 HydrophobicContact CG1-CD2 4.32Å; I207-F286 HydrophobicContact CG1-CE2 4.25Å; L260-F286 HydrophobicContact CB-CB 4.37Å; L260-F286 HydrophobicContact CD1-CB 3.71Å; V261-F286 HydrophobicContact CG2-CD1 4.19Å; V261-F286 HydrophobicContact CG2-CE1 3.81Å; V261-F286 HydrophobicContact CG2-CZ 4.27Å; L276-F286 HydrophobicContact CD2-CE1 4.15Å; L276-F286 HydrophobicContact CD2-CZ 3.97Å; L278-F286 HydrophobicContact CD2-CZ 4.08Å; H284-F286 HydrophobicContact CB-CE2 3.81Å; H284-F286 HydrophobicContact CB-CZ 4.33Å
287	P	96.8	Very high	90.2	Very high	90 Å²	90	61.4 Å²	61.4	58%	0.584	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.1	146.5	179.8	29.2	-34.5	0	0	0	111.2	G203 L260	G203-P287 CarbonylContact O-C 3.52Å; G203-P287 WeakPolarHBondContact O-CA 2.91Å; L260-P287 WeakPolarHBondContact CD2-O 3.43Å
288	F	97.4	Very high	91.6	Very high	10 Å²	10	57.2 Å²	57.2	4%	0.044	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	152.2	171.1	67.1	-96.1	0	0	0	111	I186 Y188 G203 H204 M220 L260 F290	I186-F288 HydrophobicContact CG2-CE1 3.89Å; I186-F288 HydrophobicContact CG2-CZ 3.71Å; Y188-F288 HydrophobicContact CD1-CE2 4.43Å; Y188-F288 HydrophobicContact CD1-CZ 4.05Å; Y188-F288 HydrophobicContact CE1-CE2 4.25Å; Y188-F288 AromaticContact CE1-CZ 3.98Å; Y188-F288 HydrophobicContact CE1-CZ 3.98Å; G203-F288 VanDerWaalsContact C-CE1 3.42Å; G203-F288 PolarHBondContact N-O 2.86Å; G203-F288 VanDerWaalsContact N-O 3.15Å; G203-F288 PolarHBondContact O-N 2.84Å; H204-F288 VanDerWaalsContact N-CE1 3.35Å; M220-F288 HydrophobicContact CE-CD1 3.69Å; M220-F288 HydrophobicContact CE-CD2 4.14Å; M220-F288 HydrophobicContact CE-CE1 3.72Å; M220-F288 HydrophobicContact CE-CE2 4.18Å; M220-F288 HydrophobicContact CE-CG 3.91Å; M220-F288 HydrophobicContact CE-CZ 3.98Å; M220-F288 HydrophobicContact CG-CB 4.42Å; L260-F288 HydrophobicContact CD2-CB 4.08Å; F288-F290 AromaticContact CD2-CD2 3.91Å; F288-F290 HydrophobicContact CD2-CD2 3.91Å; F288-F290 AromaticContact CD2-CE2 3.88Å; F288-F290 HydrophobicContact CD2-CE2 3.88Å; F288-F290 HydrophobicContact CE2-CD2 4.43Å
289	E	97.9	Very high	92.7	Very high	83 Å²	83	56.8 Å²	56.8	39%	0.388	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	136	174.5	178.7	168.8	-167.2	0	0	110.4	S200 L201 K202 H291	S200-E289 WeakPolarHBondContact CB-OE1 3.35Å; S200-E289 PolarHBondContact OG-OE1 3.19Å; L201-E289 CarbonylContact O-C 3.58Å; L201-E289 WeakPolarHBondContact O-CA 3.5Å; K202-E289 WeakPolarHBondContact CE-OE1 3.27Å; K202-E289 VanDerWaalsContact CE-OE2 3.29Å; K202-E289 WeakPolarHBondContact CE-OE2 3.47Å; K202-E289 HydrophobicContact CG-CB 4.15Å; K202-E289 HydrophobicContact CG-CG 3.83Å; K202-E289 IonicContact NZ-OE1 2.82Å; K202-E289 IonicContact NZ-OE2 2.67Å; E289-H291 IonicContact OE1-CE1 3.68Å; E289-H291 IonicContact OE1-NE2 3.39Å
290	F	98.4	Very high	94.1	Very high	11 Å²	11	50.9 Å²	50.9	5%	0.048	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	139.2	171.6	-65.8	-74.7	0	0	0	110.2	S200 L201 M220 C222 F256 T258 F288	S200-F290 CarbonylContact C-O 3.57Å; S200-F290 WeakPolarHBondContact CA-O 3.37Å; L201-F290 PolarHBondContact N-O 3.08Å; L201-F290 PolarHBondContact O-N 2.95Å; M220-F290 HydrophobicContact CB-CE2 4.31Å; M220-F290 HydrophobicContact CB-CZ 4.03Å; C222-F290 HydrophobicContact CB-CB 4.2Å; C222-F290 HydrophobicContact CB-CD1 3.93Å; C222-F290 HydrophobicContact CB-CD2 3.5Å; C222-F290 HydrophobicContact CB-CE1 4.1Å; C222-F290 HydrophobicContact CB-CE2 3.69Å; C222-F290 HydrophobicContact CB-CG 3.61Å; C222-F290 HydrophobicContact CB-CZ 3.97Å; F256-F290 HydrophobicContact CB-CD1 3.47Å; F256-F290 VanDerWaalsContact CB-CD1 3.47Å; F256-F290 HydrophobicContact CB-CE1 3.66Å; F256-F290 HydrophobicContact CB-CG 4.46Å; F256-F290 HydrophobicContact CD2-CB 4.33Å; F256-F290 HydrophobicContact CD2-CD1 4.25Å; F256-F290 HydrophobicContact CG-CD1 4.28Å; T258-F290 HydrophobicContact CG2-CE1 3.94Å; T258-F290 HydrophobicContact CG2-CE2 4.39Å; T258-F290 HydrophobicContact CG2-CZ 3.62Å; F288-F290 AromaticContact CD2-CD2 3.91Å; F288-F290 HydrophobicContact CD2-CD2 3.91Å; F288-F290 AromaticContact CD2-CE2 3.88Å; F288-F290 HydrophobicContact CD2-CE2 3.88Å; F288-F290 HydrophobicContact CE2-CD2 4.43Å
291	H	97.9	Very high	94.9	Very high	124 Å²	124	45 Å²	45	57%	0.574	25%	0.254	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.4	112.7	175.1	-67.1	80.5	0	0	0	109.5	S200 F256 E289	S200-H291 PolarHBondContact OG-CD2 2.79Å; S200-H291 VanDerWaalsContact OG-CD2 3.27Å; S200-H291 PolarHBondContact OG-NE2 2.85Å; F256-H291 WeakPolarHBondContact CE2-O 3.5Å; E289-H291 IonicContact OE1-CE1 3.68Å; E289-H291 IonicContact OE1-NE2 3.39Å
292	L	98	Very high	95.3	Very high	5 Å²	5	42.2 Å²	42.2	3%	0.026	24%	0.236	C	C	.	.			trans	-73.1	138.3	-176.8	-61.2	169.3	0	0	0	110.7	G198 K199 L201 F254 F334 I336	G198-L292 WeakPolarHBondContact CA-O 3.49Å; G198-L292 PolarHBondContact N-O 3.1Å; K199-L292 WeakPolarHBondContact O-CB 3.42Å; K199-L292 WeakPolarHBondContact O-CG 3.45Å; K199-L292 PolarHBondContact O-N 3.42Å; L201-L292 HydrophobicContact CB-CD1 4.22Å; L201-L292 HydrophobicContact CB-CD2 4.32Å; L201-L292 HydrophobicContact CB-CG 4.17Å; F254-L292 HydrophobicContact CE1-CD2 4.49Å; F254-L292 HydrophobicContact CE2-CD2 4.44Å; F254-L292 HydrophobicContact CZ-CD2 3.85Å; L292-F334 HydrophobicContact CD1-CE2 4.17Å; L292-F334 HydrophobicContact CD2-CE2 3.97Å; L292-F334 HydrophobicContact CD2-CZ 3.84Å; L292-I336 HydrophobicContact CD1-CD1 3.68Å
293	P	97.6	Very high	95.3	Very high	23 Å²	23	46.8 Å²	46.8	15%	0.149	25%	0.252	C	S	.	.			trans	-57.7	145.8	173.7	-25.4	33.5	0	0	0	112.4	P197 G198 F254 F256 D295 C296	P197-P293 WeakPolarHBondContact CB-O 3.24Å; G198-P293 PolarHBondContact N-O 2.87Å; G198-P293 VanDerWaalsContact N-O 3.09Å; F254-P293 HydrophobicContact CB-CG 3.96Å; F254-P293 HydrophobicContact CD1-CG 3.67Å; F254-P293 HydrophobicContact CE1-CG 4.41Å; F254-P293 HydrophobicContact CG-CG 3.97Å; F256-P293 HydrophobicContact CE2-CG 4.34Å; F256-P293 HydrophobicContact CZ-CG 3.93Å; P293-D295 WeakPolarHBondContact CB-OD1 3.4Å; P293-D295 PolarHBondContact O-N 2.83Å; P293-C296 VanDerWaalsContact CD-SG 3.57Å; P293-C296 PolarHBondContact O-SG 3.05Å
294	P	94.9	Very high	95.3	Very high	103 Å²	103	41.5 Å²	41.5	67%	0.669	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-15.7	-179.2	30.4	-35.8	0	0	0	113.8	P197	P197-P294 VanDerWaalsContact CB-O 3.27Å; P197-P294 WeakPolarHBondContact CB-O 3.38Å
295	D	93.5	Very high	95.5	Very high	115 Å²	115	39.8 Å²	39.8	62%	0.615	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.3	8.6	-176.6	61.4	-26.2	0	0	0	113.6	P293 P297	P293-D295 WeakPolarHBondContact CB-OD1 3.4Å; P293-D295 PolarHBondContact O-N 2.83Å; D295-P297 WeakPolarHBondContact O-CD 3.4Å
296	C	96.7	Very high	95.7	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.007	20%	0.203	C	C	.	.	P	Polyproline II helix	trans	-56.1	121.2	178	-69.4	0	0	0	0	111.6	P197 F254 P293 Y309 I336 N338	P197-C296 HydrophobicContact CB-CB 4.11Å; P197-C296 HydrophobicContact CG-CB 4.14Å; P197-C296 WeakPolarHBondContact CG-O 3.38Å; F254-C296 VanDerWaalsContact CE1-SG 3.58Å; P293-C296 VanDerWaalsContact CD-SG 3.57Å; P293-C296 PolarHBondContact O-SG 3.05Å; C296-Y309 HydrophobicContact CB-CE1 4.17Å; C296-I336 HydrophobicContact CB-CD1 4.45Å; C296-I336 HydrophobicContact CB-CG1 4.28Å; C296-I336 HydrophobicContact CB-CG2 4Å; C296-N338 WeakPolarHBondContact O-CB 3.28Å; C296-N338 PolarHBondContact O-ND2 3.16Å
297	P	96.7	Very high	95.8	Very high	3 Å²	3	35.2 Å²	35.2	2%	0.019	20%	0.195	C	C	.	.	P	Polyproline II helix	trans	-63.4	164.9	176.9	-28.1	38.3	0	0	0	114.5	F253 D295 S299 I307 Y309 I336 G466 C467	F253-P297 HydrophobicContact CD1-CG 4.3Å; F253-P297 HydrophobicContact CE1-CG 3.77Å; F253-P297 HydrophobicContact CE2-CG 4.16Å; F253-P297 HydrophobicContact CZ-CB 4.46Å; F253-P297 HydrophobicContact CZ-CG 3.69Å; D295-P297 WeakPolarHBondContact O-CD 3.4Å; P297-S299 PolarHBondContact O-N 3.2Å; P297-I307 HydrophobicContact CB-CD1 4Å; P297-I307 HydrophobicContact CB-CG2 4.17Å; P297-Y309 VanDerWaalsContact CD-OH 3.23Å; P297-Y309 WeakPolarHBondContact CD-OH 3.35Å; P297-Y309 PolarHBondContact O-OH 3.45Å; P297-I336 WeakPolarHBondContact O-CG2 3.36Å; P297-G466 WeakPolarHBondContact CG-O 3.25Å; P297-C467 HydrophobicContact CG-CB 4.24Å
298	Q	96.7	Very high	95.9	Very high	4 Å²	4	33.5 Å²	33.5	2%	0.019	18%	0.177	C	C	.	.	P	Polyproline II helix	trans	-63	132.4	172.9	173.6	59.8	48.9	0	0	111.4	I336 P461 I463	Q298-I336 PolarHBondContact NE2-O 2.99Å; Q298-I336 VanDerWaalsContact NE2-O 3.14Å; Q298-I336 PolarHBondContact OE1-O 2.64Å; Q298-P461 HydrophobicContact CG-CG 4.28Å; Q298-I463 HydrophobicContact CB-CD1 3.83Å; Q298-I463 HydrophobicContact CB-CG1 3.97Å; Q298-I463 HydrophobicContact CG-CD1 3.93Å; Q298-I463 HydrophobicContact CG-CG1 4.2Å
299	S	97.4	Very high	95.9	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.175	C	C	.	.	P	Polyproline II helix	trans	-61.9	138.2	173.2	-62.5	0	0	0	0	112.2	P297 I307 Y309 I336	P297-S299 PolarHBondContact O-N 3.2Å; S299-I307 WeakPolarHBondContact CA-O 3.22Å; S299-Y309 VanDerWaalsContact OG-CD2 3.23Å; S299-Y309 WeakPolarHBondContact OG-CD2 3.14Å; S299-Y309 WeakPolarHBondContact OG-CE2 3.24Å; S299-I336 PolarHBondContact N-O 2.59Å; S299-I336 VanDerWaalsContact N-O 3.14Å; S299-I336 PolarHBondContact OG-N 3.27Å
300	F	96.1	Very high	95.9	Very high	2 Å²	2	29.5 Å²	29.5	1%	0.009	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	142	-173.5	-179.6	-105	0	0	0	111.9	S306 I307 Q406 A408 A460 I463 L470 V472	F300-S306 CarbonylContact O-C 3.58Å; F300-S306 VanDerWaalsContact O-CA 3.23Å; F300-S306 WeakPolarHBondContact O-CA 3.23Å; F300-I307 HydrophobicContact CB-CB 4.34Å; F300-I307 HydrophobicContact CB-CG1 4.41Å; F300-I307 PolarHBondContact N-O 2.95Å; F300-I307 PolarHBondContact O-N 2.9Å; F300-Q406 VanDerWaalsContact CE2-NE2 3.26Å; F300-A408 HydrophobicContact CE1-CB 4.45Å; F300-A408 HydrophobicContact CZ-CB 4.25Å; F300-A460 HydrophobicContact CD2-CB 3.87Å; F300-A460 HydrophobicContact CE2-CB 4.42Å; F300-I463 HydrophobicContact CB-CD1 3.77Å; F300-I463 HydrophobicContact CD2-CD1 4.4Å; F300-I463 HydrophobicContact CG-CD1 4.19Å; F300-L470 HydrophobicContact CD1-CD1 3.99Å; F300-L470 HydrophobicContact CD1-CD2 4.44Å; F300-V472 HydrophobicContact CD1-CG2 4.01Å; F300-V472 HydrophobicContact CD2-CG2 3.81Å; F300-V472 HydrophobicContact CE1-CG2 3.84Å; F300-V472 HydrophobicContact CE2-CG1 4.1Å; F300-V472 HydrophobicContact CE2-CG2 3.63Å; F300-V472 HydrophobicContact CG-CG2 4Å; F300-V472 HydrophobicContact CZ-CG2 3.65Å
301	E	95	Very high	95.9	Very high	7 Å²	7	29 Å²	29	3%	0.033	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	131	178.2	-72.7	-60.5	136.6	0	0	111.9	S306 R308 T545 Y565 P567	E301-S306 WeakPolarHBondContact OE1-CB 3.23Å; E301-R308 WeakPolarHBondContact OE1-CD 3.45Å; E301-R308 WeakPolarHBondContact OE1-CG 3.38Å; E301-R308 IonicContact OE1-CZ 3.31Å; E301-R308 IonicContact OE1-NE 2.79Å; E301-R308 PolarHBondContact OE1-NE 3.08Å; E301-R308 IonicContact OE1-NH2 3.98Å; E301-R308 IonicContact OE2-CZ 3.92Å; E301-R308 IonicContact OE2-NE 2.62Å; E301-R308 PolarHBondContact OE2-NE 2.8Å; E301-R308 IonicContact OE2-NH2 2.72Å; E301-R308 PolarHBondContact OE2-NH2 3.44Å; E301-T545 HydrophobicContact CB-CG2 4.22Å; E301-T545 PolarHBondContact O-OG1 2.91Å; E301-Y565 HydrophobicContact CG-CD1 3.89Å; E301-Y565 HydrophobicContact CG-CE1 4Å; E301-P567 HydrophobicContact CB-CG 4.18Å; E301-P567 HydrophobicContact CG-CG 3.65Å
302	S	92.6	Very high	95.9	Very high	13 Å²	13	24.9 Å²	24.9	9%	0.091	14%	0.139	C	C	.	.			trans	-152.8	171.7	172.6	69.3	0	0	0	0	110.7	S304 G305 Y410	S302-S304 VanDerWaalsContact C-N 3.34Å; S302-S304 PolarHBondContact O-N 3.37Å; S302-G305 PolarHBondContact N-O 2.92Å; S302-G305 PolarHBondContact OG-N 3.36Å; S302-G305 VanDerWaalsContact OG-N 3.11Å; S302-G305 PolarHBondContact OG-O 3.33Å; S302-Y410 VanDerWaalsContact CB-OH 3.23Å; S302-Y410 WeakPolarHBondContact CB-OH 3.03Å; S302-Y410 PolarHBondContact OG-OH 3.26Å
303	N	88.6	Confident	95.8	Very high	126 Å²	126	24.7 Å²	24.7	67%	0.674	14%	0.138	S	C	*	.	S	Bend	trans	-67.2	-35.5	178.4	-65.3	-9.5	0	0	0	112.5	Q548	N303-Q548 PolarHBondContact OD1-NE2 2.94Å
304	S	92.3	Very high	95.6	Very high	11 Å²	11	24.5 Å²	24.5	8%	0.077	14%	0.135	C	C	.	.	S	Bend	trans	-92	-10.4	-177.1	-81.9	0	0	0	0	114.8	T228 R229 S302 W423 E425	T228-S304 CarbonylContact C-O 3.6Å; T228-S304 VanDerWaalsContact CA-O 3.29Å; T228-S304 WeakPolarHBondContact CA-O 3.43Å; R229-S304 PolarHBondContact N-O 3.22Å; R229-S304 WeakPolarHBondContact O-CA 3.36Å; S302-S304 VanDerWaalsContact C-N 3.34Å; S302-S304 PolarHBondContact O-N 3.37Å; S304-W423 VanDerWaalsContact CB-NE1 3.27Å; S304-W423 PolarHBondContact OG-NE1 3.11Å; S304-W423 VanDerWaalsContact OG-NE1 3.09Å; S304-E425 VanDerWaalsContact CB-CD 3.47Å; S304-E425 WeakPolarHBondContact CB-OE1 3.4Å; S304-E425 VanDerWaalsContact OG-CD 3.23Å; S304-E425 PolarHBondContact OG-OE1 3.43Å
305	G	94.4	Very high	95.4	Very high	4 Å²	4	19.7 Å²	19.7	4%	0.041	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	179.9	165.1	179.3	0	0	0	0	0	115	F227 S302	F227-G305 CarbonylContact O-C 3.54Å; F227-G305 WeakPolarHBondContact O-CA 3.43Å; S302-G305 PolarHBondContact N-O 2.92Å; S302-G305 PolarHBondContact OG-N 3.36Å; S302-G305 VanDerWaalsContact OG-N 3.11Å; S302-G305 PolarHBondContact OG-O 3.33Å
306	S	96	Very high	95.1	Very high	5 Å²	5	16.6 Å²	16.6	4%	0.035	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	153.6	-172.6	59.9	0	0	0	0	111.5	A226 F227 F300 E301 R308	A226-S306 CarbonylContact C-O 3.55Å; A226-S306 VanDerWaalsContact CA-O 3.23Å; A226-S306 WeakPolarHBondContact CA-O 3.36Å; F227-S306 PolarHBondContact N-O 3.5Å; F227-S306 PolarHBondContact O-N 3.29Å; F300-S306 CarbonylContact O-C 3.58Å; F300-S306 VanDerWaalsContact O-CA 3.23Å; F300-S306 WeakPolarHBondContact O-CA 3.23Å; E301-S306 WeakPolarHBondContact OE1-CB 3.23Å; S306-R308 PolarHBondContact OG-NE 3.36Å
307	I	97.9	Very high	94.3	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	106.7	165.4	-59.1	-176.2	0	0	0	106.1	A226 F253 P297 S299 F300 Y309 I463 C467 L470	A226-I307 HydrophobicContact CB-CG1 4.12Å; F253-I307 HydrophobicContact CE2-CG2 3.87Å; F253-I307 HydrophobicContact CZ-CG2 4.45Å; P297-I307 HydrophobicContact CB-CD1 4Å; P297-I307 HydrophobicContact CB-CG2 4.17Å; S299-I307 WeakPolarHBondContact CA-O 3.22Å; F300-I307 HydrophobicContact CB-CB 4.34Å; F300-I307 HydrophobicContact CB-CG1 4.41Å; F300-I307 PolarHBondContact N-O 2.95Å; F300-I307 PolarHBondContact O-N 2.9Å; I307-Y309 HydrophobicContact CG2-CE2 3.7Å; I307-Y309 WeakPolarHBondContact CG2-OH 3.01Å; I307-I463 HydrophobicContact CD1-CD1 4.33Å; I307-I463 HydrophobicContact CD1-CG2 4.35Å; I307-C467 HydrophobicContact CD1-CB 4.01Å; I307-L470 HydrophobicContact CD1-CD1 3.81Å; I307-L470 HydrophobicContact CD1-CG 4.26Å; I307-L470 HydrophobicContact CG1-CD1 4.07Å; I307-L470 HydrophobicContact CG1-CD2 4.05Å; I307-L470 HydrophobicContact CG1-CG 4.21Å
308	R	97.2	Very high	93.3	Very high	53 Å²	53	21.5 Å²	21.5	20%	0.2	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	145.5	-169.8	-72.2	174.5	-176	166.8	4.1	111.4	G224 E225 E301 S306 L333	G224-R308 WeakPolarHBondContact CA-O 3.44Å; E225-R308 PolarHBondContact N-O 2.89Å; E225-R308 PolarHBondContact O-N 2.76Å; E301-R308 WeakPolarHBondContact OE1-CD 3.45Å; E301-R308 WeakPolarHBondContact OE1-CG 3.38Å; E301-R308 IonicContact OE1-CZ 3.31Å; E301-R308 IonicContact OE1-NE 2.79Å; E301-R308 PolarHBondContact OE1-NE 3.08Å; E301-R308 IonicContact OE1-NH2 3.98Å; E301-R308 IonicContact OE2-CZ 3.92Å; E301-R308 IonicContact OE2-NE 2.62Å; E301-R308 PolarHBondContact OE2-NE 2.8Å; E301-R308 IonicContact OE2-NH2 2.72Å; E301-R308 PolarHBondContact OE2-NH2 3.44Å; S306-R308 PolarHBondContact OG-NE 3.36Å; R308-L333 HydrophobicContact CB-CD2 4.39Å; R308-L333 HydrophobicContact CG-CD2 4.23Å
309	Y	98.3	Very high	91.9	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	134	172.6	-52.7	-90.8	0	0	0	109.4	L223 F253 F254 C296 P297 S299 I307 L333 F334 I336	L223-Y309 CarbonylContact O-C 3.51Å; L223-Y309 VanDerWaalsContact O-CA 3.28Å; L223-Y309 WeakPolarHBondContact O-CA 3.36Å; F253-Y309 HydrophobicContact CD2-CE1 4.12Å; F254-Y309 AromaticContact CE1-CD1 3.7Å; F254-Y309 HydrophobicContact CE1-CD1 3.7Å; F254-Y309 AromaticContact CE1-CE1 3.81Å; F254-Y309 HydrophobicContact CE1-CE1 3.81Å; F254-Y309 AromaticContact CZ-CD1 3.84Å; F254-Y309 HydrophobicContact CZ-CD1 3.84Å; F254-Y309 HydrophobicContact CZ-CE1 4.41Å; C296-Y309 HydrophobicContact CB-CE1 4.17Å; P297-Y309 VanDerWaalsContact CD-OH 3.23Å; P297-Y309 WeakPolarHBondContact CD-OH 3.35Å; P297-Y309 PolarHBondContact O-OH 3.45Å; S299-Y309 VanDerWaalsContact OG-CD2 3.23Å; S299-Y309 WeakPolarHBondContact OG-CD2 3.14Å; S299-Y309 WeakPolarHBondContact OG-CE2 3.24Å; I307-Y309 HydrophobicContact CG2-CE2 3.7Å; I307-Y309 WeakPolarHBondContact CG2-OH 3.01Å; Y309-L333 WeakPolarHBondContact O-CA 3.22Å; Y309-F334 VanDerWaalsContact CB-CZ 3.42Å; Y309-F334 HydrophobicContact CG-CE2 4.24Å; Y309-F334 HydrophobicContact CG-CZ 4.34Å; Y309-F334 PolarHBondContact O-N 3.49Å; Y309-I336 HydrophobicContact CD1-CG1 3.83Å; Y309-I336 HydrophobicContact CD2-CB 3.92Å; Y309-I336 HydrophobicContact CD2-CG1 3.39Å; Y309-I336 HydrophobicContact CE1-CG1 3.87Å; Y309-I336 HydrophobicContact CE2-CB 3.64Å; Y309-I336 HydrophobicContact CE2-CG1 3.43Å; Y309-I336 VanDerWaalsContact CE2-CG1 3.43Å; Y309-I336 HydrophobicContact CG-CG1 3.61Å
310	C	97.7	Very high	90.4	Very high	10 Å²	10	27.7 Å²	27.7	7%	0.068	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	151.5	-179.4	66.3	0	0	0	0	112.5	C222 L223 K331 R332 L333	C222-C310 WeakPolarHBondContact CA-O 3.46Å; L223-C310 PolarHBondContact N-O 2.96Å; L223-C310 PolarHBondContact O-N 3.43Å; C310-K331 HydrophobicContact CB-CG 4.25Å; C310-R332 CarbonylContact C-O 3.52Å; C310-R332 WeakPolarHBondContact CA-O 3.34Å; C310-R332 VanDerWaalsContact CB-O 3.25Å; C310-R332 WeakPolarHBondContact CB-O 3.4Å; C310-L333 HydrophobicContact CB-CD1 4.37Å; C310-L333 HydrophobicContact CB-CG 4.01Å
311	C	98.4	Very high	88.7	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	144.5	156.1	-65.9	0	0	0	0	110.1	I186 Y188 L201 M220 F221 K331 R332	I186-C311 HydrophobicContact CD1-CB 3.96Å; I186-C311 WeakPolarHBondContact CD1-O 3.15Å; I186-C311 HydrophobicContact CG2-CB 4.31Å; Y188-C311 HydrophobicContact CE1-CB 4.13Å; Y188-C311 VanDerWaalsContact OH-CB 3.22Å; Y188-C311 WeakPolarHBondContact OH-CB 3.38Å; Y188-C311 PolarHBondContact OH-N 3.3Å; Y188-C311 PolarHBondContact OH-SG 3.36Å; L201-C311 WeakPolarHBondContact CD2-SG 3.23Å; M220-C311 HydrophobicContact CE-CB 3.86Å; F221-C311 CarbonylContact O-C 3.48Å; F221-C311 WeakPolarHBondContact O-CA 3.39Å; C311-K331 WeakPolarHBondContact O-CA 3.45Å; C311-R332 PolarHBondContact N-O 2.51Å; C311-R332 PolarHBondContact O-N 3.28Å
312	M	97.3	Very high	87.2	Confident	38 Å²	38	38 Å²	38	19%	0.187	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	133.3	173.9	-176	177.4	69.1	0	0	108.7	M220 F221 E314 I329 T330	M220-M312 WeakPolarHBondContact CA-O 3.38Å; F221-M312 HydrophobicContact CB-CB 4.43Å; F221-M312 HydrophobicContact CD2-CE 3.94Å; F221-M312 HydrophobicContact CE2-CE 4.48Å; F221-M312 HydrophobicContact CG-CE 4.33Å; F221-M312 PolarHBondContact N-O 2.81Å; F221-M312 PolarHBondContact O-N 2.94Å; M312-E314 HydrophobicContact CE-CG 4.11Å; M312-E314 WeakPolarHBondContact CE-OE1 3.38Å; M312-I329 HydrophobicContact CG-CG2 3.64Å; M312-I329 HydrophobicContact SD-CG2 3.82Å; M312-T330 CarbonylContact C-O 3.54Å; M312-T330 VanDerWaalsContact CA-O 3.28Å; M312-T330 WeakPolarHBondContact CA-O 3.49Å; M312-T330 WeakPolarHBondContact CG-O 3.47Å
313	A	96.2	Very high	85.8	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.008	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	137.7	172.2	0	0	0	0	0	109.6	I186 L205 K219 M220 I329 T330	I186-A313 HydrophobicContact CD1-CB 4.37Å; I186-A313 HydrophobicContact CG1-CB 4.43Å; L205-A313 HydrophobicContact CD1-CB 3.44Å; L205-A313 VanDerWaalsContact CD1-CB 3.44Å; L205-A313 HydrophobicContact CD2-CB 3.79Å; L205-A313 HydrophobicContact CG-CB 4.26Å; K219-A313 CarbonylContact O-C 3.54Å; K219-A313 VanDerWaalsContact O-CA 3.27Å; K219-A313 WeakPolarHBondContact O-CA 3.34Å; M220-A313 HydrophobicContact SD-CB 3.32Å; M220-A313 WeakPolarHBondContact SD-CB 3.07Å; A313-I329 VanDerWaalsContact O-CA 3.29Å; A313-I329 WeakPolarHBondContact O-CA 3.31Å; A313-T330 HydrophobicContact CB-CG2 3.71Å; A313-T330 PolarHBondContact N-O 2.98Å; A313-T330 PolarHBondContact O-N 3Å
314	E	93.3	Very high	84.8	Confident	19 Å²	19	49 Å²	49	9%	0.089	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	121.9	174.1	-56.9	-171.8	153.3	0	0	109.4	K219 F221 M312 Y316 K327 I329	K219-E314 HydrophobicContact CB-CB 4.45Å; K219-E314 PolarHBondContact N-O 3.12Å; K219-E314 PolarHBondContact O-N 3.46Å; F221-E314 HydrophobicContact CD2-CG 4.2Å; F221-E314 HydrophobicContact CE2-CB 4.26Å; F221-E314 HydrophobicContact CE2-CG 3.78Å; M312-E314 HydrophobicContact CE-CG 4.11Å; M312-E314 WeakPolarHBondContact CE-OE1 3.38Å; E314-Y316 HydrophobicContact CB-CD2 4.34Å; E314-Y316 HydrophobicContact CB-CE2 3.59Å; E314-Y316 WeakPolarHBondContact OE2-CE2 3.33Å; E314-Y316 PolarHBondContact OE2-OH 3.49Å; E314-K327 WeakPolarHBondContact OE1-CE 3.45Å; E314-K327 IonicContact OE1-NZ 3.48Å; E314-K327 PolarHBondContact OE1-NZ 3.45Å; E314-K327 WeakPolarHBondContact OE2-CE 3.48Å; E314-K327 IonicContact OE2-NZ 3.77Å; E314-K327 PolarHBondContact OE2-NZ 3.11Å; E314-I329 HydrophobicContact CG-CG1 4.39Å
315	M	90.8	Very high	83.8	Confident	1 Å²	1	49.9 Å²	49.9	1%	0.005	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	126.1	176	-177.6	-177.2	73.9	0	0	109	L177 V181 L184 I207 V215 V218 K327 K328	L177-M315 HydrophobicContact CD1-CE 3.9Å; L177-M315 HydrophobicContact CD2-CE 3.93Å; L177-M315 HydrophobicContact CG-CE 4.05Å; V181-M315 HydrophobicContact CB-CE 4.09Å; V181-M315 HydrophobicContact CG1-CE 4.17Å; V181-M315 HydrophobicContact CG2-CE 3.26Å; V181-M315 HydrophobicContact CG2-SD 4.18Å; L184-M315 HydrophobicContact CD2-CB 4.48Å; I207-M315 HydrophobicContact CD1-SD 4.4Å; I207-M315 HydrophobicContact CG2-SD 4.36Å; V215-M315 HydrophobicContact CG1-CG 3.58Å; V215-M315 HydrophobicContact CG1-SD 4.14Å; V215-M315 HydrophobicContact CG2-SD 4.08Å; V218-M315 HydrophobicContact CG2-CG 4.25Å; M315-K327 WeakPolarHBondContact O-CA 3.37Å; M315-K328 HydrophobicContact CE-CB 3.99Å; M315-K328 HydrophobicContact CE-CD 4.38Å; M315-K328 PolarHBondContact N-O 2.96Å; M315-K328 PolarHBondContact O-N 2.92Å
316	Y	87.2	Confident	83.1	Confident	51 Å²	51	50.6 Å²	50.6	20%	0.2	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	138.1	-179.1	-66.4	-92.5	0	0	0	111	D216 S217 K219 E314 A325 T326 K327	D216-Y316 PolarHBondContact N-O 3.18Å; S217-Y316 PolarHBondContact N-O 3.5Å; S217-Y316 PolarHBondContact O-N 3.48Å; K219-Y316 HydrophobicContact CD-CD2 4.49Å; K219-Y316 HydrophobicContact CD-CE2 4.19Å; E314-Y316 HydrophobicContact CB-CD2 4.34Å; E314-Y316 HydrophobicContact CB-CE2 3.59Å; E314-Y316 WeakPolarHBondContact OE2-CE2 3.33Å; E314-Y316 PolarHBondContact OE2-OH 3.49Å; Y316-A325 HydrophobicContact CD1-CB 4.12Å; Y316-T326 WeakPolarHBondContact CA-O 3.15Å; Y316-K327 HydrophobicContact CD1-CB 4.19Å; Y316-K327 HydrophobicContact CD1-CG 4.17Å; Y316-K327 HydrophobicContact CE1-CB 4.07Å; Y316-K327 HydrophobicContact CE1-CD 3.67Å; Y316-K327 HydrophobicContact CE1-CG 3.73Å; Y316-K327 WeakPolarHBondContact OH-CE 3.01Å; Y316-K327 PolarHBondContact OH-NZ 2.76Å; Y316-K327 VanDerWaalsContact OH-NZ 3.09Å
317	R	80.7	Confident	82.6	Confident	33 Å²	33	53.5 Å²	53.5	13%	0.125	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	129.1	174	178.8	-171.7	178.7	-170.7	2.1	112.1	L177 M180 C213 N214 D216 A325 T326	L177-R317 HydrophobicContact CD1-CB 3.72Å; L177-R317 VanDerWaalsContact CD1-CD 3.41Å; L177-R317 HydrophobicContact CD1-CG 4.22Å; M180-R317 PolarHBondContact SD-NH1 2.97Å; C213-R317 PolarHBondContact SG-NE 3.31Å; C213-R317 PolarHBondContact SG-NH1 3.48Å; N214-R317 VanDerWaalsContact O-CD 3.3Å; N214-R317 WeakPolarHBondContact O-CD 3.48Å; N214-R317 WeakPolarHBondContact O-CG 3.41Å; N214-R317 PolarHBondContact O-NE 3.14Å; D216-R317 VanDerWaalsContact OD2-C 3.31Å; D216-R317 WeakPolarHBondContact OD2-CA 3.33Å; R317-A325 CarbonylContact O-C 3.57Å; R317-A325 WeakPolarHBondContact O-CA 3.44Å; R317-T326 PolarHBondContact N-O 3.45Å; R317-T326 PolarHBondContact O-N 3.3Å; R317-T326 PolarHBondContact O-OG1 3.11Å
318	H	76	Confident	82.1	Confident	73 Å²	73	55.7 Å²	55.7	34%	0.338	27%	0.268	S	S	.	.			trans	-94.4	125.7	166.1	-60.2	79.5	0	0	0	109.2	D216 K275	D216-H318 IonicContact OD2-CE1 3.69Å; D216-H318 IonicContact OD2-CG 2.68Å; D216-H318 PolarHBondContact OD2-N 2.99Å; D216-H318 IonicContact OD2-ND1 3.66Å; D216-H318 PolarHBondContact OD2-ND1 3.27Å; K275-H318 PolarHBondContact NZ-O 2.95Å
319	E	67.7	Low	81.9	Confident	24 Å²	24	54 Å²	54	11%	0.112	26%	0.263	C	S	.	.			trans	-66.9	149.9	165.3	-67	-166.2	-174.2	0	0	110.2	S176 N321 D322	S176-E319 WeakPolarHBondContact CB-OE1 3.41Å; S176-E319 PolarHBondContact OG-OE1 3.11Å; E319-N321 PolarHBondContact O-N 3.47Å; E319-D322 HydrophobicContact CB-CB 4.16Å; E319-D322 PolarHBondContact O-N 3.1Å
320	D	64.1	Low	81.7	Confident	111 Å²	111	55.1 Å²	55.1	59%	0.594	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	99.7	176.5	-63	-29.7	0	0	0	108.4	K275	K275-D320 IonicContact NZ-OD1 3.84Å; K275-D320 PolarHBondContact NZ-OD1 3.4Å
321	N	61.5	Low	81.6	Confident	150 Å²	150	56.3 Å²	56.3	80%	0.802	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	113.2	-8.5	-179.8	-59.5	-27.1	0	0	0	116	E319	E319-N321 PolarHBondContact O-N 3.47Å
322	D	62.2	Low	81.5	Confident	74 Å²	74	60.5 Å²	60.5	40%	0.396	29%	0.29	S	S	.	.			trans	-87.8	132.2	175.5	-76.6	-18.3	0	0	0	111	E319 E324	E319-D322 HydrophobicContact CB-CB 4.16Å; E319-D322 PolarHBondContact O-N 3.1Å; D322-E324 VanDerWaalsContact C-N 3.27Å
323	K	63.4	Low	81.5	Confident	211 Å²	211	59.2 Å²	59.2	92%	0.917	28%	0.284	S	S	*	.	S	Bend	trans	-74.9	-21.6	172.6	-68.8	-174	179.1	-178.4	0	112.3
324	E	67.5	Low	81.6	Confident	161 Å²	161	59.2 Å²	59.2	75%	0.752	28%	0.283	S	S	*	.	S	Bend	trans	-103.8	126.6	-174.4	-170.1	149.3	-166.9	0	0	110.7	D322	D322-E324 VanDerWaalsContact C-N 3.27Å
325	A	72.5	Confident	81.8	Confident	29 Å²	29	58.3 Å²	58.3	24%	0.24	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-73.2	127.2	176.2	0	0	0	0	0	110.1	Y316 R317 K327	Y316-A325 HydrophobicContact CD1-CB 4.12Å; R317-A325 CarbonylContact O-C 3.57Å; R317-A325 WeakPolarHBondContact O-CA 3.44Å; A325-K327 PolarHBondContact O-N 2.98Å
326	T	79.3	Confident	82.1	Confident	18 Å²	18	58.2 Å²	58.2	11%	0.11	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	129.5	161.2	58.2	0	0	0	0	109.3	P174 Y316 R317	P174-T326 HydrophobicContact CB-CG2 4.26Å; Y316-T326 WeakPolarHBondContact CA-O 3.15Å; R317-T326 PolarHBondContact N-O 3.45Å; R317-T326 PolarHBondContact O-N 3.3Å; R317-T326 PolarHBondContact O-OG1 3.11Å
327	K	85.4	Confident	82.5	Confident	67 Å²	67	55.9 Å²	55.9	29%	0.291	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	123.4	-177.8	-176.1	-176.6	-176.2	176.8	0	110.1	E314 M315 Y316 A325 I329	E314-K327 WeakPolarHBondContact OE1-CE 3.45Å; E314-K327 IonicContact OE1-NZ 3.48Å; E314-K327 PolarHBondContact OE1-NZ 3.45Å; E314-K327 WeakPolarHBondContact OE2-CE 3.48Å; E314-K327 IonicContact OE2-NZ 3.77Å; E314-K327 PolarHBondContact OE2-NZ 3.11Å; M315-K327 WeakPolarHBondContact O-CA 3.37Å; Y316-K327 HydrophobicContact CD1-CB 4.19Å; Y316-K327 HydrophobicContact CD1-CG 4.17Å; Y316-K327 HydrophobicContact CE1-CB 4.07Å; Y316-K327 HydrophobicContact CE1-CD 3.67Å; Y316-K327 HydrophobicContact CE1-CG 3.73Å; Y316-K327 WeakPolarHBondContact OH-CE 3.01Å; Y316-K327 PolarHBondContact OH-NZ 2.76Å; Y316-K327 VanDerWaalsContact OH-NZ 3.09Å; A325-K327 PolarHBondContact O-N 2.98Å; K327-I329 HydrophobicContact CD-CD1 3.93Å; K327-I329 HydrophobicContact CD-CG1 4.08Å; K327-I329 HydrophobicContact CG-CD1 4.37Å; K327-I329 HydrophobicContact CG-CG1 3.98Å
328	K	88.4	Confident	83.1	Confident	46 Å²	46	57.4 Å²	57.4	20%	0.2	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	135.2	167.8	-165.8	170.6	-174.8	-179.7	0	109.2	L177 V181 E182 L184 M315	L177-K328 HydrophobicContact CD2-CB 3.79Å; V181-K328 HydrophobicContact CB-CD 4.08Å; V181-K328 HydrophobicContact CG1-CD 3.95Å; V181-K328 PolarHBondContact O-NZ 3.31Å; E182-K328 PolarHBondContact O-NZ 2.91Å; L184-K328 HydrophobicContact CB-CD 4.21Å; L184-K328 HydrophobicContact CD2-CB 4.25Å; L184-K328 HydrophobicContact CD2-CD 4.4Å; L184-K328 HydrophobicContact CD2-CG 3.94Å; M315-K328 HydrophobicContact CE-CB 3.99Å; M315-K328 HydrophobicContact CE-CD 4.38Å; M315-K328 PolarHBondContact N-O 2.96Å; M315-K328 PolarHBondContact O-N 2.92Å
329	I	92.3	Very high	83.6	Confident	18 Å²	18	54.9 Å²	54.9	9%	0.092	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	145.8	-177.4	-51.7	-179.5	0	0	0	108.7	M312 A313 E314 K327 H558 L559	M312-I329 HydrophobicContact CG-CG2 3.64Å; M312-I329 HydrophobicContact SD-CG2 3.82Å; A313-I329 VanDerWaalsContact O-CA 3.29Å; A313-I329 WeakPolarHBondContact O-CA 3.31Å; E314-I329 HydrophobicContact CG-CG1 4.39Å; K327-I329 HydrophobicContact CD-CD1 3.93Å; K327-I329 HydrophobicContact CD-CG1 4.08Å; K327-I329 HydrophobicContact CG-CD1 4.37Å; K327-I329 HydrophobicContact CG-CG1 3.98Å; I329-H558 HydrophobicContact CB-CB 4.31Å; I329-H558 HydrophobicContact CD1-CB 3.7Å; I329-H558 HydrophobicContact CG1-CB 4.1Å; I329-L559 HydrophobicContact CB-CD2 4.2Å; I329-L559 HydrophobicContact CG2-CD2 4.22Å; I329-L559 WeakPolarHBondContact O-CD2 3.31Å
330	T	94.5	Very high	84.7	Confident	23 Å²	23	55.6 Å²	55.6	14%	0.141	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	151.4	162.2	-167.4	0	0	0	0	109.3	L184 I186 L205 M312 A313	L184-T330 HydrophobicContact CD2-CG2 4.01Å; L184-T330 HydrophobicContact CG-CG2 3.67Å; L184-T330 WeakPolarHBondContact O-CB 3.18Å; L184-T330 PolarHBondContact O-OG1 2.92Å; I186-T330 HydrophobicContact CD1-CG2 3.86Å; I186-T330 HydrophobicContact CG1-CG2 3.76Å; L205-T330 HydrophobicContact CD1-CG2 4.18Å; M312-T330 CarbonylContact C-O 3.54Å; M312-T330 VanDerWaalsContact CA-O 3.28Å; M312-T330 WeakPolarHBondContact CA-O 3.49Å; M312-T330 WeakPolarHBondContact CG-O 3.47Å; A313-T330 HydrophobicContact CB-CG2 3.71Å; A313-T330 PolarHBondContact N-O 2.98Å; A313-T330 PolarHBondContact O-N 3Å
331	K	95.5	Very high	86	Confident	34 Å²	34	51.6 Å²	51.6	15%	0.148	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	132.4	-176.4	-177.3	-179.9	-174.4	174.1	0	109.3	C310 C311 I550 E555 L559 I563	C310-K331 HydrophobicContact CB-CG 4.25Å; C311-K331 WeakPolarHBondContact O-CA 3.45Å; K331-I550 HydrophobicContact CD-CD1 4.19Å; K331-E555 WeakPolarHBondContact CD-OE1 3.45Å; K331-E555 IonicContact NZ-OE1 3.84Å; K331-E555 PolarHBondContact NZ-OE1 2.82Å; K331-E555 IonicContact NZ-OE2 3.79Å; K331-E555 PolarHBondContact NZ-OE2 2.79Å; K331-L559 HydrophobicContact CB-CD1 3.87Å; K331-L559 HydrophobicContact CD-CD1 4.32Å; K331-I563 HydrophobicContact CB-CD1 4.04Å
332	R	96	Very high	87.5	Confident	88 Å²	88	45 Å²	45	33%	0.332	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	140.4	176.4	-162.6	176.4	174.9	169.6	-2	110.1	I186 Y188 C310 C311	I186-R332 HydrophobicContact CB-CB 4.02Å; I186-R332 HydrophobicContact CD1-CB 4.35Å; I186-R332 HydrophobicContact CG2-CB 4.3Å; I186-R332 WeakPolarHBondContact O-CD 2.99Å; I186-R332 PolarHBondContact O-NH1 3.09Å; Y188-R332 HydrophobicContact CD2-CG 4.32Å; Y188-R332 HydrophobicContact CE2-CB 3.96Å; Y188-R332 HydrophobicContact CE2-CG 3.7Å; Y188-R332 PolarHBondContact OH-O 3.11Å; C310-R332 CarbonylContact C-O 3.52Å; C310-R332 WeakPolarHBondContact CA-O 3.34Å; C310-R332 VanDerWaalsContact CB-O 3.25Å; C310-R332 WeakPolarHBondContact CB-O 3.4Å; C311-R332 PolarHBondContact N-O 2.51Å; C311-R332 PolarHBondContact O-N 3.28Å
333	L	96.9	Very high	88.8	Confident	12 Å²	12	43.9 Å²	43.9	6%	0.063	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	151.1	-177.2	-76.5	81.2	0	0	0	110.1	R308 Y309 C310 I550 I563 Y565	R308-L333 HydrophobicContact CB-CD2 4.39Å; R308-L333 HydrophobicContact CG-CD2 4.23Å; Y309-L333 WeakPolarHBondContact O-CA 3.22Å; C310-L333 HydrophobicContact CB-CD1 4.37Å; C310-L333 HydrophobicContact CB-CG 4.01Å; L333-I550 HydrophobicContact CD1-CD1 3.22Å; L333-I550 HydrophobicContact CD1-CG1 3.68Å; L333-I550 HydrophobicContact CD2-CD1 4.06Å; L333-I550 HydrophobicContact CD2-CG1 4.05Å; L333-I550 HydrophobicContact CG-CD1 4.25Å; L333-I563 HydrophobicContact CD1-CG2 3.87Å; L333-Y565 HydrophobicContact CB-CD2 3.58Å; L333-Y565 HydrophobicContact CB-CE2 3.92Å; L333-Y565 HydrophobicContact CB-CG 3.93Å; L333-Y565 HydrophobicContact CD2-CD1 3.57Å; L333-Y565 HydrophobicContact CD2-CD2 4.12Å; L333-Y565 HydrophobicContact CD2-CE1 4.12Å; L333-Y565 HydrophobicContact CD2-CG 3.57Å; L333-Y565 HydrophobicContact CG-CD2 4.43Å; L333-Y565 HydrophobicContact CG-CG 4.3Å
334	F	97.4	Very high	89.9	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	161.9	172.4	65.5	-87.2	0	0	0	110	Y188 P193 Y195 L201 L292 Y309 I336 Y565	Y188-F334 HydrophobicContact CE1-CD1 4.4Å; Y188-F334 HydrophobicContact CE2-CB 4.08Å; Y188-F334 AromaticContact CZ-CD1 3.91Å; Y188-F334 WeakPolarHBondContact OH-CD1 3.44Å; P193-F334 HydrophobicContact CB-CB 3.88Å; P193-F334 HydrophobicContact CG-CB 4.37Å; P193-F334 CarbonylContact O-C 3.57Å; P193-F334 WeakPolarHBondContact O-CA 3.33Å; P193-F334 WeakPolarHBondContact O-CB 3.4Å; Y195-F334 HydrophobicContact CD2-CB 4.29Å; Y195-F334 HydrophobicContact CD2-CD2 4.03Å; Y195-F334 HydrophobicContact CD2-CG 4.45Å; Y195-F334 HydrophobicContact CE2-CB 4.5Å; L201-F334 HydrophobicContact CD1-CG 4.49Å; L201-F334 HydrophobicContact CD2-CD1 4Å; L201-F334 HydrophobicContact CD2-CE1 3.49Å; L201-F334 VanDerWaalsContact CD2-CE1 3.49Å; L201-F334 HydrophobicContact CD2-CE2 4.18Å; L201-F334 HydrophobicContact CD2-CZ 3.59Å; L292-F334 HydrophobicContact CD1-CE2 4.17Å; L292-F334 HydrophobicContact CD2-CE2 3.97Å; L292-F334 HydrophobicContact CD2-CZ 3.84Å; Y309-F334 VanDerWaalsContact CB-CZ 3.42Å; Y309-F334 HydrophobicContact CG-CE2 4.24Å; Y309-F334 HydrophobicContact CG-CZ 4.34Å; Y309-F334 PolarHBondContact O-N 3.49Å; F334-I336 HydrophobicContact CD2-CD1 4.33Å; F334-I336 HydrophobicContact CE2-CD1 3.76Å; F334-I336 HydrophobicContact CE2-CG1 4.2Å; F334-Y565 PolarHBondContact O-OH 2.86Å
335	T	97.6	Very high	90.1	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	129.8	-178.2	-57.5	0	0	0	0	109.8	P193 V194 Y195 Y565 P567 H568	P193-T335 PolarHBondContact O-N 2.62Å; V194-T335 WeakPolarHBondContact CA-O 3.2Å; Y195-T335 PolarHBondContact N-O 3.34Å; T335-Y565 PolarHBondContact OG1-OH 2.78Å; T335-Y565 VanDerWaalsContact OG1-OH 3.1Å; T335-P567 HydrophobicContact CG2-CB 4.3Å; T335-H568 HydrophobicContact CG2-CB 4.25Å; T335-H568 WeakPolarHBondContact CG2-O 3.44Å; T335-H568 PolarHBondContact OG1-N 3.35Å
336	I	97.7	Very high	90	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	122.4	161.7	-65.3	-63.6	0	0	0	108.7	Y195 P197 L292 C296 P297 Q298 S299 Y309 F334 N338	Y195-I336 WeakPolarHBondContact O-CA 3.5Å; P197-I336 HydrophobicContact CG-CG2 3.75Å; L292-I336 HydrophobicContact CD1-CD1 3.68Å; C296-I336 HydrophobicContact CB-CD1 4.45Å; C296-I336 HydrophobicContact CB-CG1 4.28Å; C296-I336 HydrophobicContact CB-CG2 4Å; P297-I336 WeakPolarHBondContact O-CG2 3.36Å; Q298-I336 PolarHBondContact NE2-O 2.99Å; Q298-I336 VanDerWaalsContact NE2-O 3.14Å; Q298-I336 PolarHBondContact OE1-O 2.64Å; S299-I336 PolarHBondContact N-O 2.59Å; S299-I336 VanDerWaalsContact N-O 3.14Å; S299-I336 PolarHBondContact OG-N 3.27Å; Y309-I336 HydrophobicContact CD1-CG1 3.83Å; Y309-I336 HydrophobicContact CD2-CB 3.92Å; Y309-I336 HydrophobicContact CD2-CG1 3.39Å; Y309-I336 HydrophobicContact CE1-CG1 3.87Å; Y309-I336 HydrophobicContact CE2-CB 3.64Å; Y309-I336 HydrophobicContact CE2-CG1 3.43Å; Y309-I336 VanDerWaalsContact CE2-CG1 3.43Å; Y309-I336 HydrophobicContact CG-CG1 3.61Å; F334-I336 HydrophobicContact CD2-CD1 4.33Å; F334-I336 HydrophobicContact CE2-CD1 3.76Å; F334-I336 HydrophobicContact CE2-CG1 4.2Å; I336-N338 HydrophobicContact CG2-CB 3.94Å
337	L	95.1	Very high	90	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.005	24%	0.243	C	C	.	.			trans	-98.4	98.8	170.4	-175	61.2	0	0	0	108.8	V194 Y195 F196 P197 V498 L528 I570	V194-L337 HydrophobicContact CG1-CB 3.96Å; V194-L337 HydrophobicContact CG1-CD2 4.46Å; Y195-L337 PolarHBondContact O-N 2.95Å; F196-L337 VanDerWaalsContact CD1-O 3.22Å; F196-L337 WeakPolarHBondContact CD1-O 3.33Å; F196-L337 HydrophobicContact CE1-CB 4.29Å; F196-L337 HydrophobicContact CE1-CD2 4.03Å; F196-L337 HydrophobicContact CE1-CG 4.06Å; F196-L337 HydrophobicContact CE2-CD2 4.14Å; F196-L337 HydrophobicContact CZ-CB 4.29Å; F196-L337 HydrophobicContact CZ-CD2 3.5Å; F196-L337 HydrophobicContact CZ-CG 4.03Å; P197-L337 WeakPolarHBondContact CD-O 2.81Å; L337-V498 HydrophobicContact CD1-CG1 4.08Å; L337-L528 HydrophobicContact CD2-CD1 4.49Å; L337-I570 HydrophobicContact CD2-CB 4.5Å; L337-I570 HydrophobicContact CD2-CG1 4.31Å; L337-I570 HydrophobicContact CD2-CG2 3.54Å
338	N	93.3	Very high	89.8	Confident	65 Å²	65	49 Å²	49	35%	0.348	27%	0.265	S	S	.	.			trans	-134	75.5	179.4	-171.2	16.3	0	0	0	110.2	P197 C296 I336	P197-N338 HydrophobicContact CG-CB 3.53Å; C296-N338 WeakPolarHBondContact O-CB 3.28Å; C296-N338 PolarHBondContact O-ND2 3.16Å; I336-N338 HydrophobicContact CG2-CB 3.94Å
339	G	86.9	Confident	89.6	Confident	20 Å²	20	49.3 Å²	49.3	21%	0.206	27%	0.268	C	S	.	.			trans	-106.8	173.1	-179.8	0	0	0	0	0	113.5	D341 V498	G339-D341 PolarHBondContact O-N 3.11Å; G339-V498 WeakPolarHBondContact O-CG2 3.24Å
340	I	90.9	Very high	89.5	Confident	40 Å²	40	51.8 Å²	51.8	21%	0.205	29%	0.287	C	S	.	.			trans	-77.2	122.5	-179	-54.4	169.6	0	0	0	110.1	L342 T462 V495 G497 V498	I340-L342 HydrophobicContact CG2-CD2 4.08Å; I340-L342 PolarHBondContact O-N 3.13Å; I340-T462 HydrophobicContact CD1-CG2 4.25Å; I340-V495 HydrophobicContact CD1-CG1 3.72Å; I340-G497 CarbonylContact O-C 3.4Å; I340-G497 WeakPolarHBondContact O-CA 3.43Å; I340-V498 PolarHBondContact O-N 3.29Å
341	D	92	Very high	89.6	Confident	26 Å²	26	53.5 Å²	53.5	14%	0.139	29%	0.292	C	S	.	.	B	Isolated β-bridge	trans	-75.2	113.8	163.6	177.6	-7	0	0	0	109.1	G339 N343 T344 V499 Y532	G339-D341 PolarHBondContact O-N 3.11Å; D341-N343 PolarHBondContact O-N 2.87Å; D341-N343 VanDerWaalsContact O-N 3.14Å; D341-N343 VanDerWaalsContact OD1-CB 3.29Å; D341-N343 WeakPolarHBondContact OD1-CB 3.31Å; D341-N343 PolarHBondContact OD1-N 3.28Å; D341-N343 PolarHBondContact OD1-ND2 3.28Å; D341-T344 HydrophobicContact CB-CG2 3.82Å; D341-T344 WeakPolarHBondContact O-CB 3.13Å; D341-T344 PolarHBondContact O-N 3.36Å; D341-T344 PolarHBondContact O-OG1 2.86Å; D341-V499 HydrophobicContact CB-CB 4.21Å; D341-V499 HydrophobicContact CB-CG2 4.29Å; D341-V499 WeakPolarHBondContact OD1-CB 3.25Å; D341-Y532 WeakPolarHBondContact OD2-CE2 3.45Å; D341-Y532 VanDerWaalsContact OD2-CZ 3.25Å; D341-Y532 PolarHBondContact OD2-OH 3.49Å
342	L	92.6	Very high	89.6	Confident	12 Å²	12	55.9 Å²	55.9	6%	0.063	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-2.8	-175.2	-55.5	178.7	0	0	0	113.6	I340 R375 V377 V495 V499 P501	I340-L342 HydrophobicContact CG2-CD2 4.08Å; I340-L342 PolarHBondContact O-N 3.13Å; L342-R375 HydrophobicContact CD1-CB 4.08Å; L342-R375 HydrophobicContact CD2-CB 4.17Å; L342-V377 HydrophobicContact CD1-CG1 3.87Å; L342-V495 HydrophobicContact CD2-CG1 4.19Å; L342-V499 WeakPolarHBondContact CB-O 3.47Å; L342-V499 WeakPolarHBondContact CG-O 3.33Å; L342-V499 PolarHBondContact N-O 2.63Å; L342-P501 HydrophobicContact CB-CG 4.05Å
343	N	89.6	Confident	89.5	Confident	51 Å²	51	53.5 Å²	53.5	27%	0.273	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-13.4	169.4	-55.3	-82.7	0	0	0	112.1	D341 V499 P500 P501 R502	D341-N343 PolarHBondContact O-N 2.87Å; D341-N343 VanDerWaalsContact O-N 3.14Å; D341-N343 VanDerWaalsContact OD1-CB 3.29Å; D341-N343 WeakPolarHBondContact OD1-CB 3.31Å; D341-N343 PolarHBondContact OD1-N 3.28Å; D341-N343 PolarHBondContact OD1-ND2 3.28Å; N343-V499 WeakPolarHBondContact ND2-CG1 3.48Å; N343-P500 PolarHBondContact ND2-O 2.82Å; N343-P501 VanDerWaalsContact OD1-CA 3.25Å; N343-P501 WeakPolarHBondContact OD1-CA 3.32Å; N343-R502 WeakPolarHBondContact OD1-CG 3.22Å; N343-R502 PolarHBondContact OD1-N 3.3Å
344	T	85.7	Confident	89.4	Confident	64 Å²	64	56.5 Å²	56.5	39%	0.393	32%	0.324	S	S	.	.	S	Bend	trans	-83.3	137.2	172.1	68	0	0	0	0	109.7	D341	D341-T344 HydrophobicContact CB-CG2 3.82Å; D341-T344 WeakPolarHBondContact O-CB 3.13Å; D341-T344 PolarHBondContact O-N 3.36Å; D341-T344 PolarHBondContact O-OG1 2.86Å
345	N	73	Confident	89	Confident	131 Å²	131	58.8 Å²	58.8	70%	0.701	34%	0.336	S	S	*	.	S	Bend	trans	56.7	100.8	-178.6	-55.9	-42.7	0	0	0	114.3	Q347	N345-Q347 PolarHBondContact O-N 3.37Å
346	A	69.9	Low	88.6	Confident	114 Å²	114	65.5 Å²	65.5	94%	0.942	37%	0.367	S	S	*	.			trans	-59.8	109.2	173.1	0	0	0	0	0	110.3
347	Q	79.6	Confident	88	Confident	118 Å²	118	66.7 Å²	66.7	55%	0.551	37%	0.372	S	S	*	.			trans	-126.8	166.5	175.6	-70.7	-170.4	-57.2	0	0	109.3	N345 E349 R375	N345-Q347 PolarHBondContact O-N 3.37Å; Q347-E349 PolarHBondContact O-N 3.14Å; Q347-R375 VanDerWaalsContact CD-NH2 3.33Å; Q347-R375 VanDerWaalsContact OE1-NH1 3.07Å
348	E	80.8	Confident	87.3	Confident	165 Å²	165	68.8 Å²	68.8	77%	0.771	39%	0.387	S	S	*	.			trans	-57.6	125.7	176.2	-68.9	-176.8	177.8	0	0	110.8	R375	E348-R375 PolarHBondContact O-NE 3.49Å
349	E	83.7	Confident	86.5	Confident	53 Å²	53	66 Å²	66	25%	0.248	37%	0.372	C	S	.	.			trans	-98.6	-14	178	-71.9	-173	-138.6	0	0	112.6	Q347 P372 N373 V374 K503	Q347-E349 PolarHBondContact O-N 3.14Å; E349-P372 CarbonylContact C-O 3.57Å; E349-P372 CarbonylContact O-C 3.5Å; E349-N373 CarbonylContact O-C 3.55Å; E349-N373 WeakPolarHBondContact O-CA 3.32Å; E349-V374 WeakPolarHBondContact O-CG2 3.48Å; E349-V374 PolarHBondContact O-N 3.05Å; E349-K503 IonicContact OE1-NZ 3.67Å; E349-K503 PolarHBondContact OE1-NZ 2.95Å; E349-K503 WeakPolarHBondContact OE2-CE 3.36Å; E349-K503 IonicContact OE2-NZ 3.67Å; E349-K503 PolarHBondContact OE2-NZ 3.38Å
350	S	91.9	Very high	86	Confident	70 Å²	70	69.4 Å²	69.4	49%	0.49	39%	0.391	S	S	.	.			trans	-119.5	149.6	-177.9	65	0	0	0	0	111.3	V371	S350-V371 CarbonylContact C-O 3.57Å; S350-V371 VanDerWaalsContact CA-O 3.28Å; S350-V371 WeakPolarHBondContact CA-O 3.38Å
351	F	94.8	Very high	85.1	Confident	60 Å²	60	69.3 Å²	69.3	26%	0.263	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	139.3	173.8	-178	-88.7	0	0	0	110.1	S353 Q370 V371 V374 V492	F351-S353 VanDerWaalsContact CE1-CB 3.46Å; F351-Q370 WeakPolarHBondContact O-CA 3.27Å; F351-V371 PolarHBondContact N-O 3.04Å; F351-V371 PolarHBondContact O-N 2.91Å; F351-V374 HydrophobicContact CB-CG1 3.48Å; F351-V374 VanDerWaalsContact CB-CG1 3.48Å; F351-V492 HydrophobicContact CB-CG1 3.87Å; F351-V492 HydrophobicContact CD1-CB 4.19Å; F351-V492 HydrophobicContact CD1-CG1 3.73Å; F351-V492 HydrophobicContact CD1-CG2 3.67Å; F351-V492 HydrophobicContact CD2-CG1 4.39Å; F351-V492 HydrophobicContact CE1-CB 4.34Å; F351-V492 HydrophobicContact CE1-CG1 4.32Å; F351-V492 HydrophobicContact CE1-CG2 3.67Å; F351-V492 HydrophobicContact CG-CG1 3.76Å
352	S	95.3	Very high	84.2	Confident	84 Å²	84	75.3 Å²	75.3	59%	0.587	42%	0.42	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.2	132.3	175.4	-175.1	0	0	0	0	109.2	L369	S352-L369 VanDerWaalsContact CA-O 3.32Å; S352-L369 WeakPolarHBondContact CA-O 3.48Å
353	S	94.9	Very high	83.3	Confident	38 Å²	38	77.5 Å²	77.5	27%	0.266	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	150.2	179.6	-179.8	0	0	0	0	110.8	F351 R368 L369	F351-S353 VanDerWaalsContact CE1-CB 3.46Å; S353-R368 CarbonylContact O-C 3.58Å; S353-R368 WeakPolarHBondContact O-CA 3.13Å; S353-L369 PolarHBondContact N-O 3.41Å; S353-L369 PolarHBondContact O-N 3.35Å
354	E	93.8	Very high	83	Confident	75 Å²	75	80.3 Å²	80.3	35%	0.35	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	131.7	177.5	-174.9	171.9	136.3	0	0	109.7	Q356 V366 C367 R368	E354-Q356 HydrophobicContact CG-CG 4.34Å; E354-Q356 PolarHBondContact OE1-NE2 3.14Å; E354-V366 HydrophobicContact CG-CG1 3.83Å; E354-V366 VanDerWaalsContact OE1-CG1 3.28Å; E354-V366 WeakPolarHBondContact OE1-CG1 3.4Å; E354-C367 CarbonylContact C-O 3.59Å; E354-C367 VanDerWaalsContact CA-O 3.27Å; E354-C367 WeakPolarHBondContact CA-O 3.38Å; E354-R368 HydrophobicContact CB-CG 4.26Å; E354-R368 HydrophobicContact CG-CG 3.9Å; E354-R368 IonicContact OE1-NH2 2.66Å; E354-R368 WeakPolarHBondContact OE2-CG 3.21Å; E354-R368 IonicContact OE2-CZ 3.84Å; E354-R368 VanDerWaalsContact OE2-CZ 3.3Å; E354-R368 IonicContact OE2-NE 2.91Å; E354-R368 PolarHBondContact OE2-NE 3.29Å; E354-R368 IonicContact OE2-NH2 3.06Å; E354-R368 PolarHBondContact OE2-NH2 3.48Å
355	L	89.9	Confident	82.8	Confident	47 Å²	47	77.4 Å²	77.4	25%	0.246	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	133	169.5	-71.2	175.5	0	0	0	108.8	F357 C367 F490	L355-F357 HydrophobicContact CB-CD1 4.45Å; L355-C367 PolarHBondContact N-O 2.75Å; L355-C367 PolarHBondContact O-N 3.15Å; L355-F490 HydrophobicContact CB-CE1 3.98Å; L355-F490 HydrophobicContact CB-CZ 3.78Å; L355-F490 HydrophobicContact CD1-CD1 3.81Å; L355-F490 HydrophobicContact CD1-CD2 3.97Å; L355-F490 HydrophobicContact CD1-CE1 3.64Å; L355-F490 HydrophobicContact CD1-CE2 3.79Å; L355-F490 HydrophobicContact CD1-CG 3.98Å; L355-F490 HydrophobicContact CD1-CZ 3.62Å; L355-F490 HydrophobicContact CG-CD1 3.92Å; L355-F490 HydrophobicContact CG-CE1 3.41Å; L355-F490 VanDerWaalsContact CG-CE1 3.41Å; L355-F490 HydrophobicContact CG-CE2 4.33Å; L355-F490 HydrophobicContact CG-CZ 3.63Å
356	Q	88.8	Confident	83.5	Confident	141 Å²	141	72.6 Å²	72.6	66%	0.659	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.6	129.3	173.3	-58.3	-173.7	0.2	0	0	108.6	E354 F365 V366	E354-Q356 HydrophobicContact CG-CG 4.34Å; E354-Q356 PolarHBondContact OE1-NE2 3.14Å; Q356-F365 WeakPolarHBondContact CA-O 3.16Å; Q356-V366 HydrophobicContact CG-CG1 4.14Å; Q356-V366 HydrophobicContact CG-CG2 4.07Å
357	F	84.9	Confident	84.4	Confident	25 Å²	25	67.2 Å²	67.2	11%	0.11	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	162.7	179.9	59.1	-84.9	0	0	0	110	L355 F365 M482 Q488	L355-F357 HydrophobicContact CB-CD1 4.45Å; F357-F365 HydrophobicContact CD1-CB 4.45Å; F357-F365 HydrophobicContact CD2-CB 4.27Å; F357-F365 HydrophobicContact CD2-CD2 4.27Å; F357-F365 HydrophobicContact CE1-CB 3.96Å; F357-F365 HydrophobicContact CE2-CB 3.77Å; F357-F365 AromaticContact CE2-CD2 3.81Å; F357-F365 HydrophobicContact CE2-CD2 3.81Å; F357-F365 AromaticContact CE2-CG 3.92Å; F357-F365 HydrophobicContact CE2-CG 3.92Å; F357-F365 HydrophobicContact CZ-CB 3.6Å; F357-F365 HydrophobicContact CZ-CD2 4.41Å; F357-F365 HydrophobicContact CZ-CG 4.04Å; F357-F365 PolarHBondContact N-O 3.33Å; F357-F365 VanDerWaalsContact N-O 3.14Å; F357-F365 PolarHBondContact O-N 3.09Å; F357-M482 HydrophobicContact CE2-CG 3.83Å; F357-M482 HydrophobicContact CZ-CE 4.44Å; F357-M482 HydrophobicContact CZ-CG 3.95Å; F357-M482 HydrophobicContact CZ-SD 4.15Å; F357-Q488 HydrophobicContact CD1-CG 3.8Å; F357-Q488 HydrophobicContact CD2-CG 4.01Å; F357-Q488 HydrophobicContact CE1-CB 4.2Å; F357-Q488 HydrophobicContact CE1-CG 3.64Å; F357-Q488 HydrophobicContact CE2-CG 3.84Å; F357-Q488 HydrophobicContact CG-CG 4Å; F357-Q488 HydrophobicContact CZ-CB 4.39Å; F357-Q488 HydrophobicContact CZ-CG 3.65Å
358	S	81.6	Confident	85.1	Confident	45 Å²	45	66 Å²	66	32%	0.315	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	148.1	172.5	-64.3	0	0	0	0	110.6	H363 H364 Q486	S358-H363 CarbonylContact C-O 3.54Å; S358-H363 VanDerWaalsContact CA-O 3.25Å; S358-H363 WeakPolarHBondContact CA-O 3.23Å; S358-H364 PolarHBondContact OG-CD2 2.83Å; S358-H364 VanDerWaalsContact OG-CD2 3.27Å; S358-H364 PolarHBondContact OG-CE1 2.89Å; S358-H364 PolarHBondContact OG-ND1 3.11Å; S358-H364 PolarHBondContact OG-NE2 2.84Å; S358-Q486 PolarHBondContact O-NE2 3.45Å
359	D	75.5	Confident	85.8	Confident	8 Å²	8	58.1 Å²	58.1	4%	0.043	31%	0.307	C	S	.	.			trans	-78	171	167.9	80.1	-12.1	0	0	0	111.4	S361 H362 H363 F365	D359-S361 PolarHBondContact O-N 3.13Å; D359-S361 VanDerWaalsContact OD1-CA 3.23Å; D359-S361 WeakPolarHBondContact OD1-CA 3.13Å; D359-S361 WeakPolarHBondContact OD1-CB 3.45Å; D359-S361 PolarHBondContact OD1-N 2.96Å; D359-S361 PolarHBondContact OD1-OG 2.94Å; D359-S361 WeakPolarHBondContact OD2-CB 3.29Å; D359-S361 PolarHBondContact OD2-OG 3.1Å; D359-H362 PolarHBondContact O-N 2.84Å; D359-H362 PolarHBondContact OD1-N 3.29Å; D359-H363 PolarHBondContact N-O 3.48Å; D359-H363 WeakPolarHBondContact OD1-CA 3.49Å; D359-H363 WeakPolarHBondContact OD1-CB 3.45Å; D359-H363 IonicContact OD1-CG 3.3Å; D359-H363 PolarHBondContact OD1-N 3.02Å; D359-H363 IonicContact OD1-ND1 2.77Å; D359-H363 PolarHBondContact OD1-ND1 3.32Å; D359-H363 IonicContact OD2-CG 3.59Å; D359-H363 IonicContact OD2-ND1 2.63Å; D359-H363 PolarHBondContact OD2-ND1 3.46Å; D359-F365 HydrophobicContact CB-CE2 3.9Å
360	P	75.9	Confident	86.4	Confident	91 Å²	91	59.3 Å²	59.3	59%	0.591	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-7.6	173.6	-25	35.8	0	0	0	114.7
361	S	73.9	Confident	86.6	Confident	37 Å²	37	56 Å²	56	26%	0.259	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.8	8.1	175.9	-18.3	0	0	0	0	112.3	D359 H363 K484	D359-S361 PolarHBondContact O-N 3.13Å; D359-S361 VanDerWaalsContact OD1-CA 3.23Å; D359-S361 WeakPolarHBondContact OD1-CA 3.13Å; D359-S361 WeakPolarHBondContact OD1-CB 3.45Å; D359-S361 PolarHBondContact OD1-N 2.96Å; D359-S361 PolarHBondContact OD1-OG 2.94Å; D359-S361 WeakPolarHBondContact OD2-CB 3.29Å; D359-S361 PolarHBondContact OD2-OG 3.1Å; S361-H363 VanDerWaalsContact CB-CE1 3.49Å; S361-H363 WeakPolarHBondContact CB-CE1 3.23Å; S361-H363 WeakPolarHBondContact CB-ND1 3.36Å; S361-H363 PolarHBondContact O-N 3.38Å; S361-K484 WeakPolarHBondContact OG-CE 3.33Å; S361-K484 PolarHBondContact OG-NZ 2.76Å
362	H	71.6	Confident	86.5	Confident	152 Å²	152	56.7 Å²	56.7	70%	0.704	30%	0.301	S	S	*	.			trans	64.5	19.3	-176	-52.5	-76.2	0	0	0	115.4	D359 H364	D359-H362 PolarHBondContact O-N 2.84Å; D359-H362 PolarHBondContact OD1-N 3.29Å; H362-H364 PolarHBondContact O-ND1 3.39Å
363	H	75.2	Confident	86.3	Confident	58 Å²	58	53.4 Å²	53.4	27%	0.269	28%	0.276	S	S	.	.			trans	-77.5	127.6	168.4	-54.9	123.9	0	0	0	110.3	S358 D359 S361 F365 A392	S358-H363 CarbonylContact C-O 3.54Å; S358-H363 VanDerWaalsContact CA-O 3.25Å; S358-H363 WeakPolarHBondContact CA-O 3.23Å; D359-H363 PolarHBondContact N-O 3.48Å; D359-H363 WeakPolarHBondContact OD1-CA 3.49Å; D359-H363 WeakPolarHBondContact OD1-CB 3.45Å; D359-H363 IonicContact OD1-CG 3.3Å; D359-H363 PolarHBondContact OD1-N 3.02Å; D359-H363 IonicContact OD1-ND1 2.77Å; D359-H363 PolarHBondContact OD1-ND1 3.32Å; D359-H363 IonicContact OD2-CG 3.59Å; D359-H363 IonicContact OD2-ND1 2.63Å; D359-H363 PolarHBondContact OD2-ND1 3.46Å; S361-H363 VanDerWaalsContact CB-CE1 3.49Å; S361-H363 WeakPolarHBondContact CB-CE1 3.23Å; S361-H363 WeakPolarHBondContact CB-ND1 3.36Å; S361-H363 PolarHBondContact O-N 3.38Å; H363-F365 HydrophobicContact CB-CE2 3.96Å; H363-F365 HydrophobicContact CB-CZ 4.36Å; H363-F365 WeakPolarHBondContact O-CD2 3.08Å; H363-F365 WeakPolarHBondContact O-CE2 3.47Å; H363-A392 HydrophobicContact CB-CB 4.4Å; H363-A392 WeakPolarHBondContact CD2-CB 3.48Å
364	H	81.8	Confident	86.3	Confident	110 Å²	110	52.3 Å²	52.3	51%	0.509	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	134.1	-178.7	-67.6	63.4	0	0	0	111	S358 H362 V391	S358-H364 PolarHBondContact OG-CD2 2.83Å; S358-H364 VanDerWaalsContact OG-CD2 3.27Å; S358-H364 PolarHBondContact OG-CE1 2.89Å; S358-H364 PolarHBondContact OG-ND1 3.11Å; S358-H364 PolarHBondContact OG-NE2 2.84Å; H362-H364 PolarHBondContact O-ND1 3.39Å; H364-V391 HydrophobicContact CB-CG2 4.08Å; H364-V391 PolarHBondContact O-N 3.34Å
365	F	81.5	Confident	86.4	Confident	4 Å²	4	50.1 Å²	50.1	2%	0.018	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	137.2	175.8	-64.5	-90.1	0	0	0	109.9	Q356 F357 D359 H363 V388 I389 H390 E395 M482	Q356-F365 WeakPolarHBondContact CA-O 3.16Å; F357-F365 HydrophobicContact CD1-CB 4.45Å; F357-F365 HydrophobicContact CD2-CB 4.27Å; F357-F365 HydrophobicContact CD2-CD2 4.27Å; F357-F365 HydrophobicContact CE1-CB 3.96Å; F357-F365 HydrophobicContact CE2-CB 3.77Å; F357-F365 AromaticContact CE2-CD2 3.81Å; F357-F365 HydrophobicContact CE2-CD2 3.81Å; F357-F365 AromaticContact CE2-CG 3.92Å; F357-F365 HydrophobicContact CE2-CG 3.92Å; F357-F365 HydrophobicContact CZ-CB 3.6Å; F357-F365 HydrophobicContact CZ-CD2 4.41Å; F357-F365 HydrophobicContact CZ-CG 4.04Å; F357-F365 PolarHBondContact N-O 3.33Å; F357-F365 VanDerWaalsContact N-O 3.14Å; F357-F365 PolarHBondContact O-N 3.09Å; D359-F365 HydrophobicContact CB-CE2 3.9Å; H363-F365 HydrophobicContact CB-CE2 3.96Å; H363-F365 HydrophobicContact CB-CZ 4.36Å; H363-F365 WeakPolarHBondContact O-CD2 3.08Å; H363-F365 WeakPolarHBondContact O-CE2 3.47Å; F365-V388 HydrophobicContact CD1-CG1 4.48Å; F365-I389 WeakPolarHBondContact CA-O 3.21Å; F365-H390 HydrophobicContact CD1-CB 4.03Å; F365-H390 HydrophobicContact CE1-CB 3.92Å; F365-E395 HydrophobicContact CE1-CB 4.35Å; F365-E395 HydrophobicContact CZ-CB 3.87Å; F365-E395 HydrophobicContact CZ-CG 3.86Å; F365-M482 HydrophobicContact CD1-SD 4.35Å; F365-M482 HydrophobicContact CE1-SD 4.46Å
366	V	88.4	Confident	86.7	Confident	30 Å²	30	47.9 Å²	47.9	18%	0.182	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	109.1	168.5	-177.5	0	0	0	0	108.1	E354 Q356 I389	E354-V366 HydrophobicContact CG-CG1 3.83Å; E354-V366 VanDerWaalsContact OE1-CG1 3.28Å; E354-V366 WeakPolarHBondContact OE1-CG1 3.4Å; Q356-V366 HydrophobicContact CG-CG1 4.14Å; Q356-V366 HydrophobicContact CG-CG2 4.07Å; V366-I389 HydrophobicContact CB-CB 4.24Å; V366-I389 PolarHBondContact N-O 3.48Å; V366-I389 PolarHBondContact O-N 3.25Å
367	C	89.4	Confident	87	Confident	1 Å²	1	41.2 Å²	41.2	1%	0.007	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	123.2	179.3	-67.6	0	0	0	0	109.3	E354 L355 L386 K387 F490	E354-C367 CarbonylContact C-O 3.59Å; E354-C367 VanDerWaalsContact CA-O 3.27Å; E354-C367 WeakPolarHBondContact CA-O 3.38Å; L355-C367 PolarHBondContact N-O 2.75Å; L355-C367 PolarHBondContact O-N 3.15Å; C367-L386 HydrophobicContact CB-CD1 4.47Å; C367-K387 CarbonylContact C-O 3.55Å; C367-K387 WeakPolarHBondContact CA-O 3.4Å; C367-F490 HydrophobicContact CB-CE2 4.02Å; C367-F490 HydrophobicContact CB-CZ 3.76Å; C367-F490 WeakPolarHBondContact O-CZ 3.34Å
368	R	93.6	Very high	87.6	Confident	91 Å²	91	40 Å²	40	34%	0.343	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	112.3	176.1	-68.3	177.3	175.2	128.3	19	109.9	S353 E354 L386 K387	S353-R368 CarbonylContact O-C 3.58Å; S353-R368 WeakPolarHBondContact O-CA 3.13Å; E354-R368 HydrophobicContact CB-CG 4.26Å; E354-R368 HydrophobicContact CG-CG 3.9Å; E354-R368 IonicContact OE1-NH2 2.66Å; E354-R368 WeakPolarHBondContact OE2-CG 3.21Å; E354-R368 IonicContact OE2-CZ 3.84Å; E354-R368 VanDerWaalsContact OE2-CZ 3.3Å; E354-R368 IonicContact OE2-NE 2.91Å; E354-R368 PolarHBondContact OE2-NE 3.29Å; E354-R368 IonicContact OE2-NH2 3.06Å; E354-R368 PolarHBondContact OE2-NH2 3.48Å; R368-L386 WeakPolarHBondContact O-CA 3.41Å; R368-K387 HydrophobicContact CB-CB 4.32Å; R368-K387 PolarHBondContact N-O 3.15Å; R368-K387 PolarHBondContact O-N 3.44Å
369	L	95.4	Very high	88.2	Confident	0 Å²	0	38 Å²	38	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	131.8	175.6	-175.3	70.4	0	0	0	109.7	S352 S353 V371 T384 L386 Y478 F490 V492	S352-L369 VanDerWaalsContact CA-O 3.32Å; S352-L369 WeakPolarHBondContact CA-O 3.48Å; S353-L369 PolarHBondContact N-O 3.41Å; S353-L369 PolarHBondContact O-N 3.35Å; L369-V371 HydrophobicContact CD2-CG2 4.3Å; L369-V371 HydrophobicContact CG-CG2 4.21Å; L369-T384 HydrophobicContact CD1-CG2 3.42Å; L369-T384 VanDerWaalsContact CD1-CG2 3.42Å; L369-L386 HydrophobicContact CB-CD1 4.32Å; L369-L386 HydrophobicContact CD1-CB 4.36Å; L369-L386 HydrophobicContact CD1-CD1 4.2Å; L369-Y478 HydrophobicContact CD1-CD1 4.31Å; L369-Y478 HydrophobicContact CD1-CD2 4.47Å; L369-Y478 HydrophobicContact CD1-CE1 4.5Å; L369-Y478 HydrophobicContact CD1-CG 4.28Å; L369-Y478 HydrophobicContact CD2-CD2 3.49Å; L369-Y478 VanDerWaalsContact CD2-CD2 3.49Å; L369-Y478 HydrophobicContact CD2-CE2 3.86Å; L369-Y478 HydrophobicContact CD2-CG 3.95Å; L369-F490 HydrophobicContact CB-CD1 3.94Å; L369-F490 HydrophobicContact CB-CD2 4.21Å; L369-F490 HydrophobicContact CB-CE1 3.92Å; L369-F490 HydrophobicContact CB-CE2 4.21Å; L369-F490 HydrophobicContact CB-CG 4.08Å; L369-F490 HydrophobicContact CB-CZ 4.07Å; L369-F490 HydrophobicContact CD2-CB 3.51Å; L369-F490 HydrophobicContact CD2-CD1 4.1Å; L369-F490 HydrophobicContact CD2-CD2 4.1Å; L369-F490 HydrophobicContact CD2-CG 3.66Å; L369-F490 HydrophobicContact CG-CG 4.49Å; L369-V492 HydrophobicContact CD2-CG2 3.63Å
370	Q	96.6	Very high	89.1	Confident	78 Å²	78	37.9 Å²	37.9	36%	0.364	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	120.6	173.4	-59.9	-173.5	-53	0	0	108.8	F351 K385	F351-Q370 WeakPolarHBondContact O-CA 3.27Å; Q370-K385 HydrophobicContact CB-CB 4.31Å; Q370-K385 PolarHBondContact N-O 2.89Å; Q370-K385 PolarHBondContact O-N 2.86Å
371	V	96.4	Very high	89.9	Confident	1 Å²	1	37.7 Å²	37.7	1%	0.006	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	100.4	175.1	-177.4	0	0	0	0	107	S350 F351 L369 N373 V374 V382 T384 Y478 V492	S350-V371 CarbonylContact C-O 3.57Å; S350-V371 VanDerWaalsContact CA-O 3.28Å; S350-V371 WeakPolarHBondContact CA-O 3.38Å; F351-V371 PolarHBondContact N-O 3.04Å; F351-V371 PolarHBondContact O-N 2.91Å; L369-V371 HydrophobicContact CD2-CG2 4.3Å; L369-V371 HydrophobicContact CG-CG2 4.21Å; V371-N373 PolarHBondContact O-N 2.63Å; V371-V374 HydrophobicContact CB-CG1 4.2Å; V371-V374 HydrophobicContact CG1-CG1 3.9Å; V371-V382 HydrophobicContact CG1-CG1 3.69Å; V371-T384 HydrophobicContact CG2-CG2 4.36Å; V371-Y478 HydrophobicContact CG2-CE2 4.11Å; V371-V492 HydrophobicContact CB-CG1 4.41Å; V371-V492 HydrophobicContact CG2-CG1 4.29Å; V371-V492 HydrophobicContact CG2-CG2 4.25Å
372	P	93	Very high	90.9	Very high	75 Å²	75	35.9 Å²	35.9	49%	0.487	17%	0.169	S	C	.	.	S	Bend	trans	-65.8	-18.9	-175.9	25.5	-36.3	0	0	0	114.2	E349 S383	E349-P372 CarbonylContact C-O 3.57Å; E349-P372 CarbonylContact O-C 3.5Å; P372-S383 VanDerWaalsContact CD-O 3.32Å; P372-S383 WeakPolarHBondContact CD-O 3.5Å
373	N	91	Very high	91.9	Very high	14 Å²	14	30.7 Å²	30.7	8%	0.075	15%	0.15	C	C	.	.			trans	-134	100.8	-179.5	58.1	-47.1	0	0	0	112.4	E349 V371 V376 Y381 S383 R504	E349-N373 CarbonylContact O-C 3.55Å; E349-N373 WeakPolarHBondContact O-CA 3.32Å; V371-N373 PolarHBondContact O-N 2.63Å; N373-V376 HydrophobicContact CB-CG1 4.38Å; N373-Y381 PolarHBondContact ND2-O 2.7Å; N373-S383 PolarHBondContact OD1-N 2.87Å; N373-R504 PolarHBondContact ND2-NH1 2.77Å
374	V	95.2	Very high	92.8	Very high	15 Å²	15	28.2 Å²	28.2	9%	0.091	14%	0.139	C	C	.	.	S	Bend	trans	-99.7	-4.4	171.9	-64.2	0	0	0	0	113.8	E349 F351 V371 V492 L494 V495	E349-V374 WeakPolarHBondContact O-CG2 3.48Å; E349-V374 PolarHBondContact O-N 3.05Å; F351-V374 HydrophobicContact CB-CG1 3.48Å; F351-V374 VanDerWaalsContact CB-CG1 3.48Å; V371-V374 HydrophobicContact CB-CG1 4.2Å; V371-V374 HydrophobicContact CG1-CG1 3.9Å; V374-V492 HydrophobicContact CG1-CG1 3.57Å; V374-L494 HydrophobicContact CB-CD2 3.89Å; V374-L494 HydrophobicContact CG1-CD2 4.07Å; V374-L494 WeakPolarHBondContact O-CA 3.46Å; V374-V495 PolarHBondContact O-N 3.27Å
375	R	95.2	Very high	93.3	Very high	30 Å²	30	25.7 Å²	25.7	11%	0.113	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	112.4	172.2	-63.2	-174	168.3	-95	-20.4	107.6	L342 Q347 E348 V495 R504	L342-R375 HydrophobicContact CD1-CB 4.08Å; L342-R375 HydrophobicContact CD2-CB 4.17Å; Q347-R375 VanDerWaalsContact CD-NH2 3.33Å; Q347-R375 VanDerWaalsContact OE1-NH1 3.07Å; E348-R375 PolarHBondContact O-NE 3.49Å; R375-V495 WeakPolarHBondContact CA-O 3.21Å; R375-V495 HydrophobicContact CG-CB 4.24Å; R375-R504 PolarHBondContact O-NH1 3.16Å; R375-R504 PolarHBondContact O-NH2 2.96Å
376	V	95.6	Very high	93.7	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	159.2	-167	-70	0	0	0	0	110.8	N373 E380 V382 I456 L494 V495 V496 G497	N373-V376 HydrophobicContact CB-CG1 4.38Å; V376-E380 WeakPolarHBondContact CA-OE2 3.49Å; V376-V382 HydrophobicContact CG1-CG2 4.27Å; V376-I456 HydrophobicContact CB-CG1 4.05Å; V376-I456 HydrophobicContact CG2-CD1 3.89Å; V376-I456 HydrophobicContact CG2-CG1 3.68Å; V376-L494 HydrophobicContact CG2-CD1 4.34Å; V376-V495 PolarHBondContact N-O 2.65Å; V376-V496 HydrophobicContact CG2-CG2 4.38Å; V376-V496 CarbonylContact O-C 3.56Å; V376-V496 VanDerWaalsContact O-CA 3.27Å; V376-V496 WeakPolarHBondContact O-CA 3.38Å; V376-G497 PolarHBondContact O-N 2.79Å
377	V	95.9	Very high	93.7	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	13%	0.132	C	C	.	.			trans	-113.9	157.4	172.1	-63	0	0	0	0	110.4	L342 G379 E380 P500 F508 Y572	L342-V377 HydrophobicContact CD1-CG1 3.87Å; V377-G379 PolarHBondContact O-N 2.82Å; V377-E380 HydrophobicContact CG2-CB 4.06Å; V377-E380 PolarHBondContact N-OE2 3.34Å; V377-E380 WeakPolarHBondContact O-CB 3.49Å; V377-E380 PolarHBondContact O-N 2.85Å; V377-E380 VanDerWaalsContact O-N 3.08Å; V377-P500 HydrophobicContact CG1-CB 4.03Å; V377-P500 HydrophobicContact CG1-CG 4.48Å; V377-P500 HydrophobicContact CG2-CB 3.86Å; V377-P500 HydrophobicContact CG2-CG 4.15Å; V377-F508 HydrophobicContact CG2-CE1 4.37Å; V377-F508 HydrophobicContact CG2-CZ 3.9Å; V377-Y572 HydrophobicContact CB-CD2 3.93Å; V377-Y572 HydrophobicContact CB-CE2 4.08Å; V377-Y572 HydrophobicContact CG1-CE2 4.39Å; V377-Y572 HydrophobicContact CG2-CD2 3.46Å; V377-Y572 VanDerWaalsContact CG2-CD2 3.46Å; V377-Y572 HydrophobicContact CG2-CE2 3.95Å; V377-Y572 HydrophobicContact CG2-CG 4.15Å
378	P	96.8	Very high	93.5	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.7	134.7	172	-25.8	35.4	0	0	0	112.2	E380 I456 V496 G497 I570 V571 Y572	P378-E380 VanDerWaalsContact C-N 3.35Å; P378-I456 HydrophobicContact CB-CG2 4.43Å; P378-V496 HydrophobicContact CG-CG1 4.09Å; P378-G497 WeakPolarHBondContact CD-O 3.44Å; P378-I570 WeakPolarHBondContact CB-O 3.22Å; P378-I570 WeakPolarHBondContact CG-O 3.28Å; P378-V571 HydrophobicContact CB-CB 4.39Å; P378-V571 HydrophobicContact CB-CG1 4.3Å; P378-V571 HydrophobicContact CB-CG2 4.06Å; P378-Y572 PolarHBondContact O-N 3.37Å
379	G	94.5	Very high	92.9	Very high	2 Å²	2	25.5 Å²	25.5	2%	0.021	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	90.6	-13.3	-175.5	0	0	0	0	0	114.9	V377 Q455 I456 Y572 P574	V377-G379 PolarHBondContact O-N 2.82Å; G379-Q455 VanDerWaalsContact O-CG 3.31Å; G379-Q455 WeakPolarHBondContact O-CG 3.31Å; G379-Q455 PolarHBondContact O-NE2 2.9Å; G379-I456 WeakPolarHBondContact CA-O 3.45Å; G379-I456 PolarHBondContact N-O 2.81Å; G379-Y572 VanDerWaalsContact CA-O 3.29Å; G379-Y572 WeakPolarHBondContact CA-O 3.21Å; G379-P574 WeakPolarHBondContact O-CD 3.18Å
380	E	94	Very high	92	Very high	7 Å²	7	26.1 Å²	26.1	3%	0.033	13%	0.131	C	C	.	.			trans	-80.9	151.2	175.4	-172.1	164.8	-151.9	0	0	112.7	V376 V377 P378 Q455 I456 R504 F508	V376-E380 WeakPolarHBondContact CA-OE2 3.49Å; V377-E380 HydrophobicContact CG2-CB 4.06Å; V377-E380 PolarHBondContact N-OE2 3.34Å; V377-E380 WeakPolarHBondContact O-CB 3.49Å; V377-E380 PolarHBondContact O-N 2.85Å; V377-E380 VanDerWaalsContact O-N 3.08Å; P378-E380 VanDerWaalsContact C-N 3.35Å; E380-Q455 CarbonylContact O-C 3.57Å; E380-Q455 WeakPolarHBondContact O-CA 3.27Å; E380-I456 WeakPolarHBondContact O-CG1 3.2Å; E380-I456 PolarHBondContact O-N 2.8Å; E380-R504 WeakPolarHBondContact OE1-CD 3.05Å; E380-R504 IonicContact OE1-CZ 2.84Å; E380-R504 IonicContact OE1-NE 3.76Å; E380-R504 PolarHBondContact OE1-NE 2.8Å; E380-R504 VanDerWaalsContact OE1-NE 3.09Å; E380-R504 IonicContact OE1-NH1 3.48Å; E380-R504 PolarHBondContact OE1-NH1 3.45Å; E380-R504 IonicContact OE1-NH2 2.96Å; E380-R504 PolarHBondContact OE1-NH2 3.14Å; E380-R504 IonicContact OE2-CZ 3.74Å; E380-R504 IonicContact OE2-NE 3.08Å; E380-R504 IonicContact OE2-NH1 2.73Å; E380-R504 PolarHBondContact OE2-NH1 3.04Å; E380-R504 IonicContact OE2-NH2 3.73Å; E380-R504 PolarHBondContact OE2-NH2 2.87Å; E380-F508 HydrophobicContact CB-CE1 4.01Å; E380-F508 HydrophobicContact CB-CZ 3.97Å; E380-F508 HydrophobicContact CG-CE1 4.32Å; E380-F508 HydrophobicContact CG-CZ 3.99Å
381	Y	93.6	Very high	90.5	Very high	86 Å²	86	27.8 Å²	27.8	34%	0.337	15%	0.146	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	138.6	173.6	-73.3	-82.7	0	0	0	112.5	N373 S383 D452 V454 Q455 P574	N373-Y381 PolarHBondContact ND2-O 2.7Å; Y381-S383 PolarHBondContact O-N 3.19Å; Y381-D452 HydrophobicContact CD1-CB 3.66Å; Y381-D452 HydrophobicContact CE1-CB 4.35Å; Y381-D452 HydrophobicContact CG-CB 4.01Å; Y381-V454 WeakPolarHBondContact CA-O 3.5Å; Y381-Q455 HydrophobicContact CD1-CB 3.76Å; Y381-Q455 HydrophobicContact CD1-CG 4.2Å; Y381-Q455 HydrophobicContact CD2-CG 4.39Å; Y381-Q455 HydrophobicContact CE1-CB 3.52Å; Y381-Q455 HydrophobicContact CE1-CG 3.99Å; Y381-Q455 HydrophobicContact CE2-CG 4.15Å; Y381-Q455 HydrophobicContact CG-CB 4.43Å; Y381-Q455 HydrophobicContact CG-CG 4.41Å; Y381-P574 HydrophobicContact CD2-CG 4.5Å; Y381-P574 HydrophobicContact CE2-CB 4.32Å; Y381-P574 HydrophobicContact CE2-CG 3.93Å
382	V	94.7	Very high	88.9	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	88.3	166.7	-173.9	0	0	0	0	108.5	V371 V376 T384 A453 V454 I456 M476 L494	V371-V382 HydrophobicContact CG1-CG1 3.69Å; V376-V382 HydrophobicContact CG1-CG2 4.27Å; V382-T384 PolarHBondContact O-OG1 2.9Å; V382-A453 WeakPolarHBondContact O-CB 3.34Å; V382-A453 PolarHBondContact O-N 3.31Å; V382-V454 PolarHBondContact N-O 2.87Å; V382-I456 HydrophobicContact CG2-CD1 3.63Å; V382-I456 HydrophobicContact CG2-CG1 4.27Å; V382-M476 HydrophobicContact CB-CE 4.48Å; V382-M476 HydrophobicContact CG1-CE 4.39Å; V382-M476 HydrophobicContact CG1-CG 4.41Å; V382-L494 HydrophobicContact CG2-CD1 4.09Å
383	S	91.8	Very high	87.3	Confident	43 Å²	43	32.1 Å²	32.1	30%	0.301	16%	0.161	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	139.6	176.5	-58.2	0	0	0	0	109.7	P372 N373 Y381 D452	P372-S383 VanDerWaalsContact CD-O 3.32Å; P372-S383 WeakPolarHBondContact CD-O 3.5Å; N373-S383 PolarHBondContact OD1-N 2.87Å; Y381-S383 PolarHBondContact O-N 3.19Å; S383-D452 WeakPolarHBondContact CB-OD1 3.49Å; S383-D452 PolarHBondContact OG-OD1 3.08Å
384	T	93.7	Very high	85.6	Confident	5 Å²	5	40.3 Å²	40.3	3%	0.031	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	139.4	-173.9	-58.9	0	0	0	0	110.5	L369 V371 V382 R450 W451 A453 Y478	L369-T384 HydrophobicContact CD1-CG2 3.42Å; L369-T384 VanDerWaalsContact CD1-CG2 3.42Å; V371-T384 HydrophobicContact CG2-CG2 4.36Å; V382-T384 PolarHBondContact O-OG1 2.9Å; T384-R450 WeakPolarHBondContact O-CA 3.33Å; T384-W451 HydrophobicContact CG2-CE3 4.33Å; T384-W451 HydrophobicContact CG2-CH2 3.5Å; T384-W451 VanDerWaalsContact CG2-CH2 3.5Å; T384-W451 HydrophobicContact CG2-CZ2 3.92Å; T384-W451 HydrophobicContact CG2-CZ3 3.72Å; T384-W451 PolarHBondContact N-O 2.87Å; T384-W451 PolarHBondContact O-N 3.41Å; T384-A453 WeakPolarHBondContact OG1-CB 3.36Å; T384-Y478 HydrophobicContact CG2-CD1 4.21Å; T384-Y478 HydrophobicContact CG2-CE1 3.51Å; T384-Y478 WeakPolarHBondContact OG1-CE1 3.45Å; T384-Y478 PolarHBondContact OG1-OH 3.15Å
385	K	92.6	Very high	83.8	Confident	57 Å²	57	41.3 Å²	41.3	25%	0.248	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	125.2	169.7	177.2	-175.5	168.5	-154.5	0	109.5	Q370 T448 L449 R450	Q370-K385 HydrophobicContact CB-CB 4.31Å; Q370-K385 PolarHBondContact N-O 2.89Å; Q370-K385 PolarHBondContact O-N 2.86Å; K385-T448 HydrophobicContact CG-CG2 4.31Å; K385-L449 CarbonylContact C-O 3.6Å; K385-L449 WeakPolarHBondContact CA-O 3.39Å; K385-R450 HydrophobicContact CB-CG 4.05Å; K385-R450 HydrophobicContact CD-CG 4.42Å; K385-R450 HydrophobicContact CG-CG 3.89Å
386	L	90.8	Very high	82.5	Confident	2 Å²	2	48.2 Å²	48.2	1%	0.01	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	125.5	174.7	177.4	73.6	0	0	0	109.2	C367 R368 L369 V388 I400 T448 L449 W451 L480 F490	C367-L386 HydrophobicContact CB-CD1 4.47Å; R368-L386 WeakPolarHBondContact O-CA 3.41Å; L369-L386 HydrophobicContact CB-CD1 4.32Å; L369-L386 HydrophobicContact CD1-CB 4.36Å; L369-L386 HydrophobicContact CD1-CD1 4.2Å; L386-V388 HydrophobicContact CD1-CG2 4.38Å; L386-V388 HydrophobicContact CD2-CG2 3.79Å; L386-V388 HydrophobicContact CG-CG2 3.84Å; L386-I400 HydrophobicContact CD2-CD1 3.47Å; L386-I400 VanDerWaalsContact CD2-CD1 3.47Å; L386-I400 HydrophobicContact CD2-CG1 4.12Å; L386-T448 WeakPolarHBondContact O-CA 3.45Å; L386-L449 PolarHBondContact N-O 3.24Å; L386-L449 PolarHBondContact O-N 2.83Å; L386-W451 HydrophobicContact CB-CH2 4.05Å; L386-W451 HydrophobicContact CB-CZ3 3.77Å; L386-L480 HydrophobicContact CD1-CD2 4.01Å; L386-L480 HydrophobicContact CD2-CD2 3.42Å; L386-L480 VanDerWaalsContact CD2-CD2 3.42Å; L386-L480 HydrophobicContact CD2-CG 4.33Å; L386-L480 HydrophobicContact CG-CD2 4.3Å; L386-F490 HydrophobicContact CD1-CE2 4.25Å
387	K	89	Confident	81.5	Confident	71 Å²	71	49.9 Å²	49.9	31%	0.309	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	121.6	170.7	-178.4	-177.7	-175	-179.4	0	108.8	C367 R368 I389 T446 T447	C367-K387 CarbonylContact C-O 3.55Å; C367-K387 WeakPolarHBondContact CA-O 3.4Å; R368-K387 HydrophobicContact CB-CB 4.32Å; R368-K387 PolarHBondContact N-O 3.15Å; R368-K387 PolarHBondContact O-N 3.44Å; K387-I389 HydrophobicContact CD-CD1 4.46Å; K387-I389 HydrophobicContact CD-CG1 4.48Å; K387-I389 HydrophobicContact CG-CG1 4.32Å; K387-T446 HydrophobicContact CD-CG2 4.27Å; K387-T446 HydrophobicContact CG-CG2 3.95Å; K387-T447 CarbonylContact C-O 3.56Å; K387-T447 WeakPolarHBondContact CA-O 3.43Å
388	V	84	Confident	80.7	Confident	6 Å²	6	55 Å²	55	4%	0.036	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	120.9	177.5	-175.8	0	0	0	0	108.2	F365 L386 V397 T446 T447	F365-V388 HydrophobicContact CD1-CG1 4.48Å; L386-V388 HydrophobicContact CD1-CG2 4.38Å; L386-V388 HydrophobicContact CD2-CG2 3.79Å; L386-V388 HydrophobicContact CG-CG2 3.84Å; V388-V397 HydrophobicContact CB-CG2 4.19Å; V388-V397 HydrophobicContact CG1-CG2 3.78Å; V388-V397 HydrophobicContact CG2-CG2 3.83Å; V388-T446 CarbonylContact O-C 3.59Å; V388-T446 WeakPolarHBondContact O-CA 3.46Å; V388-T447 PolarHBondContact N-O 2.83Å; V388-T447 PolarHBondContact O-N 2.83Å
389	I	82.2	Confident	80.2	Confident	44 Å²	44	58.7 Å²	58.7	23%	0.226	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	127.8	175.8	-54	170.5	0	0	0	106.8	F365 V366 K387 T445 T446	F365-I389 WeakPolarHBondContact CA-O 3.21Å; V366-I389 HydrophobicContact CB-CB 4.24Å; V366-I389 PolarHBondContact N-O 3.48Å; V366-I389 PolarHBondContact O-N 3.25Å; K387-I389 HydrophobicContact CD-CD1 4.46Å; K387-I389 HydrophobicContact CD-CG1 4.48Å; K387-I389 HydrophobicContact CG-CG1 4.32Å; I389-T445 WeakPolarHBondContact CA-O 3.49Å; I389-T446 HydrophobicContact CG1-CG2 4.36Å
390	H	75.5	Confident	79.8	Confident	12 Å²	12	59.4 Å²	59.4	6%	0.056	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	139.6	-179.4	59.4	98.6	0	0	0	109.8	F365 A392 E444 T445	F365-H390 HydrophobicContact CD1-CB 4.03Å; F365-H390 HydrophobicContact CE1-CB 3.92Å; H390-A392 PolarHBondContact ND1-O 2.76Å; H390-E444 PolarHBondContact CE1-O 2.9Å; H390-E444 PolarHBondContact NE2-O 2.57Å; H390-T445 PolarHBondContact CD2-O 2.81Å; H390-T445 VanDerWaalsContact CD2-O 3.29Å; H390-T445 PolarHBondContact N-O 2.81Å; H390-T445 WeakPolarHBondContact O-CB 3.19Å
391	V	65.3	Low	79.8	Confident	114 Å²	114	59.6 Å²	59.6	69%	0.691	28%	0.281	S	S	*	.	S	Bend	trans	-76.5	-33.6	178.8	-179.8	0	0	0	0	111.4	H364	H364-V391 HydrophobicContact CB-CG2 4.08Å; H364-V391 PolarHBondContact O-N 3.34Å
392	A	63.4	Low	79.9	Confident	23 Å²	23	55.5 Å²	55.5	19%	0.19	27%	0.265	C	S	.	.	S	Bend	trans	-102	130.7	-175.2	0	0	0	0	0	113	H363 H390 K394	H363-A392 HydrophobicContact CB-CB 4.4Å; H363-A392 WeakPolarHBondContact CD2-CB 3.48Å; H390-A392 PolarHBondContact ND1-O 2.76Å; A392-K394 VanDerWaalsContact C-N 3.31Å; A392-K394 PolarHBondContact O-N 2.77Å
393	K	57.7	Low	80	Confident	143 Å²	143	56.7 Å²	56.7	62%	0.622	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-26	-171.1	-59.7	-170.6	-179.2	-156.8	0	116.2	E444	K393-E444 WeakPolarHBondContact CD-OE2 3.3Å; K393-E444 WeakPolarHBondContact CE-OE2 3.44Å; K393-E444 IonicContact NZ-OE2 2.69Å; K393-E444 PolarHBondContact NZ-OE2 2.96Å
394	K	56.7	Low	80.4	Confident	187 Å²	187	54.6 Å²	54.6	81%	0.813	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.1	-21.4	-169.5	-81.8	-174.7	175.7	179.1	0	114.8	A392	A392-K394 VanDerWaalsContact C-N 3.31Å; A392-K394 PolarHBondContact O-N 2.77Å
395	E	56.9	Low	80.6	Confident	35 Å²	35	54.5 Å²	54.5	16%	0.164	26%	0.255	C	S	.	.			trans	-86.3	128.3	-176.6	-139.5	82.1	-179.6	0	0	110	F365 A483	F365-E395 HydrophobicContact CE1-CB 4.35Å; F365-E395 HydrophobicContact CZ-CB 3.87Å; F365-E395 HydrophobicContact CZ-CG 3.86Å; E395-A483 VanDerWaalsContact CD-CB 3.44Å; E395-A483 HydrophobicContact CG-CB 3.56Å; E395-A483 WeakPolarHBondContact OE1-CB 3.4Å
396	R	67.7	Low	80.8	Confident	175 Å²	175	52.6 Å²	52.6	66%	0.66	25%	0.247	S	C	*	.			trans	-128.3	151.8	-176.6	-64.3	-176.6	-66.4	-123.4	-0.7	109.8	K398	R396-K398 PolarHBondContact O-N 3.48Å; R396-K398 VanDerWaalsContact O-N 3.12Å
397	V	74.5	Confident	81.1	Confident	36 Å²	36	54.2 Å²	54.2	22%	0.218	25%	0.254	C	S	.	.			trans	-58.7	118	164.5	-175	0	0	0	0	108	V388 E399 I400 L480 M482	V388-V397 HydrophobicContact CB-CG2 4.19Å; V388-V397 HydrophobicContact CG1-CG2 3.78Å; V388-V397 HydrophobicContact CG2-CG2 3.83Å; V397-E399 WeakPolarHBondContact CG1-O 3.36Å; V397-I400 HydrophobicContact CG1-CD1 4.01Å; V397-I400 HydrophobicContact CG1-CG1 3.51Å; V397-L480 HydrophobicContact CG1-CB 4.45Å; V397-M482 HydrophobicContact CB-CE 4.17Å; V397-M482 HydrophobicContact CB-SD 4.4Å; V397-M482 HydrophobicContact CG1-CE 3.74Å; V397-M482 HydrophobicContact CG2-CE 3.73Å; V397-M482 HydrophobicContact CG2-SD 3.8Å
398	K	79.1	Confident	81.6	Confident	107 Å²	107	50.9 Å²	50.9	47%	0.465	24%	0.24	S	C	.	.			trans	-73.9	-44	-177.2	-176.5	-171.9	-179	-169.7	0	110.4	R396 T481 N485	R396-K398 PolarHBondContact O-N 3.48Å; R396-K398 VanDerWaalsContact O-N 3.12Å; K398-T481 WeakPolarHBondContact CA-O 3.32Å; K398-T481 VanDerWaalsContact CB-O 3.31Å; K398-T481 WeakPolarHBondContact CB-O 3.33Å; K398-T481 HydrophobicContact CD-CG2 4.27Å; K398-T481 PolarHBondContact N-O 2.82Å; K398-N485 PolarHBondContact NZ-OD1 3.2Å
399	E	85.7	Confident	82.2	Confident	78 Å²	78	52.2 Å²	52.2	36%	0.364	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	146.1	-174.9	-172.9	175	-157.3	0	0	110.3	V397 V401 N433 T481	V397-E399 WeakPolarHBondContact CG1-O 3.36Å; E399-V401 HydrophobicContact CG-CG2 3.84Å; E399-N433 PolarHBondContact OE1-ND2 2.91Å; E399-T481 PolarHBondContact N-O 2.84Å; E399-T481 PolarHBondContact O-N 3.29Å
400	I	87.9	Confident	83	Confident	16 Å²	16	50.2 Å²	50.2	8%	0.082	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	125	170.2	-58.4	157.1	0	0	0	106.5	L386 V397 N433 A434 L449 W451 H479 L480	L386-I400 HydrophobicContact CD2-CD1 3.47Å; L386-I400 VanDerWaalsContact CD2-CD1 3.47Å; L386-I400 HydrophobicContact CD2-CG1 4.12Å; V397-I400 HydrophobicContact CG1-CD1 4.01Å; V397-I400 HydrophobicContact CG1-CG1 3.51Å; I400-N433 WeakPolarHBondContact O-CA 3.37Å; I400-A434 HydrophobicContact CB-CB 3.81Å; I400-A434 HydrophobicContact CD1-CB 4.39Å; I400-A434 HydrophobicContact CG2-CB 4.32Å; I400-A434 PolarHBondContact O-N 2.9Å; I400-L449 HydrophobicContact CD1-CD2 3.54Å; I400-W451 HydrophobicContact CG2-CH2 4Å; I400-W451 HydrophobicContact CG2-CZ2 3.92Å; I400-H479 CarbonylContact C-O 3.52Å; I400-H479 WeakPolarHBondContact CA-O 3.48Å; I400-L480 HydrophobicContact CG1-CG 4.39Å
401	V	93.2	Very high	84.1	Confident	12 Å²	12	50.9 Å²	50.9	7%	0.073	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	125	178.8	-176.5	0	0	0	0	108.2	E399 Q403 Q431 N433 Y478 H479	E399-V401 HydrophobicContact CG-CG2 3.84Å; V401-Q403 HydrophobicContact CG1-CG 4.28Å; V401-Q431 HydrophobicContact CG1-CG 3.41Å; V401-Q431 VanDerWaalsContact CG1-CG 3.41Å; V401-N433 WeakPolarHBondContact CG2-OD1 3.29Å; V401-Y478 CarbonylContact O-C 3.53Å; V401-Y478 WeakPolarHBondContact O-CA 3.38Å; V401-H479 HydrophobicContact CB-CB 4.33Å; V401-H479 PolarHBondContact N-O 3.34Å; V401-H479 PolarHBondContact O-N 3.46Å
402	A	95.7	Very high	85.6	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	129.9	171.2	0	0	0	0	0	109.4	Q431 Q432 A453 M476 L477 Y478	A402-Q431 CarbonylContact O-C 3.59Å; A402-Q431 WeakPolarHBondContact O-CA 3.32Å; A402-Q432 PolarHBondContact N-O 3.06Å; A402-Q432 PolarHBondContact O-N 3.44Å; A402-A453 HydrophobicContact CB-CB 3.89Å; A402-M476 HydrophobicContact CB-CE 3.96Å; A402-L477 CarbonylContact C-O 3.56Å; A402-L477 WeakPolarHBondContact CA-O 3.22Å; A402-Y478 HydrophobicContact CB-CD1 3.92Å; A402-Y478 HydrophobicContact CB-CE1 3.9Å
403	Q	97.5	Very high	87.2	Confident	24 Å²	24	49 Å²	49	11%	0.112	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	129.7	176.1	-68.8	-179.2	-8.3	0	0	110.3	V401 V405 V428 L430 Q431 M476 L477 H479	V401-Q403 HydrophobicContact CG1-CG 4.28Å; Q403-V405 HydrophobicContact CB-CG2 4.28Å; Q403-V428 HydrophobicContact CB-CG1 4.26Å; Q403-V428 HydrophobicContact CG-CG1 4.26Å; Q403-L430 WeakPolarHBondContact CA-O 3.06Å; Q403-Q431 HydrophobicContact CG-CB 4.04Å; Q403-Q431 HydrophobicContact CG-CG 3.8Å; Q403-M476 CarbonylContact O-C 3.47Å; Q403-M476 WeakPolarHBondContact O-CA 3.4Å; Q403-L477 HydrophobicContact CB-CB 4.29Å; Q403-L477 PolarHBondContact N-O 2.92Å; Q403-L477 PolarHBondContact O-N 3.33Å; Q403-H479 PolarHBondContact OE1-NE2 2.75Å
404	L	98.3	Very high	88.9	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	117.4	165.8	177.1	64.6	0	0	0	108.7	L429 L430 V454 I456 P457 Y474 M476 L494	L404-L429 HydrophobicContact CD2-CB 4.31Å; L404-L429 HydrophobicContact CD2-CD1 4.3Å; L404-L429 HydrophobicContact CG-CB 4.39Å; L404-L429 PolarHBondContact O-N 3.42Å; L404-L430 HydrophobicContact CB-CB 4.49Å; L404-L430 PolarHBondContact N-O 3.41Å; L404-V454 HydrophobicContact CB-CG1 4.13Å; L404-V454 HydrophobicContact CD2-CG1 4.24Å; L404-I456 HydrophobicContact CD1-CD1 4.23Å; L404-I456 HydrophobicContact CD2-CD1 3.84Å; L404-P457 HydrophobicContact CD2-CG 4.27Å; L404-Y474 HydrophobicContact CD1-CD1 4.4Å; L404-M476 HydrophobicContact CB-SD 3.85Å; L404-M476 HydrophobicContact CD1-CG 4.45Å; L404-M476 HydrophobicContact CD1-SD 3.98Å; L404-L494 HydrophobicContact CD1-CD1 3.77Å
405	V	98.4	Very high	90.4	Very high	3 Å²	3	37.2 Å²	37.2	2%	0.018	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	126	-178.8	-177.4	0	0	0	0	110.1	Q403 K407 R426 K427 V428 Y474 E475 L477	Q403-V405 HydrophobicContact CB-CG2 4.28Å; V405-K407 HydrophobicContact CG1-CG 4.36Å; V405-R426 HydrophobicContact CG1-CB 4.18Å; V405-K427 WeakPolarHBondContact CA-O 3.16Å; V405-V428 HydrophobicContact CG2-CG2 4.21Å; V405-Y474 WeakPolarHBondContact O-CA 3.36Å; V405-E475 PolarHBondContact N-O 3.37Å; V405-E475 PolarHBondContact O-N 2.94Å; V405-L477 HydrophobicContact CG2-CD1 3.67Å; V405-L477 HydrophobicContact CG2-CG 3.88Å
406	Q	97.9	Very high	91.8	Very high	17 Å²	17	41.5 Å²	41.5	8%	0.079	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	127.8	166.5	-175.1	-170.8	-48.9	0	0	109.1	F300 R426 K427 L429 V472 Y474	F300-Q406 VanDerWaalsContact CE2-NE2 3.26Å; Q406-R426 WeakPolarHBondContact O-CA 3.47Å; Q406-K427 PolarHBondContact N-O 3.2Å; Q406-K427 PolarHBondContact O-N 2.99Å; Q406-L429 HydrophobicContact CB-CD1 3.99Å; Q406-L429 HydrophobicContact CB-CD2 4.23Å; Q406-L429 HydrophobicContact CB-CG 3.98Å; Q406-V472 HydrophobicContact CG-CG1 3.78Å; Q406-Y474 HydrophobicContact CB-CD1 3.99Å; Q406-Y474 HydrophobicContact CB-CE1 3.64Å; Q406-Y474 HydrophobicContact CG-CD1 4.24Å; Q406-Y474 HydrophobicContact CG-CE1 3.59Å
407	K	97.5	Very high	92.9	Very high	35 Å²	35	36.4 Å²	36.4	15%	0.152	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	111.6	175.3	-66.2	174.9	60.8	179.1	0	109.2	V405 E424 E425 R426 V472 R473 E475	V405-K407 HydrophobicContact CG1-CG 4.36Å; K407-E424 VanDerWaalsContact CE-CD 3.47Å; K407-E424 VanDerWaalsContact CE-OE1 3.32Å; K407-E424 WeakPolarHBondContact CE-OE1 3.2Å; K407-E424 WeakPolarHBondContact CE-OE2 3.5Å; K407-E424 IonicContact NZ-OE2 3.09Å; K407-E425 WeakPolarHBondContact CA-O 3.41Å; K407-R426 VanDerWaalsContact CD-NH1 3.3Å; K407-R426 HydrophobicContact CG-CG 4.36Å; K407-V472 WeakPolarHBondContact O-CA 3.44Å; K407-R473 PolarHBondContact N-O 3.44Å; K407-R473 PolarHBondContact O-N 3.5Å; K407-E475 HydrophobicContact CD-CG 3.93Å; K407-E475 VanDerWaalsContact CD-OE1 3.22Å; K407-E475 WeakPolarHBondContact CD-OE1 3.5Å; K407-E475 WeakPolarHBondContact CD-OE2 3.5Å; K407-E475 IonicContact NZ-OE1 2.61Å; K407-E475 PolarHBondContact NZ-OE1 3.21Å; K407-E475 IonicContact NZ-OE2 3.94Å
408	A	97.9	Very high	93.7	Very high	2 Å²	2	41.4 Å²	41.4	2%	0.017	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	119.7	172.6	0	0	0	0	0	109.1	F300 Y410 E424 E425 R471	F300-A408 HydrophobicContact CE1-CB 4.45Å; F300-A408 HydrophobicContact CZ-CB 4.25Å; A408-Y410 HydrophobicContact CB-CE1 4.36Å; A408-Y410 HydrophobicContact CB-CE2 3.6Å; A408-Y410 VanDerWaalsContact CB-CZ 3.44Å; A408-Y410 WeakPolarHBondContact CB-OH 3.46Å; A408-Y410 WeakPolarHBondContact O-CD2 3.17Å; A408-Y410 WeakPolarHBondContact O-CE2 3.24Å; A408-E424 CarbonylContact O-C 3.54Å; A408-E424 VanDerWaalsContact O-CA 3.3Å; A408-E424 WeakPolarHBondContact O-CA 3.37Å; A408-E425 PolarHBondContact N-O 2.97Å; A408-E425 PolarHBondContact O-N 2.82Å; A408-R471 CarbonylContact C-O 3.39Å; A408-R471 VanDerWaalsContact CA-O 3.26Å; A408-R471 WeakPolarHBondContact CA-O 3.38Å
409	S	98	Very high	94.4	Very high	33 Å²	33	41.6 Å²	41.6	23%	0.231	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	136.1	177.1	-49.7	0	0	0	0	108.9	W423 L470 R471	S409-W423 WeakPolarHBondContact CA-O 3.36Å; S409-L470 CarbonylContact O-C 3.6Å; S409-L470 WeakPolarHBondContact O-CA 3.45Å; S409-R471 PolarHBondContact N-O 3.05Å; S409-R471 PolarHBondContact O-N 3.37Å
410	Y	98	Very high	94.8	Very high	3 Å²	3	41.4 Å²	41.4	1%	0.012	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	153.6	-173.8	-51.8	-92.5	0	0	0	111.6	T228 S302 A408 F422 W423 E425 L469 L470	T228-Y410 HydrophobicContact CG2-CD1 3.93Å; S302-Y410 VanDerWaalsContact CB-OH 3.23Å; S302-Y410 WeakPolarHBondContact CB-OH 3.03Å; S302-Y410 PolarHBondContact OG-OH 3.26Å; A408-Y410 HydrophobicContact CB-CE1 4.36Å; A408-Y410 HydrophobicContact CB-CE2 3.6Å; A408-Y410 VanDerWaalsContact CB-CZ 3.44Å; A408-Y410 WeakPolarHBondContact CB-OH 3.46Å; A408-Y410 WeakPolarHBondContact O-CD2 3.17Å; A408-Y410 WeakPolarHBondContact O-CE2 3.24Å; Y410-F422 WeakPolarHBondContact O-CA 3.14Å; Y410-W423 VanDerWaalsContact CB-CZ2 3.44Å; Y410-W423 AromaticContact CD2-CD1 3.62Å; Y410-W423 AromaticContact CD2-CE2 3.98Å; Y410-W423 HydrophobicContact CD2-CG 4.35Å; Y410-W423 AromaticContact CD2-NE1 3.39Å; Y410-W423 AromaticContact CG-CE2 3.81Å; Y410-W423 HydrophobicContact CG-CZ2 4.03Å; Y410-W423 AromaticContact CG-NE1 3.66Å; Y410-W423 PolarHBondContact N-O 3.29Å; Y410-W423 PolarHBondContact O-N 3.48Å; Y410-W423 VanDerWaalsContact O-N 3.16Å; Y410-E425 HydrophobicContact CE2-CB 3.96Å; Y410-E425 HydrophobicContact CE2-CG 3.76Å; Y410-E425 PolarHBondContact OH-OE2 3.15Å; Y410-L469 CarbonylContact C-O 3.4Å; Y410-L469 WeakPolarHBondContact CA-O 3.26Å; Y410-L470 HydrophobicContact CD1-CB 3.75Å; Y410-L470 HydrophobicContact CD1-CD2 4.31Å; Y410-L470 HydrophobicContact CE1-CB 4.2Å; Y410-L470 HydrophobicContact CE1-CD2 4.26Å
411	V	97.8	Very high	95.1	Very high	25 Å²	25	42.2 Å²	42.2	15%	0.152	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	135.5	171.5	-170.1	0	0	0	0	108.2	T228 F422 L469	T228-V411 WeakPolarHBondContact CB-O 3.49Å; T228-V411 PolarHBondContact OG1-O 3.07Å; V411-F422 HydrophobicContact CB-CD1 4.39Å; V411-F422 HydrophobicContact CB-CE1 4.32Å; V411-F422 HydrophobicContact CG1-CD1 4.21Å; V411-F422 HydrophobicContact CG1-CE1 3.8Å; V411-F422 HydrophobicContact CG1-CZ 4.33Å; V411-F422 HydrophobicContact CG2-CD1 3.75Å; V411-F422 HydrophobicContact CG2-CE1 3.69Å; V411-L469 PolarHBondContact N-O 3.39Å
412	G	97.3	Very high	95.3	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	158.4	176.6	0	0	0	0	0	110.8	P420 T421 W423	G412-P420 CarbonylContact O-C 3.55Å; G412-T421 PolarHBondContact N-O 3.41Å; G412-T421 PolarHBondContact O-N 3.4Å; G412-W423 VanDerWaalsContact N-CZ3 3.27Å
413	Y	97	Very high	95.3	Very high	99 Å²	99	49.6 Å²	49.6	39%	0.388	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	137.1	-179.5	-57.7	-87.5	0	0	0	109.8	Y247 S248 A249 A415 K418 E419 P420	Y247-Y413 WeakPolarHBondContact CA-O 3.25Å; S248-Y413 PolarHBondContact N-O 3.49Å; S248-Y413 PolarHBondContact O-N 3.01Å; A249-Y413 HydrophobicContact CB-CD2 3.77Å; A249-Y413 HydrophobicContact CB-CE2 3.92Å; Y413-A415 PolarHBondContact O-N 2.86Å; Y413-K418 WeakPolarHBondContact CD1-O 3.23Å; Y413-E419 WeakPolarHBondContact CA-O 3.39Å; Y413-P420 HydrophobicContact CD1-CB 4.07Å; Y413-P420 HydrophobicContact CE1-CB 3.88Å
414	K	93.5	Very high	95.3	Very high	39 Å²	39	52.5 Å²	52.5	17%	0.17	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	135	176.2	-169.5	170.2	-176.6	-177.2	0	110.4	N245 Y247 E416 T417 K418 E419	N245-K414 VanDerWaalsContact OD1-CE 3.31Å; N245-K414 WeakPolarHBondContact OD1-CE 3.47Å; N245-K414 PolarHBondContact OD1-NZ 3.18Å; N245-K414 VanDerWaalsContact OD1-NZ 3.11Å; Y247-K414 HydrophobicContact CD1-CB 3.85Å; Y247-K414 HydrophobicContact CD1-CG 4.32Å; Y247-K414 HydrophobicContact CE1-CB 3.78Å; Y247-K414 HydrophobicContact CE1-CD 4.14Å; Y247-K414 HydrophobicContact CE1-CG 4Å; K414-E416 VanDerWaalsContact C-N 3.33Å; K414-E416 VanDerWaalsContact CE-OE2 3.24Å; K414-E416 WeakPolarHBondContact CE-OE2 3.36Å; K414-E416 WeakPolarHBondContact CG-OE2 3.48Å; K414-E416 PolarHBondContact O-N 3Å; K414-T417 WeakPolarHBondContact CD-OG1 3.38Å; K414-K418 VanDerWaalsContact O-CA 3.22Å; K414-K418 WeakPolarHBondContact O-CA 3.37Å; K414-K418 PolarHBondContact O-N 2.95Å; K414-E419 PolarHBondContact N-O 3.17Å
415	A	88.2	Confident	95.1	Very high	42 Å²	42	55.4 Å²	55.4	35%	0.347	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-44.1	-173.1	0	0	0	0	0	113	A246 Y413 K418	A246-A415 PolarHBondContact O-N 3.3Å; A246-A415 VanDerWaalsContact O-N 3.07Å; Y413-A415 PolarHBondContact O-N 2.86Å; A415-K418 PolarHBondContact O-NZ 2.78Å
416	E	86.9	Confident	95	Very high	126 Å²	126	61.1 Å²	61.1	59%	0.589	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-47.7	-174.1	-52.1	76.5	-160.5	0	0	113.2	K414	K414-E416 VanDerWaalsContact C-N 3.33Å; K414-E416 VanDerWaalsContact CE-OE2 3.24Å; K414-E416 WeakPolarHBondContact CE-OE2 3.36Å; K414-E416 WeakPolarHBondContact CG-OE2 3.48Å; K414-E416 PolarHBondContact O-N 3Å
417	T	89.8	Confident	94.9	Very high	68 Å²	68	64.6 Å²	64.6	42%	0.417	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-13.3	-172.1	59.9	0	0	0	0	113.5	K414 E419	K414-T417 WeakPolarHBondContact CD-OG1 3.38Å; T417-E419 WeakPolarHBondContact CB-OE2 3.33Å; T417-E419 PolarHBondContact O-N 3.1Å; T417-E419 VanDerWaalsContact O-N 3.11Å; T417-E419 VanDerWaalsContact OG1-CD 3.22Å; T417-E419 WeakPolarHBondContact OG1-CG 3.42Å; T417-E419 PolarHBondContact OG1-N 2.95Å; T417-E419 PolarHBondContact OG1-OE2 3.41Å
418	K	91.8	Very high	94.8	Very high	141 Å²	141	64.9 Å²	64.9	61%	0.613	32%	0.316	S	S	*	.			trans	56.1	17.7	-170.7	-54.1	-55.6	-174	-159.2	0	114.1	Y413 K414 A415	Y413-K418 WeakPolarHBondContact CD1-O 3.23Å; K414-K418 VanDerWaalsContact O-CA 3.22Å; K414-K418 WeakPolarHBondContact O-CA 3.37Å; K414-K418 PolarHBondContact O-N 2.95Å; A415-K418 PolarHBondContact O-NZ 2.78Å
419	E	93.3	Very high	94.7	Very high	110 Å²	110	66.3 Å²	66.3	51%	0.514	32%	0.323	S	S	.	.			trans	-67.6	134.8	175.2	-70.6	163.5	156.6	0	0	110.1	Y413 K414 T417	Y413-E419 WeakPolarHBondContact CA-O 3.39Å; K414-E419 PolarHBondContact N-O 3.17Å; T417-E419 WeakPolarHBondContact CB-OE2 3.33Å; T417-E419 PolarHBondContact O-N 3.1Å; T417-E419 VanDerWaalsContact O-N 3.11Å; T417-E419 VanDerWaalsContact OG1-CD 3.22Å; T417-E419 WeakPolarHBondContact OG1-CG 3.42Å; T417-E419 PolarHBondContact OG1-N 2.95Å; T417-E419 PolarHBondContact OG1-OE2 3.41Å
420	P	94.9	Very high	94.6	Very high	74 Å²	74	67 Å²	67	48%	0.481	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	144.1	176.6	29.5	-34.1	0	0	0	110.5	G412 Y413 F422	G412-P420 CarbonylContact O-C 3.55Å; Y413-P420 HydrophobicContact CD1-CB 4.07Å; Y413-P420 HydrophobicContact CE1-CB 3.88Å; P420-F422 HydrophobicContact CB-CE2 4.19Å; P420-F422 HydrophobicContact CB-CZ 4.38Å
421	T	95	Very high	94.4	Very high	34 Å²	34	71.3 Å²	71.3	21%	0.209	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	139.5	175	-63.7	0	0	0	0	108.8	Y247 G412 W423	Y247-T421 HydrophobicContact CD1-CG2 4.07Å; Y247-T421 WeakPolarHBondContact CD1-OG1 3.25Å; Y247-T421 HydrophobicContact CE1-CG2 4.04Å; Y247-T421 WeakPolarHBondContact CE1-OG1 3.17Å; G412-T421 PolarHBondContact N-O 3.41Å; G412-T421 PolarHBondContact O-N 3.4Å; T421-W423 HydrophobicContact CG2-CE3 4.4Å; T421-W423 WeakPolarHBondContact O-CZ3 3.4Å
422	F	96.3	Very high	94	Very high	147 Å²	147	73.9 Å²	73.9	65%	0.645	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.7	138.2	-177.6	-56.5	-92.2	0	0	0	108.8	Y410 V411 P420	Y410-F422 WeakPolarHBondContact O-CA 3.14Å; V411-F422 HydrophobicContact CB-CD1 4.39Å; V411-F422 HydrophobicContact CB-CE1 4.32Å; V411-F422 HydrophobicContact CG1-CD1 4.21Å; V411-F422 HydrophobicContact CG1-CE1 3.8Å; V411-F422 HydrophobicContact CG1-CZ 4.33Å; V411-F422 HydrophobicContact CG2-CD1 3.75Å; V411-F422 HydrophobicContact CG2-CE1 3.69Å; P420-F422 HydrophobicContact CB-CE2 4.19Å; P420-F422 HydrophobicContact CB-CZ 4.38Å
423	W	96.5	Very high	93.6	Very high	20 Å²	20	77.9 Å²	77.9	8%	0.076	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	161.2	173.7	66.8	100.3	0	0	0	111.4	K230 S304 S409 Y410 G412 T421	K230-W423 HydrophobicContact CB-CD2 4.22Å; K230-W423 HydrophobicContact CB-CE3 4.49Å; K230-W423 HydrophobicContact CB-CH2 4.24Å; K230-W423 HydrophobicContact CB-CZ2 3.92Å; K230-W423 HydrophobicContact CB-CZ3 4.49Å; K230-W423 HydrophobicContact CD-CB 4.19Å; K230-W423 HydrophobicContact CD-CD2 3.88Å; K230-W423 HydrophobicContact CD-CE3 4.32Å; K230-W423 HydrophobicContact CD-CG 3.81Å; S304-W423 VanDerWaalsContact CB-NE1 3.27Å; S304-W423 PolarHBondContact OG-NE1 3.11Å; S304-W423 VanDerWaalsContact OG-NE1 3.09Å; S409-W423 WeakPolarHBondContact CA-O 3.36Å; Y410-W423 VanDerWaalsContact CB-CZ2 3.44Å; Y410-W423 AromaticContact CD2-CD1 3.62Å; Y410-W423 AromaticContact CD2-CE2 3.98Å; Y410-W423 HydrophobicContact CD2-CG 4.35Å; Y410-W423 AromaticContact CD2-NE1 3.39Å; Y410-W423 AromaticContact CG-CE2 3.81Å; Y410-W423 HydrophobicContact CG-CZ2 4.03Å; Y410-W423 AromaticContact CG-NE1 3.66Å; Y410-W423 PolarHBondContact N-O 3.29Å; Y410-W423 PolarHBondContact O-N 3.48Å; Y410-W423 VanDerWaalsContact O-N 3.16Å; G412-W423 VanDerWaalsContact N-CZ3 3.27Å; T421-W423 HydrophobicContact CG2-CE3 4.4Å; T421-W423 WeakPolarHBondContact O-CZ3 3.4Å
424	E	96.7	Very high	92.8	Very high	85 Å²	85	74 Å²	74	40%	0.397	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	135.4	178.9	-178.7	175.4	104.8	0	0	109.5	K407 A408 R426	K407-E424 VanDerWaalsContact CE-CD 3.47Å; K407-E424 VanDerWaalsContact CE-OE1 3.32Å; K407-E424 WeakPolarHBondContact CE-OE1 3.2Å; K407-E424 WeakPolarHBondContact CE-OE2 3.5Å; K407-E424 IonicContact NZ-OE2 3.09Å; A408-E424 CarbonylContact O-C 3.54Å; A408-E424 VanDerWaalsContact O-CA 3.3Å; A408-E424 WeakPolarHBondContact O-CA 3.37Å; E424-R426 HydrophobicContact CG-CG 4.15Å; E424-R426 WeakPolarHBondContact OE1-CD 3.42Å; E424-R426 VanDerWaalsContact OE1-CG 3.29Å; E424-R426 WeakPolarHBondContact OE1-CG 3.29Å; E424-R426 IonicContact OE1-CZ 2.76Å; E424-R426 IonicContact OE1-NH1 3.06Å; E424-R426 PolarHBondContact OE1-NH1 2.77Å
425	E	95	Very high	91.4	Very high	60 Å²	60	76.2 Å²	76.2	28%	0.28	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	130.7	164.3	-68	-171.2	162.4	0	0	109.5	S304 K407 A408 Y410	S304-E425 VanDerWaalsContact CB-CD 3.47Å; S304-E425 WeakPolarHBondContact CB-OE1 3.4Å; S304-E425 VanDerWaalsContact OG-CD 3.23Å; S304-E425 PolarHBondContact OG-OE1 3.43Å; K407-E425 WeakPolarHBondContact CA-O 3.41Å; A408-E425 PolarHBondContact N-O 2.97Å; A408-E425 PolarHBondContact O-N 2.82Å; Y410-E425 HydrophobicContact CE2-CB 3.96Å; Y410-E425 HydrophobicContact CE2-CG 3.76Å; Y410-E425 PolarHBondContact OH-OE2 3.15Å
426	R	96.6	Very high	89.8	Confident	124 Å²	124	84.7 Å²	84.7	47%	0.468	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	117.1	174.3	-58.6	-177.2	73.7	96.9	-1.7	109	V405 Q406 K407 E424 E475	V405-R426 HydrophobicContact CG1-CB 4.18Å; Q406-R426 WeakPolarHBondContact O-CA 3.47Å; K407-R426 VanDerWaalsContact CD-NH1 3.3Å; K407-R426 HydrophobicContact CG-CG 4.36Å; E424-R426 HydrophobicContact CG-CG 4.15Å; E424-R426 WeakPolarHBondContact OE1-CD 3.42Å; E424-R426 VanDerWaalsContact OE1-CG 3.29Å; E424-R426 WeakPolarHBondContact OE1-CG 3.29Å; E424-R426 IonicContact OE1-CZ 2.76Å; E424-R426 IonicContact OE1-NH1 3.06Å; E424-R426 PolarHBondContact OE1-NH1 2.77Å; R426-E475 IonicContact CZ-OE2 2.74Å; R426-E475 IonicContact NH1-OE2 2.95Å; R426-E475 IonicContact NH2-OE2 3.76Å; R426-E475 PolarHBondContact NH2-OE2 3.38Å
427	K	94.9	Very high	88.1	Confident	90 Å²	90	83.1 Å²	83.1	39%	0.391	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	117.8	178.6	-174.3	-176.3	173.5	-169.4	0	109.6	V405 Q406 L429 H544	V405-K427 WeakPolarHBondContact CA-O 3.16Å; Q406-K427 PolarHBondContact N-O 3.2Å; Q406-K427 PolarHBondContact O-N 2.99Å; K427-L429 HydrophobicContact CD-CD2 3.74Å; K427-L429 HydrophobicContact CG-CD2 3.98Å; K427-L429 PolarHBondContact O-N 2.89Å; K427-H544 PolarHBondContact NZ-O 3.16Å
428	V	96.2	Very high	86.3	Confident	41 Å²	41	87.9 Å²	87.9	25%	0.248	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	112.3	168.5	-176.9	0	0	0	0	107.4	Q403 V405 Q431 I602	Q403-V428 HydrophobicContact CB-CG1 4.26Å; Q403-V428 HydrophobicContact CG-CG1 4.26Å; V405-V428 HydrophobicContact CG2-CG2 4.21Å; V428-Q431 HydrophobicContact CG1-CB 4.48Å; V428-I602 HydrophobicContact CG2-CD1 4.19Å
429	L	94.6	Very high	84.3	Confident	31 Å²	31	84.3 Å²	84.3	16%	0.162	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	-42.5	179.8	-64.5	-172.4	0	0	0	111.5	L404 Q406 K427 P457 T459 Y474	L404-L429 HydrophobicContact CD2-CB 4.31Å; L404-L429 HydrophobicContact CD2-CD1 4.3Å; L404-L429 HydrophobicContact CG-CB 4.39Å; L404-L429 PolarHBondContact O-N 3.42Å; Q406-L429 HydrophobicContact CB-CD1 3.99Å; Q406-L429 HydrophobicContact CB-CD2 4.23Å; Q406-L429 HydrophobicContact CB-CG 3.98Å; K427-L429 HydrophobicContact CD-CD2 3.74Å; K427-L429 HydrophobicContact CG-CD2 3.98Å; K427-L429 PolarHBondContact O-N 2.89Å; L429-P457 HydrophobicContact CB-CG 4.34Å; L429-P457 HydrophobicContact CD1-CG 4.33Å; L429-T459 HydrophobicContact CD1-CG2 4.48Å; L429-T459 WeakPolarHBondContact CD1-OG1 3.29Å; L429-Y474 HydrophobicContact CD1-CD1 4.4Å; L429-Y474 HydrophobicContact CD1-CE1 3.79Å
430	L	95.2	Very high	82.5	Confident	49 Å²	49	84.4 Å²	84.4	26%	0.257	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	149.3	179.2	-70.7	176.8	0	0	0	110	Q403 L404 V454 Q455 P457	Q403-L430 WeakPolarHBondContact CA-O 3.06Å; L404-L430 HydrophobicContact CB-CB 4.49Å; L404-L430 PolarHBondContact N-O 3.41Å; L430-V454 HydrophobicContact CB-CG1 3.91Å; L430-V454 HydrophobicContact CD1-CG1 3.6Å; L430-V454 HydrophobicContact CG-CG1 4.4Å; L430-Q455 WeakPolarHBondContact CD1-O 3.16Å; L430-P457 HydrophobicContact CD1-CB 4.09Å; L430-P457 HydrophobicContact CD1-CG 3.94Å; L430-P457 HydrophobicContact CG-CG 4.25Å
431	Q	94	Very high	80.4	Confident	92 Å²	92	88.7 Å²	88.7	43%	0.43	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	132.6	172.5	178.2	176.4	-46	0	0	108.6	V401 A402 Q403 V428	V401-Q431 HydrophobicContact CG1-CG 3.41Å; V401-Q431 VanDerWaalsContact CG1-CG 3.41Å; A402-Q431 CarbonylContact O-C 3.59Å; A402-Q431 WeakPolarHBondContact O-CA 3.32Å; Q403-Q431 HydrophobicContact CG-CB 4.04Å; Q403-Q431 HydrophobicContact CG-CG 3.8Å; V428-Q431 HydrophobicContact CG1-CB 4.48Å
432	Q	91.2	Very high	78.3	Confident	80 Å²	80	96 Å²	96	37%	0.374	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	141	175	-67.3	-169.3	-31.2	0	0	110.5	A402 A453	A402-Q432 PolarHBondContact N-O 3.06Å; A402-Q432 PolarHBondContact O-N 3.44Å; Q432-A453 WeakPolarHBondContact CB-O 3.13Å; Q432-A453 PolarHBondContact OE1-O 2.55Å
433	N	87.4	Confident	76.2	Confident	83 Å²	83	94.2 Å²	94.2	44%	0.444	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	140.4	173	-69.9	7.6	0	0	0	108.8	E399 I400 V401 T435	E399-N433 PolarHBondContact OE1-ND2 2.91Å; I400-N433 WeakPolarHBondContact O-CA 3.37Å; V401-N433 WeakPolarHBondContact CG2-OD1 3.29Å; N433-T435 PolarHBondContact O-N 2.72Å
434	A	80.2	Confident	74.4	Confident	19 Å²	19	99.4 Å²	99.4	16%	0.157	47%	0.472	C	S	.	.	P	Polyproline II helix	trans	-57.8	125.3	167.4	0	0	0	0	0	109.1	I400 R436 L449	I400-A434 HydrophobicContact CB-CB 3.81Å; I400-A434 HydrophobicContact CD1-CB 4.39Å; I400-A434 HydrophobicContact CG2-CB 4.32Å; I400-A434 PolarHBondContact O-N 2.9Å; A434-R436 PolarHBondContact O-N 2.84Å; A434-L449 HydrophobicContact CB-CD2 3.64Å
435	T	64.9	Low	73	Confident	84 Å²	84	98.2 Å²	98.2	52%	0.515	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-59.1	136.3	167.4	24.3	0	0	0	0	108.4	N433 Q437	N433-T435 PolarHBondContact O-N 2.72Å; T435-Q437 PolarHBondContact O-N 2.85Å
436	R	54.3	Low	72	Confident	221 Å²	221	96.5 Å²	96.5	83%	0.834	46%	0.464	S	S	*	.			trans	-62.8	82	174.3	-71.4	-179.5	-180	-89.9	-4.1	108.8	A434	A434-R436 PolarHBondContact O-N 2.84Å
437	Q	51.8	Low	71	Confident	92 Å²	92	92.5 Å²	92.5	43%	0.43	45%	0.454	S	S	.	.	P	Polyproline II helix	trans	-68.5	137	163.2	-64.8	-178.9	0.7	0	0	106.7	T435 L449 R450	T435-Q437 PolarHBondContact O-N 2.85Å; Q437-L449 HydrophobicContact CB-CD1 3.59Å; Q437-L449 HydrophobicContact CG-CD1 3.76Å; Q437-R450 PolarHBondContact NE2-O 2.82Å; Q437-R450 PolarHBondContact OE1-O 2.77Å
438	K	51	Low	70.5	Confident	168 Å²	168	89.9 Å²	89.9	73%	0.73	45%	0.445	S	S	*	.	P	Polyproline II helix	trans	-56.2	132.4	169.8	-74.5	-175.7	175.4	-173.8	0	107.4	D440	K438-D440 PolarHBondContact O-N 2.92Å
439	P	51.2	Low	70	Confident	66 Å²	66	88.6 Å²	88.6	43%	0.429	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-49.4	137	169.3	-20.9	30.2	0	0	0	108.5	E441 T447	P439-E441 PolarHBondContact O-N 2.91Å; P439-T447 HydrophobicContact CB-CG2 4.15Å
440	D	53.9	Low	69.8	Low	112 Å²	112	93.8 Å²	93.8	60%	0.599	46%	0.455	S	S	*	.			trans	-54.3	110.2	172.5	-145	-10.8	0	0	0	107	K438 K442	K438-D440 PolarHBondContact O-N 2.92Å; D440-K442 PolarHBondContact O-N 3.36Å
441	E	51.1	Low	69.5	Low	164 Å²	164	92.5 Å²	92.5	77%	0.766	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	13.1	-160.4	-75.2	178.4	168.4	0	0	114.6	P439	P439-E441 PolarHBondContact O-N 2.91Å
442	K	51.1	Low	69.3	Low	187 Å²	187	92 Å²	92	81%	0.813	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.2	-9.3	-167.5	-78.2	-174.2	174.6	179.8	0	116.7	D440	D440-K442 PolarHBondContact O-N 3.36Å
443	N	51.7	Low	69.2	Low	110 Å²	110	88.2 Å²	88.2	59%	0.588	43%	0.429	S	S	*	.			trans	-142.4	110.7	175.6	-96.9	-28.3	0	0	0	111.6	T445 T446	N443-T445 PolarHBondContact O-N 2.9Å; N443-T446 PolarHBondContact O-N 2.82Å; N443-T446 VanDerWaalsContact O-N 3.15Å
444	E	59.8	Low	69.4	Low	130 Å²	130	84.3 Å²	84.3	61%	0.607	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-13.7	-179.4	-66.9	-174.3	163.2	0	0	114.5	H390 K393	H390-E444 PolarHBondContact CE1-O 2.9Å; H390-E444 PolarHBondContact NE2-O 2.57Å; K393-E444 WeakPolarHBondContact CD-OE2 3.3Å; K393-E444 WeakPolarHBondContact CE-OE2 3.44Å; K393-E444 IonicContact NZ-OE2 2.69Å; K393-E444 PolarHBondContact NZ-OE2 2.96Å
445	T	67.6	Low	70.2	Confident	60 Å²	60	86.6 Å²	86.6	37%	0.368	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.5	-2.8	-176.3	57.7	0	0	0	0	113.7	I389 H390 N443	I389-T445 WeakPolarHBondContact CA-O 3.49Å; H390-T445 PolarHBondContact CD2-O 2.81Å; H390-T445 VanDerWaalsContact CD2-O 3.29Å; H390-T445 PolarHBondContact N-O 2.81Å; H390-T445 WeakPolarHBondContact O-CB 3.19Å; N443-T445 PolarHBondContact O-N 2.9Å
446	T	73.6	Confident	71.7	Confident	23 Å²	23	82.7 Å²	82.7	14%	0.141	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	119.3	-173.2	-64.4	0	0	0	0	111.2	K387 V388 I389 N443	K387-T446 HydrophobicContact CD-CG2 4.27Å; K387-T446 HydrophobicContact CG-CG2 3.95Å; V388-T446 CarbonylContact O-C 3.59Å; V388-T446 WeakPolarHBondContact O-CA 3.46Å; I389-T446 HydrophobicContact CG1-CG2 4.36Å; N443-T446 PolarHBondContact O-N 2.82Å; N443-T446 VanDerWaalsContact O-N 3.15Å
447	T	76.3	Confident	73.7	Confident	41 Å²	41	72.8 Å²	72.8	25%	0.252	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	126.3	171.2	-60.5	0	0	0	0	109.4	K387 V388 P439	K387-T447 CarbonylContact C-O 3.56Å; K387-T447 WeakPolarHBondContact CA-O 3.43Å; V388-T447 PolarHBondContact N-O 2.83Å; V388-T447 PolarHBondContact O-N 2.83Å; P439-T447 HydrophobicContact CB-CG2 4.15Å
448	T	83.7	Confident	75.8	Confident	34 Å²	34	69 Å²	69	21%	0.209	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	127.4	171.9	-56.3	0	0	0	0	109.4	K385 L386	K385-T448 HydrophobicContact CG-CG2 4.31Å; L386-T448 WeakPolarHBondContact O-CA 3.45Å
449	L	86.1	Confident	77.9	Confident	15 Å²	15	61.3 Å²	61.3	8%	0.079	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	137.4	179.3	-177.5	72.2	0	0	0	109.6	K385 L386 I400 A434 Q437 W451	K385-L449 CarbonylContact C-O 3.6Å; K385-L449 WeakPolarHBondContact CA-O 3.39Å; L386-L449 PolarHBondContact N-O 3.24Å; L386-L449 PolarHBondContact O-N 2.83Å; I400-L449 HydrophobicContact CD1-CD2 3.54Å; A434-L449 HydrophobicContact CB-CD2 3.64Å; Q437-L449 HydrophobicContact CB-CD1 3.59Å; Q437-L449 HydrophobicContact CG-CD1 3.76Å; L449-W451 HydrophobicContact CB-CE3 4.28Å; L449-W451 HydrophobicContact CB-CZ3 4.22Å; L449-W451 HydrophobicContact CD2-CD2 4.02Å; L449-W451 HydrophobicContact CD2-CE3 3.42Å; L449-W451 VanDerWaalsContact CD2-CE3 3.42Å; L449-W451 HydrophobicContact CD2-CH2 4.08Å; L449-W451 HydrophobicContact CD2-CZ3 3.46Å; L449-W451 VanDerWaalsContact CD2-CZ3 3.46Å; L449-W451 HydrophobicContact CG-CD2 4.33Å; L449-W451 HydrophobicContact CG-CE3 3.51Å; L449-W451 HydrophobicContact CG-CZ3 3.81Å
450	R	89	Confident	80	Confident	139 Å²	139	58.2 Å²	58.2	53%	0.525	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	124.9	172.6	-72.2	-176.6	178.5	82.8	-8.8	109.9	T384 K385 Q437	T384-R450 WeakPolarHBondContact O-CA 3.33Å; K385-R450 HydrophobicContact CB-CG 4.05Å; K385-R450 HydrophobicContact CD-CG 4.42Å; K385-R450 HydrophobicContact CG-CG 3.89Å; Q437-R450 PolarHBondContact NE2-O 2.82Å; Q437-R450 PolarHBondContact OE1-O 2.77Å
451	W	89.3	Confident	82	Confident	22 Å²	22	52.9 Å²	52.9	8%	0.083	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	160.4	-179.9	76	107.8	0	0	0	110.9	T384 L386 I400 L449 A453 Y478	T384-W451 HydrophobicContact CG2-CE3 4.33Å; T384-W451 HydrophobicContact CG2-CH2 3.5Å; T384-W451 VanDerWaalsContact CG2-CH2 3.5Å; T384-W451 HydrophobicContact CG2-CZ2 3.92Å; T384-W451 HydrophobicContact CG2-CZ3 3.72Å; T384-W451 PolarHBondContact N-O 2.87Å; T384-W451 PolarHBondContact O-N 3.41Å; L386-W451 HydrophobicContact CB-CH2 4.05Å; L386-W451 HydrophobicContact CB-CZ3 3.77Å; I400-W451 HydrophobicContact CG2-CH2 4Å; I400-W451 HydrophobicContact CG2-CZ2 3.92Å; L449-W451 HydrophobicContact CB-CE3 4.28Å; L449-W451 HydrophobicContact CB-CZ3 4.22Å; L449-W451 HydrophobicContact CD2-CD2 4.02Å; L449-W451 HydrophobicContact CD2-CE3 3.42Å; L449-W451 VanDerWaalsContact CD2-CE3 3.42Å; L449-W451 HydrophobicContact CD2-CH2 4.08Å; L449-W451 HydrophobicContact CD2-CZ3 3.46Å; L449-W451 VanDerWaalsContact CD2-CZ3 3.46Å; L449-W451 HydrophobicContact CG-CD2 4.33Å; L449-W451 HydrophobicContact CG-CE3 3.51Å; L449-W451 HydrophobicContact CG-CZ3 3.81Å; W451-A453 HydrophobicContact CZ2-CB 4.48Å; W451-A453 PolarHBondContact O-N 3.04Å; W451-Y478 HydrophobicContact CH2-CD1 4.35Å; W451-Y478 HydrophobicContact CH2-CE1 4.48Å; W451-Y478 HydrophobicContact CZ2-CD1 4.02Å; W451-Y478 HydrophobicContact CZ2-CE1 4.03Å
452	D	90	Very high	84.2	Confident	83 Å²	83	45.6 Å²	45.6	44%	0.444	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	109.6	168.5	-66.1	-37.4	0	0	0	108.3	Y381 S383	Y381-D452 HydrophobicContact CD1-CB 3.66Å; Y381-D452 HydrophobicContact CE1-CB 4.35Å; Y381-D452 HydrophobicContact CG-CB 4.01Å; S383-D452 WeakPolarHBondContact CB-OD1 3.49Å; S383-D452 PolarHBondContact OG-OD1 3.08Å
453	A	88.5	Confident	86.4	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	-41.3	-165.2	0	0	0	0	0	113.3	V382 T384 A402 Q432 W451 M476 Y478	V382-A453 WeakPolarHBondContact O-CB 3.34Å; V382-A453 PolarHBondContact O-N 3.31Å; T384-A453 WeakPolarHBondContact OG1-CB 3.36Å; A402-A453 HydrophobicContact CB-CB 3.89Å; Q432-A453 WeakPolarHBondContact CB-O 3.13Å; Q432-A453 PolarHBondContact OE1-O 2.55Å; W451-A453 HydrophobicContact CZ2-CB 4.48Å; W451-A453 PolarHBondContact O-N 3.04Å; A453-M476 HydrophobicContact CB-CE 3.88Å; A453-Y478 HydrophobicContact CB-CE1 3.88Å
454	V	93.3	Very high	88.3	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155	141.6	177.6	170.5	0	0	0	0	108.2	Y381 V382 L404 L430 M476	Y381-V454 WeakPolarHBondContact CA-O 3.5Å; V382-V454 PolarHBondContact N-O 2.87Å; L404-V454 HydrophobicContact CB-CG1 4.13Å; L404-V454 HydrophobicContact CD2-CG1 4.24Å; L430-V454 HydrophobicContact CB-CG1 3.91Å; L430-V454 HydrophobicContact CD1-CG1 3.6Å; L430-V454 HydrophobicContact CG-CG1 4.4Å; V454-M476 HydrophobicContact CB-CE 4.21Å; V454-M476 HydrophobicContact CB-SD 4.38Å; V454-M476 HydrophobicContact CG2-CE 3.93Å; V454-M476 HydrophobicContact CG2-SD 4.27Å
455	Q	95.3	Very high	89.7	Confident	67 Å²	67	33.6 Å²	33.6	31%	0.313	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	124.6	161.8	-162.7	-177.8	7.6	0	0	109.1	G379 E380 Y381 L430 P457	G379-Q455 VanDerWaalsContact O-CG 3.31Å; G379-Q455 WeakPolarHBondContact O-CG 3.31Å; G379-Q455 PolarHBondContact O-NE2 2.9Å; E380-Q455 CarbonylContact O-C 3.57Å; E380-Q455 WeakPolarHBondContact O-CA 3.27Å; Y381-Q455 HydrophobicContact CD1-CB 3.76Å; Y381-Q455 HydrophobicContact CD1-CG 4.2Å; Y381-Q455 HydrophobicContact CD2-CG 4.39Å; Y381-Q455 HydrophobicContact CE1-CB 3.52Å; Y381-Q455 HydrophobicContact CE1-CG 3.99Å; Y381-Q455 HydrophobicContact CE2-CG 4.15Å; Y381-Q455 HydrophobicContact CG-CB 4.43Å; Y381-Q455 HydrophobicContact CG-CG 4.41Å; L430-Q455 WeakPolarHBondContact CD1-O 3.16Å; Q455-P457 WeakPolarHBondContact O-CD 3.48Å
456	I	96.6	Very high	90.7	Very high	2 Å²	2	33.1 Å²	33.1	1%	0.01	19%	0.186	C	C	.	.	P	Polyproline II helix	trans	-61.9	121.1	-179.2	-56.5	-55.6	0	0	0	108.8	V376 P378 G379 E380 V382 L404 T459 L494 V496	V376-I456 HydrophobicContact CB-CG1 4.05Å; V376-I456 HydrophobicContact CG2-CD1 3.89Å; V376-I456 HydrophobicContact CG2-CG1 3.68Å; P378-I456 HydrophobicContact CB-CG2 4.43Å; G379-I456 WeakPolarHBondContact CA-O 3.45Å; G379-I456 PolarHBondContact N-O 2.81Å; E380-I456 WeakPolarHBondContact O-CG1 3.2Å; E380-I456 PolarHBondContact O-N 2.8Å; V382-I456 HydrophobicContact CG2-CD1 3.63Å; V382-I456 HydrophobicContact CG2-CG1 4.27Å; L404-I456 HydrophobicContact CD1-CD1 4.23Å; L404-I456 HydrophobicContact CD2-CD1 3.84Å; I456-T459 HydrophobicContact CG2-CG2 4.05Å; I456-L494 HydrophobicContact CD1-CD1 4.3Å; I456-V496 HydrophobicContact CG2-CG1 4.35Å; I456-V496 HydrophobicContact CG2-CG2 4.49Å
457	P	96.3	Very high	91.7	Very high	14 Å²	14	32.4 Å²	32.4	9%	0.091	18%	0.182	C	C	.	.	P	Polyproline II helix	trans	-73.6	170.7	-179	31.5	-32.5	0	0	0	110.3	L404 L429 L430 Q455 T459	L404-P457 HydrophobicContact CD2-CG 4.27Å; L429-P457 HydrophobicContact CB-CG 4.34Å; L429-P457 HydrophobicContact CD1-CG 4.33Å; L430-P457 HydrophobicContact CD1-CB 4.09Å; L430-P457 HydrophobicContact CD1-CG 3.94Å; L430-P457 HydrophobicContact CG-CG 4.25Å; Q455-P457 WeakPolarHBondContact O-CD 3.48Å; P457-T459 VanDerWaalsContact C-N 3.29Å; P457-T459 PolarHBondContact O-N 2.78Å
458	P	95.7	Very high	92.7	Very high	12 Å²	12	33.9 Å²	33.9	8%	0.078	19%	0.194	C	C	.	.	S	Bend	trans	-58.5	92.3	166.7	-18.3	30.6	0	0	0	110	Q541 E542 Q543 H544 T569 V571	P458-Q541 HydrophobicContact CB-CG 4.34Å; P458-Q541 HydrophobicContact CG-CG 4.27Å; P458-E542 WeakPolarHBondContact CB-O 3.37Å; P458-Q543 CarbonylContact O-C 3.51Å; P458-Q543 VanDerWaalsContact O-CA 3.32Å; P458-Q543 WeakPolarHBondContact O-CA 2.84Å; P458-H544 PolarHBondContact O-N 3.12Å; P458-T569 HydrophobicContact CB-CG2 4.03Å; P458-V571 HydrophobicContact CB-CG2 3.74Å; P458-V571 HydrophobicContact CG-CG2 3.9Å
459	T	96.2	Very high	93.3	Very high	7 Å²	7	32.7 Å²	32.7	4%	0.043	19%	0.187	C	C	.	.			trans	-129	161.2	-176.9	-163.1	0	0	0	0	109.9	L429 I456 P457 Y474 V496 T569	L429-T459 HydrophobicContact CD1-CG2 4.48Å; L429-T459 WeakPolarHBondContact CD1-OG1 3.29Å; I456-T459 HydrophobicContact CG2-CG2 4.05Å; P457-T459 VanDerWaalsContact C-N 3.29Å; P457-T459 PolarHBondContact O-N 2.78Å; T459-Y474 HydrophobicContact CG2-CE1 4.08Å; T459-Y474 PolarHBondContact OG1-OH 3.42Å; T459-V496 HydrophobicContact CG2-CG1 4.16Å; T459-T569 PolarHBondContact O-OG1 3.25Å; T459-T569 VanDerWaalsContact O-OG1 3.11Å
460	A	95.6	Very high	93.9	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.184	C	C	.	.	P	Polyproline II helix	trans	-59.8	141.3	173.9	0	0	0	0	0	110.2	F300 Y474	F300-A460 HydrophobicContact CD2-CB 3.87Å; F300-A460 HydrophobicContact CE2-CB 4.42Å; A460-Y474 WeakPolarHBondContact O-CE2 3.2Å; A460-Y474 VanDerWaalsContact O-CZ 3.28Å; A460-Y474 PolarHBondContact O-OH 2.97Å
461	P	96	Very high	94.3	Very high	0 Å²	0	31 Å²	31	0%	0	18%	0.179	C	C	.	.	P	Polyproline II helix	trans	-52	162.7	163.3	-26.1	34	0	0	0	112.1	Q298 I463 V496 V498	Q298-P461 HydrophobicContact CG-CG 4.28Å; P461-I463 WeakPolarHBondContact O-CG1 3.17Å; P461-I463 PolarHBondContact O-N 3.18Å; P461-V496 CarbonylContact C-O 3.54Å; P461-V496 WeakPolarHBondContact CA-O 3.42Å; P461-V498 HydrophobicContact CB-CG1 4.26Å; P461-V498 HydrophobicContact CG-CG1 3.47Å; P461-V498 VanDerWaalsContact CG-CG1 3.47Å
462	T	97.2	Very high	94.7	Very high	11 Å²	11	29.9 Å²	29.9	7%	0.067	18%	0.175	C	C	.	.	P	Polyproline II helix	trans	-59	130.3	169.1	-67.8	0	0	0	0	109.3	I340 D464 V472 V496	I340-T462 HydrophobicContact CD1-CG2 4.25Å; T462-D464 HydrophobicContact CG2-CB 4.33Å; T462-V472 WeakPolarHBondContact CG2-O 3.32Å; T462-V496 PolarHBondContact N-O 3.14Å; T462-V496 PolarHBondContact OG1-N 2.98Å
463	I	96.5	Very high	95.1	Very high	7 Å²	7	31 Å²	31	4%	0.036	17%	0.173	C	C	.	.	B	Isolated β-bridge	trans	-116.4	96.5	177.5	-49.4	-179	0	0	0	107.3	Q298 F300 I307 P461 R471 V472	Q298-I463 HydrophobicContact CB-CD1 3.83Å; Q298-I463 HydrophobicContact CB-CG1 3.97Å; Q298-I463 HydrophobicContact CG-CD1 3.93Å; Q298-I463 HydrophobicContact CG-CG1 4.2Å; F300-I463 HydrophobicContact CB-CD1 3.77Å; F300-I463 HydrophobicContact CD2-CD1 4.4Å; F300-I463 HydrophobicContact CG-CD1 4.19Å; I307-I463 HydrophobicContact CD1-CD1 4.33Å; I307-I463 HydrophobicContact CD1-CG2 4.35Å; P461-I463 WeakPolarHBondContact O-CG1 3.17Å; P461-I463 PolarHBondContact O-N 3.18Å; I463-R471 CarbonylContact O-C 3.56Å; I463-R471 VanDerWaalsContact O-CA 3.24Å; I463-R471 WeakPolarHBondContact O-CA 3.47Å; I463-R471 WeakPolarHBondContact O-CB 3.34Å; I463-V472 HydrophobicContact CB-CB 4.04Å; I463-V472 HydrophobicContact CB-CG2 4.25Å; I463-V472 HydrophobicContact CD1-CB 4.37Å; I463-V472 HydrophobicContact CD1-CG2 3.98Å; I463-V472 HydrophobicContact CG1-CB 4.11Å; I463-V472 HydrophobicContact CG1-CG2 4.25Å; I463-V472 PolarHBondContact N-O 3.14Å; I463-V472 PolarHBondContact O-N 3.05Å
464	D	91.6	Very high	95.5	Very high	75 Å²	75	31.1 Å²	31.1	40%	0.401	17%	0.174	S	C	.	.			trans	-113.7	-18.2	-178.5	63.4	-3.4	0	0	0	114	T462	T462-D464 HydrophobicContact CG2-CB 4.33Å
465	C	88.5	Confident	95.7	Very high	94 Å²	94	32.6 Å²	32.6	64%	0.635	18%	0.18	S	C	*	.	S	Bend	trans	-134.8	174.7	177.5	60.9	0	0	0	0	112.1	C467	C465-C467 VanDerWaalsContact C-N 3.27Å; C465-C467 PolarHBondContact O-N 3.03Å
466	G	88.9	Confident	95.8	Very high	49 Å²	49	29.4 Å²	29.4	51%	0.505	17%	0.166	S	C	.	.	S	Bend	trans	83.7	-23.9	178.7	0	0	0	0	0	115.8	P297	P297-G466 WeakPolarHBondContact CG-O 3.25Å
467	C	95.8	Very high	95.9	Very high	8 Å²	8	30.2 Å²	30.2	5%	0.054	17%	0.17	C	C	.	.			trans	-125.3	133.7	173.9	179.2	0	0	0	0	110.6	A226 E251 F253 P297 I307 C465 L469	A226-C467 WeakPolarHBondContact CB-SG 3.29Å; E251-C467 PolarHBondContact OE2-SG 2.97Å; F253-C467 HydrophobicContact CE1-CB 4.39Å; F253-C467 HydrophobicContact CZ-CB 4.13Å; P297-C467 HydrophobicContact CG-CB 4.24Å; I307-C467 HydrophobicContact CD1-CB 4.01Å; C465-C467 VanDerWaalsContact C-N 3.27Å; C465-C467 PolarHBondContact O-N 3.03Å; C467-L469 PolarHBondContact SG-N 3.21Å; C467-L469 VanDerWaalsContact SG-N 3.45Å
468	S	95.7	Very high	95.9	Very high	73 Å²	73	29.6 Å²	29.6	51%	0.51	17%	0.166	S	C	.	.	S	Bend	trans	-87	-21.4	179.1	62.3	0	0	0	0	113.1	E251	E251-S468 WeakPolarHBondContact OE1-CB 3.32Å; E251-S468 PolarHBondContact OE1-N 3.31Å; E251-S468 PolarHBondContact OE1-OG 3.43Å; E251-S468 PolarHBondContact OE2-N 3.18Å; E251-S468 PolarHBondContact OE2-OG 3.43Å; E251-S468 VanDerWaalsContact OE2-OG 3.14Å
469	L	97.7	Very high	95.8	Very high	9 Å²	9	30.2 Å²	30.2	5%	0.047	17%	0.168	C	C	.	.	S	Bend	trans	-91.8	-27.9	-172.8	-60	-173.8	0	0	0	115	T228 A249 K250 E251 Y410 V411 C467	T228-L469 HydrophobicContact CG2-CB 3.88Å; A249-L469 HydrophobicContact CB-CD1 3.63Å; A249-L469 HydrophobicContact CB-CD2 3.57Å; A249-L469 HydrophobicContact CB-CG 4.19Å; K250-L469 VanDerWaalsContact C-CD1 3.48Å; E251-L469 HydrophobicContact CB-CD1 3.51Å; E251-L469 HydrophobicContact CB-CG 3.8Å; Y410-L469 CarbonylContact C-O 3.4Å; Y410-L469 WeakPolarHBondContact CA-O 3.26Å; V411-L469 PolarHBondContact N-O 3.39Å; C467-L469 PolarHBondContact SG-N 3.21Å; C467-L469 VanDerWaalsContact SG-N 3.45Å
470	L	97.4	Very high	95.4	Very high	3 Å²	3	30 Å²	30	2%	0.016	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	153.2	177.9	71.4	85.2	0	0	0	113.1	T228 F300 I307 S409 Y410 V472	T228-L470 HydrophobicContact CG2-CB 4.33Å; T228-L470 HydrophobicContact CG2-CD2 4.35Å; F300-L470 HydrophobicContact CD1-CD1 3.99Å; F300-L470 HydrophobicContact CD1-CD2 4.44Å; I307-L470 HydrophobicContact CD1-CD1 3.81Å; I307-L470 HydrophobicContact CD1-CG 4.26Å; I307-L470 HydrophobicContact CG1-CD1 4.07Å; I307-L470 HydrophobicContact CG1-CD2 4.05Å; I307-L470 HydrophobicContact CG1-CG 4.21Å; S409-L470 CarbonylContact O-C 3.6Å; S409-L470 WeakPolarHBondContact O-CA 3.45Å; Y410-L470 HydrophobicContact CD1-CB 3.75Å; Y410-L470 HydrophobicContact CD1-CD2 4.31Å; Y410-L470 HydrophobicContact CE1-CB 4.2Å; Y410-L470 HydrophobicContact CE1-CD2 4.26Å; L470-V472 HydrophobicContact CD1-CG2 4.16Å
471	R	98	Very high	95	Very high	114 Å²	114	30.8 Å²	30.8	43%	0.43	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	145.8	175.3	-63.8	-174.5	-176.3	121	-2	110.3	A408 S409 I463	A408-R471 CarbonylContact C-O 3.39Å; A408-R471 VanDerWaalsContact CA-O 3.26Å; A408-R471 WeakPolarHBondContact CA-O 3.38Å; S409-R471 PolarHBondContact N-O 3.05Å; S409-R471 PolarHBondContact O-N 3.37Å; I463-R471 CarbonylContact O-C 3.56Å; I463-R471 VanDerWaalsContact O-CA 3.24Å; I463-R471 WeakPolarHBondContact O-CA 3.47Å; I463-R471 WeakPolarHBondContact O-CB 3.34Å
472	V	97.9	Very high	94.2	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	120.4	179.5	-175.5	0	0	0	0	109.3	F300 Q406 K407 T462 I463 L470 Y474	F300-V472 HydrophobicContact CD1-CG2 4.01Å; F300-V472 HydrophobicContact CD2-CG2 3.81Å; F300-V472 HydrophobicContact CE1-CG2 3.84Å; F300-V472 HydrophobicContact CE2-CG1 4.1Å; F300-V472 HydrophobicContact CE2-CG2 3.63Å; F300-V472 HydrophobicContact CG-CG2 4Å; F300-V472 HydrophobicContact CZ-CG2 3.65Å; Q406-V472 HydrophobicContact CG-CG1 3.78Å; K407-V472 WeakPolarHBondContact O-CA 3.44Å; T462-V472 WeakPolarHBondContact CG2-O 3.32Å; I463-V472 HydrophobicContact CB-CB 4.04Å; I463-V472 HydrophobicContact CB-CG2 4.25Å; I463-V472 HydrophobicContact CD1-CB 4.37Å; I463-V472 HydrophobicContact CD1-CG2 3.98Å; I463-V472 HydrophobicContact CG1-CB 4.11Å; I463-V472 HydrophobicContact CG1-CG2 4.25Å; I463-V472 PolarHBondContact N-O 3.14Å; I463-V472 PolarHBondContact O-N 3.05Å; L470-V472 HydrophobicContact CD1-CG2 4.16Å; V472-Y474 HydrophobicContact CG1-CE2 4.1Å
473	R	97.7	Very high	93.1	Very high	106 Å²	106	31.6 Å²	31.6	40%	0.4	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	165.5	178.9	-61.9	-172.5	-179	107.3	-5.1	110.7	K407	K407-R473 PolarHBondContact N-O 3.44Å; K407-R473 PolarHBondContact O-N 3.5Å
474	Y	98.1	Very high	92.1	Very high	2 Å²	2	37.5 Å²	37.5	1%	0.008	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	144.9	-177.6	-64.1	-85.1	0	0	0	111.5	L404 V405 Q406 L429 T459 A460 V472 L494 V496	L404-Y474 HydrophobicContact CD1-CD1 4.4Å; V405-Y474 WeakPolarHBondContact O-CA 3.36Å; Q406-Y474 HydrophobicContact CB-CD1 3.99Å; Q406-Y474 HydrophobicContact CB-CE1 3.64Å; Q406-Y474 HydrophobicContact CG-CD1 4.24Å; Q406-Y474 HydrophobicContact CG-CE1 3.59Å; L429-Y474 HydrophobicContact CD1-CD1 4.4Å; L429-Y474 HydrophobicContact CD1-CE1 3.79Å; T459-Y474 HydrophobicContact CG2-CE1 4.08Å; T459-Y474 PolarHBondContact OG1-OH 3.42Å; A460-Y474 WeakPolarHBondContact O-CE2 3.2Å; A460-Y474 VanDerWaalsContact O-CZ 3.28Å; A460-Y474 PolarHBondContact O-OH 2.97Å; V472-Y474 HydrophobicContact CG1-CE2 4.1Å; Y474-L494 PolarHBondContact O-N 3Å; Y474-V496 HydrophobicContact CD1-CG2 4.31Å; Y474-V496 HydrophobicContact CD2-CB 3.92Å; Y474-V496 HydrophobicContact CD2-CG2 3.4Å; Y474-V496 VanDerWaalsContact CD2-CG2 3.4Å; Y474-V496 HydrophobicContact CE2-CB 3.91Å; Y474-V496 HydrophobicContact CE2-CG2 3.74Å; Y474-V496 HydrophobicContact CG-CG2 3.72Å
475	E	97.8	Very high	91.4	Very high	31 Å²	31	39.2 Å²	39.2	15%	0.145	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	139.1	174	-71.9	173.5	-177	0	0	109.2	V405 K407 R426 L477 V491 V492	V405-E475 PolarHBondContact N-O 3.37Å; V405-E475 PolarHBondContact O-N 2.94Å; K407-E475 HydrophobicContact CD-CG 3.93Å; K407-E475 VanDerWaalsContact CD-OE1 3.22Å; K407-E475 WeakPolarHBondContact CD-OE1 3.5Å; K407-E475 WeakPolarHBondContact CD-OE2 3.5Å; K407-E475 IonicContact NZ-OE1 2.61Å; K407-E475 PolarHBondContact NZ-OE1 3.21Å; K407-E475 IonicContact NZ-OE2 3.94Å; R426-E475 IonicContact CZ-OE2 2.74Å; R426-E475 IonicContact NH1-OE2 2.95Å; R426-E475 IonicContact NH2-OE2 3.76Å; R426-E475 PolarHBondContact NH2-OE2 3.38Å; E475-L477 HydrophobicContact CB-CD2 4.35Å; E475-V491 HydrophobicContact CB-CG1 4.34Å; E475-V491 HydrophobicContact CG-CG1 4.13Å; E475-V492 CarbonylContact C-O 3.57Å; E475-V492 WeakPolarHBondContact CA-O 3.29Å
476	M	97.8	Very high	91.1	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	123.1	161.9	-75.2	-72.9	-67.4	0	0	109	V382 A402 Q403 L404 A453 V454 Y478 V492 L494	V382-M476 HydrophobicContact CB-CE 4.48Å; V382-M476 HydrophobicContact CG1-CE 4.39Å; V382-M476 HydrophobicContact CG1-CG 4.41Å; A402-M476 HydrophobicContact CB-CE 3.96Å; Q403-M476 CarbonylContact O-C 3.47Å; Q403-M476 WeakPolarHBondContact O-CA 3.4Å; L404-M476 HydrophobicContact CB-SD 3.85Å; L404-M476 HydrophobicContact CD1-CG 4.45Å; L404-M476 HydrophobicContact CD1-SD 3.98Å; A453-M476 HydrophobicContact CB-CE 3.88Å; V454-M476 HydrophobicContact CB-CE 4.21Å; V454-M476 HydrophobicContact CB-SD 4.38Å; V454-M476 HydrophobicContact CG2-CE 3.93Å; V454-M476 HydrophobicContact CG2-SD 4.27Å; M476-Y478 HydrophobicContact CB-CD2 4.29Å; M476-Y478 HydrophobicContact CB-CE2 3.56Å; M476-Y478 HydrophobicContact CE-CE1 4.12Å; M476-Y478 HydrophobicContact CE-CE2 4.28Å; M476-Y478 WeakPolarHBondContact CE-OH 3.33Å; M476-V492 HydrophobicContact CB-CB 4.2Å; M476-V492 PolarHBondContact N-O 2.71Å; M476-V492 PolarHBondContact O-N 3.45Å; M476-L494 HydrophobicContact CB-CG 4.5Å; M476-L494 HydrophobicContact CG-CD1 3.35Å; M476-L494 HydrophobicContact CG-CD2 4.23Å; M476-L494 HydrophobicContact CG-CG 3.78Å; M476-L494 HydrophobicContact SD-CD1 4.25Å
477	L	97.7	Very high	91.1	Very high	19 Å²	19	39.6 Å²	39.6	10%	0.099	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	121.9	171.9	-50	-176.6	0	0	0	108.6	A402 Q403 V405 E475 T489 F490 V491	A402-L477 CarbonylContact C-O 3.56Å; A402-L477 WeakPolarHBondContact CA-O 3.22Å; Q403-L477 HydrophobicContact CB-CB 4.29Å; Q403-L477 PolarHBondContact N-O 2.92Å; Q403-L477 PolarHBondContact O-N 3.33Å; V405-L477 HydrophobicContact CG2-CD1 3.67Å; V405-L477 HydrophobicContact CG2-CG 3.88Å; E475-L477 HydrophobicContact CB-CD2 4.35Å; L477-T489 HydrophobicContact CB-CG2 4.31Å; L477-F490 WeakPolarHBondContact CA-O 3.41Å; L477-V491 HydrophobicContact CD2-CB 4.22Å; L477-V491 HydrophobicContact CD2-CG1 3.89Å; L477-V491 HydrophobicContact CD2-CG2 3.89Å
478	Y	95.4	Very high	90.8	Very high	2 Å²	2	41.8 Å²	41.8	1%	0.008	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	102	173.6	-61.5	-95.9	0	0	0	108.6	L369 V371 T384 V401 A402 W451 A453 M476 T489 F490 V492	L369-Y478 HydrophobicContact CD1-CD1 4.31Å; L369-Y478 HydrophobicContact CD1-CD2 4.47Å; L369-Y478 HydrophobicContact CD1-CE1 4.5Å; L369-Y478 HydrophobicContact CD1-CG 4.28Å; L369-Y478 HydrophobicContact CD2-CD2 3.49Å; L369-Y478 VanDerWaalsContact CD2-CD2 3.49Å; L369-Y478 HydrophobicContact CD2-CE2 3.86Å; L369-Y478 HydrophobicContact CD2-CG 3.95Å; V371-Y478 HydrophobicContact CG2-CE2 4.11Å; T384-Y478 HydrophobicContact CG2-CD1 4.21Å; T384-Y478 HydrophobicContact CG2-CE1 3.51Å; T384-Y478 WeakPolarHBondContact OG1-CE1 3.45Å; T384-Y478 PolarHBondContact OG1-OH 3.15Å; V401-Y478 CarbonylContact O-C 3.53Å; V401-Y478 WeakPolarHBondContact O-CA 3.38Å; A402-Y478 HydrophobicContact CB-CD1 3.92Å; A402-Y478 HydrophobicContact CB-CE1 3.9Å; W451-Y478 HydrophobicContact CH2-CD1 4.35Å; W451-Y478 HydrophobicContact CH2-CE1 4.48Å; W451-Y478 HydrophobicContact CZ2-CD1 4.02Å; W451-Y478 HydrophobicContact CZ2-CE1 4.03Å; A453-Y478 HydrophobicContact CB-CE1 3.88Å; M476-Y478 HydrophobicContact CB-CD2 4.29Å; M476-Y478 HydrophobicContact CB-CE2 3.56Å; M476-Y478 HydrophobicContact CE-CE1 4.12Å; M476-Y478 HydrophobicContact CE-CE2 4.28Å; M476-Y478 WeakPolarHBondContact CE-OH 3.33Å; Y478-T489 VanDerWaalsContact O-CA 3.31Å; Y478-T489 WeakPolarHBondContact O-CA 3.35Å; Y478-F490 HydrophobicContact CD2-CB 4.48Å; Y478-F490 PolarHBondContact N-O 3.12Å; Y478-F490 PolarHBondContact O-N 2.7Å; Y478-V492 HydrophobicContact CD2-CG2 3.99Å; Y478-V492 HydrophobicContact CE2-CB 4.29Å; Y478-V492 HydrophobicContact CE2-CG2 3.76Å
479	H	93.6	Very high	90.8	Very high	25 Å²	25	40.9 Å²	40.9	12%	0.116	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	119.1	176	-55.3	-60.8	0	0	0	109.3	I400 V401 Q403 Q487 Q488 T489	I400-H479 CarbonylContact C-O 3.52Å; I400-H479 WeakPolarHBondContact CA-O 3.48Å; V401-H479 HydrophobicContact CB-CB 4.33Å; V401-H479 PolarHBondContact N-O 3.34Å; V401-H479 PolarHBondContact O-N 3.46Å; Q403-H479 PolarHBondContact OE1-NE2 2.75Å; H479-Q487 HydrophobicContact CB-CG 4.31Å; H479-Q487 VanDerWaalsContact CG-NE2 3.35Å; H479-Q487 PolarHBondContact ND1-NE2 2.89Å; H479-Q487 VanDerWaalsContact ND1-NE2 3.18Å; H479-Q488 CarbonylContact C-O 3.6Å; H479-Q488 WeakPolarHBondContact CA-O 3.43Å; H479-T489 VanDerWaalsContact CE1-CG2 3.49Å; H479-T489 WeakPolarHBondContact CE1-CG2 3.42Å; H479-T489 VanDerWaalsContact ND1-CG2 3.31Å; H479-T489 WeakPolarHBondContact ND1-CG2 3.42Å; H479-T489 PolarHBondContact ND1-OG1 2.9Å
480	L	89.6	Confident	90.7	Very high	2 Å²	2	40.7 Å²	40.7	1%	0.01	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	119.5	172.5	-54.1	88.5	0	0	0	109.2	L386 V397 I400 M482 Q487 Q488 F490	L386-L480 HydrophobicContact CD1-CD2 4.01Å; L386-L480 HydrophobicContact CD2-CD2 3.42Å; L386-L480 VanDerWaalsContact CD2-CD2 3.42Å; L386-L480 HydrophobicContact CD2-CG 4.33Å; L386-L480 HydrophobicContact CG-CD2 4.3Å; V397-L480 HydrophobicContact CG1-CB 4.45Å; I400-L480 HydrophobicContact CG1-CG 4.39Å; L480-M482 HydrophobicContact CB-CE 3.2Å; L480-M482 HydrophobicContact CD2-CE 4Å; L480-M482 HydrophobicContact CG-CE 4.26Å; L480-Q487 WeakPolarHBondContact O-CA 3.33Å; L480-Q488 PolarHBondContact N-O 2.67Å; L480-Q488 PolarHBondContact O-N 2.87Å; L480-F490 HydrophobicContact CD1-CD2 3.45Å; L480-F490 VanDerWaalsContact CD1-CD2 3.45Å; L480-F490 HydrophobicContact CD1-CE2 3.45Å; L480-F490 VanDerWaalsContact CD1-CE2 3.45Å
481	T	86.7	Confident	90.7	Very high	17 Å²	17	44.1 Å²	44.1	10%	0.104	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	114.7	174.2	-54.1	0	0	0	0	108.1	K398 E399	K398-T481 WeakPolarHBondContact CA-O 3.32Å; K398-T481 VanDerWaalsContact CB-O 3.31Å; K398-T481 WeakPolarHBondContact CB-O 3.33Å; K398-T481 HydrophobicContact CD-CG2 4.27Å; K398-T481 PolarHBondContact N-O 2.82Å; E399-T481 PolarHBondContact N-O 2.84Å; E399-T481 PolarHBondContact O-N 3.29Å
482	M	78.5	Confident	90.7	Very high	3 Å²	3	38.7 Å²	38.7	2%	0.015	19%	0.192	C	C	.	.			trans	-81.5	176.3	173.9	-58.5	-56.1	117.1	0	0	110.4	F357 F365 V397 L480 N485 Q486	F357-M482 HydrophobicContact CE2-CG 3.83Å; F357-M482 HydrophobicContact CZ-CE 4.44Å; F357-M482 HydrophobicContact CZ-CG 3.95Å; F357-M482 HydrophobicContact CZ-SD 4.15Å; F365-M482 HydrophobicContact CD1-SD 4.35Å; F365-M482 HydrophobicContact CE1-SD 4.46Å; V397-M482 HydrophobicContact CB-CE 4.17Å; V397-M482 HydrophobicContact CB-SD 4.4Å; V397-M482 HydrophobicContact CG1-CE 3.74Å; V397-M482 HydrophobicContact CG2-CE 3.73Å; V397-M482 HydrophobicContact CG2-SD 3.8Å; L480-M482 HydrophobicContact CB-CE 3.2Å; L480-M482 HydrophobicContact CD2-CE 4Å; L480-M482 HydrophobicContact CG-CE 4.26Å; M482-N485 PolarHBondContact O-N 2.84Å; M482-Q486 PolarHBondContact N-O 2.86Å
483	A	73.4	Confident	90.6	Very high	24 Å²	24	42.2 Å²	42.2	20%	0.198	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-58.4	157.9	163.3	0	0	0	0	0	111.1	E395 N485	E395-A483 VanDerWaalsContact CD-CB 3.44Å; E395-A483 HydrophobicContact CG-CB 3.56Å; E395-A483 WeakPolarHBondContact OE1-CB 3.4Å; A483-N485 PolarHBondContact O-N 2.89Å; A483-N485 VanDerWaalsContact O-N 3.16Å
484	K	75.5	Confident	90.6	Very high	131 Å²	131	37.5 Å²	37.5	57%	0.57	20%	0.198	S	C	*	.	G	3₁₀ helix	trans	58.5	17.4	-167.3	-53.6	-179.5	174.6	-175.6	0	114.8	S361 Q486	S361-K484 WeakPolarHBondContact OG-CE 3.33Å; S361-K484 PolarHBondContact OG-NZ 2.76Å; K484-Q486 PolarHBondContact O-N 2.85Å
485	N	77.6	Confident	90.5	Very high	111 Å²	111	38.9 Å²	38.9	59%	0.594	21%	0.206	S	C	*	.	G	3₁₀ helix	trans	59.7	24.4	177.4	-58.4	-36.5	0	0	0	114.9	K398 M482 A483 Q487	K398-N485 PolarHBondContact NZ-OD1 3.2Å; M482-N485 PolarHBondContact O-N 2.84Å; A483-N485 PolarHBondContact O-N 2.89Å; A483-N485 VanDerWaalsContact O-N 3.16Å; N485-Q487 PolarHBondContact O-N 2.89Å
486	Q	83.2	Confident	90.4	Very high	48 Å²	48	37.4 Å²	37.4	22%	0.224	20%	0.199	C	C	.	.			trans	-71.4	126.1	168.5	179.8	178.4	-9.7	0	0	109.8	S358 M482 K484	S358-Q486 PolarHBondContact O-NE2 3.45Å; M482-Q486 PolarHBondContact N-O 2.86Å; K484-Q486 PolarHBondContact O-N 2.85Å
487	Q	88.2	Confident	90.3	Very high	104 Å²	104	37.4 Å²	37.4	49%	0.486	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	137.3	179.8	-172.3	173.2	-30	0	0	110.9	H479 L480 N485	H479-Q487 HydrophobicContact CB-CG 4.31Å; H479-Q487 VanDerWaalsContact CG-NE2 3.35Å; H479-Q487 PolarHBondContact ND1-NE2 2.89Å; H479-Q487 VanDerWaalsContact ND1-NE2 3.18Å; L480-Q487 WeakPolarHBondContact O-CA 3.33Å; N485-Q487 PolarHBondContact O-N 2.89Å
488	Q	90	Very high	90.1	Very high	53 Å²	53	36.6 Å²	36.6	25%	0.248	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	147.5	170.6	-65	-65.7	-60.1	0	0	108.9	F357 H479 L480	F357-Q488 HydrophobicContact CD1-CG 3.8Å; F357-Q488 HydrophobicContact CD2-CG 4.01Å; F357-Q488 HydrophobicContact CE1-CB 4.2Å; F357-Q488 HydrophobicContact CE1-CG 3.64Å; F357-Q488 HydrophobicContact CE2-CG 3.84Å; F357-Q488 HydrophobicContact CG-CG 4Å; F357-Q488 HydrophobicContact CZ-CB 4.39Å; F357-Q488 HydrophobicContact CZ-CG 3.65Å; H479-Q488 CarbonylContact C-O 3.6Å; H479-Q488 WeakPolarHBondContact CA-O 3.43Å; L480-Q488 PolarHBondContact N-O 2.67Å; L480-Q488 PolarHBondContact O-N 2.87Å
489	T	94.6	Very high	90	Very high	55 Å²	55	36.6 Å²	36.6	34%	0.337	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	126.2	-174	-55.8	0	0	0	0	111	L477 Y478 H479 V491	L477-T489 HydrophobicContact CB-CG2 4.31Å; Y478-T489 VanDerWaalsContact O-CA 3.31Å; Y478-T489 WeakPolarHBondContact O-CA 3.35Å; H479-T489 VanDerWaalsContact CE1-CG2 3.49Å; H479-T489 WeakPolarHBondContact CE1-CG2 3.42Å; H479-T489 VanDerWaalsContact ND1-CG2 3.31Å; H479-T489 WeakPolarHBondContact ND1-CG2 3.42Å; H479-T489 PolarHBondContact ND1-OG1 2.9Å; T489-V491 HydrophobicContact CG2-CG2 4.46Å
490	F	96.7	Very high	89.9	Confident	4 Å²	4	35.4 Å²	35.4	2%	0.018	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	139.9	161.5	-64	-92	0	0	0	109.7	L355 C367 L369 L386 L477 Y478 L480	L355-F490 HydrophobicContact CB-CE1 3.98Å; L355-F490 HydrophobicContact CB-CZ 3.78Å; L355-F490 HydrophobicContact CD1-CD1 3.81Å; L355-F490 HydrophobicContact CD1-CD2 3.97Å; L355-F490 HydrophobicContact CD1-CE1 3.64Å; L355-F490 HydrophobicContact CD1-CE2 3.79Å; L355-F490 HydrophobicContact CD1-CG 3.98Å; L355-F490 HydrophobicContact CD1-CZ 3.62Å; L355-F490 HydrophobicContact CG-CD1 3.92Å; L355-F490 HydrophobicContact CG-CE1 3.41Å; L355-F490 VanDerWaalsContact CG-CE1 3.41Å; L355-F490 HydrophobicContact CG-CE2 4.33Å; L355-F490 HydrophobicContact CG-CZ 3.63Å; C367-F490 HydrophobicContact CB-CE2 4.02Å; C367-F490 HydrophobicContact CB-CZ 3.76Å; C367-F490 WeakPolarHBondContact O-CZ 3.34Å; L369-F490 HydrophobicContact CB-CD1 3.94Å; L369-F490 HydrophobicContact CB-CD2 4.21Å; L369-F490 HydrophobicContact CB-CE1 3.92Å; L369-F490 HydrophobicContact CB-CE2 4.21Å; L369-F490 HydrophobicContact CB-CG 4.08Å; L369-F490 HydrophobicContact CB-CZ 4.07Å; L369-F490 HydrophobicContact CD2-CB 3.51Å; L369-F490 HydrophobicContact CD2-CD1 4.1Å; L369-F490 HydrophobicContact CD2-CD2 4.1Å; L369-F490 HydrophobicContact CD2-CG 3.66Å; L369-F490 HydrophobicContact CG-CG 4.49Å; L386-F490 HydrophobicContact CD1-CE2 4.25Å; L477-F490 WeakPolarHBondContact CA-O 3.41Å; Y478-F490 HydrophobicContact CD2-CB 4.48Å; Y478-F490 PolarHBondContact N-O 3.12Å; Y478-F490 PolarHBondContact O-N 2.7Å; L480-F490 HydrophobicContact CD1-CD2 3.45Å; L480-F490 VanDerWaalsContact CD1-CD2 3.45Å; L480-F490 HydrophobicContact CD1-CE2 3.45Å; L480-F490 VanDerWaalsContact CD1-CE2 3.45Å
491	V	96.9	Very high	90	Very high	75 Å²	75	35.6 Å²	35.6	46%	0.455	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	117.7	171.6	-174.3	0	0	0	0	107.7	E475 L477 T489	E475-V491 HydrophobicContact CB-CG1 4.34Å; E475-V491 HydrophobicContact CG-CG1 4.13Å; L477-V491 HydrophobicContact CD2-CB 4.22Å; L477-V491 HydrophobicContact CD2-CG1 3.89Å; L477-V491 HydrophobicContact CD2-CG2 3.89Å; T489-V491 HydrophobicContact CG2-CG2 4.46Å
492	V	97.4	Very high	90.2	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	114.2	-179.9	-177.3	0	0	0	0	108.6	F351 L369 V371 V374 E475 M476 Y478	F351-V492 HydrophobicContact CB-CG1 3.87Å; F351-V492 HydrophobicContact CD1-CB 4.19Å; F351-V492 HydrophobicContact CD1-CG1 3.73Å; F351-V492 HydrophobicContact CD1-CG2 3.67Å; F351-V492 HydrophobicContact CD2-CG1 4.39Å; F351-V492 HydrophobicContact CE1-CB 4.34Å; F351-V492 HydrophobicContact CE1-CG1 4.32Å; F351-V492 HydrophobicContact CE1-CG2 3.67Å; F351-V492 HydrophobicContact CG-CG1 3.76Å; L369-V492 HydrophobicContact CD2-CG2 3.63Å; V371-V492 HydrophobicContact CB-CG1 4.41Å; V371-V492 HydrophobicContact CG2-CG1 4.29Å; V371-V492 HydrophobicContact CG2-CG2 4.25Å; V374-V492 HydrophobicContact CG1-CG1 3.57Å; E475-V492 CarbonylContact C-O 3.57Å; E475-V492 WeakPolarHBondContact CA-O 3.29Å; M476-V492 HydrophobicContact CB-CB 4.2Å; M476-V492 PolarHBondContact N-O 2.71Å; M476-V492 PolarHBondContact O-N 3.45Å; Y478-V492 HydrophobicContact CD2-CG2 3.99Å; Y478-V492 HydrophobicContact CE2-CB 4.29Å; Y478-V492 HydrophobicContact CE2-CG2 3.76Å
493	P	96.8	Very high	90.7	Very high	74 Å²	74	47.8 Å²	47.8	48%	0.481	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	138.3	176.9	29	-33.6	0	0	0	110.3
494	L	96.3	Very high	91.5	Very high	7 Å²	7	47.7 Å²	47.7	4%	0.037	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	147.1	174.7	-67.6	-169.3	0	0	0	111.7	V374 V376 V382 L404 I456 Y474 M476	V374-L494 HydrophobicContact CB-CD2 3.89Å; V374-L494 HydrophobicContact CG1-CD2 4.07Å; V374-L494 WeakPolarHBondContact O-CA 3.46Å; V376-L494 HydrophobicContact CG2-CD1 4.34Å; V382-L494 HydrophobicContact CG2-CD1 4.09Å; L404-L494 HydrophobicContact CD1-CD1 3.77Å; I456-L494 HydrophobicContact CD1-CD1 4.3Å; Y474-L494 PolarHBondContact O-N 3Å; M476-L494 HydrophobicContact CB-CG 4.5Å; M476-L494 HydrophobicContact CG-CD1 3.35Å; M476-L494 HydrophobicContact CG-CD2 4.23Å; M476-L494 HydrophobicContact CG-CG 3.78Å; M476-L494 HydrophobicContact SD-CD1 4.25Å
495	V	96.1	Very high	92.2	Very high	31 Å²	31	42.1 Å²	42.1	19%	0.188	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	120.8	165.9	-178.7	0	0	0	0	108.5	I340 L342 V374 R375 V376	I340-V495 HydrophobicContact CD1-CG1 3.72Å; L342-V495 HydrophobicContact CD2-CG1 4.19Å; V374-V495 PolarHBondContact O-N 3.27Å; R375-V495 WeakPolarHBondContact CA-O 3.21Å; R375-V495 HydrophobicContact CG-CB 4.24Å; V376-V495 PolarHBondContact N-O 2.65Å
496	V	96.8	Very high	92.7	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	112.9	174.2	-177.6	0	0	0	0	108.4	V376 P378 I456 T459 P461 T462 Y474	V376-V496 HydrophobicContact CG2-CG2 4.38Å; V376-V496 CarbonylContact O-C 3.56Å; V376-V496 VanDerWaalsContact O-CA 3.27Å; V376-V496 WeakPolarHBondContact O-CA 3.38Å; P378-V496 HydrophobicContact CG-CG1 4.09Å; I456-V496 HydrophobicContact CG2-CG1 4.35Å; I456-V496 HydrophobicContact CG2-CG2 4.49Å; T459-V496 HydrophobicContact CG2-CG1 4.16Å; P461-V496 CarbonylContact C-O 3.54Å; P461-V496 WeakPolarHBondContact CA-O 3.42Å; T462-V496 PolarHBondContact N-O 3.14Å; T462-V496 PolarHBondContact OG1-N 2.98Å; Y474-V496 HydrophobicContact CD1-CG2 4.31Å; Y474-V496 HydrophobicContact CD2-CB 3.92Å; Y474-V496 HydrophobicContact CD2-CG2 3.4Å; Y474-V496 VanDerWaalsContact CD2-CG2 3.4Å; Y474-V496 HydrophobicContact CE2-CB 3.91Å; Y474-V496 HydrophobicContact CE2-CG2 3.74Å; Y474-V496 HydrophobicContact CG-CG2 3.72Å
497	G	95.5	Very high	93	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.226	C	C	.	.			trans	-102.8	-173.4	177.8	0	0	0	0	0	113.2	I340 V376 P378	I340-G497 CarbonylContact O-C 3.4Å; I340-G497 WeakPolarHBondContact O-CA 3.43Å; V376-G497 PolarHBondContact O-N 2.79Å; P378-G497 WeakPolarHBondContact CD-O 3.44Å
498	V	93.2	Very high	93	Very high	3 Å²	3	39.5 Å²	39.5	2%	0.018	21%	0.205	C	C	.	.	S	Bend	trans	-112.8	-25.4	177	-71.5	0	0	0	0	113	L337 G339 I340 P461 I570 Y572	L337-V498 HydrophobicContact CD1-CG1 4.08Å; G339-V498 WeakPolarHBondContact O-CG2 3.24Å; I340-V498 PolarHBondContact O-N 3.29Å; P461-V498 HydrophobicContact CB-CG1 4.26Å; P461-V498 HydrophobicContact CG-CG1 3.47Å; P461-V498 VanDerWaalsContact CG-CG1 3.47Å; V498-I570 HydrophobicContact CB-CD1 3.96Å; V498-I570 HydrophobicContact CB-CG1 4.16Å; V498-I570 HydrophobicContact CG1-CG1 4.18Å; V498-I570 WeakPolarHBondContact O-CD1 3.49Å; V498-Y572 VanDerWaalsContact O-CE2 3.23Å; V498-Y572 WeakPolarHBondContact O-CE2 3.45Å; V498-Y572 PolarHBondContact O-OH 3.38Å
499	V	92.8	Very high	92.5	Very high	1 Å²	1	40.4 Å²	40.4	1%	0.006	21%	0.21	C	C	.	.	B	Isolated β-bridge	trans	-118.1	123.1	174.6	-176.9	0	0	0	0	109.2	D341 L342 N343 W505 L528 Y532 M535	D341-V499 HydrophobicContact CB-CB 4.21Å; D341-V499 HydrophobicContact CB-CG2 4.29Å; D341-V499 WeakPolarHBondContact OD1-CB 3.25Å; L342-V499 WeakPolarHBondContact CB-O 3.47Å; L342-V499 WeakPolarHBondContact CG-O 3.33Å; L342-V499 PolarHBondContact N-O 2.63Å; N343-V499 WeakPolarHBondContact ND2-CG1 3.48Å; V499-W505 HydrophobicContact CG1-CZ2 4.39Å; V499-L528 HydrophobicContact CG2-CD2 4.01Å; V499-Y532 HydrophobicContact CG1-CD2 4.26Å; V499-Y532 HydrophobicContact CG1-CE2 4.08Å; V499-M535 HydrophobicContact CG1-SD 3.72Å; V499-M535 HydrophobicContact CG2-SD 4.15Å
500	P	92.5	Very high	91.4	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.216	C	C	.	.			trans	-71.4	154.5	179.6	23.3	-27	0	0	0	111.2	N343 V377 R502 W505 F508 P536 Y572	N343-P500 PolarHBondContact ND2-O 2.82Å; V377-P500 HydrophobicContact CG1-CB 4.03Å; V377-P500 HydrophobicContact CG1-CG 4.48Å; V377-P500 HydrophobicContact CG2-CB 3.86Å; V377-P500 HydrophobicContact CG2-CG 4.15Å; P500-R502 PolarHBondContact O-N 2.76Å; P500-W505 PolarHBondContact O-NE1 3.07Å; P500-F508 HydrophobicContact CB-CE2 3.68Å; P500-F508 HydrophobicContact CB-CZ 4.14Å; P500-F508 HydrophobicContact CG-CD2 4.24Å; P500-F508 HydrophobicContact CG-CE2 3.71Å; P500-F508 HydrophobicContact CG-CZ 4.34Å; P500-P536 HydrophobicContact CG-CG 4.39Å; P500-Y572 VanDerWaalsContact CD-OH 3.29Å; P500-Y572 WeakPolarHBondContact CD-OH 3.39Å; P500-Y572 HydrophobicContact CG-CD1 4.32Å; P500-Y572 HydrophobicContact CG-CE1 3.99Å; P500-Y572 HydrophobicContact CG-CE2 4.26Å
501	P	91.1	Very high	89.7	Confident	6 Å²	6	43.4 Å²	43.4	4%	0.039	23%	0.229	C	C	.	.			trans	-55.3	133.2	170.1	-23.3	34.4	0	0	0	111.4	L342 N343 K503 R504	L342-P501 HydrophobicContact CB-CG 4.05Å; N343-P501 VanDerWaalsContact OD1-CA 3.25Å; N343-P501 WeakPolarHBondContact OD1-CA 3.32Å; P501-K503 HydrophobicContact CB-CG 4.36Å; P501-K503 PolarHBondContact O-N 3.09Å; P501-R504 PolarHBondContact O-N 2.91Å
502	R	89.9	Confident	87.8	Confident	137 Å²	137	45.6 Å²	45.6	52%	0.517	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-46.9	-42.2	-176.8	-74.9	-173.8	-178.8	-170.6	1.3	114.2	N343 P500 R504 W505	N343-R502 WeakPolarHBondContact OD1-CG 3.22Å; N343-R502 PolarHBondContact OD1-N 3.3Å; P500-R502 PolarHBondContact O-N 2.76Å; R502-R504 PolarHBondContact O-N 3.03Å; R502-W505 HydrophobicContact CB-CD2 4.4Å; R502-W505 HydrophobicContact CB-CZ2 4.49Å; R502-W505 HydrophobicContact CG-CD2 4.27Å; R502-W505 HydrophobicContact CG-CE3 4.27Å; R502-W505 HydrophobicContact CG-CH2 3.57Å; R502-W505 HydrophobicContact CG-CZ2 3.58Å; R502-W505 HydrophobicContact CG-CZ3 3.89Å; R502-W505 WeakPolarHBondContact O-CB 3.3Å; R502-W505 PolarHBondContact O-N 3.43Å
503	K	89.2	Confident	85.8	Confident	140 Å²	140	54.1 Å²	54.1	61%	0.609	27%	0.266	S	S	*	.	G	3₁₀ helix	trans	-59.7	-18.9	179.5	70	-171	-178.3	-166.2	0	114.6	E349 P501	E349-K503 IonicContact OE1-NZ 3.67Å; E349-K503 PolarHBondContact OE1-NZ 2.95Å; E349-K503 WeakPolarHBondContact OE2-CE 3.36Å; E349-K503 IonicContact OE2-NZ 3.67Å; E349-K503 PolarHBondContact OE2-NZ 3.38Å; P501-K503 HydrophobicContact CB-CG 4.36Å; P501-K503 PolarHBondContact O-N 3.09Å
504	R	90.4	Very high	83.7	Confident	21 Å²	21	53.8 Å²	53.8	8%	0.079	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-102.4	-1.3	179.1	-65.6	-170.1	-60.3	169.5	4.5	113.4	N373 R375 E380 P501 R502 P506 L507 F508	N373-R504 PolarHBondContact ND2-NH1 2.77Å; R375-R504 PolarHBondContact O-NH1 3.16Å; R375-R504 PolarHBondContact O-NH2 2.96Å; E380-R504 WeakPolarHBondContact OE1-CD 3.05Å; E380-R504 IonicContact OE1-CZ 2.84Å; E380-R504 IonicContact OE1-NE 3.76Å; E380-R504 PolarHBondContact OE1-NE 2.8Å; E380-R504 VanDerWaalsContact OE1-NE 3.09Å; E380-R504 IonicContact OE1-NH1 3.48Å; E380-R504 PolarHBondContact OE1-NH1 3.45Å; E380-R504 IonicContact OE1-NH2 2.96Å; E380-R504 PolarHBondContact OE1-NH2 3.14Å; E380-R504 IonicContact OE2-CZ 3.74Å; E380-R504 IonicContact OE2-NE 3.08Å; E380-R504 IonicContact OE2-NH1 2.73Å; E380-R504 PolarHBondContact OE2-NH1 3.04Å; E380-R504 IonicContact OE2-NH2 3.73Å; E380-R504 PolarHBondContact OE2-NH2 2.87Å; P501-R504 PolarHBondContact O-N 2.91Å; R502-R504 PolarHBondContact O-N 3.03Å; R504-P506 VanDerWaalsContact C-CD 3.43Å; R504-P506 VanDerWaalsContact C-N 3.32Å; R504-L507 HydrophobicContact CB-CD1 3.95Å; R504-L507 HydrophobicContact CB-CG 4.46Å; R504-L507 HydrophobicContact CG-CD1 4.05Å; R504-L507 VanDerWaalsContact O-CB 3.24Å; R504-L507 WeakPolarHBondContact O-CB 3.31Å; R504-L507 WeakPolarHBondContact O-CG 3.38Å; R504-L507 PolarHBondContact O-N 2.99Å; R504-F508 HydrophobicContact CB-CE2 4.47Å; R504-F508 WeakPolarHBondContact O-CD2 3.42Å; R504-F508 WeakPolarHBondContact O-CE2 3.31Å
505	W	90.5	Very high	81.8	Confident	15 Å²	15	59.2 Å²	59.2	6%	0.057	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-55.9	-39.1	176.5	-69.5	3.6	0	0	0	114.3	V499 P500 R502 L507 F508 Y532 D534 M535 P536	V499-W505 HydrophobicContact CG1-CZ2 4.39Å; P500-W505 PolarHBondContact O-NE1 3.07Å; R502-W505 HydrophobicContact CB-CD2 4.4Å; R502-W505 HydrophobicContact CB-CZ2 4.49Å; R502-W505 HydrophobicContact CG-CD2 4.27Å; R502-W505 HydrophobicContact CG-CE3 4.27Å; R502-W505 HydrophobicContact CG-CH2 3.57Å; R502-W505 HydrophobicContact CG-CZ2 3.58Å; R502-W505 HydrophobicContact CG-CZ3 3.89Å; R502-W505 WeakPolarHBondContact O-CB 3.3Å; R502-W505 PolarHBondContact O-N 3.43Å; W505-L507 PolarHBondContact O-N 2.86Å; W505-F508 PolarHBondContact O-N 3.02Å; W505-Y532 AromaticContact CH2-CD1 3.54Å; W505-Y532 HydrophobicContact CH2-CD1 3.54Å; W505-Y532 HydrophobicContact CH2-CE1 4.41Å; W505-Y532 AromaticContact CH2-CG 3.77Å; W505-Y532 HydrophobicContact CH2-CG 3.77Å; W505-Y532 HydrophobicContact CZ2-CD1 4.01Å; W505-Y532 HydrophobicContact CZ2-CG 4.1Å; W505-D534 HydrophobicContact CE3-CB 4.44Å; W505-D534 HydrophobicContact CZ3-CB 4.19Å; W505-D534 VanDerWaalsContact CZ3-OD1 3.29Å; W505-D534 WeakPolarHBondContact CZ3-OD1 3.43Å; W505-D534 WeakPolarHBondContact CZ3-OD2 3.49Å; W505-M535 HydrophobicContact CH2-CB 3.96Å; W505-M535 HydrophobicContact CH2-CG 4.42Å; W505-M535 HydrophobicContact CZ2-CB 3.98Å; W505-M535 HydrophobicContact CZ2-CG 3.93Å; W505-M535 HydrophobicContact CZ3-CB 4.32Å; W505-P536 HydrophobicContact CB-CG 4.22Å; W505-P536 HydrophobicContact CG-CG 4.05Å
506	P	89.6	Confident	79.8	Confident	100 Å²	100	61 Å²	61	65%	0.649	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-63.2	-10.8	175.2	-23.8	35.6	0	0	0	115	R504 F508 H575	R504-P506 VanDerWaalsContact C-CD 3.43Å; R504-P506 VanDerWaalsContact C-N 3.32Å; P506-F508 VanDerWaalsContact C-N 3.3Å; P506-H575 PolarHBondContact O-CD2 2.85Å
507	L	87.5	Confident	77.9	Confident	101 Å²	101	65.3 Å²	65.3	53%	0.529	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-79.6	-15.7	175.7	-55.7	-179.9	0	0	0	112.5	R504 W505 P574 H575	R504-L507 HydrophobicContact CB-CD1 3.95Å; R504-L507 HydrophobicContact CB-CG 4.46Å; R504-L507 HydrophobicContact CG-CD1 4.05Å; R504-L507 VanDerWaalsContact O-CB 3.24Å; R504-L507 WeakPolarHBondContact O-CB 3.31Å; R504-L507 WeakPolarHBondContact O-CG 3.38Å; R504-L507 PolarHBondContact O-N 2.99Å; W505-L507 PolarHBondContact O-N 2.86Å; L507-P574 WeakPolarHBondContact O-CA 3.44Å; L507-H575 PolarHBondContact O-N 3.27Å
508	F	88.6	Confident	76.4	Confident	7 Å²	7	66.3 Å²	66.3	3%	0.031	35%	0.35	C	S	.	.	B	Isolated β-bridge	trans	-105.8	147.2	-177.1	-54.5	-74	0	0	0	111.6	V377 E380 P500 R504 W505 P506 S510 P536 Y572 S573 H575	V377-F508 HydrophobicContact CG2-CE1 4.37Å; V377-F508 HydrophobicContact CG2-CZ 3.9Å; E380-F508 HydrophobicContact CB-CE1 4.01Å; E380-F508 HydrophobicContact CB-CZ 3.97Å; E380-F508 HydrophobicContact CG-CE1 4.32Å; E380-F508 HydrophobicContact CG-CZ 3.99Å; P500-F508 HydrophobicContact CB-CE2 3.68Å; P500-F508 HydrophobicContact CB-CZ 4.14Å; P500-F508 HydrophobicContact CG-CD2 4.24Å; P500-F508 HydrophobicContact CG-CE2 3.71Å; P500-F508 HydrophobicContact CG-CZ 4.34Å; R504-F508 HydrophobicContact CB-CE2 4.47Å; R504-F508 WeakPolarHBondContact O-CD2 3.42Å; R504-F508 WeakPolarHBondContact O-CE2 3.31Å; W505-F508 PolarHBondContact O-N 3.02Å; P506-F508 VanDerWaalsContact C-N 3.3Å; F508-S510 PolarHBondContact O-N 3.13Å; F508-P536 HydrophobicContact CB-CB 3.69Å; F508-P536 HydrophobicContact CB-CG 4Å; F508-P536 HydrophobicContact CD2-CG 3.92Å; F508-P536 HydrophobicContact CG-CB 4.48Å; F508-P536 HydrophobicContact CG-CG 4.29Å; F508-Y572 HydrophobicContact CD1-CG 4.27Å; F508-Y572 HydrophobicContact CE1-CG 4.35Å; F508-Y572 HydrophobicContact CG-CD1 4.38Å; F508-S573 CarbonylContact C-O 3.42Å; F508-S573 WeakPolarHBondContact CA-O 3.3Å; F508-H575 PolarHBondContact O-CD2 3.14Å; F508-H575 PolarHBondContact O-NE2 2.73Å
509	M	81	Confident	75.4	Confident	72 Å²	72	70 Å²	70	36%	0.355	37%	0.367	S	S	.	.			trans	-63.6	129.8	175	-63.9	-171.8	72.1	0	0	110.5	N511 S573	M509-N511 VanDerWaalsContact C-N 3.34Å; M509-N511 PolarHBondContact O-N 2.9Å; M509-S573 PolarHBondContact N-O 3.5Å
510	S	70	Confident	74.5	Confident	67 Å²	67	75.7 Å²	75.7	47%	0.469	39%	0.393	S	S	.	.			trans	-74.2	87.9	166.7	-176.7	0	0	0	0	109	F508 R512	F508-S510 PolarHBondContact O-N 3.13Å; S510-R512 PolarHBondContact O-N 3.38Å; S510-R512 WeakPolarHBondContact OG-CG 3.42Å
511	N	61.1	Low	73.6	Confident	55 Å²	55	81.6 Å²	81.6	29%	0.294	42%	0.416	S	S	.	.			trans	-83.2	52.3	176.8	-116	49.4	0	0	0	112.2	M509 F513 F537 F539	M509-N511 VanDerWaalsContact C-N 3.34Å; M509-N511 PolarHBondContact O-N 2.9Å; N511-F513 PolarHBondContact O-N 3.22Å; N511-F537 HydrophobicContact CB-CB 4.42Å; N511-F539 HydrophobicContact CB-CE1 4.47Å; N511-F539 HydrophobicContact CB-CZ 3.7Å; N511-F539 WeakPolarHBondContact ND2-CZ 3.36Å
512	R	58.5	Low	73	Confident	121 Å²	121	84.8 Å²	84.8	46%	0.457	43%	0.427	S	S	.	.			trans	-79.5	-0.1	178.6	-68.2	-173.5	-167.2	-124.3	-8.7	114.1	S510 V514 D533 D534 M535	S510-R512 PolarHBondContact O-N 3.38Å; S510-R512 WeakPolarHBondContact OG-CG 3.42Å; R512-V514 PolarHBondContact O-N 2.85Å; R512-D533 PolarHBondContact NH1-O 2.86Å; R512-D533 PolarHBondContact NH2-O 3.18Å; R512-D534 VanDerWaalsContact NH2-CA 3.27Å; R512-M535 PolarHBondContact NH2-O 2.85Å
513	F	54.8	Low	72.7	Confident	178 Å²	178	82.7 Å²	82.7	78%	0.781	42%	0.423	S	S	*	.			trans	-74.7	115.1	175.4	-66.2	-76.2	0	0	0	109.6	N511	N511-F513 PolarHBondContact O-N 3.22Å
514	V	52.8	Low	72.6	Confident	68 Å²	68	76.1 Å²	76.1	41%	0.412	40%	0.395	S	S	.	.			trans	-99.8	104.5	-175.9	-177.3	0	0	0	0	109	R512 E519	R512-V514 PolarHBondContact O-N 2.85Å; V514-E519 HydrophobicContact CG1-CB 4.26Å; V514-E519 WeakPolarHBondContact CG1-OE2 3.43Å
515	D	55	Low	72.4	Confident	121 Å²	121	75.2 Å²	75.2	65%	0.647	39%	0.391	S	S	*	.			trans	-84.4	166.3	155.9	-68.8	-8.5	0	0	0	108.9	T517 S518 E519	D515-T517 VanDerWaalsContact C-N 3.26Å; D515-T517 PolarHBondContact O-N 2.85Å; D515-T517 VanDerWaalsContact O-N 3.15Å; D515-S518 VanDerWaalsContact O-CA 3.31Å; D515-S518 WeakPolarHBondContact O-CA 3.39Å; D515-S518 WeakPolarHBondContact O-CB 3.48Å; D515-S518 PolarHBondContact O-N 2.81Å; D515-E519 PolarHBondContact O-N 2.95Å
516	G	54.5	Low	72.1	Confident	67 Å²	67	78.8 Å²	78.8	69%	0.691	41%	0.409	S	S	*	.	H	α-helix	trans	-55.5	-35.6	-177.9	0	0	0	0	0	114.8	S518 E519	G516-S518 PolarHBondContact O-N 2.98Å; G516-E519 PolarHBondContact O-N 2.79Å
517	T	57.6	Low	72	Confident	91 Å²	91	75.8 Å²	75.8	56%	0.558	39%	0.389	S	S	*	.	H	α-helix	trans	-69.6	-19.2	173.4	59.7	0	0	0	0	113.4	D515 R521	D515-T517 VanDerWaalsContact C-N 3.26Å; D515-T517 PolarHBondContact O-N 2.85Å; D515-T517 VanDerWaalsContact O-N 3.15Å; T517-R521 WeakPolarHBondContact O-CG 3.32Å
518	S	64.3	Low	71.8	Confident	21 Å²	21	71.9 Å²	71.9	15%	0.147	37%	0.369	C	S	.	.	H	α-helix	trans	-76.3	-29.9	176.5	-162	0	0	0	0	111.1	D515 G516 R521 R522	D515-S518 VanDerWaalsContact O-CA 3.31Å; D515-S518 WeakPolarHBondContact O-CA 3.39Å; D515-S518 WeakPolarHBondContact O-CB 3.48Å; D515-S518 PolarHBondContact O-N 2.81Å; G516-S518 PolarHBondContact O-N 2.98Å; S518-R521 PolarHBondContact O-N 2.71Å; S518-R522 WeakPolarHBondContact O-CB 3.39Å; S518-R522 PolarHBondContact O-N 3.38Å
519	E	72.2	Confident	71.2	Confident	80 Å²	80	72.5 Å²	72.5	37%	0.374	37%	0.372	S	S	.	.	H	α-helix	trans	-70.1	-45.7	-178.2	-166.6	57.6	-147.5	0	0	112.4	V514 D515 G516 R521 R522 Q523	V514-E519 HydrophobicContact CG1-CB 4.26Å; V514-E519 WeakPolarHBondContact CG1-OE2 3.43Å; D515-E519 PolarHBondContact O-N 2.95Å; G516-E519 PolarHBondContact O-N 2.79Å; E519-R521 VanDerWaalsContact C-N 3.29Å; E519-R521 PolarHBondContact O-N 3.42Å; E519-R522 WeakPolarHBondContact O-CA 3.15Å; E519-R522 VanDerWaalsContact O-CB 3.31Å; E519-R522 WeakPolarHBondContact O-CB 3.47Å; E519-R522 PolarHBondContact O-N 3.24Å; E519-R522 VanDerWaalsContact O-N 3.08Å; E519-Q523 WeakPolarHBondContact O-CG 3.31Å; E519-Q523 PolarHBondContact O-N 3.34Å
520	E	74.2	Confident	71.1	Confident	122 Å²	122	73.8 Å²	73.8	57%	0.57	38%	0.38	S	S	*	.	H	α-helix	trans	-58.9	-42.7	174.1	-66.7	176.5	172	0	0	111.3	R522 Q523 I524	E520-R522 VanDerWaalsContact C-N 3.3Å; E520-R522 PolarHBondContact O-N 2.86Å; E520-Q523 PolarHBondContact O-N 2.79Å; E520-I524 PolarHBondContact O-N 2.85Å
521	R	73.1	Confident	71.6	Confident	123 Å²	123	75.9 Å²	75.9	46%	0.464	39%	0.386	S	S	.	.	H	α-helix	trans	-68.1	-31.6	176.6	-68.1	177.5	-178.7	-170.9	0.9	112.3	T517 S518 E519 I524	T517-R521 WeakPolarHBondContact O-CG 3.32Å; S518-R521 PolarHBondContact O-N 2.71Å; E519-R521 VanDerWaalsContact C-N 3.29Å; E519-R521 PolarHBondContact O-N 3.42Å; R521-I524 PolarHBondContact O-N 2.96Å
522	R	77.8	Confident	72.6	Confident	73 Å²	73	74.5 Å²	74.5	28%	0.275	38%	0.377	S	S	.	.	H	α-helix	trans	-66.9	-43.4	175.5	179.4	170.8	-173.9	98	7.1	111.4	S518 E519 E520 I524 I525 E526 F537	S518-R522 WeakPolarHBondContact O-CB 3.39Å; S518-R522 PolarHBondContact O-N 3.38Å; E519-R522 WeakPolarHBondContact O-CA 3.15Å; E519-R522 VanDerWaalsContact O-CB 3.31Å; E519-R522 WeakPolarHBondContact O-CB 3.47Å; E519-R522 PolarHBondContact O-N 3.24Å; E519-R522 VanDerWaalsContact O-N 3.08Å; E520-R522 VanDerWaalsContact C-N 3.3Å; E520-R522 PolarHBondContact O-N 2.86Å; R522-I524 PolarHBondContact O-N 2.7Å; R522-I525 CarbonylContact O-C 3.58Å; R522-I525 WeakPolarHBondContact O-CG1 2.93Å; R522-I525 PolarHBondContact O-N 2.75Å; R522-I525 VanDerWaalsContact O-N 3.11Å; R522-E526 PolarHBondContact O-N 2.75Å; R522-F537 HydrophobicContact CB-CE2 4.05Å; R522-F537 HydrophobicContact CB-CZ 3.68Å; R522-F537 HydrophobicContact CG-CE2 3.8Å; R522-F537 HydrophobicContact CG-CZ 3.98Å
523	Q	83.7	Confident	73.4	Confident	93 Å²	93	75.3 Å²	75.3	44%	0.435	39%	0.39	S	S	.	.	H	α-helix	trans	-58.5	-38.4	176.8	-71.2	174.2	6.1	0	0	111.8	E519 E520 I525 E526	E519-Q523 WeakPolarHBondContact O-CG 3.31Å; E519-Q523 PolarHBondContact O-N 3.34Å; E520-Q523 PolarHBondContact O-N 2.79Å; Q523-I525 VanDerWaalsContact C-N 3.32Å; Q523-I525 PolarHBondContact O-N 2.83Å; Q523-E526 WeakPolarHBondContact O-CB 3.37Å; Q523-E526 PolarHBondContact O-N 3.21Å
524	I	86.6	Confident	74.6	Confident	3 Å²	3	71.6 Å²	71.6	2%	0.015	38%	0.379	C	S	.	.	H	α-helix	trans	-57	-46.3	176	-66.8	171.8	0	0	0	111	H190 P192 V194 F196 E520 R521 R522 V540	H190-I524 HydrophobicContact CB-CD1 4.3Å; H190-I524 HydrophobicContact CB-CG1 4.01Å; P192-I524 HydrophobicContact CG-CD1 4.23Å; P192-I524 WeakPolarHBondContact O-CD1 3.49Å; V194-I524 HydrophobicContact CB-CG2 3.71Å; V194-I524 HydrophobicContact CG1-CG2 3.97Å; F196-I524 WeakPolarHBondContact CE2-O 3.48Å; E520-I524 PolarHBondContact O-N 2.85Å; R521-I524 PolarHBondContact O-N 2.96Å; R522-I524 PolarHBondContact O-N 2.7Å; I524-V540 HydrophobicContact CG2-CG2 3.95Å
525	I	86.6	Confident	76.1	Confident	1 Å²	1	68.7 Å²	68.7	1%	0.005	36%	0.361	C	S	.	.	H	α-helix	trans	-97.4	1.4	-173.5	62.4	168.6	0	0	0	114.5	R522 Q523 P527 L528 I529 F537 P538 V540 I570	R522-I525 CarbonylContact O-C 3.58Å; R522-I525 WeakPolarHBondContact O-CG1 2.93Å; R522-I525 PolarHBondContact O-N 2.75Å; R522-I525 VanDerWaalsContact O-N 3.11Å; Q523-I525 VanDerWaalsContact C-N 3.32Å; Q523-I525 PolarHBondContact O-N 2.83Å; I525-P527 VanDerWaalsContact C-N 3.27Å; I525-L528 PolarHBondContact O-N 2.84Å; I525-I529 HydrophobicContact CD1-CD1 3.77Å; I525-I529 HydrophobicContact CD1-CG1 4.42Å; I525-I529 HydrophobicContact CG1-CD1 3.74Å; I525-I529 HydrophobicContact CG1-CG1 4.42Å; I525-I529 PolarHBondContact O-N 3.02Å; I525-F537 HydrophobicContact CD1-CD1 4.09Å; I525-F537 HydrophobicContact CD1-CD2 4.15Å; I525-F537 HydrophobicContact CD1-CE1 3.71Å; I525-F537 HydrophobicContact CD1-CE2 3.78Å; I525-F537 HydrophobicContact CD1-CG 4.32Å; I525-F537 HydrophobicContact CD1-CZ 3.57Å; I525-F537 HydrophobicContact CG1-CE2 4.38Å; I525-F537 HydrophobicContact CG1-CZ 4.16Å; I525-P538 HydrophobicContact CD1-CG 3.81Å; I525-V540 HydrophobicContact CG2-CG2 3.77Å; I525-I570 HydrophobicContact CG2-CG2 3.96Å
526	E	85.2	Confident	77.6	Confident	91 Å²	91	63.2 Å²	63.2	43%	0.425	33%	0.332	S	S	.	.	H	α-helix	trans	-48.3	-41.7	178.5	-159.3	-157.8	142.6	0	0	113.1	R522 Q523 L528 I529 N530	R522-E526 PolarHBondContact O-N 2.75Å; Q523-E526 WeakPolarHBondContact O-CB 3.37Å; Q523-E526 PolarHBondContact O-N 3.21Å; E526-L528 PolarHBondContact O-N 3Å; E526-L528 VanDerWaalsContact O-N 3.13Å; E526-I529 PolarHBondContact O-N 2.67Å; E526-I529 VanDerWaalsContact O-N 3.1Å; E526-N530 VanDerWaalsContact O-CG 3.27Å; E526-N530 PolarHBondContact O-N 3.34Å; E526-N530 PolarHBondContact OE1-ND2 2.61Å
527	P	86.1	Confident	79	Confident	36 Å²	36	60.8 Å²	60.8	23%	0.234	30%	0.302	C	S	.	.	H	α-helix	trans	-59.3	-26.3	177.8	-26.1	37.2	0	0	0	114.9	F196 I525 N531	F196-P527 HydrophobicContact CD2-CB 4.05Å; F196-P527 HydrophobicContact CD2-CG 3.77Å; F196-P527 HydrophobicContact CE2-CB 4.41Å; F196-P527 HydrophobicContact CE2-CG 4.25Å; F196-P527 HydrophobicContact CG-CB 4.11Å; F196-P527 HydrophobicContact CG-CG 4.22Å; I525-P527 VanDerWaalsContact C-N 3.27Å; P527-N531 PolarHBondContact O-ND2 3.16Å
528	L	83.5	Confident	80.5	Confident	20 Å²	20	56.5 Å²	56.5	11%	0.105	28%	0.276	C	S	.	.	H	α-helix	trans	-82.3	-41.9	174.2	-68.9	173.9	0	0	0	111.6	F196 L337 V499 I525 E526 N530 N531 M535 I570	F196-L528 HydrophobicContact CE1-CD1 3.81Å; F196-L528 HydrophobicContact CE1-CD2 3.8Å; F196-L528 HydrophobicContact CE1-CG 3.53Å; F196-L528 HydrophobicContact CZ-CD1 3.53Å; F196-L528 HydrophobicContact CZ-CD2 4.27Å; F196-L528 HydrophobicContact CZ-CG 3.48Å; F196-L528 VanDerWaalsContact CZ-CG 3.48Å; L337-L528 HydrophobicContact CD2-CD1 4.49Å; V499-L528 HydrophobicContact CG2-CD2 4.01Å; I525-L528 PolarHBondContact O-N 2.84Å; E526-L528 PolarHBondContact O-N 3Å; E526-L528 VanDerWaalsContact O-N 3.13Å; L528-N530 VanDerWaalsContact C-N 3.34Å; L528-N530 PolarHBondContact O-N 3.43Å; L528-N531 PolarHBondContact O-N 3Å; L528-M535 HydrophobicContact CB-CE 4.08Å; L528-I570 HydrophobicContact CD1-CD1 3.64Å
529	I	77.2	Confident	81.7	Confident	19 Å²	19	58 Å²	58	10%	0.097	28%	0.28	C	S	.	.	H	α-helix	trans	-66.4	-37.8	-177.2	-60.8	170.9	0	0	0	110.9	I525 E526 N531 Y532 M535 F537	I525-I529 HydrophobicContact CD1-CD1 3.77Å; I525-I529 HydrophobicContact CD1-CG1 4.42Å; I525-I529 HydrophobicContact CG1-CD1 3.74Å; I525-I529 HydrophobicContact CG1-CG1 4.42Å; I525-I529 PolarHBondContact O-N 3.02Å; E526-I529 PolarHBondContact O-N 2.67Å; E526-I529 VanDerWaalsContact O-N 3.1Å; I529-N531 PolarHBondContact O-N 3.34Å; I529-N531 VanDerWaalsContact O-N 3.07Å; I529-Y532 CarbonylContact O-C 3.56Å; I529-Y532 PolarHBondContact O-N 3.26Å; I529-Y532 VanDerWaalsContact O-O 3.11Å; I529-M535 HydrophobicContact CB-CE 4.48Å; I529-M535 HydrophobicContact CG1-CE 3.77Å; I529-F537 HydrophobicContact CD1-CD2 3.68Å; I529-F537 HydrophobicContact CD1-CE2 3.43Å; I529-F537 VanDerWaalsContact CD1-CE2 3.43Å; I529-F537 HydrophobicContact CD1-CZ 4.41Å
530	N	78.9	Confident	82.6	Confident	99 Å²	99	55.2 Å²	55.2	53%	0.529	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-15.5	-178	-70.1	-8.4	0	0	0	113.6	E526 L528	E526-N530 VanDerWaalsContact O-CG 3.27Å; E526-N530 PolarHBondContact O-N 3.34Å; E526-N530 PolarHBondContact OE1-ND2 2.61Å; L528-N530 VanDerWaalsContact C-N 3.34Å; L528-N530 PolarHBondContact O-N 3.43Å
531	N	80.7	Confident	83.4	Confident	111 Å²	111	53.4 Å²	53.4	59%	0.594	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-13.7	173	-63.4	-34.6	0	0	0	112.9	P527 L528 I529	P527-N531 PolarHBondContact O-ND2 3.16Å; L528-N531 PolarHBondContact O-N 3Å; I529-N531 PolarHBondContact O-N 3.34Å; I529-N531 VanDerWaalsContact O-N 3.07Å
532	Y	82	Confident	84.4	Confident	27 Å²	27	51.6 Å²	51.6	11%	0.106	26%	0.257	C	S	.	.			trans	-152.3	91.8	-168.4	-63.8	-70.1	0	0	0	112.8	D341 V499 W505 I529 D534 M535	D341-Y532 WeakPolarHBondContact OD2-CE2 3.45Å; D341-Y532 VanDerWaalsContact OD2-CZ 3.25Å; D341-Y532 PolarHBondContact OD2-OH 3.49Å; V499-Y532 HydrophobicContact CG1-CD2 4.26Å; V499-Y532 HydrophobicContact CG1-CE2 4.08Å; W505-Y532 AromaticContact CH2-CD1 3.54Å; W505-Y532 HydrophobicContact CH2-CD1 3.54Å; W505-Y532 HydrophobicContact CH2-CE1 4.41Å; W505-Y532 AromaticContact CH2-CG 3.77Å; W505-Y532 HydrophobicContact CH2-CG 3.77Å; W505-Y532 HydrophobicContact CZ2-CD1 4.01Å; W505-Y532 HydrophobicContact CZ2-CG 4.1Å; I529-Y532 CarbonylContact O-C 3.56Å; I529-Y532 PolarHBondContact O-N 3.26Å; I529-Y532 VanDerWaalsContact O-O 3.11Å; Y532-D534 VanDerWaalsContact C-N 3.26Å; Y532-D534 PolarHBondContact O-N 3.27Å; Y532-M535 HydrophobicContact CD2-SD 4.42Å; Y532-M535 WeakPolarHBondContact O-CB 3.33Å; Y532-M535 PolarHBondContact O-N 3.25Å
533	D	74.8	Confident	85.1	Confident	137 Å²	137	48.5 Å²	48.5	73%	0.733	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-33.3	-176.2	-65.1	-36.6	0	0	0	114.6	R512	R512-D533 PolarHBondContact NH1-O 2.86Å; R512-D533 PolarHBondContact NH2-O 3.18Å
534	D	79.6	Confident	85.3	Confident	100 Å²	100	49.4 Å²	49.4	54%	0.535	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.1	3.1	-175.7	57.6	-41.1	0	0	0	114.1	W505 R512 Y532	W505-D534 HydrophobicContact CE3-CB 4.44Å; W505-D534 HydrophobicContact CZ3-CB 4.19Å; W505-D534 VanDerWaalsContact CZ3-OD1 3.29Å; W505-D534 WeakPolarHBondContact CZ3-OD1 3.43Å; W505-D534 WeakPolarHBondContact CZ3-OD2 3.49Å; R512-D534 VanDerWaalsContact NH2-CA 3.27Å; Y532-D534 VanDerWaalsContact C-N 3.26Å; Y532-D534 PolarHBondContact O-N 3.27Å
535	M	84.8	Confident	85.1	Confident	7 Å²	7	50.5 Å²	50.5	3%	0.034	26%	0.256	C	S	.	.			trans	-59.1	139	179.4	-168.3	-179.4	65.7	0	0	111.8	V499 W505 R512 L528 I529 Y532	V499-M535 HydrophobicContact CG1-SD 3.72Å; V499-M535 HydrophobicContact CG2-SD 4.15Å; W505-M535 HydrophobicContact CH2-CB 3.96Å; W505-M535 HydrophobicContact CH2-CG 4.42Å; W505-M535 HydrophobicContact CZ2-CB 3.98Å; W505-M535 HydrophobicContact CZ2-CG 3.93Å; W505-M535 HydrophobicContact CZ3-CB 4.32Å; R512-M535 PolarHBondContact NH2-O 2.85Å; L528-M535 HydrophobicContact CB-CE 4.08Å; I529-M535 HydrophobicContact CB-CE 4.48Å; I529-M535 HydrophobicContact CG1-CE 3.77Å; Y532-M535 HydrophobicContact CD2-SD 4.42Å; Y532-M535 WeakPolarHBondContact O-CB 3.33Å; Y532-M535 PolarHBondContact O-N 3.25Å
536	P	85.6	Confident	84.9	Confident	7 Å²	7	53.6 Å²	53.6	5%	0.045	28%	0.282	C	S	.	.			trans	-61.6	146.2	169.9	23.4	-30.8	0	0	0	110	P500 W505 F508 P538 Y572	P500-P536 HydrophobicContact CG-CG 4.39Å; W505-P536 HydrophobicContact CB-CG 4.22Å; W505-P536 HydrophobicContact CG-CG 4.05Å; F508-P536 HydrophobicContact CB-CB 3.69Å; F508-P536 HydrophobicContact CB-CG 4Å; F508-P536 HydrophobicContact CD2-CG 3.92Å; F508-P536 HydrophobicContact CG-CB 4.48Å; F508-P536 HydrophobicContact CG-CG 4.29Å; P536-P538 WeakPolarHBondContact O-CD 3.5Å; P536-Y572 HydrophobicContact CB-CD1 4.12Å; P536-Y572 HydrophobicContact CB-CE1 4.31Å; P536-Y572 HydrophobicContact CG-CD1 3.85Å; P536-Y572 HydrophobicContact CG-CE1 3.8Å; P536-Y572 WeakPolarHBondContact O-CE1 3.41Å
537	F	84.9	Confident	84.7	Confident	15 Å²	15	51.3 Å²	51.3	7%	0.066	28%	0.278	C	S	.	.			trans	-87.1	112	-174	-164	-85.1	0	0	0	110.7	N511 R522 I525 I529	N511-F537 HydrophobicContact CB-CB 4.42Å; R522-F537 HydrophobicContact CB-CE2 4.05Å; R522-F537 HydrophobicContact CB-CZ 3.68Å; R522-F537 HydrophobicContact CG-CE2 3.8Å; R522-F537 HydrophobicContact CG-CZ 3.98Å; I525-F537 HydrophobicContact CD1-CD1 4.09Å; I525-F537 HydrophobicContact CD1-CD2 4.15Å; I525-F537 HydrophobicContact CD1-CE1 3.71Å; I525-F537 HydrophobicContact CD1-CE2 3.78Å; I525-F537 HydrophobicContact CD1-CG 4.32Å; I525-F537 HydrophobicContact CD1-CZ 3.57Å; I525-F537 HydrophobicContact CG1-CE2 4.38Å; I525-F537 HydrophobicContact CG1-CZ 4.16Å; I529-F537 HydrophobicContact CD1-CD2 3.68Å; I529-F537 HydrophobicContact CD1-CE2 3.43Å; I529-F537 VanDerWaalsContact CD1-CE2 3.43Å; I529-F537 HydrophobicContact CD1-CZ 4.41Å
538	P	89.1	Confident	84.3	Confident	1 Å²	1	52 Å²	52	1%	0.006	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-81.5	163.9	178.6	34.5	-37	0	0	0	112.6	I525 P536 I570 V571 Y572	I525-P538 HydrophobicContact CD1-CG 3.81Å; P536-P538 WeakPolarHBondContact O-CD 3.5Å; P538-I570 HydrophobicContact CB-CB 4.01Å; P538-I570 HydrophobicContact CB-CD1 4.18Å; P538-I570 HydrophobicContact CG-CB 4.28Å; P538-I570 HydrophobicContact CG-CD1 3.91Å; P538-V571 CarbonylContact C-O 3.49Å; P538-V571 WeakPolarHBondContact CA-O 3.36Å; P538-Y572 HydrophobicContact CB-CD1 4.05Å; P538-Y572 HydrophobicContact CB-CD2 4.25Å; P538-Y572 HydrophobicContact CB-CE1 3.81Å; P538-Y572 HydrophobicContact CB-CE2 4.01Å; P538-Y572 HydrophobicContact CB-CG 4.26Å; P538-Y572 HydrophobicContact CG-CE1 4.13Å
539	F	88.7	Confident	84.5	Confident	54 Å²	54	53.8 Å²	53.8	24%	0.237	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	141	171.1	-56	-79.6	0	0	0	110.6	N511 I570 V571 S573	N511-F539 HydrophobicContact CB-CE1 4.47Å; N511-F539 HydrophobicContact CB-CZ 3.7Å; N511-F539 WeakPolarHBondContact ND2-CZ 3.36Å; F539-I570 CarbonylContact O-C 3.54Å; F539-I570 VanDerWaalsContact O-CA 3.28Å; F539-I570 WeakPolarHBondContact O-CA 3.39Å; F539-V571 PolarHBondContact N-O 3.44Å; F539-V571 PolarHBondContact O-N 2.93Å; F539-S573 WeakPolarHBondContact CE2-OG 3.28Å
540	V	90.9	Very high	85	Confident	21 Å²	21	53.4 Å²	53.4	13%	0.127	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	123.8	166.8	-176.1	0	0	0	0	108.4	P192 V194 I524 I525 H568 T569 I570	P192-V540 HydrophobicContact CG-CB 4.5Å; P192-V540 HydrophobicContact CG-CG1 3.74Å; V194-V540 HydrophobicContact CG2-CG1 3.87Å; I524-V540 HydrophobicContact CG2-CG2 3.95Å; I525-V540 HydrophobicContact CG2-CG2 3.77Å; V540-H568 HydrophobicContact CG1-CB 3.87Å; V540-T569 WeakPolarHBondContact CA-O 3.5Å; V540-I570 HydrophobicContact CG2-CG2 4.17Å
541	Q	92.2	Very high	85.5	Confident	83 Å²	83	50.8 Å²	50.8	39%	0.388	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	148.4	-179.3	-171.7	173.1	-16.9	0	0	110.7	P458 H568 T569 V571	P458-Q541 HydrophobicContact CB-CG 4.34Å; P458-Q541 HydrophobicContact CG-CG 4.27Å; Q541-H568 CarbonylContact O-C 3.57Å; Q541-H568 WeakPolarHBondContact O-CA 3.37Å; Q541-T569 PolarHBondContact N-O 2.97Å; Q541-T569 PolarHBondContact O-N 3.26Å; Q541-V571 HydrophobicContact CB-CG2 4.02Å
542	E	93.9	Very high	85.7	Confident	86 Å²	86	47.9 Å²	47.9	40%	0.402	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.4	138.6	170.1	-67.8	-169.9	158	0	0	111.2	P458 K566	P458-E542 WeakPolarHBondContact CB-O 3.37Å; E542-K566 WeakPolarHBondContact OE2-CD 3.42Å; E542-K566 IonicContact OE2-NZ 3.76Å; E542-K566 PolarHBondContact OE2-NZ 2.96Å; E542-K566 VanDerWaalsContact OE2-NZ 3.08Å
543	Q	93	Very high	85.6	Confident	8 Å²	8	54 Å²	54	4%	0.037	29%	0.287	C	S	.	.			trans	-65.7	147.1	171	-66.9	177.7	11.6	0	0	110.8	P458 T545 P567 H568 T569	P458-Q543 CarbonylContact O-C 3.51Å; P458-Q543 VanDerWaalsContact O-CA 3.32Å; P458-Q543 WeakPolarHBondContact O-CA 2.84Å; Q543-T545 PolarHBondContact O-N 2.81Å; Q543-P567 WeakPolarHBondContact CB-O 3.23Å; Q543-P567 HydrophobicContact CG-CB 4.43Å; Q543-P567 WeakPolarHBondContact CG-O 3.38Å; Q543-P567 PolarHBondContact N-O 2.74Å; Q543-H568 PolarHBondContact NE2-O 2.86Å; Q543-T569 HydrophobicContact CG-CG2 3.91Å
544	H	86.3	Confident	86	Confident	112 Å²	112	55.3 Å²	55.3	52%	0.519	29%	0.289	S	S	.	.	S	Bend	trans	-75.3	64.3	176.4	-74.4	-166.3	0	0	0	111.9	K427 P458	K427-H544 PolarHBondContact NZ-O 3.16Å; P458-H544 PolarHBondContact O-N 3.12Å
545	T	83.7	Confident	86.3	Confident	25 Å²	25	52.1 Å²	52.1	15%	0.153	27%	0.27	C	S	.	.	S	Bend	trans	-123.9	156.1	174.4	-162.8	0	0	0	0	111	E301 Q543 K566	E301-T545 HydrophobicContact CB-CG2 4.22Å; E301-T545 PolarHBondContact O-OG1 2.91Å; Q543-T545 PolarHBondContact O-N 2.81Å; T545-K566 HydrophobicContact CG2-CG 4.3Å; T545-K566 WeakPolarHBondContact O-CE 3.41Å
546	A	81.8	Confident	86.3	Confident	66 Å²	66	55.7 Å²	55.7	55%	0.545	29%	0.289	S	S	.	.			trans	-73.3	133.7	175.9	0	0	0	0	0	108.7
547	A	80.9	Confident	86.2	Confident	43 Å²	43	60.7 Å²	60.7	36%	0.355	32%	0.319	S	S	.	.			trans	-67.6	138.2	170.3	0	0	0	0	0	109.4	Y564 K566	A547-Y564 HydrophobicContact CB-CD1 4.14Å; A547-Y564 HydrophobicContact CB-CG 4.44Å; A547-K566 HydrophobicContact CB-CD 4.48Å; A547-K566 HydrophobicContact CB-CG 4.01Å
548	Q	78.1	Confident	86.2	Confident	52 Å²	52	64.1 Å²	64.1	24%	0.243	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	150.5	175.6	-62.1	-176.8	12.3	0	0	109	N303 I550	N303-Q548 PolarHBondContact OD1-NE2 2.94Å; Q548-I550 WeakPolarHBondContact O-CG2 3.47Å; Q548-I550 PolarHBondContact O-N 2.83Å
549	D	87.1	Confident	86.1	Confident	57 Å²	57	64.7 Å²	64.7	31%	0.305	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	120.6	168.8	-173.1	1.1	0	0	0	108.4	R551 P562 I563 Y564	D549-R551 WeakPolarHBondContact OD1-CG 3.48Å; D549-R551 PolarHBondContact OD1-N 2.78Å; D549-R551 IonicContact OD1-NE 3.24Å; D549-R551 PolarHBondContact OD1-NE 3.35Å; D549-R551 VanDerWaalsContact OD1-NE 3.1Å; D549-R551 IonicContact OD2-CZ 3.62Å; D549-R551 VanDerWaalsContact OD2-CZ 3.24Å; D549-R551 IonicContact OD2-NE 2.59Å; D549-R551 PolarHBondContact OD2-NE 3.18Å; D549-R551 IonicContact OD2-NH2 3.05Å; D549-R551 PolarHBondContact OD2-NH2 3.36Å; D549-P562 HydrophobicContact CB-CB 4.5Å; D549-I563 WeakPolarHBondContact CA-O 3.27Å; D549-I563 PolarHBondContact OD1-N 2.86Å; D549-I563 VanDerWaalsContact OD1-N 3.11Å; D549-Y564 HydrophobicContact CB-CE1 4.31Å
550	I	88.6	Confident	85.7	Confident	10 Å²	10	67 Å²	67	5%	0.051	36%	0.359	C	S	.	.			trans	-94.9	-1.1	-172	63.9	88.5	0	0	0	113.3	K331 L333 Q548 I563	K331-I550 HydrophobicContact CD-CD1 4.19Å; L333-I550 HydrophobicContact CD1-CD1 3.22Å; L333-I550 HydrophobicContact CD1-CG1 3.68Å; L333-I550 HydrophobicContact CD2-CD1 4.06Å; L333-I550 HydrophobicContact CD2-CG1 4.05Å; L333-I550 HydrophobicContact CG-CD1 4.25Å; Q548-I550 WeakPolarHBondContact O-CG2 3.47Å; Q548-I550 PolarHBondContact O-N 2.83Å; I550-I563 HydrophobicContact CD1-CB 4.12Å; I550-I563 HydrophobicContact CD1-CG2 3.88Å; I550-I563 HydrophobicContact CG1-CB 3.9Å; I550-I563 HydrophobicContact CG1-CG2 3.69Å; I550-I563 VanDerWaalsContact CG1-O 3.3Å; I550-I563 WeakPolarHBondContact CG1-O 3.49Å; I550-I563 PolarHBondContact N-O 2.84Å
551	R	89.2	Confident	85.5	Confident	44 Å²	44	72.9 Å²	72.9	17%	0.166	39%	0.385	C	S	.	.			trans	-65.2	138	176.4	-64.5	177.3	-61.5	171.2	-1.8	110.6	D549 E555 L556 L559 P560 E561 P562 I563	D549-R551 WeakPolarHBondContact OD1-CG 3.48Å; D549-R551 PolarHBondContact OD1-N 2.78Å; D549-R551 IonicContact OD1-NE 3.24Å; D549-R551 PolarHBondContact OD1-NE 3.35Å; D549-R551 VanDerWaalsContact OD1-NE 3.1Å; D549-R551 IonicContact OD2-CZ 3.62Å; D549-R551 VanDerWaalsContact OD2-CZ 3.24Å; D549-R551 IonicContact OD2-NE 2.59Å; D549-R551 PolarHBondContact OD2-NE 3.18Å; D549-R551 IonicContact OD2-NH2 3.05Å; D549-R551 PolarHBondContact OD2-NH2 3.36Å; R551-E555 HydrophobicContact CB-CB 4.45Å; R551-L556 HydrophobicContact CB-CD2 4.12Å; R551-L556 VanDerWaalsContact CZ-CD2 3.41Å; R551-L559 VanDerWaalsContact CD-O 3.29Å; R551-L559 WeakPolarHBondContact CD-O 3.46Å; R551-L559 PolarHBondContact NH1-O 3.32Å; R551-P560 PolarHBondContact NH1-O 3.48Å; R551-E561 WeakPolarHBondContact CD-O 3.32Å; R551-E561 PolarHBondContact NE-O 3.29Å; R551-E561 PolarHBondContact NH1-O 2.7Å; R551-P562 VanDerWaalsContact CZ-CA 3.47Å; R551-I563 HydrophobicContact CG-CB 4.37Å; R551-I563 HydrophobicContact CG-CD1 4.1Å; R551-I563 HydrophobicContact CG-CG1 4.14Å
552	S	83.8	Confident	85.3	Confident	50 Å²	50	71.3 Å²	71.3	35%	0.35	38%	0.382	S	S	.	.			trans	-77.4	160.4	165.9	63.8	0	0	0	0	111	H554 E555 L556	S552-H554 PolarHBondContact O-N 2.95Å; S552-E555 WeakPolarHBondContact CB-OE2 3.44Å; S552-E555 PolarHBondContact N-OE2 2.86Å; S552-E555 PolarHBondContact O-N 2.85Å; S552-E555 VanDerWaalsContact OG-CD 3.28Å; S552-E555 VanDerWaalsContact OG-CG 3.23Å; S552-E555 WeakPolarHBondContact OG-CG 3.45Å; S552-E555 PolarHBondContact OG-N 2.84Å; S552-E555 PolarHBondContact OG-OE2 2.87Å; S552-L556 PolarHBondContact O-N 2.92Å
553	E	81.3	Confident	85.2	Confident	156 Å²	156	68.9 Å²	68.9	73%	0.729	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-35.2	177.2	-68.1	-176.3	175.5	0	0	112.4	E555 L556	E553-E555 VanDerWaalsContact C-N 3.32Å; E553-E555 PolarHBondContact O-N 2.76Å; E553-L556 PolarHBondContact O-N 3.38Å
554	H	81.9	Confident	85.1	Confident	165 Å²	165	75.9 Å²	75.9	76%	0.764	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-24.1	176.9	-58.4	-55	0	0	0	113.5	S552 T557	S552-H554 PolarHBondContact O-N 2.95Å; H554-T557 PolarHBondContact O-OG1 2.87Å
555	E	86.7	Confident	85.3	Confident	33 Å²	33	71.3 Å²	71.3	15%	0.154	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-20.1	178.9	-75.8	167.7	136.5	0	0	112.3	K331 R551 S552 E553 T557 H558 L559	K331-E555 WeakPolarHBondContact CD-OE1 3.45Å; K331-E555 IonicContact NZ-OE1 3.84Å; K331-E555 PolarHBondContact NZ-OE1 2.82Å; K331-E555 IonicContact NZ-OE2 3.79Å; K331-E555 PolarHBondContact NZ-OE2 2.79Å; R551-E555 HydrophobicContact CB-CB 4.45Å; S552-E555 WeakPolarHBondContact CB-OE2 3.44Å; S552-E555 PolarHBondContact N-OE2 2.86Å; S552-E555 PolarHBondContact O-N 2.85Å; S552-E555 VanDerWaalsContact OG-CD 3.28Å; S552-E555 VanDerWaalsContact OG-CG 3.23Å; S552-E555 WeakPolarHBondContact OG-CG 3.45Å; S552-E555 PolarHBondContact OG-N 2.84Å; S552-E555 PolarHBondContact OG-OE2 2.87Å; E553-E555 VanDerWaalsContact C-N 3.32Å; E553-E555 PolarHBondContact O-N 2.76Å; E555-T557 PolarHBondContact O-N 3.01Å; E555-T557 VanDerWaalsContact O-N 3.14Å; E555-H558 PolarHBondContact O-N 2.99Å; E555-L559 HydrophobicContact CB-CD1 4.19Å; E555-L559 HydrophobicContact CG-CD1 4.47Å; E555-L559 PolarHBondContact O-N 2.96Å
556	L	85.7	Confident	85.8	Confident	82 Å²	82	73 Å²	73	43%	0.429	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-29.1	-177.2	-67	175.7	0	0	0	113.5	R551 S552 E553 H558	R551-L556 HydrophobicContact CB-CD2 4.12Å; R551-L556 VanDerWaalsContact CZ-CD2 3.41Å; S552-L556 PolarHBondContact O-N 2.92Å; E553-L556 PolarHBondContact O-N 3.38Å; L556-H558 VanDerWaalsContact C-N 3.33Å
557	T	83.2	Confident	86.5	Confident	111 Å²	111	69.9 Å²	69.9	68%	0.681	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-25	177.9	52.5	0	0	0	0	113.2	H554 E555	H554-T557 PolarHBondContact O-OG1 2.87Å; E555-T557 PolarHBondContact O-N 3.01Å; E555-T557 VanDerWaalsContact O-N 3.14Å
558	H	83.4	Confident	87.1	Confident	87 Å²	87	69.2 Å²	69.2	40%	0.403	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.7	-24.1	-175.7	-61.9	-67.8	0	0	0	113.3	I329 E555 L556	I329-H558 HydrophobicContact CB-CB 4.31Å; I329-H558 HydrophobicContact CD1-CB 3.7Å; I329-H558 HydrophobicContact CG1-CB 4.1Å; E555-H558 PolarHBondContact O-N 2.99Å; L556-H558 VanDerWaalsContact C-N 3.33Å
559	L	87.4	Confident	87.9	Confident	14 Å²	14	66.8 Å²	66.8	7%	0.073	33%	0.334	C	S	.	.			trans	-119.9	87.3	178.6	-62.3	176.8	0	0	0	107.7	I329 K331 R551 E555 I563	I329-L559 HydrophobicContact CB-CD2 4.2Å; I329-L559 HydrophobicContact CG2-CD2 4.22Å; I329-L559 WeakPolarHBondContact O-CD2 3.31Å; K331-L559 HydrophobicContact CB-CD1 3.87Å; K331-L559 HydrophobicContact CD-CD1 4.32Å; R551-L559 VanDerWaalsContact CD-O 3.29Å; R551-L559 WeakPolarHBondContact CD-O 3.46Å; R551-L559 PolarHBondContact NH1-O 3.32Å; E555-L559 HydrophobicContact CB-CD1 4.19Å; E555-L559 HydrophobicContact CG-CD1 4.47Å; E555-L559 PolarHBondContact O-N 2.96Å; L559-I563 HydrophobicContact CD1-CD1 3.95Å
560	P	80.3	Confident	88.2	Confident	103 Å²	103	64.1 Å²	64.1	67%	0.669	32%	0.32	S	S	*	.			trans	-72.9	-30.2	-173	27.4	-34.5	0	0	0	113.5	R551	R551-P560 PolarHBondContact NH1-O 3.48Å
561	E	87	Confident	88.4	Confident	143 Å²	143	64.3 Å²	64.3	67%	0.668	32%	0.322	S	S	*	.	S	Bend	trans	-83.1	138.7	178.5	-64.8	-56.2	136.8	0	0	111.8	R551	R551-E561 WeakPolarHBondContact CD-O 3.32Å; R551-E561 PolarHBondContact NE-O 3.29Å; R551-E561 PolarHBondContact NH1-O 2.7Å
562	P	89.1	Confident	88.6	Confident	51 Å²	51	62.3 Å²	62.3	33%	0.331	31%	0.314	S	S	.	.			trans	-64.2	140	177.6	27.6	-33.8	0	0	0	111.9	D549 R551 Y564	D549-P562 HydrophobicContact CB-CB 4.5Å; R551-P562 VanDerWaalsContact CZ-CA 3.47Å; P562-Y564 HydrophobicContact CB-CD2 4.44Å; P562-Y564 HydrophobicContact CB-CE2 3.82Å; P562-Y564 HydrophobicContact CG-CE2 3.82Å
563	I	90.1	Very high	88.8	Confident	34 Å²	34	61.9 Å²	61.9	17%	0.174	31%	0.311	C	S	.	.			trans	-108.9	101.3	177.8	-57.8	174.9	0	0	0	108	K331 L333 D549 I550 R551 L559	K331-I563 HydrophobicContact CB-CD1 4.04Å; L333-I563 HydrophobicContact CD1-CG2 3.87Å; D549-I563 WeakPolarHBondContact CA-O 3.27Å; D549-I563 PolarHBondContact OD1-N 2.86Å; D549-I563 VanDerWaalsContact OD1-N 3.11Å; I550-I563 HydrophobicContact CD1-CB 4.12Å; I550-I563 HydrophobicContact CD1-CG2 3.88Å; I550-I563 HydrophobicContact CG1-CB 3.9Å; I550-I563 HydrophobicContact CG1-CG2 3.69Å; I550-I563 VanDerWaalsContact CG1-O 3.3Å; I550-I563 WeakPolarHBondContact CG1-O 3.49Å; I550-I563 PolarHBondContact N-O 2.84Å; R551-I563 HydrophobicContact CG-CB 4.37Å; R551-I563 HydrophobicContact CG-CD1 4.1Å; R551-I563 HydrophobicContact CG-CG1 4.14Å; L559-I563 HydrophobicContact CD1-CD1 3.95Å
564	Y	91	Very high	89	Confident	155 Å²	155	55.6 Å²	55.6	61%	0.608	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.9	129.5	175.6	-66.7	-65	0	0	0	110.8	A547 D549 P562	A547-Y564 HydrophobicContact CB-CD1 4.14Å; A547-Y564 HydrophobicContact CB-CG 4.44Å; D549-Y564 HydrophobicContact CB-CE1 4.31Å; P562-Y564 HydrophobicContact CB-CD2 4.44Å; P562-Y564 HydrophobicContact CB-CE2 3.82Å; P562-Y564 HydrophobicContact CG-CE2 3.82Å
565	Y	91.9	Very high	88.8	Confident	17 Å²	17	53 Å²	53	7%	0.067	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	139.6	178	172.9	-115.7	0	0	0	111.5	E301 L333 F334 T335 P567	E301-Y565 HydrophobicContact CG-CD1 3.89Å; E301-Y565 HydrophobicContact CG-CE1 4Å; L333-Y565 HydrophobicContact CB-CD2 3.58Å; L333-Y565 HydrophobicContact CB-CE2 3.92Å; L333-Y565 HydrophobicContact CB-CG 3.93Å; L333-Y565 HydrophobicContact CD2-CD1 3.57Å; L333-Y565 HydrophobicContact CD2-CD2 4.12Å; L333-Y565 HydrophobicContact CD2-CE1 4.12Å; L333-Y565 HydrophobicContact CD2-CG 3.57Å; L333-Y565 HydrophobicContact CG-CD2 4.43Å; L333-Y565 HydrophobicContact CG-CG 4.3Å; F334-Y565 PolarHBondContact O-OH 2.86Å; T335-Y565 PolarHBondContact OG1-OH 2.78Å; T335-Y565 VanDerWaalsContact OG1-OH 3.1Å; Y565-P567 HydrophobicContact CE1-CB 4.41Å; Y565-P567 HydrophobicContact CE1-CG 3.69Å; Y565-P567 WeakPolarHBondContact OH-CA 3.34Å
566	K	93.3	Very high	87.4	Confident	61 Å²	61	59.5 Å²	59.5	27%	0.265	31%	0.305	S	S	.	.			trans	-133.1	127.7	164.7	-68.7	-177.9	-167.1	164.3	0	109.1	E542 T545 A547 H568	E542-K566 WeakPolarHBondContact OE2-CD 3.42Å; E542-K566 IonicContact OE2-NZ 3.76Å; E542-K566 PolarHBondContact OE2-NZ 2.96Å; E542-K566 VanDerWaalsContact OE2-NZ 3.08Å; T545-K566 HydrophobicContact CG2-CG 4.3Å; T545-K566 WeakPolarHBondContact O-CE 3.41Å; A547-K566 HydrophobicContact CB-CD 4.48Å; A547-K566 HydrophobicContact CB-CG 4.01Å; K566-H568 PolarHBondContact O-ND1 3.47Å
567	P	95.7	Very high	85.5	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	33%	0.331	C	S	.	.			trans	-62.6	148	173.5	-19.2	29.9	0	0	0	110.8	E301 T335 Q543 Y565	E301-P567 HydrophobicContact CB-CG 4.18Å; E301-P567 HydrophobicContact CG-CG 3.65Å; T335-P567 HydrophobicContact CG2-CB 4.3Å; Q543-P567 WeakPolarHBondContact CB-O 3.23Å; Q543-P567 HydrophobicContact CG-CB 4.43Å; Q543-P567 WeakPolarHBondContact CG-O 3.38Å; Q543-P567 PolarHBondContact N-O 2.74Å; Y565-P567 HydrophobicContact CE1-CB 4.41Å; Y565-P567 HydrophobicContact CE1-CG 3.69Å; Y565-P567 WeakPolarHBondContact OH-CA 3.34Å
568	H	94.8	Very high	83.2	Confident	28 Å²	28	58.5 Å²	58.5	13%	0.13	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	159.6	170.1	-68.1	63.9	0	0	0	110.6	P192 V194 T335 V540 Q541 Q543 K566	P192-H568 WeakPolarHBondContact CB-NE2 3.25Å; V194-H568 HydrophobicContact CG2-CB 3.63Å; T335-H568 HydrophobicContact CG2-CB 4.25Å; T335-H568 WeakPolarHBondContact CG2-O 3.44Å; T335-H568 PolarHBondContact OG1-N 3.35Å; V540-H568 HydrophobicContact CG1-CB 3.87Å; Q541-H568 CarbonylContact O-C 3.57Å; Q541-H568 WeakPolarHBondContact O-CA 3.37Å; Q543-H568 PolarHBondContact NE2-O 2.86Å; K566-H568 PolarHBondContact O-ND1 3.47Å
569	T	94.7	Very high	80.8	Confident	1 Å²	1	64.4 Å²	64.4	1%	0.006	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	173.3	171.4	-165.9	0	0	0	0	108.6	P458 T459 V540 Q541 Q543 V571	P458-T569 HydrophobicContact CB-CG2 4.03Å; T459-T569 PolarHBondContact O-OG1 3.25Å; T459-T569 VanDerWaalsContact O-OG1 3.11Å; V540-T569 WeakPolarHBondContact CA-O 3.5Å; Q541-T569 PolarHBondContact N-O 2.97Å; Q541-T569 PolarHBondContact O-N 3.26Å; Q543-T569 HydrophobicContact CG-CG2 3.91Å; T569-V571 HydrophobicContact CG2-CG2 4.12Å
570	I	92.4	Very high	78	Confident	1 Å²	1	72.5 Å²	72.5	1%	0.005	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	142	173.2	58.4	158.1	0	0	0	111.5	L337 P378 V498 I525 L528 P538 F539 V540 Y572	L337-I570 HydrophobicContact CD2-CB 4.5Å; L337-I570 HydrophobicContact CD2-CG1 4.31Å; L337-I570 HydrophobicContact CD2-CG2 3.54Å; P378-I570 WeakPolarHBondContact CB-O 3.22Å; P378-I570 WeakPolarHBondContact CG-O 3.28Å; V498-I570 HydrophobicContact CB-CD1 3.96Å; V498-I570 HydrophobicContact CB-CG1 4.16Å; V498-I570 HydrophobicContact CG1-CG1 4.18Å; V498-I570 WeakPolarHBondContact O-CD1 3.49Å; I525-I570 HydrophobicContact CG2-CG2 3.96Å; L528-I570 HydrophobicContact CD1-CD1 3.64Å; P538-I570 HydrophobicContact CB-CB 4.01Å; P538-I570 HydrophobicContact CB-CD1 4.18Å; P538-I570 HydrophobicContact CG-CB 4.28Å; P538-I570 HydrophobicContact CG-CD1 3.91Å; F539-I570 CarbonylContact O-C 3.54Å; F539-I570 VanDerWaalsContact O-CA 3.28Å; F539-I570 WeakPolarHBondContact O-CA 3.39Å; V540-I570 HydrophobicContact CG2-CG2 4.17Å; I570-Y572 HydrophobicContact CD1-CE2 4.18Å
571	V	93.5	Very high	75.3	Confident	14 Å²	14	71.2 Å²	71.2	9%	0.085	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	131.9	-173.7	-171.2	0	0	0	0	109.6	P378 P458 P538 F539 Q541 T569	P378-V571 HydrophobicContact CB-CB 4.39Å; P378-V571 HydrophobicContact CB-CG1 4.3Å; P378-V571 HydrophobicContact CB-CG2 4.06Å; P458-V571 HydrophobicContact CB-CG2 3.74Å; P458-V571 HydrophobicContact CG-CG2 3.9Å; P538-V571 CarbonylContact C-O 3.49Å; P538-V571 WeakPolarHBondContact CA-O 3.36Å; F539-V571 PolarHBondContact N-O 3.44Å; F539-V571 PolarHBondContact O-N 2.93Å; Q541-V571 HydrophobicContact CB-CG2 4.02Å; T569-V571 HydrophobicContact CG2-CG2 4.12Å
572	Y	92.4	Very high	72.3	Confident	2 Å²	2	68.9 Å²	68.9	1%	0.008	40%	0.399	C	S	.	.			trans	-94.7	139.6	177.2	-66.9	-94.9	0	0	0	110.9	V377 P378 G379 V498 P500 F508 P536 P538 I570 P574	V377-Y572 HydrophobicContact CB-CD2 3.93Å; V377-Y572 HydrophobicContact CB-CE2 4.08Å; V377-Y572 HydrophobicContact CG1-CE2 4.39Å; V377-Y572 HydrophobicContact CG2-CD2 3.46Å; V377-Y572 VanDerWaalsContact CG2-CD2 3.46Å; V377-Y572 HydrophobicContact CG2-CE2 3.95Å; V377-Y572 HydrophobicContact CG2-CG 4.15Å; P378-Y572 PolarHBondContact O-N 3.37Å; G379-Y572 VanDerWaalsContact CA-O 3.29Å; G379-Y572 WeakPolarHBondContact CA-O 3.21Å; V498-Y572 VanDerWaalsContact O-CE2 3.23Å; V498-Y572 WeakPolarHBondContact O-CE2 3.45Å; V498-Y572 PolarHBondContact O-OH 3.38Å; P500-Y572 VanDerWaalsContact CD-OH 3.29Å; P500-Y572 WeakPolarHBondContact CD-OH 3.39Å; P500-Y572 HydrophobicContact CG-CD1 4.32Å; P500-Y572 HydrophobicContact CG-CE1 3.99Å; P500-Y572 HydrophobicContact CG-CE2 4.26Å; F508-Y572 HydrophobicContact CD1-CG 4.27Å; F508-Y572 HydrophobicContact CE1-CG 4.35Å; F508-Y572 HydrophobicContact CG-CD1 4.38Å; P536-Y572 HydrophobicContact CB-CD1 4.12Å; P536-Y572 HydrophobicContact CB-CE1 4.31Å; P536-Y572 HydrophobicContact CG-CD1 3.85Å; P536-Y572 HydrophobicContact CG-CE1 3.8Å; P536-Y572 WeakPolarHBondContact O-CE1 3.41Å; P538-Y572 HydrophobicContact CB-CD1 4.05Å; P538-Y572 HydrophobicContact CB-CD2 4.25Å; P538-Y572 HydrophobicContact CB-CE1 3.81Å; P538-Y572 HydrophobicContact CB-CE2 4.01Å; P538-Y572 HydrophobicContact CB-CG 4.26Å; P538-Y572 HydrophobicContact CG-CE1 4.13Å; I570-Y572 HydrophobicContact CD1-CE2 4.18Å; Y572-P574 WeakPolarHBondContact O-CD 3.28Å
573	S	89.3	Confident	69.4	Low	41 Å²	41	76 Å²	76	29%	0.287	42%	0.424	S	S	.	.			trans	-90.2	114	174.7	-69.2	0	0	0	0	109.6	F508 M509 F539	F508-S573 CarbonylContact C-O 3.42Å; F508-S573 WeakPolarHBondContact CA-O 3.3Å; M509-S573 PolarHBondContact N-O 3.5Å; F539-S573 WeakPolarHBondContact CE2-OG 3.28Å
574	P	84.4	Confident	66.2	Low	25 Å²	25	83.5 Å²	83.5	16%	0.162	46%	0.459	C	S	.	.	B	Isolated β-bridge	trans	-66.4	151.5	172.3	28.7	-33.1	0	0	0	109.8	G379 Y381 L507 Y572 M576	G379-P574 WeakPolarHBondContact O-CD 3.18Å; Y381-P574 HydrophobicContact CD2-CG 4.5Å; Y381-P574 HydrophobicContact CE2-CB 4.32Å; Y381-P574 HydrophobicContact CE2-CG 3.93Å; L507-P574 WeakPolarHBondContact O-CA 3.44Å; Y572-P574 WeakPolarHBondContact O-CD 3.28Å; P574-M576 PolarHBondContact O-N 3.37Å
575	H	78.9	Confident	63	Low	110 Å²	110	83 Å²	83	51%	0.509	47%	0.467	S	S	.	.			trans	-57.2	115.2	168	-84	-73.1	0	0	0	109.1	P506 L507 F508 A577	P506-H575 PolarHBondContact O-CD2 2.85Å; L507-H575 PolarHBondContact O-N 3.27Å; F508-H575 PolarHBondContact O-CD2 3.14Å; F508-H575 PolarHBondContact O-NE2 2.73Å; H575-A577 PolarHBondContact O-N 2.9Å
576	M	57.6	Low	59.7	Low	170 Å²	170	88.1 Å²	88.1	84%	0.837	50%	0.502	S	S	*	.			trans	-60.3	124.6	170.2	-69.3	-157.9	-166.9	0	0	108.1	P574 G578	P574-M576 PolarHBondContact O-N 3.37Å; M576-G578 PolarHBondContact O-N 2.73Å
577	A	45	Very low	56.6	Low	119 Å²	119	91.4 Å²	91.4	98%	0.983	53%	0.527	S	S	*	.	S	Bend	trans	-68.9	71.9	163.8	0	0	0	0	0	108.6	H575	H575-A577 PolarHBondContact O-N 2.9Å
578	G	35	Very low	53.2	Low	52 Å²	52	98.3 Å²	98.3	54%	0.536	57%	0.57	S	S	.	*	S	Bend	trans	-163.2	113.6	-176.4	0	0	0	0	0	111.7	M576	M576-G578 PolarHBondContact O-N 2.73Å
579	K	32	Very low	49.9	Very low	211 Å²	211	100.5 Å²	100.5	92%	0.917	60%	0.6	S	S	*	*			trans	81	18.8	162.8	-56.1	-175.8	176.7	179.3	0	120.2	G581	K579-G581 PolarHBondContact O-N 3.18Å; K579-G581 VanDerWaalsContact O-N 3.14Å
580	M	28.7	Very low	46.6	Very low	185 Å²	185	103.1 Å²	103.1	91%	0.911	63%	0.627	S	S	*	*	S	Bend	trans	-67.4	116	148.9	-84.6	-146.4	-76.7	0	0	106.8	A582	M580-A582 VanDerWaalsContact C-N 3.35Å; M580-A582 PolarHBondContact O-N 3.28Å
581	G	23.5	Very low	43.3	Very low	76 Å²	76	110.9 Å²	110.9	78%	0.784	67%	0.667	S	S	*	*			trans	-42.9	93.1	-170.7	0	0	0	0	0	112.7	K579 K583	K579-G581 PolarHBondContact O-N 3.18Å; K579-G581 VanDerWaalsContact O-N 3.14Å; G581-K583 VanDerWaalsContact C-N 3.27Å; G581-K583 PolarHBondContact O-N 2.72Å
582	A	25.8	Very low	40.2	Very low	93 Å²	93	118.3 Å²	118.3	77%	0.769	70%	0.699	S	S	*	*			trans	-68.6	98.3	167.4	0	0	0	0	0	105.3	M580 Q584	M580-A582 VanDerWaalsContact C-N 3.35Å; M580-A582 PolarHBondContact O-N 3.28Å; A582-Q584 PolarHBondContact O-N 2.87Å; A582-Q584 VanDerWaalsContact O-N 3.13Å
583	K	26.9	Very low	36.9	Very low	200 Å²	200	125 Å²	125	87%	0.87	74%	0.735	S	S	*	*			trans	-36.3	121.3	149.8	-75.1	-180	174.8	178.9	0	106.9	G581 N585	G581-K583 VanDerWaalsContact C-N 3.27Å; G581-K583 PolarHBondContact O-N 2.72Å; K583-N585 PolarHBondContact O-N 3.29Å
584	Q	22.6	Very low	34.1	Very low	192 Å²	192	129.9 Å²	129.9	90%	0.897	76%	0.757	S	S	*	*	S	Bend	trans	-32.1	107.6	-178.6	-67.5	169.1	-9.6	0	0	111.6	A582	A582-Q584 PolarHBondContact O-N 2.87Å; A582-Q584 VanDerWaalsContact O-N 3.13Å
585	N	24.3	Very low	31.3	Very low	145 Å²	145	137.1 Å²	137.1	78%	0.775	79%	0.788	S	S	*	*			trans	-134.5	110	154.1	-124.7	-17.5	0	0	0	106.2	K583 V587	K583-N585 PolarHBondContact O-N 3.29Å; N585-V587 PolarHBondContact O-N 2.92Å
586	P	23.1	Very low	29	Very low	124 Å²	124	143.3 Å²	143.3	81%	0.805	81%	0.807	S	S	*	*			trans	-78.6	92.6	-169.6	30.9	-31.7	0	0	0	109.2
587	V	28.2	Very low	27.5	Very low	130 Å²	130	146.6 Å²	146.6	79%	0.788	81%	0.81	S	S	*	*			trans	-121.2	120.9	159.3	-175.1	0	0	0	0	107.4	N585 G589	N585-V587 PolarHBondContact O-N 2.92Å; V587-G589 PolarHBondContact O-N 2.82Å
588	T	25	Very low	26.7	Very low	146 Å²	146	151 Å²	151	90%	0.896	81%	0.807	S	S	*	*			trans	-57.3	93.9	-171.8	39.3	0	0	0	0	113.2
589	G	25	Very low	26.4	Very low	74 Å²	74	153.2 Å²	153.2	76%	0.763	81%	0.811	S	S	*	*			trans	-104.5	101.6	167.9	0	0	0	0	0	110.6	V587	V587-G589 PolarHBondContact O-N 2.82Å
590	G	24.8	Very low	26.4	Very low	56 Å²	56	151.9 Å²	151.9	58%	0.577	81%	0.808	S	S	*	*			trans	-66.8	146.1	180	0	0	0	0	0	113.5	F592	G590-F592 VanDerWaalsContact O-CD2 3.32Å; G590-F592 WeakPolarHBondContact O-CD2 3.18Å
591	L	24	Very low	26.5	Very low	163 Å²	163	148.2 Å²	148.2	85%	0.853	80%	0.8	S	S	*	*			trans	-59.1	131.4	174.3	-81.7	88	0	0	0	111.6
592	F	27.2	Very low	26.9	Very low	171 Å²	171	150 Å²	150	75%	0.75	79%	0.79	S	S	*	*			trans	-103.2	106.8	172.4	-73.3	-88.8	0	0	0	110.6	G590	G590-F592 VanDerWaalsContact O-CD2 3.32Å; G590-F592 WeakPolarHBondContact O-CD2 3.18Å
593	N	23.8	Very low	27.2	Very low	143 Å²	143	150 Å²	150	77%	0.765	78%	0.783	S	S	*	*			trans	-98.6	100.2	165.2	-79.9	-36.3	0	0	0	108.5
594	L	30.7	Very low	27.5	Very low	142 Å²	142	146.6 Å²	146.6	74%	0.743	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-88	118	-179.2	-93.2	143	0	0	0	111.2
595	H	25.3	Very low	27.8	Very low	177 Å²	177	146.4 Å²	146.4	82%	0.819	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-90.8	121.1	167.6	-78.4	72.9	0	0	0	109.7
596	W	29.6	Very low	28.1	Very low	240 Å²	240	146.6 Å²	146.6	91%	0.909	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-68.3	129.6	175.8	-58.6	92.1	0	0	0	110.9
597	R	27	Very low	28.3	Very low	240 Å²	240	147 Å²	147	91%	0.906	78%	0.775	S	S	*	*			trans	-106	117.2	163.1	-79.3	-173	177.8	-172.9	-0.3	109.1	T599	R597-T599 PolarHBondContact O-N 2.66Å; R597-T599 VanDerWaalsContact O-N 3.15Å
598	K	27.3	Very low	28.4	Very low	211 Å²	211	144.7 Å²	144.7	92%	0.917	77%	0.769	S	S	*	*			trans	-68.8	104.6	167.8	-158.2	177.2	-172.3	-179.8	0	107	Q600	K598-Q600 PolarHBondContact O-N 3.06Å
599	T	30	Very low	28.6	Very low	99 Å²	99	145.6 Å²	145.6	61%	0.607	76%	0.763	S	S	*	*			trans	-68.5	118.8	173.4	41.1	0	0	0	0	108	R597 S601	R597-T599 PolarHBondContact O-N 2.66Å; R597-T599 VanDerWaalsContact O-N 3.15Å; T599-S601 PolarHBondContact O-N 3.15Å
600	Q	31.1	Very low	28.8	Very low	183 Å²	183	153.4 Å²	153.4	86%	0.855	77%	0.771	S	S	*	*			trans	-58.2	129.8	165.1	-70.9	178	-14	0	0	106.8	K598 I602	K598-Q600 PolarHBondContact O-N 3.06Å; Q600-I602 PolarHBondContact O-N 2.96Å
601	S	31.6	Very low	29	Very low	108 Å²	108	164.5 Å²	164.5	76%	0.755	80%	0.796	S	S	*	*			trans	-42.2	124.7	173.9	47.4	0	0	0	0	109.7	T599 P603	T599-S601 PolarHBondContact O-N 3.15Å; S601-P603 WeakPolarHBondContact O-CD 3.43Å; S601-P603 VanDerWaalsContact O-N 3.14Å
602	I	32.6	Very low	29.2	Very low	112 Å²	112	164.6 Å²	164.6	57%	0.574	79%	0.793	S	S	*	*			trans	-51.8	122.4	176	-62	170.5	0	0	0	107.2	V428 Q600 V604	V428-I602 HydrophobicContact CG2-CD1 4.19Å; Q600-I602 PolarHBondContact O-N 2.96Å; I602-V604 PolarHBondContact O-N 2.85Å
603	P	30.7	Very low	29.3	Very low	95 Å²	95	164.2 Å²	164.2	62%	0.617	80%	0.795	S	S	*	*			trans	-54.3	133.7	174.4	-23.4	32.3	0	0	0	109.3	S601 F605	S601-P603 WeakPolarHBondContact O-CD 3.43Å; S601-P603 VanDerWaalsContact O-N 3.14Å; P603-F605 HydrophobicContact CB-CD2 4.15Å; P603-F605 PolarHBondContact O-N 2.73Å
604	V	33.1	Very low	29.6	Very low	128 Å²	128	165.4 Å²	165.4	78%	0.776	80%	0.797	S	S	*	*	S	Bend	trans	-61.3	81.7	178.5	-177.5	0	0	0	0	109.5	I602	I602-V604 PolarHBondContact O-N 2.85Å
605	F	29.2	Very low	29.6	Very low	187 Å²	187	166.8 Å²	166.8	82%	0.82	80%	0.8	S	S	*	*			trans	-138.7	11.7	175	-83.1	-73.1	0	0	0	113.6	P603	P603-F605 HydrophobicContact CB-CD2 4.15Å; P603-F605 PolarHBondContact O-N 2.73Å
606	I	29.9	Very low	29.8	Very low	150 Å²	150	166.1 Å²	166.1	77%	0.769	80%	0.799	S	S	*	*			trans	-116.1	69.1	169.4	-46.9	178.9	0	0	0	109.2
607	T	29	Very low	29.8	Very low	131 Å²	131	161.2 Å²	161.2	80%	0.804	79%	0.792	S	S	*	*			trans	-116.7	61.6	150.3	52.7	0	0	0	0	106.9	E609	T607-E609 PolarHBondContact O-N 2.69Å
608	A	29.4	Very low	30	Very low	82 Å²	82	155.6 Å²	155.6	68%	0.678	78%	0.783	S	S	*	*			trans	-83	104.4	160.5	0	0	0	0	0	106.3	Y610	A608-Y610 PolarHBondContact O-N 3.05Å
609	E	30	Very low	30.3	Very low	165 Å²	165	151.3 Å²	151.3	77%	0.771	77%	0.773	S	S	*	*			trans	13.1	96.9	153.3	-64	177.4	142.1	0	0	116.6	T607	T607-E609 PolarHBondContact O-N 2.69Å
610	Y	27.7	Very low	30.3	Very low	238 Å²	238	155.7 Å²	155.7	93%	0.933	79%	0.787	S	S	*	*			trans	-98	98.5	136.8	-97.1	-90.7	0	0	0	105.8	A608	A608-Y610 PolarHBondContact O-N 3.05Å
611	R	29.1	Very low	30.2	Very low	289 Å²	289	153.2 Å²	153.2	100%	1.091	78%	0.781	S	S	*	*			trans	-87	0	160.7	-96.9	-172.6	176.8	174.9	1.7	109.4

Retrieved 611 of 611 residues in 903.3 ms (Link to these results)

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