A0A087X8F3_POEFO Loading...

HtrA serine peptidase 4

AlphaFold DB , UniProt , Accession A0A087X8F3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 453 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	Q	38.4	Very low	34.3	Very low	243 Å²	243	174.8 Å²	174.8	100%	1.136	81%	0.809	S	S	*	*				0	127.9	0	-66.7	170.6	-4.5	0	0	107.2
2	S	37	Very low	34.4	Very low	102 Å²	102	175.7 Å²	175.7	71%	0.713	81%	0.814	S	S	*	*			cis	-153.1	149.1	-14.8	-60.5	0	0	0	0	106.2
3	Y	29	Very low	34	Very low	225 Å²	225	173.2 Å²	173.2	88%	0.882	80%	0.803	S	S	*	*				26	133.9	85.2	-82.7	-104.5	0	0	0	115.1
4	S	34.6	Very low	33.8	Very low	79 Å²	79	174.7 Å²	174.7	55%	0.552	80%	0.798	S	S	*	*			cis	-171.9	166.9	-13.7	76.9	0	0	0	0	108.5
5	R	37.4	Very low	33.7	Very low	212 Å²	212	173.5 Å²	173.5	80%	0.8	80%	0.8	S	S	*	*			trans	70.1	121.7	154	-71.4	174.8	179.7	178	0	116.6
6	L	37.7	Very low	33.7	Very low	158 Å²	158	173.3 Å²	173.3	83%	0.827	80%	0.799	S	S	*	*				62.2	55.5	89	-59	176.1	0	0	0	114.2
7	W	29.8	Very low	33.3	Very low	226 Å²	226	168.8 Å²	168.8	86%	0.856	79%	0.791	S	S	*	*			trans	-122.8	125.8	143.3	-93.1	68.7	0	0	0	106.3
8	Q	36.8	Very low	33.3	Very low	148 Å²	148	169.5 Å²	169.5	69%	0.692	79%	0.791	S	S	*	*			cis	-126.8	151.6	-18.5	-64.7	153.2	-84.5	0	0	105.5
9	L	35.4	Very low	33.2	Very low	152 Å²	152	168.1 Å²	168.1	80%	0.796	79%	0.789	S	S	*	*				48.4	140.8	65.2	-88.6	173.3	0	0	0	114.5
10	W	30.9	Very low	33	Very low	228 Å²	228	167.3 Å²	167.3	86%	0.864	79%	0.789	S	S	*	*			trans	70.6	136.7	164.7	-99	64	0	0	0	118.5
11	L	30.2	Very low	32.7	Very low	150 Å²	150	162.1 Å²	162.1	79%	0.785	78%	0.78	S	S	*	*	S	Bend	trans	63.3	122.1	-174.8	-64.3	120.1	0	0	0	115
12	Q	35.7	Very low	32.2	Very low	185 Å²	185	156.2 Å²	156.2	86%	0.864	76%	0.76	S	S	*	*			cis	-121	121.1	-2.6	-72.6	175.8	-87	0	0	111.8
13	E	29.6	Very low	31.8	Very low	143 Å²	143	159.2 Å²	159.2	67%	0.668	76%	0.763	S	S	*	*			trans	-72.3	156.6	158.8	-148.9	-157.5	136.8	0	0	109.3
14	R	30.5	Very low	31.6	Very low	195 Å²	195	156.4 Å²	156.4	74%	0.736	76%	0.755	S	S	*	*			trans	68.7	106.8	162.7	-55.7	172.9	-167.8	174.9	14.7	117.9
15	L	31.8	Very low	31.2	Very low	157 Å²	157	159.6 Å²	159.6	82%	0.822	76%	0.764	S	S	*	*	S	Bend		163.6	99.2	127.4	-85.4	161	0	0	0	106.7
16	H	34.5	Very low	30.9	Very low	170 Å²	170	155.2 Å²	155.2	79%	0.787	76%	0.763	S	S	*	*			cis	-133.7	154.1	10.8	-91.8	83.1	0	0	0	113.9
17	S	27.2	Very low	30.4	Very low	96 Å²	96	156.3 Å²	156.3	67%	0.671	76%	0.764	S	S	*	*			trans	-38.2	136.2	158.1	-84.1	0	0	0	0	114.4
18	K	32.3	Very low	30.3	Very low	182 Å²	182	156.1 Å²	156.1	79%	0.791	76%	0.763	S	S	*	*				67.8	144.7	77.1	-65.6	174.2	172.9	178.3	0	113.3
19	L	31.1	Very low	30.3	Very low	142 Å²	142	154.4 Å²	154.4	74%	0.743	77%	0.767	S	S	*	*			cis	-169.1	168.4	-8.3	-103	171	0	0	0	105.7
20	I	30.7	Very low	30	Very low	153 Å²	153	154.6 Å²	154.6	79%	0.785	77%	0.768	S	S	*	*			cis	-135.1	158.9	7.9	-84.8	109.6	0	0	0	106.8
21	G	25.7	Very low	30	Very low	59 Å²	59	151.5 Å²	151.5	61%	0.608	77%	0.768	S	S	*	*			cis	151.7	169.1	-9.7	0	0	0	0	0	114.5
22	V	27.8	Very low	29.9	Very low	119 Å²	119	156.1 Å²	156.1	72%	0.721	78%	0.775	S	S	*	*			trans	70.1	103.1	156	-168.6	0	0	0	0	120
23	H	28.1	Very low	29.7	Very low	165 Å²	165	155.7 Å²	155.7	76%	0.764	77%	0.77	S	S	*	*			trans	71.3	151	149.8	-68.7	-24.8	0	0	0	119.7
24	K	25	Very low	29.8	Very low	166 Å²	166	160.1 Å²	160.1	72%	0.722	78%	0.781	S	S	*	*			cis	-152	133.5	5.1	-131.1	166.1	-173	178.4	0	112.6
25	I	27.2	Very low	30.1	Very low	146 Å²	146	158.9 Å²	158.9	75%	0.749	78%	0.783	S	S	*	*			trans	52.2	126.8	148.9	-61.8	169	0	0	0	119.6
26	P	31.5	Very low	30.5	Very low	120 Å²	120	157.1 Å²	157.1	78%	0.779	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-85.7	151.1	177.8	35.8	-35.6	0	0	0	113.5
27	H	27.1	Very low	31.2	Very low	180 Å²	180	154.5 Å²	154.5	83%	0.833	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-97.8	133.5	171.6	-131.5	-82.5	0	0	0	112.8
28	R	27.5	Very low	32.8	Very low	223 Å²	223	156 Å²	156	84%	0.842	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-81.9	154.4	-174	-157.3	174.5	-173.8	177.2	1.7	111.3	L30	R28-L30 PolarHBondContact O-N 3.05Å
29	S	36.5	Very low	34.6	Very low	112 Å²	112	149.9 Å²	149.9	78%	0.783	76%	0.76	S	S	*	*			trans	-45.9	120.9	178.3	54.5	0	0	0	0	113.9
30	L	29.1	Very low	36.6	Very low	156 Å²	156	147.4 Å²	147.4	82%	0.817	75%	0.752	S	S	*	*			trans	-94.2	122.8	173.1	-84.4	167.2	0	0	0	111.6	R28 R32	R28-L30 PolarHBondContact O-N 3.05Å; L30-R32 PolarHBondContact O-N 3.11Å
31	L	30.9	Very low	38.7	Very low	163 Å²	163	149.2 Å²	149.2	85%	0.853	76%	0.757	S	S	*	*			trans	-61.3	127.2	169.3	-76.3	153.2	0	0	0	109.9	K33	L31-K33 VanDerWaalsContact C-N 3.25Å; L31-K33 PolarHBondContact O-N 2.7Å
32	R	28.8	Very low	41.1	Very low	246 Å²	246	152.1 Å²	152.1	93%	0.928	76%	0.763	S	S	*	*			trans	-75	71.8	-177.3	-163.3	178	-171	-178.3	2.9	111.5	L30 R34	L30-R32 PolarHBondContact O-N 3.11Å; R32-R34 PolarHBondContact O-N 3.32Å
33	K	29.8	Very low	43.6	Very low	177 Å²	177	149.2 Å²	149.2	77%	0.77	75%	0.747	S	S	*	*			trans	-55.8	121	172.4	-77	-172.5	174.3	-175.9	0	109.4	L31 H35	L31-K33 VanDerWaalsContact C-N 3.25Å; L31-K33 PolarHBondContact O-N 2.7Å; K33-H35 PolarHBondContact O-N 3.16Å
34	R	31.7	Very low	46.1	Very low	235 Å²	235	144.6 Å²	144.6	89%	0.887	73%	0.728	S	S	*	*			trans	-67.2	113.8	165.6	-73.1	178.8	172.3	171.3	-3.6	107.9	R32 T36	R32-R34 PolarHBondContact O-N 3.32Å; R34-T36 PolarHBondContact O-N 2.85Å; R34-T36 VanDerWaalsContact O-N 3.12Å
35	H	37.9	Very low	48.6	Very low	169 Å²	169	143.8 Å²	143.8	78%	0.782	73%	0.727	S	S	*	*			trans	-74.4	96.7	166.2	-93.6	-99.4	0	0	0	109	K33 T37	K33-H35 PolarHBondContact O-N 3.16Å; H35-T37 PolarHBondContact O-N 3.4Å; H35-T37 VanDerWaalsContact O-N 3.16Å
36	T	39.4	Very low	50.9	Low	120 Å²	120	141.6 Å²	141.6	74%	0.736	73%	0.725	S	S	*	*			trans	-75.3	92.7	162.5	47.4	0	0	0	0	108	R34 T38	R34-T36 PolarHBondContact O-N 2.85Å; R34-T36 VanDerWaalsContact O-N 3.12Å; T36-T38 PolarHBondContact O-N 3.27Å
37	T	49.7	Very low	53.2	Low	116 Å²	116	143.4 Å²	143.4	71%	0.712	72%	0.723	S	S	*	*			trans	-69.7	91.7	-176.4	-48.7	0	0	0	0	110.9	H35 C39	H35-T37 PolarHBondContact O-N 3.4Å; H35-T37 VanDerWaalsContact O-N 3.16Å; T37-C39 PolarHBondContact O-N 3.13Å
38	T	62	Low	55.7	Low	128 Å²	128	136 Å²	136	79%	0.785	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-70.5	117.2	172.4	47.7	0	0	0	0	110.2	T36	T36-T38 PolarHBondContact O-N 3.27Å
39	C	69	Low	57.9	Low	52 Å²	52	129.4 Å²	129.4	35%	0.351	68%	0.677	S	S	.	*	P	Polyproline II helix	trans	-69.1	146.1	176.7	-66.3	0	0	0	0	112.2	T37 C64	T37-C39 PolarHBondContact O-N 3.13Å; C39-C64 WeakPolarHBondContact CA-SG 3.36Å; C39-C64 HydrophobicContact CB-CB 3.57Å; C39-C64 WeakPolarHBondContact CB-SG 3.34Å; C39-C64 WeakPolarHBondContact SG-CA 3.25Å; C39-C64 WeakPolarHBondContact SG-CB 3.09Å; C39-C64 CovalentContact SG-SG 2.04Å; C39-C64 PolarHBondContact SG-SG 2.9Å
40	P	73.8	Confident	59.5	Low	90 Å²	90	130.4 Å²	130.4	58%	0.584	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-64.7	143.9	174.6	29.2	-35.1	0	0	0	110.6	V42	P40-V42 VanDerWaalsContact C-N 3.26Å; P40-V42 PolarHBondContact O-N 3.31Å
41	Q	73.2	Confident	61.2	Low	192 Å²	192	124.4 Å²	124.4	90%	0.897	65%	0.649	S	S	*	*	S	Bend	trans	-69.8	-22.5	-178.7	-65.6	-66.2	-74.8	0	0	113.3
42	V	77.5	Confident	62.8	Low	120 Å²	120	120.2 Å²	120.2	73%	0.727	63%	0.631	S	S	*	*	S	Bend	trans	-126.1	133.7	176.2	-178.7	0	0	0	0	108.2	P40	P40-V42 VanDerWaalsContact C-N 3.26Å; P40-V42 PolarHBondContact O-N 3.31Å
43	C	79.8	Confident	64.2	Low	57 Å²	57	117.6 Å²	117.6	39%	0.385	63%	0.629	S	S	.	*			trans	-90.3	107.5	177.2	173.3	0	0	0	0	110.8	C66	C43-C66 WeakPolarHBondContact CA-SG 3.47Å; C43-C66 HydrophobicContact CB-CB 3.77Å; C43-C66 WeakPolarHBondContact CB-SG 3.45Å; C43-C66 WeakPolarHBondContact SG-CA 3.48Å; C43-C66 WeakPolarHBondContact SG-CB 3.5Å; C43-C66 CovalentContact SG-SG 2.04Å; C43-C66 PolarHBondContact SG-SG 2.96Å
44	D	81.7	Confident	65.4	Low	69 Å²	69	114.7 Å²	114.7	37%	0.369	63%	0.626	S	S	.	*			trans	-91.1	110.1	167	-175.9	-6.9	0	0	0	109.9	S46 Q47	D44-S46 VanDerWaalsContact C-N 3.31Å; D44-S46 VanDerWaalsContact CG-OG 3.28Å; D44-S46 VanDerWaalsContact OD1-CB 3.3Å; D44-S46 WeakPolarHBondContact OD1-CB 3.47Å; D44-S46 PolarHBondContact OD1-N 3.45Å; D44-S46 PolarHBondContact OD1-OG 3.1Å; D44-S46 PolarHBondContact OD2-OG 3.23Å; D44-Q47 WeakPolarHBondContact OD2-CG 3.36Å; D44-Q47 PolarHBondContact OD2-NE2 3.15Å
45	Q	75.8	Confident	66.8	Low	148 Å²	148	104 Å²	104	69%	0.692	59%	0.587	S	S	*	*	S	Bend	trans	-75.7	-17.9	179.8	-62.8	-177.9	31	0	0	113.1	Q47 C48	Q45-Q47 VanDerWaalsContact C-N 3.32Å; Q45-C48 WeakPolarHBondContact O-CB 3.25Å; Q45-C48 PolarHBondContact O-N 2.79Å
46	S	76.8	Confident	67.5	Low	101 Å²	101	97.9 Å²	97.9	71%	0.706	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	-26.3	-179.8	73.9	0	0	0	0	112.8	D44 C48	D44-S46 VanDerWaalsContact C-N 3.31Å; D44-S46 VanDerWaalsContact CG-OG 3.28Å; D44-S46 VanDerWaalsContact OD1-CB 3.3Å; D44-S46 WeakPolarHBondContact OD1-CB 3.47Å; D44-S46 PolarHBondContact OD1-N 3.45Å; D44-S46 PolarHBondContact OD1-OG 3.1Å; D44-S46 PolarHBondContact OD2-OG 3.23Å; S46-C48 VanDerWaalsContact C-N 3.32Å
47	Q	78.6	Confident	68.4	Low	157 Å²	157	94.6 Å²	94.6	73%	0.734	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-1.5	176.8	-63.2	-178.7	49.6	0	0	113.2	D44 Q45	D44-Q47 WeakPolarHBondContact OD2-CG 3.36Å; D44-Q47 PolarHBondContact OD2-NE2 3.15Å; Q45-Q47 VanDerWaalsContact C-N 3.32Å
48	C	79.3	Confident	69	Low	26 Å²	26	89.5 Å²	89.5	18%	0.176	51%	0.507	C	S	.	.	S	Bend	trans	-73.4	134.6	-179.7	-69.1	0	0	0	0	111.9	Q45 S46 V50 C67	Q45-C48 WeakPolarHBondContact O-CB 3.25Å; Q45-C48 PolarHBondContact O-N 2.79Å; S46-C48 VanDerWaalsContact C-N 3.32Å; C48-V50 PolarHBondContact O-N 3.4Å; C48-C67 WeakPolarHBondContact CA-SG 3.11Å; C48-C67 HydrophobicContact CB-CB 3.63Å; C48-C67 WeakPolarHBondContact CB-SG 3.33Å; C48-C67 WeakPolarHBondContact SG-CA 3.4Å; C48-C67 WeakPolarHBondContact SG-CB 3.48Å; C48-C67 CovalentContact SG-SG 2.04Å; C48-C67 PolarHBondContact SG-SG 3.07Å
49	P	74.8	Confident	69.4	Low	84 Å²	84	90.7 Å²	90.7	55%	0.545	50%	0.497	S	S	.	.	P	Polyproline II helix	trans	-64.4	125.5	176	27.2	-33.9	0	0	0	109.9	P51	P49-P51 WeakPolarHBondContact O-CD 3.42Å
50	V	69.4	Low	69.7	Low	133 Å²	133	89.2 Å²	89.2	81%	0.806	49%	0.486	S	S	*	.	P	Polyproline II helix	trans	-60.6	119.1	179.6	-178.6	0	0	0	0	109.2	C48	C48-V50 PolarHBondContact O-N 3.4Å
51	P	65.5	Low	69.9	Low	30 Å²	30	90.9 Å²	90.9	20%	0.195	48%	0.484	C	S	.	.	P	Polyproline II helix	trans	-64.8	136.3	178.2	24.6	-32.2	0	0	0	109.9	P49 C55	P49-P51 WeakPolarHBondContact O-CD 3.42Å; P51-C55 HydrophobicContact CB-CB 3.99Å
52	P	64.3	Low	69.8	Low	75 Å²	75	83 Å²	83	49%	0.487	45%	0.448	S	S	.	.	P	Polyproline II helix	trans	-61.5	155.5	-174.3	25.8	-35.3	0	0	0	111.5	T54 C55	P52-T54 PolarHBondContact O-N 3.07Å; P52-C55 HydrophobicContact CG-CB 4.37Å; P52-C55 WeakPolarHBondContact O-CA 3.34Å; P52-C55 WeakPolarHBondContact O-CB 3.3Å; P52-C55 PolarHBondContact O-N 2.87Å
53	H	57.5	Low	69.3	Low	191 Å²	191	81.1 Å²	81.1	88%	0.884	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-18.8	-179.5	-67.2	-83.2	0	0	0	114.2	C55 C56	H53-C55 VanDerWaalsContact C-N 3.28Å; H53-C55 PolarHBondContact O-N 2.79Å; H53-C56 PolarHBondContact O-SG 2.77Å
54	T	56.1	Low	69	Low	115 Å²	115	80.7 Å²	80.7	71%	0.706	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-5.2	171.9	49	0	0	0	0	114.4	P52 C56	P52-T54 PolarHBondContact O-N 3.07Å; T54-C56 PolarHBondContact O-N 3.49Å
55	C	61.1	Low	68.6	Low	10 Å²	10	79 Å²	79	7%	0.068	44%	0.442	C	S	.	.			trans	-73.6	35.6	174.9	-157.9	0	0	0	0	112.4	P51 P52 H53 H57 C70	P51-C55 HydrophobicContact CB-CB 3.99Å; P52-C55 HydrophobicContact CG-CB 4.37Å; P52-C55 WeakPolarHBondContact O-CA 3.34Å; P52-C55 WeakPolarHBondContact O-CB 3.3Å; P52-C55 PolarHBondContact O-N 2.87Å; H53-C55 VanDerWaalsContact C-N 3.28Å; H53-C55 PolarHBondContact O-N 2.79Å; C55-H57 VanDerWaalsContact C-N 3.34Å; C55-H57 PolarHBondContact O-N 3.46Å; C55-C70 HydrophobicContact CB-CB 4.3Å; C55-C70 WeakPolarHBondContact CB-SG 3Å; C55-C70 WeakPolarHBondContact SG-CA 3.42Å; C55-C70 WeakPolarHBondContact SG-CB 3.15Å; C55-C70 CovalentContact SG-SG 2.04Å; C55-C70 PolarHBondContact SG-SG 2.82Å
56	C	53.4	Low	68.8	Low	41 Å²	41	72.7 Å²	72.7	28%	0.277	41%	0.414	S	S	.	.			trans	-69.4	-30.1	-168.9	-50	0	0	0	0	113.9	H53 T54 L138	H53-C56 PolarHBondContact O-SG 2.77Å; T54-C56 PolarHBondContact O-N 3.49Å; C56-L138 HydrophobicContact CB-CD1 3.46Å; C56-L138 VanDerWaalsContact CB-CD1 3.46Å; C56-L138 VanDerWaalsContact SG-CD1 3.51Å
57	H	57.1	Low	68.9	Low	52 Å²	52	68.7 Å²	68.7	24%	0.241	39%	0.386	C	S	.	.	S	Bend	trans	-90.5	-39.6	-153.5	-66.5	-52.8	0	0	0	112.6	C55 R134	C55-H57 VanDerWaalsContact C-N 3.34Å; C55-H57 PolarHBondContact O-N 3.46Å; H57-R134 WeakPolarHBondContact O-CD 3.15Å; H57-R134 PolarHBondContact O-NH1 3Å
58	Y	62.3	Low	68.9	Low	9 Å²	9	63.9 Å²	63.9	4%	0.035	37%	0.367	C	S	.	.			trans	-152	134.3	172.5	-52.2	-88.8	0	0	0	110.6	G71 W73 D90 L92 C127 R134	Y58-G71 PolarHBondContact O-N 2.93Å; Y58-W73 HydrophobicContact CD2-CB 4.04Å; Y58-W73 HydrophobicContact CE2-CB 3.63Å; Y58-D90 HydrophobicContact CD1-CB 4.45Å; Y58-D90 WeakPolarHBondContact CD1-O 3.49Å; Y58-D90 WeakPolarHBondContact CE1-O 3.22Å; Y58-L92 HydrophobicContact CD1-CD1 4.15Å; Y58-L92 HydrophobicContact CD2-CD1 4.13Å; Y58-L92 HydrophobicContact CE1-CD1 3.8Å; Y58-L92 HydrophobicContact CE1-CG 4.04Å; Y58-L92 HydrophobicContact CE2-CD1 3.82Å; Y58-L92 HydrophobicContact CG-CD1 4.32Å; Y58-C127 PolarHBondContact OH-O 3.39Å; Y58-R134 VanDerWaalsContact CD1-NH1 3.27Å
59	R	70.3	Confident	68.7	Low	153 Å²	153	68.7 Å²	68.7	58%	0.577	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.6	134	172.5	-76.8	179.7	174	-156.4	-1.5	108.1	V68	R59-V68 HydrophobicContact CB-CG1 3.79Å; R59-V68 HydrophobicContact CG-CG1 3.86Å
60	V	75.5	Confident	68.8	Low	20 Å²	20	67.9 Å²	67.9	12%	0.121	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	148.4	178.5	-64.2	0	0	0	0	108.9	V68 R69 C88	V60-V68 CarbonylContact O-C 3.58Å; V60-V68 WeakPolarHBondContact O-CA 3.39Å; V60-R69 HydrophobicContact CG2-CB 4.32Å; V60-R69 PolarHBondContact N-O 2.85Å; V60-R69 PolarHBondContact O-N 3.41Å; V60-C88 VanDerWaalsContact CG1-O 3.28Å; V60-C88 WeakPolarHBondContact CG1-O 3.3Å
61	K	77.1	Confident	69.2	Low	125 Å²	125	62 Å²	62	54%	0.543	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	149.5	163.2	-74.6	176.3	157.2	-144.9	0	109.4	G65 C67	K61-G65 VanDerWaalsContact CD-O 3.25Å; K61-G65 WeakPolarHBondContact CD-O 3.3Å; K61-G65 VanDerWaalsContact CE-O 3.28Å; K61-G65 WeakPolarHBondContact CE-O 3.39Å; K61-G65 PolarHBondContact NZ-O 3.22Å; K61-C67 CarbonylContact C-O 3.42Å; K61-C67 WeakPolarHBondContact CA-O 3.31Å
62	D	72.2	Confident	69.9	Low	26 Å²	26	60.8 Å²	60.8	14%	0.139	34%	0.335	C	S	.	.			trans	-63.9	174.6	167.9	62.3	26.3	0	0	0	112.2	C64 G65 C66 C67 R69	D62-C64 PolarHBondContact O-N 3.2Å; D62-C64 WeakPolarHBondContact OD1-CA 3.38Å; D62-C64 WeakPolarHBondContact OD1-CB 3.06Å; D62-C64 PolarHBondContact OD1-N 2.65Å; D62-G65 PolarHBondContact O-N 3.29Å; D62-G65 PolarHBondContact OD1-N 2.72Å; D62-G65 VanDerWaalsContact OD1-N 3.12Å; D62-C66 PolarHBondContact OD1-N 2.89Å; D62-C67 PolarHBondContact N-O 2.89Å; D62-C67 VanDerWaalsContact OD2-CB 3.27Å; D62-C67 WeakPolarHBondContact OD2-CB 3.39Å; D62-C67 PolarHBondContact OD2-N 3.35Å; D62-R69 HydrophobicContact CB-CG 4.43Å
63	A	67.1	Low	70.5	Confident	82 Å²	82	63.3 Å²	63.3	68%	0.678	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-9.3	179.2	0	0	0	0	0	114.2
64	C	73.7	Confident	71.6	Confident	47 Å²	47	55.8 Å²	55.8	32%	0.318	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.3	4.3	176	-61.7	0	0	0	0	113	C39 D62 C66	C39-C64 WeakPolarHBondContact CA-SG 3.36Å; C39-C64 HydrophobicContact CB-CB 3.57Å; C39-C64 WeakPolarHBondContact CB-SG 3.34Å; C39-C64 WeakPolarHBondContact SG-CA 3.25Å; C39-C64 WeakPolarHBondContact SG-CB 3.09Å; C39-C64 CovalentContact SG-SG 2.04Å; C39-C64 PolarHBondContact SG-SG 2.9Å; D62-C64 PolarHBondContact O-N 3.2Å; D62-C64 WeakPolarHBondContact OD1-CA 3.38Å; D62-C64 WeakPolarHBondContact OD1-CB 3.06Å; D62-C64 PolarHBondContact OD1-N 2.65Å; C64-C66 PolarHBondContact O-N 2.87Å
65	G	72.6	Confident	72.7	Confident	35 Å²	35	53.1 Å²	53.1	36%	0.361	30%	0.296	S	S	.	.	S	Bend	trans	68.4	13.3	-178.9	0	0	0	0	0	113.9	K61 D62	K61-G65 VanDerWaalsContact CD-O 3.25Å; K61-G65 WeakPolarHBondContact CD-O 3.3Å; K61-G65 VanDerWaalsContact CE-O 3.28Å; K61-G65 WeakPolarHBondContact CE-O 3.39Å; K61-G65 PolarHBondContact NZ-O 3.22Å; D62-G65 PolarHBondContact O-N 3.29Å; D62-G65 PolarHBondContact OD1-N 2.72Å; D62-G65 VanDerWaalsContact OD1-N 3.12Å
66	C	79.6	Confident	73.7	Confident	14 Å²	14	55.3 Å²	55.3	10%	0.095	31%	0.305	C	S	.	.			trans	-105.7	-78.4	-168.5	-174.6	0	0	0	0	112.4	C43 D62 C64	C43-C66 WeakPolarHBondContact CA-SG 3.47Å; C43-C66 HydrophobicContact CB-CB 3.77Å; C43-C66 WeakPolarHBondContact CB-SG 3.45Å; C43-C66 WeakPolarHBondContact SG-CA 3.48Å; C43-C66 WeakPolarHBondContact SG-CB 3.5Å; C43-C66 CovalentContact SG-SG 2.04Å; C43-C66 PolarHBondContact SG-SG 2.96Å; D62-C66 PolarHBondContact OD1-N 2.89Å; C64-C66 PolarHBondContact O-N 2.87Å
67	C	79.3	Confident	75	Confident	17 Å²	17	56.5 Å²	56.5	12%	0.115	31%	0.311	C	S	.	.	S	Bend	trans	-80.8	143	-173	-62.1	0	0	0	0	112.7	C48 K61 D62	C48-C67 WeakPolarHBondContact CA-SG 3.11Å; C48-C67 HydrophobicContact CB-CB 3.63Å; C48-C67 WeakPolarHBondContact CB-SG 3.33Å; C48-C67 WeakPolarHBondContact SG-CA 3.4Å; C48-C67 WeakPolarHBondContact SG-CB 3.48Å; C48-C67 CovalentContact SG-SG 2.04Å; C48-C67 PolarHBondContact SG-SG 3.07Å; K61-C67 CarbonylContact C-O 3.42Å; K61-C67 WeakPolarHBondContact CA-O 3.31Å; D62-C67 PolarHBondContact N-O 2.89Å; D62-C67 VanDerWaalsContact OD2-CB 3.27Å; D62-C67 WeakPolarHBondContact OD2-CB 3.39Å; D62-C67 PolarHBondContact OD2-N 3.35Å
68	V	78.1	Confident	76.2	Confident	56 Å²	56	54.2 Å²	54.2	34%	0.339	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	122.7	173.9	-179.5	0	0	0	0	110	R59 V60	R59-V68 HydrophobicContact CB-CG1 3.79Å; R59-V68 HydrophobicContact CG-CG1 3.86Å; V60-V68 CarbonylContact O-C 3.58Å; V60-V68 WeakPolarHBondContact O-CA 3.39Å
69	R	76.6	Confident	76.8	Confident	128 Å²	128	54.1 Å²	54.1	48%	0.483	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	170.9	176.1	-60	-171.5	-178.7	-144.2	0.1	110.4	V60 D62	V60-R69 HydrophobicContact CG2-CB 4.32Å; V60-R69 PolarHBondContact N-O 2.85Å; V60-R69 PolarHBondContact O-N 3.41Å; D62-R69 HydrophobicContact CB-CG 4.43Å
70	C	76.1	Confident	76.5	Confident	67 Å²	67	54.5 Å²	54.5	45%	0.453	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	123.9	173.4	-48.9	0	0	0	0	109.9	C55	C55-C70 HydrophobicContact CB-CB 4.3Å; C55-C70 WeakPolarHBondContact CB-SG 3Å; C55-C70 WeakPolarHBondContact SG-CA 3.42Å; C55-C70 WeakPolarHBondContact SG-CB 3.15Å; C55-C70 CovalentContact SG-SG 2.04Å; C55-C70 PolarHBondContact SG-SG 2.82Å
71	G	77.1	Confident	75.4	Confident	8 Å²	8	56.8 Å²	56.8	8%	0.082	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-80.4	141.3	173.4	0	0	0	0	0	111.1	Y58 S87	Y58-G71 PolarHBondContact O-N 2.93Å; G71-S87 WeakPolarHBondContact CA-O 3.44Å
72	A	80.5	Confident	74	Confident	5 Å²	5	55.5 Å²	55.5	4%	0.041	34%	0.335	C	S	.	.	B	Isolated β-bridge	trans	-63.1	138.6	176.3	0	0	0	0	0	110.9	E76 S87 G89 L92	A72-E76 VanDerWaalsContact CA-OE2 3.24Å; A72-E76 WeakPolarHBondContact CA-OE2 3.39Å; A72-E76 HydrophobicContact CB-CB 4.02Å; A72-S87 PolarHBondContact N-O 3.17Å; A72-G89 PolarHBondContact O-N 2.92Å; A72-L92 VanDerWaalsContact O-CD1 3.28Å; A72-L92 WeakPolarHBondContact O-CD1 3.4Å
73	W	76.3	Confident	72.9	Confident	128 Å²	128	62.6 Å²	62.6	49%	0.485	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-88.8	167.1	-177.1	67.6	71.6	0	0	0	113	Y58 G75 E76 C108	Y58-W73 HydrophobicContact CD2-CB 4.04Å; Y58-W73 HydrophobicContact CE2-CB 3.63Å; W73-G75 PolarHBondContact O-N 2.88Å; W73-G75 VanDerWaalsContact O-N 3.14Å; W73-E76 HydrophobicContact CD2-CG 3.76Å; W73-E76 VanDerWaalsContact CE2-CG 3.49Å; W73-E76 HydrophobicContact CE3-CG 4.44Å; W73-E76 HydrophobicContact CG-CG 3.88Å; W73-E76 WeakPolarHBondContact CH2-OE1 3.24Å; W73-E76 HydrophobicContact CZ2-CG 3.97Å; W73-E76 WeakPolarHBondContact CZ2-OE1 3.27Å; W73-E76 PolarHBondContact N-OE2 3.26Å; W73-E76 WeakPolarHBondContact O-CB 3.34Å; W73-E76 PolarHBondContact O-N 2.99Å; W73-C108 WeakPolarHBondContact O-CB 2.94Å
74	E	82.2	Confident	72.4	Confident	34 Å²	34	62.6 Å²	62.6	16%	0.159	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	119.3	-176.2	-170.1	166	-145.7	0	0	112.9	L92 C108 C110 S125 R128	E74-L92 HydrophobicContact CB-CD2 3.75Å; E74-L92 HydrophobicContact CG-CD2 4.22Å; E74-C108 CarbonylContact C-O 3.59Å; E74-C108 WeakPolarHBondContact CA-O 3.34Å; E74-C110 WeakPolarHBondContact OE1-CB 3.36Å; E74-C110 PolarHBondContact OE1-N 2.92Å; E74-S125 WeakPolarHBondContact OE2-CB 3.41Å; E74-S125 PolarHBondContact OE2-OG 2.93Å; E74-R128 PolarHBondContact O-NH2 2.83Å; E74-R128 VanDerWaalsContact OE2-CG 3.3Å; E74-R128 WeakPolarHBondContact OE2-CG 3.35Å
75	G	78	Confident	71.9	Confident	59 Å²	59	66 Å²	66	61%	0.608	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	98.3	-9.8	-174.3	0	0	0	0	0	115.4	W73 C108	W73-G75 PolarHBondContact O-N 2.88Å; W73-G75 VanDerWaalsContact O-N 3.14Å; G75-C108 PolarHBondContact N-O 2.91Å
76	E	81.6	Confident	71.8	Confident	55 Å²	55	67.6 Å²	67.6	26%	0.257	37%	0.374	S	S	.	.	S	Bend	trans	-77.9	159.2	171.9	-69.8	-162.2	107.9	0	0	113	A72 W73 S107 C108	A72-E76 VanDerWaalsContact CA-OE2 3.24Å; A72-E76 WeakPolarHBondContact CA-OE2 3.39Å; A72-E76 HydrophobicContact CB-CB 4.02Å; W73-E76 HydrophobicContact CD2-CG 3.76Å; W73-E76 VanDerWaalsContact CE2-CG 3.49Å; W73-E76 HydrophobicContact CE3-CG 4.44Å; W73-E76 HydrophobicContact CG-CG 3.88Å; W73-E76 WeakPolarHBondContact CH2-OE1 3.24Å; W73-E76 HydrophobicContact CZ2-CG 3.97Å; W73-E76 WeakPolarHBondContact CZ2-OE1 3.27Å; W73-E76 PolarHBondContact N-OE2 3.26Å; W73-E76 WeakPolarHBondContact O-CB 3.34Å; W73-E76 PolarHBondContact O-N 2.99Å; E76-S107 CarbonylContact O-C 3.5Å; E76-S107 WeakPolarHBondContact O-CA 3.39Å; E76-S107 WeakPolarHBondContact O-CB 3.32Å; E76-C108 PolarHBondContact O-N 2.86Å
77	V	82.3	Confident	71.7	Confident	67 Å²	67	68.3 Å²	68.3	41%	0.406	38%	0.379	S	S	.	.	B	Isolated β-bridge	trans	-71.3	142	176.9	-179.5	0	0	0	0	110.8	R106	V77-R106 WeakPolarHBondContact CA-O 3.49Å
78	C	81.7	Confident	71.8	Confident	3 Å²	3	68.5 Å²	68.5	2%	0.02	38%	0.38	C	S	.	.			trans	-142.9	164.5	-174.2	65.5	0	0	0	0	114.3	C88 C94 R106 S107 C108	C78-C88 WeakPolarHBondContact CB-SG 3.23Å; C78-C94 HydrophobicContact CB-CB 3.82Å; C78-C94 WeakPolarHBondContact CB-SG 3.12Å; C78-C94 WeakPolarHBondContact SG-CA 3.33Å; C78-C94 WeakPolarHBondContact SG-CB 3.48Å; C78-C94 CovalentContact SG-SG 2.03Å; C78-C94 PolarHBondContact SG-SG 3.28Å; C78-R106 PolarHBondContact N-O 3.15Å; C78-R106 VanDerWaalsContact O-CB 3.28Å; C78-R106 WeakPolarHBondContact O-CB 3.44Å; C78-S107 WeakPolarHBondContact SG-CA 3.39Å; C78-S107 PolarHBondContact SG-N 3.38Å; C78-S107 VanDerWaalsContact SG-N 3.38Å; C78-C108 VanDerWaalsContact CB-SG 3.55Å
79	G	74.2	Confident	71.8	Confident	8 Å²	8	65.9 Å²	65.9	8%	0.082	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	75.3	-157.7	-174.6	0	0	0	0	0	112.3	S81 L86	G79-S81 PolarHBondContact O-N 2.73Å; G79-L86 PolarHBondContact N-O 2.82Å; G79-L86 PolarHBondContact O-N 2.99Å
80	E	65.1	Low	71.7	Confident	160 Å²	160	64.1 Å²	64.1	75%	0.748	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.6	112.7	-179.5	-65.8	-178.7	117.1	0	0	112.5	F85	E80-F85 HydrophobicContact CG-CD2 4.2Å
81	S	52.7	Low	71.7	Confident	68 Å²	68	62.8 Å²	62.8	48%	0.476	36%	0.362	S	S	.	.	S	Bend	trans	-144.9	108.4	159.6	178.3	0	0	0	0	108.6	G79	G79-S81 PolarHBondContact O-N 2.73Å
82	S	46.2	Very low	72	Confident	98 Å²	98	63 Å²	63	69%	0.685	36%	0.361	S	S	*	.	S	Bend	trans	50.3	86.6	177.2	47.3	0	0	0	0	114.4	V84	S82-V84 PolarHBondContact O-N 3.05Å
83	D	49.8	Very low	72.3	Confident	175 Å²	175	67.9 Å²	67.9	94%	0.936	38%	0.379	S	S	*	.	S	Bend	trans	62.7	1.5	161.4	-47.4	-31.6	0	0	0	117.8
84	V	57.1	Low	72.8	Confident	83 Å²	83	64.4 Å²	64.4	50%	0.503	37%	0.373	S	S	.	.			trans	-128.6	132.2	169.1	-172.6	0	0	0	0	110.3	S82 L86	S82-V84 PolarHBondContact O-N 3.05Å; V84-L86 HydrophobicContact CB-CD1 4.01Å; V84-L86 HydrophobicContact CG1-CD1 3.84Å
85	F	62.3	Low	73.1	Confident	117 Å²	117	66.1 Å²	66.1	51%	0.513	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	106.3	169.4	-172.7	-88.2	0	0	0	109.4	E80 S87	E80-F85 HydrophobicContact CG-CD2 4.2Å; F85-S87 WeakPolarHBondContact CE1-OG 3.48Å; F85-S87 PolarHBondContact O-N 3.09Å
86	L	70.6	Confident	73.4	Confident	70 Å²	70	71.9 Å²	71.9	37%	0.366	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	100.4	175.7	-80.2	83.6	0	0	0	110.1	G79 V84	G79-L86 PolarHBondContact N-O 2.82Å; G79-L86 PolarHBondContact O-N 2.99Å; V84-L86 HydrophobicContact CB-CD1 4.01Å; V84-L86 HydrophobicContact CG1-CD1 3.84Å
87	S	77.8	Confident	73.3	Confident	29 Å²	29	71.8 Å²	71.8	20%	0.203	39%	0.39	C	S	.	.	P	Polyproline II helix	trans	-69	136.9	168.8	-59.8	0	0	0	0	110.9	G71 A72 F85	G71-S87 WeakPolarHBondContact CA-O 3.44Å; A72-S87 PolarHBondContact N-O 3.17Å; F85-S87 WeakPolarHBondContact CE1-OG 3.48Å; F85-S87 PolarHBondContact O-N 3.09Å
88	C	82.6	Confident	73	Confident	20 Å²	20	74 Å²	74	14%	0.135	41%	0.406	C	S	.	.	B	Isolated β-bridge	trans	-73.6	148.8	169	-65.5	0	0	0	0	111.2	V60 C78 L92 C94 C108	V60-C88 VanDerWaalsContact CG1-O 3.28Å; V60-C88 WeakPolarHBondContact CG1-O 3.3Å; C78-C88 WeakPolarHBondContact CB-SG 3.23Å; C88-L92 HydrophobicContact CB-CB 3.8Å; C88-C94 VanDerWaalsContact SG-CA 3.54Å; C88-C108 WeakPolarHBondContact CA-SG 3.39Å; C88-C108 HydrophobicContact CB-CB 3.83Å; C88-C108 WeakPolarHBondContact CB-SG 3.25Å; C88-C108 WeakPolarHBondContact SG-CA 3.47Å; C88-C108 WeakPolarHBondContact SG-CB 3.5Å; C88-C108 CovalentContact SG-SG 2.04Å; C88-C108 PolarHBondContact SG-SG 2.97Å
89	G	76.7	Confident	72.5	Confident	2 Å²	2	75.1 Å²	75.1	2%	0.021	42%	0.418	C	S	.	.	P	Polyproline II helix	trans	-68.3	168.8	-177.8	0	0	0	0	0	117.3	A72 G91 L92	A72-G89 PolarHBondContact O-N 2.92Å; G89-G91 PolarHBondContact O-N 2.73Å; G89-G91 VanDerWaalsContact O-N 3.15Å; G89-L92 WeakPolarHBondContact O-CA 3.37Å; G89-L92 VanDerWaalsContact O-CB 3.27Å; G89-L92 WeakPolarHBondContact O-CB 3.42Å; G89-L92 PolarHBondContact O-N 3.34Å
90	D	74.8	Confident	71.8	Confident	91 Å²	91	87.2 Å²	87.2	49%	0.487	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.4	117.5	174.1	-56.4	-52.4	0	0	0	112.9	Y58	Y58-D90 HydrophobicContact CD1-CB 4.45Å; Y58-D90 WeakPolarHBondContact CD1-O 3.49Å; Y58-D90 WeakPolarHBondContact CE1-O 3.22Å
91	G	76.1	Confident	71.7	Confident	38 Å²	38	84.7 Å²	84.7	39%	0.392	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.6	-4.7	-177	0	0	0	0	0	115.1	G89 I111 C127	G89-G91 PolarHBondContact O-N 2.73Å; G89-G91 VanDerWaalsContact O-N 3.15Å; G91-I111 WeakPolarHBondContact O-CB 3.17Å; G91-I111 VanDerWaalsContact O-CG1 3.32Å; G91-I111 WeakPolarHBondContact O-CG1 3.27Å; G91-I111 PolarHBondContact O-N 3.36Å; G91-C127 PolarHBondContact O-SG 2.75Å
92	L	84.6	Confident	72.1	Confident	12 Å²	12	84.9 Å²	84.9	6%	0.063	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	146.6	176.8	-55.9	171.8	0	0	0	110.9	Y58 A72 E74 C88 G89 C108 V109 C110 C127	Y58-L92 HydrophobicContact CD1-CD1 4.15Å; Y58-L92 HydrophobicContact CD2-CD1 4.13Å; Y58-L92 HydrophobicContact CE1-CD1 3.8Å; Y58-L92 HydrophobicContact CE1-CG 4.04Å; Y58-L92 HydrophobicContact CE2-CD1 3.82Å; Y58-L92 HydrophobicContact CG-CD1 4.32Å; A72-L92 VanDerWaalsContact O-CD1 3.28Å; A72-L92 WeakPolarHBondContact O-CD1 3.4Å; E74-L92 HydrophobicContact CB-CD2 3.75Å; E74-L92 HydrophobicContact CG-CD2 4.22Å; C88-L92 HydrophobicContact CB-CB 3.8Å; G89-L92 WeakPolarHBondContact O-CA 3.37Å; G89-L92 VanDerWaalsContact O-CB 3.27Å; G89-L92 WeakPolarHBondContact O-CB 3.42Å; G89-L92 PolarHBondContact O-N 3.34Å; L92-C108 HydrophobicContact CB-CB 4.29Å; L92-C108 HydrophobicContact CD1-CB 4.23Å; L92-V109 CarbonylContact C-O 3.55Å; L92-V109 WeakPolarHBondContact CA-O 3.3Å; L92-C110 HydrophobicContact CD2-CB 4.39Å; L92-C127 HydrophobicContact CD2-CB 3.71Å
93	R	86.6	Confident	73.3	Confident	109 Å²	109	90 Å²	90	41%	0.411	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	151.7	170	57.4	176.2	163.6	-175	-7.4	110.6	C108 V109 I111	R93-C108 CarbonylContact O-C 2.96Å; R93-C108 WeakPolarHBondContact O-CA 3.42Å; R93-V109 HydrophobicContact CG-CG2 3.7Å; R93-V109 PolarHBondContact N-O 3.06Å; R93-V109 PolarHBondContact O-N 3.31Å; R93-I111 HydrophobicContact CB-CG1 3.94Å; R93-I111 HydrophobicContact CG-CG1 3.97Å
94	C	86.8	Confident	74.3	Confident	55 Å²	55	86.2 Å²	86.2	37%	0.372	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	114.4	175.4	-174.6	0	0	0	0	110.4	C78 C88	C78-C94 HydrophobicContact CB-CB 3.82Å; C78-C94 WeakPolarHBondContact CB-SG 3.12Å; C78-C94 WeakPolarHBondContact SG-CA 3.33Å; C78-C94 WeakPolarHBondContact SG-CB 3.48Å; C78-C94 CovalentContact SG-SG 2.03Å; C78-C94 PolarHBondContact SG-SG 3.28Å; C88-C94 VanDerWaalsContact SG-CA 3.54Å
95	D	86.7	Confident	75.4	Confident	70 Å²	70	90.5 Å²	90.5	37%	0.374	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	163.8	-172.5	-151.5	-15.9	0	0	0	112.6	R106 S107 V109	D95-R106 CarbonylContact O-C 3.54Å; D95-R106 VanDerWaalsContact O-CA 3.28Å; D95-R106 WeakPolarHBondContact O-CA 3.43Å; D95-S107 PolarHBondContact N-O 2.97Å; D95-S107 PolarHBondContact O-N 2.62Å; D95-V109 HydrophobicContact CB-CG2 3.62Å
96	R	85.2	Confident	76.5	Confident	180 Å²	180	90.5 Å²	90.5	68%	0.679	47%	0.465	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.8	106.4	-177.7	-76.1	177.4	173.7	161.9	-2.1	110.9	V104 R105 R106	R96-V104 HydrophobicContact CB-CG1 3.75Å; R96-V104 HydrophobicContact CG-CG1 4.03Å; R96-R105 WeakPolarHBondContact CA-O 3.49Å; R96-R106 HydrophobicContact CG-CG 4.35Å
97	V	80.1	Confident	77.2	Confident	52 Å²	52	87.9 Å²	87.9	32%	0.315	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	139.8	-178.9	-177.3	0	0	0	0	110.9	G99 R105 S107 V109	V97-G99 PolarHBondContact O-N 3.27Å; V97-R105 PolarHBondContact N-O 2.86Å; V97-R105 PolarHBondContact O-N 2.81Å; V97-S107 WeakPolarHBondContact CB-OG 3.47Å; V97-S107 WeakPolarHBondContact CG2-OG 3.44Å; V97-V109 HydrophobicContact CG2-CG1 3.73Å
98	P	76.1	Confident	77.7	Confident	115 Å²	115	86.5 Å²	86.5	75%	0.747	44%	0.443	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.3	122.4	173.4	-22.1	33.9	0	0	0	112.2
99	G	69.9	Low	77.9	Confident	26 Å²	26	87.1 Å²	87.1	27%	0.268	45%	0.446	S	S	.	.			trans	-82	154	173.2	0	0	0	0	0	112.7	V97 S101 G102 R103	V97-G99 PolarHBondContact O-N 3.27Å; G99-S101 PolarHBondContact O-N 2.85Å; G99-G102 PolarHBondContact O-N 3.42Å; G99-R103 VanDerWaalsContact CA-O 3.32Å; G99-R103 WeakPolarHBondContact CA-O 3.22Å; G99-R103 PolarHBondContact N-O 2.63Å
100	R	60.7	Low	78.4	Confident	262 Å²	262	87.2 Å²	87.2	99%	0.989	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-5.5	179.3	-70.3	-174.5	176.7	-177.8	-1.7	116.2
101	S	62.8	Low	78.9	Confident	106 Å²	106	87.6 Å²	87.6	74%	0.741	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.4	30.8	179.6	-46.1	0	0	0	0	111.9	G99 R103	G99-S101 PolarHBondContact O-N 2.85Å; S101-R103 PolarHBondContact O-N 3.25Å
102	G	60.8	Low	79.1	Confident	73 Å²	73	87.2 Å²	87.2	75%	0.753	44%	0.439	S	S	*	.	S	Bend	trans	71	-17.2	-179.8	0	0	0	0	0	115.7	G99 V104	G99-G102 PolarHBondContact O-N 3.42Å; G102-V104 PolarHBondContact O-N 2.64Å
103	R	70.9	Confident	78.8	Confident	204 Å²	204	92.1 Å²	92.1	77%	0.77	47%	0.469	S	S	*	.			trans	-73.8	122.4	176.6	-60.8	-174.8	-173.7	-174.6	2.3	110.6	G99 S101	G99-R103 VanDerWaalsContact CA-O 3.32Å; G99-R103 WeakPolarHBondContact CA-O 3.22Å; G99-R103 PolarHBondContact N-O 2.63Å; S101-R103 PolarHBondContact O-N 3.25Å
104	V	70.7	Confident	78.5	Confident	97 Å²	97	88.8 Å²	88.8	59%	0.588	47%	0.468	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.8	132.9	169.6	-179.3	0	0	0	0	109.5	R96 G102	R96-V104 HydrophobicContact CB-CG1 3.75Å; R96-V104 HydrophobicContact CG-CG1 4.03Å; G102-V104 PolarHBondContact O-N 2.64Å
105	R	81.6	Confident	78.5	Confident	173 Å²	173	89.6 Å²	89.6	65%	0.653	47%	0.467	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.8	151.1	168.8	-80.1	-175.8	166.3	178.8	-4.5	109.8	R96 V97	R96-R105 WeakPolarHBondContact CA-O 3.49Å; V97-R105 PolarHBondContact N-O 2.86Å; V97-R105 PolarHBondContact O-N 2.81Å
106	R	83.9	Confident	78.5	Confident	116 Å²	116	86.3 Å²	86.3	44%	0.438	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	126.9	164.7	-82.6	178.7	168.3	152.8	-7.8	108.6	V77 C78 D95 R96	V77-R106 WeakPolarHBondContact CA-O 3.49Å; C78-R106 PolarHBondContact N-O 3.15Å; C78-R106 VanDerWaalsContact O-CB 3.28Å; C78-R106 WeakPolarHBondContact O-CB 3.44Å; D95-R106 CarbonylContact O-C 3.54Å; D95-R106 VanDerWaalsContact O-CA 3.28Å; D95-R106 WeakPolarHBondContact O-CA 3.43Å; R96-R106 HydrophobicContact CG-CG 4.35Å
107	S	86.9	Confident	78.4	Confident	15 Å²	15	78.2 Å²	78.2	11%	0.105	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	154.4	175.5	51.5	0	0	0	0	112.8	E76 C78 D95 V97 V109	E76-S107 CarbonylContact O-C 3.5Å; E76-S107 WeakPolarHBondContact O-CA 3.39Å; E76-S107 WeakPolarHBondContact O-CB 3.32Å; C78-S107 WeakPolarHBondContact SG-CA 3.39Å; C78-S107 PolarHBondContact SG-N 3.38Å; C78-S107 VanDerWaalsContact SG-N 3.38Å; D95-S107 PolarHBondContact N-O 2.97Å; D95-S107 PolarHBondContact O-N 2.62Å; V97-S107 WeakPolarHBondContact CB-OG 3.47Å; V97-S107 WeakPolarHBondContact CG2-OG 3.44Å; S107-V109 PolarHBondContact O-N 2.82Å
108	C	87.2	Confident	78.5	Confident	0 Å²	0	75.9 Å²	75.9	0%	0	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	126.7	178.9	-61.4	0	0	0	0	111.3	W73 E74 G75 E76 C78 C88 L92 R93	W73-C108 WeakPolarHBondContact O-CB 2.94Å; E74-C108 CarbonylContact C-O 3.59Å; E74-C108 WeakPolarHBondContact CA-O 3.34Å; G75-C108 PolarHBondContact N-O 2.91Å; E76-C108 PolarHBondContact O-N 2.86Å; C78-C108 VanDerWaalsContact CB-SG 3.55Å; C88-C108 WeakPolarHBondContact CA-SG 3.39Å; C88-C108 HydrophobicContact CB-CB 3.83Å; C88-C108 WeakPolarHBondContact CB-SG 3.25Å; C88-C108 WeakPolarHBondContact SG-CA 3.47Å; C88-C108 WeakPolarHBondContact SG-CB 3.5Å; C88-C108 CovalentContact SG-SG 2.04Å; C88-C108 PolarHBondContact SG-SG 2.97Å; L92-C108 HydrophobicContact CB-CB 4.29Å; L92-C108 HydrophobicContact CD1-CB 4.23Å; R93-C108 CarbonylContact O-C 2.96Å; R93-C108 WeakPolarHBondContact O-CA 3.42Å
109	V	87.5	Confident	78.6	Confident	34 Å²	34	73.6 Å²	73.6	21%	0.206	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	149.2	175.3	-60.7	0	0	0	0	109.9	L92 R93 D95 V97 S107 I111	L92-V109 CarbonylContact C-O 3.55Å; L92-V109 WeakPolarHBondContact CA-O 3.3Å; R93-V109 HydrophobicContact CG-CG2 3.7Å; R93-V109 PolarHBondContact N-O 3.06Å; R93-V109 PolarHBondContact O-N 3.31Å; D95-V109 HydrophobicContact CB-CG2 3.62Å; V97-V109 HydrophobicContact CG2-CG1 3.73Å; S107-V109 PolarHBondContact O-N 2.82Å; V109-I111 PolarHBondContact O-N 3.46Å
110	C	87.3	Confident	79.2	Confident	3 Å²	3	76.5 Å²	76.5	2%	0.02	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	137.7	174.9	-158.9	0	0	0	0	111.4	E74 L92 S112 I126 C127	E74-C110 WeakPolarHBondContact OE1-CB 3.36Å; E74-C110 PolarHBondContact OE1-N 2.92Å; L92-C110 HydrophobicContact CD2-CB 4.39Å; C110-S112 VanDerWaalsContact C-N 3.32Å; C110-S112 PolarHBondContact SG-O 3.24Å; C110-I126 VanDerWaalsContact SG-CG2 3.54Å; C110-C127 VanDerWaalsContact CA-SG 3.52Å; C110-C127 HydrophobicContact CB-CB 3.74Å; C110-C127 WeakPolarHBondContact CB-SG 3.22Å; C110-C127 WeakPolarHBondContact SG-CB 3.4Å; C110-C127 PolarHBondContact SG-N 3.32Å; C110-C127 VanDerWaalsContact SG-N 3.37Å; C110-C127 CovalentContact SG-SG 2.04Å; C110-C127 PolarHBondContact SG-SG 2.82Å
111	I	85.3	Confident	80.3	Confident	99 Å²	99	65.4 Å²	65.4	51%	0.508	37%	0.37	S	S	.	.	S	Bend	trans	-64.9	-42	176.3	-67.1	168.5	0	0	0	109.6	G91 R93 V109 V113	G91-I111 WeakPolarHBondContact O-CB 3.17Å; G91-I111 VanDerWaalsContact O-CG1 3.32Å; G91-I111 WeakPolarHBondContact O-CG1 3.27Å; G91-I111 PolarHBondContact O-N 3.36Å; R93-I111 HydrophobicContact CB-CG1 3.94Å; R93-I111 HydrophobicContact CG-CG1 3.97Å; V109-I111 PolarHBondContact O-N 3.46Å; I111-V113 PolarHBondContact O-N 3Å
112	S	80.2	Confident	81.6	Confident	30 Å²	30	67 Å²	67	21%	0.21	36%	0.359	C	S	.	.	S	Bend	trans	-82.9	98.8	168.6	177	0	0	0	0	109.8	C110 R149	C110-S112 VanDerWaalsContact C-N 3.32Å; C110-S112 PolarHBondContact SG-O 3.24Å; S112-R149 PolarHBondContact OG-NH1 2.83Å
113	V	77.6	Confident	82.9	Confident	115 Å²	115	64.7 Å²	64.7	70%	0.697	33%	0.328	S	S	*	.			trans	-74.9	147.4	177	-174.2	0	0	0	0	110.7	I111	I111-V113 PolarHBondContact O-N 3Å
114	G	80.3	Confident	83.6	Confident	39 Å²	39	59.6 Å²	59.6	40%	0.402	32%	0.321	S	S	.	.	S	Bend	trans	113.1	147.6	178.1	0	0	0	0	0	112.8
115	E	86.1	Confident	84.4	Confident	73 Å²	73	55 Å²	55	34%	0.341	29%	0.294	S	S	.	.			trans	-66.7	160.8	174.6	74.4	-178.3	109.7	0	0	111.6	Y123 G150 P151	E115-Y123 CarbonylContact C-O 3.51Å; E115-Y123 VanDerWaalsContact CA-O 3.24Å; E115-Y123 WeakPolarHBondContact CA-O 3.42Å; E115-Y123 WeakPolarHBondContact CB-O 3.45Å; E115-G150 WeakPolarHBondContact O-CA 3.46Å; E115-G150 PolarHBondContact O-N 2.69Å; E115-P151 VanDerWaalsContact CD-CA 3.47Å; E115-P151 HydrophobicContact CG-CB 4.28Å; E115-P151 HydrophobicContact CG-CG 4.21Å; E115-P151 WeakPolarHBondContact OE1-CG 3.4Å; E115-P151 WeakPolarHBondContact OE2-CA 3.36Å
116	V	86.9	Confident	84.6	Confident	1 Å²	1	48.9 Å²	48.9	1%	0.006	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	149.2	178.1	-53.7	0	0	0	0	110.9	Y123 I126 L129 L146 R149	V116-Y123 PolarHBondContact N-O 2.86Å; V116-Y123 PolarHBondContact O-N 3.38Å; V116-I126 HydrophobicContact CG1-CB 4.15Å; V116-L129 HydrophobicContact CG2-CB 4.24Å; V116-L129 HydrophobicContact CG2-CD1 3.98Å; V116-L146 HydrophobicContact CB-CD1 3.73Å; V116-L146 HydrophobicContact CG1-CD1 4.31Å; V116-L146 HydrophobicContact CG2-CD1 3.93Å; V116-R149 HydrophobicContact CG1-CB 4.23Å; V116-R149 HydrophobicContact CG1-CG 3.99Å
117	C	83.6	Confident	84.8	Confident	10 Å²	10	44 Å²	44	7%	0.068	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	122.1	174.8	-162.8	0	0	0	0	110.4	I147 H148 C152	C117-I147 PolarHBondContact O-N 3.45Å; C117-H148 VanDerWaalsContact CB-NE2 3.35Å; C117-H148 WeakPolarHBondContact CB-NE2 3.4Å; C117-H148 PolarHBondContact N-O 3.05Å; C117-H148 PolarHBondContact O-N 2.84Å; C117-C152 WeakPolarHBondContact CA-SG 3.49Å; C117-C152 HydrophobicContact CB-CB 4Å; C117-C152 WeakPolarHBondContact CB-SG 3.22Å; C117-C152 VanDerWaalsContact SG-CA 3.54Å; C117-C152 WeakPolarHBondContact SG-CB 3.48Å; C117-C152 CovalentContact SG-SG 2.04Å; C117-C152 PolarHBondContact SG-SG 3.16Å
118	G	81.9	Confident	84.8	Confident	2 Å²	2	48.2 Å²	48.2	2%	0.021	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	165.2	171.7	0	0	0	0	0	112	D120 G121 L145	G118-D120 PolarHBondContact O-N 3.49Å; G118-G121 PolarHBondContact N-O 3.29Å; G118-G121 PolarHBondContact O-N 2.85Å; G118-L145 CarbonylContact C-O 3.49Å; G118-L145 VanDerWaalsContact CA-O 3.24Å; G118-L145 WeakPolarHBondContact CA-O 3.4Å
119	S	78.2	Confident	84.8	Confident	68 Å²	68	48.4 Å²	48.4	48%	0.476	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-9.2	-177.7	61.8	0	0	0	0	115.6	V144 L145	S119-V144 WeakPolarHBondContact OG-CA 3.38Å; S119-L145 PolarHBondContact N-O 3.49Å; S119-L145 PolarHBondContact OG-N 3.45Å
120	D	82.8	Confident	84.7	Confident	87 Å²	87	47.9 Å²	47.9	47%	0.465	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.4	12.6	176.4	72.5	-16.9	0	0	0	113.9	G118 Y123 K132 V144	G118-D120 PolarHBondContact O-N 3.49Å; D120-Y123 VanDerWaalsContact CG-OH 3.32Å; D120-Y123 WeakPolarHBondContact OD1-CE2 3.47Å; D120-Y123 PolarHBondContact OD1-OH 2.99Å; D120-Y123 PolarHBondContact OD2-OH 2.85Å; D120-K132 IonicContact OD1-NZ 2.57Å; D120-K132 WeakPolarHBondContact OD2-CE 3.12Å; D120-K132 IonicContact OD2-NZ 2.64Å; D120-K132 PolarHBondContact OD2-NZ 2.9Å; D120-V144 WeakPolarHBondContact OD1-CG1 3.41Å; D120-V144 WeakPolarHBondContact OD1-CG2 3.34Å; D120-V144 WeakPolarHBondContact OD2-CG2 3.21Å
121	G	84.3	Confident	84.4	Confident	29 Å²	29	48.5 Å²	48.5	30%	0.299	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	140.2	-167	172.2	0	0	0	0	0	116.2	G118 Y123	G118-G121 PolarHBondContact N-O 3.29Å; G118-G121 PolarHBondContact O-N 2.85Å; G121-Y123 WeakPolarHBondContact O-CD2 3.45Å; G121-Y123 VanDerWaalsContact O-CE2 3.3Å; G121-Y123 WeakPolarHBondContact O-CE2 3.17Å
122	R	89	Confident	84.4	Confident	139 Å²	139	47.9 Å²	47.9	53%	0.525	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	142	-178.9	-80.6	177.7	-99.1	-141.3	-17.4	112.9	C152 D153	R122-C152 HydrophobicContact CG-CB 3.91Å; R122-C152 WeakPolarHBondContact CG-SG 3.25Å; R122-D153 IonicContact CZ-OD1 2.96Å; R122-D153 IonicContact CZ-OD2 3.96Å; R122-D153 VanDerWaalsContact NH1-CG 3.28Å; R122-D153 IonicContact NH1-OD1 2.63Å; R122-D153 IonicContact NH1-OD2 3.25Å; R122-D153 PolarHBondContact NH1-OD2 2.88Å; R122-D153 IonicContact NH2-OD1 3.69Å; R122-D153 PolarHBondContact NH2-OD1 3.33Å; R122-D153 IonicContact NH2-OD2 3.15Å; R122-D153 PolarHBondContact NH2-OD2 3.23Å
123	Y	88.6	Confident	84.7	Confident	24 Å²	24	48.2 Å²	48.2	9%	0.094	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	136.4	172.1	-66.1	-91.2	0	0	0	110.1	E115 V116 D120 G121 S125 R128 L129 K132 V144	E115-Y123 CarbonylContact C-O 3.51Å; E115-Y123 VanDerWaalsContact CA-O 3.24Å; E115-Y123 WeakPolarHBondContact CA-O 3.42Å; E115-Y123 WeakPolarHBondContact CB-O 3.45Å; V116-Y123 PolarHBondContact N-O 2.86Å; V116-Y123 PolarHBondContact O-N 3.38Å; D120-Y123 VanDerWaalsContact CG-OH 3.32Å; D120-Y123 WeakPolarHBondContact OD1-CE2 3.47Å; D120-Y123 PolarHBondContact OD1-OH 2.99Å; D120-Y123 PolarHBondContact OD2-OH 2.85Å; G121-Y123 WeakPolarHBondContact O-CD2 3.45Å; G121-Y123 VanDerWaalsContact O-CE2 3.3Å; G121-Y123 WeakPolarHBondContact O-CE2 3.17Å; Y123-S125 PolarHBondContact O-N 2.79Å; Y123-R128 HydrophobicContact CD1-CB 4.49Å; Y123-L129 HydrophobicContact CD1-CB 4.04Å; Y123-L129 HydrophobicContact CD2-CB 4.17Å; Y123-L129 HydrophobicContact CD2-CD1 3.85Å; Y123-L129 HydrophobicContact CD2-CG 4.17Å; Y123-L129 HydrophobicContact CE2-CD1 4.23Å; Y123-L129 HydrophobicContact CE2-CG 4.37Å; Y123-L129 HydrophobicContact CG-CB 3.84Å; Y123-L129 HydrophobicContact CG-CD1 4.36Å; Y123-L129 HydrophobicContact CG-CG 4.35Å; Y123-K132 HydrophobicContact CE1-CB 4.5Å; Y123-K132 HydrophobicContact CE1-CD 3.8Å; Y123-K132 VanDerWaalsContact OH-CD 3.22Å; Y123-K132 WeakPolarHBondContact OH-CD 3.31Å; Y123-K132 WeakPolarHBondContact OH-CE 3.39Å; Y123-K132 PolarHBondContact OH-NZ 2.61Å; Y123-V144 HydrophobicContact CE2-CG1 3.93Å
124	P	86	Confident	84.8	Confident	97 Å²	97	47.3 Å²	47.3	63%	0.63	26%	0.256	S	S	*	.	S	Bend	trans	-71.6	-9.7	-178.6	30.7	-36.8	0	0	0	113.8	R128	P124-R128 HydrophobicContact CG-CB 4.38Å; P124-R128 HydrophobicContact CG-CG 4.16Å
125	S	87.7	Confident	84.7	Confident	2 Å²	2	52 Å²	52	1%	0.014	26%	0.261	C	S	.	.			trans	-159.2	160.1	174.2	79.2	0	0	0	0	111.2	E74 Y123 C127 R128 L129	E74-S125 WeakPolarHBondContact OE2-CB 3.41Å; E74-S125 PolarHBondContact OE2-OG 2.93Å; Y123-S125 PolarHBondContact O-N 2.79Å; S125-C127 PolarHBondContact O-N 3.47Å; S125-C127 PolarHBondContact OG-N 3.31Å; S125-R128 PolarHBondContact O-N 2.95Å; S125-R128 PolarHBondContact OG-N 3.37Å; S125-L129 PolarHBondContact O-N 3Å
126	I	86.1	Confident	84.4	Confident	44 Å²	44	49.3 Å²	49.3	23%	0.226	25%	0.251	C	S	.	.	H	α-helix	trans	-62.7	-31.6	168.2	-175.8	58.1	0	0	0	112.2	C110 V116 R128 L129 G130 L146	C110-I126 VanDerWaalsContact SG-CG2 3.54Å; V116-I126 HydrophobicContact CG1-CB 4.15Å; I126-R128 VanDerWaalsContact C-N 3.31Å; I126-R128 PolarHBondContact O-N 2.95Å; I126-L129 PolarHBondContact O-N 2.77Å; I126-G130 PolarHBondContact O-N 2.87Å; I126-L146 HydrophobicContact CD1-CD1 3.98Å; I126-L146 HydrophobicContact CD1-CD2 3.8Å; I126-L146 HydrophobicContact CD1-CG 4.34Å
127	C	86.6	Confident	83.9	Confident	12 Å²	12	54.3 Å²	54.3	8%	0.081	28%	0.278	C	S	.	.	H	α-helix	trans	-64.3	-36	177.2	-62	0	0	0	0	111.8	Y58 G91 L92 C110 S125 A131	Y58-C127 PolarHBondContact OH-O 3.39Å; G91-C127 PolarHBondContact O-SG 2.75Å; L92-C127 HydrophobicContact CD2-CB 3.71Å; C110-C127 VanDerWaalsContact CA-SG 3.52Å; C110-C127 HydrophobicContact CB-CB 3.74Å; C110-C127 WeakPolarHBondContact CB-SG 3.22Å; C110-C127 WeakPolarHBondContact SG-CB 3.4Å; C110-C127 PolarHBondContact SG-N 3.32Å; C110-C127 VanDerWaalsContact SG-N 3.37Å; C110-C127 CovalentContact SG-SG 2.04Å; C110-C127 PolarHBondContact SG-SG 2.82Å; S125-C127 PolarHBondContact O-N 3.47Å; S125-C127 PolarHBondContact OG-N 3.31Å; C127-A131 WeakPolarHBondContact O-CB 3.1Å; C127-A131 PolarHBondContact O-N 3.06Å
128	R	86.8	Confident	83.3	Confident	104 Å²	104	58.9 Å²	58.9	39%	0.392	30%	0.302	S	S	.	.	H	α-helix	trans	-70.9	-37.9	175.9	-79.7	-81	173.9	178.2	-1.7	113.2	E74 Y123 P124 S125 I126 K132	E74-R128 PolarHBondContact O-NH2 2.83Å; E74-R128 VanDerWaalsContact OE2-CG 3.3Å; E74-R128 WeakPolarHBondContact OE2-CG 3.35Å; Y123-R128 HydrophobicContact CD1-CB 4.49Å; P124-R128 HydrophobicContact CG-CB 4.38Å; P124-R128 HydrophobicContact CG-CG 4.16Å; S125-R128 PolarHBondContact O-N 2.95Å; S125-R128 PolarHBondContact OG-N 3.37Å; I126-R128 VanDerWaalsContact C-N 3.31Å; I126-R128 PolarHBondContact O-N 2.95Å; R128-K132 PolarHBondContact O-N 3.07Å
129	L	87.3	Confident	83.2	Confident	5 Å²	5	67.5 Å²	67.5	3%	0.026	33%	0.333	C	S	.	.	H	α-helix	trans	-64.2	-48.4	171.4	-171.7	158.7	0	0	0	110.4	V116 Y123 S125 I126 A131 K132 N133 V144 L146	V116-L129 HydrophobicContact CG2-CB 4.24Å; V116-L129 HydrophobicContact CG2-CD1 3.98Å; Y123-L129 HydrophobicContact CD1-CB 4.04Å; Y123-L129 HydrophobicContact CD2-CB 4.17Å; Y123-L129 HydrophobicContact CD2-CD1 3.85Å; Y123-L129 HydrophobicContact CD2-CG 4.17Å; Y123-L129 HydrophobicContact CE2-CD1 4.23Å; Y123-L129 HydrophobicContact CE2-CG 4.37Å; Y123-L129 HydrophobicContact CG-CB 3.84Å; Y123-L129 HydrophobicContact CG-CD1 4.36Å; Y123-L129 HydrophobicContact CG-CG 4.35Å; S125-L129 PolarHBondContact O-N 3Å; I126-L129 PolarHBondContact O-N 2.77Å; L129-A131 VanDerWaalsContact C-N 3.34Å; L129-A131 PolarHBondContact O-N 3.49Å; L129-K132 WeakPolarHBondContact O-CB 3.19Å; L129-K132 PolarHBondContact O-N 3.11Å; L129-N133 PolarHBondContact O-N 2.6Å; L129-V144 HydrophobicContact CD1-CG1 4.18Å; L129-V144 HydrophobicContact CG-CG1 4.16Å; L129-L146 HydrophobicContact CD1-CB 4.25Å; L129-L146 HydrophobicContact CD1-CD1 4.02Å
130	G	85.4	Confident	83.2	Confident	23 Å²	23	71.9 Å²	71.9	24%	0.237	35%	0.352	C	S	.	.	H	α-helix	trans	-58.1	-41.3	176.2	0	0	0	0	0	113.5	I126 K132 N133 R134	I126-G130 PolarHBondContact O-N 2.87Å; G130-K132 VanDerWaalsContact C-N 3.31Å; G130-K132 PolarHBondContact O-N 2.75Å; G130-N133 PolarHBondContact O-N 3.31Å; G130-R134 WeakPolarHBondContact O-CG 3.23Å; G130-R134 PolarHBondContact O-N 3.31Å
131	A	82.6	Confident	82.9	Confident	16 Å²	16	69 Å²	69	13%	0.132	34%	0.343	C	S	.	.	H	α-helix	trans	-62.8	-34.6	175.1	0	0	0	0	0	113.1	C127 L129 R135	C127-A131 WeakPolarHBondContact O-CB 3.1Å; C127-A131 PolarHBondContact O-N 3.06Å; L129-A131 VanDerWaalsContact C-N 3.34Å; L129-A131 PolarHBondContact O-N 3.49Å; A131-R135 PolarHBondContact O-N 3.4Å
132	K	85.2	Confident	82.5	Confident	86 Å²	86	73.6 Å²	73.6	37%	0.374	37%	0.367	S	S	.	.	H	α-helix	trans	-71.3	-42.3	174.9	-174.5	172.9	169.7	178	0	111.7	D120 Y123 R128 L129 G130 R134 R135 A136 V144	D120-K132 IonicContact OD1-NZ 2.57Å; D120-K132 WeakPolarHBondContact OD2-CE 3.12Å; D120-K132 IonicContact OD2-NZ 2.64Å; D120-K132 PolarHBondContact OD2-NZ 2.9Å; Y123-K132 HydrophobicContact CE1-CB 4.5Å; Y123-K132 HydrophobicContact CE1-CD 3.8Å; Y123-K132 VanDerWaalsContact OH-CD 3.22Å; Y123-K132 WeakPolarHBondContact OH-CD 3.31Å; Y123-K132 WeakPolarHBondContact OH-CE 3.39Å; Y123-K132 PolarHBondContact OH-NZ 2.61Å; R128-K132 PolarHBondContact O-N 3.07Å; L129-K132 WeakPolarHBondContact O-CB 3.19Å; L129-K132 PolarHBondContact O-N 3.11Å; G130-K132 VanDerWaalsContact C-N 3.31Å; G130-K132 PolarHBondContact O-N 2.75Å; K132-R134 PolarHBondContact O-N 3.34Å; K132-R135 CarbonylContact O-C 3.58Å; K132-R135 WeakPolarHBondContact O-CA 3.41Å; K132-R135 WeakPolarHBondContact O-CB 3.35Å; K132-R135 PolarHBondContact O-N 3.49Å; K132-A136 PolarHBondContact O-N 3.32Å; K132-V144 HydrophobicContact CD-CG2 4Å; K132-V144 HydrophobicContact CG-CG2 4.4Å
133	N	86.2	Confident	82.2	Confident	37 Å²	37	71 Å²	71	20%	0.198	36%	0.363	C	S	.	.	H	α-helix	trans	-60.6	-45.2	175	-74.4	0.3	0	0	0	112.1	L129 G130 R135 A136 N137 L143 V144	L129-N133 PolarHBondContact O-N 2.6Å; G130-N133 PolarHBondContact O-N 3.31Å; N133-R135 PolarHBondContact O-N 3.49Å; N133-A136 PolarHBondContact O-N 3.15Å; N133-A136 VanDerWaalsContact O-N 3.16Å; N133-N137 WeakPolarHBondContact O-CB 3.27Å; N133-N137 PolarHBondContact O-N 3.38Å; N133-L143 HydrophobicContact CB-CD2 4.18Å; N133-V144 PolarHBondContact ND2-O 3.23Å; N133-V144 WeakPolarHBondContact OD1-CA 3.19Å; N133-V144 VanDerWaalsContact OD1-CB 3.31Å; N133-V144 WeakPolarHBondContact OD1-CB 3.25Å; N133-V144 PolarHBondContact OD1-N 2.84Å; N133-V144 PolarHBondContact OD1-O 2.75Å
134	R	78.9	Confident	82	Confident	96 Å²	96	70 Å²	70	36%	0.362	36%	0.36	S	S	.	.	H	α-helix	trans	-57.6	-31.7	172.4	-69.3	172.6	-176.2	167.2	1.9	112.3	H57 Y58 G130 K132 L138	H57-R134 WeakPolarHBondContact O-CD 3.15Å; H57-R134 PolarHBondContact O-NH1 3Å; Y58-R134 VanDerWaalsContact CD1-NH1 3.27Å; G130-R134 WeakPolarHBondContact O-CG 3.23Å; G130-R134 PolarHBondContact O-N 3.31Å; K132-R134 PolarHBondContact O-N 3.34Å; R134-L138 WeakPolarHBondContact O-CD1 3.12Å; R134-L138 WeakPolarHBondContact O-CG 3.02Å
135	R	78.2	Confident	81.6	Confident	136 Å²	136	71.3 Å²	71.3	51%	0.513	36%	0.36	S	S	.	.	H	α-helix	trans	-77.1	-36.7	176	-159.9	177.4	-176.9	179.3	2.3	113.4	A131 K132 N133	A131-R135 PolarHBondContact O-N 3.4Å; K132-R135 CarbonylContact O-C 3.58Å; K132-R135 WeakPolarHBondContact O-CA 3.41Å; K132-R135 WeakPolarHBondContact O-CB 3.35Å; K132-R135 PolarHBondContact O-N 3.49Å; N133-R135 PolarHBondContact O-N 3.49Å
136	A	79.6	Confident	81.3	Confident	17 Å²	17	74.9 Å²	74.9	14%	0.14	38%	0.379	C	S	.	.	H	α-helix	trans	-68.6	-45.3	177	0	0	0	0	0	111.1	K132 N133 L138 R139 D140 G141 P142 L143	K132-A136 PolarHBondContact O-N 3.32Å; N133-A136 PolarHBondContact O-N 3.15Å; N133-A136 VanDerWaalsContact O-N 3.16Å; A136-L138 PolarHBondContact O-N 3.16Å; A136-R139 CarbonylContact O-C 3.52Å; A136-R139 PolarHBondContact O-N 3.33Å; A136-D140 PolarHBondContact O-N 2.79Å; A136-G141 PolarHBondContact O-N 3.49Å; A136-P142 WeakPolarHBondContact CB-O 3.31Å; A136-L143 HydrophobicContact CB-CD2 4.21Å
137	N	76.3	Confident	80.6	Confident	106 Å²	106	76.4 Å²	76.4	57%	0.567	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-8.8	177.9	-156.7	98.6	0	0	0	114.8	N133 L143	N133-N137 WeakPolarHBondContact O-CB 3.27Å; N133-N137 PolarHBondContact O-N 3.38Å; N137-L143 HydrophobicContact CB-CD2 4.11Å
138	L	71.6	Confident	79.9	Confident	107 Å²	107	78.1 Å²	78.1	56%	0.56	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.1	11.1	175	-70.9	170.5	0	0	0	112.5	C56 R134 A136	C56-L138 HydrophobicContact CB-CD1 3.46Å; C56-L138 VanDerWaalsContact CB-CD1 3.46Å; C56-L138 VanDerWaalsContact SG-CD1 3.51Å; R134-L138 WeakPolarHBondContact O-CD1 3.12Å; R134-L138 WeakPolarHBondContact O-CG 3.02Å; A136-L138 PolarHBondContact O-N 3.16Å
139	R	79.6	Confident	79.5	Confident	182 Å²	182	81.3 Å²	81.3	69%	0.687	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-140	15	179.7	-66.1	-177	165.6	-149.2	-10	111.4	A136 G141	A136-R139 CarbonylContact O-C 3.52Å; A136-R139 PolarHBondContact O-N 3.33Å; R139-G141 PolarHBondContact O-N 3.04Å
140	D	77.9	Confident	79	Confident	161 Å²	161	82.1 Å²	82.1	86%	0.861	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	44.3	35	-170.9	-55	-39.5	0	0	0	113.8	A136	A136-D140 PolarHBondContact O-N 2.79Å
141	G	76.6	Confident	78.5	Confident	27 Å²	27	83 Å²	83	28%	0.278	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-92.7	160.6	-179.3	0	0	0	0	0	113.2	A136 R139 L143	A136-G141 PolarHBondContact O-N 3.49Å; R139-G141 PolarHBondContact O-N 3.04Å; G141-L143 PolarHBondContact O-N 3.2Å
142	P	75.5	Confident	77.8	Confident	124 Å²	124	84.2 Å²	84.2	81%	0.805	42%	0.424	S	S	*	.	P	Polyproline II helix	trans	-62.1	136.3	-179.2	25.8	-34.2	0	0	0	112.2	A136	A136-P142 WeakPolarHBondContact CB-O 3.31Å
143	L	83.2	Confident	76.8	Confident	85 Å²	85	85.1 Å²	85.1	45%	0.445	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-79.1	142.6	175.6	-60.1	177.4	0	0	0	110.9	N133 A136 N137 G141	N133-L143 HydrophobicContact CB-CD2 4.18Å; A136-L143 HydrophobicContact CB-CD2 4.21Å; N137-L143 HydrophobicContact CB-CD2 4.11Å; G141-L143 PolarHBondContact O-N 3.2Å
144	V	83.9	Confident	75.1	Confident	4 Å²	4	86.3 Å²	86.3	2%	0.024	44%	0.444	C	S	.	.			trans	-86.6	115.4	172.1	-176.6	0	0	0	0	108.9	S119 D120 Y123 L129 K132 N133	S119-V144 WeakPolarHBondContact OG-CA 3.38Å; D120-V144 WeakPolarHBondContact OD1-CG1 3.41Å; D120-V144 WeakPolarHBondContact OD1-CG2 3.34Å; D120-V144 WeakPolarHBondContact OD2-CG2 3.21Å; Y123-V144 HydrophobicContact CE2-CG1 3.93Å; L129-V144 HydrophobicContact CD1-CG1 4.18Å; L129-V144 HydrophobicContact CG-CG1 4.16Å; K132-V144 HydrophobicContact CD-CG2 4Å; K132-V144 HydrophobicContact CG-CG2 4.4Å; N133-V144 PolarHBondContact ND2-O 3.23Å; N133-V144 WeakPolarHBondContact OD1-CA 3.19Å; N133-V144 VanDerWaalsContact OD1-CB 3.31Å; N133-V144 WeakPolarHBondContact OD1-CB 3.25Å; N133-V144 PolarHBondContact OD1-N 2.84Å; N133-V144 PolarHBondContact OD1-O 2.75Å
145	L	78.5	Confident	73.7	Confident	123 Å²	123	89.1 Å²	89.1	64%	0.644	47%	0.471	S	S	*	.			trans	-75	135.4	173.8	-56.9	177.9	0	0	0	109.2	G118 S119 I147	G118-L145 CarbonylContact C-O 3.49Å; G118-L145 VanDerWaalsContact CA-O 3.24Å; G118-L145 WeakPolarHBondContact CA-O 3.4Å; S119-L145 PolarHBondContact N-O 3.49Å; S119-L145 PolarHBondContact OG-N 3.45Å; L145-I147 PolarHBondContact O-N 2.7Å
146	L	80.7	Confident	72.1	Confident	78 Å²	78	85.9 Å²	85.9	41%	0.408	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	119.7	167	173.7	69.4	0	0	0	108.1	V116 I126 L129 H148	V116-L146 HydrophobicContact CB-CD1 3.73Å; V116-L146 HydrophobicContact CG1-CD1 4.31Å; V116-L146 HydrophobicContact CG2-CD1 3.93Å; I126-L146 HydrophobicContact CD1-CD1 3.98Å; I126-L146 HydrophobicContact CD1-CD2 3.8Å; I126-L146 HydrophobicContact CD1-CG 4.34Å; L129-L146 HydrophobicContact CD1-CB 4.25Å; L129-L146 HydrophobicContact CD1-CD1 4.02Å; L146-H148 WeakPolarHBondContact CD1-O 3.45Å
147	I	72.9	Confident	70.2	Confident	75 Å²	75	91.8 Å²	91.8	39%	0.385	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	-55.5	174.2	-48.3	180	0	0	0	109.4	C117 L145	C117-I147 PolarHBondContact O-N 3.45Å; L145-I147 PolarHBondContact O-N 2.7Å
148	H	71.9	Confident	68.9	Low	48 Å²	48	93.7 Å²	93.7	22%	0.222	51%	0.506	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.6	171	178.8	67.1	95	0	0	0	111.8	C117 L146 P151	C117-H148 VanDerWaalsContact CB-NE2 3.35Å; C117-H148 WeakPolarHBondContact CB-NE2 3.4Å; C117-H148 PolarHBondContact N-O 3.05Å; C117-H148 PolarHBondContact O-N 2.84Å; L146-H148 WeakPolarHBondContact CD1-O 3.45Å; H148-P151 PolarHBondContact CE1-O 3.28Å
149	R	78.6	Confident	67.8	Low	172 Å²	172	95.2 Å²	95.2	65%	0.649	51%	0.51	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.6	150.1	167.3	-56.8	-174.5	-174.1	177.5	4.1	109.9	S112 V116	S112-R149 PolarHBondContact OG-NH1 2.83Å; V116-R149 HydrophobicContact CG1-CB 4.23Å; V116-R149 HydrophobicContact CG1-CG 3.99Å
150	G	75.8	Confident	66.3	Low	22 Å²	22	91.2 Å²	91.2	23%	0.227	51%	0.507	C	S	.	.	S	Bend	trans	95	169.2	-170.3	0	0	0	0	0	113.6	E115	E115-G150 WeakPolarHBondContact O-CA 3.46Å; E115-G150 PolarHBondContact O-N 2.69Å
151	P	75.6	Confident	65	Low	40 Å²	40	87.2 Å²	87.2	26%	0.26	50%	0.504	S	S	.	.			trans	-61.3	140.1	-178.9	-4.2	5.1	0	0	0	113	E115 H148 D153 S154	E115-P151 VanDerWaalsContact CD-CA 3.47Å; E115-P151 HydrophobicContact CG-CB 4.28Å; E115-P151 HydrophobicContact CG-CG 4.21Å; E115-P151 WeakPolarHBondContact OE1-CG 3.4Å; E115-P151 WeakPolarHBondContact OE2-CA 3.36Å; H148-P151 PolarHBondContact CE1-O 3.28Å; P151-D153 PolarHBondContact O-N 3.1Å; P151-S154 VanDerWaalsContact CD-OG 3.3Å; P151-S154 WeakPolarHBondContact CD-OG 3.39Å; P151-S154 WeakPolarHBondContact CG-OG 3.32Å; P151-S154 PolarHBondContact O-N 3.22Å; P151-S154 VanDerWaalsContact O-N 3.12Å; P151-S154 PolarHBondContact O-OG 3.38Å
152	C	67.9	Low	64.1	Low	42 Å²	42	87.9 Å²	87.9	28%	0.284	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-21.2	174.8	-66.4	0	0	0	0	114.1	C117 R122	C117-C152 WeakPolarHBondContact CA-SG 3.49Å; C117-C152 HydrophobicContact CB-CB 4Å; C117-C152 WeakPolarHBondContact CB-SG 3.22Å; C117-C152 VanDerWaalsContact SG-CA 3.54Å; C117-C152 WeakPolarHBondContact SG-CB 3.48Å; C117-C152 CovalentContact SG-SG 2.04Å; C117-C152 PolarHBondContact SG-SG 3.16Å; R122-C152 HydrophobicContact CG-CB 3.91Å; R122-C152 WeakPolarHBondContact CG-SG 3.25Å
153	D	63.8	Low	63.5	Low	106 Å²	106	88.6 Å²	88.6	57%	0.567	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	-13.9	-175.9	-54.5	-2	0	0	0	112.6	R122 P151 V155	R122-D153 IonicContact CZ-OD1 2.96Å; R122-D153 IonicContact CZ-OD2 3.96Å; R122-D153 VanDerWaalsContact NH1-CG 3.28Å; R122-D153 IonicContact NH1-OD1 2.63Å; R122-D153 IonicContact NH1-OD2 3.25Å; R122-D153 PolarHBondContact NH1-OD2 2.88Å; R122-D153 IonicContact NH2-OD1 3.69Å; R122-D153 PolarHBondContact NH2-OD1 3.33Å; R122-D153 IonicContact NH2-OD2 3.15Å; R122-D153 PolarHBondContact NH2-OD2 3.23Å; P151-D153 PolarHBondContact O-N 3.1Å; D153-V155 PolarHBondContact O-N 2.8Å
154	S	51.1	Low	62.4	Low	61 Å²	61	92 Å²	92	43%	0.427	51%	0.505	S	S	.	.	S	Bend	trans	-86	101.5	-174.6	61.9	0	0	0	0	111.8	P151 G156	P151-S154 VanDerWaalsContact CD-OG 3.3Å; P151-S154 WeakPolarHBondContact CD-OG 3.39Å; P151-S154 WeakPolarHBondContact CG-OG 3.32Å; P151-S154 PolarHBondContact O-N 3.22Å; P151-S154 VanDerWaalsContact O-N 3.12Å; P151-S154 PolarHBondContact O-OG 3.38Å; S154-G156 PolarHBondContact O-N 2.81Å
155	V	49.1	Very low	61.5	Low	155 Å²	155	97.2 Å²	97.2	94%	0.939	53%	0.526	S	S	*	.	S	Bend	trans	-16.9	110.9	165.2	-175.2	0	0	0	0	113.8	D153	D153-V155 PolarHBondContact O-N 2.8Å
156	G	44	Very low	60.9	Low	68 Å²	68	98.3 Å²	98.3	70%	0.701	53%	0.525	S	S	*	.			trans	-173.6	-56.4	178.1	0	0	0	0	0	116.6	S154	S154-G156 PolarHBondContact O-N 2.81Å
157	M	40.2	Very low	60.6	Low	141 Å²	141	99.1 Å²	99.1	70%	0.695	53%	0.526	S	S	*	.	S	Bend	trans	-136.6	87.3	-174.2	-93.8	-177.7	-179.7	0	0	115.1
158	R	49.1	Very low	60.7	Low	146 Å²	146	99 Å²	99	55%	0.551	53%	0.526	S	S	*	.			trans	40.2	83.5	141	-53.7	-171.7	-166.7	135.7	-4.5	117.9	Y165	R158-Y165 HydrophobicContact CB-CD2 4.07Å; R158-Y165 HydrophobicContact CB-CE2 3.46Å; R158-Y165 VanDerWaalsContact CB-CE2 3.46Å; R158-Y165 WeakPolarHBondContact CD-OH 3.27Å; R158-Y165 HydrophobicContact CG-CE2 4.19Å; R158-Y165 PolarHBondContact NH1-OH 2.99Å
159	H	48.7	Very low	61.1	Low	140 Å²	140	100.9 Å²	100.9	65%	0.648	53%	0.533	S	S	*	.			trans	41	93.2	138.3	-50	-73.6	0	0	0	117.8	G161 S162	H159-G161 PolarHBondContact O-N 2.98Å; H159-G161 VanDerWaalsContact O-N 3.14Å; H159-S162 VanDerWaalsContact O-CB 3.31Å; H159-S162 WeakPolarHBondContact O-CB 3.34Å; H159-S162 PolarHBondContact O-N 2.93Å
160	P	48.4	Very low	61.3	Low	97 Å²	97	94.3 Å²	94.3	63%	0.63	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-16.4	165.6	25.7	-34.3	0	0	0	113.6
161	G	49.9	Very low	61.6	Low	77 Å²	77	96.3 Å²	96.3	79%	0.794	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-3.5	168.5	0	0	0	0	0	115.1	H159	H159-G161 PolarHBondContact O-N 2.98Å; H159-G161 VanDerWaalsContact O-N 3.14Å
162	S	57.2	Low	61.8	Low	41 Å²	41	98.2 Å²	98.2	29%	0.287	53%	0.528	S	S	.	.	S	Bend	trans	-78.7	132.9	177	178.9	0	0	0	0	111	H159 R164 Y165 K166	H159-S162 VanDerWaalsContact O-CB 3.31Å; H159-S162 WeakPolarHBondContact O-CB 3.34Å; H159-S162 PolarHBondContact O-N 2.93Å; S162-R164 PolarHBondContact O-N 3.08Å; S162-R164 PolarHBondContact OG-N 2.86Å; S162-Y165 PolarHBondContact O-N 3.11Å; S162-K166 PolarHBondContact O-N 3.44Å; S162-K166 VanDerWaalsContact O-N 3.11Å
163	M	63.7	Low	62.5	Low	140 Å²	140	96.4 Å²	96.4	69%	0.69	52%	0.515	S	S	*	.	H	α-helix	trans	-44.4	-39.3	169.9	-58.9	-75.8	-78.4	0	0	112	Y165 K166 F167	M163-Y165 VanDerWaalsContact C-N 3.33Å; M163-Y165 PolarHBondContact O-N 2.62Å; M163-K166 PolarHBondContact O-N 2.76Å; M163-F167 HydrophobicContact CB-CD2 4.17Å; M163-F167 HydrophobicContact CE-CD2 4.24Å; M163-F167 HydrophobicContact CE-CE2 4.16Å; M163-F167 WeakPolarHBondContact O-CB 3.49Å; M163-F167 WeakPolarHBondContact O-CD2 3.45Å; M163-F167 PolarHBondContact O-N 2.9Å; M163-F167 HydrophobicContact SD-CD2 3.97Å; M163-F167 HydrophobicContact SD-CE2 3.59Å; M163-F167 VanDerWaalsContact SD-CE2 3.59Å
164	R	60.4	Low	63.5	Low	155 Å²	155	92.7 Å²	92.7	59%	0.585	50%	0.496	S	S	*	.	H	α-helix	trans	-62.5	-34.1	-177.9	-170	-179.7	179	109.7	4	113.5	S162 N168	S162-R164 PolarHBondContact O-N 3.08Å; S162-R164 PolarHBondContact OG-N 2.86Å; R164-N168 WeakPolarHBondContact O-CB 3.29Å; R164-N168 PolarHBondContact O-N 3.11Å; R164-N168 PolarHBondContact O-ND2 3.41Å
165	Y	63.3	Low	65	Low	114 Å²	114	96.7 Å²	96.7	45%	0.447	51%	0.508	S	S	.	.	H	α-helix	trans	-94.5	-25.3	179.8	-79.3	-98.2	0	0	0	112.4	R158 S162 M163	R158-Y165 HydrophobicContact CB-CD2 4.07Å; R158-Y165 HydrophobicContact CB-CE2 3.46Å; R158-Y165 VanDerWaalsContact CB-CE2 3.46Å; R158-Y165 WeakPolarHBondContact CD-OH 3.27Å; R158-Y165 HydrophobicContact CG-CE2 4.19Å; R158-Y165 PolarHBondContact NH1-OH 2.99Å; S162-Y165 PolarHBondContact O-N 3.11Å; M163-Y165 VanDerWaalsContact C-N 3.33Å; M163-Y165 PolarHBondContact O-N 2.62Å
166	K	67.1	Low	66.5	Low	146 Å²	146	93.6 Å²	93.6	64%	0.635	48%	0.483	S	S	*	.	H	α-helix	trans	-79.7	-27.1	177.4	-169.9	172.1	178.2	-179.8	0	113.7	S162 M163	S162-K166 PolarHBondContact O-N 3.44Å; S162-K166 VanDerWaalsContact O-N 3.11Å; M163-K166 PolarHBondContact O-N 2.76Å
167	F	74.9	Confident	68.3	Low	96 Å²	96	91.2 Å²	91.2	42%	0.421	45%	0.453	S	S	.	.	H	α-helix	trans	-126	-6.5	-171.5	-55.9	-67.1	0	0	0	115.5	M163 F169	M163-F167 HydrophobicContact CB-CD2 4.17Å; M163-F167 HydrophobicContact CE-CD2 4.24Å; M163-F167 HydrophobicContact CE-CE2 4.16Å; M163-F167 WeakPolarHBondContact O-CB 3.49Å; M163-F167 WeakPolarHBondContact O-CD2 3.45Å; M163-F167 PolarHBondContact O-N 2.9Å; M163-F167 HydrophobicContact SD-CD2 3.97Å; M163-F167 HydrophobicContact SD-CE2 3.59Å; M163-F167 VanDerWaalsContact SD-CE2 3.59Å; F167-F169 VanDerWaalsContact O-CD1 3.25Å; F167-F169 WeakPolarHBondContact O-CD1 3.15Å; F167-F169 VanDerWaalsContact O-CE1 3.31Å; F167-F169 WeakPolarHBondContact O-CE1 3.23Å; F167-F169 PolarHBondContact O-N 3.27Å
168	N	74.9	Confident	70.5	Confident	71 Å²	71	84.5 Å²	84.5	38%	0.38	42%	0.421	S	S	.	.			trans	-81	72.5	168	-70.3	6.7	0	0	0	110.5	R164 I170 P171	R164-N168 WeakPolarHBondContact O-CB 3.29Å; R164-N168 PolarHBondContact O-N 3.11Å; R164-N168 PolarHBondContact O-ND2 3.41Å; N168-I170 VanDerWaalsContact C-N 3.33Å; N168-P171 HydrophobicContact CB-CG 4.22Å; N168-P171 WeakPolarHBondContact O-CD 3.28Å
169	F	79.1	Confident	72.1	Confident	88 Å²	88	81 Å²	81	39%	0.386	42%	0.417	S	S	.	.	H	α-helix	trans	-79.1	-15.4	171	39.2	-112.3	0	0	0	113.1	F167 V173 L333	F167-F169 VanDerWaalsContact O-CD1 3.25Å; F167-F169 WeakPolarHBondContact O-CD1 3.15Å; F167-F169 VanDerWaalsContact O-CE1 3.31Å; F167-F169 WeakPolarHBondContact O-CE1 3.23Å; F167-F169 PolarHBondContact O-N 3.27Å; F169-V173 WeakPolarHBondContact O-CG2 3.27Å; F169-V173 PolarHBondContact O-N 3Å; F169-L333 HydrophobicContact CD2-CD1 3.44Å; F169-L333 VanDerWaalsContact CD2-CD1 3.44Å; F169-L333 HydrophobicContact CE2-CD1 3.41Å; F169-L333 VanDerWaalsContact CE2-CD1 3.41Å; F169-L333 HydrophobicContact CG-CD1 4.42Å; F169-L333 HydrophobicContact CZ-CD1 4.37Å
170	I	82.5	Confident	73.7	Confident	34 Å²	34	74.8 Å²	74.8	17%	0.174	39%	0.39	C	S	.	.	H	α-helix	trans	-65.4	-47.2	-179.2	-52.6	-62.3	0	0	0	112.7	N168 D172 V173 V174 V278 V290 I292 L333	N168-I170 VanDerWaalsContact C-N 3.33Å; I170-D172 PolarHBondContact O-N 2.85Å; I170-V173 PolarHBondContact O-N 2.89Å; I170-V173 VanDerWaalsContact O-N 3.12Å; I170-V174 HydrophobicContact CG2-CG2 4.03Å; I170-V174 WeakPolarHBondContact O-CG2 3.47Å; I170-V174 PolarHBondContact O-N 3.31Å; I170-V278 HydrophobicContact CD1-CG2 4.07Å; I170-V278 HydrophobicContact CG2-CG2 4.45Å; I170-V290 HydrophobicContact CG2-CG1 4.49Å; I170-I292 HydrophobicContact CD1-CD1 3.47Å; I170-I292 VanDerWaalsContact CD1-CD1 3.47Å; I170-I292 HydrophobicContact CD1-CG1 3.98Å; I170-I292 HydrophobicContact CG1-CD1 3.92Å; I170-L333 HydrophobicContact CD1-CD1 3.79Å; I170-L333 HydrophobicContact CD1-CD2 3.58Å; I170-L333 HydrophobicContact CD1-CG 4.34Å
171	P	81.8	Confident	75.6	Confident	65 Å²	65	70.2 Å²	70.2	42%	0.422	36%	0.36	S	S	.	.	H	α-helix	trans	-56.1	-45	176.8	-26.6	37.2	0	0	0	113.2	N168 V173 V174 E175	N168-P171 HydrophobicContact CB-CG 4.22Å; N168-P171 WeakPolarHBondContact O-CD 3.28Å; P171-V173 PolarHBondContact O-N 3.49Å; P171-V174 PolarHBondContact O-N 3.2Å; P171-E175 VanDerWaalsContact O-CB 3.28Å; P171-E175 WeakPolarHBondContact O-CB 3.48Å; P171-E175 PolarHBondContact O-N 3.34Å
172	D	80.2	Confident	77.4	Confident	80 Å²	80	66.6 Å²	66.6	43%	0.428	32%	0.322	S	S	.	.	H	α-helix	trans	-58.2	-32.4	177.6	-62.6	24.1	0	0	0	113.4	I170 R336	I170-D172 PolarHBondContact O-N 2.85Å; D172-R336 PolarHBondContact O-NH1 2.93Å
173	V	82.6	Confident	78.9	Confident	3 Å²	3	64.8 Å²	64.8	2%	0.018	31%	0.309	C	S	.	.	H	α-helix	trans	-79.1	-49	178.9	173.6	0	0	0	0	109.3	F169 I170 P171 E175 K176 I177 V278 L333 R336	F169-V173 WeakPolarHBondContact O-CG2 3.27Å; F169-V173 PolarHBondContact O-N 3Å; I170-V173 PolarHBondContact O-N 2.89Å; I170-V173 VanDerWaalsContact O-N 3.12Å; P171-V173 PolarHBondContact O-N 3.49Å; V173-E175 PolarHBondContact O-N 3.26Å; V173-K176 PolarHBondContact O-N 2.97Å; V173-I177 HydrophobicContact CG1-CD1 3.42Å; V173-I177 VanDerWaalsContact CG1-CD1 3.42Å; V173-I177 VanDerWaalsContact O-CD1 3.22Å; V173-I177 WeakPolarHBondContact O-CD1 3.44Å; V173-I177 WeakPolarHBondContact O-CG1 3.35Å; V173-I177 PolarHBondContact O-N 3.07Å; V173-I177 VanDerWaalsContact O-N 3.15Å; V173-V278 HydrophobicContact CG1-CG2 4.29Å; V173-L333 HydrophobicContact CB-CD2 4.23Å; V173-L333 HydrophobicContact CG1-CD2 4.08Å; V173-L333 HydrophobicContact CG2-CD2 3.95Å; V173-R336 HydrophobicContact CG2-CG 4.11Å
174	V	84.6	Confident	79.9	Confident	28 Å²	28	58.1 Å²	58.1	17%	0.17	28%	0.276	C	S	.	.	H	α-helix	trans	-57.9	-46.7	175.5	172.7	0	0	0	0	112	I170 P171 K176 I177 A178 V278 V290	I170-V174 HydrophobicContact CG2-CG2 4.03Å; I170-V174 WeakPolarHBondContact O-CG2 3.47Å; I170-V174 PolarHBondContact O-N 3.31Å; P171-V174 PolarHBondContact O-N 3.2Å; V174-K176 PolarHBondContact O-N 2.9Å; V174-I177 PolarHBondContact O-N 3.5Å; V174-A178 HydrophobicContact CG1-CB 4.47Å; V174-A178 WeakPolarHBondContact O-CB 3.42Å; V174-A178 PolarHBondContact O-N 2.98Å; V174-V278 HydrophobicContact CG2-CG1 4.39Å; V174-V290 HydrophobicContact CG1-CG2 3.83Å; V174-V290 HydrophobicContact CG2-CB 4.34Å; V174-V290 HydrophobicContact CG2-CG1 3.55Å; V174-V290 HydrophobicContact CG2-CG2 3.84Å
175	E	82.5	Confident	81	Confident	145 Å²	145	51.9 Å²	51.9	68%	0.678	25%	0.254	S	S	*	.	H	α-helix	trans	-59	-36.8	-178.5	-175.7	174.7	-170.8	0	0	111.9	P171 V173 P179	P171-E175 VanDerWaalsContact O-CB 3.28Å; P171-E175 WeakPolarHBondContact O-CB 3.48Å; P171-E175 PolarHBondContact O-N 3.34Å; V173-E175 PolarHBondContact O-N 3.26Å; E175-P179 WeakPolarHBondContact O-CD 3.19Å
176	K	81.4	Confident	81.7	Confident	91 Å²	91	46.5 Å²	46.5	40%	0.396	23%	0.233	S	C	.	.	H	α-helix	trans	-75	-36.4	177.8	-168.3	-168.7	172.4	-156.9	0	113.1	V173 V174 R336	V173-K176 PolarHBondContact O-N 2.97Å; V174-K176 PolarHBondContact O-N 2.9Å; K176-R336 HydrophobicContact CD-CB 4.28Å
177	I	82.8	Confident	82.1	Confident	17 Å²	17	41.1 Å²	41.1	9%	0.087	21%	0.21	C	C	.	.	H	α-helix	trans	-88.1	-38.2	-173.2	-58.6	157.1	0	0	0	111.5	V173 V174 P179 A180 V181 V280 P329 V331	V173-I177 HydrophobicContact CG1-CD1 3.42Å; V173-I177 VanDerWaalsContact CG1-CD1 3.42Å; V173-I177 VanDerWaalsContact O-CD1 3.22Å; V173-I177 WeakPolarHBondContact O-CD1 3.44Å; V173-I177 WeakPolarHBondContact O-CG1 3.35Å; V173-I177 PolarHBondContact O-N 3.07Å; V173-I177 VanDerWaalsContact O-N 3.15Å; V174-I177 PolarHBondContact O-N 3.5Å; I177-P179 VanDerWaalsContact C-N 3.31Å; I177-P179 VanDerWaalsContact O-N 3.12Å; I177-A180 PolarHBondContact O-N 2.63Å; I177-V181 HydrophobicContact CG2-CG2 3.9Å; I177-V181 PolarHBondContact O-N 3.43Å; I177-V280 HydrophobicContact CD1-CG2 4.49Å; I177-V280 HydrophobicContact CG2-CG2 4.3Å; I177-P329 HydrophobicContact CG2-CG 4.16Å; I177-V331 HydrophobicContact CD1-CB 3.8Å; I177-V331 HydrophobicContact CD1-CG1 3.65Å; I177-V331 HydrophobicContact CD1-CG2 3.85Å; I177-V331 HydrophobicContact CG1-CG1 4.39Å; I177-V331 HydrophobicContact CG1-CG2 4.49Å; I177-V331 HydrophobicContact CG2-CG2 4.33Å
178	A	84.4	Confident	81.8	Confident	1 Å²	1	40.6 Å²	40.6	1%	0.008	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-53.8	-30.6	-173.3	0	0	0	0	0	116	V174 A180 K231	V174-A178 HydrophobicContact CG1-CB 4.47Å; V174-A178 WeakPolarHBondContact O-CB 3.42Å; V174-A178 PolarHBondContact O-N 2.98Å; A178-A180 VanDerWaalsContact C-N 3.28Å; A178-A180 PolarHBondContact O-N 3.48Å; A178-K231 HydrophobicContact CB-CD 4Å; A178-K231 WeakPolarHBondContact O-CD 3.42Å
179	P	83.7	Confident	81.2	Confident	72 Å²	72	45.8 Å²	45.8	47%	0.468	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-69.2	-21.3	173.5	-20.5	34.2	0	0	0	114.6	E175 I177	E175-P179 WeakPolarHBondContact O-CD 3.19Å; I177-P179 VanDerWaalsContact C-N 3.31Å; I177-P179 VanDerWaalsContact O-N 3.12Å
180	A	83.1	Confident	80.2	Confident	10 Å²	10	42.7 Å²	42.7	8%	0.083	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-99.9	-0.7	179.7	0	0	0	0	0	113.2	I177 A178 F205 V206 C263	I177-A180 PolarHBondContact O-N 2.63Å; A178-A180 VanDerWaalsContact C-N 3.28Å; A178-A180 PolarHBondContact O-N 3.48Å; A180-F205 CarbonylContact O-C 3.56Å; A180-F205 WeakPolarHBondContact O-CA 3.41Å; A180-F205 WeakPolarHBondContact O-CB 3.21Å; A180-V206 PolarHBondContact O-N 3.08Å; A180-C263 HydrophobicContact CB-CB 3.72Å
181	V	88.6	Confident	78.9	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.006	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	136.9	172.2	177.9	0	0	0	0	108.8	I177 G204 V280 P329	I177-V181 HydrophobicContact CG2-CG2 3.9Å; I177-V181 PolarHBondContact O-N 3.43Å; V181-G204 WeakPolarHBondContact CA-O 3.39Å; V181-V280 HydrophobicContact CB-CG1 4.49Å; V181-V280 HydrophobicContact CG1-CG1 4.45Å; V181-V280 HydrophobicContact CG2-CB 4.27Å; V181-V280 HydrophobicContact CG2-CG1 3.84Å; V181-P329 HydrophobicContact CG2-CG 3.8Å
182	A	87.1	Confident	78	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	150	-176	0	0	0	0	0	111.1	S203 G204 I213 V228 L230	A182-S203 WeakPolarHBondContact O-CA 3.47Å; A182-G204 PolarHBondContact N-O 3Å; A182-G204 PolarHBondContact O-N 3.46Å; A182-I213 HydrophobicContact CB-CD1 4.25Å; A182-V228 HydrophobicContact CB-CG1 3.93Å; A182-L230 HydrophobicContact CB-CD2 3.78Å
183	H	89.1	Confident	76.9	Confident	3 Å²	3	53.9 Å²	53.9	1%	0.014	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	145.2	164.9	-169.3	54	0	0	0	109.5	E185 S201 V228 E229 S282 P283 F284	H183-E185 WeakPolarHBondContact NE2-CG 3.35Å; H183-S201 PolarHBondContact CE1-OG 2.73Å; H183-V228 WeakPolarHBondContact O-CA 3.5Å; H183-E229 HydrophobicContact CB-CB 4.23Å; H183-E229 PolarHBondContact N-O 2.73Å; H183-E229 PolarHBondContact O-N 2.66Å; H183-E229 VanDerWaalsContact O-N 3.1Å; H183-S282 PolarHBondContact ND1-O 3.31Å; H183-P283 PolarHBondContact CE1-O 3.2Å; H183-F284 PolarHBondContact CE1-N 3.17Å
184	L	84	Confident	75.8	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	124.3	178	-75.8	157.4	0	0	0	109.5	S201 G202 T215 V219 V226 K227 V228 I257	L184-S201 CarbonylContact O-C 3.55Å; L184-S201 VanDerWaalsContact O-CA 3.25Å; L184-S201 WeakPolarHBondContact O-CA 3.41Å; L184-G202 PolarHBondContact N-O 2.93Å; L184-G202 PolarHBondContact O-N 3.47Å; L184-T215 VanDerWaalsContact CD1-CB 3.43Å; L184-T215 HydrophobicContact CD1-CG2 3.6Å; L184-T215 VanDerWaalsContact CD1-OG1 3.23Å; L184-T215 WeakPolarHBondContact CD1-OG1 3.48Å; L184-V219 HydrophobicContact CB-CG1 4.35Å; L184-V226 HydrophobicContact CD2-CG1 3.51Å; L184-K227 WeakPolarHBondContact CA-O 3.35Å; L184-V228 HydrophobicContact CD2-CG2 3.66Å; L184-I257 HydrophobicContact CD2-CD1 3.65Å
185	E	83.3	Confident	74.5	Confident	25 Å²	25	69.4 Å²	69.4	12%	0.117	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	135.7	172.2	-62	-178.7	114.1	0	0	109.2	H183 F187 K227	H183-E185 WeakPolarHBondContact NE2-CG 3.35Å; E185-F187 HydrophobicContact CB-CD2 4.29Å; E185-F187 HydrophobicContact CB-CE2 3.49Å; E185-F187 VanDerWaalsContact CB-CE2 3.49Å; E185-F187 HydrophobicContact CB-CZ 4.03Å; E185-K227 HydrophobicContact CB-CB 4.34Å; E185-K227 PolarHBondContact N-O 2.93Å; E185-K227 PolarHBondContact O-N 2.97Å; E185-K227 WeakPolarHBondContact OE2-CD 3.34Å; E185-K227 IonicContact OE2-NZ 2.92Å; E185-K227 PolarHBondContact OE2-NZ 2.94Å
186	L	78.4	Confident	73.6	Confident	1 Å²	1	66.1 Å²	66.1	1%	0.005	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	126.7	175.7	-85.4	83.6	0	0	0	111.6	I198 M199 S200 V219 L220 V226	L186-I198 CarbonylContact O-C 3.57Å; L186-I198 WeakPolarHBondContact O-CA 3.23Å; L186-M199 PolarHBondContact O-N 3.07Å; L186-S200 PolarHBondContact N-O 3.5Å; L186-V219 HydrophobicContact CD1-CG1 4Å; L186-V219 VanDerWaalsContact CD1-O 3.32Å; L186-V219 WeakPolarHBondContact CD1-O 3.43Å; L186-V219 WeakPolarHBondContact CD2-O 3.42Å; L186-L220 HydrophobicContact CD1-CD2 4.44Å; L186-V226 HydrophobicContact CD1-CG1 4.36Å; L186-V226 HydrophobicContact CD1-CG2 4.39Å; L186-V226 HydrophobicContact CD2-CG2 4.33Å; L186-V226 HydrophobicContact CG-CG2 4.08Å
187	F	75.3	Confident	73	Confident	33 Å²	33	65.5 Å²	65.5	15%	0.145	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	116.6	-173.4	-70.7	-88.2	0	0	0	112.4	E185 E196 V197 I198 Q224 R225 K227	E185-F187 HydrophobicContact CB-CD2 4.29Å; E185-F187 HydrophobicContact CB-CE2 3.49Å; E185-F187 VanDerWaalsContact CB-CE2 3.49Å; E185-F187 HydrophobicContact CB-CZ 4.03Å; F187-E196 HydrophobicContact CB-CB 4.22Å; F187-E196 HydrophobicContact CD1-CB 3.85Å; F187-E196 HydrophobicContact CG-CB 4.43Å; F187-V197 WeakPolarHBondContact CA-O 3.4Å; F187-I198 HydrophobicContact CD1-CG1 4.04Å; F187-I198 HydrophobicContact CE1-CD1 4.21Å; F187-I198 HydrophobicContact CE1-CG1 3.43Å; F187-I198 VanDerWaalsContact CE1-CG1 3.43Å; F187-I198 HydrophobicContact CZ-CD1 4.32Å; F187-I198 HydrophobicContact CZ-CG1 3.82Å; F187-Q224 WeakPolarHBondContact O-CB 3.47Å; F187-R225 PolarHBondContact N-O 2.73Å; F187-K227 HydrophobicContact CD2-CB 4.1Å; F187-K227 HydrophobicContact CE2-CB 3.69Å; F187-K227 HydrophobicContact CE2-CD 3.68Å; F187-K227 HydrophobicContact CE2-CG 4.36Å; F187-K227 HydrophobicContact CZ-CD 4.12Å
188	Q	68.8	Low	72.3	Confident	85 Å²	85	69 Å²	69	40%	0.397	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	128.4	166.1	-173.3	171.3	43.2	0	0	109.4	G190 E196 V197 M199	Q188-G190 PolarHBondContact O-N 3.26Å; Q188-E196 WeakPolarHBondContact O-CA 3.24Å; Q188-V197 PolarHBondContact N-O 2.83Å; Q188-V197 PolarHBondContact O-N 3.49Å; Q188-M199 HydrophobicContact CB-CG 3.59Å; Q188-M199 HydrophobicContact CB-SD 3.71Å; Q188-M199 VanDerWaalsContact CD-SD 3.55Å; Q188-M199 HydrophobicContact CG-SD 4.14Å; Q188-M199 PolarHBondContact OE1-SD 3.15Å; Q188-M199 VanDerWaalsContact OE1-SD 3.35Å
189	R	61.5	Low	71.6	Confident	180 Å²	180	73.6 Å²	73.6	68%	0.679	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.1	117.3	163	-71.9	-178.8	176	162.9	-0.3	108.4	E196	R189-E196 IonicContact NE-OE1 3.83Å
190	G	58.3	Low	71	Confident	23 Å²	23	72.1 Å²	72.1	24%	0.237	37%	0.367	C	S	.	.			trans	-66.5	176.1	171.4	0	0	0	0	0	112.2	Q188 F192 R195	Q188-G190 PolarHBondContact O-N 3.26Å; G190-F192 PolarHBondContact O-N 3.09Å; G190-R195 PolarHBondContact N-O 3.12Å; G190-R195 VanDerWaalsContact N-O 3.13Å
191	P	55.1	Low	70.7	Confident	131 Å²	131	73.9 Å²	73.9	85%	0.851	38%	0.379	S	S	*	.	S	Bend	trans	-65.9	-4.4	174.4	28.1	-35.3	0	0	0	113.8
192	F	62.8	Low	70.3	Confident	151 Å²	151	73.9 Å²	73.9	66%	0.662	38%	0.379	S	S	*	.	S	Bend	trans	-117.7	134	171.8	-59.8	-80.1	0	0	0	109	G190 D194 R195	G190-F192 PolarHBondContact O-N 3.09Å; F192-D194 PolarHBondContact O-N 3.2Å; F192-D194 VanDerWaalsContact O-N 3.11Å; F192-R195 PolarHBondContact O-N 3.38Å
193	P	57.3	Low	70.3	Confident	131 Å²	131	73.9 Å²	73.9	85%	0.851	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-15.7	-169.2	27.2	-36.1	0	0	0	114.7
194	D	60.6	Low	70.3	Confident	161 Å²	161	73.8 Å²	73.8	86%	0.861	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.1	14.4	-172.1	-143.1	33.2	0	0	0	112.9	F192	F192-D194 PolarHBondContact O-N 3.2Å; F192-D194 VanDerWaalsContact O-N 3.11Å
195	R	57.4	Low	70.4	Confident	196 Å²	196	74 Å²	74	74%	0.74	38%	0.379	S	S	*	.			trans	-136	98.1	173	-80.2	-171.9	168.8	-172.7	-4.3	111.2	G190 F192	G190-R195 PolarHBondContact N-O 3.12Å; G190-R195 VanDerWaalsContact N-O 3.13Å; F192-R195 PolarHBondContact O-N 3.38Å
196	E	63.3	Low	70.3	Confident	76 Å²	76	72.9 Å²	72.9	36%	0.355	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	136.4	161.4	-61.8	-166.8	135.1	0	0	109.3	F187 Q188 R189 R225	F187-E196 HydrophobicContact CB-CB 4.22Å; F187-E196 HydrophobicContact CD1-CB 3.85Å; F187-E196 HydrophobicContact CG-CB 4.43Å; Q188-E196 WeakPolarHBondContact O-CA 3.24Å; R189-E196 IonicContact NE-OE1 3.83Å; E196-R225 WeakPolarHBondContact OE1-CD 3.29Å; E196-R225 IonicContact OE1-CZ 3.99Å; E196-R225 IonicContact OE1-NE 2.79Å; E196-R225 IonicContact OE1-NH1 3.23Å; E196-R225 PolarHBondContact OE1-NH1 2.98Å; E196-R225 IonicContact OE2-NH1 3.59Å; E196-R225 PolarHBondContact OE2-NH1 2.85Å
197	V	68.1	Low	70.1	Confident	79 Å²	79	74 Å²	74	48%	0.479	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	128.7	-178	-179.5	0	0	0	0	108.9	F187 Q188 M199	F187-V197 WeakPolarHBondContact CA-O 3.4Å; Q188-V197 PolarHBondContact N-O 2.83Å; Q188-V197 PolarHBondContact O-N 3.49Å; V197-M199 PolarHBondContact O-N 3.37Å
198	I	68.2	Low	69.9	Low	91 Å²	91	74.5 Å²	74.5	47%	0.467	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	114.2	174.7	-58.3	169.5	0	0	0	108.3	L186 F187	L186-I198 CarbonylContact O-C 3.57Å; L186-I198 WeakPolarHBondContact O-CA 3.23Å; F187-I198 HydrophobicContact CD1-CG1 4.04Å; F187-I198 HydrophobicContact CE1-CD1 4.21Å; F187-I198 HydrophobicContact CE1-CG1 3.43Å; F187-I198 VanDerWaalsContact CE1-CG1 3.43Å; F187-I198 HydrophobicContact CZ-CD1 4.32Å; F187-I198 HydrophobicContact CZ-CG1 3.82Å
199	M	69.1	Low	69.8	Low	97 Å²	97	76 Å²	76	48%	0.478	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	-34.4	175.2	-74.6	-154.6	84.4	0	0	113.2	L186 Q188 V197 Q224	L186-M199 PolarHBondContact O-N 3.07Å; Q188-M199 HydrophobicContact CB-CG 3.59Å; Q188-M199 HydrophobicContact CB-SD 3.71Å; Q188-M199 VanDerWaalsContact CD-SD 3.55Å; Q188-M199 HydrophobicContact CG-SD 4.14Å; Q188-M199 PolarHBondContact OE1-SD 3.15Å; Q188-M199 VanDerWaalsContact OE1-SD 3.35Å; V197-M199 PolarHBondContact O-N 3.37Å; M199-Q224 PolarHBondContact SD-NE2 2.87Å
200	S	71.1	Confident	69.8	Low	40 Å²	40	71.9 Å²	71.9	28%	0.28	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	155.3	-176.2	-154.9	0	0	0	0	110.9	L186	L186-S200 PolarHBondContact N-O 3.5Å
201	S	76.9	Confident	70.3	Confident	48 Å²	48	70.8 Å²	70.8	34%	0.336	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	145.1	179.4	-178.4	0	0	0	0	109.1	H183 L184	H183-S201 PolarHBondContact CE1-OG 2.73Å; L184-S201 CarbonylContact O-C 3.55Å; L184-S201 VanDerWaalsContact O-CA 3.25Å; L184-S201 WeakPolarHBondContact O-CA 3.41Å
202	G	81.2	Confident	71.1	Confident	1 Å²	1	67.7 Å²	67.7	1%	0.01	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.9	-172	179.5	0	0	0	0	0	113.3	L184	L184-G202 PolarHBondContact N-O 2.93Å; L184-G202 PolarHBondContact O-N 3.47Å
203	S	87.4	Confident	71.9	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	153.1	178.8	-60.6	0	0	0	0	111.8	A182 T215 G281 S282 G324 S326 G327 G328	A182-S203 WeakPolarHBondContact O-CA 3.47Å; S203-T215 WeakPolarHBondContact O-CB 3.43Å; S203-T215 PolarHBondContact O-OG1 3.28Å; S203-G281 VanDerWaalsContact OG-CA 3.29Å; S203-G281 WeakPolarHBondContact OG-CA 3.38Å; S203-S282 PolarHBondContact OG-N 3.47Å; S203-S282 PolarHBondContact OG-O 2.85Å; S203-G324 PolarHBondContact OG-O 3.44Å; S203-S326 WeakPolarHBondContact CB-O 3.47Å; S203-S326 PolarHBondContact N-O 3.1Å; S203-G327 CarbonylContact O-C 3.59Å; S203-G327 WeakPolarHBondContact O-CA 3.41Å; S203-G327 VanDerWaalsContact O-O 3.13Å; S203-G328 PolarHBondContact O-N 3.31Å
204	G	87.8	Confident	73.2	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	178.7	169.1	0	0	0	0	0	111.5	V181 A182 L214	V181-G204 WeakPolarHBondContact CA-O 3.39Å; A182-G204 PolarHBondContact N-O 3Å; A182-G204 PolarHBondContact O-N 3.46Å; G204-L214 CarbonylContact C-O 3.48Å; G204-L214 VanDerWaalsContact CA-O 3.23Å; G204-L214 WeakPolarHBondContact CA-O 3.42Å
205	F	86.6	Confident	74.3	Confident	4 Å²	4	46.8 Å²	46.8	2%	0.018	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	144.8	172.3	60.7	-75.4	0	0	0	113.4	A180 V207 I213 L214 V265 W267 P329 V338 I341	A180-F205 CarbonylContact O-C 3.56Å; A180-F205 WeakPolarHBondContact O-CA 3.41Å; A180-F205 WeakPolarHBondContact O-CB 3.21Å; F205-V207 HydrophobicContact CD2-CG1 3.66Å; F205-V207 HydrophobicContact CE2-CG1 3.45Å; F205-V207 VanDerWaalsContact CE2-CG1 3.45Å; F205-V207 HydrophobicContact CZ-CG1 4.33Å; F205-I213 CarbonylContact O-C 3.46Å; F205-I213 VanDerWaalsContact O-CA 3.28Å; F205-I213 WeakPolarHBondContact O-CA 3.23Å; F205-L214 HydrophobicContact CE1-CB 4.11Å; F205-L214 HydrophobicContact CZ-CB 4.06Å; F205-L214 HydrophobicContact CZ-CD1 4.43Å; F205-L214 PolarHBondContact N-O 2.91Å; F205-L214 PolarHBondContact O-N 3.5Å; F205-V265 HydrophobicContact CD2-CG2 4.39Å; F205-V265 HydrophobicContact CE2-CG2 4.49Å; F205-W267 HydrophobicContact CE2-CH2 4.48Å; F205-P329 HydrophobicContact CB-CB 4.35Å; F205-P329 HydrophobicContact CB-CG 3.93Å; F205-P329 HydrophobicContact CD1-CB 3.75Å; F205-P329 HydrophobicContact CD1-CG 4.07Å; F205-P329 HydrophobicContact CD2-CB 4.11Å; F205-P329 HydrophobicContact CE1-CB 4.01Å; F205-P329 HydrophobicContact CE2-CB 4.34Å; F205-P329 HydrophobicContact CG-CB 3.81Å; F205-P329 HydrophobicContact CG-CG 3.95Å; F205-P329 HydrophobicContact CZ-CB 4.3Å; F205-V338 HydrophobicContact CD2-CG2 4.49Å; F205-V338 HydrophobicContact CE2-CG1 3.92Å; F205-V338 HydrophobicContact CE2-CG2 4.22Å; F205-V338 HydrophobicContact CZ-CG1 3.98Å; F205-I341 HydrophobicContact CE1-CD1 4.21Å; F205-I341 HydrophobicContact CE1-CG1 3.99Å; F205-I341 HydrophobicContact CE1-CG2 4.3Å; F205-I341 HydrophobicContact CZ-CD1 4.41Å; F205-I341 HydrophobicContact CZ-CG1 4.14Å
206	V	82.1	Confident	75.2	Confident	2 Å²	2	37.4 Å²	37.4	1%	0.012	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	127.4	179.3	-167.7	0	0	0	0	110.1	A180 S208 W212 I213 L260 G262	A180-V206 PolarHBondContact O-N 3.08Å; V206-S208 VanDerWaalsContact CG1-O 3.29Å; V206-S208 WeakPolarHBondContact CG1-O 3.39Å; V206-W212 CarbonylContact C-O 3.59Å; V206-W212 WeakPolarHBondContact CA-O 3.33Å; V206-I213 HydrophobicContact CG2-CG1 4.01Å; V206-L260 HydrophobicContact CG1-CB 4.31Å; V206-L260 HydrophobicContact CG2-CB 4.25Å; V206-L260 HydrophobicContact CG2-CD1 4.06Å; V206-G262 VanDerWaalsContact CG1-CA 3.42Å
207	V	74.4	Confident	75.6	Confident	25 Å²	25	33.8 Å²	33.8	15%	0.152	18%	0.183	C	C	.	.			trans	-110.8	-18.8	-176.8	-56	0	0	0	0	114.9	F205 W212 L214 V265	F205-V207 HydrophobicContact CD2-CG1 3.66Å; F205-V207 HydrophobicContact CE2-CG1 3.45Å; F205-V207 VanDerWaalsContact CE2-CG1 3.45Å; F205-V207 HydrophobicContact CZ-CG1 4.33Å; V207-W212 HydrophobicContact CG2-CB 3.78Å; V207-W212 WeakPolarHBondContact CG2-O 3.3Å; V207-W212 PolarHBondContact N-O 2.87Å; V207-L214 HydrophobicContact CG1-CB 4.17Å; V207-L214 HydrophobicContact CG1-CD1 3.83Å; V207-L214 HydrophobicContact CG1-CG 3.75Å; V207-L214 HydrophobicContact CG2-CD1 4.46Å; V207-L214 HydrophobicContact CG2-CG 4.07Å; V207-V265 HydrophobicContact CB-CG2 4.29Å; V207-V265 HydrophobicContact CG1-CG2 4.18Å
208	S	69.2	Low	75.7	Confident	43 Å²	43	31.9 Å²	31.9	30%	0.301	17%	0.169	S	C	.	.	S	Bend	trans	-134.1	159.3	175.6	-167.8	0	0	0	0	112	V206 D210 G211	V206-S208 VanDerWaalsContact CG1-O 3.29Å; V206-S208 WeakPolarHBondContact CG1-O 3.39Å; S208-D210 WeakPolarHBondContact CB-OD2 3.15Å; S208-D210 PolarHBondContact O-N 3.47Å; S208-D210 PolarHBondContact OG-OD2 2.85Å; S208-G211 PolarHBondContact O-N 2.87Å; S208-G211 VanDerWaalsContact O-N 3.15Å
209	E	66.5	Low	75.6	Confident	118 Å²	118	27.7 Å²	27.7	55%	0.551	15%	0.147	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-16.2	179.6	-64.2	170.7	-147	0	0	112.1	G211 L260 R264	E209-G211 VanDerWaalsContact C-N 3.3Å; E209-G211 PolarHBondContact O-N 2.87Å; E209-L260 CarbonylContact C-O 3.58Å; E209-L260 VanDerWaalsContact O-O 3.09Å; E209-R264 IonicContact OE1-CZ 2.69Å; E209-R264 IonicContact OE1-NE 3.43Å; E209-R264 IonicContact OE1-NH2 3.84Å; E209-R264 PolarHBondContact OE1-NH2 2.84Å; E209-R264 VanDerWaalsContact OE1-NH2 3.12Å
210	D	63.1	Low	75.5	Confident	93 Å²	93	23.1 Å²	23.1	50%	0.497	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	11.4	171.7	-6.3	-102.4	0	0	0	113.6	S208 W212 T258	S208-D210 WeakPolarHBondContact CB-OD2 3.15Å; S208-D210 PolarHBondContact O-N 3.47Å; S208-D210 PolarHBondContact OG-OD2 2.85Å; D210-W212 VanDerWaalsContact OD2-CD1 3.26Å; D210-W212 PolarHBondContact OD2-NE1 2.9Å; D210-T258 VanDerWaalsContact O-CG2 3.25Å; D210-T258 WeakPolarHBondContact O-CG2 3.12Å
211	G	67.2	Low	74.8	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.122	C	C	.	.			trans	82	16.5	174.8	0	0	0	0	0	117.6	S208 E209 I213 I257 T258 L260	S208-G211 PolarHBondContact O-N 2.87Å; S208-G211 VanDerWaalsContact O-N 3.15Å; E209-G211 VanDerWaalsContact C-N 3.3Å; E209-G211 PolarHBondContact O-N 2.87Å; G211-I213 PolarHBondContact O-N 2.87Å; G211-I213 VanDerWaalsContact O-N 3.1Å; G211-I257 CarbonylContact O-C 3.5Å; G211-T258 WeakPolarHBondContact O-CA 3.35Å; G211-T258 PolarHBondContact O-N 3.38Å; G211-L260 VanDerWaalsContact CA-O 3.27Å; G211-L260 WeakPolarHBondContact CA-O 3.44Å; G211-L260 PolarHBondContact N-O 3.49Å
212	W	72.6	Confident	73.7	Confident	65 Å²	65	25 Å²	25	25%	0.246	13%	0.126	C	C	.	.			trans	-60.1	114.3	171.8	-64.6	71.5	0	0	0	109.1	V206 V207 D210 Q256 I257 F366	V206-W212 CarbonylContact C-O 3.59Å; V206-W212 WeakPolarHBondContact CA-O 3.33Å; V207-W212 HydrophobicContact CG2-CB 3.78Å; V207-W212 WeakPolarHBondContact CG2-O 3.3Å; V207-W212 PolarHBondContact N-O 2.87Å; D210-W212 VanDerWaalsContact OD2-CD1 3.26Å; D210-W212 PolarHBondContact OD2-NE1 2.9Å; W212-Q256 HydrophobicContact CD2-CG 4.11Å; W212-Q256 HydrophobicContact CE3-CB 3.95Å; W212-Q256 VanDerWaalsContact CE3-CD 3.49Å; W212-Q256 HydrophobicContact CE3-CG 3.51Å; W212-Q256 HydrophobicContact CH2-CG 4.23Å; W212-Q256 VanDerWaalsContact CH2-OE1 3.25Å; W212-Q256 VanDerWaalsContact CZ2-NE2 3.29Å; W212-Q256 HydrophobicContact CZ3-CB 3.94Å; W212-Q256 HydrophobicContact CZ3-CG 3.58Å; W212-I257 WeakPolarHBondContact CA-O 3.36Å; W212-F366 HydrophobicContact CH2-CD1 4.4Å; W212-F366 AromaticContact CH2-CE1 3.28Å; W212-F366 HydrophobicContact CH2-CE1 3.28Å; W212-F366 AromaticContact CH2-CZ 3.53Å; W212-F366 HydrophobicContact CH2-CZ 3.53Å; W212-F366 HydrophobicContact CZ3-CD1 4.1Å; W212-F366 AromaticContact CZ3-CE1 3.3Å; W212-F366 HydrophobicContact CZ3-CE1 3.3Å; W212-F366 AromaticContact CZ3-CZ 3.61Å; W212-F366 HydrophobicContact CZ3-CZ 3.61Å
213	I	80.7	Confident	72.5	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	147.2	169.1	-64.8	171.4	0	0	0	108.8	A182 F205 V206 G211 V228 I257 L260	A182-I213 HydrophobicContact CB-CD1 4.25Å; F205-I213 CarbonylContact O-C 3.46Å; F205-I213 VanDerWaalsContact O-CA 3.28Å; F205-I213 WeakPolarHBondContact O-CA 3.23Å; V206-I213 HydrophobicContact CG2-CG1 4.01Å; G211-I213 PolarHBondContact O-N 2.87Å; G211-I213 VanDerWaalsContact O-N 3.1Å; I213-V228 HydrophobicContact CD1-CB 4.41Å; I213-V228 HydrophobicContact CD1-CG1 3.65Å; I213-V228 HydrophobicContact CD1-CG2 3.88Å; I213-I257 HydrophobicContact CB-CB 3.95Å; I213-I257 HydrophobicContact CB-CD1 4.12Å; I213-I257 HydrophobicContact CB-CG1 4.23Å; I213-I257 HydrophobicContact CD1-CB 4.11Å; I213-I257 HydrophobicContact CD1-CD1 4.11Å; I213-I257 HydrophobicContact CD1-CG2 4.06Å; I213-I257 HydrophobicContact CG1-CB 4.22Å; I213-I257 HydrophobicContact CG2-CD1 4.28Å; I213-L260 HydrophobicContact CD1-CD1 4.18Å
214	L	82.8	Confident	71.4	Confident	4 Å²	4	36.4 Å²	36.4	2%	0.021	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	150.2	158.9	-64.6	-174.2	0	0	0	110.2	G204 F205 V207 L254 W267 I341 I359 L363	G204-L214 CarbonylContact C-O 3.48Å; G204-L214 VanDerWaalsContact CA-O 3.23Å; G204-L214 WeakPolarHBondContact CA-O 3.42Å; F205-L214 HydrophobicContact CE1-CB 4.11Å; F205-L214 HydrophobicContact CZ-CB 4.06Å; F205-L214 HydrophobicContact CZ-CD1 4.43Å; F205-L214 PolarHBondContact N-O 2.91Å; F205-L214 PolarHBondContact O-N 3.5Å; V207-L214 HydrophobicContact CG1-CB 4.17Å; V207-L214 HydrophobicContact CG1-CD1 3.83Å; V207-L214 HydrophobicContact CG1-CG 3.75Å; V207-L214 HydrophobicContact CG2-CD1 4.46Å; V207-L214 HydrophobicContact CG2-CG 4.07Å; L214-L254 HydrophobicContact CD2-CD2 3.81Å; L214-L254 HydrophobicContact CD2-CG 4.43Å; L214-W267 HydrophobicContact CD1-CH2 4.48Å; L214-I341 HydrophobicContact CB-CD1 4.25Å; L214-I359 HydrophobicContact CD1-CG2 3.3Å; L214-L363 HydrophobicContact CD1-CD1 4.42Å; L214-L363 HydrophobicContact CD2-CD2 4.4Å
215	T	84.5	Confident	70.6	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.1	169.4	178.1	179	0	0	0	0	109.1	L184 S203 A217 L220 L254 G327	L184-T215 VanDerWaalsContact CD1-CB 3.43Å; L184-T215 HydrophobicContact CD1-CG2 3.6Å; L184-T215 VanDerWaalsContact CD1-OG1 3.23Å; L184-T215 WeakPolarHBondContact CD1-OG1 3.48Å; S203-T215 WeakPolarHBondContact O-CB 3.43Å; S203-T215 PolarHBondContact O-OG1 3.28Å; T215-A217 PolarHBondContact O-N 3.42Å; T215-A217 VanDerWaalsContact O-N 3.08Å; T215-L220 HydrophobicContact CG2-CD1 3.42Å; T215-L220 VanDerWaalsContact CG2-CD1 3.42Å; T215-L220 HydrophobicContact CG2-CD2 4.29Å; T215-L220 HydrophobicContact CG2-CG 4Å; T215-L254 VanDerWaalsContact O-CD1 3.27Å; T215-L254 WeakPolarHBondContact O-CD1 3.2Å; T215-G327 WeakPolarHBondContact CA-O 3Å
216	N	77.3	Confident	70.2	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	19%	0.19	C	C	.	.			trans	-68.9	107.6	165.6	-73.7	-10.3	0	0	0	110.3	H218 V219 S326 G327 I341 N342 N343	N216-H218 PolarHBondContact ND2-CE1 3.37Å; N216-H218 VanDerWaalsContact ND2-CE1 3.26Å; N216-H218 PolarHBondContact O-N 2.69Å; N216-H218 VanDerWaalsContact O-N 3.11Å; N216-V219 HydrophobicContact CB-CG2 4.28Å; N216-V219 WeakPolarHBondContact O-CB 3.39Å; N216-V219 VanDerWaalsContact O-CG2 3.27Å; N216-V219 WeakPolarHBondContact O-CG2 3.47Å; N216-V219 PolarHBondContact O-N 3.33Å; N216-S326 PolarHBondContact ND2-OG 3.07Å; N216-G327 VanDerWaalsContact CG-CA 3.47Å; N216-G327 PolarHBondContact ND2-N 2.69Å; N216-I341 WeakPolarHBondContact OD1-CG2 3.31Å; N216-N342 PolarHBondContact ND2-O 3.39Å; N216-N343 WeakPolarHBondContact ND2-CA 3.4Å
217	A	71.3	Confident	70.3	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	20%	0.2	C	C	.	.	G	3₁₀ helix		56.8	-99.6	96.6	0	0	0	0	0	116.2	T215 V219 L220 S252 K253	T215-A217 PolarHBondContact O-N 3.42Å; T215-A217 VanDerWaalsContact O-N 3.08Å; A217-V219 VanDerWaalsContact C-N 3.31Å; A217-V219 PolarHBondContact O-N 2.84Å; A217-L220 PolarHBondContact O-N 3.46Å; A217-S252 VanDerWaalsContact CB-CB 3.45Å; A217-S252 WeakPolarHBondContact CB-OG 3.47Å; A217-K253 WeakPolarHBondContact CA-O 3.38Å; A217-K253 PolarHBondContact N-O 3.07Å; A217-K253 PolarHBondContact O-N 2.87Å
218	H	70.3	Confident	70.8	Confident	38 Å²	38	41.3 Å²	41.3	18%	0.176	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-74.2	-14.6	-179	51.6	-100.1	0	0	0	115.4	N216 L220 K221 S251 S326 N343	N216-H218 PolarHBondContact ND2-CE1 3.37Å; N216-H218 VanDerWaalsContact ND2-CE1 3.26Å; N216-H218 PolarHBondContact O-N 2.69Å; N216-H218 VanDerWaalsContact O-N 3.11Å; H218-L220 VanDerWaalsContact C-N 3.25Å; H218-K221 WeakPolarHBondContact O-CG 3.18Å; H218-S251 WeakPolarHBondContact CA-O 3.16Å; H218-S251 WeakPolarHBondContact CB-O 3.1Å; H218-S326 PolarHBondContact CE1-OG 2.95Å; H218-S326 PolarHBondContact NE2-OG 3.04Å; H218-N343 PolarHBondContact CE1-OD1 2.86Å; H218-N343 VanDerWaalsContact CE1-OD1 3.31Å
219	V	65.6	Low	71.5	Confident	3 Å²	3	40 Å²	40	2%	0.018	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-66.7	-32.4	172.4	-176	0	0	0	0	110	L184 L186 N216 A217 K221	L184-V219 HydrophobicContact CB-CG1 4.35Å; L186-V219 HydrophobicContact CD1-CG1 4Å; L186-V219 VanDerWaalsContact CD1-O 3.32Å; L186-V219 WeakPolarHBondContact CD1-O 3.43Å; L186-V219 WeakPolarHBondContact CD2-O 3.42Å; N216-V219 HydrophobicContact CB-CG2 4.28Å; N216-V219 WeakPolarHBondContact O-CB 3.39Å; N216-V219 VanDerWaalsContact O-CG2 3.27Å; N216-V219 WeakPolarHBondContact O-CG2 3.47Å; N216-V219 PolarHBondContact O-N 3.33Å; A217-V219 VanDerWaalsContact C-N 3.31Å; A217-V219 PolarHBondContact O-N 2.84Å; V219-K221 PolarHBondContact O-N 3.14Å
220	L	66.3	Low	72.2	Confident	2 Å²	2	35.2 Å²	35.2	1%	0.01	16%	0.16	C	C	.	.	G	3₁₀ helix	trans	-93.1	24.2	-166.5	-64.7	160.9	0	0	0	114.9	L186 T215 A217 H218 V226 I240 K253 S255	L186-L220 HydrophobicContact CD1-CD2 4.44Å; T215-L220 HydrophobicContact CG2-CD1 3.42Å; T215-L220 VanDerWaalsContact CG2-CD1 3.42Å; T215-L220 HydrophobicContact CG2-CD2 4.29Å; T215-L220 HydrophobicContact CG2-CG 4Å; A217-L220 PolarHBondContact O-N 3.46Å; H218-L220 VanDerWaalsContact C-N 3.25Å; L220-V226 HydrophobicContact CD2-CG1 4.44Å; L220-V226 HydrophobicContact CD2-CG2 4.03Å; L220-I240 HydrophobicContact CB-CD1 4.2Å; L220-I240 HydrophobicContact CD2-CD1 4.14Å; L220-I240 HydrophobicContact CD2-CG1 4.23Å; L220-K253 VanDerWaalsContact CD1-O 3.22Å; L220-K253 WeakPolarHBondContact CD1-O 3.48Å; L220-S255 WeakPolarHBondContact CD1-OG 3.27Å
221	K	57.8	Low	72.8	Confident	51 Å²	51	35.5 Å²	35.5	22%	0.222	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	150.2	-174.9	-73.4	175.3	178.3	-176.8	0	112.3	H218 V219 S251	H218-K221 WeakPolarHBondContact O-CG 3.18Å; V219-K221 PolarHBondContact O-N 3.14Å; K221-S251 WeakPolarHBondContact CE-O 3.44Å; K221-S251 PolarHBondContact NZ-OG 3.27Å
222	N	54.1	Low	73.1	Confident	76 Å²	76	40.2 Å²	40.2	41%	0.406	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.5	32.2	166.3	-59.2	-7.7	0	0	0	118.8	Q224	N222-Q224 PolarHBondContact O-N 3.19Å
223	K	54.5	Low	73.2	Confident	204 Å²	204	39.1 Å²	39.1	89%	0.887	19%	0.191	S	C	*	.	S	Bend	trans	48.5	53.1	162.1	-67.6	-171.8	176.2	-178.8	0	114.7
224	Q	63.9	Low	72.9	Confident	36 Å²	36	42 Å²	42	17%	0.168	21%	0.208	C	C	.	.			trans	-106.8	176.3	-176.7	-84.8	163.5	30.8	0	0	113.1	F187 M199 N222 V226	F187-Q224 WeakPolarHBondContact O-CB 3.47Å; M199-Q224 PolarHBondContact SD-NE2 2.87Å; N222-Q224 PolarHBondContact O-N 3.19Å; Q224-V226 PolarHBondContact O-N 2.91Å
225	R	72.4	Confident	72.7	Confident	84 Å²	84	46 Å²	46	32%	0.317	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	121.6	167.3	-64.9	177.9	79.2	-148.2	-1.9	107.6	F187 E196 E237	F187-R225 PolarHBondContact N-O 2.73Å; E196-R225 WeakPolarHBondContact OE1-CD 3.29Å; E196-R225 IonicContact OE1-CZ 3.99Å; E196-R225 IonicContact OE1-NE 2.79Å; E196-R225 IonicContact OE1-NH1 3.23Å; E196-R225 PolarHBondContact OE1-NH1 2.98Å; E196-R225 IonicContact OE2-NH1 3.59Å; E196-R225 PolarHBondContact OE2-NH1 2.85Å; R225-E237 IonicContact CZ-OE1 2.69Å; R225-E237 IonicContact CZ-OE2 3Å; R225-E237 IonicContact NE-OE1 2.98Å; R225-E237 PolarHBondContact NE-OE1 3.16Å; R225-E237 IonicContact NE-OE2 2.7Å; R225-E237 VanDerWaalsContact NH2-CD 3.27Å; R225-E237 IonicContact NH2-OE1 3.85Å; R225-E237 PolarHBondContact NH2-OE1 2.91Å; R225-E237 IonicContact NH2-OE2 3.26Å; R225-E237 PolarHBondContact NH2-OE2 3.23Å
226	V	78.6	Confident	72.5	Confident	2 Å²	2	49.2 Å²	49.2	1%	0.012	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	129.3	171.3	-176.4	0	0	0	0	107.1	L184 L186 L220 Q224 A238 I240 I257	L184-V226 HydrophobicContact CD2-CG1 3.51Å; L186-V226 HydrophobicContact CD1-CG1 4.36Å; L186-V226 HydrophobicContact CD1-CG2 4.39Å; L186-V226 HydrophobicContact CD2-CG2 4.33Å; L186-V226 HydrophobicContact CG-CG2 4.08Å; L220-V226 HydrophobicContact CD2-CG1 4.44Å; L220-V226 HydrophobicContact CD2-CG2 4.03Å; Q224-V226 PolarHBondContact O-N 2.91Å; V226-A238 HydrophobicContact CB-CB 3.88Å; V226-A238 HydrophobicContact CG1-CB 4Å; V226-A238 WeakPolarHBondContact O-CB 2.89Å; V226-A238 PolarHBondContact O-N 2.9Å; V226-I240 HydrophobicContact CG2-CD1 4.01Å; V226-I240 HydrophobicContact CG2-CG1 4.07Å; V226-I257 HydrophobicContact CG1-CD1 4.28Å
227	K	84.1	Confident	72.7	Confident	48 Å²	48	55.1 Å²	55.1	21%	0.209	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	135.5	168.7	-178.2	178.3	174.1	-78.9	0	108	L184 E185 F187 D235	L184-K227 WeakPolarHBondContact CA-O 3.35Å; E185-K227 HydrophobicContact CB-CB 4.34Å; E185-K227 PolarHBondContact N-O 2.93Å; E185-K227 PolarHBondContact O-N 2.97Å; E185-K227 WeakPolarHBondContact OE2-CD 3.34Å; E185-K227 IonicContact OE2-NZ 2.92Å; E185-K227 PolarHBondContact OE2-NZ 2.94Å; F187-K227 HydrophobicContact CD2-CB 4.1Å; F187-K227 HydrophobicContact CE2-CB 3.69Å; F187-K227 HydrophobicContact CE2-CD 3.68Å; F187-K227 HydrophobicContact CE2-CG 4.36Å; F187-K227 HydrophobicContact CZ-CD 4.12Å; K227-D235 WeakPolarHBondContact CE-OD1 3.46Å; K227-D235 WeakPolarHBondContact CE-OD2 3.48Å; K227-D235 IonicContact NZ-OD1 3.07Å; K227-D235 PolarHBondContact NZ-OD1 3.07Å; K227-D235 IonicContact NZ-OD2 2.95Å; K227-D235 PolarHBondContact NZ-OD2 2.8Å
228	V	85.2	Confident	72.9	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	124.9	173.8	172.9	0	0	0	0	108.4	A182 H183 L184 I213 D235 Y236 A238 I257 L260	A182-V228 HydrophobicContact CB-CG1 3.93Å; H183-V228 WeakPolarHBondContact O-CA 3.5Å; L184-V228 HydrophobicContact CD2-CG2 3.66Å; I213-V228 HydrophobicContact CD1-CB 4.41Å; I213-V228 HydrophobicContact CD1-CG1 3.65Å; I213-V228 HydrophobicContact CD1-CG2 3.88Å; V228-D235 CarbonylContact O-C 3.52Å; V228-D235 WeakPolarHBondContact O-CA 3.18Å; V228-Y236 PolarHBondContact N-O 3.23Å; V228-Y236 PolarHBondContact O-N 3.23Å; V228-A238 HydrophobicContact CG2-CB 3.83Å; V228-I257 HydrophobicContact CG2-CD1 3.61Å; V228-I257 HydrophobicContact CG2-CG2 4.12Å; V228-L260 HydrophobicContact CG1-CD1 4.38Å
229	E	83.6	Confident	73.1	Confident	17 Å²	17	56.6 Å²	56.6	8%	0.079	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	132.8	165.8	-167.4	-168.5	126.2	0	0	109.4	H183 P285 L286	H183-E229 HydrophobicContact CB-CB 4.23Å; H183-E229 PolarHBondContact N-O 2.73Å; H183-E229 PolarHBondContact O-N 2.66Å; H183-E229 VanDerWaalsContact O-N 3.1Å; E229-P285 WeakPolarHBondContact OE1-CA 3.49Å; E229-P285 WeakPolarHBondContact OE2-CA 3.47Å; E229-P285 WeakPolarHBondContact OE2-CB 3.29Å; E229-P285 VanDerWaalsContact OE2-CG 3.31Å; E229-P285 WeakPolarHBondContact OE2-CG 3.37Å; E229-L286 PolarHBondContact OE1-N 2.93Å
230	L	81.3	Confident	73.5	Confident	17 Å²	17	59 Å²	59	9%	0.089	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	161.1	168.5	-85.9	-162.1	0	0	0	111.9	A182 N232 G233 V234 L260	A182-L230 HydrophobicContact CB-CD2 3.78Å; L230-N232 WeakPolarHBondContact CB-OD1 3.39Å; L230-N232 PolarHBondContact O-N 2.95Å; L230-N232 PolarHBondContact O-OD1 3.46Å; L230-G233 PolarHBondContact O-N 3.1Å; L230-V234 PolarHBondContact N-O 3.14Å; L230-L260 HydrophobicContact CD1-CD1 3.73Å; L230-L260 HydrophobicContact CD1-CD2 3.39Å; L230-L260 HydrophobicContact CD1-CG 4.11Å; L230-L260 HydrophobicContact CD2-CD1 4.02Å; L230-L260 HydrophobicContact CG-CD1 3.71Å; L230-L260 HydrophobicContact CG-CD2 4.1Å
231	K	75.8	Confident	73.7	Confident	99 Å²	99	64.5 Å²	64.5	43%	0.43	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-13.5	171.8	-176.7	173.6	176.5	-173.9	0	115.4	A178	A178-K231 HydrophobicContact CB-CD 4Å; A178-K231 WeakPolarHBondContact O-CD 3.42Å
232	N	72.9	Confident	74.1	Confident	98 Å²	98	63.7 Å²	63.7	52%	0.524	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-3.7	173.2	66.3	-7.1	0	0	0	114	L230 V234	L230-N232 WeakPolarHBondContact CB-OD1 3.39Å; L230-N232 PolarHBondContact O-N 2.95Å; L230-N232 PolarHBondContact O-OD1 3.46Å; N232-V234 WeakPolarHBondContact OD1-CB 3.46Å; N232-V234 PolarHBondContact OD1-N 2.86Å
233	G	73.5	Confident	74.7	Confident	42 Å²	42	62 Å²	62	43%	0.433	32%	0.315	S	S	.	.	S	Bend	trans	75.2	22.4	-176.9	0	0	0	0	0	114.1	L230	L230-G233 PolarHBondContact O-N 3.1Å
234	V	74.5	Confident	75.2	Confident	62 Å²	62	53.8 Å²	53.8	38%	0.376	28%	0.281	S	S	.	.			trans	-103	128.3	174.9	-174.5	0	0	0	0	109.6	L230 N232 Y236	L230-V234 PolarHBondContact N-O 3.14Å; N232-V234 WeakPolarHBondContact OD1-CB 3.46Å; N232-V234 PolarHBondContact OD1-N 2.86Å; V234-Y236 HydrophobicContact CB-CE2 3.74Å; V234-Y236 HydrophobicContact CG1-CD2 4.28Å; V234-Y236 HydrophobicContact CG1-CE1 4.41Å; V234-Y236 HydrophobicContact CG1-CE2 3.5Å; V234-Y236 VanDerWaalsContact CG1-CE2 3.5Å; V234-Y236 WeakPolarHBondContact O-CD2 3.38Å; V234-Y236 WeakPolarHBondContact O-CE2 3.46Å
235	D	80.1	Confident	74.8	Confident	88 Å²	88	56 Å²	56	47%	0.471	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	139.1	177.1	-76.2	-35.2	0	0	0	111.9	K227 V228	K227-D235 WeakPolarHBondContact CE-OD1 3.46Å; K227-D235 WeakPolarHBondContact CE-OD2 3.48Å; K227-D235 IonicContact NZ-OD1 3.07Å; K227-D235 PolarHBondContact NZ-OD1 3.07Å; K227-D235 IonicContact NZ-OD2 2.95Å; K227-D235 PolarHBondContact NZ-OD2 2.8Å; V228-D235 CarbonylContact O-C 3.52Å; V228-D235 WeakPolarHBondContact O-CA 3.18Å
236	Y	80	Confident	73.7	Confident	67 Å²	67	57 Å²	57	26%	0.263	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	137.1	176.8	-59.8	-98.5	0	0	0	110.1	V228 V234 L260	V228-Y236 PolarHBondContact N-O 3.23Å; V228-Y236 PolarHBondContact O-N 3.23Å; V234-Y236 HydrophobicContact CB-CE2 3.74Å; V234-Y236 HydrophobicContact CG1-CD2 4.28Å; V234-Y236 HydrophobicContact CG1-CE1 4.41Å; V234-Y236 HydrophobicContact CG1-CE2 3.5Å; V234-Y236 VanDerWaalsContact CG1-CE2 3.5Å; V234-Y236 WeakPolarHBondContact O-CD2 3.38Å; V234-Y236 WeakPolarHBondContact O-CE2 3.46Å; Y236-L260 HydrophobicContact CD1-CD2 4.49Å; Y236-L260 HydrophobicContact CD2-CD2 4.19Å; Y236-L260 HydrophobicContact CE1-CD2 3.88Å; Y236-L260 HydrophobicContact CE2-CD2 3.55Å; Y236-L260 HydrophobicContact CE2-CG 4.41Å; Y236-L260 WeakPolarHBondContact OH-CD2 3.22Å
237	E	81.3	Confident	72.4	Confident	124 Å²	124	57.1 Å²	57.1	58%	0.579	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.2	132.8	169.2	-179.5	162	-168.9	0	0	110.2	R225	R225-E237 IonicContact CZ-OE1 2.69Å; R225-E237 IonicContact CZ-OE2 3Å; R225-E237 IonicContact NE-OE1 2.98Å; R225-E237 PolarHBondContact NE-OE1 3.16Å; R225-E237 IonicContact NE-OE2 2.7Å; R225-E237 VanDerWaalsContact NH2-CD 3.27Å; R225-E237 IonicContact NH2-OE1 3.85Å; R225-E237 PolarHBondContact NH2-OE1 2.91Å; R225-E237 IonicContact NH2-OE2 3.26Å; R225-E237 PolarHBondContact NH2-OE2 3.23Å
238	A	76.1	Confident	70.8	Confident	7 Å²	7	55.7 Å²	55.7	6%	0.058	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	138.1	-165.7	0	0	0	0	0	112.6	V226 V228 I257	V226-A238 HydrophobicContact CB-CB 3.88Å; V226-A238 HydrophobicContact CG1-CB 4Å; V226-A238 WeakPolarHBondContact O-CB 2.89Å; V226-A238 PolarHBondContact O-N 2.9Å; V228-A238 HydrophobicContact CG2-CB 3.83Å; A238-I257 HydrophobicContact CB-CB 4.19Å; A238-I257 HydrophobicContact CB-CD1 3.77Å; A238-I257 HydrophobicContact CB-CG1 3.89Å; A238-I257 HydrophobicContact CB-CG2 3.32Å
239	A	73	Confident	68.6	Low	61 Å²	61	57 Å²	57	50%	0.504	31%	0.309	S	S	.	.			trans	-119.3	113.3	-177.9	0	0	0	0	0	111.6	K241	A239-K241 WeakPolarHBondContact O-CG 3.5Å; A239-K241 PolarHBondContact O-N 3.02Å
240	I	74.4	Confident	65.7	Low	53 Å²	53	59.6 Å²	59.6	27%	0.272	33%	0.327	S	S	.	.			trans	-56.7	126.3	172.8	-63.5	168.8	0	0	0	109.8	L220 V226 V243	L220-I240 HydrophobicContact CB-CD1 4.2Å; L220-I240 HydrophobicContact CD2-CD1 4.14Å; L220-I240 HydrophobicContact CD2-CG1 4.23Å; V226-I240 HydrophobicContact CG2-CD1 4.01Å; V226-I240 HydrophobicContact CG2-CG1 4.07Å; I240-V243 HydrophobicContact CG2-CG2 3.55Å
241	K	70.1	Confident	63.2	Low	118 Å²	118	60.7 Å²	60.7	51%	0.513	34%	0.336	S	S	.	.			trans	-117.4	-35.5	-177	-49	-147.8	-172.2	178	0	116.9	A239 Q256	A239-K241 WeakPolarHBondContact O-CG 3.5Å; A239-K241 PolarHBondContact O-N 3.02Å; K241-Q256 HydrophobicContact CB-CB 4.12Å; K241-Q256 HydrophobicContact CB-CG 4.36Å; K241-Q256 VanDerWaalsContact CB-OE1 3.28Å; K241-Q256 HydrophobicContact CD-CG 4.42Å; K241-Q256 HydrophobicContact CG-CB 4.29Å; K241-Q256 HydrophobicContact CG-CG 4.1Å
242	D	67.5	Low	61.2	Low	35 Å²	35	56.4 Å²	56.4	19%	0.187	32%	0.318	C	S	.	.			trans	-146.6	148.6	172	-168.4	26.3	0	0	0	110.2	L254 S255 F362 F366 R369	D242-L254 CarbonylContact O-C 3.59Å; D242-S255 WeakPolarHBondContact O-CA 3.11Å; D242-F362 HydrophobicContact CB-CZ 4.25Å; D242-F366 HydrophobicContact CB-CD2 3.37Å; D242-F366 HydrophobicContact CB-CE2 3.68Å; D242-F366 HydrophobicContact CB-CG 4.45Å; D242-F366 WeakPolarHBondContact OD2-CD2 3.32Å; D242-R369 IonicContact OD2-CZ 3.66Å; D242-R369 VanDerWaalsContact OD2-CZ 3.26Å; D242-R369 IonicContact OD2-NE 3.7Å; D242-R369 PolarHBondContact OD2-NE 2.99Å; D242-R369 IonicContact OD2-NH2 3.37Å; D242-R369 PolarHBondContact OD2-NH2 3.31Å
243	V	65.9	Low	59.4	Low	41 Å²	41	53.9 Å²	53.9	25%	0.248	30%	0.302	C	S	.	.			trans	-147	115.6	-158.7	158.6	0	0	0	0	107.7	I240 E245 K253 L254	I240-V243 HydrophobicContact CG2-CG2 3.55Å; V243-E245 HydrophobicContact CG1-CG 3.79Å; V243-E245 WeakPolarHBondContact CG1-OE1 3.47Å; V243-K253 HydrophobicContact CB-CB 4.39Å; V243-K253 HydrophobicContact CG1-CB 3.49Å; V243-K253 VanDerWaalsContact CG1-CB 3.49Å; V243-K253 HydrophobicContact CG1-CD 4.25Å; V243-K253 HydrophobicContact CG1-CG 3.61Å; V243-K253 HydrophobicContact CG2-CB 4.13Å; V243-L254 WeakPolarHBondContact CA-O 3.42Å; V243-L254 VanDerWaalsContact CG2-O 3.22Å; V243-L254 WeakPolarHBondContact CG2-O 3.17Å
244	D	64.8	Low	57.5	Low	31 Å²	31	52.1 Å²	52.1	17%	0.166	28%	0.283	C	S	.	.			trans	-104	117.2	170.8	-168.4	-33.2	0	0	0	109.3	Q246 M247 S252 F362	D244-Q246 WeakPolarHBondContact OD1-CA 3.37Å; D244-Q246 WeakPolarHBondContact OD1-CB 3.38Å; D244-Q246 PolarHBondContact OD1-N 2.6Å; D244-M247 HydrophobicContact CB-CE 4.07Å; D244-M247 HydrophobicContact CB-CG 4.23Å; D244-M247 PolarHBondContact OD1-N 3.21Å; D244-M247 WeakPolarHBondContact OD2-CG 3.46Å; D244-S252 VanDerWaalsContact O-O 3.11Å; D244-F362 HydrophobicContact CB-CD2 3.62Å; D244-F362 HydrophobicContact CB-CE2 3.69Å
245	E	55.9	Low	55.7	Low	83 Å²	83	49.1 Å²	49.1	39%	0.388	27%	0.265	S	S	.	.	S	Bend	trans	-95.4	7.9	-179.7	-71	178	-132.1	0	0	113.4	V243 S252 K253 F383	V243-E245 HydrophobicContact CG1-CG 3.79Å; V243-E245 WeakPolarHBondContact CG1-OE1 3.47Å; E245-S252 VanDerWaalsContact CA-O 3.31Å; E245-S252 WeakPolarHBondContact CA-O 3.45Å; E245-K253 HydrophobicContact CG-CG 3.71Å; E245-K253 IonicContact OE1-NZ 2.73Å; E245-K253 PolarHBondContact OE1-NZ 3.09Å; E245-K253 IonicContact OE2-NZ 3.27Å; E245-K253 PolarHBondContact OE2-NZ 3.1Å; E245-F383 WeakPolarHBondContact OE2-CE2 3.24Å
246	Q	49	Very low	53.8	Low	103 Å²	103	45.8 Å²	45.8	48%	0.481	25%	0.247	S	C	.	.	S	Bend	trans	-114.5	-8.6	-176.5	-57.3	-134.2	-57.5	0	0	114.3	D244 D248	D244-Q246 WeakPolarHBondContact OD1-CA 3.37Å; D244-Q246 WeakPolarHBondContact OD1-CB 3.38Å; D244-Q246 PolarHBondContact OD1-N 2.6Å; Q246-D248 PolarHBondContact O-N 2.97Å
247	M	50.8	Low	51.9	Low	6 Å²	6	42.8 Å²	42.8	3%	0.03	24%	0.235	C	C	.	.	S	Bend	trans	-81.3	12.9	177.5	-62.1	-159.1	-60.5	0	0	114.1	D244 L254 L312 R358 F362	D244-M247 HydrophobicContact CB-CE 4.07Å; D244-M247 HydrophobicContact CB-CG 4.23Å; D244-M247 PolarHBondContact OD1-N 3.21Å; D244-M247 WeakPolarHBondContact OD2-CG 3.46Å; M247-L254 HydrophobicContact CE-CD2 4.25Å; M247-L312 WeakPolarHBondContact O-CD1 3.27Å; M247-R358 HydrophobicContact CG-CG 4.35Å; M247-R358 HydrophobicContact SD-CG 3.66Å; M247-R358 PolarHBondContact SD-NE 2.9Å; M247-F362 HydrophobicContact CE-CB 3.6Å; M247-F362 HydrophobicContact CE-CD2 3.89Å; M247-F362 HydrophobicContact CE-CG 3.79Å; M247-F362 HydrophobicContact SD-CB 3.82Å
248	D	50.9	Low	49.5	Very low	17 Å²	17	39.4 Å²	39.4	9%	0.091	22%	0.223	C	C	.	.	S	Bend	trans	-158.2	163	-172.7	-91.5	-55.3	0	0	0	111.2	Q246 S252 N343 I354	Q246-D248 PolarHBondContact O-N 2.97Å; D248-S252 VanDerWaalsContact CG-CB 3.42Å; D248-S252 VanDerWaalsContact CG-OG 3.32Å; D248-S252 WeakPolarHBondContact OD2-CB 3.31Å; D248-S252 PolarHBondContact OD2-OG 2.75Å; D248-N343 PolarHBondContact OD1-ND2 3.45Å; D248-I354 WeakPolarHBondContact OD2-CD1 3.28Å
249	G	38.5	Very low	47.3	Very low	29 Å²	29	46 Å²	46	30%	0.299	25%	0.253	S	S	.	.	S	Bend	trans	-62.1	171.4	159.9	0	0	0	0	0	112.8	S251	G249-S251 PolarHBondContact O-N 2.99Å
250	P	23	Very low	45.6	Very low	71 Å²	71	43.7 Å²	43.7	46%	0.461	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	80.6	-160.4	27.4	-37	0	0	0	115.2
251	S	30.1	Very low	43.5	Very low	40 Å²	40	47.8 Å²	47.8	28%	0.28	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-166.8	-0.4	168.3	-93.3	0	0	0	0	117.2	H218 K221 G249	H218-S251 WeakPolarHBondContact CA-O 3.16Å; H218-S251 WeakPolarHBondContact CB-O 3.1Å; K221-S251 WeakPolarHBondContact CE-O 3.44Å; K221-S251 PolarHBondContact NZ-OG 3.27Å; G249-S251 PolarHBondContact O-N 2.99Å
252	S	33.5	Very low	41.9	Very low	8 Å²	8	42.7 Å²	42.7	6%	0.056	24%	0.239	C	C	.	.			trans	-125.9	122.8	-146.4	-100.3	0	0	0	0	114.9	A217 D244 E245 D248	A217-S252 VanDerWaalsContact CB-CB 3.45Å; A217-S252 WeakPolarHBondContact CB-OG 3.47Å; D244-S252 VanDerWaalsContact O-O 3.11Å; E245-S252 VanDerWaalsContact CA-O 3.31Å; E245-S252 WeakPolarHBondContact CA-O 3.45Å; D248-S252 VanDerWaalsContact CG-CB 3.42Å; D248-S252 VanDerWaalsContact CG-OG 3.32Å; D248-S252 WeakPolarHBondContact OD2-CB 3.31Å; D248-S252 PolarHBondContact OD2-OG 2.75Å
253	K	34.4	Very low	40.3	Very low	45 Å²	45	43.4 Å²	43.4	20%	0.196	25%	0.247	C	C	.	.			trans	-127.6	97	-177.7	-63.2	174.1	-173.9	-71.3	0	114.1	A217 L220 V243 E245	A217-K253 WeakPolarHBondContact CA-O 3.38Å; A217-K253 PolarHBondContact N-O 3.07Å; A217-K253 PolarHBondContact O-N 2.87Å; L220-K253 VanDerWaalsContact CD1-O 3.22Å; L220-K253 WeakPolarHBondContact CD1-O 3.48Å; V243-K253 HydrophobicContact CB-CB 4.39Å; V243-K253 HydrophobicContact CG1-CB 3.49Å; V243-K253 VanDerWaalsContact CG1-CB 3.49Å; V243-K253 HydrophobicContact CG1-CD 4.25Å; V243-K253 HydrophobicContact CG1-CG 3.61Å; V243-K253 HydrophobicContact CG2-CB 4.13Å; E245-K253 HydrophobicContact CG-CG 3.71Å; E245-K253 IonicContact OE1-NZ 2.73Å; E245-K253 PolarHBondContact OE1-NZ 3.09Å; E245-K253 IonicContact OE2-NZ 3.27Å; E245-K253 PolarHBondContact OE2-NZ 3.1Å
254	L	33.1	Very low	39.2	Very low	5 Å²	5	50.7 Å²	50.7	3%	0.026	27%	0.27	C	S	.	.			trans	-54.9	158	178.7	-142.9	80.4	0	0	0	111.5	L214 T215 D242 V243 M247 I341 F362	L214-L254 HydrophobicContact CD2-CD2 3.81Å; L214-L254 HydrophobicContact CD2-CG 4.43Å; T215-L254 VanDerWaalsContact O-CD1 3.27Å; T215-L254 WeakPolarHBondContact O-CD1 3.2Å; D242-L254 CarbonylContact O-C 3.59Å; V243-L254 WeakPolarHBondContact CA-O 3.42Å; V243-L254 VanDerWaalsContact CG2-O 3.22Å; V243-L254 WeakPolarHBondContact CG2-O 3.17Å; M247-L254 HydrophobicContact CE-CD2 4.25Å; L254-I341 HydrophobicContact CD1-CD1 4.01Å; L254-F362 HydrophobicContact CB-CZ 4.36Å; L254-F362 HydrophobicContact CD2-CD1 3.39Å; L254-F362 HydrophobicContact CD2-CE1 3.45Å; L254-F362 VanDerWaalsContact CD2-CE1 3.45Å; L254-F362 HydrophobicContact CD2-CG 3.98Å; L254-F362 HydrophobicContact CD2-CZ 4.04Å
255	S	37.2	Very low	38.6	Very low	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.27	C	S	.	.			trans	-151.8	137.7	166.3	81.2	0	0	0	0	116.8	L220 D242	L220-S255 WeakPolarHBondContact CD1-OG 3.27Å; D242-S255 WeakPolarHBondContact O-CA 3.11Å
256	Q	40.4	Very low	38.3	Very low	18 Å²	18	53.3 Å²	53.3	8%	0.084	28%	0.277	C	S	.	.			trans	-60.3	147.8	157.7	169.7	-178.7	10.2	0	0	112.4	W212 K241	W212-Q256 HydrophobicContact CD2-CG 4.11Å; W212-Q256 HydrophobicContact CE3-CB 3.95Å; W212-Q256 VanDerWaalsContact CE3-CD 3.49Å; W212-Q256 HydrophobicContact CE3-CG 3.51Å; W212-Q256 HydrophobicContact CH2-CG 4.23Å; W212-Q256 VanDerWaalsContact CH2-OE1 3.25Å; W212-Q256 VanDerWaalsContact CZ2-NE2 3.29Å; W212-Q256 HydrophobicContact CZ3-CB 3.94Å; W212-Q256 HydrophobicContact CZ3-CG 3.58Å; K241-Q256 HydrophobicContact CB-CB 4.12Å; K241-Q256 HydrophobicContact CB-CG 4.36Å; K241-Q256 VanDerWaalsContact CB-OE1 3.28Å; K241-Q256 HydrophobicContact CD-CG 4.42Å; K241-Q256 HydrophobicContact CG-CB 4.29Å; K241-Q256 HydrophobicContact CG-CG 4.1Å
257	I	40	Very low	38.8	Very low	3 Å²	3	51 Å²	51	2%	0.015	26%	0.264	C	S	.	.			trans	-132.2	179	162.4	-58.4	177.8	0	0	0	108.7	L184 G211 W212 I213 V226 V228 A238	L184-I257 HydrophobicContact CD2-CD1 3.65Å; G211-I257 CarbonylContact O-C 3.5Å; W212-I257 WeakPolarHBondContact CA-O 3.36Å; I213-I257 HydrophobicContact CB-CB 3.95Å; I213-I257 HydrophobicContact CB-CD1 4.12Å; I213-I257 HydrophobicContact CB-CG1 4.23Å; I213-I257 HydrophobicContact CD1-CB 4.11Å; I213-I257 HydrophobicContact CD1-CD1 4.11Å; I213-I257 HydrophobicContact CD1-CG2 4.06Å; I213-I257 HydrophobicContact CG1-CB 4.22Å; I213-I257 HydrophobicContact CG2-CD1 4.28Å; V226-I257 HydrophobicContact CG1-CD1 4.28Å; V228-I257 HydrophobicContact CG2-CD1 3.61Å; V228-I257 HydrophobicContact CG2-CG2 4.12Å; A238-I257 HydrophobicContact CB-CB 4.19Å; A238-I257 HydrophobicContact CB-CD1 3.77Å; A238-I257 HydrophobicContact CB-CG1 3.89Å; A238-I257 HydrophobicContact CB-CG2 3.32Å
258	T	30.9	Very low	39.1	Very low	53 Å²	53	51 Å²	51	33%	0.325	26%	0.264	S	S	.	.			trans	-149.3	143.7	174.6	-31.3	0	0	0	0	104.4	D210 G211	D210-T258 VanDerWaalsContact O-CG2 3.25Å; D210-T258 WeakPolarHBondContact O-CG2 3.12Å; G211-T258 WeakPolarHBondContact O-CA 3.35Å; G211-T258 PolarHBondContact O-N 3.38Å
259	E	30.4	Very low	39	Very low	146 Å²	146	55.6 Å²	55.6	68%	0.682	30%	0.297	S	S	*	.			cis	-155.6	111	29.3	177.6	-177.8	-116.9	0	0	109.3
260	L	35.8	Very low	39.9	Very low	13 Å²	13	58.2 Å²	58.2	7%	0.068	31%	0.309	C	S	.	.			trans	-159.6	142.8	-161.9	-80.6	177.1	0	0	0	114.3	V206 E209 G211 I213 V228 L230 Y236 G262	V206-L260 HydrophobicContact CG1-CB 4.31Å; V206-L260 HydrophobicContact CG2-CB 4.25Å; V206-L260 HydrophobicContact CG2-CD1 4.06Å; E209-L260 CarbonylContact C-O 3.58Å; E209-L260 VanDerWaalsContact O-O 3.09Å; G211-L260 VanDerWaalsContact CA-O 3.27Å; G211-L260 WeakPolarHBondContact CA-O 3.44Å; G211-L260 PolarHBondContact N-O 3.49Å; I213-L260 HydrophobicContact CD1-CD1 4.18Å; V228-L260 HydrophobicContact CG1-CD1 4.38Å; L230-L260 HydrophobicContact CD1-CD1 3.73Å; L230-L260 HydrophobicContact CD1-CD2 3.39Å; L230-L260 HydrophobicContact CD1-CG 4.11Å; L230-L260 HydrophobicContact CD2-CD1 4.02Å; L230-L260 HydrophobicContact CG-CD1 3.71Å; L230-L260 HydrophobicContact CG-CD2 4.1Å; Y236-L260 HydrophobicContact CD1-CD2 4.49Å; Y236-L260 HydrophobicContact CD2-CD2 4.19Å; Y236-L260 HydrophobicContact CE1-CD2 3.88Å; Y236-L260 HydrophobicContact CE2-CD2 3.55Å; Y236-L260 HydrophobicContact CE2-CG 4.41Å; Y236-L260 WeakPolarHBondContact OH-CD2 3.22Å; L260-G262 PolarHBondContact O-N 2.86Å
261	V	32.2	Very low	41.9	Very low	139 Å²	139	55.9 Å²	55.9	84%	0.842	29%	0.293	S	S	*	.			trans	-73.5	89.1	179.3	-175.3	0	0	0	0	111.4
262	G	34.7	Very low	43.5	Very low	10 Å²	10	62.3 Å²	62.3	10%	0.103	31%	0.311	C	S	.	.			trans	-68.4	144.5	-179.6	0	0	0	0	0	115.1	V206 L260 R264	V206-G262 VanDerWaalsContact CG1-CA 3.42Å; L260-G262 PolarHBondContact O-N 2.86Å; G262-R264 PolarHBondContact O-N 2.89Å
263	C	34.5	Very low	45.1	Very low	50 Å²	50	65.5 Å²	65.5	34%	0.338	34%	0.338	S	S	.	.			trans	-74	121.5	159.7	176.8	0	0	0	0	108.1	A180 V265	A180-C263 HydrophobicContact CB-CB 3.72Å; C263-V265 PolarHBondContact O-N 3.46Å
264	R	43.4	Very low	46.8	Very low	195 Å²	195	65.5 Å²	65.5	74%	0.736	35%	0.351	S	S	*	.			trans	-51.3	105.6	-178.7	-177.7	173.4	-62.5	-171	-0.7	111.9	E209 G262	E209-R264 IonicContact OE1-CZ 2.69Å; E209-R264 IonicContact OE1-NE 3.43Å; E209-R264 IonicContact OE1-NH2 3.84Å; E209-R264 PolarHBondContact OE1-NH2 2.84Å; E209-R264 VanDerWaalsContact OE1-NH2 3.12Å; G262-R264 PolarHBondContact O-N 2.89Å
265	V	51.7	Low	49.1	Very low	29 Å²	29	66.2 Å²	66.2	18%	0.176	35%	0.354	C	S	.	.			trans	-67.6	133.1	175.1	171.1	0	0	0	0	108.9	F205 V207 C263 W267 V338	F205-V265 HydrophobicContact CD2-CG2 4.39Å; F205-V265 HydrophobicContact CE2-CG2 4.49Å; V207-V265 HydrophobicContact CB-CG2 4.29Å; V207-V265 HydrophobicContact CG1-CG2 4.18Å; C263-V265 PolarHBondContact O-N 3.46Å; V265-W267 HydrophobicContact CG1-CD2 3.96Å; V265-W267 HydrophobicContact CG1-CE3 4.01Å; V265-W267 HydrophobicContact CG1-CH2 3.78Å; V265-W267 HydrophobicContact CG1-CZ2 3.69Å; V265-W267 HydrophobicContact CG1-CZ3 3.92Å; V265-V338 HydrophobicContact CB-CG2 4.48Å; V265-V338 HydrophobicContact CG1-CB 3.87Å; V265-V338 HydrophobicContact CG1-CG2 3.75Å; V265-V338 HydrophobicContact CG2-CG2 4.02Å
266	R	50.2	Low	51.4	Low	140 Å²	140	71.2 Å²	71.2	53%	0.528	38%	0.376	S	S	.	.			trans	-115.4	140.4	167.1	-174.1	-174.2	-50.7	116.3	-6.8	107.5	D337 V338	R266-D337 HydrophobicContact CB-CB 4.43Å; R266-D337 WeakPolarHBondContact CB-OD1 3.33Å; R266-D337 VanDerWaalsContact CD-OD1 3.31Å; R266-D337 WeakPolarHBondContact CD-OD1 3.3Å; R266-D337 IonicContact CZ-OD1 3.53Å; R266-D337 IonicContact NE-OD1 2.75Å; R266-D337 IonicContact NH1-OD1 2.9Å; R266-D337 PolarHBondContact NH1-OD1 3.38Å; R266-D337 CarbonylContact O-C 3.5Å; R266-D337 WeakPolarHBondContact O-CA 3.21Å; R266-D337 VanDerWaalsContact O-CB 3.29Å; R266-D337 WeakPolarHBondContact O-CB 3.21Å; R266-V338 PolarHBondContact O-N 3.35Å
267	W	58.2	Low	53.7	Low	55 Å²	55	70.3 Å²	70.3	21%	0.208	37%	0.372	C	S	.	.			trans	-101.7	141.7	175	-48	109.4	0	0	0	109.2	F205 L214 V265 V338 I359 R360 L363	F205-W267 HydrophobicContact CE2-CH2 4.48Å; L214-W267 HydrophobicContact CD1-CH2 4.48Å; V265-W267 HydrophobicContact CG1-CD2 3.96Å; V265-W267 HydrophobicContact CG1-CE3 4.01Å; V265-W267 HydrophobicContact CG1-CH2 3.78Å; V265-W267 HydrophobicContact CG1-CZ2 3.69Å; V265-W267 HydrophobicContact CG1-CZ3 3.92Å; W267-V338 HydrophobicContact CE3-CB 4.18Å; W267-V338 HydrophobicContact CE3-CG1 4.45Å; W267-V338 HydrophobicContact CZ3-CB 3.87Å; W267-V338 HydrophobicContact CZ3-CG1 3.76Å; W267-I359 HydrophobicContact CH2-CB 4.26Å; W267-I359 HydrophobicContact CH2-CD1 4.04Å; W267-I359 HydrophobicContact CH2-CG2 3.69Å; W267-I359 HydrophobicContact CZ2-CG2 4.11Å; W267-I359 HydrophobicContact CZ3-CB 4.48Å; W267-I359 HydrophobicContact CZ3-CD1 3.77Å; W267-I359 HydrophobicContact CZ3-CG2 4.37Å; W267-R360 HydrophobicContact CB-CG 4.48Å; W267-R360 HydrophobicContact CD2-CG 4.09Å; W267-R360 HydrophobicContact CG-CG 3.85Å; W267-L363 HydrophobicContact CZ2-CD1 4.18Å
268	P	58.2	Low	56.1	Low	6 Å²	6	70.2 Å²	70.2	4%	0.039	37%	0.371	C	S	.	.			trans	-68.7	162.8	169.7	34.1	-39	0	0	0	111	V338 I339	P268-V338 WeakPolarHBondContact CD-O 3.45Å; P268-I339 HydrophobicContact CG-CB 4.3Å; P268-I339 HydrophobicContact CG-CG2 3.87Å
269	C	48.5	Very low	58.9	Low	113 Å²	113	67.7 Å²	67.7	76%	0.764	36%	0.355	S	S	*	.	S	Bend	trans	-95.7	-18.9	164.4	-65.9	0	0	0	0	113.1
270	C	58.4	Low	61.8	Low	83 Å²	83	60.7 Å²	60.7	56%	0.561	32%	0.323	S	S	*	.			trans	-147.2	145.8	178.4	-52.2	0	0	0	0	109
271	L	63.2	Low	64.4	Low	23 Å²	23	60.1 Å²	60.1	12%	0.12	32%	0.32	C	S	.	.			trans	-116.7	139.2	167.4	179	64.1	0	0	0	108.8	E275 M277 A298 I315 I339	L271-E275 HydrophobicContact CD1-CB 4.39Å; L271-M277 HydrophobicContact CD1-CE 3.9Å; L271-M277 HydrophobicContact CD2-CE 3.77Å; L271-M277 HydrophobicContact CG-CE 4.33Å; L271-A298 HydrophobicContact CB-CB 4.04Å; L271-A298 HydrophobicContact CD2-CB 4.04Å; L271-A298 HydrophobicContact CG-CB 3.91Å; L271-A298 WeakPolarHBondContact O-CB 3.32Å; L271-I315 HydrophobicContact CD2-CB 4.49Å; L271-I315 HydrophobicContact CD2-CD1 3.72Å; L271-I315 HydrophobicContact CD2-CG1 3.78Å; L271-I315 HydrophobicContact CD2-CG2 3.94Å; L271-I339 HydrophobicContact CD1-CD1 3.99Å
272	W	64.8	Low	66.9	Low	175 Å²	175	53.9 Å²	53.9	66%	0.663	28%	0.282	S	S	*	.			trans	-112.5	143.8	177.5	-63.5	-24.6	0	0	0	111.6	E275 S295	W272-E275 HydrophobicContact CB-CG 4.14Å; W272-E275 WeakPolarHBondContact O-CB 3.49Å; W272-E275 PolarHBondContact O-N 3.36Å; W272-S295 VanDerWaalsContact O-CB 3.28Å; W272-S295 WeakPolarHBondContact O-CB 3.32Å; W272-S295 PolarHBondContact O-OG 2.69Å
273	A	66.3	Low	68.6	Low	75 Å²	75	54.2 Å²	54.2	62%	0.62	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	140.1	169	0	0	0	0	0	110.2	E275	A273-E275 VanDerWaalsContact C-N 3.35Å
274	G	70.1	Confident	70.4	Confident	45 Å²	45	57.7 Å²	57.7	46%	0.464	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.8	-4.4	-172.2	0	0	0	0	0	115.8	F276 S295	G274-F276 PolarHBondContact O-N 3.47Å; G274-S295 PolarHBondContact N-O 3.25Å
275	E	81.4	Confident	71.3	Confident	19 Å²	19	51 Å²	51	9%	0.089	27%	0.274	C	S	.	.			trans	-65.2	132.8	172.1	-81.9	-165.5	-179.7	0	0	111.4	L271 W272 A273 I294 S295	L271-E275 HydrophobicContact CD1-CB 4.39Å; W272-E275 HydrophobicContact CB-CG 4.14Å; W272-E275 WeakPolarHBondContact O-CB 3.49Å; W272-E275 PolarHBondContact O-N 3.36Å; A273-E275 VanDerWaalsContact C-N 3.35Å; E275-I294 CarbonylContact O-C 3.43Å; E275-I294 VanDerWaalsContact O-CA 3.3Å; E275-I294 WeakPolarHBondContact O-CA 3.42Å; E275-S295 PolarHBondContact O-N 3.01Å
276	F	86.2	Confident	71.9	Confident	105 Å²	105	54.8 Å²	54.8	46%	0.461	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	136.5	173.9	-76.3	-77.4	0	0	0	112.3	G274 I292 G293 I294 L333	G274-F276 PolarHBondContact O-N 3.47Å; F276-I292 HydrophobicContact CD1-CD1 4.33Å; F276-G293 WeakPolarHBondContact CA-O 3.46Å; F276-I294 HydrophobicContact CD1-CG2 3.61Å; F276-I294 HydrophobicContact CE1-CG2 3.81Å; F276-I294 HydrophobicContact CG-CG2 4.16Å; F276-L333 HydrophobicContact CB-CD1 3.33Å; F276-L333 HydrophobicContact CB-CG 3.73Å; F276-L333 HydrophobicContact CD2-CD1 4.47Å; F276-L333 HydrophobicContact CG-CD1 3.97Å; F276-L333 PolarHBondContact O-N 3.1Å
277	M	88.1	Confident	73.1	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	152.2	-175.6	-58.9	175.3	162.4	0	0	111.2	L271 G293 I315 T317 L330 V331 I339	L271-M277 HydrophobicContact CD1-CE 3.9Å; L271-M277 HydrophobicContact CD2-CE 3.77Å; L271-M277 HydrophobicContact CG-CE 4.33Å; M277-G293 PolarHBondContact N-O 3.24Å; M277-G293 PolarHBondContact O-N 3.43Å; M277-G293 VanDerWaalsContact O-N 3.08Å; M277-I315 HydrophobicContact CE-CG2 3.44Å; M277-I315 VanDerWaalsContact CE-CG2 3.44Å; M277-I315 HydrophobicContact SD-CG2 4.17Å; M277-T317 HydrophobicContact SD-CG2 4.42Å; M277-L330 HydrophobicContact CB-CD1 3.93Å; M277-L330 HydrophobicContact CB-CG 4.42Å; M277-L330 HydrophobicContact CE-CD2 4.37Å; M277-L330 HydrophobicContact SD-CD1 4.34Å; M277-L330 HydrophobicContact SD-CD2 3.85Å; M277-L330 HydrophobicContact SD-CG 4.34Å; M277-V331 WeakPolarHBondContact CA-O 3.32Å; M277-I339 HydrophobicContact CE-CD1 3.48Å; M277-I339 VanDerWaalsContact CE-CD1 3.48Å; M277-I339 HydrophobicContact CG-CD1 3.75Å; M277-I339 HydrophobicContact SD-CD1 4.05Å
278	V	90.8	Very high	74.2	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	121.4	168	-171.6	0	0	0	0	108.9	I170 V173 V174 V280 V290 T291 V331 L333	I170-V278 HydrophobicContact CD1-CG2 4.07Å; I170-V278 HydrophobicContact CG2-CG2 4.45Å; V173-V278 HydrophobicContact CG1-CG2 4.29Å; V174-V278 HydrophobicContact CG2-CG1 4.39Å; V278-V280 HydrophobicContact CB-CG2 4.44Å; V278-V280 HydrophobicContact CG1-CG2 3.66Å; V278-V290 HydrophobicContact CG1-CG1 3.56Å; V278-T291 WeakPolarHBondContact CA-O 3.07Å; V278-V331 PolarHBondContact N-O 3.2Å; V278-V331 PolarHBondContact O-N 3.29Å; V278-L333 HydrophobicContact CG2-CD2 3.41Å; V278-L333 VanDerWaalsContact CG2-CD2 3.41Å
279	A	90.9	Very high	75.5	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	107.7	168.6	0	0	0	0	0	108	T291 A319 I321 L330 N342	A279-T291 PolarHBondContact N-O 2.86Å; A279-T291 PolarHBondContact O-N 2.89Å; A279-A319 HydrophobicContact CB-CB 4.41Å; A279-I321 HydrophobicContact CB-CG1 4.48Å; A279-L330 HydrophobicContact CB-CD1 3.97Å; A279-N342 VanDerWaalsContact CB-OD1 3.27Å; A279-N342 WeakPolarHBondContact CB-OD1 3.03Å
280	V	90.6	Very high	77.5	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	142.8	178.9	-169.7	0	0	0	0	109.6	I177 V181 V278 V290 G328 P329 N342	I177-V280 HydrophobicContact CD1-CG2 4.49Å; I177-V280 HydrophobicContact CG2-CG2 4.3Å; V181-V280 HydrophobicContact CB-CG1 4.49Å; V181-V280 HydrophobicContact CG1-CG1 4.45Å; V181-V280 HydrophobicContact CG2-CB 4.27Å; V181-V280 HydrophobicContact CG2-CG1 3.84Å; V278-V280 HydrophobicContact CB-CG2 4.44Å; V278-V280 HydrophobicContact CG1-CG2 3.66Å; V280-V290 HydrophobicContact CG1-CG2 4.42Å; V280-G328 WeakPolarHBondContact O-CA 3.5Å; V280-P329 PolarHBondContact N-O 3.27Å; V280-P329 VanDerWaalsContact N-O 3.08Å; V280-P329 WeakPolarHBondContact O-CD 3Å; V280-N342 PolarHBondContact O-ND2 3.44Å
281	G	89.3	Confident	79	Confident	0 Å²	0	49 Å²	49	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	178.8	174.1	0	0	0	0	0	112.7	S203 N288 T289	S203-G281 VanDerWaalsContact OG-CA 3.29Å; S203-G281 WeakPolarHBondContact OG-CA 3.38Å; G281-N288 CarbonylContact O-C 3.57Å; G281-N288 WeakPolarHBondContact O-CA 3.35Å; G281-N288 WeakPolarHBondContact O-CB 3.41Å; G281-N288 PolarHBondContact O-ND2 2.91Å; G281-T289 PolarHBondContact N-O 2.96Å; G281-T289 PolarHBondContact O-N 2.87Å
282	S	85.8	Confident	80.3	Confident	8 Å²	8	51.9 Å²	51.9	6%	0.056	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	99.8	168.3	-172.5	0	0	0	0	108.2	H183 S203 F284 Q287 G324	H183-S282 PolarHBondContact ND1-O 3.31Å; S203-S282 PolarHBondContact OG-N 3.47Å; S203-S282 PolarHBondContact OG-O 2.85Å; S282-F284 VanDerWaalsContact C-N 3.32Å; S282-F284 PolarHBondContact OG-O 3.11Å; S282-Q287 VanDerWaalsContact CA-O 3.23Å; S282-Q287 WeakPolarHBondContact CA-O 3.08Å; S282-Q287 WeakPolarHBondContact CB-O 3.26Å; S282-Q287 PolarHBondContact OG-O 2.96Å; S282-G324 CarbonylContact C-O 3.55Å; S282-G324 PolarHBondContact N-O 2.97Å
283	P	69.7	Low	81.4	Confident	18 Å²	18	43.8 Å²	43.8	12%	0.117	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	-20.9	-177.7	31.3	-39.5	0	0	0	113.8	H183 Q287 T289	H183-P283 PolarHBondContact CE1-O 3.2Å; P283-Q287 WeakPolarHBondContact CD-O 3.34Å; P283-T289 WeakPolarHBondContact CD-OG1 3.28Å; P283-T289 WeakPolarHBondContact CG-OG1 3.42Å
284	F	73.2	Confident	82.3	Confident	122 Å²	122	43 Å²	43	54%	0.535	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	158.8	-169.9	-61.7	-61.1	0	0	0	109.3	H183 S282 L286 Q287	H183-F284 PolarHBondContact CE1-N 3.17Å; S282-F284 VanDerWaalsContact C-N 3.32Å; S282-F284 PolarHBondContact OG-O 3.11Å; F284-L286 PolarHBondContact O-N 3.08Å; F284-Q287 HydrophobicContact CB-CB 4.31Å; F284-Q287 PolarHBondContact O-N 3.48Å; F284-Q287 VanDerWaalsContact O-N 3.11Å
285	P	62.6	Low	82.9	Confident	55 Å²	55	41 Å²	41	36%	0.357	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-36.9	131.1	164.5	-37	40.3	0	0	0	114.3	E229 Q287	E229-P285 WeakPolarHBondContact OE1-CA 3.49Å; E229-P285 WeakPolarHBondContact OE2-CA 3.47Å; E229-P285 WeakPolarHBondContact OE2-CB 3.29Å; E229-P285 VanDerWaalsContact OE2-CG 3.31Å; E229-P285 WeakPolarHBondContact OE2-CG 3.37Å; P285-Q287 PolarHBondContact O-N 2.89Å
286	L	63.3	Low	82.3	Confident	108 Å²	108	42.4 Å²	42.4	57%	0.565	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.8	3.3	-179.2	-59.5	177.5	0	0	0	117.6	E229 F284	E229-L286 PolarHBondContact OE1-N 2.93Å; F284-L286 PolarHBondContact O-N 3.08Å
287	Q	75.9	Confident	81.3	Confident	112 Å²	112	39 Å²	39	52%	0.523	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	143	-175.9	-64.6	-176.8	31.7	0	0	111.8	S282 P283 F284 P285	S282-Q287 VanDerWaalsContact CA-O 3.23Å; S282-Q287 WeakPolarHBondContact CA-O 3.08Å; S282-Q287 WeakPolarHBondContact CB-O 3.26Å; S282-Q287 PolarHBondContact OG-O 2.96Å; P283-Q287 WeakPolarHBondContact CD-O 3.34Å; F284-Q287 HydrophobicContact CB-CB 4.31Å; F284-Q287 PolarHBondContact O-N 3.48Å; F284-Q287 VanDerWaalsContact O-N 3.11Å; P285-Q287 PolarHBondContact O-N 2.89Å
288	N	81	Confident	79.9	Confident	48 Å²	48	39.9 Å²	39.9	26%	0.257	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	130.2	173.4	-69.7	78.4	0	0	0	110.8	G281	G281-N288 CarbonylContact O-C 3.57Å; G281-N288 WeakPolarHBondContact O-CA 3.35Å; G281-N288 WeakPolarHBondContact O-CB 3.41Å; G281-N288 PolarHBondContact O-ND2 2.91Å
289	T	85.7	Confident	78.4	Confident	34 Å²	34	45.5 Å²	45.5	21%	0.209	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	137.9	163.5	-71.9	0	0	0	0	108.9	G281 P283 T291 N325	G281-T289 PolarHBondContact N-O 2.96Å; G281-T289 PolarHBondContact O-N 2.87Å; P283-T289 WeakPolarHBondContact CD-OG1 3.28Å; P283-T289 WeakPolarHBondContact CG-OG1 3.42Å; T289-T291 HydrophobicContact CG2-CG2 4.38Å; T289-N325 HydrophobicContact CG2-CB 4.37Å
290	V	89.8	Confident	76.8	Confident	56 Å²	56	48.5 Å²	48.5	34%	0.339	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	124.7	176.8	178.8	0	0	0	0	108	I170 V174 V278 V280	I170-V290 HydrophobicContact CG2-CG1 4.49Å; V174-V290 HydrophobicContact CG1-CG2 3.83Å; V174-V290 HydrophobicContact CG2-CB 4.34Å; V174-V290 HydrophobicContact CG2-CG1 3.55Å; V174-V290 HydrophobicContact CG2-CG2 3.84Å; V278-V290 HydrophobicContact CG1-CG1 3.56Å; V280-V290 HydrophobicContact CG1-CG2 4.42Å
291	T	89.9	Confident	75	Confident	25 Å²	25	53.8 Å²	53.8	15%	0.153	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	147.2	169.3	58.2	0	0	0	0	109.7	V278 A279 T289 I320 N325	V278-T291 WeakPolarHBondContact CA-O 3.07Å; A279-T291 PolarHBondContact N-O 2.86Å; A279-T291 PolarHBondContact O-N 2.89Å; T289-T291 HydrophobicContact CG2-CG2 4.38Å; T291-I320 WeakPolarHBondContact CB-O 3.28Å; T291-I320 HydrophobicContact CG2-CB 4.06Å; T291-I320 WeakPolarHBondContact CG2-O 3.04Å; T291-I320 PolarHBondContact OG1-O 3.03Å; T291-N325 PolarHBondContact OG1-ND2 2.82Å
292	I	90.3	Very high	73.1	Confident	84 Å²	84	53.8 Å²	53.8	43%	0.431	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	147.6	179.4	-173.5	-173.7	0	0	0	108.7	I170 F276	I170-I292 HydrophobicContact CD1-CD1 3.47Å; I170-I292 VanDerWaalsContact CD1-CD1 3.47Å; I170-I292 HydrophobicContact CD1-CG1 3.98Å; I170-I292 HydrophobicContact CG1-CD1 3.92Å; F276-I292 HydrophobicContact CD1-CD1 4.33Å
293	G	88.2	Confident	71.1	Confident	5 Å²	5	59.2 Å²	59.2	5%	0.052	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	-163.1	165.6	0	0	0	0	0	111.4	F276 M277 D318	F276-G293 WeakPolarHBondContact CA-O 3.46Å; M277-G293 PolarHBondContact N-O 3.24Å; M277-G293 PolarHBondContact O-N 3.43Å; M277-G293 VanDerWaalsContact O-N 3.08Å; G293-D318 WeakPolarHBondContact CA-OD1 3.5Å
294	I	86.4	Confident	70	Confident	60 Å²	60	64.2 Å²	64.2	31%	0.308	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	162.3	172.4	54.6	167.1	0	0	0	110.9	E275 F276 S296 T317 D318	E275-I294 CarbonylContact O-C 3.43Å; E275-I294 VanDerWaalsContact O-CA 3.3Å; E275-I294 WeakPolarHBondContact O-CA 3.42Å; F276-I294 HydrophobicContact CD1-CG2 3.61Å; F276-I294 HydrophobicContact CE1-CG2 3.81Å; F276-I294 HydrophobicContact CG-CG2 4.16Å; I294-S296 PolarHBondContact O-N 3.12Å; I294-T317 WeakPolarHBondContact O-CA 3.46Å; I294-T317 VanDerWaalsContact O-CB 3.28Å; I294-T317 WeakPolarHBondContact O-CB 3.43Å; I294-T317 PolarHBondContact O-OG1 3.36Å; I294-D318 PolarHBondContact N-OD1 3.42Å
295	S	81.8	Confident	68.8	Low	2 Å²	2	60 Å²	60	1%	0.014	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	105.4	165.6	-172.4	0	0	0	0	110	W272 G274 E275	W272-S295 VanDerWaalsContact O-CB 3.28Å; W272-S295 WeakPolarHBondContact O-CB 3.32Å; W272-S295 PolarHBondContact O-OG 2.69Å; G274-S295 PolarHBondContact N-O 3.25Å; E275-S295 PolarHBondContact O-N 3.01Å
296	S	68.4	Low	68	Low	48 Å²	48	62 Å²	62	34%	0.336	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	-34.3	168.7	-59.3	0	0	0	0	111.1	I294 H316	I294-S296 PolarHBondContact O-N 3.12Å; S296-H316 VanDerWaalsContact CB-ND1 3.32Å; S296-H316 WeakPolarHBondContact CB-ND1 3.37Å; S296-H316 PolarHBondContact N-O 2.83Å
297	S	65.5	Low	67.2	Low	35 Å²	35	59.8 Å²	59.8	25%	0.245	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	132.4	172.8	-42.4	0	0	0	0	110.1	H316	S297-H316 PolarHBondContact N-O 3.15Å; S297-H316 PolarHBondContact O-N 3.02Å; S297-H316 PolarHBondContact OG-ND1 3.19Å
298	A	58.9	Low	65.5	Low	17 Å²	17	58.4 Å²	58.4	14%	0.14	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	-35.4	-177.5	0	0	0	0	0	113.1	L271	L271-A298 HydrophobicContact CB-CB 4.04Å; L271-A298 HydrophobicContact CD2-CB 4.04Å; L271-A298 HydrophobicContact CG-CB 3.91Å; L271-A298 WeakPolarHBondContact O-CB 3.32Å
299	H	60.1	Low	63.6	Low	119 Å²	119	59.6 Å²	59.6	55%	0.551	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.4	115.1	175.1	-65.6	-98	0	0	0	107.4	D313	H299-D313 HydrophobicContact CB-CB 4.39Å; H299-D313 IonicContact CG-OD2 3.74Å; H299-D313 IonicContact ND1-OD2 2.66Å; H299-D313 PolarHBondContact ND1-OD2 2.96Å
300	R	56	Low	61.8	Low	62 Å²	62	58.4 Å²	58.4	23%	0.234	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	114.1	170.8	-165.8	168.9	-168	-146.7	-10.7	109.3	G302 E304 Y314	R300-G302 PolarHBondContact O-N 3.46Å; R300-E304 IonicContact CZ-OE2 3.12Å; R300-E304 IonicContact NE-OE2 2.71Å; R300-E304 PolarHBondContact NE-OE2 3.36Å; R300-E304 IonicContact NH2-OE2 3.32Å; R300-E304 PolarHBondContact NH2-OE2 2.69Å; R300-Y314 PolarHBondContact N-O 3.16Å; R300-Y314 PolarHBondContact O-N 3.37Å
301	K	52.3	Low	59.9	Low	112 Å²	112	63.1 Å²	63.1	49%	0.487	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	132.4	180	-66.9	-170	171	-148.4	0	110.2	L303 E304 D313	K301-L303 HydrophobicContact CB-CB 4.47Å; K301-L303 PolarHBondContact O-N 3Å; K301-L303 VanDerWaalsContact O-N 3.11Å; K301-E304 WeakPolarHBondContact O-CB 3.48Å; K301-E304 PolarHBondContact O-N 2.98Å; K301-D313 WeakPolarHBondContact CG-OD1 3.28Å
302	G	50.2	Low	58.4	Low	0 Å²	0	62.9 Å²	62.9	0%	0	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-57.8	-25.2	176.9	0	0	0	0	0	113.8	R300 E304 L305 F307 S310 L312	R300-G302 PolarHBondContact O-N 3.46Å; G302-E304 PolarHBondContact O-N 2.92Å; G302-L305 WeakPolarHBondContact O-CA 3.31Å; G302-L305 WeakPolarHBondContact O-CB 3.4Å; G302-L305 PolarHBondContact O-N 3.11Å; G302-F307 WeakPolarHBondContact O-CB 3.29Å; G302-F307 PolarHBondContact O-N 3.07Å; G302-S310 WeakPolarHBondContact CA-OG 3.13Å; G302-L312 PolarHBondContact N-O 2.88Å
303	L	43.6	Very low	57.3	Low	121 Å²	121	61.7 Å²	61.7	63%	0.634	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-55.2	-29.9	169.8	-162.1	71.6	0	0	0	113.9	K301 L305	K301-L303 HydrophobicContact CB-CB 4.47Å; K301-L303 PolarHBondContact O-N 3Å; K301-L303 VanDerWaalsContact O-N 3.11Å; L303-L305 VanDerWaalsContact C-N 3.27Å; L303-L305 PolarHBondContact O-N 3.47Å
304	E	46.5	Very low	56.7	Low	123 Å²	123	61.7 Å²	61.7	58%	0.575	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-78.7	-7.3	174.4	-65	-172.2	-169.2	0	0	114.2	R300 K301 G302	R300-E304 IonicContact CZ-OE2 3.12Å; R300-E304 IonicContact NE-OE2 2.71Å; R300-E304 PolarHBondContact NE-OE2 3.36Å; R300-E304 IonicContact NH2-OE2 3.32Å; R300-E304 PolarHBondContact NH2-OE2 2.69Å; K301-E304 WeakPolarHBondContact O-CB 3.48Å; K301-E304 PolarHBondContact O-N 2.98Å; G302-E304 PolarHBondContact O-N 2.92Å
305	L	49.1	Very low	56.3	Low	33 Å²	33	59 Å²	59	17%	0.173	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-110.4	13.8	-173.2	-54.9	177.5	0	0	0	112	G302 L303 F307 Y314 F352	G302-L305 WeakPolarHBondContact O-CA 3.31Å; G302-L305 WeakPolarHBondContact O-CB 3.4Å; G302-L305 PolarHBondContact O-N 3.11Å; L303-L305 VanDerWaalsContact C-N 3.27Å; L303-L305 PolarHBondContact O-N 3.47Å; L305-F307 HydrophobicContact CB-CD2 3.55Å; L305-F307 HydrophobicContact CB-CE2 3.8Å; L305-F307 HydrophobicContact CB-CG 4.28Å; L305-F307 HydrophobicContact CD1-CD2 4Å; L305-F307 HydrophobicContact CD1-CE2 3.94Å; L305-F307 HydrophobicContact CG-CD2 4.41Å; L305-F307 PolarHBondContact O-N 3.26Å; L305-F307 VanDerWaalsContact O-N 3.16Å; L305-Y314 HydrophobicContact CD1-CD2 4.36Å; L305-F352 HydrophobicContact CD1-CD1 3.93Å; L305-F352 HydrophobicContact CD1-CD2 4.31Å; L305-F352 HydrophobicContact CD1-CE1 3.5Å; L305-F352 VanDerWaalsContact CD1-CE1 3.5Å; L305-F352 HydrophobicContact CD1-CE2 3.91Å; L305-F352 HydrophobicContact CD1-CG 4.32Å; L305-F352 HydrophobicContact CD1-CZ 3.51Å; L305-F352 HydrophobicContact CD2-CE1 3.99Å; L305-F352 HydrophobicContact CD2-CE2 4.2Å; L305-F352 HydrophobicContact CD2-CZ 3.46Å; L305-F352 VanDerWaalsContact CD2-CZ 3.46Å; L305-F352 HydrophobicContact CG-CE1 4.41Å; L305-F352 HydrophobicContact CG-CZ 4.13Å
306	D	45	Very low	56.3	Low	99 Å²	99	59.9 Å²	59.9	53%	0.529	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.2	13.8	-168.3	-144.3	36.3	0	0	0	115.4	K308	D306-K308 PolarHBondContact O-N 2.9Å; D306-K308 WeakPolarHBondContact OD1-CE 3.33Å; D306-K308 IonicContact OD1-NZ 2.73Å; D306-K308 PolarHBondContact OD1-NZ 3.36Å; D306-K308 IonicContact OD2-NZ 3.64Å; D306-K308 PolarHBondContact OD2-NZ 3.39Å
307	F	47.4	Very low	57	Low	61 Å²	61	57.6 Å²	57.6	27%	0.268	29%	0.287	S	S	.	.			trans	-78.2	66.9	167.7	-57.8	-46.4	0	0	0	109.9	G302 L305 D309 S310 Y314 L344 V346	G302-F307 WeakPolarHBondContact O-CB 3.29Å; G302-F307 PolarHBondContact O-N 3.07Å; L305-F307 HydrophobicContact CB-CD2 3.55Å; L305-F307 HydrophobicContact CB-CE2 3.8Å; L305-F307 HydrophobicContact CB-CG 4.28Å; L305-F307 HydrophobicContact CD1-CD2 4Å; L305-F307 HydrophobicContact CD1-CE2 3.94Å; L305-F307 HydrophobicContact CG-CD2 4.41Å; L305-F307 PolarHBondContact O-N 3.26Å; L305-F307 VanDerWaalsContact O-N 3.16Å; F307-D309 PolarHBondContact O-N 3.37Å; F307-S310 WeakPolarHBondContact CB-OG 3.41Å; F307-S310 PolarHBondContact O-N 3.32Å; F307-S310 PolarHBondContact O-OG 3.47Å; F307-Y314 HydrophobicContact CD2-CE2 4.43Å; F307-L344 HydrophobicContact CZ-CD1 4.19Å; F307-V346 HydrophobicContact CZ-CG2 4.13Å
308	K	39.1	Very low	57.9	Low	82 Å²	82	59 Å²	59	36%	0.357	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-18.7	-168	-71.6	179.1	173.1	93.2	0	116.6	D306	D306-K308 PolarHBondContact O-N 2.9Å; D306-K308 WeakPolarHBondContact OD1-CE 3.33Å; D306-K308 IonicContact OD1-NZ 2.73Å; D306-K308 PolarHBondContact OD1-NZ 3.36Å; D306-K308 IonicContact OD2-NZ 3.64Å; D306-K308 PolarHBondContact OD2-NZ 3.39Å
309	D	40.7	Very low	59.2	Low	73 Å²	73	58.2 Å²	58.2	39%	0.39	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	2.1	177.7	-52.3	-73.7	0	0	0	114.1	F307 K446 Q447	F307-D309 PolarHBondContact O-N 3.37Å; D309-K446 WeakPolarHBondContact OD2-CD 3.33Å; D309-K446 IonicContact OD2-NZ 2.76Å; D309-Q447 PolarHBondContact OD1-N 2.9Å
310	S	47.6	Very low	60.5	Low	10 Å²	10	57.3 Å²	57.3	7%	0.07	28%	0.284	C	S	.	.			trans	-106.7	97.9	-171.1	61	0	0	0	0	114.3	G302 F307 L312	G302-S310 WeakPolarHBondContact CA-OG 3.13Å; F307-S310 WeakPolarHBondContact CB-OG 3.41Å; F307-S310 PolarHBondContact O-N 3.32Å; F307-S310 PolarHBondContact O-OG 3.47Å; S310-L312 PolarHBondContact O-N 3.12Å
311	D	51.6	Low	61.7	Low	155 Å²	155	54.5 Å²	54.5	83%	0.829	27%	0.273	S	S	*	.			trans	-76.5	46.2	165	-162.7	32.7	0	0	0	111.1
312	L	57.1	Low	62.9	Low	19 Å²	19	52.6 Å²	52.6	10%	0.099	27%	0.268	C	S	.	.			trans	-124.9	129.6	-170.9	-65.9	159.8	0	0	0	109.2	M247 G302 S310 Y314 R358	M247-L312 WeakPolarHBondContact O-CD1 3.27Å; G302-L312 PolarHBondContact N-O 2.88Å; S310-L312 PolarHBondContact O-N 3.12Å; L312-Y314 HydrophobicContact CB-CE2 4.06Å; L312-R358 HydrophobicContact CD2-CG 4.45Å
313	D	68.3	Low	64	Low	59 Å²	59	62.4 Å²	62.4	32%	0.316	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	133.4	165.3	-76.7	-26.7	0	0	0	109.8	H299 K301 P355	H299-D313 HydrophobicContact CB-CB 4.39Å; H299-D313 IonicContact CG-OD2 3.74Å; H299-D313 IonicContact ND1-OD2 2.66Å; H299-D313 PolarHBondContact ND1-OD2 2.96Å; K301-D313 WeakPolarHBondContact CG-OD1 3.28Å; D313-P355 WeakPolarHBondContact O-CD 3.38Å; D313-P355 VanDerWaalsContact O-CG 3.26Å; D313-P355 WeakPolarHBondContact O-CG 3.35Å
314	Y	74.6	Confident	65.5	Low	5 Å²	5	57.1 Å²	57.1	2%	0.02	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	147.7	167.4	-61.5	-88.6	0	0	0	110.6	R300 L305 F307 L312 F352	R300-Y314 PolarHBondContact N-O 3.16Å; R300-Y314 PolarHBondContact O-N 3.37Å; L305-Y314 HydrophobicContact CD1-CD2 4.36Å; F307-Y314 HydrophobicContact CD2-CE2 4.43Å; L312-Y314 HydrophobicContact CB-CE2 4.06Å; Y314-F352 HydrophobicContact CD1-CB 4.48Å
315	I	77.6	Confident	67.4	Low	3 Å²	3	51.3 Å²	51.3	2%	0.015	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	125.4	165.8	-64.7	171.1	0	0	0	107.5	L271 M277 L330 I339 F352 A353 P355	L271-I315 HydrophobicContact CD2-CB 4.49Å; L271-I315 HydrophobicContact CD2-CD1 3.72Å; L271-I315 HydrophobicContact CD2-CG1 3.78Å; L271-I315 HydrophobicContact CD2-CG2 3.94Å; M277-I315 HydrophobicContact CE-CG2 3.44Å; M277-I315 VanDerWaalsContact CE-CG2 3.44Å; M277-I315 HydrophobicContact SD-CG2 4.17Å; I315-L330 HydrophobicContact CG2-CD2 3.92Å; I315-I339 HydrophobicContact CD1-CG1 4.34Å; I315-I339 WeakPolarHBondContact CD1-O 3.42Å; I315-F352 VanDerWaalsContact O-CA 3.31Å; I315-F352 WeakPolarHBondContact O-CA 3.45Å; I315-A353 HydrophobicContact CB-CB 4.3Å; I315-A353 PolarHBondContact N-O 2.99Å; I315-A353 PolarHBondContact O-N 3.02Å; I315-P355 HydrophobicContact CD1-CB 4.05Å; I315-P355 HydrophobicContact CG1-CB 4.05Å
316	H	81.6	Confident	69.1	Low	21 Å²	21	50 Å²	50	10%	0.097	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	125.8	177.5	177.8	-149.9	0	0	0	109.9	S296 S297 F352	S296-H316 VanDerWaalsContact CB-ND1 3.32Å; S296-H316 WeakPolarHBondContact CB-ND1 3.37Å; S296-H316 PolarHBondContact N-O 2.83Å; S297-H316 PolarHBondContact N-O 3.15Å; S297-H316 PolarHBondContact O-N 3.02Å; S297-H316 PolarHBondContact OG-ND1 3.19Å; H316-F352 HydrophobicContact CB-CD1 4.17Å; H316-F352 HydrophobicContact CB-CE1 3.78Å; H316-F352 AromaticContact CD2-CE1 3.7Å; H316-F352 AromaticContact CD2-CZ 3.98Å; H316-F352 AromaticContact CG-CE1 3.83Å
317	T	83.1	Confident	70.8	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	150	179.5	-175.5	0	0	0	0	112.2	M277 I294 A319 S351	M277-T317 HydrophobicContact SD-CG2 4.42Å; I294-T317 WeakPolarHBondContact O-CA 3.46Å; I294-T317 VanDerWaalsContact O-CB 3.28Å; I294-T317 WeakPolarHBondContact O-CB 3.43Å; I294-T317 PolarHBondContact O-OG1 3.36Å; T317-A319 VanDerWaalsContact C-N 3.28Å; T317-A319 HydrophobicContact CG2-CB 3.86Å; T317-A319 WeakPolarHBondContact OG1-CB 3.3Å; T317-A319 PolarHBondContact OG1-N 2.85Å; T317-A319 VanDerWaalsContact OG1-N 3.13Å; T317-S351 PolarHBondContact N-O 2.75Å; T317-S351 PolarHBondContact O-N 3.23Å
318	D	84.9	Confident	72.8	Confident	65 Å²	65	42.4 Å²	42.4	35%	0.348	21%	0.21	S	C	.	.			trans	-80.1	-7.9	169	67.8	-24.4	0	0	0	113.2	G293 I294 I320 G349	G293-D318 WeakPolarHBondContact CA-OD1 3.5Å; I294-D318 PolarHBondContact N-OD1 3.42Å; D318-I320 PolarHBondContact O-N 3.39Å; D318-G349 WeakPolarHBondContact CA-O 3.41Å
319	A	87.1	Confident	75.2	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.193	C	C	.	.	S	Bend	trans	-54.9	126.2	173.7	0	0	0	0	0	110.1	A279 T317 I321 S351	A279-A319 HydrophobicContact CB-CB 4.41Å; T317-A319 VanDerWaalsContact C-N 3.28Å; T317-A319 HydrophobicContact CG2-CB 3.86Å; T317-A319 WeakPolarHBondContact OG1-CB 3.3Å; T317-A319 PolarHBondContact OG1-N 2.85Å; T317-A319 VanDerWaalsContact OG1-N 3.13Å; A319-I321 PolarHBondContact O-N 2.85Å; A319-I321 VanDerWaalsContact O-N 3.07Å; A319-S351 WeakPolarHBondContact O-CB 3.07Å; A319-S351 PolarHBondContact O-OG 2.04Å
320	I	86	Confident	77.6	Confident	101 Å²	101	35 Å²	35	52%	0.518	18%	0.175	S	C	.	.			trans	-69.6	111.4	-174.8	-61.1	173.8	0	0	0	109.6	T291 D318 N325	T291-I320 WeakPolarHBondContact CB-O 3.28Å; T291-I320 HydrophobicContact CG2-CB 4.06Å; T291-I320 WeakPolarHBondContact CG2-O 3.04Å; T291-I320 PolarHBondContact OG1-O 3.03Å; D318-I320 PolarHBondContact O-N 3.39Å; I320-N325 PolarHBondContact O-ND2 3.22Å; I320-N325 VanDerWaalsContact O-ND2 3.12Å
321	I	82.3	Confident	79.5	Confident	2 Å²	2	34.6 Å²	34.6	1%	0.01	17%	0.172	C	C	.	.			trans	-94.2	139.3	169.7	-68	176.1	0	0	0	109.3	A279 A319 N325 N342 K345 S351 F352	A279-I321 HydrophobicContact CB-CG1 4.48Å; A319-I321 PolarHBondContact O-N 2.85Å; A319-I321 VanDerWaalsContact O-N 3.07Å; I321-N325 VanDerWaalsContact CA-OD1 3.3Å; I321-N325 WeakPolarHBondContact CA-OD1 3.31Å; I321-N342 HydrophobicContact CD1-CB 3.75Å; I321-N342 HydrophobicContact CG1-CB 4.1Å; I321-N342 HydrophobicContact CG2-CB 4.43Å; I321-K345 WeakPolarHBondContact O-CB 3.38Å; I321-S351 PolarHBondContact N-OG 3.23Å; I321-F352 WeakPolarHBondContact CD1-O 3.26Å
322	N	78.3	Confident	81	Confident	72 Å²	72	27.3 Å²	27.3	39%	0.385	13%	0.133	S	C	.	.			trans	-147.5	176.1	176.4	66.4	21.2	0	0	0	110.2	G324 N325 S326	N322-G324 PolarHBondContact O-N 3.46Å; N322-G324 VanDerWaalsContact O-N 3.07Å; N322-G324 VanDerWaalsContact OD1-CA 3.23Å; N322-G324 WeakPolarHBondContact OD1-CA 3.07Å; N322-G324 PolarHBondContact OD1-N 2.95Å; N322-N325 PolarHBondContact N-OD1 2.98Å; N322-N325 PolarHBondContact O-N 2.95Å; N322-N325 PolarHBondContact O-OD1 3.03Å; N322-N325 VanDerWaalsContact O-OD1 3.1Å; N322-N325 PolarHBondContact OD1-N 2.92Å; N322-N325 VanDerWaalsContact OD1-N 3.14Å; N322-N325 PolarHBondContact OD1-OD1 2.73Å; N322-S326 WeakPolarHBondContact O-CB 3.25Å; N322-S326 PolarHBondContact O-N 3.45Å
323	Y	72.9	Confident	82	Confident	207 Å²	207	27.4 Å²	27.4	81%	0.812	13%	0.133	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-28.4	176.5	-61.8	-70.6	0	0	0	113.5	N325	Y323-N325 PolarHBondContact O-N 2.77Å
324	G	75.2	Confident	82	Confident	10 Å²	10	31.5 Å²	31.5	10%	0.103	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-7.8	179.2	0	0	0	0	0	116.5	S203 S282 N322	S203-G324 PolarHBondContact OG-O 3.44Å; S282-G324 CarbonylContact C-O 3.55Å; S282-G324 PolarHBondContact N-O 2.97Å; N322-G324 PolarHBondContact O-N 3.46Å; N322-G324 VanDerWaalsContact O-N 3.07Å; N322-G324 VanDerWaalsContact OD1-CA 3.23Å; N322-G324 WeakPolarHBondContact OD1-CA 3.07Å; N322-G324 PolarHBondContact OD1-N 2.95Å
325	N	86.9	Confident	81.6	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-134.6	-2.3	169.7	68.7	1.8	0	0	0	115.2	T289 T291 I320 I321 N322 Y323 G327 G328 N342	T289-N325 HydrophobicContact CG2-CB 4.37Å; T291-N325 PolarHBondContact OG1-ND2 2.82Å; I320-N325 PolarHBondContact O-ND2 3.22Å; I320-N325 VanDerWaalsContact O-ND2 3.12Å; I321-N325 VanDerWaalsContact CA-OD1 3.3Å; I321-N325 WeakPolarHBondContact CA-OD1 3.31Å; N322-N325 PolarHBondContact N-OD1 2.98Å; N322-N325 PolarHBondContact O-N 2.95Å; N322-N325 PolarHBondContact O-OD1 3.03Å; N322-N325 VanDerWaalsContact O-OD1 3.1Å; N322-N325 PolarHBondContact OD1-N 2.92Å; N322-N325 VanDerWaalsContact OD1-N 3.14Å; N322-N325 PolarHBondContact OD1-OD1 2.73Å; Y323-N325 PolarHBondContact O-N 2.77Å; N325-G327 PolarHBondContact O-N 2.72Å; N325-G328 WeakPolarHBondContact O-CA 3.5Å; N325-G328 PolarHBondContact O-N 2.95Å; N325-N342 VanDerWaalsContact O-CB 3.24Å; N325-N342 WeakPolarHBondContact O-CB 3.11Å; N325-N342 PolarHBondContact O-ND2 3.13Å
326	S	83.9	Confident	81.3	Confident	6 Å²	6	41.8 Å²	41.8	4%	0.042	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	131.9	168.9	-166.8	0	0	0	0	110.6	S203 N216 H218 N322 G328 N342 N343	S203-S326 WeakPolarHBondContact CB-O 3.47Å; S203-S326 PolarHBondContact N-O 3.1Å; N216-S326 PolarHBondContact ND2-OG 3.07Å; H218-S326 PolarHBondContact CE1-OG 2.95Å; H218-S326 PolarHBondContact NE2-OG 3.04Å; N322-S326 WeakPolarHBondContact O-CB 3.25Å; N322-S326 PolarHBondContact O-N 3.45Å; S326-G328 PolarHBondContact O-N 2.66Å; S326-N342 WeakPolarHBondContact CA-O 3.44Å; S326-N343 PolarHBondContact OG-O 2.76Å
327	G	81.4	Confident	81.2	Confident	0 Å²	0	41 Å²	41	0%	0	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.9	-13.3	-171.8	0	0	0	0	0	114.4	S203 T215 N216 N325 I341 N342	S203-G327 CarbonylContact O-C 3.59Å; S203-G327 WeakPolarHBondContact O-CA 3.41Å; S203-G327 VanDerWaalsContact O-O 3.13Å; T215-G327 WeakPolarHBondContact CA-O 3Å; N216-G327 VanDerWaalsContact CG-CA 3.47Å; N216-G327 PolarHBondContact ND2-N 2.69Å; N325-G327 PolarHBondContact O-N 2.72Å; G327-I341 WeakPolarHBondContact O-CG2 3.48Å; G327-N342 PolarHBondContact N-O 2.77Å
328	G	88.1	Confident	81.2	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	19%	0.193	C	C	.	.	S	Bend	trans	-73.9	167.6	171.4	0	0	0	0	0	112.3	S203 V280 N325 S326 N342	S203-G328 PolarHBondContact O-N 3.31Å; V280-G328 WeakPolarHBondContact O-CA 3.5Å; N325-G328 WeakPolarHBondContact O-CA 3.5Å; N325-G328 PolarHBondContact O-N 2.95Å; S326-G328 PolarHBondContact O-N 2.66Å; G328-N342 VanDerWaalsContact C-ND2 3.3Å; G328-N342 WeakPolarHBondContact O-CB 3.4Å; G328-N342 VanDerWaalsContact O-CG 3.27Å; G328-N342 PolarHBondContact O-N 3.2Å; G328-N342 PolarHBondContact O-ND2 2.78Å; G328-N342 VanDerWaalsContact O-ND2 3.11Å
329	P	90.8	Very high	81.2	Confident	1 Å²	1	38.5 Å²	38.5	1%	0.006	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	142.8	-178.1	30.7	-32.4	0	0	0	111.8	I177 V181 F205 V280 V331 V338 N342	I177-P329 HydrophobicContact CG2-CG 4.16Å; V181-P329 HydrophobicContact CG2-CG 3.8Å; F205-P329 HydrophobicContact CB-CB 4.35Å; F205-P329 HydrophobicContact CB-CG 3.93Å; F205-P329 HydrophobicContact CD1-CB 3.75Å; F205-P329 HydrophobicContact CD1-CG 4.07Å; F205-P329 HydrophobicContact CD2-CB 4.11Å; F205-P329 HydrophobicContact CE1-CB 4.01Å; F205-P329 HydrophobicContact CE2-CB 4.34Å; F205-P329 HydrophobicContact CG-CB 3.81Å; F205-P329 HydrophobicContact CG-CG 3.95Å; F205-P329 HydrophobicContact CZ-CB 4.3Å; V280-P329 PolarHBondContact N-O 3.27Å; V280-P329 VanDerWaalsContact N-O 3.08Å; V280-P329 WeakPolarHBondContact O-CD 3Å; P329-V331 HydrophobicContact CB-CG2 3.92Å; P329-V331 HydrophobicContact CG-CG2 4.33Å; P329-V338 HydrophobicContact CB-CG1 4.04Å; P329-V338 HydrophobicContact CB-CG2 4.28Å; P329-N342 PolarHBondContact O-ND2 3.32Å
330	L	89.4	Confident	81.1	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	127.6	159.8	-169.4	66.5	0	0	0	107.9	M277 A279 I315 I339 G340 N342 A353	M277-L330 HydrophobicContact CB-CD1 3.93Å; M277-L330 HydrophobicContact CB-CG 4.42Å; M277-L330 HydrophobicContact CE-CD2 4.37Å; M277-L330 HydrophobicContact SD-CD1 4.34Å; M277-L330 HydrophobicContact SD-CD2 3.85Å; M277-L330 HydrophobicContact SD-CG 4.34Å; A279-L330 HydrophobicContact CB-CD1 3.97Å; I315-L330 HydrophobicContact CG2-CD2 3.92Å; L330-I339 HydrophobicContact CB-CG1 4.16Å; L330-I339 HydrophobicContact CD2-CD1 4.08Å; L330-I339 HydrophobicContact CD2-CG1 3.97Å; L330-I339 HydrophobicContact CG-CD1 4.02Å; L330-I339 HydrophobicContact CG-CG1 3.83Å; L330-I339 WeakPolarHBondContact O-CG1 3.43Å; L330-I339 PolarHBondContact O-N 2.9Å; L330-G340 PolarHBondContact N-O 2.8Å; L330-G340 PolarHBondContact O-N 2.86Å; L330-N342 WeakPolarHBondContact CB-OD1 3.46Å; L330-N342 PolarHBondContact N-OD1 3.05Å; L330-A353 HydrophobicContact CB-CB 4.37Å; L330-A353 HydrophobicContact CD2-CB 3.56Å
331	V	88.1	Confident	81.1	Confident	1 Å²	1	33.7 Å²	33.7	1%	0.006	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	138.5	-171.9	-170.7	0	0	0	0	111.5	I177 M277 V278 P329 D337 V338	I177-V331 HydrophobicContact CD1-CB 3.8Å; I177-V331 HydrophobicContact CD1-CG1 3.65Å; I177-V331 HydrophobicContact CD1-CG2 3.85Å; I177-V331 HydrophobicContact CG1-CG1 4.39Å; I177-V331 HydrophobicContact CG1-CG2 4.49Å; I177-V331 HydrophobicContact CG2-CG2 4.33Å; M277-V331 WeakPolarHBondContact CA-O 3.32Å; V278-V331 PolarHBondContact N-O 3.2Å; V278-V331 PolarHBondContact O-N 3.29Å; P329-V331 HydrophobicContact CB-CG2 3.92Å; P329-V331 HydrophobicContact CG-CG2 4.33Å; V331-D337 WeakPolarHBondContact CA-O 3.03Å; V331-D337 WeakPolarHBondContact CG1-O 3.4Å; V331-V338 HydrophobicContact CG2-CG2 4.21Å
332	N	84	Confident	81.4	Confident	1 Å²	1	33.6 Å²	33.6	1%	0.005	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	150.1	172.4	70.7	32.3	0	0	0	112.7	R335 R336 D337 I339	N332-R335 PolarHBondContact OD1-N 3.39Å; N332-R335 VanDerWaalsContact OD1-N 3.12Å; N332-R336 WeakPolarHBondContact O-CA 3.45Å; N332-R336 PolarHBondContact O-N 3.23Å; N332-R336 PolarHBondContact OD1-N 3.21Å; N332-D337 PolarHBondContact N-O 3.41Å; N332-D337 VanDerWaalsContact N-O 3.1Å; N332-D337 PolarHBondContact OD1-N 3.12Å; N332-I339 HydrophobicContact CB-CG2 3.87Å
333	L	77.6	Confident	81.4	Confident	22 Å²	22	30.3 Å²	30.3	12%	0.115	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-40.7	178.8	-62.6	-171.5	0	0	0	113.7	F169 I170 V173 F276 V278	F169-L333 HydrophobicContact CD2-CD1 3.44Å; F169-L333 VanDerWaalsContact CD2-CD1 3.44Å; F169-L333 HydrophobicContact CE2-CD1 3.41Å; F169-L333 VanDerWaalsContact CE2-CD1 3.41Å; F169-L333 HydrophobicContact CG-CD1 4.42Å; F169-L333 HydrophobicContact CZ-CD1 4.37Å; I170-L333 HydrophobicContact CD1-CD1 3.79Å; I170-L333 HydrophobicContact CD1-CD2 3.58Å; I170-L333 HydrophobicContact CD1-CG 4.34Å; V173-L333 HydrophobicContact CB-CD2 4.23Å; V173-L333 HydrophobicContact CG1-CD2 4.08Å; V173-L333 HydrophobicContact CG2-CD2 3.95Å; F276-L333 HydrophobicContact CB-CD1 3.33Å; F276-L333 HydrophobicContact CB-CG 3.73Å; F276-L333 HydrophobicContact CD2-CD1 4.47Å; F276-L333 HydrophobicContact CG-CD1 3.97Å; F276-L333 PolarHBondContact O-N 3.1Å; V278-L333 HydrophobicContact CG2-CD2 3.41Å; V278-L333 VanDerWaalsContact CG2-CD2 3.41Å
334	L	68.4	Low	81.1	Confident	145 Å²	145	23.5 Å²	23.5	76%	0.759	11%	0.111	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70	-38.3	-165.9	-74.4	168.1	0	0	0	113.3
335	R	65.8	Low	80.4	Confident	130 Å²	130	28.7 Å²	28.7	49%	0.491	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.8	-19.7	-177.6	-57.8	-177.3	176.7	93.7	0.5	112.6	N332 D337	N332-R335 PolarHBondContact OD1-N 3.39Å; N332-R335 VanDerWaalsContact OD1-N 3.12Å; R335-D337 VanDerWaalsContact C-N 3.29Å; R335-D337 HydrophobicContact CB-CB 4.19Å; R335-D337 WeakPolarHBondContact CB-OD1 3.28Å; R335-D337 WeakPolarHBondContact CB-OD2 3.25Å; R335-D337 VanDerWaalsContact CD-OD2 3.26Å; R335-D337 WeakPolarHBondContact CD-OD2 3.32Å
336	R	72.9	Confident	79	Confident	94 Å²	94	32.8 Å²	32.8	36%	0.355	16%	0.156	S	C	.	.			trans	62.3	41.4	-171.8	-43.2	-173.6	-169.1	-176.1	6.2	110.6	D172 V173 K176 N332	D172-R336 PolarHBondContact O-NH1 2.93Å; V173-R336 HydrophobicContact CG2-CG 4.11Å; K176-R336 HydrophobicContact CD-CB 4.28Å; N332-R336 WeakPolarHBondContact O-CA 3.45Å; N332-R336 PolarHBondContact O-N 3.23Å; N332-R336 PolarHBondContact OD1-N 3.21Å
337	D	78.6	Confident	77.5	Confident	4 Å²	4	36.1 Å²	36.1	2%	0.021	18%	0.176	C	C	.	.			trans	-99.5	140.2	-179.8	-63.9	-10.3	0	0	0	109	R266 V331 N332 R335 I339	R266-D337 HydrophobicContact CB-CB 4.43Å; R266-D337 WeakPolarHBondContact CB-OD1 3.33Å; R266-D337 VanDerWaalsContact CD-OD1 3.31Å; R266-D337 WeakPolarHBondContact CD-OD1 3.3Å; R266-D337 IonicContact CZ-OD1 3.53Å; R266-D337 IonicContact NE-OD1 2.75Å; R266-D337 IonicContact NH1-OD1 2.9Å; R266-D337 PolarHBondContact NH1-OD1 3.38Å; R266-D337 CarbonylContact O-C 3.5Å; R266-D337 WeakPolarHBondContact O-CA 3.21Å; R266-D337 VanDerWaalsContact O-CB 3.29Å; R266-D337 WeakPolarHBondContact O-CB 3.21Å; V331-D337 WeakPolarHBondContact CA-O 3.03Å; V331-D337 WeakPolarHBondContact CG1-O 3.4Å; N332-D337 PolarHBondContact N-O 3.41Å; N332-D337 VanDerWaalsContact N-O 3.1Å; N332-D337 PolarHBondContact OD1-N 3.12Å; R335-D337 VanDerWaalsContact C-N 3.29Å; R335-D337 HydrophobicContact CB-CB 4.19Å; R335-D337 WeakPolarHBondContact CB-OD1 3.28Å; R335-D337 WeakPolarHBondContact CB-OD2 3.25Å; R335-D337 VanDerWaalsContact CD-OD2 3.26Å; R335-D337 WeakPolarHBondContact CD-OD2 3.32Å; D337-I339 PolarHBondContact O-N 3.08Å
338	V	83.4	Confident	76.6	Confident	11 Å²	11	40 Å²	40	7%	0.067	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	125.3	174.6	-177.2	0	0	0	0	107.6	F205 V265 R266 W267 P268 P329 V331 G340	F205-V338 HydrophobicContact CD2-CG2 4.49Å; F205-V338 HydrophobicContact CE2-CG1 3.92Å; F205-V338 HydrophobicContact CE2-CG2 4.22Å; F205-V338 HydrophobicContact CZ-CG1 3.98Å; V265-V338 HydrophobicContact CB-CG2 4.48Å; V265-V338 HydrophobicContact CG1-CB 3.87Å; V265-V338 HydrophobicContact CG1-CG2 3.75Å; V265-V338 HydrophobicContact CG2-CG2 4.02Å; R266-V338 PolarHBondContact O-N 3.35Å; W267-V338 HydrophobicContact CE3-CB 4.18Å; W267-V338 HydrophobicContact CE3-CG1 4.45Å; W267-V338 HydrophobicContact CZ3-CB 3.87Å; W267-V338 HydrophobicContact CZ3-CG1 3.76Å; P268-V338 WeakPolarHBondContact CD-O 3.45Å; P329-V338 HydrophobicContact CB-CG1 4.04Å; P329-V338 HydrophobicContact CB-CG2 4.28Å; V331-V338 HydrophobicContact CG2-CG2 4.21Å; V338-G340 WeakPolarHBondContact CG1-O 3.46Å
339	I	84.3	Confident	75.5	Confident	1 Å²	1	41.9 Å²	41.9	1%	0.005	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	-15.3	-178	70.3	-177.3	0	0	0	112	P268 L271 M277 I315 L330 N332 D337 S356	P268-I339 HydrophobicContact CG-CB 4.3Å; P268-I339 HydrophobicContact CG-CG2 3.87Å; L271-I339 HydrophobicContact CD1-CD1 3.99Å; M277-I339 HydrophobicContact CE-CD1 3.48Å; M277-I339 VanDerWaalsContact CE-CD1 3.48Å; M277-I339 HydrophobicContact CG-CD1 3.75Å; M277-I339 HydrophobicContact SD-CD1 4.05Å; I315-I339 HydrophobicContact CD1-CG1 4.34Å; I315-I339 WeakPolarHBondContact CD1-O 3.42Å; L330-I339 HydrophobicContact CB-CG1 4.16Å; L330-I339 HydrophobicContact CD2-CD1 4.08Å; L330-I339 HydrophobicContact CD2-CG1 3.97Å; L330-I339 HydrophobicContact CG-CD1 4.02Å; L330-I339 HydrophobicContact CG-CG1 3.83Å; L330-I339 WeakPolarHBondContact O-CG1 3.43Å; L330-I339 PolarHBondContact O-N 2.9Å; N332-I339 HydrophobicContact CB-CG2 3.87Å; D337-I339 PolarHBondContact O-N 3.08Å; I339-S356 WeakPolarHBondContact O-CB 3Å; I339-S356 PolarHBondContact O-N 2.63Å; I339-S356 PolarHBondContact O-OG 2.84Å
340	G	84.1	Confident	74.4	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-177.8	-175.5	173.8	0	0	0	0	0	114.3	L330 V338 I354	L330-G340 PolarHBondContact N-O 2.8Å; L330-G340 PolarHBondContact O-N 2.86Å; V338-G340 WeakPolarHBondContact CG1-O 3.46Å; G340-I354 CarbonylContact C-O 3.52Å; G340-I354 WeakPolarHBondContact CA-O 3.48Å
341	I	86.8	Confident	73.9	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	126.6	170.7	-43.6	-170.2	0	0	0	109.2	F205 L214 N216 L254 G327 N343 A353 I354 I359	F205-I341 HydrophobicContact CE1-CD1 4.21Å; F205-I341 HydrophobicContact CE1-CG1 3.99Å; F205-I341 HydrophobicContact CE1-CG2 4.3Å; F205-I341 HydrophobicContact CZ-CD1 4.41Å; F205-I341 HydrophobicContact CZ-CG1 4.14Å; L214-I341 HydrophobicContact CB-CD1 4.25Å; N216-I341 WeakPolarHBondContact OD1-CG2 3.31Å; L254-I341 HydrophobicContact CD1-CD1 4.01Å; G327-I341 WeakPolarHBondContact O-CG2 3.48Å; I341-N343 PolarHBondContact O-N 3.12Å; I341-A353 CarbonylContact O-C 3.6Å; I341-A353 WeakPolarHBondContact O-CA 3.28Å; I341-A353 WeakPolarHBondContact O-CB 3.43Å; I341-I354 PolarHBondContact N-O 3.44Å; I341-I354 PolarHBondContact O-N 2.04Å; I341-I359 HydrophobicContact CD1-CD1 4.02Å; I341-I359 HydrophobicContact CD1-CG1 4.28Å; I341-I359 HydrophobicContact CG1-CD1 3.49Å; I341-I359 VanDerWaalsContact CG1-CD1 3.49Å; I341-I359 HydrophobicContact CG1-CG1 4.16Å
342	N	88	Confident	73.5	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	115.8	177.5	-58.2	-35.5	0	0	0	109.6	N216 A279 V280 I321 N325 S326 G327 G328 P329 L330	N216-N342 PolarHBondContact ND2-O 3.39Å; A279-N342 VanDerWaalsContact CB-OD1 3.27Å; A279-N342 WeakPolarHBondContact CB-OD1 3.03Å; V280-N342 PolarHBondContact O-ND2 3.44Å; I321-N342 HydrophobicContact CD1-CB 3.75Å; I321-N342 HydrophobicContact CG1-CB 4.1Å; I321-N342 HydrophobicContact CG2-CB 4.43Å; N325-N342 VanDerWaalsContact O-CB 3.24Å; N325-N342 WeakPolarHBondContact O-CB 3.11Å; N325-N342 PolarHBondContact O-ND2 3.13Å; S326-N342 WeakPolarHBondContact CA-O 3.44Å; G327-N342 PolarHBondContact N-O 2.77Å; G328-N342 VanDerWaalsContact C-ND2 3.3Å; G328-N342 WeakPolarHBondContact O-CB 3.4Å; G328-N342 VanDerWaalsContact O-CG 3.27Å; G328-N342 PolarHBondContact O-N 3.2Å; G328-N342 PolarHBondContact O-ND2 2.78Å; G328-N342 VanDerWaalsContact O-ND2 3.11Å; P329-N342 PolarHBondContact O-ND2 3.32Å; L330-N342 WeakPolarHBondContact CB-OD1 3.46Å; L330-N342 PolarHBondContact N-OD1 3.05Å
343	N	78.1	Confident	73.4	Confident	3 Å²	3	44.5 Å²	44.5	2%	0.016	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	-86.2	-170.5	-165.9	6	0	0	0	114	N216 H218 D248 S326 I341 F352 I354	N216-N343 WeakPolarHBondContact ND2-CA 3.4Å; H218-N343 PolarHBondContact CE1-OD1 2.86Å; H218-N343 VanDerWaalsContact CE1-OD1 3.31Å; D248-N343 PolarHBondContact OD1-ND2 3.45Å; S326-N343 PolarHBondContact OG-O 2.76Å; I341-N343 PolarHBondContact O-N 3.12Å; N343-F352 WeakPolarHBondContact CA-O 3.27Å; N343-F352 WeakPolarHBondContact CB-O 3.01Å; N343-F352 PolarHBondContact N-O 3.05Å; N343-I354 HydrophobicContact CB-CG1 4.19Å
344	L	67.1	Low	73.6	Confident	65 Å²	65	43.6 Å²	43.6	34%	0.34	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	150.2	-171	-62.5	175.7	0	0	0	111	F307 S351 F352	F307-L344 HydrophobicContact CZ-CD1 4.19Å; L344-S351 CarbonylContact O-C 3.34Å; L344-S351 WeakPolarHBondContact O-CA 3.33Å; L344-F352 PolarHBondContact N-O 2.98Å; L344-F352 PolarHBondContact O-N 3.45Å
345	K	61.3	Low	74.2	Confident	118 Å²	118	37.6 Å²	37.6	51%	0.513	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	124.9	161.9	175.4	-170.5	168	-168.5	0	107.5	I321 T347	I321-K345 WeakPolarHBondContact O-CB 3.38Å; K345-T347 WeakPolarHBondContact CE-O 3.47Å; K345-T347 WeakPolarHBondContact CG-O 3.43Å
346	V	56.8	Low	74.8	Confident	87 Å²	87	31.6 Å²	31.6	53%	0.527	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	-40.8	177.7	171.5	0	0	0	0	110.9	F307 I350 F352	F307-V346 HydrophobicContact CZ-CG2 4.13Å; V346-I350 HydrophobicContact CB-CG2 4.36Å; V346-I350 PolarHBondContact N-O 3.2Å; V346-F352 HydrophobicContact CB-CE2 4.08Å; V346-F352 HydrophobicContact CG2-CD2 3.81Å; V346-F352 HydrophobicContact CG2-CE2 3.64Å
347	T	53.4	Low	74.9	Confident	75 Å²	75	30 Å²	30	46%	0.46	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	-174.6	173.3	-172	0	0	0	0	111.4	K345 G349 I350	K345-T347 WeakPolarHBondContact CE-O 3.47Å; K345-T347 WeakPolarHBondContact CG-O 3.43Å; T347-G349 PolarHBondContact O-N 2.81Å; T347-I350 HydrophobicContact CG2-CB 3.77Å; T347-I350 HydrophobicContact CG2-CD1 3.8Å; T347-I350 HydrophobicContact CG2-CG1 3.92Å; T347-I350 PolarHBondContact N-O 3.37Å; T347-I350 PolarHBondContact O-N 3.48Å
348	A	62.2	Low	74.7	Confident	81 Å²	81	33.1 Å²	33.1	67%	0.669	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.7	126.6	173.7	0	0	0	0	0	110.5	I350	A348-I350 VanDerWaalsContact C-N 3.25Å; A348-I350 PolarHBondContact O-N 2.94Å
349	G	63.9	Low	74.4	Confident	41 Å²	41	32.7 Å²	32.7	42%	0.423	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.5	7.5	-177.5	0	0	0	0	0	115.5	D318 T347	D318-G349 WeakPolarHBondContact CA-O 3.41Å; T347-G349 PolarHBondContact O-N 2.81Å
350	I	68.3	Low	74	Confident	53 Å²	53	37.6 Å²	37.6	27%	0.272	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	99.6	176.3	-60.1	-174.4	0	0	0	109.5	V346 T347 A348 F352	V346-I350 HydrophobicContact CB-CG2 4.36Å; V346-I350 PolarHBondContact N-O 3.2Å; T347-I350 HydrophobicContact CG2-CB 3.77Å; T347-I350 HydrophobicContact CG2-CD1 3.8Å; T347-I350 HydrophobicContact CG2-CG1 3.92Å; T347-I350 PolarHBondContact N-O 3.37Å; T347-I350 PolarHBondContact O-N 3.48Å; A348-I350 VanDerWaalsContact C-N 3.25Å; A348-I350 PolarHBondContact O-N 2.94Å; I350-F352 HydrophobicContact CG2-CE2 3.51Å; I350-F352 HydrophobicContact CG2-CZ 3.54Å
351	S	78.7	Confident	73.5	Confident	1 Å²	1	42 Å²	42	1%	0.007	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	154.3	174.6	-48	0	0	0	0	111	T317 A319 I321 L344	T317-S351 PolarHBondContact N-O 2.75Å; T317-S351 PolarHBondContact O-N 3.23Å; A319-S351 WeakPolarHBondContact O-CB 3.07Å; A319-S351 PolarHBondContact O-OG 2.04Å; I321-S351 PolarHBondContact N-OG 3.23Å; L344-S351 CarbonylContact O-C 3.34Å; L344-S351 WeakPolarHBondContact O-CA 3.33Å
352	F	80.2	Confident	72.9	Confident	3 Å²	3	42.3 Å²	42.3	1%	0.013	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	145.4	-176.7	-64.3	-72.3	0	0	0	112.7	L305 Y314 I315 H316 I321 N343 L344 V346 I350	L305-F352 HydrophobicContact CD1-CD1 3.93Å; L305-F352 HydrophobicContact CD1-CD2 4.31Å; L305-F352 HydrophobicContact CD1-CE1 3.5Å; L305-F352 VanDerWaalsContact CD1-CE1 3.5Å; L305-F352 HydrophobicContact CD1-CE2 3.91Å; L305-F352 HydrophobicContact CD1-CG 4.32Å; L305-F352 HydrophobicContact CD1-CZ 3.51Å; L305-F352 HydrophobicContact CD2-CE1 3.99Å; L305-F352 HydrophobicContact CD2-CE2 4.2Å; L305-F352 HydrophobicContact CD2-CZ 3.46Å; L305-F352 VanDerWaalsContact CD2-CZ 3.46Å; L305-F352 HydrophobicContact CG-CE1 4.41Å; L305-F352 HydrophobicContact CG-CZ 4.13Å; Y314-F352 HydrophobicContact CD1-CB 4.48Å; I315-F352 VanDerWaalsContact O-CA 3.31Å; I315-F352 WeakPolarHBondContact O-CA 3.45Å; H316-F352 HydrophobicContact CB-CD1 4.17Å; H316-F352 HydrophobicContact CB-CE1 3.78Å; H316-F352 AromaticContact CD2-CE1 3.7Å; H316-F352 AromaticContact CD2-CZ 3.98Å; H316-F352 AromaticContact CG-CE1 3.83Å; I321-F352 WeakPolarHBondContact CD1-O 3.26Å; N343-F352 WeakPolarHBondContact CA-O 3.27Å; N343-F352 WeakPolarHBondContact CB-O 3.01Å; N343-F352 PolarHBondContact N-O 3.05Å; L344-F352 PolarHBondContact N-O 2.98Å; L344-F352 PolarHBondContact O-N 3.45Å; V346-F352 HydrophobicContact CB-CE2 4.08Å; V346-F352 HydrophobicContact CG2-CD2 3.81Å; V346-F352 HydrophobicContact CG2-CE2 3.64Å; I350-F352 HydrophobicContact CG2-CE2 3.51Å; I350-F352 HydrophobicContact CG2-CZ 3.54Å
353	A	81.9	Confident	72.3	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	146.3	175.3	0	0	0	0	0	111.9	I315 L330 I341	I315-A353 HydrophobicContact CB-CB 4.3Å; I315-A353 PolarHBondContact N-O 2.99Å; I315-A353 PolarHBondContact O-N 3.02Å; L330-A353 HydrophobicContact CB-CB 4.37Å; L330-A353 HydrophobicContact CD2-CB 3.56Å; I341-A353 CarbonylContact O-C 3.6Å; I341-A353 WeakPolarHBondContact O-CA 3.28Å; I341-A353 WeakPolarHBondContact O-CB 3.43Å
354	I	81.4	Confident	72.2	Confident	4 Å²	4	46.6 Å²	46.6	2%	0.021	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	123.9	176.9	-58.2	167.7	0	0	0	108.1	D248 G340 I341 N343 R358	D248-I354 WeakPolarHBondContact OD2-CD1 3.28Å; G340-I354 CarbonylContact C-O 3.52Å; G340-I354 WeakPolarHBondContact CA-O 3.48Å; I341-I354 PolarHBondContact N-O 3.44Å; I341-I354 PolarHBondContact O-N 2.04Å; N343-I354 HydrophobicContact CB-CG1 4.19Å; I354-R358 HydrophobicContact CG2-CB 4.4Å; I354-R358 HydrophobicContact CG2-CG 4.44Å
355	P	80.3	Confident	72.3	Confident	18 Å²	18	46.9 Å²	46.9	12%	0.117	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	150	-171.4	27.2	-35.1	0	0	0	114.1	D313 I315 D357 R358 I359	D313-P355 WeakPolarHBondContact O-CD 3.38Å; D313-P355 VanDerWaalsContact O-CG 3.26Å; D313-P355 WeakPolarHBondContact O-CG 3.35Å; I315-P355 HydrophobicContact CD1-CB 4.05Å; I315-P355 HydrophobicContact CG1-CB 4.05Å; P355-D357 VanDerWaalsContact C-N 3.26Å; P355-D357 PolarHBondContact O-N 3.12Å; P355-D357 VanDerWaalsContact O-N 3.16Å; P355-R358 HydrophobicContact CG-CB 4.04Å; P355-R358 WeakPolarHBondContact O-CB 3.31Å; P355-R358 PolarHBondContact O-N 2.95Å; P355-I359 PolarHBondContact O-N 2.92Å
356	S	78.3	Confident	72.7	Confident	4 Å²	4	41.9 Å²	41.9	3%	0.028	24%	0.241	C	C	.	.	H	α-helix	trans	-52.6	-37.1	-179.3	47	0	0	0	0	114.7	I339 R358 I359 R360	I339-S356 WeakPolarHBondContact O-CB 3Å; I339-S356 PolarHBondContact O-N 2.63Å; I339-S356 PolarHBondContact O-OG 2.84Å; S356-R358 VanDerWaalsContact C-N 3.33Å; S356-I359 WeakPolarHBondContact O-CB 3.44Å; S356-I359 PolarHBondContact O-N 3.49Å; S356-R360 VanDerWaalsContact O-CG 3.27Å; S356-R360 WeakPolarHBondContact O-CG 3.01Å; S356-R360 PolarHBondContact O-N 2.85Å
357	D	75.8	Confident	73.2	Confident	61 Å²	61	42.9 Å²	42.9	33%	0.326	24%	0.24	S	C	.	.	H	α-helix	trans	-72	-29.1	-179	-64.7	-70	0	0	0	112.6	P355 R360 Q361	P355-D357 VanDerWaalsContact C-N 3.26Å; P355-D357 PolarHBondContact O-N 3.12Å; P355-D357 VanDerWaalsContact O-N 3.16Å; D357-R360 PolarHBondContact O-N 3.23Å; D357-R360 IonicContact OD1-CZ 2.75Å; D357-R360 IonicContact OD1-NE 3.34Å; D357-R360 IonicContact OD1-NH1 3.77Å; D357-R360 PolarHBondContact OD1-NH1 3.34Å; D357-Q361 WeakPolarHBondContact O-CG 3.4Å; D357-Q361 PolarHBondContact O-N 3.43Å
358	R	74.3	Confident	74	Confident	70 Å²	70	43 Å²	43	26%	0.264	24%	0.237	S	C	.	.	H	α-helix	trans	-72.1	-37.6	172.7	-170.2	54.8	176.6	162.8	7.4	111.5	M247 L312 I354 P355 S356 R360 Q361 F362	M247-R358 HydrophobicContact CG-CG 4.35Å; M247-R358 HydrophobicContact SD-CG 3.66Å; M247-R358 PolarHBondContact SD-NE 2.9Å; L312-R358 HydrophobicContact CD2-CG 4.45Å; I354-R358 HydrophobicContact CG2-CB 4.4Å; I354-R358 HydrophobicContact CG2-CG 4.44Å; P355-R358 HydrophobicContact CG-CB 4.04Å; P355-R358 WeakPolarHBondContact O-CB 3.31Å; P355-R358 PolarHBondContact O-N 2.95Å; S356-R358 VanDerWaalsContact C-N 3.33Å; R358-R360 VanDerWaalsContact C-N 3.33Å; R358-R360 PolarHBondContact O-N 2.94Å; R358-Q361 PolarHBondContact O-N 2.79Å; R358-F362 PolarHBondContact O-N 2.92Å; R358-F362 VanDerWaalsContact O-N 3.1Å
359	I	76.6	Confident	74.3	Confident	2 Å²	2	43.3 Å²	43.3	1%	0.01	22%	0.221	C	C	.	.	H	α-helix	trans	-60.3	-43.1	170.2	-53.5	169.5	0	0	0	110.9	L214 W267 I341 P355 S356 F362 L363	L214-I359 HydrophobicContact CD1-CG2 3.3Å; W267-I359 HydrophobicContact CH2-CB 4.26Å; W267-I359 HydrophobicContact CH2-CD1 4.04Å; W267-I359 HydrophobicContact CH2-CG2 3.69Å; W267-I359 HydrophobicContact CZ2-CG2 4.11Å; W267-I359 HydrophobicContact CZ3-CB 4.48Å; W267-I359 HydrophobicContact CZ3-CD1 3.77Å; W267-I359 HydrophobicContact CZ3-CG2 4.37Å; I341-I359 HydrophobicContact CD1-CD1 4.02Å; I341-I359 HydrophobicContact CD1-CG1 4.28Å; I341-I359 HydrophobicContact CG1-CD1 3.49Å; I341-I359 VanDerWaalsContact CG1-CD1 3.49Å; I341-I359 HydrophobicContact CG1-CG1 4.16Å; P355-I359 PolarHBondContact O-N 2.92Å; S356-I359 WeakPolarHBondContact O-CB 3.44Å; S356-I359 PolarHBondContact O-N 3.49Å; I359-F362 PolarHBondContact O-N 3.27Å; I359-L363 HydrophobicContact CG2-CD1 4.09Å; I359-L363 HydrophobicContact CG2-CG 4.44Å; I359-L363 WeakPolarHBondContact O-CG 3.04Å; I359-L363 PolarHBondContact O-N 3Å
360	R	75.9	Confident	74.4	Confident	103 Å²	103	47.1 Å²	47.1	39%	0.389	23%	0.228	S	C	.	.	H	α-helix	trans	-65	-38.4	178.6	-72.6	165.4	64	-163.8	-9.9	112.7	W267 S356 D357 R358 A364	W267-R360 HydrophobicContact CB-CG 4.48Å; W267-R360 HydrophobicContact CD2-CG 4.09Å; W267-R360 HydrophobicContact CG-CG 3.85Å; S356-R360 VanDerWaalsContact O-CG 3.27Å; S356-R360 WeakPolarHBondContact O-CG 3.01Å; S356-R360 PolarHBondContact O-N 2.85Å; D357-R360 PolarHBondContact O-N 3.23Å; D357-R360 IonicContact OD1-CZ 2.75Å; D357-R360 IonicContact OD1-NE 3.34Å; D357-R360 IonicContact OD1-NH1 3.77Å; D357-R360 PolarHBondContact OD1-NH1 3.34Å; R358-R360 VanDerWaalsContact C-N 3.33Å; R358-R360 PolarHBondContact O-N 2.94Å; R360-A364 WeakPolarHBondContact O-CB 3.5Å; R360-A364 PolarHBondContact O-N 3.29Å; R360-A364 VanDerWaalsContact O-N 3.09Å
361	Q	74.5	Confident	74.1	Confident	94 Å²	94	50.2 Å²	50.2	44%	0.439	24%	0.244	S	C	.	.	H	α-helix	trans	-58.9	-55.3	171.8	-73.1	168.2	-2.2	0	0	110.3	D357 R358 L363 A364 D365	D357-Q361 WeakPolarHBondContact O-CG 3.4Å; D357-Q361 PolarHBondContact O-N 3.43Å; R358-Q361 PolarHBondContact O-N 2.79Å; Q361-L363 VanDerWaalsContact C-N 3.33Å; Q361-L363 PolarHBondContact O-N 3.34Å; Q361-A364 WeakPolarHBondContact O-CB 3.44Å; Q361-A364 PolarHBondContact O-N 3.05Å; Q361-D365 VanDerWaalsContact O-CG 3.28Å; Q361-D365 PolarHBondContact O-N 2.87Å
362	F	74.9	Confident	73.2	Confident	6 Å²	6	56.1 Å²	56.1	3%	0.026	28%	0.276	C	S	.	.	H	α-helix	trans	-54.1	-45.9	178.1	170.8	-91.1	0	0	0	113.2	D242 D244 M247 L254 R358 I359 A364 D365 F366	D242-F362 HydrophobicContact CB-CZ 4.25Å; D244-F362 HydrophobicContact CB-CD2 3.62Å; D244-F362 HydrophobicContact CB-CE2 3.69Å; M247-F362 HydrophobicContact CE-CB 3.6Å; M247-F362 HydrophobicContact CE-CD2 3.89Å; M247-F362 HydrophobicContact CE-CG 3.79Å; M247-F362 HydrophobicContact SD-CB 3.82Å; L254-F362 HydrophobicContact CB-CZ 4.36Å; L254-F362 HydrophobicContact CD2-CD1 3.39Å; L254-F362 HydrophobicContact CD2-CE1 3.45Å; L254-F362 VanDerWaalsContact CD2-CE1 3.45Å; L254-F362 HydrophobicContact CD2-CG 3.98Å; L254-F362 HydrophobicContact CD2-CZ 4.04Å; R358-F362 PolarHBondContact O-N 2.92Å; R358-F362 VanDerWaalsContact O-N 3.1Å; I359-F362 PolarHBondContact O-N 3.27Å; F362-A364 VanDerWaalsContact C-N 3.32Å; F362-A364 PolarHBondContact O-N 3.38Å; F362-D365 PolarHBondContact O-N 3.11Å; F362-F366 HydrophobicContact CE1-CB 4.4Å; F362-F366 HydrophobicContact CZ-CB 4.41Å; F362-F366 VanDerWaalsContact O-CB 3.29Å; F362-F366 WeakPolarHBondContact O-CB 3.27Å; F362-F366 PolarHBondContact O-N 2.94Å
363	L	74.3	Confident	71.8	Confident	45 Å²	45	59.2 Å²	59.2	24%	0.236	31%	0.309	C	S	.	.	H	α-helix	trans	-63.7	-37.1	179.6	-73.2	173.3	0	0	0	112.4	L214 W267 I359 Q361 H367	L214-L363 HydrophobicContact CD1-CD1 4.42Å; L214-L363 HydrophobicContact CD2-CD2 4.4Å; W267-L363 HydrophobicContact CZ2-CD1 4.18Å; I359-L363 HydrophobicContact CG2-CD1 4.09Å; I359-L363 HydrophobicContact CG2-CG 4.44Å; I359-L363 WeakPolarHBondContact O-CG 3.04Å; I359-L363 PolarHBondContact O-N 3Å; Q361-L363 VanDerWaalsContact C-N 3.33Å; Q361-L363 PolarHBondContact O-N 3.34Å; L363-H367 WeakPolarHBondContact O-CB 3.36Å; L363-H367 PolarHBondContact O-N 3.01Å; L363-H367 VanDerWaalsContact O-N 3.09Å
364	A	75.3	Confident	70.3	Confident	47 Å²	47	67.6 Å²	67.6	39%	0.388	35%	0.345	S	S	.	.	H	α-helix	trans	-68.9	-45.1	174.4	0	0	0	0	0	111.5	R360 Q361 F362 F366 H367 N368	R360-A364 WeakPolarHBondContact O-CB 3.5Å; R360-A364 PolarHBondContact O-N 3.29Å; R360-A364 VanDerWaalsContact O-N 3.09Å; Q361-A364 WeakPolarHBondContact O-CB 3.44Å; Q361-A364 PolarHBondContact O-N 3.05Å; F362-A364 VanDerWaalsContact C-N 3.32Å; F362-A364 PolarHBondContact O-N 3.38Å; A364-F366 PolarHBondContact O-N 3.12Å; A364-H367 PolarHBondContact O-N 3.35Å; A364-N368 WeakPolarHBondContact O-CB 3.06Å; A364-N368 PolarHBondContact O-N 3.37Å; A364-N368 PolarHBondContact O-ND2 2.03Å
365	D	70.1	Confident	68.5	Low	71 Å²	71	69 Å²	69	38%	0.38	36%	0.361	S	S	.	.	H	α-helix	trans	-66	-39.8	-179.7	-63	-29	0	0	0	111.7	Q361 F362 N368 R369	Q361-D365 VanDerWaalsContact O-CG 3.28Å; Q361-D365 PolarHBondContact O-N 2.87Å; F362-D365 PolarHBondContact O-N 3.11Å; D365-N368 PolarHBondContact O-N 3.14Å; D365-R369 WeakPolarHBondContact O-CG 3.38Å; D365-R369 PolarHBondContact O-N 2.94Å
366	F	68.8	Low	66.8	Low	14 Å²	14	71.9 Å²	71.9	6%	0.061	38%	0.376	C	S	.	.	H	α-helix	trans	-59.8	-47.4	170.4	164.8	-94.7	0	0	0	111.7	W212 D242 F362 A364 N368 R369 Q370	W212-F366 HydrophobicContact CH2-CD1 4.4Å; W212-F366 AromaticContact CH2-CE1 3.28Å; W212-F366 HydrophobicContact CH2-CE1 3.28Å; W212-F366 AromaticContact CH2-CZ 3.53Å; W212-F366 HydrophobicContact CH2-CZ 3.53Å; W212-F366 HydrophobicContact CZ3-CD1 4.1Å; W212-F366 AromaticContact CZ3-CE1 3.3Å; W212-F366 HydrophobicContact CZ3-CE1 3.3Å; W212-F366 AromaticContact CZ3-CZ 3.61Å; W212-F366 HydrophobicContact CZ3-CZ 3.61Å; D242-F366 HydrophobicContact CB-CD2 3.37Å; D242-F366 HydrophobicContact CB-CE2 3.68Å; D242-F366 HydrophobicContact CB-CG 4.45Å; D242-F366 WeakPolarHBondContact OD2-CD2 3.32Å; F362-F366 HydrophobicContact CE1-CB 4.4Å; F362-F366 HydrophobicContact CZ-CB 4.41Å; F362-F366 VanDerWaalsContact O-CB 3.29Å; F362-F366 WeakPolarHBondContact O-CB 3.27Å; F362-F366 PolarHBondContact O-N 2.94Å; A364-F366 PolarHBondContact O-N 3.12Å; F366-N368 VanDerWaalsContact C-N 3.29Å; F366-N368 PolarHBondContact O-N 3.16Å; F366-R369 WeakPolarHBondContact O-CB 3.44Å; F366-R369 PolarHBondContact O-N 2.04Å; F366-R369 VanDerWaalsContact O-N 3.12Å; F366-Q370 HydrophobicContact CD1-CG 4.39Å; F366-Q370 HydrophobicContact CD2-CG 4.31Å; F366-Q370 HydrophobicContact CE1-CG 3.75Å; F366-Q370 HydrophobicContact CE2-CG 3.75Å; F366-Q370 VanDerWaalsContact CE2-NE2 3.26Å; F366-Q370 HydrophobicContact CZ-CG 3.43Å; F366-Q370 VanDerWaalsContact CZ-CG 3.43Å; F366-Q370 WeakPolarHBondContact O-CG 3.2Å; F366-Q370 PolarHBondContact O-N 2.92Å
367	H	69.1	Low	65.3	Low	108 Å²	108	76.7 Å²	76.7	50%	0.5	41%	0.407	S	S	.	.	H	α-helix	trans	-61.3	-39.8	178.5	-177.6	-96.5	0	0	0	111.4	L363 A364 Q370 L371	L363-H367 WeakPolarHBondContact O-CB 3.36Å; L363-H367 PolarHBondContact O-N 3.01Å; L363-H367 VanDerWaalsContact O-N 3.09Å; A364-H367 PolarHBondContact O-N 3.35Å; H367-Q370 PolarHBondContact O-N 2.78Å; H367-L371 VanDerWaalsContact CE1-CD1 3.47Å; H367-L371 WeakPolarHBondContact CE1-CD1 3.44Å; H367-L371 WeakPolarHBondContact O-CG 3.36Å; H367-L371 PolarHBondContact O-N 3.46Å
368	N	69.2	Low	63.8	Low	78 Å²	78	81.9 Å²	81.9	42%	0.417	43%	0.429	S	S	.	.	H	α-helix	trans	-65	-40.5	173.1	-64.6	-25.1	0	0	0	112.1	A364 D365 F366 Q370 L371 N372	A364-N368 WeakPolarHBondContact O-CB 3.06Å; A364-N368 PolarHBondContact O-N 3.37Å; A364-N368 PolarHBondContact O-ND2 2.03Å; D365-N368 PolarHBondContact O-N 3.14Å; F366-N368 VanDerWaalsContact C-N 3.29Å; F366-N368 PolarHBondContact O-N 3.16Å; N368-Q370 VanDerWaalsContact C-N 3.33Å; N368-Q370 PolarHBondContact O-N 2.84Å; N368-L371 PolarHBondContact O-N 2.89Å; N368-N372 WeakPolarHBondContact O-CB 3.11Å; N368-N372 PolarHBondContact O-N 3.38Å; N368-N372 VanDerWaalsContact O-N 3.08Å; N368-N372 PolarHBondContact O-ND2 2.92Å
369	R	68.6	Low	62.3	Low	87 Å²	87	84.9 Å²	84.9	33%	0.328	45%	0.446	S	S	.	.	H	α-helix	trans	-59.7	-39.8	172.9	-76.2	-173.5	-74.1	-86.2	8.8	112.1	D242 D365 F366	D242-R369 IonicContact OD2-CZ 3.66Å; D242-R369 VanDerWaalsContact OD2-CZ 3.26Å; D242-R369 IonicContact OD2-NE 3.7Å; D242-R369 PolarHBondContact OD2-NE 2.99Å; D242-R369 IonicContact OD2-NH2 3.37Å; D242-R369 PolarHBondContact OD2-NH2 3.31Å; D365-R369 WeakPolarHBondContact O-CG 3.38Å; D365-R369 PolarHBondContact O-N 2.94Å; F366-R369 WeakPolarHBondContact O-CB 3.44Å; F366-R369 PolarHBondContact O-N 2.04Å; F366-R369 VanDerWaalsContact O-N 3.12Å
370	Q	66.4	Low	60.9	Low	120 Å²	120	94.5 Å²	94.5	56%	0.561	48%	0.482	S	S	*	.	H	α-helix	trans	-68.3	-48.1	176.5	-67	-62.2	-47.2	0	0	112.2	F366 H367 N368 N372	F366-Q370 HydrophobicContact CD1-CG 4.39Å; F366-Q370 HydrophobicContact CD2-CG 4.31Å; F366-Q370 HydrophobicContact CE1-CG 3.75Å; F366-Q370 HydrophobicContact CE2-CG 3.75Å; F366-Q370 VanDerWaalsContact CE2-NE2 3.26Å; F366-Q370 HydrophobicContact CZ-CG 3.43Å; F366-Q370 VanDerWaalsContact CZ-CG 3.43Å; F366-Q370 WeakPolarHBondContact O-CG 3.2Å; F366-Q370 PolarHBondContact O-N 2.92Å; H367-Q370 PolarHBondContact O-N 2.78Å; N368-Q370 VanDerWaalsContact C-N 3.33Å; N368-Q370 PolarHBondContact O-N 2.84Å; Q370-N372 PolarHBondContact O-N 3.01Å
371	L	62.8	Low	59.8	Low	118 Å²	118	96.3 Å²	96.3	62%	0.618	49%	0.492	S	S	*	.	H	α-helix	trans	-64.6	-39.7	-177.6	-73.6	-179.7	0	0	0	113.4	H367 N368 G373	H367-L371 VanDerWaalsContact CE1-CD1 3.47Å; H367-L371 WeakPolarHBondContact CE1-CD1 3.44Å; H367-L371 WeakPolarHBondContact O-CG 3.36Å; H367-L371 PolarHBondContact O-N 3.46Å; N368-L371 PolarHBondContact O-N 2.89Å; L371-G373 VanDerWaalsContact C-N 3.27Å; L371-G373 PolarHBondContact O-N 3.15Å
372	N	59.8	Low	59.1	Low	125 Å²	125	99.1 Å²	99.1	67%	0.668	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-3.6	-171.8	-68	-16.1	0	0	0	113.8	N368 Q370 K374	N368-N372 WeakPolarHBondContact O-CB 3.11Å; N368-N372 PolarHBondContact O-N 3.38Å; N368-N372 VanDerWaalsContact O-N 3.08Å; N368-N372 PolarHBondContact O-ND2 2.92Å; Q370-N372 PolarHBondContact O-N 3.01Å; N372-K374 PolarHBondContact O-N 2.04Å
373	G	49.3	Very low	58.6	Low	69 Å²	69	104 Å²	104	71%	0.711	53%	0.525	S	S	*	.	S	Bend	trans	68.8	-21.5	172.5	0	0	0	0	0	116.2	L371	L371-G373 VanDerWaalsContact C-N 3.27Å; L371-G373 PolarHBondContact O-N 3.15Å
374	K	50	Low	58.7	Low	175 Å²	175	103.7 Å²	103.7	76%	0.761	52%	0.523	S	S	*	.	S	Bend	trans	-135.1	124.2	163.3	-68.7	177.2	-178.5	173.2	0	106.9	N372 D376	N372-K374 PolarHBondContact O-N 2.04Å; K374-D376 PolarHBondContact O-N 2.83Å
375	G	44	Very low	58.6	Low	35 Å²	35	101.6 Å²	101.6	36%	0.361	51%	0.506	S	S	.	.			trans	-56.9	138.6	164.5	0	0	0	0	0	109.6
376	D	44.8	Very low	58.5	Low	78 Å²	78	99 Å²	99	42%	0.417	49%	0.493	S	S	.	.			trans	-47.3	123.4	-176.8	172.6	20.3	0	0	0	111.9	K374 E378 H379	K374-D376 PolarHBondContact O-N 2.83Å; D376-E378 PolarHBondContact O-N 2.95Å; D376-E378 WeakPolarHBondContact OD1-CB 3.33Å; D376-E378 PolarHBondContact OD1-N 2.85Å; D376-H379 PolarHBondContact O-N 3.25Å; D376-H379 VanDerWaalsContact O-N 3.16Å; D376-H379 IonicContact OD2-CE1 3.94Å; D376-H379 IonicContact OD2-CG 3.62Å; D376-H379 IonicContact OD2-ND1 3.47Å; D376-H379 PolarHBondContact OD2-ND1 2.04Å
377	P	47.1	Very low	58.2	Low	104 Å²	104	99.6 Å²	99.6	68%	0.675	50%	0.495	S	S	*	.	G	3₁₀ helix	trans	-54.9	-31.5	177.5	-26.2	35.2	0	0	0	114.1	H379 R380	P377-H379 VanDerWaalsContact C-N 3.25Å; P377-H379 PolarHBondContact O-N 2.76Å; P377-R380 PolarHBondContact O-N 3.17Å
378	E	44.4	Very low	58.3	Low	170 Å²	170	95.8 Å²	95.8	79%	0.794	48%	0.477	S	S	*	.	G	3₁₀ helix	trans	-69.7	-23.6	-177.1	-159.6	160.1	-130.7	0	0	112.3	D376	D376-E378 PolarHBondContact O-N 2.95Å; D376-E378 WeakPolarHBondContact OD1-CB 3.33Å; D376-E378 PolarHBondContact OD1-N 2.85Å
379	H	42.6	Very low	58.2	Low	133 Å²	133	95.4 Å²	95.4	62%	0.616	47%	0.474	S	S	*	.	G	3₁₀ helix	trans	-98	11.3	-178.6	-77.1	82.6	0	0	0	114.7	D376 P377 K381	D376-H379 PolarHBondContact O-N 3.25Å; D376-H379 VanDerWaalsContact O-N 3.16Å; D376-H379 IonicContact OD2-CE1 3.94Å; D376-H379 IonicContact OD2-CG 3.62Å; D376-H379 IonicContact OD2-ND1 3.47Å; D376-H379 PolarHBondContact OD2-ND1 2.04Å; P377-H379 VanDerWaalsContact C-N 3.25Å; P377-H379 PolarHBondContact O-N 2.76Å; H379-K381 PolarHBondContact O-N 2.94Å
380	R	47.1	Very low	58.2	Low	204 Å²	204	92.8 Å²	92.8	77%	0.77	47%	0.465	S	S	*	.			trans	-75	70.7	170.5	-72.4	-173.3	171.7	-159.8	-3.4	111.7	P377 K382	P377-R380 PolarHBondContact O-N 3.17Å; R380-K382 PolarHBondContact O-N 2.54Å
381	K	53.3	Low	58.2	Low	141 Å²	141	88.2 Å²	88.2	61%	0.613	44%	0.443	S	S	*	.			trans	-58.4	129.4	173.3	-65.9	-172.8	-179.8	-171.5	0	109.8	H379	H379-K381 PolarHBondContact O-N 2.94Å
382	K	59.4	Low	58.2	Low	154 Å²	154	84.4 Å²	84.4	67%	0.67	43%	0.425	S	S	*	.			trans	-73	150.4	-173.4	-60.1	155.2	177.1	174.5	0	109.7	R380 V453	R380-K382 PolarHBondContact O-N 2.54Å; K382-V453 HydrophobicContact CB-CG1 4.46Å; K382-V453 VanDerWaalsContact CD-C 3.44Å; K382-V453 WeakPolarHBondContact CD-O 3.44Å; K382-V453 WeakPolarHBondContact CD-OXT 3.36Å; K382-V453 WeakPolarHBondContact CE-O 3.36Å; K382-V453 VanDerWaalsContact NZ-C 3.3Å; K382-V453 PolarHBondContact NZ-O 3.32Å; K382-V453 PolarHBondContact NZ-OXT 3.21Å
383	F	65.3	Low	58.4	Low	107 Å²	107	83.8 Å²	83.8	47%	0.469	43%	0.428	S	S	.	.			trans	-129.6	106.4	-174.2	179.4	-100.8	0	0	0	110.2	E245 I419 T422	E245-F383 WeakPolarHBondContact OE2-CE2 3.24Å; F383-I419 HydrophobicContact CZ-CD1 3.96Å; F383-T422 HydrophobicContact CE1-CG2 3.81Å
384	L	75.9	Confident	58.9	Low	40 Å²	40	84.3 Å²	84.3	21%	0.209	42%	0.421	C	S	.	.			trans	-69.6	-41.7	179.6	-178.1	54.6	0	0	0	111.8	V386 A424 M429 V449 V453	L384-V386 HydrophobicContact CB-CG2 4.45Å; L384-V386 HydrophobicContact CD2-CG1 4.43Å; L384-V386 HydrophobicContact CD2-CG2 3.73Å; L384-V386 HydrophobicContact CG-CG1 4.39Å; L384-V386 HydrophobicContact CG-CG2 4.06Å; L384-A424 HydrophobicContact CD1-CB 4.14Å; L384-A424 HydrophobicContact CG-CB 4.15Å; L384-A424 VanDerWaalsContact O-CB 3.3Å; L384-A424 WeakPolarHBondContact O-CB 3.4Å; L384-A424 PolarHBondContact O-N 2.93Å; L384-M429 HydrophobicContact CD1-SD 4.28Å; L384-M429 HydrophobicContact CD2-SD 4.44Å; L384-V449 HydrophobicContact CD2-CG1 4.45Å; L384-V453 HydrophobicContact CB-CG1 4.31Å; L384-V453 HydrophobicContact CD2-CG2 4.15Å
385	G	71.9	Confident	59.3	Low	2 Å²	2	77.3 Å²	77.3	2%	0.021	39%	0.392	C	S	.	.			trans	95.1	14.6	-179.6	0	0	0	0	0	116.1	I419	G385-I419 VanDerWaalsContact O-CB 3.3Å; G385-I419 WeakPolarHBondContact O-CB 2.96Å; G385-I419 WeakPolarHBondContact O-CG1 3.48Å; G385-I419 PolarHBondContact O-N 3.05Å
386	V	68.4	Low	60.2	Low	17 Å²	17	76.4 Å²	76.4	10%	0.103	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	153.6	169	-64.8	0	0	0	0	111.4	L384 M388 I415 E417 V418 A424 M429	L384-V386 HydrophobicContact CB-CG2 4.45Å; L384-V386 HydrophobicContact CD2-CG1 4.43Å; L384-V386 HydrophobicContact CD2-CG2 3.73Å; L384-V386 HydrophobicContact CG-CG1 4.39Å; L384-V386 HydrophobicContact CG-CG2 4.06Å; V386-M388 HydrophobicContact CG2-CG 3.74Å; V386-M388 HydrophobicContact CG2-SD 4.05Å; V386-I415 HydrophobicContact CB-CG1 4.27Å; V386-I415 HydrophobicContact CB-CG2 4.08Å; V386-I415 HydrophobicContact CG1-CD1 4.1Å; V386-I415 HydrophobicContact CG1-CG1 4.24Å; V386-I415 HydrophobicContact CG1-CG2 4.03Å; V386-E417 CarbonylContact C-O 3.49Å; V386-V418 HydrophobicContact CG1-CG2 4.27Å; V386-A424 HydrophobicContact CG1-CB 3.51Å; V386-M429 HydrophobicContact CG1-CE 4.16Å; V386-M429 HydrophobicContact CG1-SD 4.02Å
387	R	63.4	Low	61.1	Low	27 Å²	27	79.1 Å²	79.1	10%	0.102	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	128.3	161.6	-59.7	-163	-167.4	140.6	24.8	110.8	I415 H416 E417	R387-I415 WeakPolarHBondContact O-CA 3.36Å; R387-H416 VanDerWaalsContact CB-NE2 3.27Å; R387-H416 WeakPolarHBondContact CB-NE2 3.3Å; R387-H416 PolarHBondContact O-N 2.91Å; R387-E417 HydrophobicContact CB-CB 4.23Å; R387-E417 HydrophobicContact CG-CB 4.33Å; R387-E417 IonicContact CZ-OE1 3.76Å; R387-E417 IonicContact CZ-OE2 2.63Å; R387-E417 PolarHBondContact N-O 3.26Å; R387-E417 IonicContact NE-OE1 3.79Å; R387-E417 IonicContact NE-OE2 3.62Å; R387-E417 IonicContact NH1-OE1 3.12Å; R387-E417 IonicContact NH1-OE2 2.73Å; R387-E417 PolarHBondContact NH1-OE2 3.39Å; R387-E417 VanDerWaalsContact NH2-CD 3.29Å; R387-E417 IonicContact NH2-OE1 3.92Å; R387-E417 PolarHBondContact NH2-OE1 3.25Å; R387-E417 IonicContact NH2-OE2 2.98Å; R387-E417 PolarHBondContact NH2-OE2 3.23Å
388	M	71.3	Confident	61.8	Low	27 Å²	27	79.8 Å²	79.8	13%	0.133	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	137	-165.3	-67.8	-176.9	-69.8	0	0	112.7	V386 V413 Y414 K446 V449	V386-M388 HydrophobicContact CG2-CG 3.74Å; V386-M388 HydrophobicContact CG2-SD 4.05Å; M388-V413 HydrophobicContact CB-CG1 3.59Å; M388-V413 HydrophobicContact CG-CG1 3.72Å; M388-V413 HydrophobicContact SD-CG1 3.8Å; M388-Y414 WeakPolarHBondContact CA-O 3.37Å; M388-K446 HydrophobicContact CB-CB 4.42Å; M388-K446 HydrophobicContact CB-CD 3.75Å; M388-K446 HydrophobicContact CB-CG 4.12Å; M388-K446 HydrophobicContact CE-CB 4.22Å; M388-K446 WeakPolarHBondContact O-CD 3.45Å; M388-K446 VanDerWaalsContact O-CE 3.3Å; M388-K446 WeakPolarHBondContact O-CE 3.35Å; M388-K446 PolarHBondContact O-NZ 2.71Å; M388-K446 HydrophobicContact SD-CB 4.46Å; M388-V449 HydrophobicContact CE-CB 4.39Å; M388-V449 HydrophobicContact CE-CG1 4.26Å; M388-V449 HydrophobicContact SD-CB 3.76Å; M388-V449 HydrophobicContact SD-CG1 3.53Å; M388-V449 VanDerWaalsContact SD-CG1 3.53Å; M388-V449 HydrophobicContact SD-CG2 4.1Å
389	M	66.1	Low	62.7	Low	70 Å²	70	72.4 Å²	72.4	35%	0.345	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	137.1	168.6	-152	170.9	-74.5	0	0	108.5	L395 Y414	M389-L395 HydrophobicContact CG-CD2 3.67Å; M389-L395 HydrophobicContact SD-CD1 3.93Å; M389-L395 HydrophobicContact SD-CD2 3.58Å; M389-L395 VanDerWaalsContact SD-CD2 3.58Å; M389-L395 HydrophobicContact SD-CG 4.36Å; M389-Y414 HydrophobicContact CB-CD1 4.06Å; M389-Y414 PolarHBondContact N-O 3.24Å; M389-Y414 PolarHBondContact O-N 3.23Å
390	Q	68.3	Low	63.8	Low	32 Å²	32	71.3 Å²	71.3	15%	0.15	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	139.3	178.8	-172.2	-177.1	11.3	0	0	108	T392 L395 Y444 T445 K446	Q390-T392 PolarHBondContact O-N 3.37Å; Q390-L395 WeakPolarHBondContact O-CD2 3.05Å; Q390-Y444 PolarHBondContact NE2-O 3.49Å; Q390-T445 VanDerWaalsContact NE2-CG2 3.3Å; Q390-K446 HydrophobicContact CB-CG 4.08Å
391	F	67.9	Low	64.6	Low	24 Å²	24	69.1 Å²	69.1	11%	0.105	34%	0.338	C	S	.	.			trans	-65.2	129	173.1	-63.8	-51.1	0	0	0	111.6	F406 V409 G412 Y414 V434	F391-F406 HydrophobicContact CD1-CZ 4.45Å; F391-F406 AromaticContact CE1-CE2 3.79Å; F391-F406 HydrophobicContact CE1-CE2 3.79Å; F391-F406 AromaticContact CE1-CZ 3.48Å; F391-F406 HydrophobicContact CE1-CZ 3.48Å; F391-F406 VanDerWaalsContact CE1-CZ 3.48Å; F391-F406 HydrophobicContact CE2-CZ 4.47Å; F391-F406 AromaticContact CZ-CE2 3.87Å; F391-F406 HydrophobicContact CZ-CE2 3.87Å; F391-F406 AromaticContact CZ-CZ 3.49Å; F391-F406 HydrophobicContact CZ-CZ 3.49Å; F391-F406 VanDerWaalsContact CZ-CZ 3.49Å; F391-V409 HydrophobicContact CE2-CG2 3.89Å; F391-V409 HydrophobicContact CZ-CG2 4.15Å; F391-G412 VanDerWaalsContact CD2-O 3.22Å; F391-G412 WeakPolarHBondContact CD2-O 2.99Å; F391-Y414 HydrophobicContact CE1-CG 4.4Å; F391-V434 HydrophobicContact CE2-CG1 3.57Å; F391-V434 HydrophobicContact CE2-CG2 4.43Å; F391-V434 HydrophobicContact CZ-CG1 3.83Å; F391-V434 HydrophobicContact CZ-CG2 3.85Å
392	T	62.7	Low	64.9	Low	38 Å²	38	69.3 Å²	69.3	23%	0.233	34%	0.341	C	S	.	.			trans	-115.4	151.9	156.3	60.6	0	0	0	0	107	Q390 S394 L395 T396	Q390-T392 PolarHBondContact O-N 3.37Å; T392-S394 VanDerWaalsContact C-N 3.26Å; T392-S394 PolarHBondContact O-N 3.42Å; T392-S394 VanDerWaalsContact O-N 3.15Å; T392-S394 PolarHBondContact OG1-OG 3.29Å; T392-L395 PolarHBondContact O-N 2.9Å; T392-L395 WeakPolarHBondContact OG1-CB 3.01Å; T392-T396 PolarHBondContact O-N 3.41Å; T392-T396 PolarHBondContact O-OG1 3.35Å
393	P	62.7	Low	65	Low	112 Å²	112	63.9 Å²	63.9	73%	0.727	32%	0.32	S	S	*	.	H	α-helix	trans	-52.4	-42.2	-174.4	-30	36.5	0	0	0	113.9	T396 E397	P393-T396 PolarHBondContact O-N 3.32Å; P393-E397 PolarHBondContact O-N 3.17Å
394	S	60.7	Low	64.8	Low	80 Å²	80	67.1 Å²	67.1	56%	0.559	34%	0.343	S	S	*	.	H	α-helix	trans	-65.6	-38	177.4	55.1	0	0	0	0	113.8	T392 E397 E398	T392-S394 VanDerWaalsContact C-N 3.26Å; T392-S394 PolarHBondContact O-N 3.42Å; T392-S394 VanDerWaalsContact O-N 3.15Å; T392-S394 PolarHBondContact OG1-OG 3.29Å; S394-E397 PolarHBondContact O-N 2.91Å; S394-E398 PolarHBondContact O-N 3.34Å; S394-E398 VanDerWaalsContact O-N 3.16Å
395	L	58.8	Low	64.3	Low	29 Å²	29	76.2 Å²	76.2	15%	0.152	37%	0.374	C	S	.	.	H	α-helix	trans	-71.5	-35.2	178	178.6	69.9	0	0	0	111.2	M389 Q390 T392 E397 E398 I399	M389-L395 HydrophobicContact CG-CD2 3.67Å; M389-L395 HydrophobicContact SD-CD1 3.93Å; M389-L395 HydrophobicContact SD-CD2 3.58Å; M389-L395 VanDerWaalsContact SD-CD2 3.58Å; M389-L395 HydrophobicContact SD-CG 4.36Å; Q390-L395 WeakPolarHBondContact O-CD2 3.05Å; T392-L395 PolarHBondContact O-N 2.9Å; T392-L395 WeakPolarHBondContact OG1-CB 3.01Å; L395-E397 VanDerWaalsContact C-N 3.29Å; L395-E397 PolarHBondContact O-N 3.41Å; L395-E398 PolarHBondContact O-N 2.99Å; L395-I399 HydrophobicContact CD1-CD1 3.93Å; L395-I399 HydrophobicContact CD1-CG1 4.1Å; L395-I399 HydrophobicContact CD2-CD1 4.22Å; L395-I399 HydrophobicContact CG-CD1 3.76Å; L395-I399 HydrophobicContact CG-CG1 4.26Å; L395-I399 WeakPolarHBondContact O-CB 3.36Å; L395-I399 WeakPolarHBondContact O-CG1 3.28Å; L395-I399 PolarHBondContact O-N 2.78Å
396	T	62	Low	64	Low	15 Å²	15	77.6 Å²	77.6	9%	0.092	38%	0.38	C	S	.	.	H	α-helix	trans	-64.2	-35.8	176.9	-59	0	0	0	0	111.5	T392 P393 R400 F406	T392-T396 PolarHBondContact O-N 3.41Å; T392-T396 PolarHBondContact O-OG1 3.35Å; P393-T396 PolarHBondContact O-N 3.32Å; T396-R400 WeakPolarHBondContact O-CB 3Å; T396-R400 VanDerWaalsContact O-CD 3.31Å; T396-R400 WeakPolarHBondContact O-CD 3.25Å; T396-R400 WeakPolarHBondContact O-CG 3.02Å; T396-R400 PolarHBondContact O-N 2.83Å; T396-R400 VanDerWaalsContact O-N 3.17Å; T396-F406 HydrophobicContact CG2-CE1 4.37Å
397	E	64.8	Low	64	Low	135 Å²	135	79.5 Å²	79.5	63%	0.631	39%	0.393	S	S	*	.	H	α-helix	trans	-67.5	-50.9	172.3	-68.1	174.4	155.2	0	0	110.9	P393 S394 L395 I399 R400 E401	P393-E397 PolarHBondContact O-N 3.17Å; S394-E397 PolarHBondContact O-N 2.91Å; L395-E397 VanDerWaalsContact C-N 3.29Å; L395-E397 PolarHBondContact O-N 3.41Å; E397-I399 PolarHBondContact O-N 2.89Å; E397-R400 PolarHBondContact O-N 3.42Å; E397-R400 VanDerWaalsContact O-N 3.09Å; E397-E401 PolarHBondContact O-N 3.01Å
398	E	60.7	Low	64.5	Low	118 Å²	118	84.9 Å²	84.9	55%	0.551	42%	0.423	S	S	*	.	H	α-helix	trans	-58.2	-40.5	179.9	-172.4	175	-157.1	0	0	113.3	S394 L395 H402	S394-E398 PolarHBondContact O-N 3.34Å; S394-E398 VanDerWaalsContact O-N 3.16Å; L395-E398 PolarHBondContact O-N 2.99Å; E398-H402 PolarHBondContact O-ND1 3.34Å
399	I	62.8	Low	64.5	Low	16 Å²	16	84.9 Å²	84.9	8%	0.082	43%	0.425	C	S	.	.	H	α-helix	trans	-70.8	-38.8	175.7	-65.6	173.5	0	0	0	111.4	L395 E397 E401 H402 V403 F406 Y414	L395-I399 HydrophobicContact CD1-CD1 3.93Å; L395-I399 HydrophobicContact CD1-CG1 4.1Å; L395-I399 HydrophobicContact CD2-CD1 4.22Å; L395-I399 HydrophobicContact CG-CD1 3.76Å; L395-I399 HydrophobicContact CG-CG1 4.26Å; L395-I399 WeakPolarHBondContact O-CB 3.36Å; L395-I399 WeakPolarHBondContact O-CG1 3.28Å; L395-I399 PolarHBondContact O-N 2.78Å; E397-I399 PolarHBondContact O-N 2.89Å; I399-E401 VanDerWaalsContact C-N 3.27Å; I399-E401 PolarHBondContact O-N 2.84Å; I399-H402 PolarHBondContact O-N 3.38Å; I399-H402 VanDerWaalsContact O-N 3.15Å; I399-V403 HydrophobicContact CG2-CB 4.35Å; I399-V403 HydrophobicContact CG2-CG2 3.95Å; I399-V403 WeakPolarHBondContact O-CB 3.07Å; I399-V403 PolarHBondContact O-N 3.01Å; I399-F406 HydrophobicContact CG2-CD2 3.42Å; I399-F406 VanDerWaalsContact CG2-CD2 3.42Å; I399-F406 HydrophobicContact CG2-CE2 3.67Å; I399-F406 HydrophobicContact CG2-CG 4.15Å; I399-Y414 HydrophobicContact CD1-CD1 4.04Å; I399-Y414 HydrophobicContact CD1-CE1 4Å; I399-Y414 HydrophobicContact CD1-CG 4.39Å; I399-Y414 HydrophobicContact CG2-CE2 4.4Å
400	R	66.6	Low	64.5	Low	109 Å²	109	87 Å²	87	41%	0.411	45%	0.446	S	S	.	.	H	α-helix	trans	-64	-30.3	177.3	-77.9	170.2	-175.7	-133.4	-1.5	112.6	T396 E397 F406 D408 V409	T396-R400 WeakPolarHBondContact O-CB 3Å; T396-R400 VanDerWaalsContact O-CD 3.31Å; T396-R400 WeakPolarHBondContact O-CD 3.25Å; T396-R400 WeakPolarHBondContact O-CG 3.02Å; T396-R400 PolarHBondContact O-N 2.83Å; T396-R400 VanDerWaalsContact O-N 3.17Å; E397-R400 PolarHBondContact O-N 3.42Å; E397-R400 VanDerWaalsContact O-N 3.09Å; R400-F406 HydrophobicContact CG-CD1 3.56Å; R400-F406 HydrophobicContact CG-CE1 4.05Å; R400-F406 HydrophobicContact CG-CG 4.28Å; R400-D408 IonicContact CZ-OD1 2.61Å; R400-D408 VanDerWaalsContact CZ-OD1 3.27Å; R400-D408 IonicContact NH1-OD1 2.79Å; R400-D408 PolarHBondContact NH1-OD1 3.25Å; R400-D408 IonicContact NH2-OD1 2.87Å; R400-D408 PolarHBondContact NH2-OD1 2.81Å; R400-V409 PolarHBondContact NH2-O 2.96Å
401	E	63.2	Low	64.7	Low	158 Å²	158	87.4 Å²	87.4	74%	0.738	45%	0.453	S	S	*	.	H	α-helix	trans	-74.1	-22.3	174.8	-70.3	-173.6	160.1	0	0	113.9	E397 I399	E397-E401 PolarHBondContact O-N 3.01Å; I399-E401 VanDerWaalsContact C-N 3.27Å; I399-E401 PolarHBondContact O-N 2.84Å
402	H	60.3	Low	65.2	Low	146 Å²	146	86.3 Å²	86.3	68%	0.676	45%	0.448	S	S	*	.	H	α-helix	trans	-115.2	-5.8	-171.7	-67.5	87	0	0	0	115	E398 I399	E398-H402 PolarHBondContact O-ND1 3.34Å; I399-H402 PolarHBondContact O-N 3.38Å; I399-H402 VanDerWaalsContact O-N 3.15Å
403	V	61.8	Low	66.1	Low	39 Å²	39	84.5 Å²	84.5	24%	0.236	44%	0.437	C	S	.	.			trans	-128.2	97.1	-177.9	-176.9	0	0	0	0	110.4	I399 R405 F406	I399-V403 HydrophobicContact CG2-CB 4.35Å; I399-V403 HydrophobicContact CG2-CG2 3.95Å; I399-V403 WeakPolarHBondContact O-CB 3.07Å; I399-V403 PolarHBondContact O-N 3.01Å; V403-R405 PolarHBondContact O-N 2.04Å; V403-F406 HydrophobicContact CB-CB 4.26Å; V403-F406 HydrophobicContact CG1-CB 4.28Å; V403-F406 PolarHBondContact O-N 3.12Å; V403-F406 VanDerWaalsContact O-N 3.07Å
404	D	60.9	Low	66.9	Low	176 Å²	176	80.1 Å²	80.1	94%	0.941	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.7	-14.4	-175.8	-75.4	-41	0	0	0	116.7
405	R	65.9	Low	67.8	Low	231 Å²	231	76.3 Å²	76.3	87%	0.872	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135.1	21.4	-173.3	-50.8	-171.5	76.4	-177.3	2.7	113.5	V403	V403-R405 PolarHBondContact O-N 2.04Å
406	F	65.5	Low	68.2	Low	30 Å²	30	78 Å²	78	13%	0.132	39%	0.387	C	S	.	.			trans	-60.8	131.7	176.6	-174.8	-93.2	0	0	0	111.1	F391 T396 I399 R400 V403 V409 Y414 V434	F391-F406 HydrophobicContact CD1-CZ 4.45Å; F391-F406 AromaticContact CE1-CE2 3.79Å; F391-F406 HydrophobicContact CE1-CE2 3.79Å; F391-F406 AromaticContact CE1-CZ 3.48Å; F391-F406 HydrophobicContact CE1-CZ 3.48Å; F391-F406 VanDerWaalsContact CE1-CZ 3.48Å; F391-F406 HydrophobicContact CE2-CZ 4.47Å; F391-F406 AromaticContact CZ-CE2 3.87Å; F391-F406 HydrophobicContact CZ-CE2 3.87Å; F391-F406 AromaticContact CZ-CZ 3.49Å; F391-F406 HydrophobicContact CZ-CZ 3.49Å; F391-F406 VanDerWaalsContact CZ-CZ 3.49Å; T396-F406 HydrophobicContact CG2-CE1 4.37Å; I399-F406 HydrophobicContact CG2-CD2 3.42Å; I399-F406 VanDerWaalsContact CG2-CD2 3.42Å; I399-F406 HydrophobicContact CG2-CE2 3.67Å; I399-F406 HydrophobicContact CG2-CG 4.15Å; R400-F406 HydrophobicContact CG-CD1 3.56Å; R400-F406 HydrophobicContact CG-CE1 4.05Å; R400-F406 HydrophobicContact CG-CG 4.28Å; V403-F406 HydrophobicContact CB-CB 4.26Å; V403-F406 HydrophobicContact CG1-CB 4.28Å; V403-F406 PolarHBondContact O-N 3.12Å; V403-F406 VanDerWaalsContact O-N 3.07Å; F406-V409 HydrophobicContact CE1-CG2 4.04Å; F406-V409 HydrophobicContact CZ-CG2 4Å; F406-Y414 HydrophobicContact CE2-CD2 4.2Å; F406-Y414 HydrophobicContact CE2-CE2 4.41Å; F406-V434 HydrophobicContact CE2-CG2 4.3Å
407	P	68.6	Low	68.4	Low	58 Å²	58	79.8 Å²	79.8	38%	0.377	39%	0.394	S	S	.	.			trans	-71	148.9	-177.3	29.4	-35.3	0	0	0	111.8	V409 V434	P407-V409 HydrophobicContact CB-CG1 4.25Å; P407-V409 HydrophobicContact CG-CG1 4.33Å; P407-V409 HydrophobicContact CG-CG2 4.21Å; P407-V409 PolarHBondContact O-N 2.83Å; P407-V434 HydrophobicContact CG-CG2 3.94Å
408	D	72.4	Confident	68.6	Low	140 Å²	140	74 Å²	74	75%	0.749	37%	0.368	S	S	*	.			trans	-77.4	77.1	176.4	-168	30.5	0	0	0	111.5	R400	R400-D408 IonicContact CZ-OD1 2.61Å; R400-D408 VanDerWaalsContact CZ-OD1 3.27Å; R400-D408 IonicContact NH1-OD1 2.79Å; R400-D408 PolarHBondContact NH1-OD1 3.25Å; R400-D408 IonicContact NH2-OD1 2.87Å; R400-D408 PolarHBondContact NH2-OD1 2.81Å
409	V	70.9	Confident	68.7	Low	26 Å²	26	69.8 Å²	69.8	16%	0.158	35%	0.349	C	S	.	.			trans	-112.9	139.4	175.6	-64.5	0	0	0	0	109.9	F391 R400 F406 P407 V434 I436	F391-V409 HydrophobicContact CE2-CG2 3.89Å; F391-V409 HydrophobicContact CZ-CG2 4.15Å; R400-V409 PolarHBondContact NH2-O 2.96Å; F406-V409 HydrophobicContact CE1-CG2 4.04Å; F406-V409 HydrophobicContact CZ-CG2 4Å; P407-V409 HydrophobicContact CB-CG1 4.25Å; P407-V409 HydrophobicContact CG-CG1 4.33Å; P407-V409 HydrophobicContact CG-CG2 4.21Å; P407-V409 PolarHBondContact O-N 2.83Å; V409-V434 HydrophobicContact CG2-CG1 4.22Å; V409-V434 HydrophobicContact CG2-CG2 4.48Å; V409-I436 HydrophobicContact CG1-CG2 3.91Å
410	S	67.1	Low	68.6	Low	114 Å²	114	74.2 Å²	74.2	80%	0.797	38%	0.379	S	S	*	.	S	Bend	trans	-98.2	-11.1	176.7	54.4	0	0	0	0	113.4
411	S	72.7	Confident	68.7	Low	42 Å²	42	72.6 Å²	72.6	29%	0.294	40%	0.396	S	S	.	.	S	Bend	trans	-156.9	160.1	-178.1	54.1	0	0	0	0	110.8
412	G	79	Confident	69.3	Low	1 Å²	1	66 Å²	66	1%	0.01	37%	0.366	C	S	.	.			trans	136.6	-174.9	-174.9	0	0	0	0	0	112.3	F391 I435 I443	F391-G412 VanDerWaalsContact CD2-O 3.22Å; F391-G412 WeakPolarHBondContact CD2-O 2.99Å; G412-I435 CarbonylContact C-O 3.58Å; G412-I435 VanDerWaalsContact CA-O 3.23Å; G412-I435 WeakPolarHBondContact CA-O 3.31Å; G412-I443 WeakPolarHBondContact CA-O 3.47Å
413	V	81	Confident	70.3	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	119	175.4	173.9	0	0	0	0	109.5	M388 V434 I435 I443 T445 K446 V449	M388-V413 HydrophobicContact CB-CG1 3.59Å; M388-V413 HydrophobicContact CG-CG1 3.72Å; M388-V413 HydrophobicContact SD-CG1 3.8Å; V413-V434 WeakPolarHBondContact O-CA 3.24Å; V413-I435 HydrophobicContact CB-CB 4.38Å; V413-I435 PolarHBondContact N-O 3.21Å; V413-I435 PolarHBondContact O-N 3.06Å; V413-I443 HydrophobicContact CG2-CG2 3.91Å; V413-T445 VanDerWaalsContact CG2-C 3.43Å; V413-T445 WeakPolarHBondContact CG2-O 3.32Å; V413-K446 HydrophobicContact CG1-CG 4.19Å; V413-K446 HydrophobicContact CG2-CG 4.37Å; V413-V449 HydrophobicContact CB-CG2 4.17Å; V413-V449 HydrophobicContact CG1-CG2 4.41Å; V413-V449 HydrophobicContact CG2-CG2 4.01Å
414	Y	79.3	Confident	71.1	Confident	19 Å²	19	59.9 Å²	59.9	8%	0.075	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	133.4	179	175.1	-110.3	0	0	0	111	M388 M389 F391 I399 F406 H416 H432 V434	M388-Y414 WeakPolarHBondContact CA-O 3.37Å; M389-Y414 HydrophobicContact CB-CD1 4.06Å; M389-Y414 PolarHBondContact N-O 3.24Å; M389-Y414 PolarHBondContact O-N 3.23Å; F391-Y414 HydrophobicContact CE1-CG 4.4Å; I399-Y414 HydrophobicContact CD1-CD1 4.04Å; I399-Y414 HydrophobicContact CD1-CE1 4Å; I399-Y414 HydrophobicContact CD1-CG 4.39Å; I399-Y414 HydrophobicContact CG2-CE2 4.4Å; F406-Y414 HydrophobicContact CE2-CD2 4.2Å; F406-Y414 HydrophobicContact CE2-CE2 4.41Å; Y414-H416 HydrophobicContact CD1-CB 4.12Å; Y414-H416 HydrophobicContact CE1-CB 3.83Å; Y414-H432 HydrophobicContact CE2-CB 4.07Å; Y414-H432 AromaticContact CZ-ND1 3.86Å; Y414-H432 PolarHBondContact OH-ND1 2.95Å; Y414-V434 HydrophobicContact CD2-CG2 4.26Å
415	I	79.1	Confident	71.9	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.005	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	111.8	175.3	-65.2	160.6	0	0	0	107.8	V386 R387 V418 M429 H432 D433 I435	V386-I415 HydrophobicContact CB-CG1 4.27Å; V386-I415 HydrophobicContact CB-CG2 4.08Å; V386-I415 HydrophobicContact CG1-CD1 4.1Å; V386-I415 HydrophobicContact CG1-CG1 4.24Å; V386-I415 HydrophobicContact CG1-CG2 4.03Å; R387-I415 WeakPolarHBondContact O-CA 3.36Å; I415-V418 HydrophobicContact CG2-CG2 3.57Å; I415-M429 HydrophobicContact CD1-CE 3.5Å; I415-M429 VanDerWaalsContact CD1-CE 3.5Å; I415-H432 VanDerWaalsContact O-CA 3.3Å; I415-H432 WeakPolarHBondContact O-CA 3.33Å; I415-H432 PolarHBondContact O-N 3.2Å; I415-D433 HydrophobicContact CB-CB 4.36Å; I415-D433 HydrophobicContact CD1-CB 3.82Å; I415-D433 PolarHBondContact N-O 3.23Å; I415-I435 HydrophobicContact CD1-CD1 4.05Å; I415-I435 HydrophobicContact CD1-CG1 3.78Å; I415-I435 HydrophobicContact CG1-CD1 4.32Å; I415-I435 HydrophobicContact CG1-CG1 4.27Å
416	H	67.6	Low	72.8	Confident	64 Å²	64	47.7 Å²	47.7	30%	0.296	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	-14.7	-178.3	92.3	67.5	0	0	0	113.1	R387 Y414	R387-H416 VanDerWaalsContact CB-NE2 3.27Å; R387-H416 WeakPolarHBondContact CB-NE2 3.3Å; R387-H416 PolarHBondContact O-N 2.91Å; Y414-H416 HydrophobicContact CD1-CB 4.12Å; Y414-H416 HydrophobicContact CE1-CB 3.83Å
417	E	66.7	Low	74	Confident	52 Å²	52	50 Å²	50	24%	0.243	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.1	126.8	179.7	-173.3	-178	144.9	0	0	110	V386 R387 D431	V386-E417 CarbonylContact C-O 3.49Å; R387-E417 HydrophobicContact CB-CB 4.23Å; R387-E417 HydrophobicContact CG-CB 4.33Å; R387-E417 IonicContact CZ-OE1 3.76Å; R387-E417 IonicContact CZ-OE2 2.63Å; R387-E417 PolarHBondContact N-O 3.26Å; R387-E417 IonicContact NE-OE1 3.79Å; R387-E417 IonicContact NE-OE2 3.62Å; R387-E417 IonicContact NH1-OE1 3.12Å; R387-E417 IonicContact NH1-OE2 2.73Å; R387-E417 PolarHBondContact NH1-OE2 3.39Å; R387-E417 VanDerWaalsContact NH2-CD 3.29Å; R387-E417 IonicContact NH2-OE1 3.92Å; R387-E417 PolarHBondContact NH2-OE1 3.25Å; R387-E417 IonicContact NH2-OE2 2.98Å; R387-E417 PolarHBondContact NH2-OE2 3.23Å; E417-D431 VanDerWaalsContact CA-OD1 3.25Å; E417-D431 WeakPolarHBondContact CA-OD1 3.28Å
418	V	67.9	Low	75	Confident	15 Å²	15	49.5 Å²	49.5	9%	0.091	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	118.8	169.9	-178	0	0	0	0	108.9	V386 I415 P420 A424 M429 M430 D431	V386-V418 HydrophobicContact CG1-CG2 4.27Å; I415-V418 HydrophobicContact CG2-CG2 3.57Å; V418-P420 WeakPolarHBondContact O-CD 3.49Å; V418-A424 HydrophobicContact CG1-CB 3.92Å; V418-M429 HydrophobicContact CG2-CB 4.24Å; V418-M430 VanDerWaalsContact CG2-C 3.41Å; V418-M430 WeakPolarHBondContact CG2-O 3.24Å; V418-D431 PolarHBondContact N-OD1 2.04Å
419	I	64.1	Low	75.7	Confident	29 Å²	29	45.1 Å²	45.1	15%	0.149	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-75.3	122.3	-175.2	-59.6	167.8	0	0	0	108.9	F383 G385 T422 S425	F383-I419 HydrophobicContact CZ-CD1 3.96Å; G385-I419 VanDerWaalsContact O-CB 3.3Å; G385-I419 WeakPolarHBondContact O-CB 2.96Å; G385-I419 WeakPolarHBondContact O-CG1 3.48Å; G385-I419 PolarHBondContact O-N 3.05Å; I419-T422 HydrophobicContact CB-CG2 3.79Å; I419-T422 HydrophobicContact CG2-CG2 3.8Å; I419-T422 WeakPolarHBondContact O-CB 3.2Å; I419-T422 VanDerWaalsContact O-CG2 3.25Å; I419-T422 WeakPolarHBondContact O-CG2 3.43Å; I419-T422 PolarHBondContact O-N 2.85Å; I419-T422 PolarHBondContact O-OG1 3.45Å; I419-S425 WeakPolarHBondContact O-CB 3.32Å
420	P	60.4	Low	76.4	Confident	109 Å²	109	50 Å²	50	71%	0.708	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	141.3	-177.4	-27	36.2	0	0	0	113.5	V418 T422	V418-P420 WeakPolarHBondContact O-CD 3.49Å; P420-T422 VanDerWaalsContact C-N 3.33Å
421	G	67.8	Low	76.9	Confident	74 Å²	74	48.4 Å²	48.4	76%	0.763	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.6	18.7	178.3	0	0	0	0	0	114.7	S425	G421-S425 PolarHBondContact N-OG 3.34Å
422	T	75.4	Confident	77.1	Confident	19 Å²	19	51.1 Å²	51.1	12%	0.117	33%	0.328	C	S	.	.	S	Bend	trans	-101	176.3	173.8	62.5	0	0	0	0	112.4	F383 I419 P420 A424 S425 S426	F383-T422 HydrophobicContact CE1-CG2 3.81Å; I419-T422 HydrophobicContact CB-CG2 3.79Å; I419-T422 HydrophobicContact CG2-CG2 3.8Å; I419-T422 WeakPolarHBondContact O-CB 3.2Å; I419-T422 VanDerWaalsContact O-CG2 3.25Å; I419-T422 WeakPolarHBondContact O-CG2 3.43Å; I419-T422 PolarHBondContact O-N 2.85Å; I419-T422 PolarHBondContact O-OG1 3.45Å; P420-T422 VanDerWaalsContact C-N 3.33Å; T422-A424 PolarHBondContact O-N 2.88Å; T422-S425 PolarHBondContact O-N 2.83Å; T422-S425 PolarHBondContact OG1-N 3.21Å; T422-S426 WeakPolarHBondContact O-CB 3.42Å; T422-S426 PolarHBondContact O-N 2.86Å; T422-S426 PolarHBondContact O-OG 2.9Å
423	A	81.7	Confident	77.4	Confident	58 Å²	58	54.2 Å²	54.2	48%	0.479	34%	0.344	S	S	.	.	H	α-helix	trans	-57.8	-45.5	174.6	0	0	0	0	0	112	S426 A427	A423-S426 CarbonylContact O-C 3.51Å; A423-S426 PolarHBondContact O-N 3.43Å; A423-S426 VanDerWaalsContact O-N 3.16Å; A423-A427 WeakPolarHBondContact O-CB 3.37Å; A423-A427 PolarHBondContact O-N 2.83Å
424	A	79.9	Confident	77.7	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-57.9	-50.2	175.5	0	0	0	0	0	113	L384 V386 V418 T422 S426 A427 G428 M429	L384-A424 HydrophobicContact CD1-CB 4.14Å; L384-A424 HydrophobicContact CG-CB 4.15Å; L384-A424 VanDerWaalsContact O-CB 3.3Å; L384-A424 WeakPolarHBondContact O-CB 3.4Å; L384-A424 PolarHBondContact O-N 2.93Å; V386-A424 HydrophobicContact CG1-CB 3.51Å; V418-A424 HydrophobicContact CG1-CB 3.92Å; T422-A424 PolarHBondContact O-N 2.88Å; A424-S426 PolarHBondContact O-N 3.48Å; A424-A427 PolarHBondContact O-N 3.14Å; A424-A427 VanDerWaalsContact O-N 3.15Å; A424-G428 PolarHBondContact O-N 2.72Å; A424-M429 HydrophobicContact CB-CB 4.24Å; A424-M429 HydrophobicContact CB-CG 4.22Å; A424-M429 HydrophobicContact CB-SD 3.51Å; A424-M429 VanDerWaalsContact CB-SD 3.51Å; A424-M429 WeakPolarHBondContact O-CB 3.44Å; A424-M429 WeakPolarHBondContact O-CG 3.3Å; A424-M429 PolarHBondContact O-N 3.36Å; A424-M429 VanDerWaalsContact O-N 3.1Å
425	S	76.8	Confident	78.1	Confident	49 Å²	49	55.4 Å²	55.4	34%	0.343	35%	0.353	S	S	.	.	H	α-helix	trans	-60.7	-33.2	176.2	173.2	0	0	0	0	112.2	I419 G421 T422	I419-S425 WeakPolarHBondContact O-CB 3.32Å; G421-S425 PolarHBondContact N-OG 3.34Å; T422-S425 PolarHBondContact O-N 2.83Å; T422-S425 PolarHBondContact OG1-N 3.21Å
426	S	85.4	Confident	78.6	Confident	101 Å²	101	59.8 Å²	59.8	71%	0.706	38%	0.375	S	S	*	.	H	α-helix	trans	-80	-25.2	178.1	-51.6	0	0	0	0	112.9	T422 A423 A424 G428	T422-S426 WeakPolarHBondContact O-CB 3.42Å; T422-S426 PolarHBondContact O-N 2.86Å; T422-S426 PolarHBondContact O-OG 2.9Å; A423-S426 CarbonylContact O-C 3.51Å; A423-S426 PolarHBondContact O-N 3.43Å; A423-S426 VanDerWaalsContact O-N 3.16Å; A424-S426 PolarHBondContact O-N 3.48Å; S426-G428 VanDerWaalsContact C-N 3.3Å
427	A	89.4	Confident	79.7	Confident	78 Å²	78	59.5 Å²	59.5	65%	0.645	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-4.7	174.3	0	0	0	0	0	113.2	A423 A424 M429	A423-A427 WeakPolarHBondContact O-CB 3.37Å; A423-A427 PolarHBondContact O-N 2.83Å; A424-A427 PolarHBondContact O-N 3.14Å; A424-A427 VanDerWaalsContact O-N 3.15Å; A427-M429 HydrophobicContact CB-CG 4.43Å
428	G	90.1	Very high	80.8	Confident	48 Å²	48	58.7 Å²	58.7	50%	0.495	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	84	14.6	179	0	0	0	0	0	115.1	A424 S426	A424-G428 PolarHBondContact O-N 2.72Å; S426-G428 VanDerWaalsContact C-N 3.3Å
429	M	88.3	Confident	81.8	Confident	49 Å²	49	65.4 Å²	65.4	24%	0.241	41%	0.413	C	S	.	.			trans	-65.2	144.1	171.9	-52.7	-178.3	84	0	0	110	L384 V386 I415 V418 A424 A427 I435	L384-M429 HydrophobicContact CD1-SD 4.28Å; L384-M429 HydrophobicContact CD2-SD 4.44Å; V386-M429 HydrophobicContact CG1-CE 4.16Å; V386-M429 HydrophobicContact CG1-SD 4.02Å; I415-M429 HydrophobicContact CD1-CE 3.5Å; I415-M429 VanDerWaalsContact CD1-CE 3.5Å; V418-M429 HydrophobicContact CG2-CB 4.24Å; A424-M429 HydrophobicContact CB-CB 4.24Å; A424-M429 HydrophobicContact CB-CG 4.22Å; A424-M429 HydrophobicContact CB-SD 3.51Å; A424-M429 VanDerWaalsContact CB-SD 3.51Å; A424-M429 WeakPolarHBondContact O-CB 3.44Å; A424-M429 WeakPolarHBondContact O-CG 3.3Å; A424-M429 PolarHBondContact O-N 3.36Å; A424-M429 VanDerWaalsContact O-N 3.1Å; A427-M429 HydrophobicContact CB-CG 4.43Å; M429-I435 HydrophobicContact CE-CD1 4.32Å; M429-I435 HydrophobicContact CE-CG1 4.37Å
430	M	84.8	Confident	82.9	Confident	127 Å²	127	67.5 Å²	67.5	63%	0.626	44%	0.442	S	S	*	.			trans	-121.6	162.5	-176.5	-55.2	-166.4	-164.6	0	0	112.4	V418 D433	V418-M430 VanDerWaalsContact CG2-C 3.41Å; V418-M430 WeakPolarHBondContact CG2-O 3.24Å; M430-D433 PolarHBondContact N-OD2 3Å; M430-D433 WeakPolarHBondContact O-CB 3.41Å; M430-D433 PolarHBondContact O-N 3.16Å
431	D	77.7	Confident	84.2	Confident	82 Å²	82	71.5 Å²	71.5	44%	0.439	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	143.9	167	-60	-24.1	0	0	0	109.4	E417 V418 D433	E417-D431 VanDerWaalsContact CA-OD1 3.25Å; E417-D431 WeakPolarHBondContact CA-OD1 3.28Å; V418-D431 PolarHBondContact N-OD1 2.04Å; D431-D433 VanDerWaalsContact C-N 3.27Å; D431-D433 PolarHBondContact O-N 3.07Å
432	H	77.3	Confident	85.2	Confident	99 Å²	99	71.5 Å²	71.5	46%	0.458	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.7	2	-176.3	-42.3	-79.7	0	0	0	116.4	Y414 I415	Y414-H432 HydrophobicContact CE2-CB 4.07Å; Y414-H432 AromaticContact CZ-ND1 3.86Å; Y414-H432 PolarHBondContact OH-ND1 2.95Å; I415-H432 VanDerWaalsContact O-CA 3.3Å; I415-H432 WeakPolarHBondContact O-CA 3.33Å; I415-H432 PolarHBondContact O-N 3.2Å
433	D	85.3	Confident	85.7	Confident	66 Å²	66	71 Å²	71	35%	0.353	43%	0.425	S	S	.	.			trans	-61.4	157.9	171.1	-84.9	-17.3	0	0	0	112.4	I415 M430 D431	I415-D433 HydrophobicContact CB-CB 4.36Å; I415-D433 HydrophobicContact CD1-CB 3.82Å; I415-D433 PolarHBondContact N-O 3.23Å; M430-D433 PolarHBondContact N-OD2 3Å; M430-D433 WeakPolarHBondContact O-CB 3.41Å; M430-D433 PolarHBondContact O-N 3.16Å; D431-D433 VanDerWaalsContact C-N 3.27Å; D431-D433 PolarHBondContact O-N 3.07Å
434	V	86.3	Confident	85.7	Confident	28 Å²	28	74.1 Å²	74.1	17%	0.17	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	121.5	173.9	-175.8	0	0	0	0	111.1	F391 F406 P407 V409 V413 Y414 I436	F391-V434 HydrophobicContact CE2-CG1 3.57Å; F391-V434 HydrophobicContact CE2-CG2 4.43Å; F391-V434 HydrophobicContact CZ-CG1 3.83Å; F391-V434 HydrophobicContact CZ-CG2 3.85Å; F406-V434 HydrophobicContact CE2-CG2 4.3Å; P407-V434 HydrophobicContact CG-CG2 3.94Å; V409-V434 HydrophobicContact CG2-CG1 4.22Å; V409-V434 HydrophobicContact CG2-CG2 4.48Å; V413-V434 WeakPolarHBondContact O-CA 3.24Å; Y414-V434 HydrophobicContact CD2-CG2 4.26Å; V434-I436 HydrophobicContact CG1-CG2 3.91Å; V434-I436 PolarHBondContact O-N 2.96Å
435	I	88.1	Confident	85.6	Confident	16 Å²	16	75.9 Å²	75.9	8%	0.082	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	104.8	168.8	-52	174.9	0	0	0	108.2	G412 V413 I415 M429 I438 I443 V449	G412-I435 CarbonylContact C-O 3.58Å; G412-I435 VanDerWaalsContact CA-O 3.23Å; G412-I435 WeakPolarHBondContact CA-O 3.31Å; V413-I435 HydrophobicContact CB-CB 4.38Å; V413-I435 PolarHBondContact N-O 3.21Å; V413-I435 PolarHBondContact O-N 3.06Å; I415-I435 HydrophobicContact CD1-CD1 4.05Å; I415-I435 HydrophobicContact CD1-CG1 3.78Å; I415-I435 HydrophobicContact CG1-CD1 4.32Å; I415-I435 HydrophobicContact CG1-CG1 4.27Å; M429-I435 HydrophobicContact CE-CD1 4.32Å; M429-I435 HydrophobicContact CE-CG1 4.37Å; I435-I438 HydrophobicContact CG2-CD1 4.11Å; I435-I438 HydrophobicContact CG2-CG1 3.88Å; I435-I443 HydrophobicContact CG2-CB 4.42Å; I435-I443 HydrophobicContact CG2-CG1 4.28Å; I435-I443 HydrophobicContact CG2-CG2 4.35Å; I435-V449 HydrophobicContact CD1-CG1 3.78Å; I435-V449 HydrophobicContact CD1-CG2 3.99Å; I435-V449 HydrophobicContact CG2-CG2 4.19Å
436	I	89.7	Confident	85.7	Confident	93 Å²	93	75.1 Å²	75.1	48%	0.477	43%	0.427	S	S	.	.			trans	-95.1	-24.7	173.9	59.9	173.6	0	0	0	112.9	V409 V434 P442 I443	V409-I436 HydrophobicContact CG1-CG2 3.91Å; V434-I436 HydrophobicContact CG1-CG2 3.91Å; V434-I436 PolarHBondContact O-N 2.96Å; I436-P442 WeakPolarHBondContact O-CA 3.38Å; I436-I443 PolarHBondContact O-N 3.02Å
437	S	90.2	Very high	85.1	Confident	58 Å²	58	75 Å²	75	41%	0.406	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159	156.2	179.7	57.4	0	0	0	0	112.3	R441	S437-R441 CarbonylContact C-O 3.41Å; S437-R441 WeakPolarHBondContact CA-O 3.42Å; S437-R441 WeakPolarHBondContact CB-O 3.48Å
438	I	89.7	Confident	84.7	Confident	35 Å²	35	73.9 Å²	73.9	18%	0.179	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	132.2	170.5	-60.9	169.2	0	0	0	107.4	I435 G440 R441 I443 V449 A452	I435-I438 HydrophobicContact CG2-CD1 4.11Å; I435-I438 HydrophobicContact CG2-CG1 3.88Å; I438-G440 PolarHBondContact O-N 3.22Å; I438-R441 PolarHBondContact N-O 2.94Å; I438-R441 WeakPolarHBondContact O-CB 3.36Å; I438-R441 PolarHBondContact O-N 2.82Å; I438-I443 HydrophobicContact CB-CD1 4.41Å; I438-I443 HydrophobicContact CB-CG1 4.4Å; I438-I443 HydrophobicContact CD1-CD1 4.08Å; I438-I443 HydrophobicContact CD1-CG1 4.19Å; I438-I443 HydrophobicContact CG1-CD1 4.28Å; I438-I443 HydrophobicContact CG1-CG1 4.03Å; I438-V449 HydrophobicContact CD1-CB 4.26Å; I438-V449 HydrophobicContact CD1-CG1 4.03Å; I438-V449 HydrophobicContact CD1-CG2 4.22Å; I438-A452 HydrophobicContact CB-CB 4.28Å; I438-A452 HydrophobicContact CD1-CB 3.86Å; I438-A452 HydrophobicContact CG2-CB 3.94Å
439	D	89.1	Confident	84.3	Confident	156 Å²	156	71.7 Å²	71.7	83%	0.834	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.9	36.9	-175.3	-66	-14.3	0	0	0	114.3	R441	D439-R441 PolarHBondContact O-N 2.82Å
440	G	86.9	Confident	83.7	Confident	73 Å²	73	72.9 Å²	72.9	75%	0.753	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.1	-2.4	-178.1	0	0	0	0	0	115.4	I438	I438-G440 PolarHBondContact O-N 3.22Å
441	R	88.9	Confident	83.4	Confident	193 Å²	193	73.2 Å²	73.2	73%	0.728	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.3	128.9	171.8	-57.2	-179	-177.8	-177.1	1.9	109.5	S437 I438 D439	S437-R441 CarbonylContact C-O 3.41Å; S437-R441 WeakPolarHBondContact CA-O 3.42Å; S437-R441 WeakPolarHBondContact CB-O 3.48Å; I438-R441 PolarHBondContact N-O 2.94Å; I438-R441 WeakPolarHBondContact O-CB 3.36Å; I438-R441 PolarHBondContact O-N 2.82Å; D439-R441 PolarHBondContact O-N 2.82Å
442	P	88.9	Confident	83.4	Confident	73 Å²	73	71.6 Å²	71.6	47%	0.474	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	148.2	174.1	29.5	-34.9	0	0	0	110.8	I436 Y444	I436-P442 WeakPolarHBondContact O-CA 3.38Å; P442-Y444 HydrophobicContact CB-CE2 3.82Å; P442-Y444 HydrophobicContact CG-CE2 3.9Å
443	I	86.3	Confident	82.9	Confident	8 Å²	8	70 Å²	70	4%	0.041	38%	0.382	C	S	.	.			trans	-119.6	133	-176.8	-65.5	-66.9	0	0	0	110	G412 V413 I435 I436 I438 E448 V449	G412-I443 WeakPolarHBondContact CA-O 3.47Å; V413-I443 HydrophobicContact CG2-CG2 3.91Å; I435-I443 HydrophobicContact CG2-CB 4.42Å; I435-I443 HydrophobicContact CG2-CG1 4.28Å; I435-I443 HydrophobicContact CG2-CG2 4.35Å; I436-I443 PolarHBondContact O-N 3.02Å; I438-I443 HydrophobicContact CB-CD1 4.41Å; I438-I443 HydrophobicContact CB-CG1 4.4Å; I438-I443 HydrophobicContact CD1-CD1 4.08Å; I438-I443 HydrophobicContact CD1-CG1 4.19Å; I438-I443 HydrophobicContact CG1-CD1 4.28Å; I438-I443 HydrophobicContact CG1-CG1 4.03Å; I443-E448 WeakPolarHBondContact CA-OE2 3.3Å; I443-E448 HydrophobicContact CD1-CB 3.69Å; I443-E448 HydrophobicContact CG2-CB 4.47Å; I443-V449 HydrophobicContact CG2-CG2 3.59Å
444	Y	80.9	Confident	82.8	Confident	124 Å²	124	70.2 Å²	70.2	49%	0.486	38%	0.383	S	S	.	.			trans	-125	-22	-178.6	-56.6	-85	0	0	0	113.2	Q390 P442 E448	Q390-Y444 PolarHBondContact NE2-O 3.49Å; P442-Y444 HydrophobicContact CB-CE2 3.82Å; P442-Y444 HydrophobicContact CG-CE2 3.9Å; Y444-E448 PolarHBondContact N-OE2 3.44Å
445	T	78.6	Confident	82.6	Confident	38 Å²	38	72.4 Å²	72.4	23%	0.233	39%	0.394	C	S	.	.	S	Bend	trans	-130.3	158	-178.2	68.8	0	0	0	0	112.5	Q390 V413 Q447 E448 V449	Q390-T445 VanDerWaalsContact NE2-CG2 3.3Å; V413-T445 VanDerWaalsContact CG2-C 3.43Å; V413-T445 WeakPolarHBondContact CG2-O 3.32Å; T445-Q447 VanDerWaalsContact C-N 3.26Å; T445-Q447 PolarHBondContact O-N 2.75Å; T445-E448 VanDerWaalsContact CB-OE1 3.27Å; T445-E448 WeakPolarHBondContact CB-OE1 3.46Å; T445-E448 WeakPolarHBondContact CG2-OE1 3.19Å; T445-E448 PolarHBondContact N-OE1 2.82Å; T445-E448 PolarHBondContact O-N 3.04Å; T445-E448 VanDerWaalsContact OG1-CG 3.25Å; T445-E448 WeakPolarHBondContact OG1-CG 3.42Å; T445-E448 PolarHBondContact OG1-N 2.95Å; T445-E448 VanDerWaalsContact OG1-N 3.11Å; T445-E448 PolarHBondContact OG1-OE1 3.37Å; T445-V449 PolarHBondContact O-N 2.9Å
446	K	77.6	Confident	82.3	Confident	32 Å²	32	75.5 Å²	75.5	14%	0.139	41%	0.412	C	S	.	.	H	α-helix	trans	-69.5	-27.5	173.2	-40.6	-174.5	-151.4	175.1	0	112.1	D309 M388 Q390 V413 V449 S450	D309-K446 WeakPolarHBondContact OD2-CD 3.33Å; D309-K446 IonicContact OD2-NZ 2.76Å; M388-K446 HydrophobicContact CB-CB 4.42Å; M388-K446 HydrophobicContact CB-CD 3.75Å; M388-K446 HydrophobicContact CB-CG 4.12Å; M388-K446 HydrophobicContact CE-CB 4.22Å; M388-K446 WeakPolarHBondContact O-CD 3.45Å; M388-K446 VanDerWaalsContact O-CE 3.3Å; M388-K446 WeakPolarHBondContact O-CE 3.35Å; M388-K446 PolarHBondContact O-NZ 2.71Å; M388-K446 HydrophobicContact SD-CB 4.46Å; Q390-K446 HydrophobicContact CB-CG 4.08Å; V413-K446 HydrophobicContact CG1-CG 4.19Å; V413-K446 HydrophobicContact CG2-CG 4.37Å; K446-V449 PolarHBondContact O-N 2.53Å; K446-S450 WeakPolarHBondContact O-CB 3.5Å; K446-S450 PolarHBondContact O-N 3.5Å; K446-S450 PolarHBondContact O-OG 2.99Å
447	Q	74	Confident	81.9	Confident	100 Å²	100	74.5 Å²	74.5	47%	0.467	41%	0.408	S	S	.	.	H	α-helix	trans	-60.6	-46.8	173.1	-175	177.9	-19.7	0	0	110.5	D309 T445 V449 S450 E451	D309-Q447 PolarHBondContact OD1-N 2.9Å; T445-Q447 VanDerWaalsContact C-N 3.26Å; T445-Q447 PolarHBondContact O-N 2.75Å; Q447-V449 VanDerWaalsContact C-N 3.3Å; Q447-V449 PolarHBondContact O-N 3.04Å; Q447-S450 CarbonylContact O-C 3.51Å; Q447-S450 WeakPolarHBondContact O-CA 3.45Å; Q447-S450 WeakPolarHBondContact O-CB 3.32Å; Q447-S450 PolarHBondContact O-N 2.81Å; Q447-E451 HydrophobicContact CG-CG 4.3Å; Q447-E451 WeakPolarHBondContact CG-OE1 3.42Å; Q447-E451 PolarHBondContact NE2-OE1 3.04Å; Q447-E451 WeakPolarHBondContact O-CG 3.46Å; Q447-E451 PolarHBondContact O-N 3.12Å
448	E	80.6	Confident	81.4	Confident	54 Å²	54	75.5 Å²	75.5	25%	0.252	41%	0.408	S	S	.	.	H	α-helix	trans	-59.1	-37.3	175.6	-69.9	149.1	-125.4	0	0	112.8	I443 Y444 T445 S450 A452	I443-E448 WeakPolarHBondContact CA-OE2 3.3Å; I443-E448 HydrophobicContact CD1-CB 3.69Å; I443-E448 HydrophobicContact CG2-CB 4.47Å; Y444-E448 PolarHBondContact N-OE2 3.44Å; T445-E448 VanDerWaalsContact CB-OE1 3.27Å; T445-E448 WeakPolarHBondContact CB-OE1 3.46Å; T445-E448 WeakPolarHBondContact CG2-OE1 3.19Å; T445-E448 PolarHBondContact N-OE1 2.82Å; T445-E448 PolarHBondContact O-N 3.04Å; T445-E448 VanDerWaalsContact OG1-CG 3.25Å; T445-E448 WeakPolarHBondContact OG1-CG 3.42Å; T445-E448 PolarHBondContact OG1-N 2.95Å; T445-E448 VanDerWaalsContact OG1-N 3.11Å; T445-E448 PolarHBondContact OG1-OE1 3.37Å; E448-S450 VanDerWaalsContact C-N 3.34Å; E448-A452 VanDerWaalsContact O-CB 3.24Å; E448-A452 WeakPolarHBondContact O-CB 3.39Å; E448-A452 PolarHBondContact O-N 2.83Å
449	V	80.9	Confident	80.8	Confident	2 Å²	2	78.2 Å²	78.2	1%	0.012	42%	0.423	C	S	.	.	H	α-helix	trans	-64.7	-40.6	171.7	-178.2	0	0	0	0	111.3	L384 M388 V413 I435 I438 I443 T445 K446 Q447 E451 A452 V453	L384-V449 HydrophobicContact CD2-CG1 4.45Å; M388-V449 HydrophobicContact CE-CB 4.39Å; M388-V449 HydrophobicContact CE-CG1 4.26Å; M388-V449 HydrophobicContact SD-CB 3.76Å; M388-V449 HydrophobicContact SD-CG1 3.53Å; M388-V449 VanDerWaalsContact SD-CG1 3.53Å; M388-V449 HydrophobicContact SD-CG2 4.1Å; V413-V449 HydrophobicContact CB-CG2 4.17Å; V413-V449 HydrophobicContact CG1-CG2 4.41Å; V413-V449 HydrophobicContact CG2-CG2 4.01Å; I435-V449 HydrophobicContact CD1-CG1 3.78Å; I435-V449 HydrophobicContact CD1-CG2 3.99Å; I435-V449 HydrophobicContact CG2-CG2 4.19Å; I438-V449 HydrophobicContact CD1-CB 4.26Å; I438-V449 HydrophobicContact CD1-CG1 4.03Å; I438-V449 HydrophobicContact CD1-CG2 4.22Å; I443-V449 HydrophobicContact CG2-CG2 3.59Å; T445-V449 PolarHBondContact O-N 2.9Å; K446-V449 PolarHBondContact O-N 2.53Å; Q447-V449 VanDerWaalsContact C-N 3.3Å; Q447-V449 PolarHBondContact O-N 3.04Å; V449-E451 VanDerWaalsContact C-N 3.33Å; V449-A452 PolarHBondContact O-N 3.03Å; V449-V453 WeakPolarHBondContact O-CG2 3.22Å; V449-V453 PolarHBondContact O-N 2.57Å
450	S	76.1	Confident	80.2	Confident	73 Å²	73	72.6 Å²	72.6	51%	0.51	39%	0.394	S	S	.	.	H	α-helix	trans	-75.3	-22.2	-177.6	-53.4	0	0	0	0	113.2	K446 Q447 E448	K446-S450 WeakPolarHBondContact O-CB 3.5Å; K446-S450 PolarHBondContact O-N 3.5Å; K446-S450 PolarHBondContact O-OG 2.99Å; Q447-S450 CarbonylContact O-C 3.51Å; Q447-S450 WeakPolarHBondContact O-CA 3.45Å; Q447-S450 WeakPolarHBondContact O-CB 3.32Å; Q447-S450 PolarHBondContact O-N 2.81Å; E448-S450 VanDerWaalsContact C-N 3.34Å
451	E	77.9	Confident	79.7	Confident	134 Å²	134	72.6 Å²	72.6	63%	0.626	37%	0.366	S	S	*	.	H	α-helix	trans	-86.6	-28.4	173.5	-72.8	178.6	-174.6	0	0	112.6	Q447 V449	Q447-E451 HydrophobicContact CG-CG 4.3Å; Q447-E451 WeakPolarHBondContact CG-OE1 3.42Å; Q447-E451 PolarHBondContact NE2-OE1 3.04Å; Q447-E451 WeakPolarHBondContact O-CG 3.46Å; Q447-E451 PolarHBondContact O-N 3.12Å; V449-E451 VanDerWaalsContact C-N 3.33Å
452	A	77.8	Confident	79	Confident	49 Å²	49	62.6 Å²	62.6	41%	0.405	34%	0.336	S	S	.	.	H	α-helix	trans	-80.4	-22.2	-178.5	0	0	0	0	0	114.4	I438 E448 V449	I438-A452 HydrophobicContact CB-CB 4.28Å; I438-A452 HydrophobicContact CD1-CB 3.86Å; I438-A452 HydrophobicContact CG2-CB 3.94Å; E448-A452 VanDerWaalsContact O-CB 3.24Å; E448-A452 WeakPolarHBondContact O-CB 3.39Å; E448-A452 PolarHBondContact O-N 2.83Å; V449-A452 PolarHBondContact O-N 3.03Å
453	V	68.1	Low	78.1	Confident	64 Å²	64	61.6 Å²	61.6	39%	0.388	32%	0.324	S	S	.	.			trans	-90.1	0	-175.1	175.2	0	0	0	0	112	K382 L384 V449	K382-V453 HydrophobicContact CB-CG1 4.46Å; K382-V453 VanDerWaalsContact CD-C 3.44Å; K382-V453 WeakPolarHBondContact CD-O 3.44Å; K382-V453 WeakPolarHBondContact CD-OXT 3.36Å; K382-V453 WeakPolarHBondContact CE-O 3.36Å; K382-V453 VanDerWaalsContact NZ-C 3.3Å; K382-V453 PolarHBondContact NZ-O 3.32Å; K382-V453 PolarHBondContact NZ-OXT 3.21Å; L384-V453 HydrophobicContact CB-CG1 4.31Å; L384-V453 HydrophobicContact CD2-CG2 4.15Å; V449-V453 WeakPolarHBondContact O-CG2 3.22Å; V449-V453 PolarHBondContact O-N 2.57Å

Retrieved 453 of 453 residues in 2515.6 ms (Link to these results)

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