A0A0D9RHT7_CHLSB Loading...

Grainyhead like transcription factor 2

AlphaFold DB , UniProt , Accession A0A0D9RHT7, Species CHLSB (Chlorocebus sabaeus, Green monkey), Gene GRHL2, Length 625 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.3	Very low	33.4	Very low	236 Å²	236	166 Å²	166	100%	1.163	83%	0.834	S	S	*	*				0	144.9	0	-59.5	165.6	72.7	0	0	108
2	S	33.5	Very low	33.4	Very low	91 Å²	91	163.3 Å²	163.3	64%	0.636	83%	0.832	S	S	*	*			cis	176.8	131.2	-29.4	-88.1	0	0	0	0	106.6
3	Q	32.3	Very low	33.1	Very low	164 Å²	164	157.8 Å²	157.8	77%	0.766	83%	0.826	S	S	*	*			trans	62.6	159.7	157.8	-68.4	167.3	-85.6	0	0	116.6
4	E	34.3	Very low	32.8	Very low	151 Å²	151	158.9 Å²	158.9	71%	0.706	83%	0.832	S	S	*	*			cis	-153.7	-178.6	-22.8	-121.5	165.9	146.2	0	0	109.5
5	S	34.3	Very low	32.7	Very low	103 Å²	103	156.7 Å²	156.7	72%	0.72	83%	0.827	S	S	*	*			trans	20	138.8	154.7	59.8	0	0	0	0	120.3
6	D	32.2	Very low	33.1	Very low	149 Å²	149	154.2 Å²	154.2	80%	0.797	82%	0.823	S	S	*	*				-159.7	167.2	58.6	-150.8	-8.4	0	0	0	115.5
7	N	32.8	Very low	33	Very low	151 Å²	151	155.4 Å²	155.4	81%	0.807	83%	0.825	S	S	*	*			trans	-85.4	152.7	179.6	-75.5	-81.1	0	0	0	112.8
8	N	32.9	Very low	33.8	Very low	166 Å²	166	152.4 Å²	152.4	89%	0.888	82%	0.816	S	S	*	*			trans	-135.2	140.8	166.5	-140.9	-27.7	0	0	0	112.5
9	K	40.1	Very low	33.6	Very low	192 Å²	192	149.7 Å²	149.7	84%	0.835	81%	0.81	S	S	*	*			trans	-97.7	134.7	-164.9	-60.5	169.2	-176.8	169.4	0	111.8
10	R	32.8	Very low	33.3	Very low	247 Å²	247	149.7 Å²	149.7	93%	0.932	81%	0.81	S	S	*	*			trans	-160.5	142.1	143.6	-115.5	164.3	-172.5	-179.4	1.6	113.6
11	L	30.5	Very low	33.5	Very low	176 Å²	176	147.8 Å²	147.8	92%	0.921	81%	0.805	S	S	*	*			trans	-83	149.7	169.5	-72.8	153.6	0	0	0	109.6
12	V	32.3	Very low	34.2	Very low	134 Å²	134	142 Å²	142	81%	0.812	79%	0.785	S	S	*	*			trans	-128.4	125.6	168.8	179.6	0	0	0	0	108.4
13	A	29.5	Very low	34.2	Very low	92 Å²	92	147 Å²	147	76%	0.76	80%	0.796	S	S	*	*			trans	-106.4	138.2	169.2	0	0	0	0	0	108.9
14	L	29.9	Very low	34	Very low	173 Å²	173	146.9 Å²	146.9	91%	0.906	80%	0.8	S	S	*	*			trans	-88.2	132.7	177.6	-75.3	164.7	0	0	0	110.5
15	V	30.5	Very low	34.2	Very low	125 Å²	125	145.3 Å²	145.3	76%	0.758	80%	0.801	S	S	*	*			trans	-121.7	127.1	174.5	179.5	0	0	0	0	108.3
16	P	39.8	Very low	34.6	Very low	117 Å²	117	151.3 Å²	151.3	76%	0.76	81%	0.808	S	S	*	*			trans	-84.5	154.5	179.5	34.1	-34.8	0	0	0	112.5
17	M	30.4	Very low	34.8	Very low	175 Å²	175	154.6 Å²	154.6	86%	0.862	81%	0.809	S	S	*	*			trans	-137.7	160.7	172.6	-78.4	-63.1	-75.3	0	0	110.9
18	P	47.8	Very low	35.3	Very low	102 Å²	102	151.1 Å²	151.1	66%	0.662	80%	0.801	S	S	*	*			trans	-125	-157.5	-141.5	45.2	-33.9	0	0	0	115.8
19	S	31	Very low	35.8	Very low	101 Å²	101	149.9 Å²	149.9	71%	0.706	79%	0.785	S	S	*	*			trans	79.3	142	179.9	72.1	0	0	0	0	115.9
20	D	27	Very low	36.3	Very low	149 Å²	149	146.5 Å²	146.5	80%	0.797	78%	0.781	S	S	*	*			cis	-171.4	176.3	-15.7	-100.5	-25.9	0	0	0	107.9
21	P	37.5	Very low	37.7	Very low	109 Å²	109	136.9 Å²	136.9	71%	0.708	75%	0.752	S	S	*	*			cis	-123.6	178.3	-33	39.3	-24.8	0	0	0	112
22	P	47.8	Very low	39	Very low	116 Å²	116	135.8 Å²	135.8	75%	0.753	74%	0.741	S	S	*	*			trans	-100.6	114.2	-175.5	35.1	-30.4	0	0	0	114.9
23	F	31.7	Very low	40.3	Very low	196 Å²	196	135.3 Å²	135.3	86%	0.86	73%	0.734	S	S	*	*			trans	-149	107.6	163.3	-99.5	-77.9	0	0	0	113.5
24	N	29.8	Very low	41.9	Very low	160 Å²	160	134.9 Å²	134.9	86%	0.856	72%	0.717	S	S	*	*			trans	-158.6	110.1	130.5	-125.1	-32.1	0	0	0	111.1
25	T	38.2	Very low	43.4	Very low	118 Å²	118	129.4 Å²	129.4	72%	0.724	70%	0.697	S	S	*	*			trans	-134	142.4	173.6	-49.1	0	0	0	0	107.7
26	R	41.7	Very low	44.7	Very low	229 Å²	229	131.6 Å²	131.6	86%	0.864	69%	0.691	S	S	*	*			trans	82.2	129.7	-172.6	-49.8	164.5	-179.5	-102.7	0.5	112.1
27	R	36.2	Very low	45.9	Very low	219 Å²	219	132.3 Å²	132.3	83%	0.826	68%	0.682	S	S	*	*				-118.9	166	50.8	-68.2	179.8	178.4	170.5	0.1	114.9
28	A	44.1	Very low	47.5	Very low	77 Å²	77	125.9 Å²	125.9	64%	0.636	66%	0.655	S	S	*	*			trans	-89.3	130.8	159.3	0	0	0	0	0	108.2	T30	A28-T30 PolarHBondContact O-N 2.76Å
29	Y	42.7	Very low	48.7	Very low	141 Å²	141	126.7 Å²	126.7	55%	0.553	65%	0.645	S	S	*	*			trans	-83	117	-170.9	-68.3	-84.8	0	0	0	112	E34 K77	Y29-E34 HydrophobicContact CD1-CB 3.98Å; Y29-E34 HydrophobicContact CD1-CG 4.35Å; Y29-K77 PolarHBondContact O-NZ 2.9Å
30	T	50.2	Low	50.6	Low	120 Å²	120	128.4 Å²	128.4	74%	0.736	65%	0.646	S	S	*	*			trans	-96.9	-26.8	-175.5	46.8	0	0	0	0	113.6	A28 K77	A28-T30 PolarHBondContact O-N 2.76Å; T30-K77 PolarHBondContact O-NZ 3.42Å
31	S	62.3	Low	52.8	Low	46 Å²	46	128.5 Å²	128.5	32%	0.322	64%	0.641	S	S	.	*			trans	-85.2	163.6	178.5	78.7	0	0	0	0	113.9	E34	S31-E34 WeakPolarHBondContact OG-CB 3.3Å; S31-E34 VanDerWaalsContact OG-CG 3.24Å; S31-E34 WeakPolarHBondContact OG-CG 3.44Å; S31-E34 PolarHBondContact OG-N 3.34Å; S31-E34 PolarHBondContact OG-OE2 3.04Å
32	E	58.9	Low	54.6	Low	152 Å²	152	127.8 Å²	127.8	71%	0.71	63%	0.632	S	S	*	*	S	Bend	trans	-90	-34.3	174.2	-60.8	-174.4	149.1	0	0	112	E34 A35 W36	E32-E34 VanDerWaalsContact C-N 3.27Å; E32-E34 PolarHBondContact O-N 3.15Å; E32-A35 WeakPolarHBondContact O-CB 3.26Å; E32-A35 PolarHBondContact O-N 2.85Å; E32-W36 VanDerWaalsContact O-CD1 3.28Å; E32-W36 PolarHBondContact O-N 2.64Å
33	D	59.7	Low	56.1	Low	124 Å²	124	126.3 Å²	126.3	66%	0.663	62%	0.622	S	S	*	*	H	α-helix	trans	-57.7	-35.8	177.4	-70.2	-22.9	0	0	0	113.3	A35 W36 K37	D33-A35 VanDerWaalsContact C-N 3.31Å; D33-W36 PolarHBondContact O-N 3.12Å; D33-K37 WeakPolarHBondContact O-CG 3.23Å; D33-K37 PolarHBondContact O-N 3.12Å
34	E	62.3	Low	58.5	Low	84 Å²	84	119.1 Å²	119.1	39%	0.393	59%	0.592	S	S	.	*	H	α-helix	trans	-69	-29.4	176	-71	171.6	119.1	0	0	112.3	Y29 S31 E32 S38	Y29-E34 HydrophobicContact CD1-CB 3.98Å; Y29-E34 HydrophobicContact CD1-CG 4.35Å; S31-E34 WeakPolarHBondContact OG-CB 3.3Å; S31-E34 VanDerWaalsContact OG-CG 3.24Å; S31-E34 WeakPolarHBondContact OG-CG 3.44Å; S31-E34 PolarHBondContact OG-N 3.34Å; S31-E34 PolarHBondContact OG-OE2 3.04Å; E32-E34 VanDerWaalsContact C-N 3.27Å; E32-E34 PolarHBondContact O-N 3.15Å; E34-S38 PolarHBondContact O-N 2.77Å; E34-S38 VanDerWaalsContact O-N 3.08Å
35	A	62.7	Low	61	Low	58 Å²	58	114.9 Å²	114.9	48%	0.479	57%	0.572	S	S	.	*	H	α-helix	trans	-71.6	-41.8	174.5	0	0	0	0	0	111.3	E32 D33 K37 S38 Y39	E32-A35 WeakPolarHBondContact O-CB 3.26Å; E32-A35 PolarHBondContact O-N 2.85Å; D33-A35 VanDerWaalsContact C-N 3.31Å; A35-K37 VanDerWaalsContact C-N 3.34Å; A35-K37 PolarHBondContact O-N 2.66Å; A35-S38 PolarHBondContact O-N 2.84Å; A35-Y39 PolarHBondContact O-N 2.76Å
36	W	57.5	Low	63.1	Low	171 Å²	171	113.4 Å²	113.4	65%	0.648	57%	0.573	S	S	*	*	H	α-helix	trans	-61.8	-39	173.9	-71.3	111.6	0	0	0	112.5	E32 D33 Y39 L40	E32-W36 VanDerWaalsContact O-CD1 3.28Å; E32-W36 PolarHBondContact O-N 2.64Å; D33-W36 PolarHBondContact O-N 3.12Å; W36-Y39 PolarHBondContact O-N 3.3Å; W36-L40 WeakPolarHBondContact O-CG 2.88Å; W36-L40 PolarHBondContact O-N 2.85Å
37	K	63.7	Low	64.6	Low	131 Å²	131	105.4 Å²	105.4	57%	0.57	56%	0.555	S	S	*	*	H	α-helix	trans	-62	-47.1	171.9	-74.2	-180	179.7	-179.5	0	112.2	D33 A35 Y39 L40 E41	D33-K37 WeakPolarHBondContact O-CG 3.23Å; D33-K37 PolarHBondContact O-N 3.12Å; A35-K37 VanDerWaalsContact C-N 3.34Å; A35-K37 PolarHBondContact O-N 2.66Å; K37-Y39 VanDerWaalsContact C-N 3.28Å; K37-Y39 PolarHBondContact O-N 2.73Å; K37-L40 PolarHBondContact O-N 2.83Å; K37-L40 VanDerWaalsContact O-N 3.1Å; K37-E41 PolarHBondContact O-N 2.86Å
38	S	65.5	Low	66.7	Low	40 Å²	40	96 Å²	96	28%	0.28	52%	0.522	S	S	.	.	H	α-helix	trans	-60	-37.2	179.2	-166.6	0	0	0	0	112.7	E34 A35 N42	E34-S38 PolarHBondContact O-N 2.77Å; E34-S38 VanDerWaalsContact O-N 3.08Å; A35-S38 PolarHBondContact O-N 2.84Å; S38-N42 PolarHBondContact O-N 2.93Å
39	Y	71.7	Confident	68.4	Low	120 Å²	120	97.6 Å²	97.6	47%	0.471	52%	0.515	S	S	.	.	H	α-helix	trans	-64.8	-37.7	174.5	179.9	-94.9	0	0	0	113.4	A35 W36 K37 Y71	A35-Y39 PolarHBondContact O-N 2.76Å; W36-Y39 PolarHBondContact O-N 3.3Å; K37-Y39 VanDerWaalsContact C-N 3.28Å; K37-Y39 PolarHBondContact O-N 2.73Å; Y39-Y71 HydrophobicContact CD2-CE2 4.09Å; Y39-Y71 AromaticContact CD2-CZ 3.82Å; Y39-Y71 VanDerWaalsContact CD2-OH 3.32Å; Y39-Y71 WeakPolarHBondContact CD2-OH 3.2Å
40	L	70.4	Confident	70.1	Confident	136 Å²	136	93.7 Å²	93.7	71%	0.712	51%	0.512	S	S	*	.	H	α-helix	trans	-78.1	-38.2	179.1	-70.1	171.5	0	0	0	113	W36 K37	W36-L40 WeakPolarHBondContact O-CG 2.88Å; W36-L40 PolarHBondContact O-N 2.85Å; K37-L40 PolarHBondContact O-N 2.83Å; K37-L40 VanDerWaalsContact O-N 3.1Å
41	E	74.2	Confident	71.4	Confident	151 Å²	151	92.9 Å²	92.9	71%	0.706	50%	0.501	S	S	*	.	H	α-helix	trans	-77.5	-32	179.4	-69.5	179.6	165.7	0	0	112.8	K37 P43	K37-E41 PolarHBondContact O-N 2.86Å; E41-P43 WeakPolarHBondContact O-CD 3.43Å
42	N	75.8	Confident	72.2	Confident	94 Å²	94	91.6 Å²	91.6	50%	0.503	49%	0.49	S	S	.	.	S	Bend	trans	-124.7	70.3	178.4	-72.4	-81.1	0	0	0	111.5	S38 Y71	S38-N42 PolarHBondContact O-N 2.93Å; N42-Y71 WeakPolarHBondContact O-CE1 3.42Å; N42-Y71 PolarHBondContact O-OH 2.77Å; N42-Y71 VanDerWaalsContact O-OH 3.07Å
43	P	79.6	Confident	72.8	Confident	86 Å²	86	86.7 Å²	86.7	56%	0.558	47%	0.472	S	S	*	.	P	Polyproline II helix	trans	-57	148.2	177.2	25.1	-35	0	0	0	111.7	E41 T45 Y70	E41-P43 WeakPolarHBondContact O-CD 3.43Å; P43-T45 PolarHBondContact O-N 3.43Å; P43-Y70 PolarHBondContact O-OH 2.66Å
44	L	81.3	Confident	73.4	Confident	44 Å²	44	86.9 Å²	86.9	23%	0.23	47%	0.472	C	S	.	.	P	Polyproline II helix	trans	-58.7	124.2	177.9	-73	168.3	0	0	0	110.9	T48 M52 L67 Y70 Y71	L44-T48 HydrophobicContact CD2-CG2 3.71Å; L44-M52 HydrophobicContact CD1-SD 4.13Å; L44-L67 HydrophobicContact CD1-CD1 3.91Å; L44-L67 HydrophobicContact CD2-CD1 4.17Å; L44-L67 HydrophobicContact CG-CD1 4.48Å; L44-Y70 HydrophobicContact CD2-CD1 3.68Å; L44-Y70 HydrophobicContact CD2-CE1 3.78Å; L44-Y70 HydrophobicContact CD2-CG 4.06Å; L44-Y71 HydrophobicContact CD2-CE2 4.11Å; L44-Y71 HydrophobicContact CG-CE2 4.3Å
45	T	83.1	Confident	73.9	Confident	71 Å²	71	89.5 Å²	89.5	44%	0.436	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-60.1	150.9	172.4	81.8	0	0	0	0	110.6	P43 A47 T48 K49	P43-T45 PolarHBondContact O-N 3.43Å; T45-A47 PolarHBondContact O-N 2.74Å; T45-A47 VanDerWaalsContact O-N 3.12Å; T45-A47 PolarHBondContact OG1-N 2.68Å; T45-T48 PolarHBondContact O-N 2.87Å; T45-T48 PolarHBondContact OG1-N 2.63Å; T45-T48 PolarHBondContact OG1-OG1 3.3Å; T45-K49 PolarHBondContact O-N 3.1Å
46	A	81.4	Confident	74.1	Confident	88 Å²	88	90.1 Å²	90.1	73%	0.727	50%	0.501	S	S	*	.	H	α-helix	trans	-56.5	-30.1	176.9	0	0	0	0	0	112.9	A50	A46-A50 VanDerWaalsContact O-CB 3.27Å; A46-A50 WeakPolarHBondContact O-CB 3.49Å; A46-A50 PolarHBondContact O-N 3.38Å
47	A	74.1	Confident	74.7	Confident	61 Å²	61	85.9 Å²	85.9	50%	0.504	49%	0.491	S	S	.	.	H	α-helix	trans	-71.4	-44	174	0	0	0	0	0	112.3	T45 A50 M51	T45-A47 PolarHBondContact O-N 2.74Å; T45-A47 VanDerWaalsContact O-N 3.12Å; T45-A47 PolarHBondContact OG1-N 2.68Å; A47-A50 PolarHBondContact O-N 3.15Å; A47-M51 WeakPolarHBondContact O-CE 3.46Å; A47-M51 WeakPolarHBondContact O-CG 3.27Å; A47-M51 PolarHBondContact O-N 2.84Å; A47-M51 VanDerWaalsContact O-N 3.08Å
48	T	79.3	Confident	75.1	Confident	21 Å²	21	83 Å²	83	13%	0.129	48%	0.479	C	S	.	.	H	α-helix	trans	-60.8	-46.2	175.5	-42.4	0	0	0	0	110.6	L44 T45 M51 M52 Y70	L44-T48 HydrophobicContact CD2-CG2 3.71Å; T45-T48 PolarHBondContact O-N 2.87Å; T45-T48 PolarHBondContact OG1-N 2.63Å; T45-T48 PolarHBondContact OG1-OG1 3.3Å; T48-M51 PolarHBondContact O-N 2.72Å; T48-M52 PolarHBondContact O-N 2.85Å; T48-Y70 HydrophobicContact CG2-CD2 3.88Å; T48-Y70 HydrophobicContact CG2-CE2 4.22Å; T48-Y70 HydrophobicContact CG2-CG 4.35Å
49	K	79.8	Confident	75.4	Confident	111 Å²	111	87.6 Å²	87.6	48%	0.483	50%	0.501	S	S	.	.	H	α-helix	trans	-62.7	-47.7	178.2	-173.7	163.9	-175.8	165.8	0	111.8	T45 M51 M52 S53 E58	T45-K49 PolarHBondContact O-N 3.1Å; K49-M51 PolarHBondContact O-N 2.97Å; K49-M52 WeakPolarHBondContact O-CA 3.39Å; K49-M52 WeakPolarHBondContact O-CB 3.34Å; K49-M52 PolarHBondContact O-N 3.01Å; K49-S53 PolarHBondContact O-N 3.25Å; K49-S53 PolarHBondContact O-OG 3.31Å; K49-E58 WeakPolarHBondContact CE-OE2 3.29Å; K49-E58 IonicContact NZ-OE2 2.69Å
50	A	78.1	Confident	75.7	Confident	59 Å²	59	83 Å²	83	49%	0.488	49%	0.486	S	S	.	.	H	α-helix	trans	-62.3	-23.4	177.3	0	0	0	0	0	114.1	A46 A47	A46-A50 VanDerWaalsContact O-CB 3.27Å; A46-A50 WeakPolarHBondContact O-CB 3.49Å; A46-A50 PolarHBondContact O-N 3.38Å; A47-A50 PolarHBondContact O-N 3.15Å
51	M	78.3	Confident	75.9	Confident	103 Å²	103	80.7 Å²	80.7	51%	0.507	49%	0.487	S	S	.	.	H	α-helix	trans	-77.7	-28.4	171.6	-76	-173.9	-78.3	0	0	113.3	A47 T48 K49 I54 L66	A47-M51 WeakPolarHBondContact O-CE 3.46Å; A47-M51 WeakPolarHBondContact O-CG 3.27Å; A47-M51 PolarHBondContact O-N 2.84Å; A47-M51 VanDerWaalsContact O-N 3.08Å; T48-M51 PolarHBondContact O-N 2.72Å; K49-M51 PolarHBondContact O-N 2.97Å; M51-I54 WeakPolarHBondContact O-CG2 3.26Å; M51-L66 HydrophobicContact CB-CD1 4.26Å
52	M	78.8	Confident	76	Confident	19 Å²	19	76.9 Å²	76.9	9%	0.094	48%	0.481	C	S	.	.	H	α-helix	trans	-69.2	-42.7	167.8	-65.5	173.3	65.4	0	0	110.5	L44 T48 K49 I54 A63 L66 L67	L44-M52 HydrophobicContact CD1-SD 4.13Å; T48-M52 PolarHBondContact O-N 2.85Å; K49-M52 WeakPolarHBondContact O-CA 3.39Å; K49-M52 WeakPolarHBondContact O-CB 3.34Å; K49-M52 PolarHBondContact O-N 3.01Å; M52-I54 PolarHBondContact O-N 2.99Å; M52-A63 HydrophobicContact CB-CB 3.87Å; M52-A63 HydrophobicContact CE-CB 4.11Å; M52-A63 HydrophobicContact CG-CB 4.09Å; M52-L66 HydrophobicContact CG-CB 4.4Å; M52-L66 HydrophobicContact CG-CD1 4.41Å; M52-L67 HydrophobicContact CE-CB 4.17Å; M52-L67 HydrophobicContact CE-CD1 4.25Å; M52-L67 HydrophobicContact SD-CD1 4.31Å
53	S	72.3	Confident	76.2	Confident	48 Å²	48	72.5 Å²	72.5	34%	0.336	46%	0.458	S	S	.	.	G	3₁₀ helix	trans	-69.3	-2.1	-179.1	-42.5	0	0	0	0	115.4	K49 N55 G56 E58	K49-S53 PolarHBondContact O-N 3.25Å; K49-S53 PolarHBondContact O-OG 3.31Å; S53-N55 PolarHBondContact O-N 2.93Å; S53-N55 VanDerWaalsContact O-N 3.09Å; S53-G56 PolarHBondContact O-N 2.89Å; S53-E58 WeakPolarHBondContact CA-OE1 3.32Å; S53-E58 VanDerWaalsContact CB-OE1 3.22Å; S53-E58 WeakPolarHBondContact CB-OE1 3.47Å; S53-E58 PolarHBondContact N-OE1 3.05Å; S53-E58 PolarHBondContact OG-OE1 3.17Å
54	I	72.2	Confident	76.2	Confident	128 Å²	128	71.3 Å²	71.3	66%	0.656	45%	0.447	S	S	*	.	G	3₁₀ helix	trans	-67.3	-19.9	-160.4	-151.7	168	0	0	0	114.4	M51 M52	M51-I54 WeakPolarHBondContact O-CG2 3.26Å; M52-I54 PolarHBondContact O-N 2.99Å
55	N	72.6	Confident	76	Confident	140 Å²	140	70.4 Å²	70.4	75%	0.749	45%	0.447	S	S	*	.	G	3₁₀ helix	trans	-107.4	-1.4	173.9	-76.5	99.3	0	0	0	113.9	S53 D57	S53-N55 PolarHBondContact O-N 2.93Å; S53-N55 VanDerWaalsContact O-N 3.09Å; N55-D57 PolarHBondContact O-N 2.91Å
56	G	67.1	Low	75.9	Confident	71 Å²	71	70.8 Å²	70.8	73%	0.732	45%	0.446	S	S	*	.	S	Bend	trans	78.8	-0.2	-171.8	0	0	0	0	0	115	S53	S53-G56 PolarHBondContact O-N 2.89Å
57	D	69.9	Low	75.9	Confident	81 Å²	81	68.7 Å²	68.7	43%	0.433	42%	0.423	S	S	.	.			trans	-114.4	87.6	-178.6	-179.6	6.8	0	0	0	109.7	N55 D59 S60	N55-D57 PolarHBondContact O-N 2.91Å; D57-D59 PolarHBondContact O-N 3.2Å; D57-D59 PolarHBondContact OD1-N 2.84Å; D57-S60 VanDerWaalsContact O-CB 3.32Å; D57-S60 WeakPolarHBondContact O-CB 3.44Å; D57-S60 PolarHBondContact O-N 2.83Å; D57-S60 PolarHBondContact O-OG 3.31Å; D57-S60 PolarHBondContact OD1-N 2.86Å; D57-S60 VanDerWaalsContact OD1-N 3.07Å; D57-S60 WeakPolarHBondContact OD2-CB 3.21Å
58	E	71.4	Confident	76.3	Confident	72 Å²	72	68.2 Å²	68.2	34%	0.336	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-23.3	179.9	-60.3	-97.2	98.9	0	0	112.1	K49 S53 A63	K49-E58 WeakPolarHBondContact CE-OE2 3.29Å; K49-E58 IonicContact NZ-OE2 2.69Å; S53-E58 WeakPolarHBondContact CA-OE1 3.32Å; S53-E58 VanDerWaalsContact CB-OE1 3.22Å; S53-E58 WeakPolarHBondContact CB-OE1 3.47Å; S53-E58 PolarHBondContact N-OE1 3.05Å; S53-E58 PolarHBondContact OG-OE1 3.17Å; E58-A63 WeakPolarHBondContact O-CB 3.43Å
59	D	71.8	Confident	76.4	Confident	135 Å²	135	71.1 Å²	71.1	72%	0.722	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	-3.5	-178.9	-64.6	-51.2	0	0	0	112.8	D57 L64	D57-D59 PolarHBondContact O-N 3.2Å; D57-D59 PolarHBondContact OD1-N 2.84Å; D59-L64 WeakPolarHBondContact O-CD1 3.46Å
60	S	79.1	Confident	76.5	Confident	23 Å²	23	69.3 Å²	69.3	16%	0.161	41%	0.414	C	S	.	.	S	Bend	trans	-54.8	145.9	178.5	64.7	0	0	0	0	112.6	D57 A62 A63 L64	D57-S60 VanDerWaalsContact O-CB 3.32Å; D57-S60 WeakPolarHBondContact O-CB 3.44Å; D57-S60 PolarHBondContact O-N 2.83Å; D57-S60 PolarHBondContact O-OG 3.31Å; D57-S60 PolarHBondContact OD1-N 2.86Å; D57-S60 VanDerWaalsContact OD1-N 3.07Å; D57-S60 WeakPolarHBondContact OD2-CB 3.21Å; S60-A62 PolarHBondContact O-N 2.92Å; S60-A63 PolarHBondContact O-N 3.43Å; S60-A63 WeakPolarHBondContact OG-CB 3.36Å; S60-A63 PolarHBondContact OG-N 3.07Å; S60-L64 PolarHBondContact O-N 2.68Å
61	A	74.8	Confident	76.6	Confident	89 Å²	89	68.5 Å²	68.5	74%	0.736	40%	0.398	S	S	*	.	H	α-helix	trans	-57.8	-22.3	176.8	0	0	0	0	0	113.5	G65	A61-G65 PolarHBondContact O-N 2.6Å
62	A	75.4	Confident	76.5	Confident	70 Å²	70	71.3 Å²	71.3	58%	0.579	41%	0.408	S	S	*	.	H	α-helix	trans	-74	-45.8	172	0	0	0	0	0	112.2	S60 G65 L66	S60-A62 PolarHBondContact O-N 2.92Å; A62-G65 PolarHBondContact O-N 2.9Å; A62-L66 WeakPolarHBondContact O-CG 3.32Å; A62-L66 PolarHBondContact O-N 2.98Å
63	A	79.4	Confident	76.3	Confident	2 Å²	2	72.3 Å²	72.3	2%	0.017	42%	0.415	C	S	.	.	H	α-helix	trans	-63.2	-44.9	175.1	0	0	0	0	0	111.8	M52 E58 S60 G65 L66 L67	M52-A63 HydrophobicContact CB-CB 3.87Å; M52-A63 HydrophobicContact CE-CB 4.11Å; M52-A63 HydrophobicContact CG-CB 4.09Å; E58-A63 WeakPolarHBondContact O-CB 3.43Å; S60-A63 PolarHBondContact O-N 3.43Å; S60-A63 WeakPolarHBondContact OG-CB 3.36Å; S60-A63 PolarHBondContact OG-N 3.07Å; A63-G65 VanDerWaalsContact C-N 3.31Å; A63-G65 PolarHBondContact O-N 2.9Å; A63-L66 PolarHBondContact O-N 3.46Å; A63-L67 PolarHBondContact O-N 3.26Å
64	L	79.7	Confident	76.1	Confident	62 Å²	62	72 Å²	72	33%	0.325	41%	0.411	S	S	.	.	H	α-helix	trans	-61.3	-38.3	172.4	-66.6	174.9	0	0	0	112	D59 S60 L67 Y68	D59-L64 WeakPolarHBondContact O-CD1 3.46Å; S60-L64 PolarHBondContact O-N 2.68Å; L64-L67 HydrophobicContact CD2-CD2 4.48Å; L64-L67 WeakPolarHBondContact O-CB 3.49Å; L64-L67 PolarHBondContact O-N 2.83Å; L64-Y68 HydrophobicContact CB-CE2 4.29Å; L64-Y68 WeakPolarHBondContact O-CD2 3.28Å; L64-Y68 VanDerWaalsContact O-CG 3.31Å; L64-Y68 PolarHBondContact O-N 2.8Å
65	G	78.2	Confident	75.7	Confident	24 Å²	24	75.2 Å²	75.2	25%	0.247	42%	0.415	C	S	.	.	H	α-helix	trans	-58.6	-47	173	0	0	0	0	0	112.9	A61 A62 A63 Y68 D69	A61-G65 PolarHBondContact O-N 2.6Å; A62-G65 PolarHBondContact O-N 2.9Å; A63-G65 VanDerWaalsContact C-N 3.31Å; A63-G65 PolarHBondContact O-N 2.9Å; G65-Y68 PolarHBondContact O-N 3.46Å; G65-D69 WeakPolarHBondContact O-CB 3.43Å; G65-D69 PolarHBondContact O-N 3.24Å
66	L	80.9	Confident	75.2	Confident	79 Å²	79	75.5 Å²	75.5	41%	0.414	42%	0.417	S	S	.	.	H	α-helix	trans	-62.3	-41	174.5	-69.2	173.3	0	0	0	112	M51 M52 A62 A63 D69 Y70	M51-L66 HydrophobicContact CB-CD1 4.26Å; M52-L66 HydrophobicContact CG-CB 4.4Å; M52-L66 HydrophobicContact CG-CD1 4.41Å; A62-L66 WeakPolarHBondContact O-CG 3.32Å; A62-L66 PolarHBondContact O-N 2.98Å; A63-L66 PolarHBondContact O-N 3.46Å; L66-D69 PolarHBondContact O-N 2.87Å; L66-Y70 WeakPolarHBondContact O-CB 3.22Å; L66-Y70 PolarHBondContact O-N 3.31Å
67	L	80.9	Confident	75	Confident	45 Å²	45	77.1 Å²	77.1	24%	0.236	40%	0.404	C	S	.	.	H	α-helix	trans	-61.7	-47.9	177.6	-170.2	69.5	0	0	0	111.5	L44 M52 A63 L64 D69 Y70 Y71	L44-L67 HydrophobicContact CD1-CD1 3.91Å; L44-L67 HydrophobicContact CD2-CD1 4.17Å; L44-L67 HydrophobicContact CG-CD1 4.48Å; M52-L67 HydrophobicContact CE-CB 4.17Å; M52-L67 HydrophobicContact CE-CD1 4.25Å; M52-L67 HydrophobicContact SD-CD1 4.31Å; A63-L67 PolarHBondContact O-N 3.26Å; L64-L67 HydrophobicContact CD2-CD2 4.48Å; L64-L67 WeakPolarHBondContact O-CB 3.49Å; L64-L67 PolarHBondContact O-N 2.83Å; L67-D69 VanDerWaalsContact C-N 3.35Å; L67-D69 PolarHBondContact O-N 2.9Å; L67-Y70 PolarHBondContact O-N 2.95Å; L67-Y71 HydrophobicContact CD1-CD2 3.88Å; L67-Y71 HydrophobicContact CD1-CE2 3.64Å; L67-Y71 HydrophobicContact CG-CD2 4.25Å; L67-Y71 HydrophobicContact CG-CE2 4.48Å; L67-Y71 WeakPolarHBondContact O-CD2 3.25Å; L67-Y71 PolarHBondContact O-N 2.96Å
68	Y	83.6	Confident	74.8	Confident	51 Å²	51	76.2 Å²	76.2	20%	0.2	39%	0.394	C	S	.	.	H	α-helix	trans	-66.4	-32.9	177	-65.3	-44.8	0	0	0	113.1	L64 G65 K72 V73 R78	L64-Y68 HydrophobicContact CB-CE2 4.29Å; L64-Y68 WeakPolarHBondContact O-CD2 3.28Å; L64-Y68 VanDerWaalsContact O-CG 3.31Å; L64-Y68 PolarHBondContact O-N 2.8Å; G65-Y68 PolarHBondContact O-N 3.46Å; Y68-K72 CarbonylContact O-C 3.58Å; Y68-K72 WeakPolarHBondContact O-CA 3.49Å; Y68-K72 PolarHBondContact O-N 2.84Å; Y68-V73 HydrophobicContact CD1-CB 3.75Å; Y68-V73 HydrophobicContact CD1-CG1 3.94Å; Y68-V73 HydrophobicContact CD1-CG2 3.86Å; Y68-V73 HydrophobicContact CE1-CG1 4.34Å; Y68-V73 HydrophobicContact CG-CB 4.32Å; Y68-V73 PolarHBondContact O-N 3.34Å; Y68-R78 VanDerWaalsContact CB-CZ 3.44Å; Y68-R78 HydrophobicContact CD1-CG 4.43Å; Y68-R78 HydrophobicContact CD2-CB 4.11Å; Y68-R78 HydrophobicContact CD2-CG 3.69Å; Y68-R78 HydrophobicContact CE2-CB 3.9Å; Y68-R78 HydrophobicContact CE2-CG 3.91Å; Y68-R78 HydrophobicContact CG-CG 3.97Å; Y68-R78 PolarHBondContact O-NH2 3.47Å
69	D	80.3	Confident	73.8	Confident	82 Å²	82	79.9 Å²	79.9	44%	0.439	42%	0.416	S	S	.	.	H	α-helix	trans	-82.1	-20.7	177	-80.1	0.7	0	0	0	113.2	G65 L66 L67 K72 R78	G65-D69 WeakPolarHBondContact O-CB 3.43Å; G65-D69 PolarHBondContact O-N 3.24Å; L66-D69 PolarHBondContact O-N 2.87Å; L67-D69 VanDerWaalsContact C-N 3.35Å; L67-D69 PolarHBondContact O-N 2.9Å; D69-K72 WeakPolarHBondContact O-CD 3.32Å; D69-K72 WeakPolarHBondContact O-CE 3.05Å; D69-K72 PolarHBondContact O-NZ 3.41Å; D69-R78 IonicContact OD1-CZ 3.98Å; D69-R78 IonicContact OD1-NH1 3.97Å; D69-R78 PolarHBondContact OD1-NH1 2.8Å; D69-R78 IonicContact OD1-NH2 2.64Å; D69-R78 PolarHBondContact OD1-NH2 2.78Å
70	Y	81.3	Confident	72.5	Confident	73 Å²	73	80.8 Å²	80.8	29%	0.286	42%	0.419	S	S	.	.	H	α-helix	trans	-71.5	-57.7	167.8	-173.2	-98.6	0	0	0	110.3	P43 L44 T48 L66 L67 K72	P43-Y70 PolarHBondContact O-OH 2.66Å; L44-Y70 HydrophobicContact CD2-CD1 3.68Å; L44-Y70 HydrophobicContact CD2-CE1 3.78Å; L44-Y70 HydrophobicContact CD2-CG 4.06Å; T48-Y70 HydrophobicContact CG2-CD2 3.88Å; T48-Y70 HydrophobicContact CG2-CE2 4.22Å; T48-Y70 HydrophobicContact CG2-CG 4.35Å; L66-Y70 WeakPolarHBondContact O-CB 3.22Å; L66-Y70 PolarHBondContact O-N 3.31Å; L67-Y70 PolarHBondContact O-N 2.95Å; Y70-K72 PolarHBondContact O-N 3.36Å
71	Y	81.6	Confident	70.3	Confident	42 Å²	42	85.2 Å²	85.2	17%	0.165	45%	0.45	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	9.9	179.9	-64.7	-67	0	0	0	114.8	Y39 N42 L44 L67 V73	Y39-Y71 HydrophobicContact CD2-CE2 4.09Å; Y39-Y71 AromaticContact CD2-CZ 3.82Å; Y39-Y71 VanDerWaalsContact CD2-OH 3.32Å; Y39-Y71 WeakPolarHBondContact CD2-OH 3.2Å; N42-Y71 WeakPolarHBondContact O-CE1 3.42Å; N42-Y71 PolarHBondContact O-OH 2.77Å; N42-Y71 VanDerWaalsContact O-OH 3.07Å; L44-Y71 HydrophobicContact CD2-CE2 4.11Å; L44-Y71 HydrophobicContact CG-CE2 4.3Å; L67-Y71 HydrophobicContact CD1-CD2 3.88Å; L67-Y71 HydrophobicContact CD1-CE2 3.64Å; L67-Y71 HydrophobicContact CG-CD2 4.25Å; L67-Y71 HydrophobicContact CG-CE2 4.48Å; L67-Y71 WeakPolarHBondContact O-CD2 3.25Å; L67-Y71 PolarHBondContact O-N 2.96Å; Y71-V73 PolarHBondContact O-N 3.32Å; Y71-V73 VanDerWaalsContact O-N 3.13Å
72	K	76.4	Confident	68.4	Low	162 Å²	162	87.4 Å²	87.4	70%	0.704	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.9	33.7	176.1	-51.9	-57.7	172.5	-160.7	0	115.1	Y68 D69 Y70	Y68-K72 CarbonylContact O-C 3.58Å; Y68-K72 WeakPolarHBondContact O-CA 3.49Å; Y68-K72 PolarHBondContact O-N 2.84Å; D69-K72 WeakPolarHBondContact O-CD 3.32Å; D69-K72 WeakPolarHBondContact O-CE 3.05Å; D69-K72 PolarHBondContact O-NZ 3.41Å; Y70-K72 PolarHBondContact O-N 3.36Å
73	V	73.4	Confident	66.1	Low	39 Å²	39	89.3 Å²	89.3	24%	0.236	46%	0.463	C	S	.	.			trans	-63.3	126	-179.3	-179	0	0	0	0	110.1	Y68 Y71 K77 R78	Y68-V73 HydrophobicContact CD1-CB 3.75Å; Y68-V73 HydrophobicContact CD1-CG1 3.94Å; Y68-V73 HydrophobicContact CD1-CG2 3.86Å; Y68-V73 HydrophobicContact CE1-CG1 4.34Å; Y68-V73 HydrophobicContact CG-CB 4.32Å; Y68-V73 PolarHBondContact O-N 3.34Å; Y71-V73 PolarHBondContact O-N 3.32Å; Y71-V73 VanDerWaalsContact O-N 3.13Å; V73-K77 HydrophobicContact CG1-CB 4.3Å; V73-R78 PolarHBondContact O-NE 3.24Å; V73-R78 PolarHBondContact O-NH2 3.48Å
74	P	68.5	Low	63.9	Low	41 Å²	41	99.1 Å²	99.1	27%	0.266	51%	0.506	S	S	.	.			trans	-53.7	141.3	179.5	-28.4	35.8	0	0	0	112.8	D76 K77	P74-D76 PolarHBondContact O-N 2.88Å; P74-K77 PolarHBondContact O-N 3.46Å; P74-K77 VanDerWaalsContact O-N 3.15Å
75	R	62.6	Low	61.5	Low	197 Å²	197	101 Å²	101	74%	0.743	53%	0.53	S	S	*	.	G	3₁₀ helix	trans	-60.4	-33.3	-173.8	-70.6	-175.7	176.6	-177.5	-1.3	112.8	K77 R78	R75-K77 PolarHBondContact O-N 2.58Å; R75-R78 WeakPolarHBondContact O-CB 3.26Å; R75-R78 PolarHBondContact O-N 3.06Å
76	D	62.1	Low	59.1	Low	146 Å²	146	105.3 Å²	105.3	78%	0.781	56%	0.557	S	S	*	*	G	3₁₀ helix	trans	-68	-15.6	-176.8	-34.2	-70.9	0	0	0	112.8	P74	P74-D76 PolarHBondContact O-N 2.88Å
77	K	62.8	Low	56.7	Low	105 Å²	105	108.9 Å²	108.9	46%	0.457	58%	0.576	S	S	.	*	G	3₁₀ helix	trans	-96.3	0.2	174.2	-73.9	-173.6	164.8	-172.4	0	114	Y29 T30 V73 P74 R75 L79	Y29-K77 PolarHBondContact O-NZ 2.9Å; T30-K77 PolarHBondContact O-NZ 3.42Å; V73-K77 HydrophobicContact CG1-CB 4.3Å; P74-K77 PolarHBondContact O-N 3.46Å; P74-K77 VanDerWaalsContact O-N 3.15Å; R75-K77 PolarHBondContact O-N 2.58Å; K77-L79 VanDerWaalsContact C-N 3.3Å; K77-L79 PolarHBondContact O-N 2.87Å
78	R	67.6	Low	54.2	Low	61 Å²	61	113 Å²	113	23%	0.23	61%	0.608	C	S	.	*			trans	-89.8	29.1	-172.9	-56.9	-178	-172.7	-161.8	-2.6	114.3	Y68 D69 V73 R75	Y68-R78 VanDerWaalsContact CB-CZ 3.44Å; Y68-R78 HydrophobicContact CD1-CG 4.43Å; Y68-R78 HydrophobicContact CD2-CB 4.11Å; Y68-R78 HydrophobicContact CD2-CG 3.69Å; Y68-R78 HydrophobicContact CE2-CB 3.9Å; Y68-R78 HydrophobicContact CE2-CG 3.91Å; Y68-R78 HydrophobicContact CG-CG 3.97Å; Y68-R78 PolarHBondContact O-NH2 3.47Å; D69-R78 IonicContact OD1-CZ 3.98Å; D69-R78 IonicContact OD1-NH1 3.97Å; D69-R78 PolarHBondContact OD1-NH1 2.8Å; D69-R78 IonicContact OD1-NH2 2.64Å; D69-R78 PolarHBondContact OD1-NH2 2.78Å; V73-R78 PolarHBondContact O-NE 3.24Å; V73-R78 PolarHBondContact O-NH2 3.48Å; R75-R78 WeakPolarHBondContact O-CB 3.26Å; R75-R78 PolarHBondContact O-N 3.06Å
79	L	49.5	Very low	51.7	Low	150 Å²	150	119 Å²	119	79%	0.785	64%	0.638	S	S	*	*			trans	-115.4	116.8	-176	-69.8	173.7	0	0	0	111.2	K77	K77-L79 VanDerWaalsContact C-N 3.3Å; K77-L79 PolarHBondContact O-N 2.87Å
80	L	43.8	Very low	49.3	Very low	153 Å²	153	123.6 Å²	123.6	80%	0.801	66%	0.657	S	S	*	*			trans	-131.4	133.4	165.3	-69.8	175.9	0	0	0	108.9	V82	L80-V82 PolarHBondContact O-N 2.88Å
81	S	33.4	Very low	46.8	Very low	116 Å²	116	127.3 Å²	127.3	81%	0.811	68%	0.682	S	S	*	*			trans	-86.1	103.6	-179.1	53.5	0	0	0	0	111.1	S83	S81-S83 PolarHBondContact O-N 3.3Å
82	V	34.5	Very low	44.3	Very low	135 Å²	135	133.7 Å²	133.7	82%	0.818	71%	0.714	S	S	*	*			trans	-79.1	104.3	173.5	-179.1	0	0	0	0	110	L80	L80-V82 PolarHBondContact O-N 2.88Å
83	S	28	Very low	42.1	Very low	110 Å²	110	131.6 Å²	131.6	77%	0.769	71%	0.706	S	S	*	*			trans	-67.8	125.8	169.4	-63.4	0	0	0	0	110.5	S81	S81-S83 PolarHBondContact O-N 3.3Å
84	K	33.4	Very low	40.2	Very low	208 Å²	208	137 Å²	137	90%	0.904	73%	0.726	S	S	*	*			trans	-75.1	129.2	173.1	-70.3	-173.3	175.1	-173.1	0	111
85	A	28	Very low	38.4	Very low	102 Å²	102	144.9 Å²	144.9	84%	0.843	75%	0.751	S	S	*	*			trans	-104.1	153.6	153.7	0	0	0	0	0	108.7
86	S	28.3	Very low	36.7	Very low	115 Å²	115	142.4 Å²	142.4	80%	0.804	75%	0.753	S	S	*	*			trans	-99	168.5	-164.5	53.7	0	0	0	0	114.5
87	D	30.9	Very low	35	Very low	154 Å²	154	140.4 Å²	140.4	82%	0.824	75%	0.749	S	S	*	*			trans	-49.8	149.6	170.2	-60.4	-81.8	0	0	0	114.3
88	S	27.9	Very low	33.3	Very low	130 Å²	130	143.6 Å²	143.6	91%	0.909	77%	0.77	S	S	*	*			trans	-151.6	142.4	143.5	-77	0	0	0	0	109.9
89	Q	31	Very low	31.4	Very low	177 Å²	177	144 Å²	144	83%	0.827	79%	0.794	S	S	*	*			trans	-105.2	146.8	-173.2	171.3	-168.9	-37.2	0	0	109
90	E	30.3	Very low	31.1	Very low	180 Å²	180	142.7 Å²	142.7	84%	0.841	79%	0.794	S	S	*	*			trans	162.8	152.5	133.1	-89.1	-178.9	160.5	0	0	113.7
91	D	29.3	Very low	30.4	Very low	150 Å²	150	139.9 Å²	139.9	80%	0.802	79%	0.787	S	S	*	*			trans	-80.6	152.1	169.1	-63.8	-82.6	0	0	0	111.3
92	Q	29.4	Very low	30.3	Very low	177 Å²	177	142.4 Å²	142.4	83%	0.827	79%	0.786	S	S	*	*				170.6	152.3	112.6	-93.6	179.4	45.9	0	0	116.7
93	E	30.6	Very low	30.1	Very low	117 Å²	117	140 Å²	140	55%	0.547	78%	0.78	S	S	.	*			trans	51.8	111.4	144.2	-60.4	-90.3	106.6	0	0	122.1
94	K	32.7	Very low	30.3	Very low	152 Å²	152	143 Å²	143	66%	0.661	78%	0.782	S	S	*	*				38.6	127.3	122.1	-52.7	169.7	-168.5	144.5	0	120.3
95	R	30.1	Very low	30	Very low	207 Å²	207	138 Å²	138	78%	0.781	77%	0.773	S	S	*	*				143	110.6	107.7	-169.6	-179.6	-63	136.8	2.8	115.4
96	N	27.1	Very low	30	Very low	146 Å²	146	139.6 Å²	139.6	78%	0.781	77%	0.767	S	S	*	*			trans	27.4	129	144.9	-68.8	17.8	0	0	0	123.7
97	C	26.3	Very low	30.2	Very low	104 Å²	104	141.6 Å²	141.6	70%	0.703	77%	0.768	S	S	*	*			trans	90.7	113.8	130	-71.9	0	0	0	0	123.4
98	L	28.3	Very low	30	Very low	171 Å²	171	140 Å²	140	90%	0.895	77%	0.769	S	S	*	*			trans	75.7	150.1	135.8	-56.7	170.5	0	0	0	120
99	G	26.3	Very low	30	Very low	71 Å²	71	137.4 Å²	137.4	73%	0.732	76%	0.762	S	S	*	*			trans	-107.1	-137.9	178.3	0	0	0	0	0	112.2
100	P	44.1	Very low	29.8	Very low	122 Å²	122	132.6 Å²	132.6	79%	0.792	76%	0.761	S	S	*	*			cis	-134	-160.9	2.7	44.1	-26.2	0	0	0	114.1
101	S	28.3	Very low	29.7	Very low	94 Å²	94	133.1 Å²	133.1	66%	0.657	76%	0.763	S	S	*	*			trans	68.1	153	162.5	-77	0	0	0	0	118.7
102	E	31.1	Very low	29.7	Very low	169 Å²	169	133.1 Å²	133.1	79%	0.79	76%	0.763	S	S	*	*			cis	-163.2	158.4	-17.7	-119.9	166.3	121.8	0	0	111
103	A	31.6	Very low	29.7	Very low	83 Å²	83	136.3 Å²	136.3	69%	0.686	77%	0.768	S	S	*	*			trans	55	148.7	149.4	0	0	0	0	0	121.5
104	Q	30.4	Very low	29.6	Very low	175 Å²	175	137.8 Å²	137.8	82%	0.818	78%	0.784	S	S	*	*			cis	-166.2	156.3	-11.5	-114.5	177.5	12	0	0	110.8
105	S	28	Very low	29.4	Very low	101 Å²	101	138.4 Å²	138.4	71%	0.706	79%	0.79	S	S	*	*			trans	69.5	146.9	153.8	78.6	0	0	0	0	118.7
106	N	28.4	Very low	29.3	Very low	136 Å²	136	135.7 Å²	135.7	73%	0.727	80%	0.795	S	S	*	*			cis	-161.3	140.8	-5.4	-119.7	-7.4	0	0	0	113
107	L	31.9	Very low	29.4	Very low	158 Å²	158	135.5 Å²	135.5	83%	0.827	79%	0.794	S	S	*	*			trans	60.9	146.8	153.2	-56.5	173.9	0	0	0	118.6
108	S	27.1	Very low	29.4	Very low	121 Å²	121	140.3 Å²	140.3	85%	0.846	80%	0.803	S	S	*	*			cis	-152.6	155.9	-4.8	-176.8	0	0	0	0	108.2
109	G	27.8	Very low	29.5	Very low	74 Å²	74	138.7 Å²	138.7	76%	0.763	80%	0.8	S	S	*	*			trans	-176.1	-19.2	-178.7	0	0	0	0	0	121.3
110	G	27.6	Very low	29.6	Very low	77 Å²	77	140.9 Å²	140.9	79%	0.794	80%	0.799	S	S	*	*			trans	68.1	101.2	169.5	0	0	0	0	0	117.6
111	E	27.8	Very low	29	Very low	191 Å²	191	140.9 Å²	140.9	89%	0.893	80%	0.799	S	S	*	*			trans	-131.3	163.4	170.9	-82.7	-154.2	123.9	0	0	113.8
112	N	29.4	Very low	28.9	Very low	150 Å²	150	142.3 Å²	142.3	80%	0.802	80%	0.803	S	S	*	*			trans	-63.7	139.7	-176.8	-64.8	-80.2	0	0	0	114.4
113	R	29.2	Very low	28.7	Very low	244 Å²	244	141.5 Å²	141.5	92%	0.921	81%	0.805	S	S	*	*			trans	-174.7	109.3	137.7	-104.1	159	-169.9	-156.3	3.3	112.3
114	V	28	Very low	28.4	Very low	147 Å²	147	145.4 Å²	145.4	89%	0.891	81%	0.813	S	S	*	*			trans	-87	136.6	160.8	177.2	0	0	0	0	108.6
115	Q	28.7	Very low	28.2	Very low	166 Å²	166	142.2 Å²	142.2	78%	0.776	81%	0.81	S	S	*	*			trans	-87.5	130.2	-174.8	-60.5	173.4	2.2	0	0	110.8	L117	Q115-L117 PolarHBondContact O-N 2.96Å
116	V	27.6	Very low	28.2	Very low	149 Å²	149	145.5 Å²	145.5	90%	0.903	82%	0.819	S	S	*	*			trans	-79.9	102.1	171.1	179.3	0	0	0	0	109
117	L	29	Very low	28.1	Very low	143 Å²	143	146.4 Å²	146.4	75%	0.749	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-68.3	142.1	173.5	-82.6	162.1	0	0	0	111.4	Q115 T119	Q115-L117 PolarHBondContact O-N 2.96Å; L117-T119 PolarHBondContact O-N 2.91Å
118	K	27.4	Very low	27.9	Very low	205 Å²	205	146.9 Å²	146.9	89%	0.891	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-70.6	124.2	168.3	-63.6	176.3	-178.9	176.1	0	108.9
119	T	29.2	Very low	27.9	Very low	136 Å²	136	146.9 Å²	146.9	83%	0.834	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-101.2	142.1	168.1	45	0	0	0	0	111.1	L117	L117-T119 PolarHBondContact O-N 2.91Å
120	V	29.3	Very low	27.8	Very low	118 Å²	118	150 Å²	150	72%	0.715	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-90.8	146.4	-176.8	-179.5	0	0	0	0	108.7	V122	V120-V122 PolarHBondContact O-N 3.31Å
121	P	30.4	Very low	27.7	Very low	122 Å²	122	153.8 Å²	153.8	79%	0.792	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-57.1	125.2	173.6	22.9	-34.9	0	0	0	111.7
122	V	26.8	Very low	27.7	Very low	123 Å²	123	151.1 Å²	151.1	75%	0.745	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-88.7	121.5	178.4	175.8	0	0	0	0	109.5	V120 L124	V120-V122 PolarHBondContact O-N 3.31Å; V122-L124 HydrophobicContact CG1-CD2 4.34Å
123	N	26.2	Very low	27.5	Very low	153 Å²	153	149.7 Å²	149.7	82%	0.818	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-78.1	131.5	162	-87.7	-62.4	0	0	0	109.2
124	L	26.9	Very low	27.5	Very low	165 Å²	165	141.8 Å²	141.8	86%	0.864	77%	0.77	S	S	*	*			trans	-101.9	96.6	167.4	-71.1	174.4	0	0	0	108.9	V122	V122-L124 HydrophobicContact CG1-CD2 4.34Å
125	S	25.7	Very low	27.4	Very low	108 Å²	108	143.4 Å²	143.4	76%	0.755	77%	0.765	S	S	*	*			trans	-90.1	142.1	161	49.2	0	0	0	0	109.7
126	L	27.4	Very low	27.3	Very low	170 Å²	170	145.5 Å²	145.5	89%	0.89	77%	0.766	S	S	*	*			trans	-133.8	113.2	173.7	-110.6	165.6	0	0	0	107.6
127	N	26	Very low	27.2	Very low	154 Å²	154	145.1 Å²	145.1	82%	0.824	75%	0.754	S	S	*	*			trans	-121.2	135.3	174	-85.2	-17.7	0	0	0	108.7
128	Q	27.8	Very low	27.1	Very low	169 Å²	169	146.8 Å²	146.8	79%	0.79	76%	0.758	S	S	*	*			trans	-163.3	89.8	165.1	-172.4	107.6	92.7	0	0	104.6
129	D	27	Very low	27.1	Very low	121 Å²	121	147 Å²	147	65%	0.647	76%	0.755	S	S	*	*				78.6	151.1	94.9	-64.5	-40	0	0	0	114.2
130	H	27.3	Very low	26.9	Very low	138 Å²	138	145.7 Å²	145.7	64%	0.639	75%	0.751	S	S	*	*			cis	-171.6	127.7	-29.6	-163.8	-82.5	0	0	0	108.3	E132	H130-E132 IonicContact CE1-OE1 2.81Å
131	L	25.3	Very low	26.7	Very low	157 Å²	157	148.1 Å²	148.1	82%	0.822	76%	0.758	S	S	*	*			trans	177.3	121.4	158.1	-121.7	52.6	0	0	0	107
132	E	27.5	Very low	26.5	Very low	136 Å²	136	147.3 Å²	147.3	64%	0.636	76%	0.755	S	S	*	*				61.6	131.7	61.4	-65.3	-160.1	-141.9	0	0	113.6	H130	H130-E132 IonicContact CE1-OE1 2.81Å
133	N	25.7	Very low	26.6	Very low	120 Å²	120	150.5 Å²	150.5	64%	0.642	76%	0.759	S	S	*	*			cis	-157.5	-177.1	0	-129.3	-62.9	0	0	0	106.7
134	S	27.3	Very low	27.2	Very low	77 Å²	77	149.1 Å²	149.1	54%	0.538	76%	0.759	S	S	.	*			cis	-161.4	158.6	6.7	-142.2	0	0	0	0	115.2
135	K	27.6	Very low	27.2	Very low	182 Å²	182	150 Å²	150	79%	0.791	76%	0.758	S	S	*	*			trans	41.8	123.1	141.4	-70.2	172	-173.2	174.2	0	122.5
136	R	25.8	Very low	27.3	Very low	210 Å²	210	150.3 Å²	150.3	79%	0.792	76%	0.76	S	S	*	*				63.3	117.9	115.9	-156.9	-147.5	-170.2	-155.1	11.9	118.4
137	E	25.6	Very low	27.3	Very low	140 Å²	140	147.2 Å²	147.2	65%	0.654	75%	0.753	S	S	*	*				-169.8	173.4	102.3	-101	179.5	-160	0	0	114.7
138	Q	27.3	Very low	27.4	Very low	179 Å²	179	144.1 Å²	144.1	84%	0.836	75%	0.749	S	S	*	*			trans	-145.2	113.5	-163.3	170.9	-168.8	8.9	0	0	108.3
139	Y	26.1	Very low	27.4	Very low	210 Å²	210	143 Å²	143	82%	0.824	75%	0.747	S	S	*	*			trans	-144.2	133.2	170.7	-98.2	-76.4	0	0	0	113.1
140	S	25.1	Very low	27.4	Very low	107 Å²	107	144 Å²	144	75%	0.748	75%	0.751	S	S	*	*			trans	-98.3	153.3	162.3	47	0	0	0	0	109.7
141	I	26.1	Very low	27.8	Very low	169 Å²	169	142.9 Å²	142.9	87%	0.867	76%	0.756	S	S	*	*			trans	-153.5	157.5	165.9	-104.6	150.8	0	0	0	108.8
142	S	25.6	Very low	27.9	Very low	105 Å²	105	141.2 Å²	141.2	73%	0.734	75%	0.752	S	S	*	*			trans	-107.6	175.9	-163.1	56.7	0	0	0	0	115.2
143	F	30.4	Very low	27.9	Very low	190 Å²	190	140.9 Å²	140.9	83%	0.833	76%	0.764	S	S	*	*			trans	-50.7	162.8	166.1	-62.1	-89.5	0	0	0	114
144	P	37.2	Very low	28	Very low	124 Å²	124	138.3 Å²	138.3	81%	0.805	77%	0.767	S	S	*	*				-132.9	177.5	103.6	39.3	-31.5	0	0	0	115.1
145	E	26.5	Very low	27.9	Very low	184 Å²	184	142.4 Å²	142.4	86%	0.86	78%	0.781	S	S	*	*			trans	-102.1	-166.9	-174	-52.8	175.9	97.8	0	0	114.4
146	S	29.3	Very low	27.9	Very low	114 Å²	114	140.4 Å²	140.4	80%	0.797	78%	0.784	S	S	*	*			trans	82.5	147.7	162.3	-92.5	0	0	0	0	119.3
147	S	27.4	Very low	28	Very low	106 Å²	106	136.8 Å²	136.8	74%	0.741	79%	0.785	S	S	*	*			cis	-171.9	-169.3	-21.9	46.2	0	0	0	0	110.4
148	A	27.2	Very low	28.1	Very low	88 Å²	88	136.9 Å²	136.9	73%	0.727	79%	0.794	S	S	*	*			trans	86.7	156.3	173.5	0	0	0	0	0	118.4
149	I	27.6	Very low	27.9	Very low	146 Å²	146	135.2 Å²	135.2	75%	0.749	79%	0.785	S	S	*	*				177.5	122	-51.4	-97.6	160.3	0	0	0	109
150	I	27.9	Very low	28	Very low	142 Å²	142	129.4 Å²	129.4	73%	0.728	78%	0.78	S	S	*	*			trans	59.3	160.6	149.2	-65.6	177.6	0	0	0	117.6	V152	I150-V152 HydrophobicContact CG2-CG2 4.4Å
151	P	35.5	Very low	27.9	Very low	114 Å²	114	130.6 Å²	130.6	74%	0.74	77%	0.774	S	S	*	*			cis	-107.8	168	-0.2	15.7	9.3	0	0	0	114.2
152	V	27.7	Very low	27.8	Very low	122 Å²	122	129.4 Å²	129.4	74%	0.739	77%	0.769	S	S	*	*			cis	85.5	99	35.2	-177.8	0	0	0	0	115.7	I150	I150-V152 HydrophobicContact CG2-CG2 4.4Å
153	S	28.1	Very low	27.7	Very low	129 Å²	129	134.1 Å²	134.1	90%	0.902	78%	0.777	S	S	*	*			trans	-177.7	147.1	149.4	-78	0	0	0	0	108.7
154	G	26.8	Very low	27.6	Very low	67 Å²	67	130.6 Å²	130.6	69%	0.691	77%	0.771	S	S	*	*			cis	169.2	114.1	-11	0	0	0	0	0	113.7
155	I	26.2	Very low	27.4	Very low	163 Å²	163	130.5 Å²	130.5	84%	0.836	77%	0.77	S	S	*	*			trans	58.9	117	152.1	-50.4	170.8	0	0	0	119.3
156	T	26.8	Very low	27.4	Very low	139 Å²	139	127.3 Å²	127.3	85%	0.853	76%	0.763	S	S	*	*				-170.8	153	120.6	14.6	0	0	0	0	112
157	V	28.1	Very low	27.4	Very low	135 Å²	135	131.4 Å²	131.4	82%	0.818	77%	0.767	S	S	*	*			trans	-147.8	126.7	-173.7	176.9	0	0	0	0	111.9
158	V	26.3	Very low	27.5	Very low	141 Å²	141	134.6 Å²	134.6	86%	0.855	77%	0.772	S	S	*	*			trans	-157	128.1	157.2	-138	0	0	0	0	105.6
159	K	23.5	Very low	27.4	Very low	145 Å²	145	135 Å²	135	63%	0.63	78%	0.776	S	S	*	*			cis	89.3	100.5	24.6	-173.5	168.6	172.4	157.6	0	116.9	E161	K159-E161 VanDerWaalsContact CE-OE1 3.23Å; K159-E161 WeakPolarHBondContact CE-OE1 3.42Å; K159-E161 WeakPolarHBondContact CE-OE2 3.16Å; K159-E161 IonicContact NZ-OE1 3.83Å; K159-E161 PolarHBondContact NZ-OE1 3.1Å; K159-E161 IonicContact NZ-OE2 3.97Å; K159-E161 PolarHBondContact NZ-OE2 3.22Å
160	A	27.9	Very low	28.1	Very low	88 Å²	88	133.8 Å²	133.8	73%	0.727	78%	0.777	S	S	*	*			trans	-173.7	126	137	0	0	0	0	0	106.1
161	E	23.3	Very low	28.9	Very low	132 Å²	132	132 Å²	132	62%	0.617	78%	0.775	S	S	*	*				58.9	92.1	56.9	-65.2	176.4	174.4	0	0	111.2	K159	K159-E161 VanDerWaalsContact CE-OE1 3.23Å; K159-E161 WeakPolarHBondContact CE-OE1 3.42Å; K159-E161 WeakPolarHBondContact CE-OE2 3.16Å; K159-E161 IonicContact NZ-OE1 3.83Å; K159-E161 PolarHBondContact NZ-OE1 3.1Å; K159-E161 IonicContact NZ-OE2 3.97Å; K159-E161 PolarHBondContact NZ-OE2 3.22Å
162	D	24.2	Very low	28.7	Very low	144 Å²	144	131.9 Å²	131.9	77%	0.77	77%	0.772	S	S	*	*				88.3	117.1	68.2	-81.5	-48.4	0	0	0	113.8
163	F	24.4	Very low	28.8	Very low	204 Å²	204	135 Å²	135	90%	0.895	78%	0.778	S	S	*	*				176.9	163.2	118.8	-112.3	-90.5	0	0	0	113.4
164	T	27.8	Very low	29	Very low	115 Å²	115	138.6 Å²	138.6	71%	0.706	77%	0.773	S	S	*	*			trans	-102.9	156.9	-178	55	0	0	0	0	113.6
165	P	33.9	Very low	30	Very low	122 Å²	122	141.1 Å²	141.1	79%	0.792	78%	0.777	S	S	*	*				-135.7	159.8	105.1	13.2	9.6	0	0	0	112.3
166	V	26.3	Very low	30.2	Very low	118 Å²	118	143.5 Å²	143.5	72%	0.715	78%	0.776	S	S	*	*			cis	110.8	125.7	25.6	167.1	0	0	0	0	113.4
167	F	27.6	Very low	30.3	Very low	200 Å²	200	140.1 Å²	140.1	88%	0.877	77%	0.768	S	S	*	*			trans	74.8	171.2	173.3	-85.3	-64.3	0	0	0	121.2
168	M	29.8	Very low	30.6	Very low	173 Å²	173	139.6 Å²	139.6	85%	0.852	76%	0.761	S	S	*	*			trans	-140.2	162.7	-143.6	-55	-178.1	75.4	0	0	116.7
169	A	25.7	Very low	30.8	Very low	96 Å²	96	136.2 Å²	136.2	79%	0.793	75%	0.754	S	S	*	*			trans	89.4	158.6	151.3	0	0	0	0	0	119.8
170	P	43.3	Very low	31.2	Very low	120 Å²	120	137.7 Å²	137.7	78%	0.779	76%	0.764	S	S	*	*			trans	-123.8	-140.8	-145.1	35.5	-11.1	0	0	0	112.1
171	P	44.4	Very low	31.5	Very low	105 Å²	105	138.2 Å²	138.2	68%	0.682	75%	0.751	S	S	*	*			cis	-145.5	-177.1	-6.1	37.2	-12.5	0	0	0	119.6
172	V	31.2	Very low	31.7	Very low	111 Å²	111	139.3 Å²	139.3	67%	0.673	76%	0.756	S	S	*	*			trans	63	147.9	160.4	-132.6	0	0	0	0	122
173	H	28.6	Very low	31.9	Very low	188 Å²	188	141.4 Å²	141.4	87%	0.87	75%	0.753	S	S	*	*				-170.1	165.4	119.9	-108	-76.5	0	0	0	114.6
174	Y	33.3	Very low	32	Very low	205 Å²	205	137.5 Å²	137.5	80%	0.804	75%	0.746	S	S	*	*			trans	-127.9	167.7	-176.9	-87.6	-85.8	0	0	0	112.2
175	P	46.5	Very low	31.9	Very low	119 Å²	119	137.9 Å²	137.9	77%	0.773	75%	0.748	S	S	*	*				-140.7	138.1	115.1	30.1	-12.6	0	0	0	114
176	R	30.6	Very low	31.8	Very low	214 Å²	214	138.2 Å²	138.2	81%	0.808	74%	0.742	S	S	*	*				74.2	135.3	84.1	-162.9	178.1	-174.4	-174.3	0.3	113.6	D178	R176-D178 IonicContact CZ-OD2 2.62Å; R176-D178 IonicContact NE-OD1 2.74Å; R176-D178 IonicContact NE-OD2 3.46Å; R176-D178 PolarHBondContact NE-OD2 3.47Å; R176-D178 IonicContact NH2-OD2 3.33Å; R176-D178 PolarHBondContact NH2-OD2 2.98Å
177	G	30	Very low	31.8	Very low	68 Å²	68	140.9 Å²	140.9	70%	0.701	74%	0.744	S	S	*	*			cis	158.2	-175.8	6.2	0	0	0	0	0	108.6
178	D	33.5	Very low	31.7	Very low	123 Å²	123	139 Å²	139	66%	0.658	74%	0.738	S	S	*	*			cis	-152.9	165.3	-8	-65.5	-42.1	0	0	0	105.4	R176	R176-D178 IonicContact CZ-OD2 2.62Å; R176-D178 IonicContact NE-OD1 2.74Å; R176-D178 IonicContact NE-OD2 3.46Å; R176-D178 PolarHBondContact NE-OD2 3.47Å; R176-D178 IonicContact NH2-OD2 3.33Å; R176-D178 PolarHBondContact NH2-OD2 2.98Å
179	G	30.6	Very low	31.4	Very low	70 Å²	70	138.4 Å²	138.4	72%	0.722	73%	0.733	S	S	*	*			cis	-136.6	-110.3	-6.2	0	0	0	0	0	110.3
180	E	31.7	Very low	31.3	Very low	176 Å²	176	138.7 Å²	138.7	82%	0.822	73%	0.725	S	S	*	*			cis	-153.9	157.7	-5.4	-76.4	-155.8	99.5	0	0	111.9
181	E	35.1	Very low	30.4	Very low	99 Å²	99	140.1 Å²	140.1	46%	0.463	72%	0.721	S	S	.	*			trans	25.1	132.6	148.5	-51.4	-72.4	112.3	0	0	122.6	R183	E181-R183 IonicContact OE1-CZ 3.18Å; E181-R183 IonicContact OE1-NH1 2.74Å; E181-R183 PolarHBondContact OE1-NH1 3.08Å; E181-R183 IonicContact OE1-NH2 2.7Å; E181-R183 PolarHBondContact OE1-NH2 3.46Å; E181-R183 IonicContact OE2-NH1 3.39Å; E181-R183 PolarHBondContact OE2-NH1 3.24Å
182	Q	27.5	Very low	29.6	Very low	156 Å²	156	143.6 Å²	143.6	73%	0.729	72%	0.722	S	S	*	*			cis	-145.8	120.2	5.4	-105.3	156.6	29.2	0	0	110.7
183	R	27.5	Very low	29.2	Very low	187 Å²	187	145.3 Å²	145.3	71%	0.706	73%	0.727	S	S	*	*				60.6	114	97.3	-62.3	-168.6	-173.5	110.9	16.3	115.5	E181	E181-R183 IonicContact OE1-CZ 3.18Å; E181-R183 IonicContact OE1-NH1 2.74Å; E181-R183 PolarHBondContact OE1-NH1 3.08Å; E181-R183 IonicContact OE1-NH2 2.7Å; E181-R183 PolarHBondContact OE1-NH2 3.46Å; E181-R183 IonicContact OE2-NH1 3.39Å; E181-R183 PolarHBondContact OE2-NH1 3.24Å
184	V	26.4	Very low	29.3	Very low	123 Å²	123	142 Å²	142	75%	0.745	72%	0.72	S	S	*	*			cis	79.7	130.3	48.7	-178.9	0	0	0	0	111.1
185	V	27.6	Very low	29.3	Very low	123 Å²	123	138 Å²	138	75%	0.745	72%	0.719	S	S	*	*				-135.2	176.3	51.2	-140.7	0	0	0	0	111.3
186	I	31.4	Very low	28.4	Very low	129 Å²	129	137 Å²	137	66%	0.662	72%	0.715	S	S	*	*			cis	65	137.7	23.8	3	175.9	0	0	0	115
187	F	25.5	Very low	28.4	Very low	173 Å²	173	134.6 Å²	134.6	76%	0.759	72%	0.718	S	S	*	*			cis	-111.8	-145.6	15.8	-104	-105.7	0	0	0	113.5
188	E	25	Very low	28.3	Very low	162 Å²	162	135.4 Å²	135.4	76%	0.757	72%	0.718	S	S	*	*			cis	-161.9	174.8	15.8	-165.6	46.6	-83	0	0	113.6
189	Q	23.4	Very low	28	Very low	159 Å²	159	134.8 Å²	134.8	74%	0.743	72%	0.719	S	S	*	*			trans	-115	160.9	-170.5	-169.1	-176.9	-27.1	0	0	116.3
190	T	24.7	Very low	28	Very low	103 Å²	103	140.2 Å²	140.2	63%	0.632	73%	0.725	S	S	*	*			trans	90.2	110.7	151	7.5	0	0	0	0	123.3
191	Q	24.8	Very low	27.8	Very low	149 Å²	149	137.3 Å²	137.3	70%	0.696	72%	0.724	S	S	*	*				91.2	138.7	123.1	-109.3	173.1	-8.6	0	0	125.8
192	Y	27.2	Very low	27.5	Very low	179 Å²	179	136.7 Å²	136.7	70%	0.702	74%	0.736	S	S	*	*			trans	92.2	134.1	150.9	-79.9	-67.3	0	0	0	125.1
193	D	23.6	Very low	27.6	Very low	146 Å²	146	139.3 Å²	139.3	78%	0.781	74%	0.74	S	S	*	*			trans	86.4	158.2	150.4	-68.8	-24.9	0	0	0	124.9
194	V	29	Very low	27.7	Very low	119 Å²	119	136.9 Å²	136.9	72%	0.721	74%	0.741	S	S	*	*			trans	-141.6	145.4	-143.7	177.9	0	0	0	0	112.2
195	P	33.3	Very low	28	Very low	121 Å²	121	138.4 Å²	138.4	79%	0.786	74%	0.737	S	S	*	*				-124.6	141.2	127.7	-1.6	23.6	0	0	0	110.8
196	S	28.8	Very low	28.1	Very low	98 Å²	98	138.2 Å²	138.2	69%	0.685	73%	0.732	S	S	*	*			cis	62.7	120.7	39.4	-160.2	0	0	0	0	112.2
197	L	30.7	Very low	28.1	Very low	164 Å²	164	137.9 Å²	137.9	86%	0.859	73%	0.732	S	S	*	*			cis	-133.9	-169.9	10.9	-148.5	64.2	0	0	0	107
198	A	28.1	Very low	28.5	Very low	85 Å²	85	135.8 Å²	135.8	70%	0.702	72%	0.724	S	S	*	*			cis	-159.1	-173.4	9.1	0	0	0	0	0	112.6
199	T	25.6	Very low	28.7	Very low	110 Å²	110	138.2 Å²	138.2	68%	0.675	73%	0.726	S	S	*	*			trans	-98.9	159.2	179.1	48.6	0	0	0	0	113.8
200	H	31.3	Very low	29.1	Very low	184 Å²	184	136 Å²	136	85%	0.852	73%	0.728	S	S	*	*				-171.8	170.2	113.8	-95.9	-59.3	0	0	0	112.5
201	S	27.6	Very low	29.9	Very low	115 Å²	115	137.5 Å²	137.5	80%	0.804	74%	0.738	S	S	*	*			trans	-123.7	174.9	-164.9	-47.6	0	0	0	0	112.6
202	A	28	Very low	30.8	Very low	86 Å²	86	136.4 Å²	136.4	71%	0.711	74%	0.744	S	S	*	*			trans	102.1	123.8	145.6	0	0	0	0	0	121.5
203	Y	30.4	Very low	30.8	Very low	211 Å²	211	135.2 Å²	135.2	83%	0.827	75%	0.75	S	S	*	*			trans	78.3	116.6	131.4	-82.7	-124.6	0	0	0	123.1
204	L	29.9	Very low	31.3	Very low	135 Å²	135	132.8 Å²	132.8	71%	0.707	74%	0.744	S	S	*	*				75.8	122.2	129.8	-69.2	-175.2	0	0	0	124.5
205	K	31.3	Very low	31.4	Very low	155 Å²	155	132.8 Å²	132.8	67%	0.674	74%	0.744	S	S	*	*				72.2	142.8	127.7	-91.2	-174.7	146.7	-71.7	0	123.2
206	D	29.9	Very low	31.1	Very low	120 Å²	120	137.5 Å²	137.5	64%	0.642	75%	0.748	S	S	*	*			trans	65.8	145	140	-64.4	5.2	0	0	0	118.4
207	D	32.1	Very low	31.3	Very low	121 Å²	121	136.1 Å²	136.1	65%	0.647	74%	0.738	S	S	*	*			cis	-157	172.7	-9.8	-153.3	-2.1	0	0	0	112.2
208	Q	33	Very low	31.2	Very low	130 Å²	130	136.7 Å²	136.7	61%	0.607	74%	0.737	S	S	*	*			trans	49.4	125.9	147.9	-81.7	176.4	84	0	0	123.6
209	R	30.9	Very low	31.3	Very low	212 Å²	212	136.4 Å²	136.4	80%	0.8	73%	0.729	S	S	*	*				48.6	128.4	129.1	-55.6	172.6	172.8	-156.2	-0.7	118.8
210	S	30.1	Very low	31.5	Very low	112 Å²	112	140.3 Å²	140.3	78%	0.783	74%	0.737	S	S	*	*				-175.7	158.5	71.5	-64.5	0	0	0	0	112.3
211	T	42.2	Very low	31.5	Very low	135 Å²	135	139.7 Å²	139.7	83%	0.828	73%	0.732	S	S	*	*			trans	-81.1	162.6	157	52.3	0	0	0	0	110.2
212	P	44.4	Very low	31.5	Very low	127 Å²	127	141.5 Å²	141.5	83%	0.825	73%	0.733	S	S	*	*				-142.7	172	97.6	38.7	-24.6	0	0	0	115.1
213	D	27.5	Very low	31.5	Very low	154 Å²	154	141.6 Å²	141.6	82%	0.824	73%	0.733	S	S	*	*			trans	-99.1	165.3	171.9	-175.7	12.8	0	0	0	110.2
214	S	33.4	Very low	31.4	Very low	94 Å²	94	136 Å²	136	66%	0.657	73%	0.731	S	S	*	*			trans	151.1	108.3	149.5	176.7	0	0	0	0	115.4
215	T	31.5	Very low	31.4	Very low	119 Å²	119	135.6 Å²	135.6	73%	0.73	73%	0.734	S	S	*	*				55.2	116.6	126.3	-34.8	0	0	0	0	121.7
216	Y	26.6	Very low	31.3	Very low	221 Å²	221	134.3 Å²	134.3	87%	0.867	73%	0.73	S	S	*	*			trans	-141.6	162.1	131.9	-164.9	-103.7	0	0	0	110
217	S	32.1	Very low	31.3	Very low	69 Å²	69	136.5 Å²	136.5	48%	0.483	73%	0.734	S	S	.	*			trans	-140.3	143.1	-156.9	55.3	0	0	0	0	114.2
218	E	29.3	Very low	31.1	Very low	176 Å²	176	140.3 Å²	140.3	82%	0.822	75%	0.746	S	S	*	*			trans	61.8	154.8	152.2	-67.8	-154	81.2	0	0	119.1
219	S	29.7	Very low	30.8	Very low	79 Å²	79	145.8 Å²	145.8	55%	0.552	76%	0.761	S	S	*	*			cis	-167.6	159.8	-16.7	-97.8	0	0	0	0	107.7
220	F	30	Very low	30.7	Very low	192 Å²	192	141.6 Å²	141.6	84%	0.842	76%	0.764	S	S	*	*			trans	167.2	139.4	133.7	-97.5	-60.4	0	0	0	116.4
221	K	31.4	Very low	30.5	Very low	171 Å²	171	140.7 Å²	140.7	74%	0.743	76%	0.763	S	S	*	*			trans	74.8	91.6	151.7	-67.2	174.1	-175.5	-179.8	0	120.4
222	D	27.7	Very low	30	Very low	153 Å²	153	139.8 Å²	139.8	82%	0.818	76%	0.763	S	S	*	*				24.4	147.4	103.7	-53.4	-54	0	0	0	120.3
223	A	27.5	Very low	29.3	Very low	87 Å²	87	141.2 Å²	141.2	72%	0.719	77%	0.769	S	S	*	*			cis	-172.9	170.7	-15.1	0	0	0	0	0	109.8
224	A	28.3	Very low	29.2	Very low	94 Å²	94	137 Å²	137	78%	0.777	76%	0.762	S	S	*	*			trans	67.4	134.6	-179.1	0	0	0	0	0	114.2
225	T	30.5	Very low	29.1	Very low	127 Å²	127	137.3 Å²	137.3	78%	0.779	77%	0.769	S	S	*	*			cis	-151.8	162.7	9	-7.7	0	0	0	0	106.6
226	E	29.2	Very low	29	Very low	127 Å²	127	140.4 Å²	140.4	59%	0.593	78%	0.776	S	S	*	*			cis	-143.1	176.4	30.8	-109.2	-73.8	43.2	0	0	113.3
227	K	30.8	Very low	29	Very low	167 Å²	167	137.5 Å²	137.5	73%	0.726	77%	0.77	S	S	*	*			trans	-36.9	129.7	171.7	-60.8	138.5	-166.7	153.1	0	116.6
228	F	26.3	Very low	28.9	Very low	201 Å²	201	145.8 Å²	145.8	88%	0.882	79%	0.793	S	S	*	*			trans	-113.1	138.7	146	-110.8	-94.6	0	0	0	110
229	R	28	Very low	29.2	Very low	244 Å²	244	143.4 Å²	143.4	92%	0.921	78%	0.783	S	S	*	*			trans	-136.2	127	166.8	-86.4	-170.2	173.3	-168.8	-1.4	108.8
230	S	28.1	Very low	29.1	Very low	124 Å²	124	150.8 Å²	150.8	87%	0.867	80%	0.8	S	S	*	*			trans	-91.3	128.1	179	-50.7	0	0	0	0	111.4
231	A	26.1	Very low	28.9	Very low	93 Å²	93	148 Å²	148	77%	0.769	79%	0.794	S	S	*	*			trans	-155.6	116.7	164.5	0	0	0	0	0	112.3
232	S	30.7	Very low	28.9	Very low	117 Å²	117	146.1 Å²	146.1	82%	0.818	79%	0.788	S	S	*	*			trans	10.6	107	155.7	58.9	0	0	0	0	121.3
233	V	29.6	Very low	29	Very low	157 Å²	157	145.1 Å²	145.1	95%	0.952	79%	0.788	S	S	*	*				-143.3	141.7	128.8	-169.8	0	0	0	0	103
234	G	25.5	Very low	29.5	Very low	66 Å²	66	146 Å²	146	68%	0.68	79%	0.789	S	S	*	*			cis	155.8	167.5	18.1	0	0	0	0	0	104.3
235	A	32.2	Very low	30.3	Very low	99 Å²	99	146.1 Å²	146.1	82%	0.818	78%	0.784	S	S	*	*			trans	-81.2	145.6	170.9	0	0	0	0	0	110
236	E	28.4	Very low	31.6	Very low	184 Å²	184	142.5 Å²	142.5	86%	0.86	77%	0.771	S	S	*	*			trans	169.8	165.2	139.3	-87.3	-72.5	95	0	0	109
237	E	28.5	Very low	34.1	Very low	160 Å²	160	139.1 Å²	139.1	75%	0.748	76%	0.76	S	S	*	*			trans	52	89.8	154.1	-157.3	162	-127.1	0	0	121.2
238	Y	28.7	Very low	37	Very low	244 Å²	244	131.6 Å²	131.6	96%	0.957	73%	0.727	S	S	*	*			trans	-133.3	72.6	137.2	-88	-74	0	0	0	109.8	Y240	Y238-Y240 PolarHBondContact O-N 3.07Å
239	M	35.6	Very low	40.3	Very low	126 Å²	126	125.6 Å²	125.6	62%	0.621	70%	0.701	S	S	*	*			trans	-80.5	105.5	167.5	-74.6	-153.2	75.7	0	0	110.2	Q242	M239-Q242 HydrophobicContact CE-CB 3.9Å; M239-Q242 HydrophobicContact CE-CG 4.35Å
240	Y	28.3	Very low	43.6	Very low	234 Å²	234	114 Å²	114	92%	0.918	66%	0.658	S	S	*	*			trans	-159.8	66.9	152.5	-131.3	-82	0	0	0	114.7	Y238	Y238-Y240 PolarHBondContact O-N 3.07Å
241	D	25.9	Very low	46.8	Very low	132 Å²	132	108.8 Å²	108.8	71%	0.706	62%	0.621	S	S	*	*				-170.2	97.3	124.6	-172.6	8.1	0	0	0	108.9	T243	D241-T243 PolarHBondContact OD1-OG1 2.67Å
242	Q	30.1	Very low	50.2	Low	133 Å²	133	104.4 Å²	104.4	62%	0.621	58%	0.584	S	S	*	*			trans	-139.9	56.1	-179.7	-169.5	149.4	87.8	0	0	111.1	M239 S244	M239-Q242 HydrophobicContact CE-CB 3.9Å; M239-Q242 HydrophobicContact CE-CG 4.35Å; Q242-S244 PolarHBondContact O-N 3.49Å
243	T	31	Very low	53.3	Low	132 Å²	132	102.3 Å²	102.3	81%	0.81	56%	0.562	S	S	*	*			trans	-87.8	26.7	175.6	51.8	0	0	0	0	113.5	D241	D241-T243 PolarHBondContact OD1-OG1 2.67Å
244	S	37.5	Very low	56.4	Low	106 Å²	106	95.1 Å²	95.1	74%	0.741	52%	0.519	S	S	*	.			trans	-140.6	52.7	176	51.7	0	0	0	0	112.4	Q242 G246	Q242-S244 PolarHBondContact O-N 3.49Å; S244-G246 PolarHBondContact O-N 3.4Å; S244-G246 VanDerWaalsContact O-N 3.08Å
245	S	45.6	Very low	59.4	Low	96 Å²	96	94.4 Å²	94.4	67%	0.671	50%	0.501	S	S	*	.			trans	-50.8	114.2	175.5	-46.6	0	0	0	0	111.1	T247	S245-T247 PolarHBondContact O-N 3.27Å
246	G	57.4	Low	62	Low	50 Å²	50	92.8 Å²	92.8	52%	0.515	48%	0.476	S	S	.	.			trans	-67.1	98	-172.3	0	0	0	0	0	112	S244	S244-G246 PolarHBondContact O-N 3.4Å; S244-G246 VanDerWaalsContact O-N 3.08Å
247	T	82.2	Confident	64.8	Low	57 Å²	57	84.3 Å²	84.3	35%	0.35	44%	0.436	S	S	.	.			trans	-65.5	-45.9	-179.8	48.8	0	0	0	0	111.7	S245 E282 T283	S245-T247 PolarHBondContact O-N 3.27Å; T247-E282 CarbonylContact O-C 3.3Å; T247-E282 WeakPolarHBondContact O-CA 3.44Å; T247-E282 WeakPolarHBondContact O-CG 3.42Å; T247-T283 PolarHBondContact O-N 3.13Å
248	F	92	Very high	67.4	Low	8 Å²	8	80.5 Å²	80.5	4%	0.035	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	136	-178.8	-66.8	-83.3	0	0	0	112.2	Y250 S281 E282 V296 W359 V361 T395 I406 H407	F248-Y250 HydrophobicContact CB-CE1 3.9Å; F248-S281 WeakPolarHBondContact CA-O 3.24Å; F248-E282 HydrophobicContact CD1-CB 4.29Å; F248-E282 HydrophobicContact CD1-CG 4.28Å; F248-E282 HydrophobicContact CE1-CB 4.24Å; F248-E282 HydrophobicContact CE1-CG 4.14Å; F248-E282 HydrophobicContact CZ-CG 4.37Å; F248-V296 HydrophobicContact CE1-CG1 4.41Å; F248-V296 HydrophobicContact CZ-CG1 4.18Å; F248-W359 AromaticContact CD1-CH2 3.95Å; F248-W359 HydrophobicContact CD1-CH2 3.95Å; F248-W359 HydrophobicContact CD1-CZ2 4.04Å; F248-W359 HydrophobicContact CE1-CH2 4.07Å; F248-W359 HydrophobicContact CE1-CZ2 4.12Å; F248-V361 HydrophobicContact CE1-CG1 3.91Å; F248-V361 HydrophobicContact CZ-CG1 4.38Å; F248-T395 HydrophobicContact CD1-CG2 4.37Å; F248-T395 HydrophobicContact CE1-CG2 4.06Å; F248-T395 HydrophobicContact CZ-CG2 4.16Å; F248-I406 HydrophobicContact CE2-CD1 3.71Å; F248-I406 HydrophobicContact CE2-CG1 4.21Å; F248-I406 HydrophobicContact CZ-CD1 3.86Å; F248-H407 HydrophobicContact CB-CB 4.28Å; F248-H407 WeakPolarHBondContact CB-CE1 3.37Å; F248-H407 WeakPolarHBondContact CB-ND1 3.15Å; F248-H407 HydrophobicContact CD2-CB 3.63Å; F248-H407 HydrophobicContact CE2-CB 4.39Å; F248-H407 HydrophobicContact CG-CB 4.26Å; F248-H407 AromaticContact CG-CE1 3.93Å; F248-H407 PolarHBondContact O-NE2 3.01Å
249	Q	94.6	Very high	69.6	Low	75 Å²	75	74.7 Å²	74.7	35%	0.35	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	132.6	176.7	-179.1	179.4	-108.3	0	0	110.1	S281 T283 Y467	Q249-S281 PolarHBondContact N-O 3Å; Q249-S281 PolarHBondContact O-N 3.24Å; Q249-S281 PolarHBondContact O-OG 3.07Å; Q249-S281 VanDerWaalsContact O-OG 3.07Å; Q249-T283 WeakPolarHBondContact CB-OG1 3.42Å; Q249-Y467 HydrophobicContact CG-CD1 4.03Å; Q249-Y467 HydrophobicContact CG-CE1 4.28Å
250	Y	96.8	Very high	71.1	Confident	2 Å²	2	76 Å²	76	1%	0.008	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	148.7	174.6	-30	-56	0	0	0	111.1	F248 T279 L280 I393 T395 H407 A409 F468	F248-Y250 HydrophobicContact CB-CE1 3.9Å; Y250-T279 CarbonylContact C-O 3.51Å; Y250-T279 VanDerWaalsContact CA-O 3.23Å; Y250-T279 WeakPolarHBondContact CA-O 3.48Å; Y250-L280 HydrophobicContact CD1-CB 3.82Å; Y250-L280 HydrophobicContact CD1-CD2 3.89Å; Y250-L280 HydrophobicContact CD1-CG 3.8Å; Y250-L280 HydrophobicContact CE1-CB 4.36Å; Y250-L280 HydrophobicContact CE1-CD2 4.04Å; Y250-L280 HydrophobicContact CE1-CG 4.42Å; Y250-L280 HydrophobicContact CG-CG 4.44Å; Y250-I393 HydrophobicContact CD2-CB 3.72Å; Y250-I393 HydrophobicContact CD2-CD1 3.85Å; Y250-I393 HydrophobicContact CD2-CG1 4.23Å; Y250-I393 HydrophobicContact CD2-CG2 3.88Å; Y250-I393 HydrophobicContact CE1-CG2 4.27Å; Y250-I393 HydrophobicContact CE2-CB 3.62Å; Y250-I393 HydrophobicContact CE2-CG2 3.58Å; Y250-I393 HydrophobicContact CG-CD1 3.96Å; Y250-I393 HydrophobicContact CG-CG2 4.34Å; Y250-T395 WeakPolarHBondContact OH-CB 3.32Å; Y250-T395 PolarHBondContact OH-OG1 3.12Å; Y250-H407 AromaticContact CE1-CE1 3.47Å; Y250-H407 VanDerWaalsContact CE1-CE1 3.47Å; Y250-H407 WeakPolarHBondContact CE1-CE1 3.1Å; Y250-H407 AromaticContact CE2-CE1 2.96Å; Y250-H407 WeakPolarHBondContact CE2-CE1 3.41Å; Y250-H407 AromaticContact CE2-ND1 3.66Å; Y250-H407 AromaticContact CE2-NE2 3.56Å; Y250-H407 AromaticContact CZ-CE1 2.5Å; Y250-H407 AromaticContact CZ-ND1 3.43Å; Y250-H407 AromaticContact CZ-NE2 3.86Å; Y250-H407 PolarHBondContact OH-CE1 3.21Å; Y250-H407 PolarHBondContact OH-ND1 2.97Å; Y250-A409 HydrophobicContact CD2-CB 3.8Å; Y250-A409 HydrophobicContact CE2-CB 3.73Å; Y250-F468 HydrophobicContact CD2-CB 4.27Å; Y250-F468 HydrophobicContact CD2-CG 4.39Å; Y250-F468 WeakPolarHBondContact O-CD2 3.44Å; Y250-F468 PolarHBondContact O-N 3.3Å
251	T	97	Very high	73	Confident	14 Å²	14	71.3 Å²	71.3	9%	0.086	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	150.8	-179	48.2	0	0	0	0	111.5	I278 T279 I465 T466 Y467	T251-I278 WeakPolarHBondContact O-CA 3.34Å; T251-I278 WeakPolarHBondContact O-CG2 3.4Å; T251-T279 PolarHBondContact N-O 2.73Å; T251-T279 PolarHBondContact O-N 3.24Å; T251-T279 VanDerWaalsContact OG1-CB 3.32Å; T251-T279 WeakPolarHBondContact OG1-CB 3.5Å; T251-T279 WeakPolarHBondContact OG1-CG2 3.46Å; T251-I465 HydrophobicContact CG2-CG2 3.54Å; T251-T466 CarbonylContact C-O 3.59Å; T251-T466 WeakPolarHBondContact CA-O 3.31Å; T251-Y467 HydrophobicContact CG2-CD1 3.45Å; T251-Y467 VanDerWaalsContact CG2-CD1 3.45Å; T251-Y467 HydrophobicContact CG2-CD2 4.43Å; T251-Y467 HydrophobicContact CG2-CE1 3.51Å; T251-Y467 HydrophobicContact CG2-CE2 4.47Å; T251-Y467 HydrophobicContact CG2-CG 3.94Å
252	L	97.5	Very high	74.8	Confident	0 Å²	0	74.5 Å²	74.5	0%	0	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	121.5	175.4	170.3	62.5	0	0	0	109.1	A254 T268 L270 I278 I391 I413 T466 F468	L252-A254 HydrophobicContact CD1-CB 4.41Å; L252-A254 HydrophobicContact CG-CB 4.12Å; L252-A254 PolarHBondContact O-N 3.4Å; L252-A254 VanDerWaalsContact O-N 3.15Å; L252-T268 HydrophobicContact CD2-CG2 3.85Å; L252-T268 HydrophobicContact CG-CG2 4.42Å; L252-L270 HydrophobicContact CD2-CD2 4.38Å; L252-I278 HydrophobicContact CB-CG1 4.37Å; L252-I278 HydrophobicContact CD1-CD1 4.35Å; L252-I278 HydrophobicContact CD1-CG1 3.78Å; L252-I391 HydrophobicContact CD2-CD1 4.08Å; L252-I413 HydrophobicContact CD2-CG2 4.43Å; L252-T466 PolarHBondContact N-O 3.38Å; L252-T466 PolarHBondContact O-N 2.94Å; L252-F468 HydrophobicContact CB-CE2 3.77Å; L252-F468 HydrophobicContact CB-CZ 4.37Å
253	E	96	Very high	76.6	Confident	74 Å²	74	71.5 Å²	71.5	35%	0.346	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	81.9	177.6	-63.1	-155	116.9	0	0	111.1	A277 S463 I465	E253-A277 HydrophobicContact CB-CB 4.16Å; E253-A277 HydrophobicContact CG-CB 4.11Å; E253-A277 PolarHBondContact N-O 2.85Å; E253-S463 WeakPolarHBondContact OE1-CB 3.24Å; E253-S463 PolarHBondContact OE1-OG 3.41Å; E253-I465 HydrophobicContact CG-CG1 4.49Å
254	A	94.1	Very high	78.7	Confident	6 Å²	6	69.1 Å²	69.1	5%	0.05	38%	0.381	C	S	.	.	S	Bend	trans	-158.4	147.4	178.7	0	0	0	0	0	112.3	L252 K256 T268 L270 Y276 D464	L252-A254 HydrophobicContact CD1-CB 4.41Å; L252-A254 HydrophobicContact CG-CB 4.12Å; L252-A254 PolarHBondContact O-N 3.4Å; L252-A254 VanDerWaalsContact O-N 3.15Å; A254-K256 PolarHBondContact O-N 3.06Å; A254-K256 VanDerWaalsContact O-N 3.15Å; A254-T268 HydrophobicContact CB-CG2 3.51Å; A254-T268 WeakPolarHBondContact O-CG2 3.43Å; A254-L270 HydrophobicContact CB-CD2 3.47Å; A254-L270 VanDerWaalsContact CB-CD2 3.47Å; A254-Y276 HydrophobicContact CB-CD1 3.53Å; A254-Y276 HydrophobicContact CB-CE1 3.8Å; A254-Y276 HydrophobicContact CB-CG 4.28Å; A254-D464 CarbonylContact C-O 3.53Å; A254-D464 PolarHBondContact N-O 3.18Å
255	T	87.4	Confident	80.8	Confident	50 Å²	50	64.6 Å²	64.6	31%	0.307	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-59.7	119.4	-171.8	-53.6	0	0	0	0	113.2	Y269 I425 D464	T255-Y269 PolarHBondContact O-N 3.44Å; T255-Y269 VanDerWaalsContact O-N 3.14Å; T255-I425 HydrophobicContact CG2-CB 4.41Å; T255-I425 HydrophobicContact CG2-CD1 3.68Å; T255-I425 HydrophobicContact CG2-CG1 3.58Å; T255-I425 HydrophobicContact CG2-CG2 4.15Å; T255-D464 WeakPolarHBondContact CA-OD2 3.34Å; T255-D464 WeakPolarHBondContact CB-OD2 3.46Å; T255-D464 VanDerWaalsContact CG2-OD2 3.28Å; T255-D464 WeakPolarHBondContact CG2-OD2 3.22Å; T255-D464 PolarHBondContact OG1-OD2 2.57Å
256	K	88.6	Confident	82.8	Confident	66 Å²	66	61 Å²	61	29%	0.287	33%	0.325	S	S	.	.	B	Isolated β-bridge	trans	-78.7	146	-174.4	-165.2	173.3	-176.4	173.5	0	111.7	A254 L258 I425 T466	A254-K256 PolarHBondContact O-N 3.06Å; A254-K256 VanDerWaalsContact O-N 3.15Å; K256-L258 PolarHBondContact O-N 3.37Å; K256-I425 VanDerWaalsContact O-CD1 3.3Å; K256-I425 WeakPolarHBondContact O-CD1 3.47Å; K256-T466 HydrophobicContact CD-CG2 4.28Å
257	S	86.4	Confident	84.4	Confident	5 Å²	5	60.6 Å²	60.6	4%	0.035	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-59.9	125.6	172.2	175.4	0	0	0	0	111.7	R259 M267 Y269	S257-R259 WeakPolarHBondContact CB-O 3.45Å; S257-R259 PolarHBondContact O-N 2.86Å; S257-R259 PolarHBondContact OG-N 3.36Å; S257-R259 VanDerWaalsContact OG-N 3.15Å; S257-R259 PolarHBondContact OG-O 3.15Å; S257-M267 WeakPolarHBondContact CB-O 3.4Å; S257-M267 PolarHBondContact N-O 3.36Å; S257-Y269 PolarHBondContact OG-OH 3.5Å
258	L	82.8	Confident	85.1	Confident	81 Å²	81	57.9 Å²	57.9	42%	0.424	29%	0.294	S	S	.	.	S	Bend	trans	-67.5	-14.2	169.4	-67.8	175	0	0	0	112.5	K256 E428 E429	K256-L258 PolarHBondContact O-N 3.37Å; L258-E428 HydrophobicContact CB-CB 4.31Å; L258-E428 HydrophobicContact CD1-CB 4.18Å; L258-E429 HydrophobicContact CD1-CB 4.39Å; L258-E429 HydrophobicContact CD1-CG 3.56Å
259	R	74.9	Confident	85.3	Confident	122 Å²	122	58.1 Å²	58.1	46%	0.46	30%	0.295	S	S	.	.			trans	-90.5	112	164.7	-70.6	172.8	-160.2	-56.4	-30.2	110.3	S257 E428	S257-R259 WeakPolarHBondContact CB-O 3.45Å; S257-R259 PolarHBondContact O-N 2.86Å; S257-R259 PolarHBondContact OG-N 3.36Å; S257-R259 VanDerWaalsContact OG-N 3.15Å; S257-R259 PolarHBondContact OG-O 3.15Å; R259-E428 WeakPolarHBondContact CD-OE1 3Å; R259-E428 WeakPolarHBondContact CD-OE2 3.38Å; R259-E428 VanDerWaalsContact CG-OE2 3.25Å; R259-E428 WeakPolarHBondContact CG-OE2 3.32Å; R259-E428 IonicContact CZ-OE1 2.77Å; R259-E428 VanDerWaalsContact NE-CD 3.35Å; R259-E428 IonicContact NE-OE1 3.17Å; R259-E428 PolarHBondContact NE-OE1 2.93Å; R259-E428 IonicContact NE-OE2 3.01Å; R259-E428 PolarHBondContact NE-OE2 3.33Å; R259-E428 IonicContact NH2-OE1 2.69Å; R259-E428 PolarHBondContact NH2-OE1 3.41Å
260	Q	66.4	Low	85.4	Confident	153 Å²	153	54.7 Å²	54.7	72%	0.715	28%	0.279	S	S	*	.	P	Polyproline II helix	trans	-99.1	130.5	153.8	-61.5	175.1	17.4	0	0	106.9
261	K	68.9	Low	85.4	Confident	135 Å²	135	54.6 Å²	54.6	59%	0.587	28%	0.279	S	S	*	.	P	Polyproline II helix	trans	-92.6	150.7	159.9	-56.7	-157.9	-155.9	83.5	0	107.7	E264	K261-E264 HydrophobicContact CB-CB 4.32Å; K261-E264 HydrophobicContact CB-CG 4.29Å; K261-E264 WeakPolarHBondContact CD-OE2 3.5Å; K261-E264 VanDerWaalsContact CG-OE2 3.32Å; K261-E264 WeakPolarHBondContact CG-OE2 3.41Å; K261-E264 IonicContact NZ-OE1 2.71Å; K261-E264 PolarHBondContact NZ-OE1 3.35Å; K261-E264 IonicContact NZ-OE2 3.53Å; K261-E264 PolarHBondContact NZ-OE2 2.79Å
262	Q	62.9	Low	85.5	Confident	200 Å²	200	57.7 Å²	57.7	94%	0.935	29%	0.291	S	S	*	.	S	Bend	trans	-64	150	164.8	-74.7	172.8	-38.8	0	0	109.8	E264	Q262-E264 PolarHBondContact O-N 2.96Å; Q262-E264 VanDerWaalsContact O-N 3.07Å
263	G	67.9	Low	85.3	Confident	70 Å²	70	59.9 Å²	59.9	72%	0.722	31%	0.313	S	S	*	.	S	Bend	trans	81.3	-49.5	-177.6	0	0	0	0	0	115	K469	G263-K469 PolarHBondContact O-NZ 3.3Å
264	E	76.1	Confident	85.4	Confident	82 Å²	82	59.2 Å²	59.2	38%	0.383	31%	0.31	S	S	.	.	S	Bend	trans	-61.9	164.2	-176.8	-72.2	-179.9	176.5	0	0	114	K261 Q262 K469	K261-E264 HydrophobicContact CB-CB 4.32Å; K261-E264 HydrophobicContact CB-CG 4.29Å; K261-E264 WeakPolarHBondContact CD-OE2 3.5Å; K261-E264 VanDerWaalsContact CG-OE2 3.32Å; K261-E264 WeakPolarHBondContact CG-OE2 3.41Å; K261-E264 IonicContact NZ-OE1 2.71Å; K261-E264 PolarHBondContact NZ-OE1 3.35Å; K261-E264 IonicContact NZ-OE2 3.53Å; K261-E264 PolarHBondContact NZ-OE2 2.79Å; Q262-E264 PolarHBondContact O-N 2.96Å; Q262-E264 VanDerWaalsContact O-N 3.07Å; E264-K469 PolarHBondContact O-NZ 3.07Å
265	G	80.3	Confident	85.5	Confident	11 Å²	11	62.5 Å²	62.5	11%	0.113	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-75	171.7	174.7	0	0	0	0	0	113.1	M267	G265-M267 PolarHBondContact O-N 3.34Å
266	P	87.6	Confident	86	Confident	19 Å²	19	61.1 Å²	61.1	12%	0.123	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-62.7	128.9	169.1	27.4	-32.2	0	0	0	109.3	Q412 T466 Y467 K469	P266-Q412 WeakPolarHBondContact O-CA 3.31Å; P266-Q412 WeakPolarHBondContact O-CB 3.29Å; P266-Q412 PolarHBondContact O-N 3.1Å; P266-T466 HydrophobicContact CB-CG2 3.67Å; P266-T466 HydrophobicContact CG-CG2 4.33Å; P266-Y467 WeakPolarHBondContact CG-O 3.2Å; P266-K469 HydrophobicContact CG-CB 4.28Å
267	M	92.9	Very high	86.4	Confident	42 Å²	42	58.2 Å²	58.2	21%	0.207	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	127.4	-176.8	172.8	62.4	65.9	0	0	110.8	S257 G265 Y269 Q412 K414	S257-M267 WeakPolarHBondContact CB-O 3.4Å; S257-M267 PolarHBondContact N-O 3.36Å; G265-M267 PolarHBondContact O-N 3.34Å; M267-Y269 HydrophobicContact CG-CD1 4.4Å; M267-Y269 HydrophobicContact CG-CE1 3.74Å; M267-Y269 HydrophobicContact SD-CD1 4.44Å; M267-Y269 HydrophobicContact SD-CE1 4.08Å; M267-Q412 WeakPolarHBondContact CA-O 3.47Å; M267-Q412 HydrophobicContact CE-CB 3.6Å; M267-Q412 HydrophobicContact SD-CB 4.24Å; M267-K414 HydrophobicContact SD-CB 4.22Å
268	T	95.4	Very high	86.9	Confident	0 Å²	0	58 Å²	58	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	144.4	-174.3	-56.5	0	0	0	0	111.2	L252 A254 L270 C411 Q412 I413 K414 T466	L252-T268 HydrophobicContact CD2-CG2 3.85Å; L252-T268 HydrophobicContact CG-CG2 4.42Å; A254-T268 HydrophobicContact CB-CG2 3.51Å; A254-T268 WeakPolarHBondContact O-CG2 3.43Å; T268-L270 HydrophobicContact CG2-CD2 4.07Å; T268-C411 PolarHBondContact OG1-SG 3.28Å; T268-Q412 PolarHBondContact N-O 2.75Å; T268-I413 WeakPolarHBondContact O-CA 3.41Å; T268-K414 PolarHBondContact O-N 3.14Å; T268-T466 WeakPolarHBondContact OG1-CG2 3.37Å; T268-T466 PolarHBondContact OG1-OG1 3.26Å
269	Y	96	Very high	87.6	Confident	13 Å²	13	54.8 Å²	54.8	5%	0.051	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	121.9	-176.8	-60.5	-22.9	0	0	0	111.3	T255 S257 M267 K414 F416 K424 I425	T255-Y269 PolarHBondContact O-N 3.44Å; T255-Y269 VanDerWaalsContact O-N 3.14Å; S257-Y269 PolarHBondContact OG-OH 3.5Å; M267-Y269 HydrophobicContact CG-CD1 4.4Å; M267-Y269 HydrophobicContact CG-CE1 3.74Å; M267-Y269 HydrophobicContact SD-CD1 4.44Å; M267-Y269 HydrophobicContact SD-CE1 4.08Å; Y269-K414 WeakPolarHBondContact CA-O 3.32Å; Y269-K414 HydrophobicContact CD1-CB 3.89Å; Y269-K414 HydrophobicContact CE1-CB 4.17Å; Y269-F416 AromaticContact CD1-CE2 3.96Å; Y269-F416 HydrophobicContact CD1-CE2 3.96Å; Y269-F416 HydrophobicContact CD1-CZ 4.49Å; Y269-F416 HydrophobicContact CD2-CE2 4.5Å; Y269-F416 AromaticContact CG-CE2 3.86Å; Y269-F416 HydrophobicContact CG-CE2 3.86Å; Y269-K424 HydrophobicContact CD2-CB 4.19Å; Y269-K424 HydrophobicContact CD2-CG 3.52Å; Y269-K424 HydrophobicContact CE2-CB 4.38Å; Y269-K424 HydrophobicContact CE2-CD 4.24Å; Y269-K424 HydrophobicContact CE2-CG 3.29Å; Y269-K424 HydrophobicContact CG-CG 4.33Å; Y269-K424 WeakPolarHBondContact OH-CE 3.26Å; Y269-I425 HydrophobicContact CD2-CD1 3.48Å; Y269-I425 VanDerWaalsContact CD2-CD1 3.48Å; Y269-I425 HydrophobicContact CD2-CG1 3.91Å; Y269-I425 HydrophobicContact CE2-CD1 3.78Å; Y269-I425 HydrophobicContact CE2-CG1 4.5Å
270	L	97.5	Very high	88.7	Confident	3 Å²	3	49 Å²	49	2%	0.016	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	153.9	-176	-53.8	-176.7	0	0	0	110.8	L252 A254 T268 Y276 V371 I391 I413 K414 V415 F416	L252-L270 HydrophobicContact CD2-CD2 4.38Å; A254-L270 HydrophobicContact CB-CD2 3.47Å; A254-L270 VanDerWaalsContact CB-CD2 3.47Å; T268-L270 HydrophobicContact CG2-CD2 4.07Å; L270-Y276 HydrophobicContact CB-CD2 4.44Å; L270-Y276 HydrophobicContact CB-CE2 3.84Å; L270-Y276 HydrophobicContact CD2-CD1 4.08Å; L270-Y276 HydrophobicContact CD2-CD2 3.8Å; L270-Y276 HydrophobicContact CD2-CE1 4.06Å; L270-Y276 HydrophobicContact CD2-CE2 3.8Å; L270-Y276 HydrophobicContact CD2-CG 3.93Å; L270-Y276 HydrophobicContact CG-CD2 4.5Å; L270-Y276 HydrophobicContact CG-CE2 4.32Å; L270-V371 HydrophobicContact CD1-CG2 4.1Å; L270-I391 HydrophobicContact CD1-CD1 4.14Å; L270-I413 HydrophobicContact CD1-CB 4.18Å; L270-I413 HydrophobicContact CD1-CD1 4.13Å; L270-I413 HydrophobicContact CD1-CG2 3.83Å; L270-I413 HydrophobicContact CG-CG2 4.28Å; L270-K414 PolarHBondContact N-O 2.87Å; L270-V415 HydrophobicContact CB-CG2 4.43Å; L270-V415 CarbonylContact O-C 3.53Å; L270-V415 WeakPolarHBondContact O-CA 2.96Å; L270-F416 PolarHBondContact O-N 3.17Å
271	N	97.8	Very high	90	Very high	1 Å²	1	42.8 Å²	42.8	1%	0.005	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	137.6	170.6	-62.8	-46.3	0	0	0	110.1	G273 Q274 Y276 F416 D418 G420 A421 E422	N271-G273 PolarHBondContact O-N 2.82Å; N271-Q274 HydrophobicContact CB-CB 4.03Å; N271-Q274 PolarHBondContact ND2-OE1 3.25Å; N271-Q274 VanDerWaalsContact ND2-OE1 3.08Å; N271-Q274 WeakPolarHBondContact O-CB 3.44Å; N271-Q274 PolarHBondContact O-N 2.74Å; N271-Y276 PolarHBondContact N-OH 3.16Å; N271-F416 CarbonylContact C-O 3.45Å; N271-F416 WeakPolarHBondContact CA-O 3.34Å; N271-D418 WeakPolarHBondContact CB-O 3.29Å; N271-D418 PolarHBondContact OD1-O 2.88Å; N271-G420 PolarHBondContact OD1-N 3.16Å; N271-A421 WeakPolarHBondContact OD1-CB 3.35Å; N271-A421 PolarHBondContact OD1-N 2.81Å; N271-E422 PolarHBondContact ND2-OE1 2.97Å; N271-E422 PolarHBondContact ND2-OE2 2.82Å
272	K	97.4	Very high	91	Very high	79 Å²	79	37.4 Å²	37.4	34%	0.343	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	129	178.1	-173.9	-162.7	-175.2	-53.9	0	110.8	Q274 V371 N372 L374 V415 F416	K272-Q274 PolarHBondContact O-N 3.3Å; K272-V371 WeakPolarHBondContact CA-O 3.39Å; K272-N372 WeakPolarHBondContact CE-O 3.44Å; K272-N372 PolarHBondContact NZ-O 3.12Å; K272-L374 HydrophobicContact CB-CD2 3.77Å; K272-L374 HydrophobicContact CD-CD2 4.09Å; K272-L374 HydrophobicContact CD-CG 4.36Å; K272-L374 HydrophobicContact CG-CD2 4.33Å; K272-V415 HydrophobicContact CB-CG1 4.26Å; K272-F416 PolarHBondContact N-O 3.28Å
273	G	94.3	Very high	91.7	Very high	46 Å²	46	31.2 Å²	31.2	47%	0.474	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.6	2.9	179	0	0	0	0	0	114.6	N271 T370	N271-G273 PolarHBondContact O-N 2.82Å; G273-T370 WeakPolarHBondContact CA-OG1 3.48Å; G273-T370 PolarHBondContact N-OG1 3.41Å
274	Q	97.3	Very high	91.6	Very high	59 Å²	59	28.8 Å²	28.8	28%	0.276	16%	0.163	S	C	.	.			trans	-93.1	131.5	171.8	-176.5	177.1	-36.1	0	0	109.2	N271 K272 Y276	N271-Q274 HydrophobicContact CB-CB 4.03Å; N271-Q274 PolarHBondContact ND2-OE1 3.25Å; N271-Q274 VanDerWaalsContact ND2-OE1 3.08Å; N271-Q274 WeakPolarHBondContact O-CB 3.44Å; N271-Q274 PolarHBondContact O-N 2.74Å; K272-Q274 PolarHBondContact O-N 3.3Å; Q274-Y276 HydrophobicContact CB-CE2 3.81Å; Q274-Y276 VanDerWaalsContact CD-OH 3.31Å; Q274-Y276 HydrophobicContact CG-CE1 4.43Å; Q274-Y276 HydrophobicContact CG-CE2 3.94Å; Q274-Y276 PolarHBondContact NE2-OH 3.07Å; Q274-Y276 WeakPolarHBondContact O-CD2 3.41Å; Q274-Y276 VanDerWaalsContact O-CE2 3.26Å; Q274-Y276 WeakPolarHBondContact O-CE2 3.46Å; Q274-Y276 PolarHBondContact OE1-OH 3.32Å
275	F	97.4	Very high	90.7	Very high	76 Å²	76	32.6 Å²	32.6	33%	0.333	19%	0.186	S	C	.	.			trans	-76.8	140.7	173.1	-72.7	-77.4	0	0	0	111.9	A335 I369 T370	F275-A335 HydrophobicContact CD1-CB 3.72Å; F275-A335 HydrophobicContact CE1-CB 3.59Å; F275-A335 HydrophobicContact CE2-CB 4.49Å; F275-A335 HydrophobicContact CG-CB 4.25Å; F275-A335 HydrophobicContact CZ-CB 4Å; F275-I369 CarbonylContact C-O 3.55Å; F275-I369 VanDerWaalsContact CA-O 3.3Å; F275-I369 WeakPolarHBondContact CA-O 3.26Å; F275-T370 HydrophobicContact CD1-CG2 4.1Å; F275-T370 HydrophobicContact CE1-CG2 3.55Å; F275-T370 HydrophobicContact CE2-CG2 4.47Å; F275-T370 HydrophobicContact CZ-CG2 3.77Å
276	Y	97.5	Very high	89.4	Confident	20 Å²	20	38 Å²	38	8%	0.078	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	138.4	176.9	-63.8	-83.8	0	0	0	109.7	A254 L270 N271 Q274 F368 I369	A254-Y276 HydrophobicContact CB-CD1 3.53Å; A254-Y276 HydrophobicContact CB-CE1 3.8Å; A254-Y276 HydrophobicContact CB-CG 4.28Å; L270-Y276 HydrophobicContact CB-CD2 4.44Å; L270-Y276 HydrophobicContact CB-CE2 3.84Å; L270-Y276 HydrophobicContact CD2-CD1 4.08Å; L270-Y276 HydrophobicContact CD2-CD2 3.8Å; L270-Y276 HydrophobicContact CD2-CE1 4.06Å; L270-Y276 HydrophobicContact CD2-CE2 3.8Å; L270-Y276 HydrophobicContact CD2-CG 3.93Å; L270-Y276 HydrophobicContact CG-CD2 4.5Å; L270-Y276 HydrophobicContact CG-CE2 4.32Å; N271-Y276 PolarHBondContact N-OH 3.16Å; Q274-Y276 HydrophobicContact CB-CE2 3.81Å; Q274-Y276 VanDerWaalsContact CD-OH 3.31Å; Q274-Y276 HydrophobicContact CG-CE1 4.43Å; Q274-Y276 HydrophobicContact CG-CE2 3.94Å; Q274-Y276 PolarHBondContact NE2-OH 3.07Å; Q274-Y276 WeakPolarHBondContact O-CD2 3.41Å; Q274-Y276 VanDerWaalsContact O-CE2 3.26Å; Q274-Y276 WeakPolarHBondContact O-CE2 3.46Å; Q274-Y276 PolarHBondContact OE1-OH 3.32Å; Y276-F368 WeakPolarHBondContact O-CA 3.11Å; Y276-I369 PolarHBondContact N-O 2.92Å; Y276-I369 PolarHBondContact O-N 3.09Å
277	A	96.8	Very high	87.9	Confident	5 Å²	5	42.3 Å²	42.3	4%	0.041	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	137.2	178.3	0	0	0	0	0	111	E253 I367 F368	E253-A277 HydrophobicContact CB-CB 4.16Å; E253-A277 HydrophobicContact CG-CB 4.11Å; E253-A277 PolarHBondContact N-O 2.85Å; A277-I367 CarbonylContact C-O 3.56Å; A277-I367 WeakPolarHBondContact CA-O 3.48Å; A277-F368 HydrophobicContact CB-CD1 3.92Å; A277-F368 HydrophobicContact CB-CE1 3.8Å; A277-F368 HydrophobicContact CB-CZ 4.35Å
278	I	97.7	Very high	85.5	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	129.3	162.5	-68.8	176.5	0	0	0	108	T251 L252 L280 V300 I367 I369 I391 I393 F468	T251-I278 WeakPolarHBondContact O-CA 3.34Å; T251-I278 WeakPolarHBondContact O-CG2 3.4Å; L252-I278 HydrophobicContact CB-CG1 4.37Å; L252-I278 HydrophobicContact CD1-CD1 4.35Å; L252-I278 HydrophobicContact CD1-CG1 3.78Å; I278-L280 HydrophobicContact CG2-CD1 3.9Å; I278-L280 HydrophobicContact CG2-CG 4.39Å; I278-V300 HydrophobicContact CD1-CG1 4.24Å; I278-I367 HydrophobicContact CB-CD1 4.2Å; I278-I367 HydrophobicContact CB-CG1 3.74Å; I278-I367 HydrophobicContact CG2-CD1 4.44Å; I278-I367 HydrophobicContact CG2-CG1 4.29Å; I278-I367 PolarHBondContact N-O 2.85Å; I278-I367 PolarHBondContact O-N 2.87Å; I278-I369 HydrophobicContact CD1-CD1 3.5Å; I278-I369 HydrophobicContact CD1-CG1 3.84Å; I278-I369 HydrophobicContact CG1-CD1 4.43Å; I278-I369 HydrophobicContact CG1-CG1 4.31Å; I278-I391 HydrophobicContact CD1-CG2 4.3Å; I278-I393 HydrophobicContact CG2-CD1 3.87Å; I278-F468 HydrophobicContact CD1-CZ 4Å; I278-F468 HydrophobicContact CG2-CE2 4.49Å
279	T	96.8	Very high	83	Confident	14 Å²	14	54 Å²	54	9%	0.086	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	140.6	173.7	-90.6	0	0	0	0	109.1	Y250 T251 E364 A365	Y250-T279 CarbonylContact C-O 3.51Å; Y250-T279 VanDerWaalsContact CA-O 3.23Å; Y250-T279 WeakPolarHBondContact CA-O 3.48Å; T251-T279 PolarHBondContact N-O 2.73Å; T251-T279 PolarHBondContact O-N 3.24Å; T251-T279 VanDerWaalsContact OG1-CB 3.32Å; T251-T279 WeakPolarHBondContact OG1-CB 3.5Å; T251-T279 WeakPolarHBondContact OG1-CG2 3.46Å; T279-E364 WeakPolarHBondContact CB-OE1 3.3Å; T279-E364 VanDerWaalsContact CG2-CD 3.43Å; T279-E364 HydrophobicContact CG2-CG 3.57Å; T279-E364 WeakPolarHBondContact CG2-OE1 3.39Å; T279-E364 PolarHBondContact OG1-OE1 2.88Å; T279-A365 CarbonylContact C-O 3.53Å; T279-A365 WeakPolarHBondContact CA-O 3.45Å
280	L	96.8	Very high	81.1	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	139.3	175.1	-53.2	85.9	0	0	0	109.7	Y250 I278 F357 W359 A365 I393	Y250-L280 HydrophobicContact CD1-CB 3.82Å; Y250-L280 HydrophobicContact CD1-CD2 3.89Å; Y250-L280 HydrophobicContact CD1-CG 3.8Å; Y250-L280 HydrophobicContact CE1-CB 4.36Å; Y250-L280 HydrophobicContact CE1-CD2 4.04Å; Y250-L280 HydrophobicContact CE1-CG 4.42Å; Y250-L280 HydrophobicContact CG-CG 4.44Å; I278-L280 HydrophobicContact CG2-CD1 3.9Å; I278-L280 HydrophobicContact CG2-CG 4.39Å; L280-F357 HydrophobicContact CD1-CE2 4.26Å; L280-F357 HydrophobicContact CD1-CZ 3.89Å; L280-F357 HydrophobicContact CD2-CE2 4.36Å; L280-F357 HydrophobicContact CD2-CZ 4.02Å; L280-W359 HydrophobicContact CB-CH2 4.08Å; L280-W359 HydrophobicContact CB-CZ2 3.81Å; L280-W359 HydrophobicContact CD2-CZ2 4.36Å; L280-A365 HydrophobicContact CB-CB 4.29Å; L280-A365 WeakPolarHBondContact CD1-O 3.47Å; L280-A365 PolarHBondContact N-O 2.88Å; L280-A365 PolarHBondContact O-N 2.89Å; L280-I393 HydrophobicContact CD2-CG2 3.95Å
281	S	94.3	Very high	78.5	Confident	23 Å²	23	68 Å²	68	16%	0.161	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	152.9	-174.9	57.5	0	0	0	0	111.9	F248 Q249	F248-S281 WeakPolarHBondContact CA-O 3.24Å; Q249-S281 PolarHBondContact N-O 3Å; Q249-S281 PolarHBondContact O-N 3.24Å; Q249-S281 PolarHBondContact O-OG 3.07Å; Q249-S281 VanDerWaalsContact O-OG 3.07Å
282	E	89.4	Confident	76.5	Confident	23 Å²	23	73.9 Å²	73.9	11%	0.107	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	121.4	164.1	-157.2	177.1	-154.3	0	0	108.7	T247 F248 K287 R290 V361	T247-E282 CarbonylContact O-C 3.3Å; T247-E282 WeakPolarHBondContact O-CA 3.44Å; T247-E282 WeakPolarHBondContact O-CG 3.42Å; F248-E282 HydrophobicContact CD1-CB 4.29Å; F248-E282 HydrophobicContact CD1-CG 4.28Å; F248-E282 HydrophobicContact CE1-CB 4.24Å; F248-E282 HydrophobicContact CE1-CG 4.14Å; F248-E282 HydrophobicContact CZ-CG 4.37Å; E282-K287 WeakPolarHBondContact O-CE 3.19Å; E282-K287 PolarHBondContact O-NZ 3.18Å; E282-R290 IonicContact OE1-CZ 3.88Å; E282-R290 IonicContact OE1-NH1 2.63Å; E282-R290 IonicContact OE1-NH2 2.66Å; E282-R290 PolarHBondContact OE1-NH2 2.99Å; E282-R290 IonicContact OE2-NH2 3.17Å; E282-R290 PolarHBondContact OE2-NH2 3Å; E282-V361 HydrophobicContact CB-CB 3.94Å; E282-V361 HydrophobicContact CB-CG1 4.44Å; E282-V361 WeakPolarHBondContact OE2-CB 3.38Å; E282-V361 VanDerWaalsContact OE2-CG2 3.27Å; E282-V361 WeakPolarHBondContact OE2-CG2 3.41Å
283	T	79.4	Confident	74.8	Confident	69 Å²	69	73.5 Å²	73.5	42%	0.423	39%	0.391	S	S	.	.			trans	-104.3	-6.6	-172	-36	0	0	0	0	113	T247 Q249	T247-T283 PolarHBondContact O-N 3.13Å; Q249-T283 WeakPolarHBondContact CB-OG1 3.42Å
284	G	65.9	Low	74.3	Confident	20 Å²	20	72.8 Å²	72.8	21%	0.206	38%	0.379	C	S	.	.			trans	-69.1	138.8	-177.7	0	0	0	0	0	114	N286 K287	G284-N286 PolarHBondContact O-N 3.04Å; G284-N286 VanDerWaalsContact O-N 3.1Å; G284-K287 VanDerWaalsContact O-CG 3.28Å; G284-K287 WeakPolarHBondContact O-CG 3.46Å
285	D	56.1	Low	73.9	Confident	161 Å²	161	74.9 Å²	74.9	86%	0.861	39%	0.387	S	S	*	.	G	3₁₀ helix	trans	-62.8	-18.3	-176.6	-55.2	-71.1	0	0	0	114.4	K287	D285-K287 PolarHBondContact O-N 3.46Å
286	N	52.2	Low	73.7	Confident	125 Å²	125	71.5 Å²	71.5	67%	0.668	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-73.3	23.7	-177.5	-73.2	-48.9	0	0	0	115	G284 C288 F289	G284-N286 PolarHBondContact O-N 3.04Å; G284-N286 VanDerWaalsContact O-N 3.1Å; N286-C288 PolarHBondContact O-N 3.44Å; N286-C288 VanDerWaalsContact O-N 3.07Å; N286-F289 PolarHBondContact O-N 3.23Å
287	K	57	Low	73.5	Confident	110 Å²	110	74.7 Å²	74.7	48%	0.478	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-56.9	-25.4	-179.1	-56.9	-155	174.2	-152.4	0	113.6	E282 G284 D285	E282-K287 WeakPolarHBondContact O-CE 3.19Å; E282-K287 PolarHBondContact O-NZ 3.18Å; G284-K287 VanDerWaalsContact O-CG 3.28Å; G284-K287 WeakPolarHBondContact O-CG 3.46Å; D285-K287 PolarHBondContact O-N 3.46Å
288	C	43.6	Very low	73.6	Confident	117 Å²	117	74.5 Å²	74.5	79%	0.791	38%	0.383	S	S	*	.	G	3₁₀ helix	trans	-80.5	-10.1	-177.4	-68.2	0	0	0	0	116	N286	N286-C288 PolarHBondContact O-N 3.44Å; N286-C288 VanDerWaalsContact O-N 3.07Å
289	F	42.3	Very low	73.6	Confident	171 Å²	171	74.8 Å²	74.8	75%	0.75	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-112.4	6.8	-167.3	-73.8	-70.2	0	0	0	116.2	N286 H291	N286-F289 PolarHBondContact O-N 3.23Å; F289-H291 PolarHBondContact O-N 2.97Å
290	R	56.1	Low	73.7	Confident	143 Å²	143	74.2 Å²	74.2	54%	0.54	38%	0.381	S	S	.	.			trans	-90.9	105.8	-178.7	-70.3	-84.9	-100.8	-87.6	-25.8	111.7	E282	E282-R290 IonicContact OE1-CZ 3.88Å; E282-R290 IonicContact OE1-NH1 2.63Å; E282-R290 IonicContact OE1-NH2 2.66Å; E282-R290 PolarHBondContact OE1-NH2 2.99Å; E282-R290 IonicContact OE2-NH2 3.17Å; E282-R290 PolarHBondContact OE2-NH2 3Å
291	H	43.5	Very low	73.7	Confident	167 Å²	167	74.2 Å²	74.2	77%	0.773	38%	0.381	S	S	*	.			trans	-59.4	160	163.3	-75.3	68.2	0	0	0	110.3	F289 I293	F289-H291 PolarHBondContact O-N 2.97Å; H291-I293 PolarHBondContact O-N 2.86Å
292	P	54.3	Low	73.9	Confident	123 Å²	123	73.1 Å²	73.1	80%	0.799	37%	0.373	S	S	*	.	S	Bend		-73.8	20.2	-118.9	30.6	-40.3	0	0	0	117.8
293	I	63.2	Low	74.3	Confident	72 Å²	72	72.3 Å²	72.3	37%	0.369	37%	0.37	S	S	.	.			trans	-107.8	98.6	179.8	-56.7	104.2	0	0	0	110.3	H291 N399	H291-I293 PolarHBondContact O-N 2.86Å; I293-N399 WeakPolarHBondContact CG1-ND2 3.27Å; I293-N399 HydrophobicContact CG2-CB 4.47Å; I293-N399 WeakPolarHBondContact CG2-OD1 3.49Å
294	S	82.3	Confident	75.1	Confident	31 Å²	31	69.5 Å²	69.5	22%	0.217	35%	0.352	C	S	.	.			trans	-88.8	-11.4	173	51.5	0	0	0	0	114.1	D360 V361 N362	S294-D360 VanDerWaalsContact CB-OD1 3.27Å; S294-D360 WeakPolarHBondContact CB-OD1 3.38Å; S294-D360 VanDerWaalsContact CB-OD2 3.25Å; S294-D360 WeakPolarHBondContact CB-OD2 3.45Å; S294-D360 PolarHBondContact OG-OD2 3.34Å; S294-V361 WeakPolarHBondContact O-CG1 3.32Å; S294-V361 WeakPolarHBondContact O-CG2 3.33Å; S294-V361 PolarHBondContact O-N 2.92Å; S294-N362 WeakPolarHBondContact CB-ND2 3.46Å
295	K	88.8	Confident	76.2	Confident	103 Å²	103	70.1 Å²	70.1	45%	0.448	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	140.2	-174	-63.9	-161.3	174.6	-163.6	0	113.5	W359 Y398	K295-W359 WeakPolarHBondContact CA-O 3.35Å; K295-Y398 HydrophobicContact CB-CD1 4.5Å; K295-Y398 HydrophobicContact CB-CG 4.35Å; K295-Y398 WeakPolarHBondContact O-CB 3.46Å
296	V	93.3	Very high	77.3	Confident	4 Å²	4	66.5 Å²	66.5	2%	0.024	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	162.8	172.9	-70.1	0	0	0	0	109.9	F248 T358 W359 V361 T395 Y396 I406	F248-V296 HydrophobicContact CE1-CG1 4.41Å; F248-V296 HydrophobicContact CZ-CG1 4.18Å; V296-T358 VanDerWaalsContact O-CA 3.25Å; V296-T358 WeakPolarHBondContact O-CA 3.42Å; V296-W359 HydrophobicContact CG2-CD2 3.77Å; V296-W359 VanDerWaalsContact CG2-CE2 3.41Å; V296-W359 HydrophobicContact CG2-CE3 4.43Å; V296-W359 HydrophobicContact CG2-CG 4.07Å; V296-W359 HydrophobicContact CG2-CH2 4.43Å; V296-W359 HydrophobicContact CG2-CZ2 3.78Å; V296-W359 PolarHBondContact N-O 3.46Å; V296-W359 PolarHBondContact O-N 2.86Å; V296-V361 HydrophobicContact CB-CG1 4.41Å; V296-V361 HydrophobicContact CG1-CG1 3.77Å; V296-V361 HydrophobicContact CG2-CG1 3.74Å; V296-T395 HydrophobicContact CB-CG2 4.02Å; V296-T395 HydrophobicContact CG1-CG2 4.42Å; V296-T395 HydrophobicContact CG2-CG2 4.22Å; V296-Y396 WeakPolarHBondContact CA-O 2.84Å; V296-Y396 WeakPolarHBondContact CB-O 3.34Å; V296-I406 HydrophobicContact CG1-CD1 4.47Å
297	R	94.9	Very high	78.3	Confident	88 Å²	88	69 Å²	69	33%	0.332	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	128.5	170.1	-172.2	-176.1	71.3	158.5	-2.3	109.1	S356 F357 T358 T395 Y396	R297-S356 WeakPolarHBondContact CD-OG 3.36Å; R297-F357 CarbonylContact C-O 3.54Å; R297-F357 WeakPolarHBondContact CA-O 3.4Å; R297-F357 WeakPolarHBondContact CG-O 3.45Å; R297-T358 HydrophobicContact CB-CG2 4.23Å; R297-T358 HydrophobicContact CG-CG2 4.28Å; R297-T395 CarbonylContact O-C 3.53Å; R297-T395 WeakPolarHBondContact O-CA 3.45Å; R297-Y396 PolarHBondContact N-O 2.76Å; R297-Y396 PolarHBondContact O-N 2.8Å
298	S	97.3	Very high	79.7	Confident	0 Å²	0	66 Å²	66	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	142.4	173.9	-65.4	0	0	0	0	110.9	S356 F357 W359 D394 T395	S298-S356 WeakPolarHBondContact O-CA 3.35Å; S298-F357 PolarHBondContact N-O 3.04Å; S298-F357 PolarHBondContact O-N 3.47Å; S298-W359 PolarHBondContact OG-NE1 2.96Å; S298-D394 CarbonylContact C-O 3.53Å; S298-D394 WeakPolarHBondContact CA-O 3.22Å; S298-T395 PolarHBondContact OG-OG1 3.36Å
299	V	97.9	Very high	81.9	Confident	7 Å²	7	65.3 Å²	65.3	4%	0.042	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	114.5	173.7	-175.4	0	0	0	0	107.8	M301 I350 A354 V355 I393 D394 Y396	V299-M301 HydrophobicContact CB-CE 4.16Å; V299-M301 HydrophobicContact CG1-CE 3.93Å; V299-M301 WeakPolarHBondContact O-CE 3.33Å; V299-I350 HydrophobicContact CG1-CD1 3.7Å; V299-I350 HydrophobicContact CG2-CD1 4.34Å; V299-A354 HydrophobicContact CG1-CB 4.18Å; V299-V355 WeakPolarHBondContact CA-O 3.4Å; V299-I393 WeakPolarHBondContact O-CA 3.3Å; V299-D394 PolarHBondContact N-O 3.33Å; V299-D394 PolarHBondContact O-N 3.42Å; V299-Y396 HydrophobicContact CB-CE2 4.5Å; V299-Y396 HydrophobicContact CG2-CD2 4.39Å; V299-Y396 HydrophobicContact CG2-CE2 3.89Å
300	V	98.6	Very high	84.3	Confident	1 Å²	1	63 Å²	63	1%	0.006	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	130.2	175.7	179.8	0	0	0	0	108	I278 L332 A354 V355 F357 I367 I391 I393	I278-V300 HydrophobicContact CD1-CG1 4.24Å; V300-L332 HydrophobicContact CG1-CD2 4.36Å; V300-L332 VanDerWaalsContact O-CD2 3.22Å; V300-L332 WeakPolarHBondContact O-CD2 3.36Å; V300-A354 CarbonylContact O-C 3.56Å; V300-A354 WeakPolarHBondContact O-CA 3.44Å; V300-V355 PolarHBondContact N-O 3.28Å; V300-V355 PolarHBondContact O-N 2.99Å; V300-F357 HydrophobicContact CB-CE1 4.49Å; V300-F357 HydrophobicContact CG2-CE1 3.66Å; V300-F357 HydrophobicContact CG2-CZ 4.03Å; V300-I367 HydrophobicContact CB-CD1 4.39Å; V300-I367 HydrophobicContact CG1-CD1 4.44Å; V300-I367 HydrophobicContact CG2-CD1 3.84Å; V300-I391 HydrophobicContact CG1-CG2 3.85Å; V300-I393 HydrophobicContact CG1-CG1 4.38Å; V300-I393 HydrophobicContact CG2-CD1 4.16Å; V300-I393 HydrophobicContact CG2-CG1 4.03Å; V300-I393 HydrophobicContact CG2-CG2 4.19Å
301	M	98.3	Very high	86.1	Confident	1 Å²	1	61.7 Å²	61.7	1%	0.005	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	150.6	-170.7	66.7	-166.1	97.4	0	0	113.2	V299 V303 N353 A354 I391 Q392 D394 P478	V299-M301 HydrophobicContact CB-CE 4.16Å; V299-M301 HydrophobicContact CG1-CE 3.93Å; V299-M301 WeakPolarHBondContact O-CE 3.33Å; M301-V303 HydrophobicContact CG-CG1 4.06Å; M301-V303 HydrophobicContact SD-CG1 4.26Å; M301-N353 CarbonylContact C-O 3.53Å; M301-N353 WeakPolarHBondContact CA-O 3.25Å; M301-N353 WeakPolarHBondContact CB-O 3.46Å; M301-A354 HydrophobicContact CB-CB 3.7Å; M301-I391 CarbonylContact O-C 3.57Å; M301-I391 VanDerWaalsContact O-CA 3.3Å; M301-I391 WeakPolarHBondContact O-CA 3.17Å; M301-Q392 HydrophobicContact CE-CG 4.35Å; M301-Q392 HydrophobicContact CG-CB 3.78Å; M301-Q392 PolarHBondContact N-O 2.89Å; M301-Q392 PolarHBondContact O-N 2.72Å; M301-Q392 HydrophobicContact SD-CB 4.31Å; M301-Q392 HydrophobicContact SD-CG 4.47Å; M301-D394 HydrophobicContact CE-CB 3.79Å; M301-P478 HydrophobicContact CE-CG 4.08Å; M301-P478 HydrophobicContact SD-CB 3.36Å; M301-P478 WeakPolarHBondContact SD-CB 3.21Å; M301-P478 HydrophobicContact SD-CG 3.4Å; M301-P478 WeakPolarHBondContact SD-CG 3.26Å
302	V	98.4	Very high	88.5	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	119.8	172.2	-177.9	0	0	0	0	108.8	W317 V331 L332 N353 V371 L389 I413	V302-W317 HydrophobicContact CG1-CH2 4.12Å; V302-W317 WeakPolarHBondContact O-CZ2 3.38Å; V302-V331 HydrophobicContact CB-CG1 4.08Å; V302-V331 HydrophobicContact CG1-CG1 4.19Å; V302-V331 HydrophobicContact CG2-CG1 4.5Å; V302-L332 HydrophobicContact CG2-CB 4.16Å; V302-L332 HydrophobicContact CG2-CD1 4.12Å; V302-L332 HydrophobicContact CG2-CD2 4.44Å; V302-L332 HydrophobicContact CG2-CG 4.48Å; V302-N353 PolarHBondContact N-O 3.18Å; V302-N353 PolarHBondContact O-ND2 2.56Å; V302-V371 HydrophobicContact CG1-CG1 4.29Å; V302-V371 HydrophobicContact CG2-CG1 4.1Å; V302-V371 HydrophobicContact CG2-CG2 3.91Å; V302-L389 HydrophobicContact CG1-CD2 4.39Å; V302-I413 HydrophobicContact CG1-CD1 4.45Å
303	V	97.1	Very high	90.4	Very high	5 Å²	5	51.8 Å²	51.8	3%	0.03	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	164.7	-178.3	-66.1	0	0	0	0	111	M301 L389 M390 Q392 P478	M301-V303 HydrophobicContact CG-CG1 4.06Å; M301-V303 HydrophobicContact SD-CG1 4.26Å; V303-L389 WeakPolarHBondContact O-CA 3.33Å; V303-M390 HydrophobicContact CG2-CE 3.81Å; V303-M390 HydrophobicContact CG2-CG 3.66Å; V303-M390 PolarHBondContact N-O 2.72Å; V303-M390 PolarHBondContact O-N 3.3Å; V303-Q392 HydrophobicContact CG2-CB 4.07Å; V303-P478 HydrophobicContact CG1-CB 4.13Å
304	F	96.1	Very high	92	Very high	11 Å²	11	48.9 Å²	48.9	5%	0.048	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	142.5	171.2	-61.8	-73.6	0	0	0	110	Q313 Y316 W317 F378 L387 L389	F304-Q313 HydrophobicContact CD2-CB 3.86Å; F304-Q313 HydrophobicContact CD2-CG 3.76Å; F304-Q313 HydrophobicContact CE2-CB 4.17Å; F304-Y316 HydrophobicContact CE1-CD2 4.22Å; F304-Y316 HydrophobicContact CE2-CD2 4.17Å; F304-Y316 AromaticContact CZ-CD2 3.97Å; F304-Y316 HydrophobicContact CZ-CD2 3.97Å; F304-Y316 HydrophobicContact CZ-CG 4.22Å; F304-W317 HydrophobicContact CD2-CZ2 4.28Å; F304-W317 AromaticContact CE2-CD1 3.99Å; F304-W317 HydrophobicContact CE2-CD2 4.03Å; F304-W317 AromaticContact CE2-CE2 3.48Å; F304-W317 VanDerWaalsContact CE2-CE2 3.48Å; F304-W317 HydrophobicContact CE2-CG 4.31Å; F304-W317 AromaticContact CE2-CZ2 3.76Å; F304-W317 HydrophobicContact CE2-CZ2 3.76Å; F304-W317 AromaticContact CE2-NE1 3.49Å; F304-W317 HydrophobicContact CZ-CD2 4.21Å; F304-W317 AromaticContact CZ-CE2 3.93Å; F304-W317 HydrophobicContact CZ-CH2 4.28Å; F304-W317 AromaticContact CZ-CZ2 3.98Å; F304-W317 HydrophobicContact CZ-CZ2 3.98Å; F304-F378 HydrophobicContact CE1-CD1 4.15Å; F304-F378 HydrophobicContact CE1-CD2 4.05Å; F304-F378 HydrophobicContact CE1-CE1 4.02Å; F304-F378 AromaticContact CE1-CE2 3.92Å; F304-F378 HydrophobicContact CE1-CE2 3.92Å; F304-F378 HydrophobicContact CE1-CG 4.15Å; F304-F378 AromaticContact CE1-CZ 3.89Å; F304-F378 HydrophobicContact CE1-CZ 3.89Å; F304-F378 AromaticContact CZ-CD1 3.9Å; F304-F378 HydrophobicContact CZ-CD1 3.9Å; F304-F378 AromaticContact CZ-CE1 3.7Å; F304-F378 HydrophobicContact CZ-CE1 3.7Å; F304-F378 HydrophobicContact CZ-CE2 4.44Å; F304-F378 HydrophobicContact CZ-CG 4.34Å; F304-F378 AromaticContact CZ-CZ 3.99Å; F304-F378 HydrophobicContact CZ-CZ 3.99Å; F304-L387 HydrophobicContact CD1-CB 4.27Å; F304-L387 HydrophobicContact CD1-CD1 4.11Å; F304-L387 HydrophobicContact CE1-CB 4.28Å; F304-L387 HydrophobicContact CE1-CD1 3.68Å; F304-L387 HydrophobicContact CZ-CD1 4.44Å; F304-L389 HydrophobicContact CD1-CD2 3.72Å; F304-L389 HydrophobicContact CE1-CD2 3.74Å
305	S	88.5	Confident	92.5	Very high	32 Å²	32	54.7 Å²	54.7	22%	0.224	26%	0.26	C	S	.	.	S	Bend	trans	-95	12.4	179.1	-179.8	0	0	0	0	113	P388 Q412	S305-P388 PolarHBondContact N-O 3.21Å; S305-Q412 PolarHBondContact OG-NE2 3.46Å; S305-Q412 VanDerWaalsContact OG-NE2 3.11Å
306	E	80.1	Confident	92.9	Very high	86 Å²	86	51.9 Å²	51.9	40%	0.402	25%	0.246	S	C	.	.	S	Bend	trans	-109.5	142.1	173.2	-83.4	166.2	-168.5	0	0	109.2	K308 P388	E306-K308 HydrophobicContact CB-CD 4.33Å; E306-K308 HydrophobicContact CB-CG 4.09Å; E306-K308 PolarHBondContact O-N 3.48Å; E306-K308 WeakPolarHBondContact OE2-CE 3.33Å; E306-P388 HydrophobicContact CB-CG 4.41Å; E306-P388 VanDerWaalsContact CD-CG 3.48Å; E306-P388 HydrophobicContact CG-CG 3.55Å; E306-P388 VanDerWaalsContact OE1-CD 3.25Å; E306-P388 WeakPolarHBondContact OE1-CD 3.36Å; E306-P388 VanDerWaalsContact OE1-CG 3.23Å; E306-P388 WeakPolarHBondContact OE1-CG 3.28Å
307	D	73.6	Confident	93.1	Very high	178 Å²	178	51.7 Å²	51.7	95%	0.952	25%	0.245	S	C	*	.			trans	-73.5	53	-179	-55.2	-65	0	0	0	113
308	K	84.8	Confident	93.1	Very high	46 Å²	46	50.5 Å²	50.5	20%	0.2	24%	0.243	C	C	.	.			trans	-80.7	143.9	176.9	-69.9	179.8	164	-75.2	0	110.5	E306 E312 Q313 Y316	E306-K308 HydrophobicContact CB-CD 4.33Å; E306-K308 HydrophobicContact CB-CG 4.09Å; E306-K308 PolarHBondContact O-N 3.48Å; E306-K308 WeakPolarHBondContact OE2-CE 3.33Å; K308-E312 WeakPolarHBondContact CB-OE2 3.36Å; K308-E312 HydrophobicContact CD-CG 4.48Å; K308-E312 VanDerWaalsContact CD-OE2 3.31Å; K308-E312 WeakPolarHBondContact CD-OE2 3.22Å; K308-E312 VanDerWaalsContact CG-OE2 3.26Å; K308-E312 WeakPolarHBondContact CG-OE2 3.46Å; K308-E312 IonicContact NZ-OE1 3.3Å; K308-E312 PolarHBondContact NZ-OE1 2.87Å; K308-E312 IonicContact NZ-OE2 2.63Å; K308-E312 PolarHBondContact NZ-OE2 2.84Å; K308-Q313 HydrophobicContact CB-CG 3.96Å; K308-Q313 PolarHBondContact O-NE2 2.66Å; K308-Y316 HydrophobicContact CD-CE2 3.69Å; K308-Y316 PolarHBondContact NZ-OH 3.32Å
309	N	91.3	Very high	93	Very high	102 Å²	102	53.8 Å²	53.8	55%	0.545	26%	0.255	S	S	.	.			trans	-61.5	158.6	176.7	72.9	48.9	0	0	0	111.8	D311 E312 Q313	N309-D311 VanDerWaalsContact C-N 3.27Å; N309-D311 PolarHBondContact O-N 3.27Å; N309-D311 PolarHBondContact OD1-N 2.84Å; N309-E312 PolarHBondContact O-N 2.95Å; N309-E312 PolarHBondContact OD1-N 2.89Å; N309-Q313 PolarHBondContact O-N 2.96Å; N309-Q313 VanDerWaalsContact O-N 3.14Å
310	R	92.4	Very high	92.9	Very high	122 Å²	122	53.5 Å²	53.5	46%	0.46	25%	0.254	S	S	.	.	H	α-helix	trans	-53.6	-42.7	-175.5	-178.8	177.5	178.1	90.2	-3.4	112.6	Q313 L314 V479	R310-Q313 PolarHBondContact O-N 3.07Å; R310-L314 HydrophobicContact CG-CD1 3.98Å; R310-L314 HydrophobicContact CG-CG 4.45Å; R310-L314 WeakPolarHBondContact O-CB 3.3Å; R310-L314 VanDerWaalsContact O-CG 3.28Å; R310-L314 WeakPolarHBondContact O-CG 3.27Å; R310-L314 PolarHBondContact O-N 3.05Å; R310-V479 HydrophobicContact CB-CG2 4.42Å; R310-V479 HydrophobicContact CG-CG1 4.34Å; R310-V479 HydrophobicContact CG-CG2 4.23Å
311	D	93.7	Very high	92.8	Very high	117 Å²	117	54.8 Å²	54.8	63%	0.626	26%	0.259	S	S	*	.	H	α-helix	trans	-74.6	-32.2	-173.8	-58.3	-52.2	0	0	0	112.7	N309 L314 K315	N309-D311 VanDerWaalsContact C-N 3.27Å; N309-D311 PolarHBondContact O-N 3.27Å; N309-D311 PolarHBondContact OD1-N 2.84Å; D311-L314 PolarHBondContact O-N 2.97Å; D311-K315 VanDerWaalsContact O-CB 3.29Å; D311-K315 WeakPolarHBondContact O-CB 3.34Å; D311-K315 PolarHBondContact O-N 3.07Å
312	E	93.7	Very high	92.6	Very high	60 Å²	60	59.2 Å²	59.2	28%	0.28	29%	0.291	S	S	.	.	H	α-helix	trans	-68	-43.1	171.4	-166.8	-176.5	-163.3	0	0	111.3	K308 N309 L314 K315 Y316	K308-E312 WeakPolarHBondContact CB-OE2 3.36Å; K308-E312 HydrophobicContact CD-CG 4.48Å; K308-E312 VanDerWaalsContact CD-OE2 3.31Å; K308-E312 WeakPolarHBondContact CD-OE2 3.22Å; K308-E312 VanDerWaalsContact CG-OE2 3.26Å; K308-E312 WeakPolarHBondContact CG-OE2 3.46Å; K308-E312 IonicContact NZ-OE1 3.3Å; K308-E312 PolarHBondContact NZ-OE1 2.87Å; K308-E312 IonicContact NZ-OE2 2.63Å; K308-E312 PolarHBondContact NZ-OE2 2.84Å; N309-E312 PolarHBondContact O-N 2.95Å; N309-E312 PolarHBondContact OD1-N 2.89Å; E312-L314 VanDerWaalsContact C-N 3.35Å; E312-L314 PolarHBondContact O-N 3.15Å; E312-K315 WeakPolarHBondContact O-CB 3.32Å; E312-K315 PolarHBondContact O-N 3.14Å; E312-Y316 HydrophobicContact CG-CE2 4.03Å; E312-Y316 PolarHBondContact O-N 3.34Å; E312-Y316 PolarHBondContact OE1-OH 2.94Å
313	Q	94.8	Very high	92.5	Very high	22 Å²	22	65.4 Å²	65.4	10%	0.103	31%	0.314	C	S	.	.	H	α-helix	trans	-60.8	-43.9	173.7	-65.6	-167.3	46	0	0	111.4	F304 K308 N309 R310 K315 Y316 W317 V479	F304-Q313 HydrophobicContact CD2-CB 3.86Å; F304-Q313 HydrophobicContact CD2-CG 3.76Å; F304-Q313 HydrophobicContact CE2-CB 4.17Å; K308-Q313 HydrophobicContact CB-CG 3.96Å; K308-Q313 PolarHBondContact O-NE2 2.66Å; N309-Q313 PolarHBondContact O-N 2.96Å; N309-Q313 VanDerWaalsContact O-N 3.14Å; R310-Q313 PolarHBondContact O-N 3.07Å; Q313-K315 VanDerWaalsContact C-N 3.34Å; Q313-K315 PolarHBondContact O-N 2.83Å; Q313-Y316 PolarHBondContact O-N 3.34Å; Q313-W317 PolarHBondContact O-N 2.82Å; Q313-V479 HydrophobicContact CB-CB 4.21Å; Q313-V479 HydrophobicContact CB-CG1 4Å; Q313-V479 HydrophobicContact CB-CG2 4.12Å; Q313-V479 HydrophobicContact CG-CG2 4.37Å
314	L	95.3	Very high	92.4	Very high	10 Å²	10	67 Å²	67	5%	0.052	32%	0.321	C	S	.	.	H	α-helix	trans	-65.9	-32.9	174.9	-70.3	175.5	0	0	0	112.9	R310 D311 E312 W317 K318 V479 F481 H486	R310-L314 HydrophobicContact CG-CD1 3.98Å; R310-L314 HydrophobicContact CG-CG 4.45Å; R310-L314 WeakPolarHBondContact O-CB 3.3Å; R310-L314 VanDerWaalsContact O-CG 3.28Å; R310-L314 WeakPolarHBondContact O-CG 3.27Å; R310-L314 PolarHBondContact O-N 3.05Å; D311-L314 PolarHBondContact O-N 2.97Å; E312-L314 VanDerWaalsContact C-N 3.35Å; E312-L314 PolarHBondContact O-N 3.15Å; L314-W317 PolarHBondContact O-N 3.36Å; L314-K318 WeakPolarHBondContact O-CB 3.25Å; L314-K318 VanDerWaalsContact O-CG 3.28Å; L314-K318 WeakPolarHBondContact O-CG 3.47Å; L314-K318 PolarHBondContact O-N 2.86Å; L314-V479 HydrophobicContact CD2-CG1 3.64Å; L314-V479 HydrophobicContact CG-CG1 3.75Å; L314-F481 HydrophobicContact CD2-CD2 4.24Å; L314-H486 VanDerWaalsContact CD2-NE2 3.32Å; L314-H486 WeakPolarHBondContact CD2-NE2 2.96Å
315	K	94.8	Very high	92.1	Very high	154 Å²	154	75.9 Å²	75.9	67%	0.67	36%	0.362	S	S	*	.	H	α-helix	trans	-62.9	-42.4	173.3	-176.6	179.3	-179.7	178.2	0	111.3	D311 E312 Q313 Y319	D311-K315 VanDerWaalsContact O-CB 3.29Å; D311-K315 WeakPolarHBondContact O-CB 3.34Å; D311-K315 PolarHBondContact O-N 3.07Å; E312-K315 WeakPolarHBondContact O-CB 3.32Å; E312-K315 PolarHBondContact O-N 3.14Å; Q313-K315 VanDerWaalsContact C-N 3.34Å; Q313-K315 PolarHBondContact O-N 2.83Å; K315-Y319 WeakPolarHBondContact O-CB 3.47Å; K315-Y319 PolarHBondContact O-N 3.08Å
316	Y	95.8	Very high	92.3	Very high	44 Å²	44	78.3 Å²	78.3	17%	0.173	38%	0.376	C	S	.	.	H	α-helix	trans	-66.9	-42	174.1	-64.1	-38.2	0	0	0	112.6	F304 K308 E312 Q313 Y319 W320 F378 L387	F304-Y316 HydrophobicContact CE1-CD2 4.22Å; F304-Y316 HydrophobicContact CE2-CD2 4.17Å; F304-Y316 AromaticContact CZ-CD2 3.97Å; F304-Y316 HydrophobicContact CZ-CD2 3.97Å; F304-Y316 HydrophobicContact CZ-CG 4.22Å; K308-Y316 HydrophobicContact CD-CE2 3.69Å; K308-Y316 PolarHBondContact NZ-OH 3.32Å; E312-Y316 HydrophobicContact CG-CE2 4.03Å; E312-Y316 PolarHBondContact O-N 3.34Å; E312-Y316 PolarHBondContact OE1-OH 2.94Å; Q313-Y316 PolarHBondContact O-N 3.34Å; Y316-Y319 PolarHBondContact O-N 2.87Å; Y316-W320 WeakPolarHBondContact O-CB 3.25Å; Y316-W320 PolarHBondContact O-N 2.85Å; Y316-F378 HydrophobicContact CD1-CB 4.31Å; Y316-F378 HydrophobicContact CG-CB 4.39Å; Y316-L387 HydrophobicContact CD1-CD1 4.17Å; Y316-L387 HydrophobicContact CD2-CD1 3.46Å; Y316-L387 VanDerWaalsContact CD2-CD1 3.46Å; Y316-L387 HydrophobicContact CE1-CD1 4.18Å; Y316-L387 HydrophobicContact CE2-CD1 3.43Å; Y316-L387 VanDerWaalsContact CE2-CD1 3.43Å; Y316-L387 HydrophobicContact CE2-CD2 4.49Å; Y316-L387 HydrophobicContact CG-CD1 3.84Å
317	W	96.9	Very high	92.7	Very high	0 Å²	0	77.7 Å²	77.7	0%	0	39%	0.386	C	S	.	.	H	α-helix	trans	-63.9	-42.2	176.2	-69.7	129.7	0	0	0	112.6	V302 F304 Q313 L314 Y319 W320 H321 V331 N353 F378 L389 F481	V302-W317 HydrophobicContact CG1-CH2 4.12Å; V302-W317 WeakPolarHBondContact O-CZ2 3.38Å; F304-W317 HydrophobicContact CD2-CZ2 4.28Å; F304-W317 AromaticContact CE2-CD1 3.99Å; F304-W317 HydrophobicContact CE2-CD2 4.03Å; F304-W317 AromaticContact CE2-CE2 3.48Å; F304-W317 VanDerWaalsContact CE2-CE2 3.48Å; F304-W317 HydrophobicContact CE2-CG 4.31Å; F304-W317 AromaticContact CE2-CZ2 3.76Å; F304-W317 HydrophobicContact CE2-CZ2 3.76Å; F304-W317 AromaticContact CE2-NE1 3.49Å; F304-W317 HydrophobicContact CZ-CD2 4.21Å; F304-W317 AromaticContact CZ-CE2 3.93Å; F304-W317 HydrophobicContact CZ-CH2 4.28Å; F304-W317 AromaticContact CZ-CZ2 3.98Å; F304-W317 HydrophobicContact CZ-CZ2 3.98Å; Q313-W317 PolarHBondContact O-N 2.82Å; L314-W317 PolarHBondContact O-N 3.36Å; W317-Y319 PolarHBondContact O-N 3Å; W317-W320 PolarHBondContact O-N 3.24Å; W317-H321 VanDerWaalsContact O-CB 3.31Å; W317-H321 WeakPolarHBondContact O-CB 3.2Å; W317-H321 PolarHBondContact O-N 3.24Å; W317-V331 HydrophobicContact CE3-CG2 3.76Å; W317-V331 HydrophobicContact CH2-CG1 3.76Å; W317-V331 HydrophobicContact CH2-CG2 4.44Å; W317-V331 HydrophobicContact CZ3-CB 4.23Å; W317-V331 HydrophobicContact CZ3-CG1 3.57Å; W317-V331 HydrophobicContact CZ3-CG2 3.58Å; W317-N353 HydrophobicContact CZ2-CB 4.42Å; W317-F378 AromaticContact CE3-CE1 3.8Å; W317-F378 HydrophobicContact CE3-CE1 3.8Å; W317-F378 HydrophobicContact CE3-CZ 4.34Å; W317-F378 HydrophobicContact CH2-CE1 4.32Å; W317-F378 HydrophobicContact CH2-CZ 4.08Å; W317-F378 AromaticContact CZ3-CE1 3.61Å; W317-F378 HydrophobicContact CZ3-CE1 3.61Å; W317-F378 AromaticContact CZ3-CZ 3.68Å; W317-F378 HydrophobicContact CZ3-CZ 3.68Å; W317-L389 HydrophobicContact CH2-CD2 4.33Å; W317-F481 HydrophobicContact CB-CB 3.95Å; W317-F481 HydrophobicContact CB-CD1 3.92Å; W317-F481 HydrophobicContact CB-CD2 3.55Å; W317-F481 HydrophobicContact CB-CE1 4.34Å; W317-F481 HydrophobicContact CB-CE2 4.01Å; W317-F481 HydrophobicContact CB-CG 3.51Å; W317-F481 HydrophobicContact CB-CZ 4.38Å; W317-F481 HydrophobicContact CG-CB 3.89Å; W317-F481 HydrophobicContact CG-CD1 4.49Å; W317-F481 HydrophobicContact CG-CD2 4.4Å; W317-F481 HydrophobicContact CG-CG 4.02Å
318	K	95.1	Very high	93.5	Very high	63 Å²	63	77.6 Å²	77.6	27%	0.274	38%	0.377	S	S	.	.	H	α-helix	trans	-60.8	-41.6	172.1	-75.3	176	174.2	-177.2	0	112.3	L314 H321 S322 F481 H486	L314-K318 WeakPolarHBondContact O-CB 3.25Å; L314-K318 VanDerWaalsContact O-CG 3.28Å; L314-K318 WeakPolarHBondContact O-CG 3.47Å; L314-K318 PolarHBondContact O-N 2.86Å; K318-H321 PolarHBondContact O-N 3.35Å; K318-S322 WeakPolarHBondContact O-CB 3.22Å; K318-S322 PolarHBondContact O-N 3.24Å; K318-S322 PolarHBondContact O-OG 2.88Å; K318-F481 HydrophobicContact CG-CE2 3.91Å; K318-H486 WeakPolarHBondContact CE-O 3.46Å; K318-H486 PolarHBondContact NZ-O 3.48Å
319	Y	95.8	Very high	94	Very high	69 Å²	69	78.1 Å²	78.1	27%	0.271	38%	0.38	S	S	.	.	H	α-helix	trans	-66	-38.5	176.9	-177.1	-89.4	0	0	0	112.6	K315 Y316 W317 S322 R323 D377 S380	K315-Y319 WeakPolarHBondContact O-CB 3.47Å; K315-Y319 PolarHBondContact O-N 3.08Å; Y316-Y319 PolarHBondContact O-N 2.87Å; W317-Y319 PolarHBondContact O-N 3Å; Y319-S322 PolarHBondContact O-OG 3.14Å; Y319-R323 VanDerWaalsContact O-CD 3.22Å; Y319-R323 WeakPolarHBondContact O-CD 3.49Å; Y319-R323 VanDerWaalsContact O-CG 3.26Å; Y319-R323 WeakPolarHBondContact O-CG 3.35Å; Y319-R323 PolarHBondContact OH-NH1 3.46Å; Y319-D377 WeakPolarHBondContact CE1-O 3.32Å; Y319-S380 VanDerWaalsContact OH-CB 3.23Å; Y319-S380 WeakPolarHBondContact OH-CB 3.38Å; Y319-S380 PolarHBondContact OH-N 3.21Å; Y319-S380 PolarHBondContact OH-OG 2.87Å
320	W	96.7	Very high	94.3	Very high	1 Å²	1	74 Å²	74	0%	0.004	36%	0.356	C	S	.	.	H	α-helix	trans	-66.4	-46	173.5	172.9	85.1	0	0	0	111.3	Y316 W317 R323 Q324 Q329 R330 V331 N372 C373 F378	Y316-W320 WeakPolarHBondContact O-CB 3.25Å; Y316-W320 PolarHBondContact O-N 2.85Å; W317-W320 PolarHBondContact O-N 3.24Å; W320-R323 PolarHBondContact O-N 3.13Å; W320-Q324 HydrophobicContact CD2-CG 4.32Å; W320-Q324 HydrophobicContact CE3-CG 4.29Å; W320-Q324 HydrophobicContact CH2-CG 3.8Å; W320-Q324 HydrophobicContact CZ2-CG 3.84Å; W320-Q324 HydrophobicContact CZ3-CG 4.03Å; W320-Q324 PolarHBondContact O-NE2 3.19Å; W320-Q329 HydrophobicContact CH2-CG 3.99Å; W320-Q329 VanDerWaalsContact CH2-O 3.27Å; W320-Q329 WeakPolarHBondContact CH2-O 3.26Å; W320-Q329 HydrophobicContact CZ2-CG 4.26Å; W320-Q329 WeakPolarHBondContact CZ3-O 3.33Å; W320-R330 WeakPolarHBondContact CH2-O 3.47Å; W320-V331 HydrophobicContact CD2-CG2 4.16Å; W320-V331 HydrophobicContact CE3-CG2 3.62Å; W320-V331 HydrophobicContact CH2-CB 4.39Å; W320-V331 HydrophobicContact CH2-CG2 3.65Å; W320-V331 HydrophobicContact CZ2-CG2 4.17Å; W320-V331 HydrophobicContact CZ3-CG2 3.36Å; W320-N372 HydrophobicContact CZ2-CB 4.44Å; W320-C373 HydrophobicContact CD2-CB 4.43Å; W320-C373 HydrophobicContact CG-CB 4.34Å; W320-C373 HydrophobicContact CZ2-CB 4.44Å; W320-C373 VanDerWaalsContact NE1-CB 3.27Å; W320-F378 HydrophobicContact CB-CD1 3.98Å; W320-F378 HydrophobicContact CB-CE1 3.81Å; W320-F378 HydrophobicContact CG-CE1 4.16Å
321	H	96.1	Very high	94.6	Very high	27 Å²	27	68.1 Å²	68.1	13%	0.125	33%	0.334	C	S	.	.	H	α-helix	trans	-66.9	-43.1	-175.2	-175.4	-114.5	0	0	0	112.7	W317 K318 R323 Q324 A327 Y352 F481	W317-H321 VanDerWaalsContact O-CB 3.31Å; W317-H321 WeakPolarHBondContact O-CB 3.2Å; W317-H321 PolarHBondContact O-N 3.24Å; K318-H321 PolarHBondContact O-N 3.35Å; H321-R323 PolarHBondContact O-N 2.82Å; H321-Q324 PolarHBondContact O-N 2.68Å; H321-A327 PolarHBondContact NE2-O 2.79Å; H321-Y352 AromaticContact NE2-CE2 3.66Å; H321-F481 HydrophobicContact CB-CE1 3.71Å; H321-F481 HydrophobicContact CB-CZ 3.69Å; H321-F481 AromaticContact CG-CE1 3.86Å; H321-F481 AromaticContact CG-CZ 3.89Å
322	S	94.8	Very high	94.8	Very high	95 Å²	95	62.6 Å²	62.6	66%	0.664	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-8	177	66.7	0	0	0	0	114.6	K318 Y319	K318-S322 WeakPolarHBondContact O-CB 3.22Å; K318-S322 PolarHBondContact O-N 3.24Å; K318-S322 PolarHBondContact O-OG 2.88Å; Y319-S322 PolarHBondContact O-OG 3.14Å
323	R	95	Very high	95	Very high	130 Å²	130	61.6 Å²	61.6	49%	0.491	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	-2.9	175.2	-65.5	171.6	58.5	95.8	15.6	113.5	Y319 W320 H321	Y319-R323 VanDerWaalsContact O-CD 3.22Å; Y319-R323 WeakPolarHBondContact O-CD 3.49Å; Y319-R323 VanDerWaalsContact O-CG 3.26Å; Y319-R323 WeakPolarHBondContact O-CG 3.35Å; Y319-R323 PolarHBondContact OH-NH1 3.46Å; W320-R323 PolarHBondContact O-N 3.13Å; H321-R323 PolarHBondContact O-N 2.82Å
324	Q	94.4	Very high	95.1	Very high	39 Å²	39	61.6 Å²	61.6	18%	0.182	30%	0.302	C	S	.	.	S	Bend	trans	-81.3	143.4	177.3	-55.5	-48.5	-61.8	0	0	111	W320 H321 T326 Q329	W320-Q324 HydrophobicContact CD2-CG 4.32Å; W320-Q324 HydrophobicContact CE3-CG 4.29Å; W320-Q324 HydrophobicContact CH2-CG 3.8Å; W320-Q324 HydrophobicContact CZ2-CG 3.84Å; W320-Q324 HydrophobicContact CZ3-CG 4.03Å; W320-Q324 PolarHBondContact O-NE2 3.19Å; H321-Q324 PolarHBondContact O-N 2.68Å; Q324-T326 PolarHBondContact O-N 2.97Å; Q324-Q329 HydrophobicContact CB-CB 3.81Å; Q324-Q329 HydrophobicContact CB-CG 4.04Å; Q324-Q329 HydrophobicContact CG-CB 4.01Å; Q324-Q329 HydrophobicContact CG-CG 3.84Å
325	H	90.8	Very high	95.1	Very high	197 Å²	197	61.5 Å²	61.5	91%	0.912	30%	0.302	S	S	*	.	S	Bend	trans	-68.3	-16	179.1	-61.6	-63.8	0	0	0	114
326	T	92.5	Very high	94.8	Very high	83 Å²	83	60.4 Å²	60.4	51%	0.509	30%	0.304	S	S	.	.	S	Bend	trans	-137.1	127	-176.1	-52.1	0	0	0	0	109	Q324 K328 Q329	Q324-T326 PolarHBondContact O-N 2.97Å; T326-K328 HydrophobicContact CG2-CB 4.12Å; T326-K328 PolarHBondContact O-N 3.28Å; T326-K328 VanDerWaalsContact O-N 3.16Å; T326-Q329 WeakPolarHBondContact O-CB 3.45Å; T326-Q329 PolarHBondContact O-N 3.29Å
327	A	88.8	Confident	94.5	Very high	73 Å²	73	63.3 Å²	63.3	60%	0.603	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-30.8	179.8	0	0	0	0	0	113.2	H321 Q329 Y352	H321-A327 PolarHBondContact NE2-O 2.79Å; A327-Q329 PolarHBondContact O-N 3.06Å; A327-Y352 WeakPolarHBondContact O-CE2 3.48Å; A327-Y352 PolarHBondContact O-OH 3.03Å
328	K	91.1	Very high	93.7	Very high	176 Å²	176	71.4 Å²	71.4	77%	0.765	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-1.9	174.3	-58.7	-171.6	176.8	-171.8	0	114.9	T326 R330	T326-K328 HydrophobicContact CG2-CB 4.12Å; T326-K328 PolarHBondContact O-N 3.28Å; T326-K328 VanDerWaalsContact O-N 3.16Å; K328-R330 PolarHBondContact O-N 2.97Å
329	Q	95	Very high	92.8	Very high	56 Å²	56	73 Å²	73	26%	0.262	36%	0.359	S	S	.	.			trans	-70	108.2	-179.3	-179.6	61	84.3	0	0	110	W320 Q324 T326 A327 Y352 N372	W320-Q329 HydrophobicContact CH2-CG 3.99Å; W320-Q329 VanDerWaalsContact CH2-O 3.27Å; W320-Q329 WeakPolarHBondContact CH2-O 3.26Å; W320-Q329 HydrophobicContact CZ2-CG 4.26Å; W320-Q329 WeakPolarHBondContact CZ3-O 3.33Å; Q324-Q329 HydrophobicContact CB-CB 3.81Å; Q324-Q329 HydrophobicContact CB-CG 4.04Å; Q324-Q329 HydrophobicContact CG-CB 4.01Å; Q324-Q329 HydrophobicContact CG-CG 3.84Å; T326-Q329 WeakPolarHBondContact O-CB 3.45Å; T326-Q329 PolarHBondContact O-N 3.29Å; A327-Q329 PolarHBondContact O-N 3.06Å; Q329-Y352 WeakPolarHBondContact O-CD2 3.15Å; Q329-N372 PolarHBondContact NE2-ND2 3.15Å; Q329-N372 VanDerWaalsContact NE2-ND2 3.19Å
330	R	97.5	Very high	91.8	Very high	15 Å²	15	69.8 Å²	69.8	6%	0.057	35%	0.346	C	S	.	.			trans	-80.8	158.4	175.3	-62.6	170.2	53.8	79	16.4	111.6	W320 K328 L332 D333 E349 A351 Y352 A354 N372	W320-R330 WeakPolarHBondContact CH2-O 3.47Å; K328-R330 PolarHBondContact O-N 2.97Å; R330-L332 PolarHBondContact NE-O 3.01Å; R330-L332 VanDerWaalsContact NE-O 3.08Å; R330-L332 PolarHBondContact NH2-O 3.44Å; R330-D333 WeakPolarHBondContact CB-OD1 3.46Å; R330-D333 WeakPolarHBondContact CD-OD1 3.29Å; R330-D333 IonicContact NE-OD1 2.85Å; R330-D333 PolarHBondContact NE-OD1 3.04Å; R330-E349 WeakPolarHBondContact CD-OE2 3.48Å; R330-E349 IonicContact CZ-OE2 3.4Å; R330-E349 VanDerWaalsContact CZ-OE2 3.26Å; R330-E349 IonicContact NE-OE1 2.76Å; R330-E349 IonicContact NE-OE2 3.26Å; R330-E349 PolarHBondContact NE-OE2 2.99Å; R330-E349 VanDerWaalsContact NH1-CD 3.34Å; R330-E349 PolarHBondContact NH1-O 2.76Å; R330-E349 IonicContact NH1-OE2 2.71Å; R330-E349 PolarHBondContact NH1-OE2 3.48Å; R330-A351 PolarHBondContact NH1-O 3.28Å; R330-A351 PolarHBondContact NH2-O 3.13Å; R330-Y352 HydrophobicContact CB-CD2 4.46Å; R330-Y352 HydrophobicContact CG-CD2 4.19Å; R330-Y352 HydrophobicContact CG-CE2 4.44Å; R330-Y352 HydrophobicContact CG-CG 4.4Å; R330-A354 PolarHBondContact NH2-O 3.16Å; R330-N372 VanDerWaalsContact O-CB 3.26Å; R330-N372 WeakPolarHBondContact O-CB 3.43Å; R330-N372 PolarHBondContact O-ND2 2.83Å
331	V	98.3	Very high	90.9	Very high	0 Å²	0	74.6 Å²	74.6	0%	0	37%	0.367	C	S	.	.	S	Bend	trans	-79	-36	173.6	177	0	0	0	0	111	V302 W317 W320 Y352 N353 V371 N372 C373	V302-V331 HydrophobicContact CB-CG1 4.08Å; V302-V331 HydrophobicContact CG1-CG1 4.19Å; V302-V331 HydrophobicContact CG2-CG1 4.5Å; W317-V331 HydrophobicContact CE3-CG2 3.76Å; W317-V331 HydrophobicContact CH2-CG1 3.76Å; W317-V331 HydrophobicContact CH2-CG2 4.44Å; W317-V331 HydrophobicContact CZ3-CB 4.23Å; W317-V331 HydrophobicContact CZ3-CG1 3.57Å; W317-V331 HydrophobicContact CZ3-CG2 3.58Å; W320-V331 HydrophobicContact CD2-CG2 4.16Å; W320-V331 HydrophobicContact CE3-CG2 3.62Å; W320-V331 HydrophobicContact CH2-CB 4.39Å; W320-V331 HydrophobicContact CH2-CG2 3.65Å; W320-V331 HydrophobicContact CZ2-CG2 4.17Å; W320-V331 HydrophobicContact CZ3-CG2 3.36Å; V331-Y352 WeakPolarHBondContact CA-O 3.37Å; V331-Y352 WeakPolarHBondContact CB-O 3.35Å; V331-Y352 PolarHBondContact N-O 3.08Å; V331-N353 HydrophobicContact CB-CB 3.97Å; V331-N353 HydrophobicContact CG1-CB 4.16Å; V331-N353 HydrophobicContact CG2-CB 4.31Å; V331-V371 WeakPolarHBondContact O-CA 3.35Å; V331-N372 PolarHBondContact O-N 3.14Å; V331-C373 HydrophobicContact CG1-CB 4.4Å
332	L	98.4	Very high	90.3	Very high	0 Å²	0	78.8 Å²	78.8	0%	0	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	119.1	-177.9	178.2	67.6	0	0	0	110	V300 V302 R330 Y352 V355 I369 V371	V300-L332 HydrophobicContact CG1-CD2 4.36Å; V300-L332 VanDerWaalsContact O-CD2 3.22Å; V300-L332 WeakPolarHBondContact O-CD2 3.36Å; V302-L332 HydrophobicContact CG2-CB 4.16Å; V302-L332 HydrophobicContact CG2-CD1 4.12Å; V302-L332 HydrophobicContact CG2-CD2 4.44Å; V302-L332 HydrophobicContact CG2-CG 4.48Å; R330-L332 PolarHBondContact NE-O 3.01Å; R330-L332 VanDerWaalsContact NE-O 3.08Å; R330-L332 PolarHBondContact NH2-O 3.44Å; L332-Y352 PolarHBondContact N-O 3.21Å; L332-Y352 VanDerWaalsContact N-O 3.15Å; L332-V355 HydrophobicContact CD2-CG2 4.32Å; L332-V355 HydrophobicContact CG-CG2 4.36Å; L332-I369 HydrophobicContact CD1-CB 3.87Å; L332-I369 HydrophobicContact CD1-CD1 3.74Å; L332-I369 HydrophobicContact CD1-CG1 4.43Å; L332-I369 HydrophobicContact CD1-CG2 4.18Å; L332-V371 HydrophobicContact CD1-CG2 4.47Å
333	D	97.1	Very high	89.9	Confident	39 Å²	39	75.7 Å²	75.7	21%	0.209	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	155	171	-54.6	-44.2	0	0	0	110.7	R330 I369 T370 N372	R330-D333 WeakPolarHBondContact CB-OD1 3.46Å; R330-D333 WeakPolarHBondContact CD-OD1 3.29Å; R330-D333 IonicContact NE-OD1 2.85Å; R330-D333 PolarHBondContact NE-OD1 3.04Å; D333-I369 VanDerWaalsContact O-CA 3.25Å; D333-I369 WeakPolarHBondContact O-CA 3.27Å; D333-T370 HydrophobicContact CB-CG2 3.73Å; D333-T370 PolarHBondContact N-O 2.86Å; D333-T370 PolarHBondContact O-N 3.01Å; D333-N372 PolarHBondContact OD2-ND2 3.22Å
334	I	96.3	Very high	89.8	Confident	23 Å²	23	70 Å²	70	12%	0.118	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	147.1	172.4	-170.3	165.6	0	0	0	109.2	I344 I347 V355 I367 F368	I334-I344 HydrophobicContact CD1-CD1 4.08Å; I334-I347 HydrophobicContact CD1-CD1 4.39Å; I334-I347 HydrophobicContact CG2-CG2 4.17Å; I334-V355 HydrophobicContact CD1-CG1 4.41Å; I334-V355 HydrophobicContact CG2-CG1 4.23Å; I334-I367 HydrophobicContact CD1-CB 4.04Å; I334-I367 HydrophobicContact CD1-CG2 4.15Å; I334-F368 CarbonylContact C-O 3.51Å; I334-F368 WeakPolarHBondContact CA-O 3.14Å
335	A	95	Very high	89.7	Confident	7 Å²	7	69.5 Å²	69.5	6%	0.058	35%	0.352	C	S	.	.			trans	-90.6	136.9	178.8	0	0	0	0	0	112.3	F275 Y337 F368	F275-A335 HydrophobicContact CD1-CB 3.72Å; F275-A335 HydrophobicContact CE1-CB 3.59Å; F275-A335 HydrophobicContact CE2-CB 4.49Å; F275-A335 HydrophobicContact CG-CB 4.25Å; F275-A335 HydrophobicContact CZ-CB 4Å; A335-Y337 HydrophobicContact CB-CD1 3.81Å; A335-Y337 HydrophobicContact CB-CD2 4.23Å; A335-Y337 HydrophobicContact CB-CE1 3.8Å; A335-Y337 HydrophobicContact CB-CE2 4.23Å; A335-Y337 HydrophobicContact CB-CG 4.02Å; A335-Y337 PolarHBondContact O-N 3.04Å; A335-F368 HydrophobicContact CB-CB 3.93Å; A335-F368 PolarHBondContact N-O 3.37Å
336	D	90.1	Very high	89.8	Confident	131 Å²	131	64.5 Å²	64.5	70%	0.701	33%	0.332	S	S	*	.			trans	-73.1	42.3	175.3	-63.4	-43.7	0	0	0	113.6	F341	D336-F341 HydrophobicContact CB-CE2 3.85Å; D336-F341 HydrophobicContact CB-CZ 4.3Å; D336-F341 WeakPolarHBondContact OD1-CZ 3.48Å
337	Y	87.9	Confident	89.9	Confident	106 Å²	106	63.3 Å²	63.3	42%	0.416	32%	0.322	S	S	.	.			trans	-76.9	131.8	178.5	-66.6	-4.9	0	0	0	110.6	A335 E339 S340 F341 F368	A335-Y337 HydrophobicContact CB-CD1 3.81Å; A335-Y337 HydrophobicContact CB-CD2 4.23Å; A335-Y337 HydrophobicContact CB-CE1 3.8Å; A335-Y337 HydrophobicContact CB-CE2 4.23Å; A335-Y337 HydrophobicContact CB-CG 4.02Å; A335-Y337 PolarHBondContact O-N 3.04Å; Y337-E339 PolarHBondContact O-N 3.34Å; Y337-E339 VanDerWaalsContact O-N 3.15Å; Y337-S340 WeakPolarHBondContact O-CB 3.31Å; Y337-S340 PolarHBondContact O-N 2.82Å; Y337-S340 PolarHBondContact O-OG 3.25Å; Y337-F341 WeakPolarHBondContact O-CD2 3.45Å; Y337-F341 PolarHBondContact O-N 3Å; Y337-F368 HydrophobicContact CD2-CB 4.04Å; Y337-F368 AromaticContact CD2-CD1 3.88Å; Y337-F368 HydrophobicContact CD2-CD1 3.88Å; Y337-F368 AromaticContact CD2-CD2 3.55Å; Y337-F368 HydrophobicContact CD2-CD2 3.55Å; Y337-F368 HydrophobicContact CD2-CE1 4.15Å; Y337-F368 AromaticContact CD2-CE2 3.86Å; Y337-F368 HydrophobicContact CD2-CE2 3.86Å; Y337-F368 AromaticContact CD2-CG 3.56Å; Y337-F368 HydrophobicContact CD2-CG 3.56Å; Y337-F368 HydrophobicContact CD2-CZ 4.13Å; Y337-F368 HydrophobicContact CE2-CB 4.1Å; Y337-F368 AromaticContact CE2-CD1 3.77Å; Y337-F368 HydrophobicContact CE2-CD1 3.77Å; Y337-F368 HydrophobicContact CE2-CD2 4.27Å; Y337-F368 HydrophobicContact CE2-CE1 4.19Å; Y337-F368 AromaticContact CE2-CG 3.81Å; Y337-F368 HydrophobicContact CE2-CG 3.81Å; Y337-F368 HydrophobicContact CG-CD2 4.39Å
338	K	81	Confident	90.2	Very high	169 Å²	169	64 Å²	64	74%	0.735	31%	0.313	S	S	*	.	H	α-helix	trans	-57.7	-29.1	178.9	-172.6	177.1	179.6	-177.9	0	113.3	N342	K338-N342 PolarHBondContact O-N 3Å; K338-N342 PolarHBondContact O-ND2 3.16Å; K338-N342 VanDerWaalsContact O-ND2 3.14Å; K338-N342 PolarHBondContact O-OD1 3.12Å
339	E	75.9	Confident	90.4	Very high	97 Å²	97	61.2 Å²	61.2	45%	0.453	30%	0.303	S	S	.	.	H	α-helix	trans	-60.5	-44.3	173.7	-169.1	178.6	164	0	0	111.3	Y337 K366	Y337-E339 PolarHBondContact O-N 3.34Å; Y337-E339 VanDerWaalsContact O-N 3.15Å; E339-K366 WeakPolarHBondContact OE1-CD 3.45Å; E339-K366 WeakPolarHBondContact OE1-CE 3.38Å; E339-K366 IonicContact OE1-NZ 2.66Å; E339-K366 PolarHBondContact OE1-NZ 2.91Å
340	S	74.1	Confident	90.4	Very high	1 Å²	1	61.5 Å²	61.5	1%	0.007	31%	0.305	C	S	.	.	H	α-helix	trans	-63.1	-53.4	179	-34.1	0	0	0	0	111.7	Y337 N342 T343 I344 K366	Y337-S340 WeakPolarHBondContact O-CB 3.31Å; Y337-S340 PolarHBondContact O-N 2.82Å; Y337-S340 PolarHBondContact O-OG 3.25Å; S340-N342 PolarHBondContact O-N 3.46Å; S340-T343 PolarHBondContact O-N 2.93Å; S340-T343 PolarHBondContact O-OG1 3.06Å; S340-T343 VanDerWaalsContact O-OG1 3.07Å; S340-I344 WeakPolarHBondContact O-CG1 3.25Å; S340-I344 PolarHBondContact O-N 2.86Å; S340-I344 VanDerWaalsContact O-N 3.07Å; S340-K366 VanDerWaalsContact CA-O 3.25Å; S340-K366 WeakPolarHBondContact CA-O 3.36Å; S340-K366 WeakPolarHBondContact CB-O 3.19Å
341	F	79.1	Confident	90.4	Very high	102 Å²	102	60.9 Å²	60.9	45%	0.447	30%	0.304	S	S	.	.	H	α-helix	trans	-62.5	-14.3	-175.2	-73.5	-65.1	0	0	0	115.1	D336 Y337 I347	D336-F341 HydrophobicContact CB-CE2 3.85Å; D336-F341 HydrophobicContact CB-CZ 4.3Å; D336-F341 WeakPolarHBondContact OD1-CZ 3.48Å; Y337-F341 WeakPolarHBondContact O-CD2 3.45Å; Y337-F341 PolarHBondContact O-N 3Å; F341-I347 HydrophobicContact CD1-CD1 3.96Å; F341-I347 HydrophobicContact CE1-CD1 3.49Å; F341-I347 VanDerWaalsContact CE1-CD1 3.49Å; F341-I347 HydrophobicContact CZ-CD1 4.31Å
342	N	83.3	Confident	90.4	Very high	116 Å²	116	63 Å²	63	62%	0.62	31%	0.312	S	S	*	.	H	α-helix	trans	-74.5	-29.3	171.4	-61.9	-29.3	0	0	0	112	K338 S340	K338-N342 PolarHBondContact O-N 3Å; K338-N342 PolarHBondContact O-ND2 3.16Å; K338-N342 VanDerWaalsContact O-ND2 3.14Å; K338-N342 PolarHBondContact O-OD1 3.12Å; S340-N342 PolarHBondContact O-N 3.46Å
343	T	86	Confident	90.4	Very high	30 Å²	30	63 Å²	63	18%	0.184	31%	0.312	C	S	.	.	H	α-helix	trans	-109.5	-15.9	-170.9	67.4	0	0	0	0	113.7	S340 E364 K366	S340-T343 PolarHBondContact O-N 2.93Å; S340-T343 PolarHBondContact O-OG1 3.06Å; S340-T343 VanDerWaalsContact O-OG1 3.07Å; T343-E364 WeakPolarHBondContact CG2-O 3.22Å; T343-K366 PolarHBondContact OG1-N 3.24Å
344	I	92.7	Very high	90.4	Very high	11 Å²	11	61.2 Å²	61.2	6%	0.056	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	148.6	-179.9	78.2	-166.4	0	0	0	112.1	I334 S340 I347 F357 T358 W359 A365 I367	I334-I344 HydrophobicContact CD1-CD1 4.08Å; S340-I344 WeakPolarHBondContact O-CG1 3.25Å; S340-I344 PolarHBondContact O-N 2.86Å; S340-I344 VanDerWaalsContact O-N 3.07Å; I344-I347 HydrophobicContact CD1-CD1 3.65Å; I344-I347 HydrophobicContact CD1-CG1 4.26Å; I344-I347 HydrophobicContact CG1-CD1 3.91Å; I344-I347 HydrophobicContact CG1-CG1 4.22Å; I344-F357 HydrophobicContact CB-CD2 3.97Å; I344-F357 HydrophobicContact CB-CG 4.49Å; I344-F357 HydrophobicContact CG2-CD2 3.81Å; I344-F357 HydrophobicContact CG2-CE2 4.06Å; I344-T358 CarbonylContact C-O 3.46Å; I344-T358 VanDerWaalsContact CA-O 3.27Å; I344-T358 WeakPolarHBondContact CA-O 3.21Å; I344-W359 HydrophobicContact CG2-CB 4.47Å; I344-A365 HydrophobicContact CG2-CB 4.13Å; I344-I367 HydrophobicContact CD1-CG2 3.74Å; I344-I367 HydrophobicContact CG2-CG2 4.02Å
345	G	92.2	Very high	90.5	Very high	28 Å²	28	60.2 Å²	60.2	29%	0.289	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	-176.9	173	0	0	0	0	0	112.4	I347 F357 T358	G345-I347 VanDerWaalsContact C-N 3.29Å; G345-I347 PolarHBondContact O-N 3.35Å; G345-I347 VanDerWaalsContact O-N 3.14Å; G345-F357 WeakPolarHBondContact O-CA 3.27Å; G345-F357 WeakPolarHBondContact O-CB 3.34Å; G345-T358 VanDerWaalsContact C-OG1 3.27Å; G345-T358 PolarHBondContact N-O 3.36Å; G345-T358 PolarHBondContact O-N 2.83Å; G345-T358 PolarHBondContact O-OG1 2.95Å
346	N	92.6	Very high	90.6	Very high	92 Å²	92	59.9 Å²	59.9	49%	0.492	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	45.1	47.8	174.5	-58.8	103.1	0	0	0	114	E348 T358	N346-E348 PolarHBondContact O-N 2.71Å; N346-T358 HydrophobicContact CB-CG2 3.83Å; N346-T358 PolarHBondContact OD1-OG1 3.17Å
347	I	95.1	Very high	91	Very high	58 Å²	58	53.7 Å²	53.7	30%	0.297	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	123	-179.6	-49.8	-175.7	0	0	0	109.1	I334 F341 I344 G345 V355 S356 F357	I334-I347 HydrophobicContact CD1-CD1 4.39Å; I334-I347 HydrophobicContact CG2-CG2 4.17Å; F341-I347 HydrophobicContact CD1-CD1 3.96Å; F341-I347 HydrophobicContact CE1-CD1 3.49Å; F341-I347 VanDerWaalsContact CE1-CD1 3.49Å; F341-I347 HydrophobicContact CZ-CD1 4.31Å; I344-I347 HydrophobicContact CD1-CD1 3.65Å; I344-I347 HydrophobicContact CD1-CG1 4.26Å; I344-I347 HydrophobicContact CG1-CD1 3.91Å; I344-I347 HydrophobicContact CG1-CG1 4.22Å; G345-I347 VanDerWaalsContact C-N 3.29Å; G345-I347 PolarHBondContact O-N 3.35Å; G345-I347 VanDerWaalsContact O-N 3.14Å; I347-V355 HydrophobicContact CG2-CG1 3.81Å; I347-S356 CarbonylContact C-O 3.6Å; I347-S356 WeakPolarHBondContact CA-O 3.48Å; I347-F357 HydrophobicContact CG1-CB 4.22Å
348	E	95.3	Very high	91.3	Very high	86 Å²	86	48.9 Å²	48.9	40%	0.402	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	121	-173.5	-72.7	167	178.1	0	0	110.1	N346 I350 S356	N346-E348 PolarHBondContact O-N 2.71Å; E348-I350 HydrophobicContact CB-CG2 3.81Å; E348-I350 PolarHBondContact O-N 3.39Å; E348-S356 PolarHBondContact N-O 2.9Å; E348-S356 PolarHBondContact O-N 2.81Å; E348-S356 PolarHBondContact OE2-OG 2.74Å
349	E	95.8	Very high	92	Very high	118 Å²	118	41 Å²	41	55%	0.551	21%	0.209	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-80	43.7	-176.5	-94.1	-163.5	-156	0	0	114	R330 A351	R330-E349 WeakPolarHBondContact CD-OE2 3.48Å; R330-E349 IonicContact CZ-OE2 3.4Å; R330-E349 VanDerWaalsContact CZ-OE2 3.26Å; R330-E349 IonicContact NE-OE1 2.76Å; R330-E349 IonicContact NE-OE2 3.26Å; R330-E349 PolarHBondContact NE-OE2 2.99Å; R330-E349 VanDerWaalsContact NH1-CD 3.34Å; R330-E349 PolarHBondContact NH1-O 2.76Å; R330-E349 IonicContact NH1-OE2 2.71Å; R330-E349 PolarHBondContact NH1-OE2 3.48Å; E349-A351 PolarHBondContact O-N 2.89Å
350	I	95.3	Very high	92.7	Very high	62 Å²	62	38 Å²	38	32%	0.318	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-52.2	-20.3	-162.2	65.8	166.9	0	0	0	117.2	V299 E348 A354 L480	V299-I350 HydrophobicContact CG1-CD1 3.7Å; V299-I350 HydrophobicContact CG2-CD1 4.34Å; E348-I350 HydrophobicContact CB-CG2 3.81Å; E348-I350 PolarHBondContact O-N 3.39Å; I350-A354 HydrophobicContact CD1-CB 4.36Å; I350-A354 HydrophobicContact CG1-CB 4.04Å; I350-L480 HydrophobicContact CD1-CD1 4.27Å
351	A	97.4	Very high	93.5	Very high	3 Å²	3	38.4 Å²	38.4	3%	0.025	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	163.9	169.8	0	0	0	0	0	110.6	R330 E349 N353 A354 L480 I482	R330-A351 PolarHBondContact NH1-O 3.28Å; R330-A351 PolarHBondContact NH2-O 3.13Å; E349-A351 PolarHBondContact O-N 2.89Å; A351-N353 PolarHBondContact O-N 2.93Å; A351-N353 VanDerWaalsContact O-N 3.14Å; A351-A354 HydrophobicContact CB-CB 4.08Å; A351-A354 PolarHBondContact N-O 3.06Å; A351-A354 PolarHBondContact O-N 3.45Å; A351-A354 VanDerWaalsContact O-N 3.13Å; A351-L480 HydrophobicContact CB-CB 3.88Å; A351-L480 HydrophobicContact CB-CD2 4.19Å; A351-L480 HydrophobicContact CB-CG 4.42Å; A351-I482 HydrophobicContact CB-CG1 4.1Å
352	Y	97.8	Very high	93.9	Very high	45 Å²	45	38.5 Å²	38.5	18%	0.176	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-22.4	176.4	-87.1	54.8	0	0	0	112.5	H321 A327 Q329 R330 V331 L332 F481 P483	H321-Y352 AromaticContact NE2-CE2 3.66Å; A327-Y352 WeakPolarHBondContact O-CE2 3.48Å; A327-Y352 PolarHBondContact O-OH 3.03Å; Q329-Y352 WeakPolarHBondContact O-CD2 3.15Å; R330-Y352 HydrophobicContact CB-CD2 4.46Å; R330-Y352 HydrophobicContact CG-CD2 4.19Å; R330-Y352 HydrophobicContact CG-CE2 4.44Å; R330-Y352 HydrophobicContact CG-CG 4.4Å; V331-Y352 WeakPolarHBondContact CA-O 3.37Å; V331-Y352 WeakPolarHBondContact CB-O 3.35Å; V331-Y352 PolarHBondContact N-O 3.08Å; L332-Y352 PolarHBondContact N-O 3.21Å; L332-Y352 VanDerWaalsContact N-O 3.15Å; Y352-F481 WeakPolarHBondContact CB-O 3.39Å; Y352-F481 HydrophobicContact CG-CD1 4.45Å; Y352-F481 PolarHBondContact N-O 3.15Å; Y352-P483 HydrophobicContact CD1-CG 3.96Å; Y352-P483 HydrophobicContact CD2-CG 4.12Å; Y352-P483 VanDerWaalsContact CE1-CD 3.45Å; Y352-P483 HydrophobicContact CE1-CG 3.79Å; Y352-P483 HydrophobicContact CE2-CG 3.98Å; Y352-P483 HydrophobicContact CG-CG 4.13Å
353	N	98.1	Very high	94.2	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.4	11.3	176.3	70.3	-44.7	0	0	0	114.5	M301 V302 W317 V331 A351 V479 F481	M301-N353 CarbonylContact C-O 3.53Å; M301-N353 WeakPolarHBondContact CA-O 3.25Å; M301-N353 WeakPolarHBondContact CB-O 3.46Å; V302-N353 PolarHBondContact N-O 3.18Å; V302-N353 PolarHBondContact O-ND2 2.56Å; W317-N353 HydrophobicContact CZ2-CB 4.42Å; V331-N353 HydrophobicContact CB-CB 3.97Å; V331-N353 HydrophobicContact CG1-CB 4.16Å; V331-N353 HydrophobicContact CG2-CB 4.31Å; A351-N353 PolarHBondContact O-N 2.93Å; A351-N353 VanDerWaalsContact O-N 3.14Å; N353-V479 PolarHBondContact ND2-O 2.73Å; N353-F481 PolarHBondContact OD1-N 3.06Å
354	A	98.3	Very high	94.5	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	148.3	179.2	0	0	0	0	0	113.5	V299 V300 M301 R330 I350 A351 L480	V299-A354 HydrophobicContact CG1-CB 4.18Å; V300-A354 CarbonylContact O-C 3.56Å; V300-A354 WeakPolarHBondContact O-CA 3.44Å; M301-A354 HydrophobicContact CB-CB 3.7Å; R330-A354 PolarHBondContact NH2-O 3.16Å; I350-A354 HydrophobicContact CD1-CB 4.36Å; I350-A354 HydrophobicContact CG1-CB 4.04Å; A351-A354 HydrophobicContact CB-CB 4.08Å; A351-A354 PolarHBondContact N-O 3.06Å; A351-A354 PolarHBondContact O-N 3.45Å; A351-A354 VanDerWaalsContact O-N 3.13Å; A354-L480 HydrophobicContact CB-CD2 3.69Å
355	V	98.3	Very high	94.6	Very high	3 Å²	3	41.3 Å²	41.3	2%	0.018	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	132	172.3	-179.1	0	0	0	0	108.4	V299 V300 L332 I334 I347	V299-V355 WeakPolarHBondContact CA-O 3.4Å; V300-V355 PolarHBondContact N-O 3.28Å; V300-V355 PolarHBondContact O-N 2.99Å; L332-V355 HydrophobicContact CD2-CG2 4.32Å; L332-V355 HydrophobicContact CG-CG2 4.36Å; I334-V355 HydrophobicContact CD1-CG1 4.41Å; I334-V355 HydrophobicContact CG2-CG1 4.23Å; I347-V355 HydrophobicContact CG2-CG1 3.81Å
356	S	97.3	Very high	94.8	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	144.3	174.8	165.2	0	0	0	0	109.4	R297 S298 I347 E348	R297-S356 WeakPolarHBondContact CD-OG 3.36Å; S298-S356 WeakPolarHBondContact O-CA 3.35Å; I347-S356 CarbonylContact C-O 3.6Å; I347-S356 WeakPolarHBondContact CA-O 3.48Å; E348-S356 PolarHBondContact N-O 2.9Å; E348-S356 PolarHBondContact O-N 2.81Å; E348-S356 PolarHBondContact OE2-OG 2.74Å
357	F	96.9	Very high	95	Very high	1 Å²	1	37.7 Å²	37.7	0%	0.004	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	160.9	171	57.2	-88.9	0	0	0	111	L280 R297 S298 V300 I344 G345 I347 W359 I367	L280-F357 HydrophobicContact CD1-CE2 4.26Å; L280-F357 HydrophobicContact CD1-CZ 3.89Å; L280-F357 HydrophobicContact CD2-CE2 4.36Å; L280-F357 HydrophobicContact CD2-CZ 4.02Å; R297-F357 CarbonylContact C-O 3.54Å; R297-F357 WeakPolarHBondContact CA-O 3.4Å; R297-F357 WeakPolarHBondContact CG-O 3.45Å; S298-F357 PolarHBondContact N-O 3.04Å; S298-F357 PolarHBondContact O-N 3.47Å; V300-F357 HydrophobicContact CB-CE1 4.49Å; V300-F357 HydrophobicContact CG2-CE1 3.66Å; V300-F357 HydrophobicContact CG2-CZ 4.03Å; I344-F357 HydrophobicContact CB-CD2 3.97Å; I344-F357 HydrophobicContact CB-CG 4.49Å; I344-F357 HydrophobicContact CG2-CD2 3.81Å; I344-F357 HydrophobicContact CG2-CE2 4.06Å; G345-F357 WeakPolarHBondContact O-CA 3.27Å; G345-F357 WeakPolarHBondContact O-CB 3.34Å; I347-F357 HydrophobicContact CG1-CB 4.22Å; F357-W359 AromaticContact CD2-CD1 3.96Å; F357-W359 AromaticContact CE2-CD1 3.67Å; F357-W359 HydrophobicContact CE2-CG 4.42Å; F357-I367 HydrophobicContact CE1-CD1 3.75Å; F357-I367 HydrophobicContact CE1-CG2 3.98Å; F357-I367 HydrophobicContact CE2-CG2 4.02Å; F357-I367 HydrophobicContact CZ-CD1 3.95Å; F357-I367 HydrophobicContact CZ-CG2 3.72Å
358	T	95.4	Very high	95.1	Very high	4 Å²	4	36.2 Å²	36.2	3%	0.025	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	150.7	171.7	58.9	0	0	0	0	111.2	V296 R297 I344 G345 N346 Y398	V296-T358 VanDerWaalsContact O-CA 3.25Å; V296-T358 WeakPolarHBondContact O-CA 3.42Å; R297-T358 HydrophobicContact CB-CG2 4.23Å; R297-T358 HydrophobicContact CG-CG2 4.28Å; I344-T358 CarbonylContact C-O 3.46Å; I344-T358 VanDerWaalsContact CA-O 3.27Å; I344-T358 WeakPolarHBondContact CA-O 3.21Å; G345-T358 VanDerWaalsContact C-OG1 3.27Å; G345-T358 PolarHBondContact N-O 3.36Å; G345-T358 PolarHBondContact O-N 2.83Å; G345-T358 PolarHBondContact O-OG1 2.95Å; N346-T358 HydrophobicContact CB-CG2 3.83Å; N346-T358 PolarHBondContact OD1-OG1 3.17Å; T358-Y398 HydrophobicContact CG2-CD2 3.77Å; T358-Y398 HydrophobicContact CG2-CE2 3.63Å
359	W	95	Very high	95.2	Very high	5 Å²	5	32.3 Å²	32.3	2%	0.019	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	169.3	173.8	59.9	-77.2	0	0	0	111.3	F248 L280 K295 V296 S298 I344 F357 V361 A365	F248-W359 AromaticContact CD1-CH2 3.95Å; F248-W359 HydrophobicContact CD1-CH2 3.95Å; F248-W359 HydrophobicContact CD1-CZ2 4.04Å; F248-W359 HydrophobicContact CE1-CH2 4.07Å; F248-W359 HydrophobicContact CE1-CZ2 4.12Å; L280-W359 HydrophobicContact CB-CH2 4.08Å; L280-W359 HydrophobicContact CB-CZ2 3.81Å; L280-W359 HydrophobicContact CD2-CZ2 4.36Å; K295-W359 WeakPolarHBondContact CA-O 3.35Å; V296-W359 HydrophobicContact CG2-CD2 3.77Å; V296-W359 VanDerWaalsContact CG2-CE2 3.41Å; V296-W359 HydrophobicContact CG2-CE3 4.43Å; V296-W359 HydrophobicContact CG2-CG 4.07Å; V296-W359 HydrophobicContact CG2-CH2 4.43Å; V296-W359 HydrophobicContact CG2-CZ2 3.78Å; V296-W359 PolarHBondContact N-O 3.46Å; V296-W359 PolarHBondContact O-N 2.86Å; S298-W359 PolarHBondContact OG-NE1 2.96Å; I344-W359 HydrophobicContact CG2-CB 4.47Å; F357-W359 AromaticContact CD2-CD1 3.96Å; F357-W359 AromaticContact CE2-CD1 3.67Å; F357-W359 HydrophobicContact CE2-CG 4.42Å; W359-V361 HydrophobicContact CH2-CG1 4.43Å; W359-V361 HydrophobicContact CZ3-CG1 4.36Å; W359-A365 HydrophobicContact CB-CB 3.49Å; W359-A365 VanDerWaalsContact CB-CB 3.49Å; W359-A365 HydrophobicContact CD2-CB 3.48Å; W359-A365 VanDerWaalsContact CD2-CB 3.48Å; W359-A365 HydrophobicContact CE3-CB 3.52Å; W359-A365 HydrophobicContact CG-CB 3.49Å; W359-A365 VanDerWaalsContact CG-CB 3.49Å; W359-A365 HydrophobicContact CZ3-CB 4.39Å
360	D	91.3	Very high	95.4	Very high	33 Å²	33	26.9 Å²	26.9	18%	0.176	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	125.4	-179.1	-163.7	-66.5	0	0	0	111	S294 N362 E363	S294-D360 VanDerWaalsContact CB-OD1 3.27Å; S294-D360 WeakPolarHBondContact CB-OD1 3.38Å; S294-D360 VanDerWaalsContact CB-OD2 3.25Å; S294-D360 WeakPolarHBondContact CB-OD2 3.45Å; S294-D360 PolarHBondContact OG-OD2 3.34Å; D360-N362 PolarHBondContact O-N 2.7Å; D360-N362 VanDerWaalsContact O-N 3.14Å; D360-N362 WeakPolarHBondContact OD1-CB 3.39Å; D360-N362 PolarHBondContact OD1-N 3.23Å; D360-N362 PolarHBondContact OD1-ND2 2.82Å; D360-E363 PolarHBondContact O-N 2.88Å
361	V	90.3	Very high	95.5	Very high	10 Å²	10	24.1 Å²	24.1	6%	0.061	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-12.1	-174.4	-58.6	0	0	0	0	114.9	F248 E282 S294 V296 W359 E363	F248-V361 HydrophobicContact CE1-CG1 3.91Å; F248-V361 HydrophobicContact CZ-CG1 4.38Å; E282-V361 HydrophobicContact CB-CB 3.94Å; E282-V361 HydrophobicContact CB-CG1 4.44Å; E282-V361 WeakPolarHBondContact OE2-CB 3.38Å; E282-V361 VanDerWaalsContact OE2-CG2 3.27Å; E282-V361 WeakPolarHBondContact OE2-CG2 3.41Å; S294-V361 WeakPolarHBondContact O-CG1 3.32Å; S294-V361 WeakPolarHBondContact O-CG2 3.33Å; S294-V361 PolarHBondContact O-N 2.92Å; V296-V361 HydrophobicContact CB-CG1 4.41Å; V296-V361 HydrophobicContact CG1-CG1 3.77Å; V296-V361 HydrophobicContact CG2-CG1 3.74Å; W359-V361 HydrophobicContact CH2-CG1 4.43Å; W359-V361 HydrophobicContact CZ3-CG1 4.36Å; V361-E363 VanDerWaalsContact C-N 3.33Å
362	N	87.9	Confident	95.5	Very high	103 Å²	103	24.3 Å²	24.3	55%	0.551	12%	0.117	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-21	173.6	-58.3	-73.6	0	0	0	112.3	S294 D360	S294-N362 WeakPolarHBondContact CB-ND2 3.46Å; D360-N362 PolarHBondContact O-N 2.7Å; D360-N362 VanDerWaalsContact O-N 3.14Å; D360-N362 WeakPolarHBondContact OD1-CB 3.39Å; D360-N362 PolarHBondContact OD1-N 3.23Å; D360-N362 PolarHBondContact OD1-ND2 2.82Å
363	E	89.8	Confident	95.5	Very high	108 Å²	108	22.1 Å²	22.1	51%	0.505	11%	0.109	S	C	.	.	S	Bend	trans	-105.6	164	-179.7	-63.5	-173.5	-176.5	0	0	111.3	D360 V361	D360-E363 PolarHBondContact O-N 2.88Å; V361-E363 VanDerWaalsContact C-N 3.33Å
364	E	92	Very high	95.5	Very high	108 Å²	108	23.4 Å²	23.4	51%	0.505	12%	0.115	S	C	.	.			trans	-89	111.3	169.8	-170.2	-174.9	130.5	0	0	108.9	T279 T343	T279-E364 WeakPolarHBondContact CB-OE1 3.3Å; T279-E364 VanDerWaalsContact CG2-CD 3.43Å; T279-E364 HydrophobicContact CG2-CG 3.57Å; T279-E364 WeakPolarHBondContact CG2-OE1 3.39Å; T279-E364 PolarHBondContact OG1-OE1 2.88Å; T343-E364 WeakPolarHBondContact CG2-O 3.22Å
365	A	95	Very high	95.4	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	120.9	178	0	0	0	0	0	110.2	T279 L280 I344 W359	T279-A365 CarbonylContact C-O 3.53Å; T279-A365 WeakPolarHBondContact CA-O 3.45Å; L280-A365 HydrophobicContact CB-CB 4.29Å; L280-A365 WeakPolarHBondContact CD1-O 3.47Å; L280-A365 PolarHBondContact N-O 2.88Å; L280-A365 PolarHBondContact O-N 2.89Å; I344-A365 HydrophobicContact CG2-CB 4.13Å; W359-A365 HydrophobicContact CB-CB 3.49Å; W359-A365 VanDerWaalsContact CB-CB 3.49Å; W359-A365 HydrophobicContact CD2-CB 3.48Å; W359-A365 VanDerWaalsContact CD2-CB 3.48Å; W359-A365 HydrophobicContact CE3-CB 3.52Å; W359-A365 HydrophobicContact CG-CB 3.49Å; W359-A365 VanDerWaalsContact CG-CB 3.49Å; W359-A365 HydrophobicContact CZ3-CB 4.39Å
366	K	95.8	Very high	95.3	Very high	43 Å²	43	26.4 Å²	26.4	19%	0.187	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	125.3	-174.7	-167.5	172.9	177.4	-173.3	0	110.8	E339 S340 T343 F368	E339-K366 WeakPolarHBondContact OE1-CD 3.45Å; E339-K366 WeakPolarHBondContact OE1-CE 3.38Å; E339-K366 IonicContact OE1-NZ 2.66Å; E339-K366 PolarHBondContact OE1-NZ 2.91Å; S340-K366 VanDerWaalsContact CA-O 3.25Å; S340-K366 WeakPolarHBondContact CA-O 3.36Å; S340-K366 WeakPolarHBondContact CB-O 3.19Å; T343-K366 PolarHBondContact OG1-N 3.24Å; K366-F368 HydrophobicContact CD-CE2 4.45Å; K366-F368 HydrophobicContact CG-CE2 4.25Å
367	I	97.1	Very high	95.2	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.005	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	158.5	177.4	72.3	174.8	0	0	0	109.7	A277 I278 V300 I334 I344 F357 I369	A277-I367 CarbonylContact C-O 3.56Å; A277-I367 WeakPolarHBondContact CA-O 3.48Å; I278-I367 HydrophobicContact CB-CD1 4.2Å; I278-I367 HydrophobicContact CB-CG1 3.74Å; I278-I367 HydrophobicContact CG2-CD1 4.44Å; I278-I367 HydrophobicContact CG2-CG1 4.29Å; I278-I367 PolarHBondContact N-O 2.85Å; I278-I367 PolarHBondContact O-N 2.87Å; V300-I367 HydrophobicContact CB-CD1 4.39Å; V300-I367 HydrophobicContact CG1-CD1 4.44Å; V300-I367 HydrophobicContact CG2-CD1 3.84Å; I334-I367 HydrophobicContact CD1-CB 4.04Å; I334-I367 HydrophobicContact CD1-CG2 4.15Å; I344-I367 HydrophobicContact CD1-CG2 3.74Å; I344-I367 HydrophobicContact CG2-CG2 4.02Å; F357-I367 HydrophobicContact CE1-CD1 3.75Å; F357-I367 HydrophobicContact CE1-CG2 3.98Å; F357-I367 HydrophobicContact CE2-CG2 4.02Å; F357-I367 HydrophobicContact CZ-CD1 3.95Å; F357-I367 HydrophobicContact CZ-CG2 3.72Å; I367-I369 HydrophobicContact CD1-CG2 3.76Å; I367-I369 HydrophobicContact CG1-CG2 4.17Å
368	F	97.4	Very high	95.1	Very high	28 Å²	28	28.2 Å²	28.2	12%	0.123	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	122.3	172.3	-65.2	-104	0	0	0	108.1	Y276 A277 I334 A335 Y337 K366	Y276-F368 WeakPolarHBondContact O-CA 3.11Å; A277-F368 HydrophobicContact CB-CD1 3.92Å; A277-F368 HydrophobicContact CB-CE1 3.8Å; A277-F368 HydrophobicContact CB-CZ 4.35Å; I334-F368 CarbonylContact C-O 3.51Å; I334-F368 WeakPolarHBondContact CA-O 3.14Å; A335-F368 HydrophobicContact CB-CB 3.93Å; A335-F368 PolarHBondContact N-O 3.37Å; Y337-F368 HydrophobicContact CD2-CB 4.04Å; Y337-F368 AromaticContact CD2-CD1 3.88Å; Y337-F368 HydrophobicContact CD2-CD1 3.88Å; Y337-F368 AromaticContact CD2-CD2 3.55Å; Y337-F368 HydrophobicContact CD2-CD2 3.55Å; Y337-F368 HydrophobicContact CD2-CE1 4.15Å; Y337-F368 AromaticContact CD2-CE2 3.86Å; Y337-F368 HydrophobicContact CD2-CE2 3.86Å; Y337-F368 AromaticContact CD2-CG 3.56Å; Y337-F368 HydrophobicContact CD2-CG 3.56Å; Y337-F368 HydrophobicContact CD2-CZ 4.13Å; Y337-F368 HydrophobicContact CE2-CB 4.1Å; Y337-F368 AromaticContact CE2-CD1 3.77Å; Y337-F368 HydrophobicContact CE2-CD1 3.77Å; Y337-F368 HydrophobicContact CE2-CD2 4.27Å; Y337-F368 HydrophobicContact CE2-CE1 4.19Å; Y337-F368 AromaticContact CE2-CG 3.81Å; Y337-F368 HydrophobicContact CE2-CG 3.81Å; Y337-F368 HydrophobicContact CG-CD2 4.39Å; K366-F368 HydrophobicContact CD-CE2 4.45Å; K366-F368 HydrophobicContact CG-CE2 4.25Å
369	I	97.9	Very high	94.8	Very high	4 Å²	4	30.4 Å²	30.4	2%	0.021	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	151.7	-175.2	59.5	149.5	0	0	0	112.6	F275 Y276 I278 L332 D333 I367 I391	F275-I369 CarbonylContact C-O 3.55Å; F275-I369 VanDerWaalsContact CA-O 3.3Å; F275-I369 WeakPolarHBondContact CA-O 3.26Å; Y276-I369 PolarHBondContact N-O 2.92Å; Y276-I369 PolarHBondContact O-N 3.09Å; I278-I369 HydrophobicContact CD1-CD1 3.5Å; I278-I369 HydrophobicContact CD1-CG1 3.84Å; I278-I369 HydrophobicContact CG1-CD1 4.43Å; I278-I369 HydrophobicContact CG1-CG1 4.31Å; L332-I369 HydrophobicContact CD1-CB 3.87Å; L332-I369 HydrophobicContact CD1-CD1 3.74Å; L332-I369 HydrophobicContact CD1-CG1 4.43Å; L332-I369 HydrophobicContact CD1-CG2 4.18Å; D333-I369 VanDerWaalsContact O-CA 3.25Å; D333-I369 WeakPolarHBondContact O-CA 3.27Å; I367-I369 HydrophobicContact CD1-CG2 3.76Å; I367-I369 HydrophobicContact CG1-CG2 4.17Å; I369-I391 HydrophobicContact CD1-CD1 3.91Å
370	T	98.1	Very high	94.4	Very high	4 Å²	4	34.4 Å²	34.4	3%	0.025	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	142.4	166.3	172.8	0	0	0	0	110.5	G273 F275 D333 N372	G273-T370 WeakPolarHBondContact CA-OG1 3.48Å; G273-T370 PolarHBondContact N-OG1 3.41Å; F275-T370 HydrophobicContact CD1-CG2 4.1Å; F275-T370 HydrophobicContact CE1-CG2 3.55Å; F275-T370 HydrophobicContact CE2-CG2 4.47Å; F275-T370 HydrophobicContact CZ-CG2 3.77Å; D333-T370 HydrophobicContact CB-CG2 3.73Å; D333-T370 PolarHBondContact N-O 2.86Å; D333-T370 PolarHBondContact O-N 3.01Å; T370-N372 PolarHBondContact OG1-OD1 3.23Å; T370-N372 VanDerWaalsContact OG1-OD1 3.12Å
371	V	98.5	Very high	94.3	Very high	3 Å²	3	39.3 Å²	39.3	2%	0.018	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	123.9	171.5	-175.3	0	0	0	0	109	L270 K272 V302 V331 L332 I413 V415	L270-V371 HydrophobicContact CD1-CG2 4.1Å; K272-V371 WeakPolarHBondContact CA-O 3.39Å; V302-V371 HydrophobicContact CG1-CG1 4.29Å; V302-V371 HydrophobicContact CG2-CG1 4.1Å; V302-V371 HydrophobicContact CG2-CG2 3.91Å; V331-V371 WeakPolarHBondContact O-CA 3.35Å; L332-V371 HydrophobicContact CD1-CG2 4.47Å; V371-I413 HydrophobicContact CG1-CD1 4.3Å; V371-I413 HydrophobicContact CG2-CD1 4.16Å; V371-V415 HydrophobicContact CB-CG2 4.22Å; V371-V415 HydrophobicContact CG1-CG2 3.84Å
372	N	98	Very high	94	Very high	7 Å²	7	48.6 Å²	48.6	4%	0.037	25%	0.249	C	C	.	.			trans	-104.6	-0.1	-168	-63.2	-35.4	0	0	0	114.5	K272 W320 Q329 R330 V331 D333 T370	K272-N372 WeakPolarHBondContact CE-O 3.44Å; K272-N372 PolarHBondContact NZ-O 3.12Å; W320-N372 HydrophobicContact CZ2-CB 4.44Å; Q329-N372 PolarHBondContact NE2-ND2 3.15Å; Q329-N372 VanDerWaalsContact NE2-ND2 3.19Å; R330-N372 VanDerWaalsContact O-CB 3.26Å; R330-N372 WeakPolarHBondContact O-CB 3.43Å; R330-N372 PolarHBondContact O-ND2 2.83Å; V331-N372 PolarHBondContact O-N 3.14Å; D333-N372 PolarHBondContact OD2-ND2 3.22Å; T370-N372 PolarHBondContact OG1-OD1 3.23Å; T370-N372 VanDerWaalsContact OG1-OD1 3.12Å
373	C	97.8	Very high	93.7	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	27%	0.265	C	S	.	.			trans	-100.4	135.4	169.7	62.1	0	0	0	0	111	W320 V331 F378 V415	W320-C373 HydrophobicContact CD2-CB 4.43Å; W320-C373 HydrophobicContact CG-CB 4.34Å; W320-C373 HydrophobicContact CZ2-CB 4.44Å; W320-C373 VanDerWaalsContact NE1-CB 3.27Å; V331-C373 HydrophobicContact CG1-CB 4.4Å; C373-F378 HydrophobicContact CB-CZ 3.87Å; C373-V415 WeakPolarHBondContact O-CB 3.43Å; C373-V415 VanDerWaalsContact O-CG1 3.23Å; C373-V415 WeakPolarHBondContact O-CG1 3.43Å
374	L	97.3	Very high	93.5	Very high	27 Å²	27	45 Å²	45	14%	0.141	26%	0.255	C	S	.	.			trans	-75.6	147.5	163.6	-53.8	179.9	0	0	0	108.9	K272 T376 D377 F378 V415 C417	K272-L374 HydrophobicContact CB-CD2 3.77Å; K272-L374 HydrophobicContact CD-CD2 4.09Å; K272-L374 HydrophobicContact CD-CG 4.36Å; K272-L374 HydrophobicContact CG-CD2 4.33Å; L374-T376 PolarHBondContact O-N 3.44Å; L374-D377 HydrophobicContact CB-CB 4.48Å; L374-D377 WeakPolarHBondContact CB-OD1 3.43Å; L374-D377 PolarHBondContact N-OD2 3.19Å; L374-D377 PolarHBondContact O-N 3.34Å; L374-F378 WeakPolarHBondContact O-CE2 3.5Å; L374-V415 HydrophobicContact CD2-CG1 4.44Å; L374-C417 HydrophobicContact CD1-CB 4.33Å; L374-C417 HydrophobicContact CD2-CB 4.26Å
375	S	95.8	Very high	93.1	Very high	2 Å²	2	49.1 Å²	49.1	1%	0.014	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-16.2	172.8	-59.2	0	0	0	0	113.2	G386 L387 V415	S375-G386 CarbonylContact O-C 3.53Å; S375-G386 VanDerWaalsContact O-C 3.3Å; S375-G386 WeakPolarHBondContact O-CA 3.49Å; S375-L387 PolarHBondContact O-N 2.82Å; S375-V415 PolarHBondContact N-O 2.93Å; S375-V415 PolarHBondContact OG-N 3.14Å; S375-V415 VanDerWaalsContact OG-N 3.11Å
376	T	95.8	Very high	92.8	Very high	63 Å²	63	50 Å²	50	39%	0.387	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-10.6	177.4	46.5	0	0	0	0	115	L374 F378	L374-T376 PolarHBondContact O-N 3.44Å; T376-F378 PolarHBondContact O-N 3.49Å; T376-F378 VanDerWaalsContact O-N 3.16Å
377	D	95.8	Very high	92.7	Very high	30 Å²	30	49.5 Å²	49.5	16%	0.16	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-16.8	-171	-72.2	-19	0	0	0	114.1	Y319 L374 S379	Y319-D377 WeakPolarHBondContact CE1-O 3.32Å; L374-D377 HydrophobicContact CB-CB 4.48Å; L374-D377 WeakPolarHBondContact CB-OD1 3.43Å; L374-D377 PolarHBondContact N-OD2 3.19Å; L374-D377 PolarHBondContact O-N 3.34Å; D377-S379 PolarHBondContact O-N 2.74Å
378	F	94.9	Very high	92.5	Very high	10 Å²	10	51.3 Å²	51.3	4%	0.044	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	6.1	-175.7	-50.8	-73.3	0	0	0	114.4	F304 Y316 W317 W320 C373 L374 T376 L387 L389	F304-F378 HydrophobicContact CE1-CD1 4.15Å; F304-F378 HydrophobicContact CE1-CD2 4.05Å; F304-F378 HydrophobicContact CE1-CE1 4.02Å; F304-F378 AromaticContact CE1-CE2 3.92Å; F304-F378 HydrophobicContact CE1-CE2 3.92Å; F304-F378 HydrophobicContact CE1-CG 4.15Å; F304-F378 AromaticContact CE1-CZ 3.89Å; F304-F378 HydrophobicContact CE1-CZ 3.89Å; F304-F378 AromaticContact CZ-CD1 3.9Å; F304-F378 HydrophobicContact CZ-CD1 3.9Å; F304-F378 AromaticContact CZ-CE1 3.7Å; F304-F378 HydrophobicContact CZ-CE1 3.7Å; F304-F378 HydrophobicContact CZ-CE2 4.44Å; F304-F378 HydrophobicContact CZ-CG 4.34Å; F304-F378 AromaticContact CZ-CZ 3.99Å; F304-F378 HydrophobicContact CZ-CZ 3.99Å; Y316-F378 HydrophobicContact CD1-CB 4.31Å; Y316-F378 HydrophobicContact CG-CB 4.39Å; W317-F378 AromaticContact CE3-CE1 3.8Å; W317-F378 HydrophobicContact CE3-CE1 3.8Å; W317-F378 HydrophobicContact CE3-CZ 4.34Å; W317-F378 HydrophobicContact CH2-CE1 4.32Å; W317-F378 HydrophobicContact CH2-CZ 4.08Å; W317-F378 AromaticContact CZ3-CE1 3.61Å; W317-F378 HydrophobicContact CZ3-CE1 3.61Å; W317-F378 AromaticContact CZ3-CZ 3.68Å; W317-F378 HydrophobicContact CZ3-CZ 3.68Å; W320-F378 HydrophobicContact CB-CD1 3.98Å; W320-F378 HydrophobicContact CB-CE1 3.81Å; W320-F378 HydrophobicContact CG-CE1 4.16Å; C373-F378 HydrophobicContact CB-CZ 3.87Å; L374-F378 WeakPolarHBondContact O-CE2 3.5Å; T376-F378 PolarHBondContact O-N 3.49Å; T376-F378 VanDerWaalsContact O-N 3.16Å; F378-L387 HydrophobicContact CB-CD1 3.51Å; F378-L387 HydrophobicContact CB-CG 4.15Å; F378-L387 HydrophobicContact CD2-CB 4.17Å; F378-L387 HydrophobicContact CD2-CD1 3.97Å; F378-L387 HydrophobicContact CD2-CG 4.28Å; F378-L387 HydrophobicContact CG-CD1 3.84Å; F378-L389 HydrophobicContact CE2-CD1 4.13Å; F378-L389 HydrophobicContact CE2-CD2 3.99Å; F378-L389 HydrophobicContact CE2-CG 4.35Å; F378-L389 HydrophobicContact CZ-CD1 4.49Å; F378-L389 HydrophobicContact CZ-CD2 4.11Å
379	S	88.7	Confident	92.5	Very high	49 Å²	49	50 Å²	50	34%	0.343	29%	0.285	S	S	.	.			trans	-150.6	146	172.9	-179.8	0	0	0	0	111.2	D377 Q381	D377-S379 PolarHBondContact O-N 2.74Å; S379-Q381 VanDerWaalsContact C-N 3.29Å; S379-Q381 WeakPolarHBondContact OG-CB 3.41Å; S379-Q381 PolarHBondContact OG-N 3.08Å; S379-Q381 VanDerWaalsContact OG-N 3.14Å
380	S	87.1	Confident	92.4	Very high	90 Å²	90	50.4 Å²	50.4	63%	0.629	29%	0.287	S	S	*	.			trans	-78.8	-9.9	170.4	39.7	0	0	0	0	113.6	Y319 K382	Y319-S380 VanDerWaalsContact OH-CB 3.23Å; Y319-S380 WeakPolarHBondContact OH-CB 3.38Å; Y319-S380 PolarHBondContact OH-N 3.21Å; Y319-S380 PolarHBondContact OH-OG 2.87Å; S380-K382 PolarHBondContact O-N 3.38Å
381	Q	88.8	Confident	92.4	Very high	135 Å²	135	50.2 Å²	50.2	63%	0.631	29%	0.286	S	S	*	.			trans	-71.1	117.8	-176.7	-172.5	-179.3	17.5	0	0	110.8	S379 V384	S379-Q381 VanDerWaalsContact C-N 3.29Å; S379-Q381 WeakPolarHBondContact OG-CB 3.41Å; S379-Q381 PolarHBondContact OG-N 3.08Å; S379-Q381 VanDerWaalsContact OG-N 3.14Å; Q381-V384 HydrophobicContact CB-CG1 3.71Å; Q381-V384 HydrophobicContact CG-CG1 3.78Å; Q381-V384 WeakPolarHBondContact O-CG1 3.4Å; Q381-V384 WeakPolarHBondContact O-CG2 3.05Å
382	K	84.8	Confident	92.4	Very high	206 Å²	206	50.6 Å²	50.6	90%	0.896	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	144.6	176.3	-65	-178.4	179.7	178.9	0	110.7	S380 V384	S380-K382 PolarHBondContact O-N 3.38Å; K382-V384 PolarHBondContact O-N 3.2Å
383	G	80.4	Confident	92.4	Very high	87 Å²	87	50.3 Å²	50.3	90%	0.897	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.3	2.1	176	0	0	0	0	0	116.1
384	V	86	Confident	92.4	Very high	47 Å²	47	50.3 Å²	50.3	29%	0.285	29%	0.286	S	S	.	.			trans	-65.8	149.4	177.8	-64.5	0	0	0	0	113	Q381 K382 G386	Q381-V384 HydrophobicContact CB-CG1 3.71Å; Q381-V384 HydrophobicContact CG-CG1 3.78Å; Q381-V384 WeakPolarHBondContact O-CG1 3.4Å; Q381-V384 WeakPolarHBondContact O-CG2 3.05Å; K382-V384 PolarHBondContact O-N 3.2Å; V384-G386 PolarHBondContact O-N 3.43Å; V384-G386 VanDerWaalsContact O-N 3.12Å
385	K	84.4	Confident	92.3	Very high	195 Å²	195	49 Å²	49	85%	0.848	28%	0.279	S	S	*	.			trans	-58.8	-22.1	177.4	-172.4	-178.6	173.2	-165.2	0	113.6	K414	K385-K414 PolarHBondContact O-NZ 3.05Å
386	G	89.3	Confident	92.2	Very high	18 Å²	18	50.5 Å²	50.5	19%	0.186	29%	0.285	C	S	.	.			trans	78.2	146.5	-169.1	0	0	0	0	0	112.3	S375 V384	S375-G386 CarbonylContact O-C 3.53Å; S375-G386 VanDerWaalsContact O-C 3.3Å; S375-G386 WeakPolarHBondContact O-CA 3.49Å; V384-G386 PolarHBondContact O-N 3.43Å; V384-G386 VanDerWaalsContact O-N 3.12Å
387	L	93.2	Very high	91.8	Very high	34 Å²	34	49.5 Å²	49.5	18%	0.178	28%	0.28	C	S	.	.			trans	-68.7	148	176.8	-63	-175.6	0	0	0	110.8	F304 Y316 S375 F378	F304-L387 HydrophobicContact CD1-CB 4.27Å; F304-L387 HydrophobicContact CD1-CD1 4.11Å; F304-L387 HydrophobicContact CE1-CB 4.28Å; F304-L387 HydrophobicContact CE1-CD1 3.68Å; F304-L387 HydrophobicContact CZ-CD1 4.44Å; Y316-L387 HydrophobicContact CD1-CD1 4.17Å; Y316-L387 HydrophobicContact CD2-CD1 3.46Å; Y316-L387 VanDerWaalsContact CD2-CD1 3.46Å; Y316-L387 HydrophobicContact CE1-CD1 4.18Å; Y316-L387 HydrophobicContact CE2-CD1 3.43Å; Y316-L387 VanDerWaalsContact CE2-CD1 3.43Å; Y316-L387 HydrophobicContact CE2-CD2 4.49Å; Y316-L387 HydrophobicContact CG-CD1 3.84Å; S375-L387 PolarHBondContact O-N 2.82Å; F378-L387 HydrophobicContact CB-CD1 3.51Å; F378-L387 HydrophobicContact CB-CG 4.15Å; F378-L387 HydrophobicContact CD2-CB 4.17Å; F378-L387 HydrophobicContact CD2-CD1 3.97Å; F378-L387 HydrophobicContact CD2-CG 4.28Å; F378-L387 HydrophobicContact CG-CD1 3.84Å
388	P	92.9	Very high	91.1	Very high	38 Å²	38	53.9 Å²	53.9	25%	0.247	30%	0.296	C	S	.	.			trans	-79.1	124.2	175.9	33	-32.9	0	0	0	110.3	S305 E306	S305-P388 PolarHBondContact N-O 3.21Å; E306-P388 HydrophobicContact CB-CG 4.41Å; E306-P388 VanDerWaalsContact CD-CG 3.48Å; E306-P388 HydrophobicContact CG-CG 3.55Å; E306-P388 VanDerWaalsContact OE1-CD 3.25Å; E306-P388 WeakPolarHBondContact OE1-CD 3.36Å; E306-P388 VanDerWaalsContact OE1-CG 3.23Å; E306-P388 WeakPolarHBondContact OE1-CG 3.28Å
389	L	96.4	Very high	90.1	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	155.2	175.9	-66.7	175.7	0	0	0	109.7	V302 V303 F304 W317 F378 I413 V415	V302-L389 HydrophobicContact CG1-CD2 4.39Å; V303-L389 WeakPolarHBondContact O-CA 3.33Å; F304-L389 HydrophobicContact CD1-CD2 3.72Å; F304-L389 HydrophobicContact CE1-CD2 3.74Å; W317-L389 HydrophobicContact CH2-CD2 4.33Å; F378-L389 HydrophobicContact CE2-CD1 4.13Å; F378-L389 HydrophobicContact CE2-CD2 3.99Å; F378-L389 HydrophobicContact CE2-CG 4.35Å; F378-L389 HydrophobicContact CZ-CD1 4.49Å; F378-L389 HydrophobicContact CZ-CD2 4.11Å; L389-I413 HydrophobicContact CB-CD1 4.16Å; L389-I413 HydrophobicContact CB-CG1 3.78Å; L389-I413 PolarHBondContact O-N 2.79Å; L389-V415 HydrophobicContact CD1-CG2 4.3Å
390	M	96.7	Very high	89.1	Confident	13 Å²	13	60.4 Å²	60.4	6%	0.064	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	150.2	165.7	65.8	-174.9	-144	0	0	111	V303 Q392 Y410 C411 Q412 M471	V303-M390 HydrophobicContact CG2-CE 3.81Å; V303-M390 HydrophobicContact CG2-CG 3.66Å; V303-M390 PolarHBondContact N-O 2.72Å; V303-M390 PolarHBondContact O-N 3.3Å; M390-Q392 HydrophobicContact CE-CB 4.19Å; M390-Q392 HydrophobicContact CE-CG 4.41Å; M390-Y410 HydrophobicContact CB-CD2 4.44Å; M390-Y410 HydrophobicContact CE-CG 4.29Å; M390-Y410 HydrophobicContact SD-CD2 3.63Å; M390-Y410 HydrophobicContact SD-CE2 4.44Å; M390-Y410 HydrophobicContact SD-CG 3.97Å; M390-C411 CarbonylContact C-O 3.5Å; M390-C411 VanDerWaalsContact CA-O 3.24Å; M390-C411 WeakPolarHBondContact CA-O 3.4Å; M390-C411 WeakPolarHBondContact CB-O 3.44Å; M390-Q412 HydrophobicContact CB-CG 4.48Å; M390-M471 HydrophobicContact CE-CE 4.25Å; M390-M471 HydrophobicContact CE-SD 4.09Å
391	I	98.2	Very high	88.2	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	126.5	162.1	-58.3	166	0	0	0	106.1	L252 L270 I278 V300 M301 I369 Y410 C411 I413 F468	L252-I391 HydrophobicContact CD2-CD1 4.08Å; L270-I391 HydrophobicContact CD1-CD1 4.14Å; I278-I391 HydrophobicContact CD1-CG2 4.3Å; V300-I391 HydrophobicContact CG1-CG2 3.85Å; M301-I391 CarbonylContact O-C 3.57Å; M301-I391 VanDerWaalsContact O-CA 3.3Å; M301-I391 WeakPolarHBondContact O-CA 3.17Å; I369-I391 HydrophobicContact CD1-CD1 3.91Å; I391-Y410 CarbonylContact O-C 3.54Å; I391-Y410 VanDerWaalsContact O-CA 3.23Å; I391-Y410 WeakPolarHBondContact O-CA 3.45Å; I391-C411 PolarHBondContact N-O 3.04Å; I391-C411 PolarHBondContact O-N 3.01Å; I391-I413 HydrophobicContact CD1-CD1 4.32Å; I391-I413 HydrophobicContact CD1-CG2 3.85Å; I391-I413 HydrophobicContact CG1-CD1 3.85Å; I391-I413 HydrophobicContact CG1-CG1 4.31Å; I391-I413 HydrophobicContact CG1-CG2 4.02Å; I391-F468 HydrophobicContact CB-CE1 4.04Å; I391-F468 HydrophobicContact CB-CZ 4.3Å; I391-F468 HydrophobicContact CG2-CE1 3.86Å; I391-F468 HydrophobicContact CG2-CZ 4.01Å
392	Q	97.8	Very high	87.7	Confident	12 Å²	12	62.1 Å²	62.1	6%	0.056	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	145.5	172.8	-175	-179.2	-50.1	0	0	109	M301 V303 M390 D394 R408 A409	M301-Q392 HydrophobicContact CE-CG 4.35Å; M301-Q392 HydrophobicContact CG-CB 3.78Å; M301-Q392 PolarHBondContact N-O 2.89Å; M301-Q392 PolarHBondContact O-N 2.72Å; M301-Q392 HydrophobicContact SD-CB 4.31Å; M301-Q392 HydrophobicContact SD-CG 4.47Å; V303-Q392 HydrophobicContact CG2-CB 4.07Å; M390-Q392 HydrophobicContact CE-CB 4.19Å; M390-Q392 HydrophobicContact CE-CG 4.41Å; Q392-D394 WeakPolarHBondContact CG-OD1 3.26Å; Q392-D394 PolarHBondContact NE2-OD1 3.49Å; Q392-D394 PolarHBondContact NE2-OD2 3.39Å; Q392-R408 HydrophobicContact CG-CG 4.14Å; Q392-R408 VanDerWaalsContact NE2-NE 3.16Å; Q392-A409 WeakPolarHBondContact CA-O 3.47Å
393	I	98.3	Very high	87.5	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	113	175.8	-53.5	-173.4	0	0	0	108.4	Y250 I278 L280 V299 V300 R408 A409 F468	Y250-I393 HydrophobicContact CD2-CB 3.72Å; Y250-I393 HydrophobicContact CD2-CD1 3.85Å; Y250-I393 HydrophobicContact CD2-CG1 4.23Å; Y250-I393 HydrophobicContact CD2-CG2 3.88Å; Y250-I393 HydrophobicContact CE1-CG2 4.27Å; Y250-I393 HydrophobicContact CE2-CB 3.62Å; Y250-I393 HydrophobicContact CE2-CG2 3.58Å; Y250-I393 HydrophobicContact CG-CD1 3.96Å; Y250-I393 HydrophobicContact CG-CG2 4.34Å; I278-I393 HydrophobicContact CG2-CD1 3.87Å; L280-I393 HydrophobicContact CD2-CG2 3.95Å; V299-I393 WeakPolarHBondContact O-CA 3.3Å; V300-I393 HydrophobicContact CG1-CG1 4.38Å; V300-I393 HydrophobicContact CG2-CD1 4.16Å; V300-I393 HydrophobicContact CG2-CG1 4.03Å; V300-I393 HydrophobicContact CG2-CG2 4.19Å; I393-R408 WeakPolarHBondContact O-CA 3.27Å; I393-A409 PolarHBondContact N-O 3.24Å; I393-A409 PolarHBondContact O-N 3.43Å; I393-A409 VanDerWaalsContact O-N 3.07Å; I393-F468 HydrophobicContact CD1-CD1 4.06Å; I393-F468 HydrophobicContact CD1-CE1 3.61Å; I393-F468 HydrophobicContact CD1-CE2 4.08Å; I393-F468 HydrophobicContact CD1-CZ 3.63Å; I393-F468 HydrophobicContact CG1-CD1 4.12Å; I393-F468 HydrophobicContact CG1-CE1 3.69Å; I393-F468 HydrophobicContact CG1-CZ 4.18Å
394	D	97.1	Very high	87.9	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	120.2	175.7	-75.7	16.5	0	0	0	108.9	S298 V299 M301 Q392 Y396 P405 R408	S298-D394 CarbonylContact C-O 3.53Å; S298-D394 WeakPolarHBondContact CA-O 3.22Å; V299-D394 PolarHBondContact N-O 3.33Å; V299-D394 PolarHBondContact O-N 3.42Å; M301-D394 HydrophobicContact CE-CB 3.79Å; Q392-D394 WeakPolarHBondContact CG-OD1 3.26Å; Q392-D394 PolarHBondContact NE2-OD1 3.49Å; Q392-D394 PolarHBondContact NE2-OD2 3.39Å; D394-Y396 HydrophobicContact CB-CE2 3.66Å; D394-P405 HydrophobicContact CB-CB 4.13Å; D394-R408 VanDerWaalsContact OD1-CG 3.29Å; D394-R408 WeakPolarHBondContact OD1-CG 3.38Å; D394-R408 IonicContact OD1-CZ 2.74Å; D394-R408 IonicContact OD1-NE 3.77Å; D394-R408 PolarHBondContact OD1-NE 2.88Å; D394-R408 IonicContact OD1-NH2 2.74Å; D394-R408 IonicContact OD2-CZ 2.58Å; D394-R408 IonicContact OD2-NE 3.89Å; D394-R408 PolarHBondContact OD2-NE 3.27Å; D394-R408 IonicContact OD2-NH2 3.3Å; D394-R408 PolarHBondContact OD2-NH2 3.24Å
395	T	95.9	Very high	88.2	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	136.2	178.7	-64.9	0	0	0	0	110.4	F248 Y250 V296 R297 S298 P405 I406 H407	F248-T395 HydrophobicContact CD1-CG2 4.37Å; F248-T395 HydrophobicContact CE1-CG2 4.06Å; F248-T395 HydrophobicContact CZ-CG2 4.16Å; Y250-T395 WeakPolarHBondContact OH-CB 3.32Å; Y250-T395 PolarHBondContact OH-OG1 3.12Å; V296-T395 HydrophobicContact CB-CG2 4.02Å; V296-T395 HydrophobicContact CG1-CG2 4.42Å; V296-T395 HydrophobicContact CG2-CG2 4.22Å; R297-T395 CarbonylContact O-C 3.53Å; R297-T395 WeakPolarHBondContact O-CA 3.45Å; S298-T395 PolarHBondContact OG-OG1 3.36Å; T395-P405 CarbonylContact O-C 3.56Å; T395-P405 WeakPolarHBondContact O-CA 3.23Å; T395-P405 WeakPolarHBondContact O-CB 3.41Å; T395-I406 HydrophobicContact CG2-CG1 4.4Å; T395-I406 VanDerWaalsContact O-CG1 3.26Å; T395-I406 WeakPolarHBondContact O-CG1 3.47Å; T395-I406 PolarHBondContact O-N 3.09Å; T395-H407 PolarHBondContact N-O 3.03Å; T395-H407 PolarHBondContact O-N 3.44Å
396	Y	92.9	Very high	88.6	Confident	34 Å²	34	51.7 Å²	51.7	13%	0.133	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	143.9	-174.4	-58.8	-99.2	0	0	0	109.7	V296 R297 V299 D394 Y398 P405	V296-Y396 WeakPolarHBondContact CA-O 2.84Å; V296-Y396 WeakPolarHBondContact CB-O 3.34Å; R297-Y396 PolarHBondContact N-O 2.76Å; R297-Y396 PolarHBondContact O-N 2.8Å; V299-Y396 HydrophobicContact CB-CE2 4.5Å; V299-Y396 HydrophobicContact CG2-CD2 4.39Å; V299-Y396 HydrophobicContact CG2-CE2 3.89Å; D394-Y396 HydrophobicContact CB-CE2 3.66Å; Y396-Y398 PolarHBondContact O-N 2.95Å; Y396-P405 HydrophobicContact CD1-CB 4.3Å; Y396-P405 HydrophobicContact CE1-CB 3.99Å; Y396-P405 HydrophobicContact CE1-CG 4.47Å; Y396-P405 HydrophobicContact CE2-CB 4.38Å
397	S	88.4	Confident	88.9	Confident	42 Å²	42	51.6 Å²	51.6	29%	0.294	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	127.1	169.5	171.1	0	0	0	0	109.8	N399 N400	S397-N399 VanDerWaalsContact C-N 3.27Å; S397-N399 PolarHBondContact O-N 2.81Å; S397-N400 PolarHBondContact O-N 2.97Å
398	Y	81.4	Confident	89	Confident	122 Å²	122	50.2 Å²	50.2	48%	0.478	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-31.5	-174.1	-173.7	-103.4	0	0	0	113.3	K295 T358 Y396	K295-Y398 HydrophobicContact CB-CD1 4.5Å; K295-Y398 HydrophobicContact CB-CG 4.35Å; K295-Y398 WeakPolarHBondContact O-CB 3.46Å; T358-Y398 HydrophobicContact CG2-CD2 3.77Å; T358-Y398 HydrophobicContact CG2-CE2 3.63Å; Y396-Y398 PolarHBondContact O-N 2.95Å
399	N	73.7	Confident	89.2	Confident	103 Å²	103	48.4 Å²	48.4	55%	0.551	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.2	-10.3	-179.8	-82.3	38.5	0	0	0	114.1	I293 S397	I293-N399 WeakPolarHBondContact CG1-ND2 3.27Å; I293-N399 HydrophobicContact CG2-CB 4.47Å; I293-N399 WeakPolarHBondContact CG2-OD1 3.49Å; S397-N399 VanDerWaalsContact C-N 3.27Å; S397-N399 PolarHBondContact O-N 2.81Å
400	N	67.7	Low	89.2	Confident	93 Å²	93	50.1 Å²	50.1	50%	0.497	24%	0.24	S	C	.	.			trans	-96.7	116	-177.6	-171.1	-8.7	0	0	0	109.9	S397 S402	S397-N400 PolarHBondContact O-N 2.97Å; N400-S402 PolarHBondContact O-N 3.03Å; N400-S402 WeakPolarHBondContact OD1-CB 3.4Å; N400-S402 PolarHBondContact OD1-N 3.08Å
401	R	68.2	Low	89.1	Confident	209 Å²	209	49.5 Å²	49.5	79%	0.789	24%	0.237	S	C	*	.			trans	-70.7	20.8	176.4	-60.3	-166.4	-172.7	-164.5	8.1	114	H600	R401-H600 PolarHBondContact NH1-CE1 3.18Å; R401-H600 PolarHBondContact NH1-NE2 3.36Å
402	S	77.9	Confident	89	Confident	51 Å²	51	50.4 Å²	50.4	36%	0.357	24%	0.242	S	C	.	.			trans	-79.5	129.4	177.1	-166.8	0	0	0	0	111.1	N400 K404	N400-S402 PolarHBondContact O-N 3.03Å; N400-S402 WeakPolarHBondContact OD1-CB 3.4Å; N400-S402 PolarHBondContact OD1-N 3.08Å; S402-K404 PolarHBondContact O-N 3.17Å; S402-K404 VanDerWaalsContact O-N 3.16Å; S402-K404 WeakPolarHBondContact OG-CB 3.5Å; S402-K404 PolarHBondContact OG-N 3.22Å
403	N	80.7	Confident	88.9	Confident	151 Å²	151	50 Å²	50	81%	0.807	24%	0.239	S	C	*	.	S	Bend	trans	-72.2	2.5	170.1	-68.4	-42.3	0	0	0	113.2
404	K	88.6	Confident	88.8	Confident	88 Å²	88	52.6 Å²	52.6	38%	0.383	25%	0.251	S	S	.	.	S	Bend	trans	-94.1	126.7	176.8	-174.2	177	174.8	175.8	0	110.5	S402 L474 H475	S402-K404 PolarHBondContact O-N 3.17Å; S402-K404 VanDerWaalsContact O-N 3.16Å; S402-K404 WeakPolarHBondContact OG-CB 3.5Å; S402-K404 PolarHBondContact OG-N 3.22Å; K404-L474 HydrophobicContact CG-CB 4.22Å; K404-H475 WeakPolarHBondContact CE-NE2 3.15Å; K404-H475 PolarHBondContact NZ-NE2 2.9Å
405	P	93.1	Very high	88.8	Confident	5 Å²	5	52.8 Å²	52.8	3%	0.032	25%	0.252	C	S	.	.			trans	-63.7	145.9	171.8	26.2	-33.2	0	0	0	111.3	D394 T395 Y396 L474	D394-P405 HydrophobicContact CB-CB 4.13Å; T395-P405 CarbonylContact O-C 3.56Å; T395-P405 WeakPolarHBondContact O-CA 3.23Å; T395-P405 WeakPolarHBondContact O-CB 3.41Å; Y396-P405 HydrophobicContact CD1-CB 4.3Å; Y396-P405 HydrophobicContact CE1-CB 3.99Å; Y396-P405 HydrophobicContact CE1-CG 4.47Å; Y396-P405 HydrophobicContact CE2-CB 4.38Å; P405-L474 WeakPolarHBondContact CD-O 3.37Å; P405-L474 HydrophobicContact CG-CB 4.31Å; P405-L474 HydrophobicContact CG-CD2 4.12Å
406	I	92.4	Very high	88.9	Confident	72 Å²	72	54.8 Å²	54.8	37%	0.369	26%	0.261	S	S	.	.	S	Bend	trans	-81.6	-22.7	172.2	60.6	169.4	0	0	0	112.1	F248 V296 T395	F248-I406 HydrophobicContact CE2-CD1 3.71Å; F248-I406 HydrophobicContact CE2-CG1 4.21Å; F248-I406 HydrophobicContact CZ-CD1 3.86Å; V296-I406 HydrophobicContact CG1-CD1 4.47Å; T395-I406 HydrophobicContact CG2-CG1 4.4Å; T395-I406 VanDerWaalsContact O-CG1 3.26Å; T395-I406 WeakPolarHBondContact O-CG1 3.47Å; T395-I406 PolarHBondContact O-N 3.09Å
407	H	94.5	Very high	89	Confident	17 Å²	17	55.7 Å²	55.7	8%	0.079	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	144.4	171.9	-177.2	-107.9	0	0	0	110.6	F248 Y250 T395	F248-H407 HydrophobicContact CB-CB 4.28Å; F248-H407 WeakPolarHBondContact CB-CE1 3.37Å; F248-H407 WeakPolarHBondContact CB-ND1 3.15Å; F248-H407 HydrophobicContact CD2-CB 3.63Å; F248-H407 HydrophobicContact CE2-CB 4.39Å; F248-H407 HydrophobicContact CG-CB 4.26Å; F248-H407 AromaticContact CG-CE1 3.93Å; F248-H407 PolarHBondContact O-NE2 3.01Å; Y250-H407 AromaticContact CE1-CE1 3.47Å; Y250-H407 VanDerWaalsContact CE1-CE1 3.47Å; Y250-H407 WeakPolarHBondContact CE1-CE1 3.1Å; Y250-H407 AromaticContact CE2-CE1 2.96Å; Y250-H407 WeakPolarHBondContact CE2-CE1 3.41Å; Y250-H407 AromaticContact CE2-ND1 3.66Å; Y250-H407 AromaticContact CE2-NE2 3.56Å; Y250-H407 AromaticContact CZ-CE1 2.5Å; Y250-H407 AromaticContact CZ-ND1 3.43Å; Y250-H407 AromaticContact CZ-NE2 3.86Å; Y250-H407 PolarHBondContact OH-CE1 3.21Å; Y250-H407 PolarHBondContact OH-ND1 2.97Å; T395-H407 PolarHBondContact N-O 3.03Å; T395-H407 PolarHBondContact O-N 3.44Å
408	R	96	Very high	89.3	Confident	5 Å²	5	58.8 Å²	58.8	2%	0.019	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	139	176.2	176.2	176	-72	166.9	-15.3	109.8	Q392 I393 D394 T470 M471 D473 L474 S476	Q392-R408 HydrophobicContact CG-CG 4.14Å; Q392-R408 VanDerWaalsContact NE2-NE 3.16Å; I393-R408 WeakPolarHBondContact O-CA 3.27Å; D394-R408 VanDerWaalsContact OD1-CG 3.29Å; D394-R408 WeakPolarHBondContact OD1-CG 3.38Å; D394-R408 IonicContact OD1-CZ 2.74Å; D394-R408 IonicContact OD1-NE 3.77Å; D394-R408 PolarHBondContact OD1-NE 2.88Å; D394-R408 IonicContact OD1-NH2 2.74Å; D394-R408 IonicContact OD2-CZ 2.58Å; D394-R408 IonicContact OD2-NE 3.89Å; D394-R408 PolarHBondContact OD2-NE 3.27Å; D394-R408 IonicContact OD2-NH2 3.3Å; D394-R408 PolarHBondContact OD2-NH2 3.24Å; R408-T470 CarbonylContact O-C 3.54Å; R408-T470 WeakPolarHBondContact O-CA 3.38Å; R408-M471 HydrophobicContact CB-CB 4.29Å; R408-M471 HydrophobicContact CG-CB 3.9Å; R408-M471 HydrophobicContact CG-CG 4.07Å; R408-M471 HydrophobicContact CG-SD 3.73Å; R408-M471 PolarHBondContact O-N 3.03Å; R408-D473 WeakPolarHBondContact CD-O 3.19Å; R408-D473 PolarHBondContact NH1-O 3.33Å; R408-L474 HydrophobicContact CB-CD2 3.63Å; R408-S476 VanDerWaalsContact CZ-O 3.3Å; R408-S476 PolarHBondContact NH1-O 2.95Å; R408-S476 PolarHBondContact NH2-O 2.99Å
409	A	96.6	Very high	89.9	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	162.6	171.4	0	0	0	0	0	112	Y250 Q392 I393 F468 K469	Y250-A409 HydrophobicContact CD2-CB 3.8Å; Y250-A409 HydrophobicContact CE2-CB 3.73Å; Q392-A409 WeakPolarHBondContact CA-O 3.47Å; I393-A409 PolarHBondContact N-O 3.24Å; I393-A409 PolarHBondContact O-N 3.43Å; I393-A409 VanDerWaalsContact O-N 3.07Å; A409-F468 HydrophobicContact CB-CB 3.83Å; A409-K469 CarbonylContact C-O 3.6Å; A409-K469 VanDerWaalsContact CA-O 3.23Å; A409-K469 WeakPolarHBondContact CA-O 3.28Å; A409-K469 WeakPolarHBondContact CB-O 3.2Å
410	Y	96.6	Very high	91	Very high	35 Å²	35	52.9 Å²	52.9	14%	0.137	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	154.7	-179.1	73.9	-72.2	0	0	0	114	M390 I391 Q412 F468 K469 M471	M390-Y410 HydrophobicContact CB-CD2 4.44Å; M390-Y410 HydrophobicContact CE-CG 4.29Å; M390-Y410 HydrophobicContact SD-CD2 3.63Å; M390-Y410 HydrophobicContact SD-CE2 4.44Å; M390-Y410 HydrophobicContact SD-CG 3.97Å; I391-Y410 CarbonylContact O-C 3.54Å; I391-Y410 VanDerWaalsContact O-CA 3.23Å; I391-Y410 WeakPolarHBondContact O-CA 3.45Å; Y410-Q412 HydrophobicContact CD2-CG 4.14Å; Y410-Q412 HydrophobicContact CE2-CG 4Å; Y410-F468 WeakPolarHBondContact O-CA 3.32Å; Y410-K469 HydrophobicContact CD1-CB 4.27Å; Y410-K469 WeakPolarHBondContact CD1-O 3.16Å; Y410-K469 HydrophobicContact CE1-CB 3.97Å; Y410-K469 HydrophobicContact CE1-CD 3.98Å; Y410-K469 HydrophobicContact CE1-CG 3.93Å; Y410-K469 PolarHBondContact N-O 2.86Å; Y410-K469 PolarHBondContact O-N 3Å; Y410-K469 PolarHBondContact OH-NZ 3.36Å; Y410-M471 HydrophobicContact CD1-CG 3.39Å; Y410-M471 HydrophobicContact CD1-SD 3.73Å; Y410-M471 HydrophobicContact CE1-CG 3.86Å; Y410-M471 HydrophobicContact CE1-SD 4.49Å; Y410-M471 HydrophobicContact CG-CG 4.38Å; Y410-M471 HydrophobicContact CG-SD 4.19Å
411	C	95.8	Very high	92.3	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	124.1	164.7	-175.9	0	0	0	0	108.3	T268 M390 I391 F468	T268-C411 PolarHBondContact OG1-SG 3.28Å; M390-C411 CarbonylContact C-O 3.5Å; M390-C411 VanDerWaalsContact CA-O 3.24Å; M390-C411 WeakPolarHBondContact CA-O 3.4Å; M390-C411 WeakPolarHBondContact CB-O 3.44Å; I391-C411 PolarHBondContact N-O 3.04Å; I391-C411 PolarHBondContact O-N 3.01Å; C411-F468 HydrophobicContact CB-CD1 3.83Å; C411-F468 HydrophobicContact CB-CD2 4.32Å; C411-F468 HydrophobicContact CB-CE1 3.73Å; C411-F468 HydrophobicContact CB-CE2 4.28Å; C411-F468 HydrophobicContact CB-CG 4.11Å; C411-F468 HydrophobicContact CB-CZ 3.97Å
412	Q	95.8	Very high	93.5	Very high	20 Å²	20	41.7 Å²	41.7	9%	0.093	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	140.4	172.4	-65.1	-173.3	-25.3	0	0	109.5	P266 M267 T268 S305 M390 Y410	P266-Q412 WeakPolarHBondContact O-CA 3.31Å; P266-Q412 WeakPolarHBondContact O-CB 3.29Å; P266-Q412 PolarHBondContact O-N 3.1Å; M267-Q412 WeakPolarHBondContact CA-O 3.47Å; M267-Q412 HydrophobicContact CE-CB 3.6Å; M267-Q412 HydrophobicContact SD-CB 4.24Å; T268-Q412 PolarHBondContact N-O 2.75Å; S305-Q412 PolarHBondContact OG-NE2 3.46Å; S305-Q412 VanDerWaalsContact OG-NE2 3.11Å; M390-Q412 HydrophobicContact CB-CG 4.48Å; Y410-Q412 HydrophobicContact CD2-CG 4.14Å; Y410-Q412 HydrophobicContact CE2-CG 4Å
413	I	96.3	Very high	94.3	Very high	2 Å²	2	44.3 Å²	44.3	1%	0.01	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	147.8	-178.5	55.9	158.5	0	0	0	111.7	L252 T268 L270 V302 V371 L389 I391 V415	L252-I413 HydrophobicContact CD2-CG2 4.43Å; T268-I413 WeakPolarHBondContact O-CA 3.41Å; L270-I413 HydrophobicContact CD1-CB 4.18Å; L270-I413 HydrophobicContact CD1-CD1 4.13Å; L270-I413 HydrophobicContact CD1-CG2 3.83Å; L270-I413 HydrophobicContact CG-CG2 4.28Å; V302-I413 HydrophobicContact CG1-CD1 4.45Å; V371-I413 HydrophobicContact CG1-CD1 4.3Å; V371-I413 HydrophobicContact CG2-CD1 4.16Å; L389-I413 HydrophobicContact CB-CD1 4.16Å; L389-I413 HydrophobicContact CB-CG1 3.78Å; L389-I413 PolarHBondContact O-N 2.79Å; I391-I413 HydrophobicContact CD1-CD1 4.32Å; I391-I413 HydrophobicContact CD1-CG2 3.85Å; I391-I413 HydrophobicContact CG1-CD1 3.85Å; I391-I413 HydrophobicContact CG1-CG1 4.31Å; I391-I413 HydrophobicContact CG1-CG2 4.02Å; I413-V415 HydrophobicContact CD1-CG2 3.87Å
414	K	95.7	Very high	95	Very high	55 Å²	55	39.8 Å²	39.8	24%	0.239	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	122	163.4	-162.8	172.8	-175.5	75.8	0	109.4	M267 T268 Y269 L270 K385 F416	M267-K414 HydrophobicContact SD-CB 4.22Å; T268-K414 PolarHBondContact O-N 3.14Å; Y269-K414 WeakPolarHBondContact CA-O 3.32Å; Y269-K414 HydrophobicContact CD1-CB 3.89Å; Y269-K414 HydrophobicContact CE1-CB 4.17Å; L270-K414 PolarHBondContact N-O 2.87Å; K385-K414 PolarHBondContact O-NZ 3.05Å; K414-F416 HydrophobicContact CB-CE2 3.94Å; K414-F416 HydrophobicContact CB-CZ 4.24Å; K414-F416 HydrophobicContact CD-CE1 4.28Å; K414-F416 HydrophobicContact CD-CE2 4.24Å; K414-F416 HydrophobicContact CD-CZ 3.66Å; K414-F416 HydrophobicContact CG-CE1 4.49Å; K414-F416 HydrophobicContact CG-CE2 3.92Å; K414-F416 HydrophobicContact CG-CZ 3.82Å; K414-F416 WeakPolarHBondContact O-CD2 3.47Å; K414-F416 WeakPolarHBondContact O-CE2 3.1Å
415	V	97.2	Very high	95.2	Very high	4 Å²	4	36.4 Å²	36.4	2%	0.024	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	131.2	-174.3	-167.4	0	0	0	0	109.9	L270 K272 V371 C373 L374 S375 L389 I413	L270-V415 HydrophobicContact CB-CG2 4.43Å; L270-V415 CarbonylContact O-C 3.53Å; L270-V415 WeakPolarHBondContact O-CA 2.96Å; K272-V415 HydrophobicContact CB-CG1 4.26Å; V371-V415 HydrophobicContact CB-CG2 4.22Å; V371-V415 HydrophobicContact CG1-CG2 3.84Å; C373-V415 WeakPolarHBondContact O-CB 3.43Å; C373-V415 VanDerWaalsContact O-CG1 3.23Å; C373-V415 WeakPolarHBondContact O-CG1 3.43Å; L374-V415 HydrophobicContact CD2-CG1 4.44Å; S375-V415 PolarHBondContact N-O 2.93Å; S375-V415 PolarHBondContact OG-N 3.14Å; S375-V415 VanDerWaalsContact OG-N 3.11Å; L389-V415 HydrophobicContact CD1-CG2 4.3Å; I413-V415 HydrophobicContact CD1-CG2 3.87Å
416	F	96.5	Very high	95.1	Very high	42 Å²	42	41.7 Å²	41.7	18%	0.184	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	162.5	-176.7	-58.3	-93.9	0	0	0	111.7	Y269 L270 N271 K272 K414 A421 K424	Y269-F416 AromaticContact CD1-CE2 3.96Å; Y269-F416 HydrophobicContact CD1-CE2 3.96Å; Y269-F416 HydrophobicContact CD1-CZ 4.49Å; Y269-F416 HydrophobicContact CD2-CE2 4.5Å; Y269-F416 AromaticContact CG-CE2 3.86Å; Y269-F416 HydrophobicContact CG-CE2 3.86Å; L270-F416 PolarHBondContact O-N 3.17Å; N271-F416 CarbonylContact C-O 3.45Å; N271-F416 WeakPolarHBondContact CA-O 3.34Å; K272-F416 PolarHBondContact N-O 3.28Å; K414-F416 HydrophobicContact CB-CE2 3.94Å; K414-F416 HydrophobicContact CB-CZ 4.24Å; K414-F416 HydrophobicContact CD-CE1 4.28Å; K414-F416 HydrophobicContact CD-CE2 4.24Å; K414-F416 HydrophobicContact CD-CZ 3.66Å; K414-F416 HydrophobicContact CG-CE1 4.49Å; K414-F416 HydrophobicContact CG-CE2 3.92Å; K414-F416 HydrophobicContact CG-CZ 3.82Å; K414-F416 WeakPolarHBondContact O-CD2 3.47Å; K414-F416 WeakPolarHBondContact O-CE2 3.1Å; F416-A421 HydrophobicContact CD2-CB 4.32Å; F416-K424 HydrophobicContact CE1-CB 4.23Å; F416-K424 HydrophobicContact CE1-CG 4.28Å; F416-K424 HydrophobicContact CE2-CB 4.36Å; F416-K424 HydrophobicContact CE2-CG 4.27Å; F416-K424 HydrophobicContact CZ-CB 3.92Å; F416-K424 HydrophobicContact CZ-CD 4.19Å; F416-K424 HydrophobicContact CZ-CG 3.67Å
417	C	95.5	Very high	95.1	Very high	53 Å²	53	42.3 Å²	42.3	36%	0.358	20%	0.197	S	C	.	.	S	Bend	trans	-81	155.6	169.8	64.5	0	0	0	0	111.9	L374 K419 G420 R423	L374-C417 HydrophobicContact CD1-CB 4.33Å; L374-C417 HydrophobicContact CD2-CB 4.26Å; C417-K419 PolarHBondContact O-N 2.98Å; C417-K419 VanDerWaalsContact O-N 3.12Å; C417-G420 WeakPolarHBondContact O-CA 3.23Å; C417-G420 PolarHBondContact O-N 2.65Å; C417-R423 PolarHBondContact O-NH2 3.47Å
418	D	94.4	Very high	95	Very high	107 Å²	107	41.8 Å²	41.8	57%	0.572	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.2	-107.8	173.7	15.7	-81.6	0	0	0	113.8	N271 R423	N271-D418 WeakPolarHBondContact CB-O 3.29Å; N271-D418 PolarHBondContact OD1-O 2.88Å; D418-R423 IonicContact OD2-CZ 2.72Å; D418-R423 IonicContact OD2-NH1 3.76Å; D418-R423 PolarHBondContact OD2-NH1 3.21Å; D418-R423 IonicContact OD2-NH2 2.66Å; D418-R423 PolarHBondContact OD2-NH2 3.19Å
419	K	95.3	Very high	94.7	Very high	99 Å²	99	45.8 Å²	45.8	43%	0.43	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116	39.3	177.8	-70	-70.4	173.2	-166.4	0	111.5	C417 E422 R423	C417-K419 PolarHBondContact O-N 2.98Å; C417-K419 VanDerWaalsContact O-N 3.12Å; K419-E422 WeakPolarHBondContact CA-OE2 3.49Å; K419-E422 WeakPolarHBondContact CD-OE1 3.39Å; K419-E422 WeakPolarHBondContact CD-OE2 3.47Å; K419-E422 WeakPolarHBondContact CE-OE1 3.46Å; K419-E422 IonicContact NZ-OE1 2.73Å; K419-E422 PolarHBondContact NZ-OE1 2.79Å; K419-E422 PolarHBondContact O-N 2.95Å; K419-R423 WeakPolarHBondContact O-CG 3.32Å; K419-R423 PolarHBondContact O-N 2.83Å
420	G	95.9	Very high	94.5	Very high	3 Å²	3	52.2 Å²	52.2	3%	0.031	24%	0.237	C	C	.	.	H	α-helix	trans	-71.1	-33.5	-174.9	0	0	0	0	0	113.7	N271 C417 R423 K424	N271-G420 PolarHBondContact OD1-N 3.16Å; C417-G420 WeakPolarHBondContact O-CA 3.23Å; C417-G420 PolarHBondContact O-N 2.65Å; G420-R423 PolarHBondContact O-N 2.73Å; G420-K424 WeakPolarHBondContact O-CB 3.2Å; G420-K424 PolarHBondContact O-N 3Å
421	A	95.2	Very high	94.2	Very high	5 Å²	5	56.7 Å²	56.7	4%	0.041	26%	0.257	C	S	.	.	H	α-helix	trans	-61.1	-48.3	171.7	0	0	0	0	0	111	N271 F416 R423 K424 I425	N271-A421 WeakPolarHBondContact OD1-CB 3.35Å; N271-A421 PolarHBondContact OD1-N 2.81Å; F416-A421 HydrophobicContact CD2-CB 4.32Å; A421-R423 PolarHBondContact O-N 2.74Å; A421-K424 WeakPolarHBondContact O-CB 3.45Å; A421-K424 PolarHBondContact O-N 3.04Å; A421-K424 VanDerWaalsContact O-N 3.14Å; A421-I425 WeakPolarHBondContact O-CG1 3.3Å; A421-I425 PolarHBondContact O-N 2.93Å
422	E	94.4	Very high	93.8	Very high	62 Å²	62	60.4 Å²	60.4	29%	0.29	28%	0.275	S	S	.	.	H	α-helix	trans	-71.5	-28	180	-58	93.2	146.1	0	0	112.8	N271 K419 R426	N271-E422 PolarHBondContact ND2-OE1 2.97Å; N271-E422 PolarHBondContact ND2-OE2 2.82Å; K419-E422 WeakPolarHBondContact CA-OE2 3.49Å; K419-E422 WeakPolarHBondContact CD-OE1 3.39Å; K419-E422 WeakPolarHBondContact CD-OE2 3.47Å; K419-E422 WeakPolarHBondContact CE-OE1 3.46Å; K419-E422 IonicContact NZ-OE1 2.73Å; K419-E422 PolarHBondContact NZ-OE1 2.79Å; K419-E422 PolarHBondContact O-N 2.95Å; E422-R426 WeakPolarHBondContact O-CG 3.41Å; E422-R426 PolarHBondContact O-NE 3.18Å
423	R	94.7	Very high	93.2	Very high	105 Å²	105	64.2 Å²	64.2	40%	0.396	30%	0.296	S	S	.	.	H	α-helix	trans	-63.5	-52.2	165	-72.6	-177.3	-60.3	-113.6	7.1	110.1	C417 D418 K419 G420 A421 I425 R426 D427	C417-R423 PolarHBondContact O-NH2 3.47Å; D418-R423 IonicContact OD2-CZ 2.72Å; D418-R423 IonicContact OD2-NH1 3.76Å; D418-R423 PolarHBondContact OD2-NH1 3.21Å; D418-R423 IonicContact OD2-NH2 2.66Å; D418-R423 PolarHBondContact OD2-NH2 3.19Å; K419-R423 WeakPolarHBondContact O-CG 3.32Å; K419-R423 PolarHBondContact O-N 2.83Å; G420-R423 PolarHBondContact O-N 2.73Å; A421-R423 PolarHBondContact O-N 2.74Å; R423-I425 PolarHBondContact O-N 2.87Å; R423-R426 PolarHBondContact O-N 2.8Å; R423-D427 VanDerWaalsContact O-CG 3.32Å; R423-D427 PolarHBondContact O-N 2.79Å; R423-D427 VanDerWaalsContact O-N 3.1Å
424	K	94.1	Very high	92.8	Very high	57 Å²	57	74 Å²	74	25%	0.248	33%	0.333	C	S	.	.	H	α-helix	trans	-59.6	-42.1	-175	174.5	64.9	-169.1	151	0	113.2	Y269 F416 G420 A421 D427 E428	Y269-K424 HydrophobicContact CD2-CB 4.19Å; Y269-K424 HydrophobicContact CD2-CG 3.52Å; Y269-K424 HydrophobicContact CE2-CB 4.38Å; Y269-K424 HydrophobicContact CE2-CD 4.24Å; Y269-K424 HydrophobicContact CE2-CG 3.29Å; Y269-K424 HydrophobicContact CG-CG 4.33Å; Y269-K424 WeakPolarHBondContact OH-CE 3.26Å; F416-K424 HydrophobicContact CE1-CB 4.23Å; F416-K424 HydrophobicContact CE1-CG 4.28Å; F416-K424 HydrophobicContact CE2-CB 4.36Å; F416-K424 HydrophobicContact CE2-CG 4.27Å; F416-K424 HydrophobicContact CZ-CB 3.92Å; F416-K424 HydrophobicContact CZ-CD 4.19Å; F416-K424 HydrophobicContact CZ-CG 3.67Å; G420-K424 WeakPolarHBondContact O-CB 3.2Å; G420-K424 PolarHBondContact O-N 3Å; A421-K424 WeakPolarHBondContact O-CB 3.45Å; A421-K424 PolarHBondContact O-N 3.04Å; A421-K424 VanDerWaalsContact O-N 3.14Å; K424-D427 PolarHBondContact O-N 2.98Å; K424-E428 WeakPolarHBondContact CE-OE1 3.41Å; K424-E428 IonicContact NZ-OE1 3.92Å; K424-E428 PolarHBondContact NZ-OE1 2.95Å; K424-E428 WeakPolarHBondContact O-CG 3.47Å; K424-E428 PolarHBondContact O-N 3.47Å
425	I	92.3	Very high	91.9	Very high	16 Å²	16	79.4 Å²	79.4	8%	0.082	36%	0.356	C	S	.	.	H	α-helix	trans	-63.1	-48.6	177	-66.9	-68.3	0	0	0	111	T255 K256 Y269 A421 R423 D427 E428 E429	T255-I425 HydrophobicContact CG2-CB 4.41Å; T255-I425 HydrophobicContact CG2-CD1 3.68Å; T255-I425 HydrophobicContact CG2-CG1 3.58Å; T255-I425 HydrophobicContact CG2-CG2 4.15Å; K256-I425 VanDerWaalsContact O-CD1 3.3Å; K256-I425 WeakPolarHBondContact O-CD1 3.47Å; Y269-I425 HydrophobicContact CD2-CD1 3.48Å; Y269-I425 VanDerWaalsContact CD2-CD1 3.48Å; Y269-I425 HydrophobicContact CD2-CG1 3.91Å; Y269-I425 HydrophobicContact CE2-CD1 3.78Å; Y269-I425 HydrophobicContact CE2-CG1 4.5Å; A421-I425 WeakPolarHBondContact O-CG1 3.3Å; A421-I425 PolarHBondContact O-N 2.93Å; R423-I425 PolarHBondContact O-N 2.87Å; I425-D427 PolarHBondContact O-N 3.03Å; I425-E428 CarbonylContact O-C 3.59Å; I425-E428 WeakPolarHBondContact O-CA 3.4Å; I425-E428 WeakPolarHBondContact O-CB 3.36Å; I425-E428 PolarHBondContact O-N 2.87Å; I425-E429 HydrophobicContact CG2-CG 4.27Å; I425-E429 WeakPolarHBondContact O-CG 3.36Å; I425-E429 PolarHBondContact O-N 2.88Å
426	R	92.8	Very high	90.5	Very high	117 Å²	117	86.1 Å²	86.1	44%	0.442	39%	0.385	S	S	.	.	H	α-helix	trans	-61	-30.2	178.1	-69.6	178.8	-67.3	168.5	-0.9	113	E422 R423 E429 R430	E422-R426 WeakPolarHBondContact O-CG 3.41Å; E422-R426 PolarHBondContact O-NE 3.18Å; R423-R426 PolarHBondContact O-N 2.8Å; R426-E429 WeakPolarHBondContact CA-OE2 3.34Å; R426-R430 WeakPolarHBondContact O-CB 3.23Å; R426-R430 VanDerWaalsContact O-CG 3.25Å; R426-R430 WeakPolarHBondContact O-CG 3.39Å; R426-R430 PolarHBondContact O-N 2.87Å; R426-R430 PolarHBondContact O-NH1 3.11Å
427	D	91.8	Very high	88.7	Confident	85 Å²	85	87.4 Å²	87.4	46%	0.455	41%	0.41	S	S	.	.	H	α-helix	trans	-70	-33.6	172.9	-61.8	-19.4	0	0	0	112.3	R423 K424 I425 R430 K431	R423-D427 VanDerWaalsContact O-CG 3.32Å; R423-D427 PolarHBondContact O-N 2.79Å; R423-D427 VanDerWaalsContact O-N 3.1Å; K424-D427 PolarHBondContact O-N 2.98Å; I425-D427 PolarHBondContact O-N 3.03Å; D427-R430 IonicContact OD1-CZ 3.24Å; D427-R430 IonicContact OD1-NH1 2.71Å; D427-R430 PolarHBondContact OD1-NH1 2.88Å; D427-R430 IonicContact OD1-NH2 3.26Å; D427-K431 VanDerWaalsContact O-CB 3.29Å; D427-K431 WeakPolarHBondContact O-CB 3.28Å; D427-K431 PolarHBondContact O-N 2.97Å
428	E	92.1	Very high	86.7	Confident	6 Å²	6	94.2 Å²	94.2	3%	0.028	43%	0.434	C	S	.	.	H	α-helix	trans	-73.5	-43.9	176	-55.3	-110.2	119.8	0	0	111.5	L258 R259 K424 I425 K431 Q432	L258-E428 HydrophobicContact CB-CB 4.31Å; L258-E428 HydrophobicContact CD1-CB 4.18Å; R259-E428 WeakPolarHBondContact CD-OE1 3Å; R259-E428 WeakPolarHBondContact CD-OE2 3.38Å; R259-E428 VanDerWaalsContact CG-OE2 3.25Å; R259-E428 WeakPolarHBondContact CG-OE2 3.32Å; R259-E428 IonicContact CZ-OE1 2.77Å; R259-E428 VanDerWaalsContact NE-CD 3.35Å; R259-E428 IonicContact NE-OE1 3.17Å; R259-E428 PolarHBondContact NE-OE1 2.93Å; R259-E428 IonicContact NE-OE2 3.01Å; R259-E428 PolarHBondContact NE-OE2 3.33Å; R259-E428 IonicContact NH2-OE1 2.69Å; R259-E428 PolarHBondContact NH2-OE1 3.41Å; K424-E428 WeakPolarHBondContact CE-OE1 3.41Å; K424-E428 IonicContact NZ-OE1 3.92Å; K424-E428 PolarHBondContact NZ-OE1 2.95Å; K424-E428 WeakPolarHBondContact O-CG 3.47Å; K424-E428 PolarHBondContact O-N 3.47Å; I425-E428 CarbonylContact O-C 3.59Å; I425-E428 WeakPolarHBondContact O-CA 3.4Å; I425-E428 WeakPolarHBondContact O-CB 3.36Å; I425-E428 PolarHBondContact O-N 2.87Å; E428-K431 CarbonylContact O-C 3.55Å; E428-K431 PolarHBondContact O-N 3.49Å; E428-Q432 WeakPolarHBondContact O-CB 3.29Å; E428-Q432 PolarHBondContact O-N 3.26Å
429	E	90.8	Very high	84.5	Confident	88 Å²	88	92 Å²	92	41%	0.411	44%	0.436	S	S	.	.	H	α-helix	trans	-55.7	-54.9	172.9	-68.8	174.6	149.8	0	0	111.3	L258 I425 R426 K431 Q432 N433	L258-E429 HydrophobicContact CD1-CB 4.39Å; L258-E429 HydrophobicContact CD1-CG 3.56Å; I425-E429 HydrophobicContact CG2-CG 4.27Å; I425-E429 WeakPolarHBondContact O-CG 3.36Å; I425-E429 PolarHBondContact O-N 2.88Å; R426-E429 WeakPolarHBondContact CA-OE2 3.34Å; E429-K431 PolarHBondContact O-N 2.81Å; E429-Q432 PolarHBondContact O-N 3.03Å; E429-N433 PolarHBondContact O-N 3.47Å; E429-N433 PolarHBondContact O-OD1 3.49Å
430	R	91.7	Very high	82.3	Confident	135 Å²	135	96.5 Å²	96.5	51%	0.509	46%	0.458	S	S	.	.	H	α-helix	trans	-58.6	-34.1	178.1	-70	-173.2	-135.3	97.9	-19.6	111.7	R426 D427 R434	R426-R430 WeakPolarHBondContact O-CB 3.23Å; R426-R430 VanDerWaalsContact O-CG 3.25Å; R426-R430 WeakPolarHBondContact O-CG 3.39Å; R426-R430 PolarHBondContact O-N 2.87Å; R426-R430 PolarHBondContact O-NH1 3.11Å; D427-R430 IonicContact OD1-CZ 3.24Å; D427-R430 IonicContact OD1-NH1 2.71Å; D427-R430 PolarHBondContact OD1-NH1 2.88Å; D427-R430 IonicContact OD1-NH2 3.26Å; R430-R434 WeakPolarHBondContact O-CB 3.2Å; R430-R434 VanDerWaalsContact O-CG 3.26Å; R430-R434 WeakPolarHBondContact O-CG 3.49Å; R430-R434 PolarHBondContact O-N 2.98Å
431	K	90.3	Very high	79.7	Confident	129 Å²	129	101.2 Å²	101.2	56%	0.561	50%	0.497	S	S	*	.	H	α-helix	trans	-76.8	-27.4	175.9	-169.9	162.4	-178.4	171	0	113.4	D427 E428 E429	D427-K431 VanDerWaalsContact O-CB 3.29Å; D427-K431 WeakPolarHBondContact O-CB 3.28Å; D427-K431 PolarHBondContact O-N 2.97Å; E428-K431 CarbonylContact O-C 3.55Å; E428-K431 PolarHBondContact O-N 3.49Å; E429-K431 PolarHBondContact O-N 2.81Å
432	Q	86.4	Confident	77.4	Confident	79 Å²	79	106 Å²	106	37%	0.369	53%	0.53	S	S	.	.	H	α-helix	trans	-76.3	-44.3	173.4	-164.1	-170.5	62.3	0	0	111.2	E428 E429 R434 K435 K436	E428-Q432 WeakPolarHBondContact O-CB 3.29Å; E428-Q432 PolarHBondContact O-N 3.26Å; E429-Q432 PolarHBondContact O-N 3.03Å; Q432-R434 VanDerWaalsContact C-N 3.34Å; Q432-R434 PolarHBondContact O-N 3.3Å; Q432-K435 WeakPolarHBondContact O-CA 3.37Å; Q432-K435 WeakPolarHBondContact O-CB 3.44Å; Q432-K435 PolarHBondContact O-N 3.05Å; Q432-K436 PolarHBondContact O-N 2.96Å
433	N	84.1	Confident	74.7	Confident	100 Å²	100	112.4 Å²	112.4	54%	0.535	56%	0.56	S	S	.	*	H	α-helix	trans	-64.4	-38.7	179	-69.9	15.4	0	0	0	111.3	E429 K435 K436 G437	E429-N433 PolarHBondContact O-N 3.47Å; E429-N433 PolarHBondContact O-OD1 3.49Å; N433-K435 PolarHBondContact O-N 3.19Å; N433-K436 PolarHBondContact O-N 3.2Å; N433-G437 PolarHBondContact O-N 2.83Å
434	R	86.8	Confident	72.2	Confident	208 Å²	208	113.3 Å²	113.3	79%	0.785	58%	0.578	S	S	*	*	H	α-helix	trans	-61	-22.5	170.4	-78.4	178	177.4	-165.4	0	114.4	R430 Q432	R430-R434 WeakPolarHBondContact O-CB 3.2Å; R430-R434 VanDerWaalsContact O-CG 3.26Å; R430-R434 WeakPolarHBondContact O-CG 3.49Å; R430-R434 PolarHBondContact O-N 2.98Å; Q432-R434 VanDerWaalsContact C-N 3.34Å; Q432-R434 PolarHBondContact O-N 3.3Å
435	K	78.1	Confident	69.6	Low	168 Å²	168	119.6 Å²	119.6	73%	0.73	61%	0.608	S	S	*	*	H	α-helix	trans	-81.4	-46.3	170.6	-77.8	-165.9	167.6	-157.7	0	111.8	Q432 N433 G437 K438	Q432-K435 WeakPolarHBondContact O-CA 3.37Å; Q432-K435 WeakPolarHBondContact O-CB 3.44Å; Q432-K435 PolarHBondContact O-N 3.05Å; N433-K435 PolarHBondContact O-N 3.19Å; K435-G437 VanDerWaalsContact C-N 3.31Å; K435-G437 PolarHBondContact O-N 3.27Å; K435-K438 PolarHBondContact O-N 3.31Å
436	K	67.2	Low	66.7	Low	145 Å²	145	124.1 Å²	124.1	63%	0.63	64%	0.639	S	S	*	*	H	α-helix	trans	-59	-41.9	178	-70.3	-178.4	175.2	175.9	0	111.8	Q432 N433 K438 G439	Q432-K436 PolarHBondContact O-N 2.96Å; N433-K436 PolarHBondContact O-N 3.2Å; K436-K438 PolarHBondContact O-N 2.92Å; K436-G439 PolarHBondContact O-N 2.99Å; K436-G439 VanDerWaalsContact O-N 3.08Å
437	G	58.3	Low	63.7	Low	69 Å²	69	125.8 Å²	125.8	71%	0.711	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.5	0.6	179.6	0	0	0	0	0	116.9	N433 K435	N433-G437 PolarHBondContact O-N 2.83Å; K435-G437 VanDerWaalsContact C-N 3.31Å; K435-G437 PolarHBondContact O-N 3.27Å
438	K	54	Low	61.1	Low	196 Å²	196	127 Å²	127	85%	0.852	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.1	5	170.5	-77.7	-160.8	170.1	-163.6	0	113.9	K435 K436	K435-K438 PolarHBondContact O-N 3.31Å; K436-K438 PolarHBondContact O-N 2.92Å
439	G	47.6	Very low	58.3	Low	60 Å²	60	132.7 Å²	132.7	62%	0.619	71%	0.713	S	S	*	*	S	Bend	trans	-104.2	-1.3	-174.7	0	0	0	0	0	116.6	K436	K436-G439 PolarHBondContact O-N 2.99Å; K436-G439 VanDerWaalsContact O-N 3.08Å
440	Q	49.2	Very low	55.8	Low	193 Å²	193	133.6 Å²	133.6	90%	0.902	73%	0.729	S	S	*	*			trans	-134.3	86.2	-179.3	-74.4	-176.1	-23.5	0	0	110.8
441	A	42.5	Very low	53.2	Low	102 Å²	102	134.9 Å²	134.9	84%	0.843	75%	0.746	S	S	*	*	S	Bend	trans	-144.3	30.3	172.3	0	0	0	0	0	111.6
442	S	45.5	Very low	50.4	Low	105 Å²	105	131.9 Å²	131.9	73%	0.734	75%	0.752	S	S	*	*	S	Bend	trans	-158	49.8	-172.5	64.6	0	0	0	0	114
443	Q	39.5	Very low	48.3	Very low	197 Å²	197	138.2 Å²	138.2	92%	0.921	78%	0.778	S	S	*	*			trans	-164	136.3	152.7	-112.1	167.6	17.2	0	0	109.7
444	T	41.6	Very low	46	Very low	124 Å²	124	141.5 Å²	141.5	76%	0.761	79%	0.794	S	S	*	*			trans	-142.5	142.6	-169.9	-39.9	0	0	0	0	109
445	Q	39.1	Very low	43.6	Very low	190 Å²	190	135.7 Å²	135.7	89%	0.888	79%	0.791	S	S	*	*			trans	67.7	141.6	-179	-57.8	162.6	8.9	0	0	113.6
446	C	30.6	Very low	41.7	Very low	110 Å²	110	132.3 Å²	132.3	74%	0.743	80%	0.795	S	S	*	*			cis	-143.6	177.1	-8	58.8	0	0	0	0	107.3
447	N	31.3	Very low	40.2	Very low	153 Å²	153	132.7 Å²	132.7	82%	0.818	80%	0.802	S	S	*	*			cis	-155.8	176.1	26.5	-138.3	-5.3	0	0	0	111.3
448	S	37.1	Very low	39.1	Very low	110 Å²	110	134.4 Å²	134.4	77%	0.769	80%	0.801	S	S	*	*			trans	-91.6	142.1	-175.4	51	0	0	0	0	115.3
449	S	31.8	Very low	38.3	Very low	126 Å²	126	133.2 Å²	133.2	88%	0.881	80%	0.803	S	S	*	*			trans	-158.4	159.4	150.2	50.2	0	0	0	0	109.9
450	S	38.5	Very low	37.7	Very low	107 Å²	107	138.3 Å²	138.3	75%	0.748	81%	0.81	S	S	*	*			trans	-110.6	167.4	-164.4	55.5	0	0	0	0	114.7
451	D	37.5	Very low	37.5	Very low	162 Å²	162	139.1 Å²	139.1	87%	0.866	81%	0.811	S	S	*	*			trans	55.6	95.6	166.1	-70.5	-58.9	0	0	0	118.8
452	G	31.3	Very low	37.7	Very low	66 Å²	66	143.4 Å²	143.4	68%	0.68	81%	0.81	S	S	*	*			trans	-146.2	83.9	164.6	0	0	0	0	0	110	L454	G452-L454 PolarHBondContact O-N 3.03Å
453	K	43.3	Very low	38.3	Very low	212 Å²	212	141.2 Å²	141.2	92%	0.922	80%	0.795	S	S	*	*			trans	-75.2	61.6	-172.3	-163.8	179.8	-175.7	177	0	112.5	A455	K453-A455 PolarHBondContact O-N 2.96Å; K453-A455 VanDerWaalsContact O-N 3.07Å
454	L	36.5	Very low	40.5	Very low	168 Å²	168	135.7 Å²	135.7	88%	0.88	77%	0.772	S	S	*	*			trans	-65.1	107.6	173.2	-66.6	-179.6	0	0	0	109.2	G452 A456	G452-L454 PolarHBondContact O-N 3.03Å; L454-A456 PolarHBondContact O-N 3.16Å
455	A	35.9	Very low	42.9	Very low	86 Å²	86	132.9 Å²	132.9	71%	0.711	75%	0.752	S	S	*	*			trans	-56.6	133.4	170.6	0	0	0	0	0	109.1	K453 I457	K453-A455 PolarHBondContact O-N 2.96Å; K453-A455 VanDerWaalsContact O-N 3.07Å; A455-I457 VanDerWaalsContact C-N 3.34Å; A455-I457 PolarHBondContact O-N 3.23Å
456	A	38.1	Very low	45.5	Very low	98 Å²	98	123.8 Å²	123.8	81%	0.81	71%	0.709	S	S	*	*			trans	-63.1	99.3	170.9	0	0	0	0	0	108.2	L454 P458	L454-A456 PolarHBondContact O-N 3.16Å; A456-P458 WeakPolarHBondContact O-CD 3.34Å; A456-P458 VanDerWaalsContact O-N 3.13Å
457	I	35	Very low	48.5	Very low	152 Å²	152	124.4 Å²	124.4	78%	0.779	70%	0.697	S	S	*	*			trans	-52.3	121.5	170.4	-61.2	176.4	0	0	0	105.8	A455 L459	A455-I457 VanDerWaalsContact C-N 3.34Å; A455-I457 PolarHBondContact O-N 3.23Å; I457-L459 PolarHBondContact O-N 3.29Å
458	P	35.1	Very low	51.6	Low	106 Å²	106	118 Å²	118	69%	0.688	66%	0.662	S	S	*	*			trans	-54.7	119.7	177.6	-25.3	34.3	0	0	0	107.9	A456 Q460	A456-P458 WeakPolarHBondContact O-CD 3.34Å; A456-P458 VanDerWaalsContact O-N 3.13Å; P458-Q460 VanDerWaalsContact C-N 3.25Å; P458-Q460 PolarHBondContact O-N 3.43Å
459	L	36.6	Very low	54.3	Low	171 Å²	171	116.8 Å²	116.8	90%	0.895	64%	0.643	S	S	*	*			trans	-61.2	95.9	176.8	179.7	68.2	0	0	0	106.7	I457 K461	I457-L459 PolarHBondContact O-N 3.29Å; L459-K461 PolarHBondContact O-N 2.94Å
460	Q	35.7	Very low	57.3	Low	166 Å²	166	114.2 Å²	114.2	78%	0.776	62%	0.621	S	S	*	*			trans	-57.8	137.1	-177.8	-71.5	-161.7	-12.5	0	0	107.8	P458 K462	P458-Q460 VanDerWaalsContact C-N 3.25Å; P458-Q460 PolarHBondContact O-N 3.43Å; Q460-K462 PolarHBondContact O-N 3.06Å
461	K	44.7	Very low	59.8	Low	211 Å²	211	111.1 Å²	111.1	92%	0.917	60%	0.596	S	S	*	*			trans	-66.4	79.3	175.1	-69.3	-178.4	177.8	179.1	0	109.1	L459 S463	L459-K461 PolarHBondContact O-N 2.94Å; K461-S463 PolarHBondContact O-N 3.09Å
462	K	48.2	Very low	62.4	Low	191 Å²	191	109.7 Å²	109.7	83%	0.83	60%	0.595	S	S	*	*			trans	-54.3	122.4	155.1	-66.4	-169.9	174.4	-169.4	0	105.5	Q460	Q460-K462 PolarHBondContact O-N 3.06Å
463	S	56.4	Low	65.3	Low	59 Å²	59	109.1 Å²	109.1	41%	0.413	58%	0.577	S	S	.	*			trans	-57.7	141.1	169.2	34.7	0	0	0	0	108.3	E253 K461 I465	E253-S463 WeakPolarHBondContact OE1-CB 3.24Å; E253-S463 PolarHBondContact OE1-OG 3.41Å; K461-S463 PolarHBondContact O-N 3.09Å; S463-I465 PolarHBondContact O-N 2.93Å; S463-I465 WeakPolarHBondContact OG-CG1 3.13Å
464	D	85.6	Confident	67.6	Low	81 Å²	81	100.8 Å²	100.8	43%	0.433	54%	0.542	S	S	.	.			trans	-72.3	82.6	172.9	-72.1	-54.1	0	0	0	108.4	A254 T255	A254-D464 CarbonylContact C-O 3.53Å; A254-D464 PolarHBondContact N-O 3.18Å; T255-D464 WeakPolarHBondContact CA-OD2 3.34Å; T255-D464 WeakPolarHBondContact CB-OD2 3.46Å; T255-D464 VanDerWaalsContact CG2-OD2 3.28Å; T255-D464 WeakPolarHBondContact CG2-OD2 3.22Å; T255-D464 PolarHBondContact OG1-OD2 2.57Å
465	I	91.8	Very high	70.2	Confident	65 Å²	65	99.4 Å²	99.4	33%	0.333	53%	0.531	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	118.8	-178.8	-61.1	177.3	0	0	0	109	T251 E253 S463 Y467	T251-I465 HydrophobicContact CG2-CG2 3.54Å; E253-I465 HydrophobicContact CG-CG1 4.49Å; S463-I465 PolarHBondContact O-N 2.93Å; S463-I465 WeakPolarHBondContact OG-CG1 3.13Å; I465-Y467 HydrophobicContact CG2-CD2 4.44Å; I465-Y467 HydrophobicContact CG2-CE2 4.02Å
466	T	94.7	Very high	72.8	Confident	0 Å²	0	98.7 Å²	98.7	0%	0	52%	0.52	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	109.9	172.2	-61.2	0	0	0	0	111	T251 L252 K256 P266 T268	T251-T466 CarbonylContact C-O 3.59Å; T251-T466 WeakPolarHBondContact CA-O 3.31Å; L252-T466 PolarHBondContact N-O 3.38Å; L252-T466 PolarHBondContact O-N 2.94Å; K256-T466 HydrophobicContact CD-CG2 4.28Å; P266-T466 HydrophobicContact CB-CG2 3.67Å; P266-T466 HydrophobicContact CG-CG2 4.33Å; T268-T466 WeakPolarHBondContact OG1-CG2 3.37Å; T268-T466 PolarHBondContact OG1-OG1 3.26Å
467	Y	94.3	Very high	75.3	Confident	122 Å²	122	101.8 Å²	101.8	48%	0.478	52%	0.518	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	137.8	169.6	-63.8	-95.2	0	0	0	111.1	Q249 T251 P266 I465	Q249-Y467 HydrophobicContact CG-CD1 4.03Å; Q249-Y467 HydrophobicContact CG-CE1 4.28Å; T251-Y467 HydrophobicContact CG2-CD1 3.45Å; T251-Y467 VanDerWaalsContact CG2-CD1 3.45Å; T251-Y467 HydrophobicContact CG2-CD2 4.43Å; T251-Y467 HydrophobicContact CG2-CE1 3.51Å; T251-Y467 HydrophobicContact CG2-CE2 4.47Å; T251-Y467 HydrophobicContact CG2-CG 3.94Å; P266-Y467 WeakPolarHBondContact CG-O 3.2Å; I465-Y467 HydrophobicContact CG2-CD2 4.44Å; I465-Y467 HydrophobicContact CG2-CE2 4.02Å
468	F	95.5	Very high	78.1	Confident	20 Å²	20	96 Å²	96	9%	0.088	49%	0.49	C	S	.	.	P	Polyproline II helix	trans	-73	149.8	171.4	-75.8	-116.6	0	0	0	110.4	Y250 L252 I278 I391 I393 A409 Y410 C411	Y250-F468 HydrophobicContact CD2-CB 4.27Å; Y250-F468 HydrophobicContact CD2-CG 4.39Å; Y250-F468 WeakPolarHBondContact O-CD2 3.44Å; Y250-F468 PolarHBondContact O-N 3.3Å; L252-F468 HydrophobicContact CB-CE2 3.77Å; L252-F468 HydrophobicContact CB-CZ 4.37Å; I278-F468 HydrophobicContact CD1-CZ 4Å; I278-F468 HydrophobicContact CG2-CE2 4.49Å; I391-F468 HydrophobicContact CB-CE1 4.04Å; I391-F468 HydrophobicContact CB-CZ 4.3Å; I391-F468 HydrophobicContact CG2-CE1 3.86Å; I391-F468 HydrophobicContact CG2-CZ 4.01Å; I393-F468 HydrophobicContact CD1-CD1 4.06Å; I393-F468 HydrophobicContact CD1-CE1 3.61Å; I393-F468 HydrophobicContact CD1-CE2 4.08Å; I393-F468 HydrophobicContact CD1-CZ 3.63Å; I393-F468 HydrophobicContact CG1-CD1 4.12Å; I393-F468 HydrophobicContact CG1-CE1 3.69Å; I393-F468 HydrophobicContact CG1-CZ 4.18Å; A409-F468 HydrophobicContact CB-CB 3.83Å; Y410-F468 WeakPolarHBondContact O-CA 3.32Å; C411-F468 HydrophobicContact CB-CD1 3.83Å; C411-F468 HydrophobicContact CB-CD2 4.32Å; C411-F468 HydrophobicContact CB-CE1 3.73Å; C411-F468 HydrophobicContact CB-CE2 4.28Å; C411-F468 HydrophobicContact CB-CG 4.11Å; C411-F468 HydrophobicContact CB-CZ 3.97Å
469	K	94.3	Very high	81	Confident	84 Å²	84	91.3 Å²	91.3	37%	0.365	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	122.7	176.1	178.9	175.7	173.4	-171.4	0	109.5	G263 E264 P266 A409 Y410	G263-K469 PolarHBondContact O-NZ 3.3Å; E264-K469 PolarHBondContact O-NZ 3.07Å; P266-K469 HydrophobicContact CG-CB 4.28Å; A409-K469 CarbonylContact C-O 3.6Å; A409-K469 VanDerWaalsContact CA-O 3.23Å; A409-K469 WeakPolarHBondContact CA-O 3.28Å; A409-K469 WeakPolarHBondContact CB-O 3.2Å; Y410-K469 HydrophobicContact CD1-CB 4.27Å; Y410-K469 WeakPolarHBondContact CD1-O 3.16Å; Y410-K469 HydrophobicContact CE1-CB 3.97Å; Y410-K469 HydrophobicContact CE1-CD 3.98Å; Y410-K469 HydrophobicContact CE1-CG 3.93Å; Y410-K469 PolarHBondContact N-O 2.86Å; Y410-K469 PolarHBondContact O-N 3Å; Y410-K469 PolarHBondContact OH-NZ 3.36Å
470	T	93.9	Very high	83.8	Confident	71 Å²	71	85.6 Å²	85.6	44%	0.436	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.7	144.3	176.3	-58.4	0	0	0	0	111.7	R408	R408-T470 CarbonylContact O-C 3.54Å; R408-T470 WeakPolarHBondContact O-CA 3.38Å
471	M	92.3	Very high	86.7	Confident	43 Å²	43	77.7 Å²	77.7	21%	0.212	39%	0.393	C	S	.	.			trans	-109	128.7	173.2	-58.1	-179	69.7	0	0	109.2	M390 R408 Y410 D473	M390-M471 HydrophobicContact CE-CE 4.25Å; M390-M471 HydrophobicContact CE-SD 4.09Å; R408-M471 HydrophobicContact CB-CB 4.29Å; R408-M471 HydrophobicContact CG-CB 3.9Å; R408-M471 HydrophobicContact CG-CG 4.07Å; R408-M471 HydrophobicContact CG-SD 3.73Å; R408-M471 PolarHBondContact O-N 3.03Å; Y410-M471 HydrophobicContact CD1-CG 3.39Å; Y410-M471 HydrophobicContact CD1-SD 3.73Å; Y410-M471 HydrophobicContact CE1-CG 3.86Å; Y410-M471 HydrophobicContact CE1-SD 4.49Å; Y410-M471 HydrophobicContact CG-CG 4.38Å; Y410-M471 HydrophobicContact CG-SD 4.19Å; M471-D473 VanDerWaalsContact C-N 3.29Å
472	P	91.4	Very high	89.1	Confident	131 Å²	131	70.7 Å²	70.7	85%	0.851	37%	0.365	S	S	*	.	S	Bend	trans	-73.6	-23.2	175.8	30.5	-34.9	0	0	0	112.5	L474	P472-L474 PolarHBondContact O-N 3.42Å
473	D	91.4	Very high	90.7	Very high	55 Å²	55	61.7 Å²	61.7	29%	0.294	33%	0.326	S	S	.	.			trans	-81	107.3	176.9	177.8	21.9	0	0	0	111.7	R408 M471 H475 S476	R408-D473 WeakPolarHBondContact CD-O 3.19Å; R408-D473 PolarHBondContact NH1-O 3.33Å; M471-D473 VanDerWaalsContact C-N 3.29Å; D473-H475 WeakPolarHBondContact OD1-CA 3.43Å; D473-H475 PolarHBondContact OD1-N 3.25Å; D473-H475 IonicContact OD1-ND1 2.74Å; D473-S476 PolarHBondContact OD1-N 2.74Å; D473-S476 VanDerWaalsContact OD1-N 3.15Å; D473-S476 WeakPolarHBondContact OD2-CB 3.46Å; D473-S476 PolarHBondContact OD2-N 3.33Å; D473-S476 PolarHBondContact OD2-OG 3.02Å
474	L	92.6	Very high	91.3	Very high	37 Å²	37	64.2 Å²	64.2	19%	0.194	34%	0.335	C	S	.	.			trans	-101.7	4.5	174.5	-58.3	173.7	0	0	0	112.6	K404 P405 R408 P472	K404-L474 HydrophobicContact CG-CB 4.22Å; P405-L474 WeakPolarHBondContact CD-O 3.37Å; P405-L474 HydrophobicContact CG-CB 4.31Å; P405-L474 HydrophobicContact CG-CD2 4.12Å; R408-L474 HydrophobicContact CB-CD2 3.63Å; P472-L474 PolarHBondContact O-N 3.42Å
475	H	89.9	Confident	90	Very high	138 Å²	138	64.2 Å²	64.2	64%	0.639	34%	0.338	S	S	*	.	S	Bend	trans	-103.4	-35.9	-174.5	-55.9	108.7	0	0	0	113.4	K404 D473 Q477	K404-H475 WeakPolarHBondContact CE-NE2 3.15Å; K404-H475 PolarHBondContact NZ-NE2 2.9Å; D473-H475 WeakPolarHBondContact OD1-CA 3.43Å; D473-H475 PolarHBondContact OD1-N 3.25Å; D473-H475 IonicContact OD1-ND1 2.74Å; H475-Q477 PolarHBondContact O-N 3.07Å
476	S	91.3	Very high	88.2	Confident	71 Å²	71	62 Å²	62	50%	0.497	33%	0.326	S	S	.	.	S	Bend	trans	-60.2	137.4	175.9	-65.8	0	0	0	0	111.3	R408 D473	R408-S476 VanDerWaalsContact CZ-O 3.3Å; R408-S476 PolarHBondContact NH1-O 2.95Å; R408-S476 PolarHBondContact NH2-O 2.99Å; D473-S476 PolarHBondContact OD1-N 2.74Å; D473-S476 VanDerWaalsContact OD1-N 3.15Å; D473-S476 WeakPolarHBondContact OD2-CB 3.46Å; D473-S476 PolarHBondContact OD2-N 3.33Å; D473-S476 PolarHBondContact OD2-OG 3.02Å
477	Q	91.4	Very high	85.8	Confident	164 Å²	164	68 Å²	68	77%	0.766	35%	0.352	S	S	*	.	P	Polyproline II helix	trans	-96.4	128.9	178.5	-65.4	-175.1	4.1	0	0	110.8	H475	H475-Q477 PolarHBondContact O-N 3.07Å
478	P	93.6	Very high	83.3	Confident	29 Å²	29	64.3 Å²	64.3	19%	0.188	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-68.4	151	177.9	28.8	-34.6	0	0	0	112	M301 V303 L480	M301-P478 HydrophobicContact CE-CG 4.08Å; M301-P478 HydrophobicContact SD-CB 3.36Å; M301-P478 WeakPolarHBondContact SD-CB 3.21Å; M301-P478 HydrophobicContact SD-CG 3.4Å; M301-P478 WeakPolarHBondContact SD-CG 3.26Å; V303-P478 HydrophobicContact CG1-CB 4.13Å; P478-L480 PolarHBondContact O-N 2.9Å
479	V	95.3	Very high	80.5	Confident	9 Å²	9	67.7 Å²	67.7	6%	0.055	37%	0.366	C	S	.	.			trans	-82.2	99	178.6	-176.7	0	0	0	0	110.4	R310 Q313 L314 N353	R310-V479 HydrophobicContact CB-CG2 4.42Å; R310-V479 HydrophobicContact CG-CG1 4.34Å; R310-V479 HydrophobicContact CG-CG2 4.23Å; Q313-V479 HydrophobicContact CB-CB 4.21Å; Q313-V479 HydrophobicContact CB-CG1 4Å; Q313-V479 HydrophobicContact CB-CG2 4.12Å; Q313-V479 HydrophobicContact CG-CG2 4.37Å; L314-V479 HydrophobicContact CD2-CG1 3.64Å; L314-V479 HydrophobicContact CG-CG1 3.75Å; N353-V479 PolarHBondContact ND2-O 2.73Å
480	L	96.1	Very high	78.1	Confident	50 Å²	50	68.9 Å²	68.9	26%	0.262	38%	0.376	S	S	.	.			trans	-82.4	129.2	173.3	-60.3	-173	0	0	0	111.6	I350 A351 A354 P478 H486	I350-L480 HydrophobicContact CD1-CD1 4.27Å; A351-L480 HydrophobicContact CB-CB 3.88Å; A351-L480 HydrophobicContact CB-CD2 4.19Å; A351-L480 HydrophobicContact CB-CG 4.42Å; A354-L480 HydrophobicContact CB-CD2 3.69Å; P478-L480 PolarHBondContact O-N 2.9Å; L480-H486 PolarHBondContact O-NE2 3.3Å; L480-H486 VanDerWaalsContact O-NE2 3.09Å
481	F	96.5	Very high	75.6	Confident	1 Å²	1	73.9 Å²	73.9	0%	0.004	39%	0.394	C	S	.	.			trans	-101.4	115	179.3	178.1	-118.1	0	0	0	111.2	L314 W317 K318 H321 Y352 N353 P483 H486	L314-F481 HydrophobicContact CD2-CD2 4.24Å; W317-F481 HydrophobicContact CB-CB 3.95Å; W317-F481 HydrophobicContact CB-CD1 3.92Å; W317-F481 HydrophobicContact CB-CD2 3.55Å; W317-F481 HydrophobicContact CB-CE1 4.34Å; W317-F481 HydrophobicContact CB-CE2 4.01Å; W317-F481 HydrophobicContact CB-CG 3.51Å; W317-F481 HydrophobicContact CB-CZ 4.38Å; W317-F481 HydrophobicContact CG-CB 3.89Å; W317-F481 HydrophobicContact CG-CD1 4.49Å; W317-F481 HydrophobicContact CG-CD2 4.4Å; W317-F481 HydrophobicContact CG-CG 4.02Å; K318-F481 HydrophobicContact CG-CE2 3.91Å; H321-F481 HydrophobicContact CB-CE1 3.71Å; H321-F481 HydrophobicContact CB-CZ 3.69Å; H321-F481 AromaticContact CG-CE1 3.86Å; H321-F481 AromaticContact CG-CZ 3.89Å; Y352-F481 WeakPolarHBondContact CB-O 3.39Å; Y352-F481 HydrophobicContact CG-CD1 4.45Å; Y352-F481 PolarHBondContact N-O 3.15Å; N353-F481 PolarHBondContact OD1-N 3.06Å; F481-P483 HydrophobicContact CE1-CG 3.81Å; F481-P483 HydrophobicContact CZ-CB 4.22Å; F481-P483 HydrophobicContact CZ-CG 3.81Å; F481-H486 AromaticContact CD2-CD2 3.81Å
482	I	94.1	Very high	72.9	Confident	63 Å²	63	81.3 Å²	81.3	32%	0.323	42%	0.42	S	S	.	.			trans	-127.7	106.5	174.5	-55.9	172.5	0	0	0	106	A351 D484 V485 H486	A351-I482 HydrophobicContact CB-CG1 4.1Å; I482-D484 PolarHBondContact O-N 1.97Å; I482-V485 HydrophobicContact CB-CB 4.38Å; I482-V485 HydrophobicContact CB-CG2 4.33Å; I482-V485 HydrophobicContact CG2-CB 4.26Å; I482-V485 HydrophobicContact CG2-CG2 3.78Å; I482-H486 PolarHBondContact N-CD2 2.77Å; I482-H486 PolarHBondContact O-CD2 3.07Å; I482-H486 PolarHBondContact O-N 3.33Å
483	P	81.6	Confident	69.9	Low	3 Å²	3	79.7 Å²	79.7	2%	0.019	41%	0.408	C	S	.	.	H	α-helix	trans	-50.4	-52	-168.5	-29.6	34	0	0	0	114	Y352 F481 H486 F487	Y352-P483 HydrophobicContact CD1-CG 3.96Å; Y352-P483 HydrophobicContact CD2-CG 4.12Å; Y352-P483 VanDerWaalsContact CE1-CD 3.45Å; Y352-P483 HydrophobicContact CE1-CG 3.79Å; Y352-P483 HydrophobicContact CE2-CG 3.98Å; Y352-P483 HydrophobicContact CG-CG 4.13Å; F481-P483 HydrophobicContact CE1-CG 3.81Å; F481-P483 HydrophobicContact CZ-CB 4.22Å; F481-P483 HydrophobicContact CZ-CG 3.81Å; P483-H486 CarbonylContact O-C 3.57Å; P483-H486 PolarHBondContact O-N 2.86Å; P483-H486 VanDerWaalsContact O-N 3.13Å; P483-F487 VanDerWaalsContact O-CD2 3.29Å; P483-F487 WeakPolarHBondContact O-CD2 3.33Å; P483-F487 PolarHBondContact O-N 3.34Å
484	D	69.9	Low	67	Low	111 Å²	111	80.1 Å²	80.1	59%	0.594	43%	0.425	S	S	*	.	H	α-helix	trans	-72	-42.4	-166.1	-48.4	-76.1	0	0	0	112.5	I482 H486 F487 A488	I482-D484 PolarHBondContact O-N 1.97Å; D484-H486 PolarHBondContact O-N 3.44Å; D484-F487 PolarHBondContact O-N 2.85Å; D484-A488 PolarHBondContact O-N 2.95Å; D484-A488 VanDerWaalsContact O-N 3.16Å
485	V	59.3	Low	64	Low	81 Å²	81	87 Å²	87	49%	0.491	46%	0.456	S	S	.	.	H	α-helix	trans	-57.7	-37.6	171.4	-180	0	0	0	0	110.8	I482	I482-V485 HydrophobicContact CB-CB 4.38Å; I482-V485 HydrophobicContact CB-CG2 4.33Å; I482-V485 HydrophobicContact CG2-CB 4.26Å; I482-V485 HydrophobicContact CG2-CG2 3.78Å
486	H	52.3	Low	61	Low	19 Å²	19	85.8 Å²	85.8	9%	0.088	46%	0.459	C	S	.	.	H	α-helix	trans	-81.9	-10	179.3	-65.2	-49.9	0	0	0	114	L314 K318 L480 F481 I482 P483 D484	L314-H486 VanDerWaalsContact CD2-NE2 3.32Å; L314-H486 WeakPolarHBondContact CD2-NE2 2.96Å; K318-H486 WeakPolarHBondContact CE-O 3.46Å; K318-H486 PolarHBondContact NZ-O 3.48Å; L480-H486 PolarHBondContact O-NE2 3.3Å; L480-H486 VanDerWaalsContact O-NE2 3.09Å; F481-H486 AromaticContact CD2-CD2 3.81Å; I482-H486 PolarHBondContact N-CD2 2.77Å; I482-H486 PolarHBondContact O-CD2 3.07Å; I482-H486 PolarHBondContact O-N 3.33Å; P483-H486 CarbonylContact O-C 3.57Å; P483-H486 PolarHBondContact O-N 2.86Å; P483-H486 VanDerWaalsContact O-N 3.13Å; D484-H486 PolarHBondContact O-N 3.44Å
487	F	45.6	Very low	57.9	Low	125 Å²	125	92.3 Å²	92.3	55%	0.548	47%	0.474	S	S	.	.	H	α-helix	trans	-83.5	-45.7	168.5	-90.5	-75.4	0	0	0	111.8	P483 D484 N489 L490	P483-F487 VanDerWaalsContact O-CD2 3.29Å; P483-F487 WeakPolarHBondContact O-CD2 3.33Å; P483-F487 PolarHBondContact O-N 3.34Å; D484-F487 PolarHBondContact O-N 2.85Å; F487-N489 PolarHBondContact O-N 2.97Å; F487-N489 VanDerWaalsContact O-N 3.14Å; F487-L490 PolarHBondContact O-N 3.07Å; F487-L490 VanDerWaalsContact O-N 3.08Å
488	A	40.4	Very low	54.8	Low	46 Å²	46	94.8 Å²	94.8	38%	0.38	48%	0.477	S	S	.	.	H	α-helix	trans	-61.6	-23.6	-175.4	0	0	0	0	0	114.8	D484	D484-A488 PolarHBondContact O-N 2.95Å; D484-A488 VanDerWaalsContact O-N 3.16Å
489	N	38	Very low	51.6	Low	90 Å²	90	100 Å²	100	48%	0.481	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-34.8	175.7	-71.8	-26.7	0	0	0	112.8	F487 Q491 R492 T493	F487-N489 PolarHBondContact O-N 2.97Å; F487-N489 VanDerWaalsContact O-N 3.14Å; N489-Q491 VanDerWaalsContact C-N 3.31Å; N489-Q491 PolarHBondContact O-N 2.87Å; N489-R492 PolarHBondContact O-N 2.82Å; N489-T493 PolarHBondContact O-N 2.71Å; N489-T493 PolarHBondContact O-OG1 3.26Å
490	L	44	Very low	48.5	Very low	110 Å²	110	104 Å²	104	58%	0.576	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-31.1	-173.9	-169.1	63.1	0	0	0	112.5	F487 R492 T493	F487-L490 PolarHBondContact O-N 3.07Å; F487-L490 VanDerWaalsContact O-N 3.08Å; L490-R492 VanDerWaalsContact C-N 3.27Å; L490-R492 PolarHBondContact O-N 2.77Å; L490-T493 PolarHBondContact O-N 2.82Å
491	Q	40.5	Very low	45.4	Very low	175 Å²	175	109.8 Å²	109.8	82%	0.818	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.1	-24.9	172.8	-65.5	-171.6	3.6	0	0	113.1	N489	N489-Q491 VanDerWaalsContact C-N 3.31Å; N489-Q491 PolarHBondContact O-N 2.87Å
492	R	35.5	Very low	42.4	Very low	199 Å²	199	117.3 Å²	117.3	75%	0.751	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	-18.8	176.6	-89.1	-179.8	-82.8	-136.9	-2.1	114.1	N489 L490 G494	N489-R492 PolarHBondContact O-N 2.82Å; L490-R492 VanDerWaalsContact C-N 3.27Å; L490-R492 PolarHBondContact O-N 2.77Å; R492-G494 VanDerWaalsContact C-N 3.29Å
493	T	29.4	Very low	39.5	Very low	97 Å²	97	121.2 Å²	121.2	60%	0.595	63%	0.626	S	S	*	*	S	Bend	trans	-84.4	-1.5	172.8	-39.8	0	0	0	0	112.9	N489 L490 Q495	N489-T493 PolarHBondContact O-N 2.71Å; N489-T493 PolarHBondContact O-OG1 3.26Å; L490-T493 PolarHBondContact O-N 2.82Å; T493-Q495 PolarHBondContact O-N 2.88Å; T493-Q495 VanDerWaalsContact O-N 3.09Å
494	G	30.2	Very low	37.2	Very low	64 Å²	64	130.6 Å²	130.6	66%	0.66	66%	0.661	S	S	*	*	S	Bend	trans	-70.1	3	-178.2	0	0	0	0	0	116.8	R492	R492-G494 VanDerWaalsContact C-N 3.29Å
495	Q	30	Very low	35.3	Very low	182 Å²	182	134.1 Å²	134.1	85%	0.85	67%	0.674	S	S	*	*			trans	-131	65.7	177.9	-73.4	-165.3	-35.1	0	0	112.5	T493	T493-Q495 PolarHBondContact O-N 2.88Å; T493-Q495 VanDerWaalsContact O-N 3.09Å
496	V	27.2	Very low	33.9	Very low	113 Å²	113	134.2 Å²	134.2	69%	0.685	69%	0.691	S	S	*	*			trans	-130.9	110.1	156.2	-176.4	0	0	0	0	107.8	Y498	V496-Y498 PolarHBondContact O-N 3.47Å
497	Y	25.8	Very low	32.8	Very low	207 Å²	207	137.3 Å²	137.3	81%	0.812	73%	0.729	S	S	*	*			trans	-68.6	125.1	172.4	-82.8	-102.7	0	0	0	109.6
498	Y	26.6	Very low	31.9	Very low	216 Å²	216	136.6 Å²	136.6	85%	0.847	74%	0.739	S	S	*	*			trans	-92.6	108.6	149.6	-96.7	-84.9	0	0	0	107.6	V496	V496-Y498 PolarHBondContact O-N 3.47Å
499	N	26.7	Very low	31.5	Very low	140 Å²	140	141.2 Å²	141.2	75%	0.749	76%	0.762	S	S	*	*			trans	-74.7	130	157.1	-66.4	-41.9	0	0	0	107.4
500	A	30.1	Very low	31.2	Very low	93 Å²	93	143.8 Å²	143.8	77%	0.769	78%	0.775	S	S	*	*			trans	-131.2	114.3	162.8	0	0	0	0	0	106.1
501	D	29.5	Very low	30.6	Very low	170 Å²	170	144.7 Å²	144.7	91%	0.909	79%	0.785	S	S	*	*			trans	-69.8	125.9	167.6	-71.1	-58.5	0	0	0	108.8
502	D	33.4	Very low	30.2	Very low	160 Å²	160	144.9 Å²	144.9	86%	0.856	78%	0.783	S	S	*	*			trans	-150.1	157.1	138.8	-147.5	-21.2	0	0	0	109
503	E	34.1	Very low	29.9	Very low	144 Å²	144	146.5 Å²	146.5	67%	0.673	79%	0.789	S	S	*	*			trans	-84.9	169.3	-163.5	-53.1	-167.5	103.1	0	0	115.8
504	R	32.5	Very low	29.8	Very low	200 Å²	200	149.2 Å²	149.2	76%	0.755	80%	0.797	S	S	*	*			trans	89.4	101.1	151	-69.5	167.6	-159	-134.2	-1.4	120.4
505	E	31.3	Very low	29.7	Very low	186 Å²	186	155.6 Å²	155.6	87%	0.869	81%	0.807	S	S	*	*				95.5	112.5	108.7	-166.2	165.1	-152.6	0	0	119.6
506	G	29.9	Very low	29.8	Very low	82 Å²	82	157.5 Å²	157.5	85%	0.845	81%	0.807	S	S	*	*			trans	106.3	107.4	150	0	0	0	0	0	117.5
507	G	29	Very low	30.4	Very low	85 Å²	85	156.7 Å²	156.7	88%	0.876	80%	0.804	S	S	*	*			trans	147.2	82.5	163.7	0	0	0	0	0	116.4
508	S	27.1	Very low	30.5	Very low	110 Å²	110	154.2 Å²	154.2	77%	0.769	80%	0.801	S	S	*	*			trans	-82.1	133.3	177.6	175.3	0	0	0	0	113.6
509	V	31.6	Very low	30.7	Very low	143 Å²	143	152 Å²	152	87%	0.867	80%	0.799	S	S	*	*			trans	-144	143.8	140.7	-168.8	0	0	0	0	109.6
510	L	30.5	Very low	31	Very low	144 Å²	144	152.9 Å²	152.9	75%	0.754	80%	0.798	S	S	*	*			trans	-79.7	170.8	177.7	-62.8	150.5	0	0	0	110.7
511	V	32.4	Very low	31.1	Very low	129 Å²	129	157.7 Å²	157.7	78%	0.782	81%	0.805	S	S	*	*				-167.3	117.3	53.1	170.7	0	0	0	0	106.8
512	K	31.9	Very low	31.3	Very low	178 Å²	178	158.5 Å²	158.5	77%	0.774	80%	0.801	S	S	*	*				67.3	92.8	77.7	-168.9	-174.2	-179.1	178	0	117.3
513	R	28.6	Very low	31.2	Very low	233 Å²	233	153.9 Å²	153.9	88%	0.879	79%	0.791	S	S	*	*			trans	-161.1	103.3	144.9	-111.7	176.9	173.3	133	-0.7	108.9
514	M	28.4	Very low	31.2	Very low	154 Å²	154	153 Å²	153	76%	0.759	80%	0.797	S	S	*	*				94.5	89	87.1	-84	177.8	167.5	0	0	114.5
515	F	26.3	Very low	31.1	Very low	198 Å²	198	150 Å²	150	87%	0.868	80%	0.801	S	S	*	*				-1.3	153.4	125.4	-77.1	-64.7	0	0	0	118
516	R	32.8	Very low	31.3	Very low	223 Å²	223	146.7 Å²	146.7	84%	0.842	80%	0.795	S	S	*	*			cis	-171.6	-167.9	25.9	-124.4	-170.3	-162.5	-168.5	4.7	107.4
517	P	40.9	Very low	31.5	Very low	96 Å²	96	147.8 Å²	147.8	62%	0.623	79%	0.79	S	S	*	*			cis	-131.8	-167.3	-44.6	39.4	-21.9	0	0	0	113.2
518	M	26.4	Very low	32.2	Very low	154 Å²	154	153.9 Å²	153.9	76%	0.759	79%	0.793	S	S	*	*			trans	71.5	147.5	158.2	-111.8	82.1	178.1	0	0	117.4
519	E	31.8	Very low	32.5	Very low	170 Å²	170	157.5 Å²	157.5	79%	0.794	80%	0.797	S	S	*	*			cis	-137.2	-177.9	-0.1	-160.6	140.9	-135.3	0	0	111.7
520	E	32.5	Very low	32.4	Very low	159 Å²	159	159.1 Å²	159.1	74%	0.743	80%	0.798	S	S	*	*			trans	-113.7	127.1	-159.7	175.1	177.3	-160.3	0	0	112.1	F522	E520-F522 HydrophobicContact CG-CD2 4.45Å; E520-F522 HydrophobicContact CG-CE2 4.47Å
521	E	31.1	Very low	32.4	Very low	193 Å²	193	162.2 Å²	162.2	90%	0.902	81%	0.805	S	S	*	*			trans	-145.3	125.8	165.8	-165.9	167	-143.8	0	0	111.5
522	F	33.7	Very low	32.8	Very low	188 Å²	188	164.4 Å²	164.4	83%	0.825	81%	0.807	S	S	*	*			trans	-87.7	108.7	179.6	-90.1	-102.4	0	0	0	111	E520	E520-F522 HydrophobicContact CG-CD2 4.45Å; E520-F522 HydrophobicContact CG-CE2 4.47Å
523	G	33	Very low	33	Very low	63 Å²	63	163.5 Å²	163.5	65%	0.649	81%	0.805	S	S	*	*			trans	-114.1	144.7	169.5	0	0	0	0	0	112.2
524	P	32.4	Very low	33.7	Very low	125 Å²	125	156.4 Å²	156.4	81%	0.812	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-70.4	149.7	-178.4	29.6	-35.1	0	0	0	112.3	P526	P524-P526 WeakPolarHBondContact O-CD 3.47Å
525	V	31.7	Very low	35.1	Very low	138 Å²	138	152.5 Å²	152.5	84%	0.836	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-58.2	120.4	179.3	-178	0	0	0	0	110.2	S527	V525-S527 PolarHBondContact O-N 2.75Å
526	P	35.7	Very low	37.5	Very low	115 Å²	115	148.7 Å²	148.7	75%	0.747	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-62.3	134.8	172.1	26.2	-32.7	0	0	0	109	P524	P524-P526 WeakPolarHBondContact O-CD 3.47Å
527	S	33.5	Very low	40.2	Very low	105 Å²	105	145.4 Å²	145.4	73%	0.734	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-57.6	157.3	-176.3	49.8	0	0	0	0	112.1	V525 Q529	V525-S527 PolarHBondContact O-N 2.75Å; S527-Q529 PolarHBondContact O-N 3.4Å
528	K	44.3	Very low	42.8	Very low	213 Å²	213	141 Å²	141	93%	0.926	73%	0.731	S	S	*	*			trans	-53.4	95.5	174.5	-71.4	178.7	177.9	176.1	0	110.2	M530	K528-M530 PolarHBondContact O-N 2.74Å
529	Q	32.5	Very low	46.1	Very low	186 Å²	186	135.1 Å²	135.1	87%	0.869	70%	0.703	S	S	*	*			trans	-63.4	130.1	164.6	-79.7	-171.8	-28.7	0	0	108	S527 K531	S527-Q529 PolarHBondContact O-N 3.4Å; Q529-K531 PolarHBondContact O-N 3.34Å
530	M	29.7	Very low	49.2	Very low	177 Å²	177	127 Å²	127	87%	0.872	67%	0.665	S	S	*	*			trans	-56.4	136	174.2	-160.7	161.8	64.3	0	0	108	K528 E532	K528-M530 PolarHBondContact O-N 2.74Å; M530-E532 VanDerWaalsContact C-N 3.25Å; M530-E532 PolarHBondContact O-N 2.72Å
531	K	31.5	Very low	52.3	Low	209 Å²	209	123 Å²	123	91%	0.909	64%	0.644	S	S	*	*			trans	-73.4	84.1	-176.9	-173	-176.5	176.4	-177.9	0	109.9	Q529	Q529-K531 PolarHBondContact O-N 3.34Å
532	E	40.4	Very low	55.4	Low	175 Å²	175	113.8 Å²	113.8	82%	0.818	60%	0.601	S	S	*	*			trans	-64.5	166.1	175.1	-162.8	164.4	-163.3	0	0	111.4	M530	M530-E532 VanDerWaalsContact C-N 3.25Å; M530-E532 PolarHBondContact O-N 2.72Å
533	E	36.5	Very low	58.3	Low	159 Å²	159	107.8 Å²	107.8	74%	0.743	57%	0.572	S	S	*	*			trans	-50.4	142.2	-158.5	-63.4	-173.5	120.8	0	0	117.1	T535	E533-T535 HydrophobicContact CB-CG2 4.49Å; E533-T535 PolarHBondContact O-N 3.24Å
534	G	41.5	Very low	61.2	Low	84 Å²	84	108.4 Å²	108.4	87%	0.866	56%	0.557	S	S	*	*			trans	-71.8	77.6	155.1	0	0	0	0	0	110.5	K536	G534-K536 PolarHBondContact O-N 2.84Å
535	T	59.2	Low	63.9	Low	72 Å²	72	110.1 Å²	110.1	44%	0.442	56%	0.555	S	S	.	*			trans	-46.8	120.8	-179.5	39.9	0	0	0	0	112.4	E533 R537	E533-T535 HydrophobicContact CB-CG2 4.49Å; E533-T535 PolarHBondContact O-N 3.24Å; T535-R537 VanDerWaalsContact C-N 3.32Å; T535-R537 PolarHBondContact O-N 2.86Å
536	K	76.6	Confident	66.6	Low	118 Å²	118	109.2 Å²	109.2	51%	0.513	55%	0.55	S	S	.	.			trans	-72.4	80.8	-177.5	-174.6	-161.8	168.9	-171.4	0	110.8	G534 P558 E599	G534-K536 PolarHBondContact O-N 2.84Å; K536-P558 HydrophobicContact CB-CG 4.41Å; K536-P558 HydrophobicContact CD-CG 4.44Å; K536-P558 WeakPolarHBondContact O-CD 3.23Å; K536-E599 PolarHBondContact NZ-O 3.43Å
537	R	89.9	Confident	69.3	Low	154 Å²	154	106.1 Å²	106.1	58%	0.581	53%	0.527	S	S	*	.			trans	-65.3	142.5	173.5	-59.4	-175.7	-171.8	-168	0.9	110.8	T535 M554 L555	T535-R537 VanDerWaalsContact C-N 3.32Å; T535-R537 PolarHBondContact O-N 2.86Å; R537-M554 HydrophobicContact CB-SD 4.27Å; R537-L555 VanDerWaalsContact CA-O 3.3Å; R537-L555 WeakPolarHBondContact CA-O 3.24Å
538	V	94.5	Very high	71.9	Confident	3 Å²	3	108.3 Å²	108.3	2%	0.018	53%	0.53	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	129.6	178.7	-178	0	0	0	0	109.7	L540 L555 P558 S602 N603	V538-L540 HydrophobicContact CG1-CD2 3.6Å; V538-L540 HydrophobicContact CG1-CG 4.35Å; V538-L555 HydrophobicContact CB-CB 4.46Å; V538-L555 PolarHBondContact N-O 2.88Å; V538-L555 VanDerWaalsContact N-O 3.17Å; V538-L555 WeakPolarHBondContact O-CB 3.33Å; V538-L555 PolarHBondContact O-N 2.93Å; V538-P558 HydrophobicContact CG2-CB 4.02Å; V538-S602 WeakPolarHBondContact CG1-O 3.47Å; V538-N603 WeakPolarHBondContact CA-OD1 3.37Å
539	L	95.6	Very high	74.3	Confident	31 Å²	31	103.6 Å²	103.6	16%	0.162	52%	0.519	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	122.3	170.5	171.5	58.8	0	0	0	109.3	Y541 A552 L553 M554 N603 E604	L539-Y541 HydrophobicContact CD1-CE1 4.31Å; L539-Y541 HydrophobicContact CD2-CE1 4.18Å; L539-Y541 HydrophobicContact CG-CE1 4.33Å; L539-A552 HydrophobicContact CD1-CB 3.75Å; L539-L553 WeakPolarHBondContact CA-O 3.37Å; L539-M554 HydrophobicContact CB-CE 3.93Å; L539-M554 HydrophobicContact CD1-CE 4.29Å; L539-N603 PolarHBondContact N-OD1 2.62Å; L539-N603 CarbonylContact O-C 3.56Å; L539-N603 WeakPolarHBondContact O-CA 3.45Å; L539-E604 HydrophobicContact CD2-CG 4.46Å; L539-E604 PolarHBondContact O-N 3.41Å
540	L	97	Very high	77.3	Confident	0 Å²	0	98.5 Å²	98.5	0%	0	49%	0.494	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	149.6	171	-49.6	179.7	0	0	0	110.1	V538 L553 L555 L563 Y601 D605 F607	V538-L540 HydrophobicContact CG1-CD2 3.6Å; V538-L540 HydrophobicContact CG1-CG 4.35Å; L540-L553 HydrophobicContact CB-CB 4.42Å; L540-L553 PolarHBondContact N-O 3Å; L540-L553 PolarHBondContact O-N 3.15Å; L540-L555 HydrophobicContact CD1-CD1 3.89Å; L540-L555 HydrophobicContact CD1-CD2 4.02Å; L540-L555 HydrophobicContact CG-CD1 3.98Å; L540-L563 HydrophobicContact CD1-CD1 4.15Å; L540-Y601 HydrophobicContact CD1-CD2 4.17Å; L540-Y601 HydrophobicContact CD2-CD2 4.39Å; L540-Y601 HydrophobicContact CD2-CG 4.21Å; L540-D605 HydrophobicContact CD2-CB 4.13Å; L540-F607 HydrophobicContact CB-CE2 4.47Å; L540-F607 HydrophobicContact CD1-CE2 4.36Å; L540-F607 HydrophobicContact CD2-CE2 4.21Å
541	Y	97.2	Very high	80.5	Confident	74 Å²	74	92 Å²	92	29%	0.29	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	122.6	172.3	-70.6	-47.1	0	0	0	110.4	L539 D551 A552 E604 D605 T606 F607	L539-Y541 HydrophobicContact CD1-CE1 4.31Å; L539-Y541 HydrophobicContact CD2-CE1 4.18Å; L539-Y541 HydrophobicContact CG-CE1 4.33Å; Y541-D551 WeakPolarHBondContact CA-O 3.49Å; Y541-A552 HydrophobicContact CD1-CB 4.44Å; Y541-A552 HydrophobicContact CE1-CB 4.27Å; Y541-E604 HydrophobicContact CD2-CB 3.92Å; Y541-E604 HydrophobicContact CD2-CG 4.34Å; Y541-E604 HydrophobicContact CE2-CB 3.6Å; Y541-E604 HydrophobicContact CE2-CG 3.58Å; Y541-D605 PolarHBondContact N-O 3.06Å; Y541-T606 HydrophobicContact CD2-CG2 4.39Å; Y541-T606 CarbonylContact O-C 3.56Å; Y541-T606 VanDerWaalsContact O-CA 3.31Å; Y541-T606 WeakPolarHBondContact O-CA 3.14Å; Y541-F607 PolarHBondContact O-N 3.33Å
542	V	96.7	Very high	83.6	Confident	0 Å²	0	84.7 Å²	84.7	0%	0	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	142.6	-176.5	-54	0	0	0	0	111.6	F550 D551 L553 Y571 F607 L609 L622	V542-F550 CarbonylContact O-C 3.52Å; V542-F550 WeakPolarHBondContact O-CA 3.47Å; V542-D551 HydrophobicContact CG2-CB 4.11Å; V542-D551 PolarHBondContact N-O 3.28Å; V542-D551 PolarHBondContact O-N 2.85Å; V542-L553 HydrophobicContact CB-CD1 4.45Å; V542-L553 HydrophobicContact CG1-CD1 3.76Å; V542-L553 HydrophobicContact CG1-CG 4.28Å; V542-L553 HydrophobicContact CG2-CD1 3.81Å; V542-L553 HydrophobicContact CG2-CD2 4.47Å; V542-L553 HydrophobicContact CG2-CG 3.81Å; V542-Y571 HydrophobicContact CG2-CE2 4.45Å; V542-Y571 WeakPolarHBondContact CG2-OH 3.02Å; V542-F607 WeakPolarHBondContact CA-O 3.44Å; V542-F607 HydrophobicContact CG1-CB 4.33Å; V542-F607 HydrophobicContact CG1-CD2 4.42Å; V542-L609 HydrophobicContact CB-CB 4.09Å; V542-L609 HydrophobicContact CG2-CB 4.45Å; V542-L609 HydrophobicContact CG2-CD2 4.04Å; V542-L622 HydrophobicContact CG1-CD2 3.91Å
543	R	95.5	Very high	86.2	Confident	62 Å²	62	76.4 Å²	76.4	23%	0.234	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	156.1	170.3	69.8	-172.6	-169.7	114.5	-5.2	110.6	D547 D548 V549 F550 F607 I608 L609	R543-D547 VanDerWaalsContact CD-O 3.26Å; R543-D547 WeakPolarHBondContact CD-O 3.29Å; R543-D547 PolarHBondContact NH1-O 3.15Å; R543-D548 IonicContact NH1-OD1 3.72Å; R543-V549 VanDerWaalsContact CB-O 3.26Å; R543-V549 WeakPolarHBondContact CB-O 3.45Å; R543-F550 HydrophobicContact CB-CD1 3.94Å; R543-F550 HydrophobicContact CB-CE1 4.31Å; R543-F550 HydrophobicContact CB-CG 4.25Å; R543-F550 HydrophobicContact CG-CD1 3.91Å; R543-F550 HydrophobicContact CG-CE1 3.76Å; R543-F550 HydrophobicContact CG-CG 4.44Å; R543-F550 HydrophobicContact CG-CZ 4.15Å; R543-F607 PolarHBondContact N-O 2.88Å; R543-F607 VanDerWaalsContact N-O 3.1Å; R543-I608 HydrophobicContact CG-CD1 3.66Å; R543-I608 CarbonylContact O-C 3.59Å; R543-I608 VanDerWaalsContact O-CA 3.27Å; R543-I608 WeakPolarHBondContact O-CA 3.25Å; R543-L609 PolarHBondContact O-N 3.46Å
544	K	92.9	Very high	89	Confident	77 Å²	77	73.3 Å²	73.3	34%	0.335	39%	0.389	S	S	.	.			trans	-75.3	161.7	167.6	-51.5	-173.1	-152.3	87.5	0	109.7	T546 D547	K544-T546 PolarHBondContact O-N 3.01Å; K544-T546 VanDerWaalsContact O-N 3.15Å; K544-D547 HydrophobicContact CB-CB 4.26Å; K544-D547 WeakPolarHBondContact CB-OD2 3.42Å; K544-D547 VanDerWaalsContact CG-OD2 3.3Å; K544-D547 WeakPolarHBondContact CG-OD2 3.45Å; K544-D547 IonicContact NZ-OD2 2.97Å; K544-D547 PolarHBondContact NZ-OD2 2.95Å; K544-D547 PolarHBondContact O-N 2.79Å
545	E	88.9	Confident	91.5	Very high	161 Å²	161	69.3 Å²	69.3	75%	0.752	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-22.7	177.3	-165.7	163.7	-165	0	0	112.9	I608	E545-I608 HydrophobicContact CB-CG2 3.99Å
546	T	88.6	Confident	93	Very high	119 Å²	119	70.5 Å²	70.5	73%	0.73	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-12.2	175.6	48.8	0	0	0	0	115.3	K544	K544-T546 PolarHBondContact O-N 3.01Å; K544-T546 VanDerWaalsContact O-N 3.15Å
547	D	92.1	Very high	93.7	Very high	49 Å²	49	66.8 Å²	66.8	26%	0.262	34%	0.336	S	S	.	.			trans	-111.7	120.1	-162.6	-57.9	0.1	0	0	0	109.4	R543 K544 V549	R543-D547 VanDerWaalsContact CD-O 3.26Å; R543-D547 WeakPolarHBondContact CD-O 3.29Å; R543-D547 PolarHBondContact NH1-O 3.15Å; K544-D547 HydrophobicContact CB-CB 4.26Å; K544-D547 WeakPolarHBondContact CB-OD2 3.42Å; K544-D547 VanDerWaalsContact CG-OD2 3.3Å; K544-D547 WeakPolarHBondContact CG-OD2 3.45Å; K544-D547 IonicContact NZ-OD2 2.97Å; K544-D547 PolarHBondContact NZ-OD2 2.95Å; K544-D547 PolarHBondContact O-N 2.79Å; D547-V549 VanDerWaalsContact C-N 3.25Å; D547-V549 PolarHBondContact O-N 3.14Å
548	D	89.4	Confident	93.8	Very high	151 Å²	151	60.1 Å²	60.1	81%	0.807	31%	0.312	S	S	*	.	S	Bend	trans	-76.2	-7.6	-178.4	-75	-41	0	0	0	114.7	R543	R543-D548 IonicContact NH1-OD1 3.72Å
549	V	93.9	Very high	93.8	Very high	114 Å²	114	61.5 Å²	61.5	69%	0.691	32%	0.321	S	S	*	.	S	Bend	trans	-114.1	138.6	-175.7	-178.3	0	0	0	0	110.1	R543 D547	R543-V549 VanDerWaalsContact CB-O 3.26Å; R543-V549 WeakPolarHBondContact CB-O 3.45Å; D547-V549 VanDerWaalsContact C-N 3.25Å; D547-V549 PolarHBondContact O-N 3.14Å
550	F	96.3	Very high	93.8	Very high	79 Å²	79	61.4 Å²	61.4	35%	0.346	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-88.4	132.4	174.5	-69.3	-93.1	0	0	0	112.2	V542 R543 T606 I625	V542-F550 CarbonylContact O-C 3.52Å; V542-F550 WeakPolarHBondContact O-CA 3.47Å; R543-F550 HydrophobicContact CB-CD1 3.94Å; R543-F550 HydrophobicContact CB-CE1 4.31Å; R543-F550 HydrophobicContact CB-CG 4.25Å; R543-F550 HydrophobicContact CG-CD1 3.91Å; R543-F550 HydrophobicContact CG-CE1 3.76Å; R543-F550 HydrophobicContact CG-CG 4.44Å; R543-F550 HydrophobicContact CG-CZ 4.15Å; F550-T606 HydrophobicContact CE1-CG2 4.06Å; F550-T606 HydrophobicContact CZ-CG2 4.28Å; F550-I625 HydrophobicContact CE1-CD1 3.68Å; F550-I625 HydrophobicContact CZ-CD1 3.7Å
551	D	95.8	Very high	93.7	Very high	41 Å²	41	67.9 Å²	67.9	22%	0.219	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	142	164.3	-84.6	-40.9	0	0	0	111.5	Y541 V542 K570 Y571	Y541-D551 WeakPolarHBondContact CA-O 3.49Å; V542-D551 HydrophobicContact CG2-CB 4.11Å; V542-D551 PolarHBondContact N-O 3.28Å; V542-D551 PolarHBondContact O-N 2.85Å; D551-K570 HydrophobicContact CB-CD 4.14Å; D551-K570 HydrophobicContact CB-CG 4.44Å; D551-K570 VanDerWaalsContact CG-CE 3.43Å; D551-K570 WeakPolarHBondContact OD1-CE 3.37Å; D551-K570 IonicContact OD1-NZ 3.33Å; D551-K570 PolarHBondContact OD1-NZ 2.89Å; D551-K570 IonicContact OD2-NZ 3.75Å; D551-Y571 WeakPolarHBondContact CB-OH 3.42Å; D551-Y571 VanDerWaalsContact OD2-CE1 3.29Å; D551-Y571 WeakPolarHBondContact OD2-CE1 3.16Å; D551-Y571 PolarHBondContact OD2-OH 2.95Å
552	A	96.1	Very high	93.6	Very high	55 Å²	55	64.5 Å²	64.5	46%	0.455	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	124.3	170.7	0	0	0	0	0	111.3	L539 Y541	L539-A552 HydrophobicContact CD1-CB 3.75Å; Y541-A552 HydrophobicContact CD1-CB 4.44Å; Y541-A552 HydrophobicContact CE1-CB 4.27Å
553	L	96.2	Very high	93.5	Very high	2 Å²	2	64.5 Å²	64.5	1%	0.01	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	114.5	167	-63.9	-175.7	0	0	0	109.7	L539 L540 V542 L555 L563 A566 I567 K570 Y571	L539-L553 WeakPolarHBondContact CA-O 3.37Å; L540-L553 HydrophobicContact CB-CB 4.42Å; L540-L553 PolarHBondContact N-O 3Å; L540-L553 PolarHBondContact O-N 3.15Å; V542-L553 HydrophobicContact CB-CD1 4.45Å; V542-L553 HydrophobicContact CG1-CD1 3.76Å; V542-L553 HydrophobicContact CG1-CG 4.28Å; V542-L553 HydrophobicContact CG2-CD1 3.81Å; V542-L553 HydrophobicContact CG2-CD2 4.47Å; V542-L553 HydrophobicContact CG2-CG 3.81Å; L553-L555 HydrophobicContact CB-CD1 4.04Å; L553-L563 HydrophobicContact CD1-CD1 4.19Å; L553-A566 HydrophobicContact CB-CB 4.29Å; L553-I567 HydrophobicContact CD1-CG1 3.83Å; L553-K570 HydrophobicContact CD2-CB 3.47Å; L553-K570 VanDerWaalsContact CD2-CB 3.47Å; L553-K570 HydrophobicContact CD2-CD 4.49Å; L553-K570 HydrophobicContact CD2-CG 3.65Å; L553-Y571 HydrophobicContact CD2-CE2 4.33Å
554	M	94.8	Very high	93.4	Very high	94 Å²	94	63 Å²	63	46%	0.463	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	99.4	177.9	179	59.9	64.2	0	0	110.3	R537 L539 K556	R537-M554 HydrophobicContact CB-SD 4.27Å; L539-M554 HydrophobicContact CB-CE 3.93Å; L539-M554 HydrophobicContact CD1-CE 4.29Å; M554-K556 PolarHBondContact O-N 2.95Å
555	L	95	Very high	93.5	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	114.7	178.1	-76.9	61.3	0	0	0	109	R537 V538 L540 L553 S557 L563 A566 I598	R537-L555 VanDerWaalsContact CA-O 3.3Å; R537-L555 WeakPolarHBondContact CA-O 3.24Å; V538-L555 HydrophobicContact CB-CB 4.46Å; V538-L555 PolarHBondContact N-O 2.88Å; V538-L555 VanDerWaalsContact N-O 3.17Å; V538-L555 WeakPolarHBondContact O-CB 3.33Å; V538-L555 PolarHBondContact O-N 2.93Å; L540-L555 HydrophobicContact CD1-CD1 3.89Å; L540-L555 HydrophobicContact CD1-CD2 4.02Å; L540-L555 HydrophobicContact CG-CD1 3.98Å; L553-L555 HydrophobicContact CB-CD1 4.04Å; L555-S557 VanDerWaalsContact C-N 3.33Å; L555-L563 HydrophobicContact CD1-CD1 4.06Å; L555-L563 HydrophobicContact CD2-CB 4.01Å; L555-L563 HydrophobicContact CD2-CD1 4.25Å; L555-L563 HydrophobicContact CG-CB 4.36Å; L555-L563 HydrophobicContact CG-CD1 4.41Å; L555-A566 HydrophobicContact CD1-CB 4Å; L555-A566 HydrophobicContact CG-CB 4.45Å; L555-I598 HydrophobicContact CD2-CG2 3.64Å
556	K	89.6	Confident	93.9	Very high	97 Å²	97	55 Å²	55	42%	0.422	30%	0.298	S	S	.	.	S	Bend	trans	-68.5	-33.8	178.9	-69.3	157.5	-177.6	159.2	0	111.7	M554 E569	M554-K556 PolarHBondContact O-N 2.95Å; K556-E569 VanDerWaalsContact NZ-CD 3.33Å; K556-E569 IonicContact NZ-OE1 3.77Å; K556-E569 PolarHBondContact NZ-OE1 3.48Å; K556-E569 IonicContact NZ-OE2 3.72Å; K556-E569 PolarHBondContact NZ-OE2 3.14Å
557	S	91.1	Very high	94.1	Very high	39 Å²	39	49.3 Å²	49.3	27%	0.273	26%	0.263	S	S	.	.	S	Bend	trans	-132.8	148.9	163.2	66.1	0	0	0	0	109.1	L555 T559	L555-S557 VanDerWaalsContact C-N 3.33Å; S557-T559 PolarHBondContact O-N 2.86Å; S557-T559 PolarHBondContact OG-OG1 2.87Å
558	P	92.7	Very high	94.2	Very high	14 Å²	14	48.5 Å²	48.5	9%	0.091	26%	0.261	C	S	.	.	S	Bend	trans	-86	57.1	-174.7	37.3	-35.4	0	0	0	111	K536 V538 I598 E599	K536-P558 HydrophobicContact CB-CG 4.41Å; K536-P558 HydrophobicContact CD-CG 4.44Å; K536-P558 WeakPolarHBondContact O-CD 3.23Å; V538-P558 HydrophobicContact CG2-CB 4.02Å; P558-I598 VanDerWaalsContact C-CG2 3.4Å; P558-I598 HydrophobicContact CB-CG2 4.49Å; P558-I598 CarbonylContact O-C 3.37Å; P558-I598 WeakPolarHBondContact O-CG2 3.38Å; P558-E599 HydrophobicContact CG-CG 4.15Å; P558-E599 PolarHBondContact O-N 3.37Å
559	T	95.1	Very high	94.4	Very high	32 Å²	32	47.5 Å²	47.5	20%	0.196	25%	0.252	C	S	.	.	S	Bend	trans	-123.4	165.1	-174.9	58.8	0	0	0	0	111	S557 K561 G562 L563 D595	S557-T559 PolarHBondContact O-N 2.86Å; S557-T559 PolarHBondContact OG-OG1 2.87Å; T559-K561 PolarHBondContact O-N 3.2Å; T559-G562 PolarHBondContact O-N 3.23Å; T559-G562 VanDerWaalsContact O-N 3.15Å; T559-G562 PolarHBondContact OG1-N 3.26Å; T559-L563 WeakPolarHBondContact O-CB 3.35Å; T559-L563 PolarHBondContact O-N 3.14Å; T559-D595 VanDerWaalsContact CA-OD1 3.3Å; T559-D595 WeakPolarHBondContact CA-OD1 3.47Å; T559-D595 VanDerWaalsContact CB-OD1 3.22Å; T559-D595 WeakPolarHBondContact CB-OD1 3.3Å; T559-D595 HydrophobicContact CG2-CB 4.48Å
560	V	95.1	Very high	94.4	Very high	29 Å²	29	46.3 Å²	46.3	18%	0.176	24%	0.237	C	C	.	.	H	α-helix	trans	-54.2	-45.8	171.3	172.5	0	0	0	0	109.9	L563 M564 L581 D594 D595 I598	V560-L563 PolarHBondContact O-N 2.76Å; V560-M564 HydrophobicContact CG1-CE 3.64Å; V560-M564 HydrophobicContact CG1-CG 4.46Å; V560-M564 HydrophobicContact CG1-SD 3.94Å; V560-M564 WeakPolarHBondContact O-CB 3.48Å; V560-M564 VanDerWaalsContact O-CG 3.26Å; V560-M564 WeakPolarHBondContact O-CG 3.47Å; V560-M564 PolarHBondContact O-N 3.14Å; V560-L581 HydrophobicContact CG1-CD2 4.04Å; V560-D594 VanDerWaalsContact CG2-C 3.41Å; V560-D595 PolarHBondContact N-OD1 2.66Å; V560-I598 HydrophobicContact CB-CD1 4.14Å; V560-I598 HydrophobicContact CG2-CD1 3.64Å
561	K	94.3	Very high	94.1	Very high	137 Å²	137	45 Å²	45	60%	0.596	23%	0.231	S	C	*	.	H	α-helix	trans	-60.6	-48.8	175.4	179.4	173.2	169.7	176.2	0	111.7	T559 L563 M564 E565	T559-K561 PolarHBondContact O-N 3.2Å; K561-L563 VanDerWaalsContact C-N 3.3Å; K561-L563 PolarHBondContact O-N 2.82Å; K561-M564 PolarHBondContact O-N 2.87Å; K561-E565 WeakPolarHBondContact CE-OE1 3.47Å; K561-E565 HydrophobicContact CG-CG 4.45Å; K561-E565 IonicContact NZ-OE1 2.82Å; K561-E565 WeakPolarHBondContact O-CB 3.33Å; K561-E565 WeakPolarHBondContact O-CG 3.28Å; K561-E565 PolarHBondContact O-N 3.1Å
562	G	94.6	Very high	93.8	Very high	2 Å²	2	46.2 Å²	46.2	2%	0.021	25%	0.253	C	S	.	.	H	α-helix	trans	-63.6	-31.8	178.9	0	0	0	0	0	113.9	T559 A566	T559-G562 PolarHBondContact O-N 3.23Å; T559-G562 VanDerWaalsContact O-N 3.15Å; T559-G562 PolarHBondContact OG1-N 3.26Å; G562-A566 WeakPolarHBondContact O-CB 3.42Å; G562-A566 PolarHBondContact O-N 3.47Å
563	L	95.2	Very high	93.4	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-73.6	-42.8	173	179.8	51.3	0	0	0	111.8	L540 L553 L555 T559 V560 K561 A566 I567 L581 M593 I598 L622	L540-L563 HydrophobicContact CD1-CD1 4.15Å; L553-L563 HydrophobicContact CD1-CD1 4.19Å; L555-L563 HydrophobicContact CD1-CD1 4.06Å; L555-L563 HydrophobicContact CD2-CB 4.01Å; L555-L563 HydrophobicContact CD2-CD1 4.25Å; L555-L563 HydrophobicContact CG-CB 4.36Å; L555-L563 HydrophobicContact CG-CD1 4.41Å; T559-L563 WeakPolarHBondContact O-CB 3.35Å; T559-L563 PolarHBondContact O-N 3.14Å; V560-L563 PolarHBondContact O-N 2.76Å; K561-L563 VanDerWaalsContact C-N 3.3Å; K561-L563 PolarHBondContact O-N 2.82Å; L563-A566 PolarHBondContact O-N 3.38Å; L563-I567 HydrophobicContact CD1-CD1 3.78Å; L563-I567 HydrophobicContact CD1-CG1 4.16Å; L563-I567 HydrophobicContact CG-CD1 3.9Å; L563-I567 WeakPolarHBondContact O-CB 3.47Å; L563-I567 WeakPolarHBondContact O-CD1 3.39Å; L563-I567 VanDerWaalsContact O-CG1 3.25Å; L563-I567 WeakPolarHBondContact O-CG1 3.4Å; L563-I567 PolarHBondContact O-N 2.94Å; L563-L581 HydrophobicContact CD2-CD2 3.98Å; L563-L581 HydrophobicContact CG-CD2 4.24Å; L563-M593 HydrophobicContact CD2-CE 4.29Å; L563-I598 HydrophobicContact CB-CD1 4.12Å; L563-I598 HydrophobicContact CD2-CD1 3.76Å; L563-I598 HydrophobicContact CD2-CG1 4.08Å; L563-L622 HydrophobicContact CD1-CD1 4.34Å; L563-L622 HydrophobicContact CD2-CD1 4.02Å
564	M	94.8	Very high	93	Very high	31 Å²	31	47.4 Å²	47.4	15%	0.153	25%	0.254	C	S	.	.	H	α-helix	trans	-61	-42.9	172.9	-72	174.1	171.4	0	0	111.9	V560 K561 I567 S568 V575 I578 L581	V560-M564 HydrophobicContact CG1-CE 3.64Å; V560-M564 HydrophobicContact CG1-CG 4.46Å; V560-M564 HydrophobicContact CG1-SD 3.94Å; V560-M564 WeakPolarHBondContact O-CB 3.48Å; V560-M564 VanDerWaalsContact O-CG 3.26Å; V560-M564 WeakPolarHBondContact O-CG 3.47Å; V560-M564 PolarHBondContact O-N 3.14Å; K561-M564 PolarHBondContact O-N 2.87Å; M564-I567 PolarHBondContact O-N 3.23Å; M564-S568 VanDerWaalsContact O-CB 3.26Å; M564-S568 WeakPolarHBondContact O-CB 3.26Å; M564-S568 PolarHBondContact O-N 2.83Å; M564-V575 HydrophobicContact CB-CG1 4.12Å; M564-I578 HydrophobicContact CB-CD1 4.11Å; M564-I578 HydrophobicContact CE-CB 4.45Å; M564-I578 HydrophobicContact CE-CG2 4.13Å; M564-I578 VanDerWaalsContact CE-O 3.31Å; M564-I578 WeakPolarHBondContact CE-O 3.44Å; M564-I578 HydrophobicContact CG-CB 4.23Å; M564-I578 HydrophobicContact CG-CD1 4.33Å; M564-I578 HydrophobicContact CG-CG2 4.04Å; M564-L581 HydrophobicContact CE-CB 4.15Å; M564-L581 HydrophobicContact CE-CD2 4.42Å; M564-L581 HydrophobicContact CG-CD2 4.39Å
565	E	95.1	Very high	92.8	Very high	64 Å²	64	45 Å²	45	30%	0.299	24%	0.244	S	C	.	.	H	α-helix	trans	-60.4	-45.6	174	-76.2	175.3	-174.9	0	0	111.7	K561 S568 E569 V575	K561-E565 WeakPolarHBondContact CE-OE1 3.47Å; K561-E565 HydrophobicContact CG-CG 4.45Å; K561-E565 IonicContact NZ-OE1 2.82Å; K561-E565 WeakPolarHBondContact O-CB 3.33Å; K561-E565 WeakPolarHBondContact O-CG 3.28Å; K561-E565 PolarHBondContact O-N 3.1Å; E565-S568 WeakPolarHBondContact O-CB 3.5Å; E565-S568 PolarHBondContact O-N 3.12Å; E565-E569 WeakPolarHBondContact O-CB 3.4Å; E565-E569 PolarHBondContact O-N 3Å; E565-V575 HydrophobicContact CG-CG2 4.38Å
566	A	95.4	Very high	92.5	Very high	6 Å²	6	52.7 Å²	52.7	5%	0.05	28%	0.28	C	S	.	.	H	α-helix	trans	-64.6	-40.1	177.9	0	0	0	0	0	112.6	L553 L555 G562 L563 K570	L553-A566 HydrophobicContact CB-CB 4.29Å; L555-A566 HydrophobicContact CD1-CB 4Å; L555-A566 HydrophobicContact CG-CB 4.45Å; G562-A566 WeakPolarHBondContact O-CB 3.42Å; G562-A566 PolarHBondContact O-N 3.47Å; L563-A566 PolarHBondContact O-N 3.38Å; A566-K570 VanDerWaalsContact O-CB 3.24Å; A566-K570 WeakPolarHBondContact O-CB 3.44Å; A566-K570 PolarHBondContact O-N 3.48Å
567	I	94.2	Very high	92.6	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-65.7	-42.2	174.9	-68.9	161.3	0	0	0	110.5	L553 L563 M564 K570 Y571 L573 I578 L581 M611 V620	L553-I567 HydrophobicContact CD1-CG1 3.83Å; L563-I567 HydrophobicContact CD1-CD1 3.78Å; L563-I567 HydrophobicContact CD1-CG1 4.16Å; L563-I567 HydrophobicContact CG-CD1 3.9Å; L563-I567 WeakPolarHBondContact O-CB 3.47Å; L563-I567 WeakPolarHBondContact O-CD1 3.39Å; L563-I567 VanDerWaalsContact O-CG1 3.25Å; L563-I567 WeakPolarHBondContact O-CG1 3.4Å; L563-I567 PolarHBondContact O-N 2.94Å; M564-I567 PolarHBondContact O-N 3.23Å; I567-K570 PolarHBondContact O-N 3.45Å; I567-Y571 HydrophobicContact CG2-CD2 4.16Å; I567-Y571 WeakPolarHBondContact O-CB 3.45Å; I567-Y571 PolarHBondContact O-N 2.72Å; I567-L573 HydrophobicContact CG2-CD1 4.49Å; I567-I578 HydrophobicContact CB-CD1 4.27Å; I567-I578 HydrophobicContact CG2-CD1 3.96Å; I567-L581 HydrophobicContact CD1-CD1 4.34Å; I567-M611 HydrophobicContact CG2-SD 4.44Å; I567-V620 HydrophobicContact CD1-CG1 4.14Å
568	S	93.5	Very high	92.6	Very high	31 Å²	31	51.8 Å²	51.8	22%	0.217	27%	0.272	C	S	.	.	H	α-helix	trans	-59	-50.3	174.6	168.1	0	0	0	0	111.8	M564 E565 K570 G572 L573	M564-S568 VanDerWaalsContact O-CB 3.26Å; M564-S568 WeakPolarHBondContact O-CB 3.26Å; M564-S568 PolarHBondContact O-N 2.83Å; E565-S568 WeakPolarHBondContact O-CB 3.5Å; E565-S568 PolarHBondContact O-N 3.12Å; S568-K570 VanDerWaalsContact C-N 3.35Å; S568-K570 PolarHBondContact O-N 3.28Å; S568-G572 WeakPolarHBondContact O-CA 3.46Å; S568-G572 PolarHBondContact O-N 2.85Å; S568-L573 WeakPolarHBondContact CA-O 3.31Å; S568-L573 WeakPolarHBondContact CB-O 3.45Å; S568-L573 PolarHBondContact OG-O 2.86Å; S568-L573 VanDerWaalsContact OG-O 3.07Å
569	E	93.4	Very high	92.5	Very high	131 Å²	131	53.9 Å²	53.9	61%	0.612	29%	0.29	S	S	*	.	H	α-helix	trans	-64.9	-35.5	179.8	-172.2	171	-175.4	0	0	112.4	K556 E565	K556-E569 VanDerWaalsContact NZ-CD 3.33Å; K556-E569 IonicContact NZ-OE1 3.77Å; K556-E569 PolarHBondContact NZ-OE1 3.48Å; K556-E569 IonicContact NZ-OE2 3.72Å; K556-E569 PolarHBondContact NZ-OE2 3.14Å; E565-E569 WeakPolarHBondContact O-CB 3.4Å; E565-E569 PolarHBondContact O-N 3Å
570	K	93.3	Very high	92.3	Very high	89 Å²	89	56.2 Å²	56.2	39%	0.387	30%	0.297	S	S	.	.	H	α-helix	trans	-78.9	-38.4	179.8	-178.8	68.5	-127.6	-162.8	0	114	D551 L553 A566 I567 S568	D551-K570 HydrophobicContact CB-CD 4.14Å; D551-K570 HydrophobicContact CB-CG 4.44Å; D551-K570 VanDerWaalsContact CG-CE 3.43Å; D551-K570 WeakPolarHBondContact OD1-CE 3.37Å; D551-K570 IonicContact OD1-NZ 3.33Å; D551-K570 PolarHBondContact OD1-NZ 2.89Å; D551-K570 IonicContact OD2-NZ 3.75Å; L553-K570 HydrophobicContact CD2-CB 3.47Å; L553-K570 VanDerWaalsContact CD2-CB 3.47Å; L553-K570 HydrophobicContact CD2-CD 4.49Å; L553-K570 HydrophobicContact CD2-CG 3.65Å; A566-K570 VanDerWaalsContact O-CB 3.24Å; A566-K570 WeakPolarHBondContact O-CB 3.44Å; A566-K570 PolarHBondContact O-N 3.48Å; I567-K570 PolarHBondContact O-N 3.45Å; S568-K570 VanDerWaalsContact C-N 3.35Å; S568-K570 PolarHBondContact O-N 3.28Å
571	Y	91.7	Very high	92.3	Very high	52 Å²	52	55.1 Å²	55.1	20%	0.204	29%	0.291	C	S	.	.	H	α-helix	trans	-117.4	0.6	-169.8	-62.6	-67.3	0	0	0	115.1	V542 D551 L553 I567 L573 L609 M611	V542-Y571 HydrophobicContact CG2-CE2 4.45Å; V542-Y571 WeakPolarHBondContact CG2-OH 3.02Å; D551-Y571 WeakPolarHBondContact CB-OH 3.42Å; D551-Y571 VanDerWaalsContact OD2-CE1 3.29Å; D551-Y571 WeakPolarHBondContact OD2-CE1 3.16Å; D551-Y571 PolarHBondContact OD2-OH 2.95Å; L553-Y571 HydrophobicContact CD2-CE2 4.33Å; I567-Y571 HydrophobicContact CG2-CD2 4.16Å; I567-Y571 WeakPolarHBondContact O-CB 3.45Å; I567-Y571 PolarHBondContact O-N 2.72Å; Y571-L573 VanDerWaalsContact C-N 3.3Å; Y571-L573 PolarHBondContact O-N 3.1Å; Y571-L609 HydrophobicContact CD2-CD2 4.11Å; Y571-L609 HydrophobicContact CE2-CD2 3.31Å; Y571-M611 HydrophobicContact CD1-CE 4.25Å; Y571-M611 HydrophobicContact CD2-CE 4.21Å; Y571-M611 HydrophobicContact CD2-SD 4.42Å; Y571-M611 HydrophobicContact CG-CE 4.06Å
572	G	88.4	Confident	92.4	Very high	66 Å²	66	51 Å²	51	68%	0.68	27%	0.272	S	S	*	.			trans	71.3	21.3	177.9	0	0	0	0	0	114.5	S568	S568-G572 WeakPolarHBondContact O-CA 3.46Å; S568-G572 PolarHBondContact O-N 2.85Å
573	L	87.3	Confident	92.5	Very high	28 Å²	28	52.9 Å²	52.9	15%	0.147	28%	0.279	C	S	.	.			trans	-93.3	117.1	-179.4	-62.4	179.8	0	0	0	110.3	I567 S568 Y571 V575 M611 F618	I567-L573 HydrophobicContact CG2-CD1 4.49Å; S568-L573 WeakPolarHBondContact CA-O 3.31Å; S568-L573 WeakPolarHBondContact CB-O 3.45Å; S568-L573 PolarHBondContact OG-O 2.86Å; S568-L573 VanDerWaalsContact OG-O 3.07Å; Y571-L573 VanDerWaalsContact C-N 3.3Å; Y571-L573 PolarHBondContact O-N 3.1Å; L573-V575 PolarHBondContact O-N 3.31Å; L573-M611 HydrophobicContact CD1-SD 3.66Å; L573-F618 HydrophobicContact CD2-CD2 4.29Å; L573-F618 HydrophobicContact CD2-CE1 4.37Å; L573-F618 HydrophobicContact CD2-CE2 3.81Å; L573-F618 HydrophobicContact CD2-CZ 3.86Å
574	P	88.6	Confident	92.4	Very high	54 Å²	54	56.4 Å²	56.4	35%	0.351	30%	0.295	S	S	.	.			trans	-54.8	133.2	177.2	-25	33.6	0	0	0	111.9	E576 K577	P574-E576 VanDerWaalsContact CB-OE2 3.32Å; P574-E576 WeakPolarHBondContact CB-OE2 3.35Å; P574-E576 PolarHBondContact O-N 2.83Å; P574-K577 HydrophobicContact CB-CD 4.4Å; P574-K577 HydrophobicContact CB-CG 4.26Å; P574-K577 HydrophobicContact CG-CD 4.2Å; P574-K577 WeakPolarHBondContact O-CB 3.32Å; P574-K577 PolarHBondContact O-N 2.82Å
575	V	89.6	Confident	92.2	Very high	42 Å²	42	56.2 Å²	56.2	26%	0.255	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-55.9	-38	-176.2	173	0	0	0	0	111.3	M564 E565 L573 K577 I578	M564-V575 HydrophobicContact CB-CG1 4.12Å; E565-V575 HydrophobicContact CG-CG2 4.38Å; L573-V575 PolarHBondContact O-N 3.31Å; V575-K577 PolarHBondContact O-N 2.79Å; V575-K577 VanDerWaalsContact O-N 3.17Å; V575-I578 PolarHBondContact O-N 2.89Å
576	E	89.9	Confident	91.7	Very high	162 Å²	162	60 Å²	60	76%	0.757	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-64	-20	179.1	-49.9	74.1	-161.8	0	0	112.6	P574	P574-E576 VanDerWaalsContact CB-OE2 3.32Å; P574-E576 WeakPolarHBondContact CB-OE2 3.35Å; P574-E576 PolarHBondContact O-N 2.83Å
577	K	90.9	Very high	91.3	Very high	113 Å²	113	68.6 Å²	68.6	49%	0.491	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-91.5	-6.5	175.5	-63.2	-173.9	178.5	-178	0	113	P574 V575 A579 G617 F618	P574-K577 HydrophobicContact CB-CD 4.4Å; P574-K577 HydrophobicContact CB-CG 4.26Å; P574-K577 HydrophobicContact CG-CD 4.2Å; P574-K577 WeakPolarHBondContact O-CB 3.32Å; P574-K577 PolarHBondContact O-N 2.82Å; V575-K577 PolarHBondContact O-N 2.79Å; V575-K577 VanDerWaalsContact O-N 3.17Å; K577-A579 PolarHBondContact O-N 2.85Å; K577-G617 CarbonylContact O-C 3.55Å; K577-G617 WeakPolarHBondContact O-CA 3.32Å; K577-F618 HydrophobicContact CB-CD2 3.97Å; K577-F618 HydrophobicContact CB-CE2 4.31Å; K577-F618 HydrophobicContact CD-CE2 4.44Å; K577-F618 PolarHBondContact O-N 2.97Å
578	I	92	Very high	91	Very high	5 Å²	5	70.7 Å²	70.7	3%	0.026	37%	0.369	C	S	.	.			trans	-83.9	69.9	176.8	-50.5	-179.2	0	0	0	109.1	M564 I567 V575 K580 V620	M564-I578 HydrophobicContact CB-CD1 4.11Å; M564-I578 HydrophobicContact CE-CB 4.45Å; M564-I578 HydrophobicContact CE-CG2 4.13Å; M564-I578 VanDerWaalsContact CE-O 3.31Å; M564-I578 WeakPolarHBondContact CE-O 3.44Å; M564-I578 HydrophobicContact CG-CB 4.23Å; M564-I578 HydrophobicContact CG-CD1 4.33Å; M564-I578 HydrophobicContact CG-CG2 4.04Å; I567-I578 HydrophobicContact CB-CD1 4.27Å; I567-I578 HydrophobicContact CG2-CD1 3.96Å; V575-I578 PolarHBondContact O-N 2.89Å; I578-K580 VanDerWaalsContact C-N 3.33Å; I578-K580 PolarHBondContact O-N 2.56Å; I578-V620 HydrophobicContact CG2-CB 4.43Å; I578-V620 HydrophobicContact CG2-CG2 3.83Å
579	A	89.3	Confident	90.9	Very high	57 Å²	57	74.2 Å²	74.2	47%	0.471	39%	0.385	S	S	.	.			trans	-66.5	-28.9	-170.4	0	0	0	0	0	114.1	K577 F618	K577-A579 PolarHBondContact O-N 2.85Å; A579-F618 PolarHBondContact N-O 3.43Å; A579-F618 VanDerWaalsContact N-O 3.15Å
580	K	92.2	Very high	90.9	Very high	82 Å²	82	72 Å²	72	36%	0.357	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	131.9	-177	-70	170	-177.9	152.9	0	111	I578 Y582 F618 K619 V620	I578-K580 VanDerWaalsContact C-N 3.33Å; I578-K580 PolarHBondContact O-N 2.56Å; K580-Y582 HydrophobicContact CB-CD2 4.47Å; K580-Y582 HydrophobicContact CB-CE2 3.73Å; K580-Y582 HydrophobicContact CD-CE2 4.44Å; K580-Y582 HydrophobicContact CG-CE2 4.45Å; K580-F618 PolarHBondContact N-O 2.94Å; K580-K619 HydrophobicContact CB-CB 4.32Å; K580-K619 HydrophobicContact CB-CG 4.44Å; K580-K619 WeakPolarHBondContact O-CA 3.5Å; K580-V620 PolarHBondContact O-N 3.45Å
581	L	95.3	Very high	90.9	Very high	6 Å²	6	70.8 Å²	70.8	3%	0.031	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	118.7	-179.1	-173.6	65.4	0	0	0	110.1	V560 L563 M564 I567 N592 M593 V620	V560-L581 HydrophobicContact CG1-CD2 4.04Å; L563-L581 HydrophobicContact CD2-CD2 3.98Å; L563-L581 HydrophobicContact CG-CD2 4.24Å; M564-L581 HydrophobicContact CE-CB 4.15Å; M564-L581 HydrophobicContact CE-CD2 4.42Å; M564-L581 HydrophobicContact CG-CD2 4.39Å; I567-L581 HydrophobicContact CD1-CD1 4.34Å; L581-N592 PolarHBondContact O-OD1 2.72Å; L581-M593 HydrophobicContact CB-CB 4.33Å; L581-M593 HydrophobicContact CD2-CB 4.05Å; L581-M593 HydrophobicContact CD2-CG 4.42Å; L581-M593 HydrophobicContact CG-CB 3.94Å; L581-M593 HydrophobicContact CG-CG 3.99Å; L581-M593 WeakPolarHBondContact O-CB 3.43Å; L581-M593 PolarHBondContact O-N 3.15Å; L581-V620 WeakPolarHBondContact CA-O 3.43Å; L581-V620 HydrophobicContact CD1-CB 3.71Å; L581-V620 HydrophobicContact CD1-CG1 3.72Å
582	Y	96.3	Very high	91.1	Very high	51 Å²	51	73.3 Å²	73.3	20%	0.2	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	149.3	-175.8	-63.2	-70.5	0	0	0	112.9	K580 L590 V591 N592 K619 V620 T621 L622	K580-Y582 HydrophobicContact CB-CD2 4.47Å; K580-Y582 HydrophobicContact CB-CE2 3.73Å; K580-Y582 HydrophobicContact CD-CE2 4.44Å; K580-Y582 HydrophobicContact CG-CE2 4.45Å; Y582-L590 HydrophobicContact CD1-CD2 4.17Å; Y582-L590 HydrophobicContact CD1-CG 4.13Å; Y582-L590 HydrophobicContact CD2-CD2 4.38Å; Y582-L590 HydrophobicContact CG-CD1 4.2Å; Y582-L590 HydrophobicContact CG-CD2 4.08Å; Y582-L590 HydrophobicContact CG-CG 4.08Å; Y582-V591 CarbonylContact C-O 3.49Å; Y582-V591 WeakPolarHBondContact CA-O 3.37Å; Y582-N592 HydrophobicContact CD1-CB 4.38Å; Y582-N592 HydrophobicContact CE1-CB 4.24Å; Y582-N592 WeakPolarHBondContact CE1-OD1 3.13Å; Y582-K619 HydrophobicContact CD2-CD 4.17Å; Y582-K619 HydrophobicContact CD2-CG 3.85Å; Y582-K619 HydrophobicContact CE2-CD 4.03Å; Y582-K619 HydrophobicContact CE2-CG 3.89Å; Y582-V620 PolarHBondContact N-O 3.17Å; Y582-T621 CarbonylContact O-C 3.54Å; Y582-T621 VanDerWaalsContact O-CA 3.32Å; Y582-T621 WeakPolarHBondContact O-CA 3.48Å; Y582-L622 PolarHBondContact O-N 3.08Å
583	K	95.1	Very high	91.4	Very high	41 Å²	41	70.7 Å²	70.7	18%	0.178	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	135.1	162.2	-170.5	-176.6	-174.5	178.5	0	109	L590 V591 M593 I597 Y601 L622 E624	K583-L590 CarbonylContact O-C 3.58Å; K583-L590 WeakPolarHBondContact O-CA 3.03Å; K583-V591 PolarHBondContact N-O 3.27Å; K583-V591 PolarHBondContact O-N 3.15Å; K583-M593 HydrophobicContact CB-CE 3.9Å; K583-M593 HydrophobicContact CB-CG 4.2Å; K583-M593 HydrophobicContact CB-SD 4.06Å; K583-M593 HydrophobicContact CG-CE 4.46Å; K583-I597 HydrophobicContact CD-CG2 4.07Å; K583-Y601 WeakPolarHBondContact CD-OH 3.48Å; K583-L622 CarbonylContact C-O 3.56Å; K583-L622 WeakPolarHBondContact CA-O 3.43Å; K583-E624 WeakPolarHBondContact CE-OE1 3.41Å; K583-E624 IonicContact NZ-OE1 3.02Å; K583-E624 PolarHBondContact NZ-OE1 3.43Å
584	K	94.5	Very high	91.7	Very high	74 Å²	74	72.3 Å²	72.3	32%	0.322	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	116.9	169.6	-174.5	175.8	167.2	-157.9	0	109.3	I589 L590 T621 L622 M623 E624	K584-I589 WeakPolarHBondContact CA-O 3.47Å; K584-L590 HydrophobicContact CB-CD1 3.94Å; K584-L590 HydrophobicContact CG-CD1 4.45Å; K584-T621 HydrophobicContact CB-CG2 3.84Å; K584-L622 PolarHBondContact N-O 3.37Å; K584-M623 HydrophobicContact CB-CB 4.04Å; K584-M623 HydrophobicContact CB-CG 4.2Å; K584-M623 HydrophobicContact CD-CG 4.23Å; K584-M623 HydrophobicContact CD-SD 3.55Å; K584-M623 VanDerWaalsContact CD-SD 3.55Å; K584-M623 VanDerWaalsContact CE-SD 3.53Å; K584-M623 HydrophobicContact CG-CG 4.22Å; K584-M623 HydrophobicContact CG-SD 4.12Å; K584-M623 PolarHBondContact NZ-SD 3.4Å; K584-M623 VanDerWaalsContact O-CA 3.28Å; K584-M623 WeakPolarHBondContact O-CA 3.38Å; K584-E624 PolarHBondContact O-N 2.85Å
585	S	89.1	Confident	91.9	Very high	26 Å²	26	73.4 Å²	73.4	18%	0.182	38%	0.375	C	S	.	.			trans	-73.3	162.2	177.8	65.2	0	0	0	0	112.2	K587 G588 I589 E624	S585-K587 PolarHBondContact O-N 3.36Å; S585-G588 PolarHBondContact O-N 2.83Å; S585-I589 PolarHBondContact N-O 3.23Å; S585-I589 WeakPolarHBondContact OG-CB 3.15Å; S585-I589 PolarHBondContact OG-N 2.76Å; S585-I589 PolarHBondContact OG-O 2.73Å; S585-E624 VanDerWaalsContact CA-OE2 3.29Å; S585-E624 WeakPolarHBondContact CA-OE2 3.23Å
586	K	86.3	Confident	92	Very high	145 Å²	145	76 Å²	76	63%	0.63	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-22	172.7	-51.6	-165.6	-173	-155.7	0	114.1	G588 E624 I625	K586-G588 VanDerWaalsContact C-N 3.29Å; K586-E624 HydrophobicContact CG-CB 3.87Å; K586-I625 WeakPolarHBondContact CE-O 3.39Å; K586-I625 WeakPolarHBondContact CE-OXT 3.47Å; K586-I625 PolarHBondContact NZ-O 3.38Å; K586-I625 PolarHBondContact NZ-OXT 2.85Å
587	K	86.8	Confident	92.1	Very high	186 Å²	186	70.2 Å²	70.2	81%	0.809	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	8.6	175.4	-65.9	-176.2	179.5	-179	0	113.6	S585 I589	S585-K587 PolarHBondContact O-N 3.36Å; K587-I589 HydrophobicContact CB-CG1 4.39Å; K587-I589 PolarHBondContact O-N 3.35Å
588	G	86.9	Confident	92.3	Very high	43 Å²	43	64.8 Å²	64.8	44%	0.443	34%	0.338	S	S	.	.	S	Bend	trans	78.9	-9.8	-178.9	0	0	0	0	0	115.4	S585 K586 L590	S585-G588 PolarHBondContact O-N 2.83Å; K586-G588 VanDerWaalsContact C-N 3.29Å; G588-L590 PolarHBondContact O-N 3.11Å
589	I	92.3	Very high	92.2	Very high	106 Å²	106	69.2 Å²	69.2	54%	0.544	36%	0.359	S	S	.	.			trans	-64.2	124.4	179.6	-51.2	174.2	0	0	0	109.4	K584 S585 K587 V591	K584-I589 WeakPolarHBondContact CA-O 3.47Å; S585-I589 PolarHBondContact N-O 3.23Å; S585-I589 WeakPolarHBondContact OG-CB 3.15Å; S585-I589 PolarHBondContact OG-N 2.76Å; S585-I589 PolarHBondContact OG-O 2.73Å; K587-I589 HydrophobicContact CB-CG1 4.39Å; K587-I589 PolarHBondContact O-N 3.35Å; I589-V591 HydrophobicContact CG2-CG2 4.24Å
590	L	93.3	Very high	92.3	Very high	84 Å²	84	71.8 Å²	71.8	44%	0.44	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	134.7	174.8	-164.1	74	0	0	0	110	Y582 K583 K584 G588 T621	Y582-L590 HydrophobicContact CD1-CD2 4.17Å; Y582-L590 HydrophobicContact CD1-CG 4.13Å; Y582-L590 HydrophobicContact CD2-CD2 4.38Å; Y582-L590 HydrophobicContact CG-CD1 4.2Å; Y582-L590 HydrophobicContact CG-CD2 4.08Å; Y582-L590 HydrophobicContact CG-CG 4.08Å; K583-L590 CarbonylContact O-C 3.58Å; K583-L590 WeakPolarHBondContact O-CA 3.03Å; K584-L590 HydrophobicContact CB-CD1 3.94Å; K584-L590 HydrophobicContact CG-CD1 4.45Å; G588-L590 PolarHBondContact O-N 3.11Å; L590-T621 HydrophobicContact CD1-CG2 3.75Å
591	V	94.2	Very high	92.3	Very high	63 Å²	63	68.3 Å²	68.3	38%	0.382	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	136.4	-175.8	-173.2	0	0	0	0	108.6	Y582 K583 I589 I597	Y582-V591 CarbonylContact C-O 3.49Å; Y582-V591 WeakPolarHBondContact CA-O 3.37Å; K583-V591 PolarHBondContact N-O 3.27Å; K583-V591 PolarHBondContact O-N 3.15Å; I589-V591 HydrophobicContact CG2-CG2 4.24Å; V591-I597 HydrophobicContact CG1-CD1 3.88Å
592	N	94.7	Very high	92.1	Very high	106 Å²	106	71.3 Å²	71.3	57%	0.567	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.9	133.6	173.5	-161.8	44.1	0	0	0	109.6	L581 Y582 I597	L581-N592 PolarHBondContact O-OD1 2.72Å; Y582-N592 HydrophobicContact CD1-CB 4.38Å; Y582-N592 HydrophobicContact CE1-CB 4.24Å; Y582-N592 WeakPolarHBondContact CE1-OD1 3.13Å; N592-I597 WeakPolarHBondContact O-CD1 3.39Å
593	M	94.3	Very high	91.9	Very high	11 Å²	11	73.7 Å²	73.7	5%	0.054	38%	0.383	C	S	.	.			trans	-78.5	136.2	-179.6	-70.8	-109.7	-145.9	0	0	111.2	L563 L581 K583 I597 I598 Y601 L622	L563-M593 HydrophobicContact CD2-CE 4.29Å; L581-M593 HydrophobicContact CB-CB 4.33Å; L581-M593 HydrophobicContact CD2-CB 4.05Å; L581-M593 HydrophobicContact CD2-CG 4.42Å; L581-M593 HydrophobicContact CG-CB 3.94Å; L581-M593 HydrophobicContact CG-CG 3.99Å; L581-M593 WeakPolarHBondContact O-CB 3.43Å; L581-M593 PolarHBondContact O-N 3.15Å; K583-M593 HydrophobicContact CB-CE 3.9Å; K583-M593 HydrophobicContact CB-CG 4.2Å; K583-M593 HydrophobicContact CB-SD 4.06Å; K583-M593 HydrophobicContact CG-CE 4.46Å; M593-I597 HydrophobicContact SD-CG2 3.72Å; M593-I598 HydrophobicContact SD-CD1 4.32Å; M593-I598 HydrophobicContact SD-CG1 3.98Å; M593-Y601 HydrophobicContact CE-CE2 4.33Å; M593-Y601 VanDerWaalsContact CE-OH 3.29Å; M593-Y601 WeakPolarHBondContact CE-OH 3.44Å; M593-Y601 HydrophobicContact SD-CE2 4.16Å; M593-Y601 PolarHBondContact SD-OH 2.89Å; M593-L622 HydrophobicContact CE-CB 3.86Å; M593-L622 HydrophobicContact CE-CD1 3.86Å; M593-L622 HydrophobicContact CE-CG 4.11Å
594	D	93.9	Very high	91.8	Very high	62 Å²	62	77.6 Å²	77.6	33%	0.332	40%	0.402	S	S	.	.			trans	-127.6	173.6	168.9	75.3	-20.1	0	0	0	109.9	V560 N596 I597 I598	V560-D594 VanDerWaalsContact CG2-C 3.41Å; D594-N596 VanDerWaalsContact C-N 3.27Å; D594-N596 PolarHBondContact O-N 3.21Å; D594-N596 PolarHBondContact OD1-N 2.97Å; D594-N596 WeakPolarHBondContact OD2-CB 3.43Å; D594-N596 PolarHBondContact OD2-ND2 3.37Å; D594-I597 PolarHBondContact O-N 2.91Å; D594-I597 WeakPolarHBondContact OD1-CB 3.49Å; D594-I597 WeakPolarHBondContact OD1-CD1 3.02Å; D594-I597 WeakPolarHBondContact OD1-CG1 3.25Å; D594-I597 PolarHBondContact OD1-N 2.69Å; D594-I598 PolarHBondContact O-N 3.21Å
595	D	93.5	Very high	91.8	Very high	76 Å²	76	76.5 Å²	76.5	41%	0.406	40%	0.4	S	S	.	.	H	α-helix	trans	-61.9	-37.9	-179.5	-64.5	-31.6	0	0	0	111.1	T559 V560 I597 I598 E599	T559-D595 VanDerWaalsContact CA-OD1 3.3Å; T559-D595 WeakPolarHBondContact CA-OD1 3.47Å; T559-D595 VanDerWaalsContact CB-OD1 3.22Å; T559-D595 WeakPolarHBondContact CB-OD1 3.3Å; T559-D595 HydrophobicContact CG2-CB 4.48Å; V560-D595 PolarHBondContact N-OD1 2.66Å; D595-I597 VanDerWaalsContact C-N 3.34Å; D595-I597 PolarHBondContact O-N 3.18Å; D595-I598 PolarHBondContact O-N 2.74Å; D595-E599 PolarHBondContact O-N 2.94Å
596	N	91.6	Very high	92.1	Very high	98 Å²	98	77.9 Å²	77.9	52%	0.524	41%	0.407	S	S	.	.	H	α-helix	trans	-57.1	-44.1	177.7	-58.9	-79.1	0	0	0	112.3	D594 I598 H600	D594-N596 VanDerWaalsContact C-N 3.27Å; D594-N596 PolarHBondContact O-N 3.21Å; D594-N596 PolarHBondContact OD1-N 2.97Å; D594-N596 WeakPolarHBondContact OD2-CB 3.43Å; D594-N596 PolarHBondContact OD2-ND2 3.37Å; N596-I598 VanDerWaalsContact C-N 3.29Å; N596-I598 PolarHBondContact O-N 3.08Å; N596-H600 PolarHBondContact O-N 3.07Å; N596-H600 PolarHBondContact O-ND1 3.27Å
597	I	92.8	Very high	92.6	Very high	39 Å²	39	71.1 Å²	71.1	20%	0.2	38%	0.378	C	S	.	.	H	α-helix	trans	-61.9	-38.8	177.5	-75.4	163.8	0	0	0	111.1	K583 V591 N592 M593 D594 D595 H600 Y601	K583-I597 HydrophobicContact CD-CG2 4.07Å; V591-I597 HydrophobicContact CG1-CD1 3.88Å; N592-I597 WeakPolarHBondContact O-CD1 3.39Å; M593-I597 HydrophobicContact SD-CG2 3.72Å; D594-I597 PolarHBondContact O-N 2.91Å; D594-I597 WeakPolarHBondContact OD1-CB 3.49Å; D594-I597 WeakPolarHBondContact OD1-CD1 3.02Å; D594-I597 WeakPolarHBondContact OD1-CG1 3.25Å; D594-I597 PolarHBondContact OD1-N 2.69Å; D595-I597 VanDerWaalsContact C-N 3.34Å; D595-I597 PolarHBondContact O-N 3.18Å; I597-H600 PolarHBondContact O-N 2.74Å; I597-Y601 HydrophobicContact CG2-CE2 4.37Å; I597-Y601 WeakPolarHBondContact CG2-OH 3.23Å
598	I	93.1	Very high	93.1	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-80.6	-32.8	-174.3	-60.8	164.7	0	0	0	111.3	L555 P558 V560 L563 M593 D594 D595 N596 H600 Y601	L555-I598 HydrophobicContact CD2-CG2 3.64Å; P558-I598 VanDerWaalsContact C-CG2 3.4Å; P558-I598 HydrophobicContact CB-CG2 4.49Å; P558-I598 CarbonylContact O-C 3.37Å; P558-I598 WeakPolarHBondContact O-CG2 3.38Å; V560-I598 HydrophobicContact CB-CD1 4.14Å; V560-I598 HydrophobicContact CG2-CD1 3.64Å; L563-I598 HydrophobicContact CB-CD1 4.12Å; L563-I598 HydrophobicContact CD2-CD1 3.76Å; L563-I598 HydrophobicContact CD2-CG1 4.08Å; M593-I598 HydrophobicContact SD-CD1 4.32Å; M593-I598 HydrophobicContact SD-CG1 3.98Å; D594-I598 PolarHBondContact O-N 3.21Å; D595-I598 PolarHBondContact O-N 2.74Å; N596-I598 VanDerWaalsContact C-N 3.29Å; N596-I598 PolarHBondContact O-N 3.08Å; I598-H600 PolarHBondContact O-N 2.79Å; I598-Y601 HydrophobicContact CB-CD2 4.21Å; I598-Y601 HydrophobicContact CB-CE2 4.3Å; I598-Y601 HydrophobicContact CG1-CD2 4.3Å; I598-Y601 HydrophobicContact CG1-CE2 3.89Å; I598-Y601 HydrophobicContact CG2-CD2 4.08Å; I598-Y601 HydrophobicContact CG2-CE2 4.49Å; I598-Y601 PolarHBondContact O-N 2.63Å; I598-Y601 VanDerWaalsContact O-N 3.1Å
599	E	91.6	Very high	93.5	Very high	98 Å²	98	61.2 Å²	61.2	46%	0.458	32%	0.323	S	S	.	.	H	α-helix	trans	-58	-27.5	169	-78	-165.9	167.2	0	0	113.5	K536 P558 D595	K536-E599 PolarHBondContact NZ-O 3.43Å; P558-E599 HydrophobicContact CG-CG 4.15Å; P558-E599 PolarHBondContact O-N 3.37Å; D595-E599 PolarHBondContact O-N 2.94Å
600	H	90	Very high	93.6	Very high	111 Å²	111	59.6 Å²	59.6	51%	0.514	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-8.5	179.1	-73.3	67.1	0	0	0	113.7	R401 N596 I597 I598	R401-H600 PolarHBondContact NH1-CE1 3.18Å; R401-H600 PolarHBondContact NH1-NE2 3.36Å; N596-H600 PolarHBondContact O-N 3.07Å; N596-H600 PolarHBondContact O-ND1 3.27Å; I597-H600 PolarHBondContact O-N 2.74Å; I598-H600 PolarHBondContact O-N 2.79Å
601	Y	92.7	Very high	93.6	Very high	8 Å²	8	58 Å²	58	3%	0.031	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-69.7	141.5	173.3	-64	-44.5	0	0	0	111.6	L540 K583 M593 I597 I598 D605 F607	L540-Y601 HydrophobicContact CD1-CD2 4.17Å; L540-Y601 HydrophobicContact CD2-CD2 4.39Å; L540-Y601 HydrophobicContact CD2-CG 4.21Å; K583-Y601 WeakPolarHBondContact CD-OH 3.48Å; M593-Y601 HydrophobicContact CE-CE2 4.33Å; M593-Y601 VanDerWaalsContact CE-OH 3.29Å; M593-Y601 WeakPolarHBondContact CE-OH 3.44Å; M593-Y601 HydrophobicContact SD-CE2 4.16Å; M593-Y601 PolarHBondContact SD-OH 2.89Å; I597-Y601 HydrophobicContact CG2-CE2 4.37Å; I597-Y601 WeakPolarHBondContact CG2-OH 3.23Å; I598-Y601 HydrophobicContact CB-CD2 4.21Å; I598-Y601 HydrophobicContact CB-CE2 4.3Å; I598-Y601 HydrophobicContact CG1-CD2 4.3Å; I598-Y601 HydrophobicContact CG1-CE2 3.89Å; I598-Y601 HydrophobicContact CG2-CD2 4.08Å; I598-Y601 HydrophobicContact CG2-CE2 4.49Å; I598-Y601 PolarHBondContact O-N 2.63Å; I598-Y601 VanDerWaalsContact O-N 3.1Å; Y601-D605 WeakPolarHBondContact CA-OD2 3.41Å; Y601-F607 HydrophobicContact CD1-CE1 4.44Å; Y601-F607 HydrophobicContact CD1-CE2 4.49Å; Y601-F607 AromaticContact CD1-CZ 3.64Å; Y601-F607 HydrophobicContact CD1-CZ 3.64Å; Y601-F607 AromaticContact CE1-CE1 3.84Å; Y601-F607 HydrophobicContact CE1-CE1 3.84Å; Y601-F607 AromaticContact CE1-CZ 3.46Å; Y601-F607 HydrophobicContact CE1-CZ 3.46Å; Y601-F607 VanDerWaalsContact CE1-CZ 3.46Å; Y601-F607 HydrophobicContact CG-CZ 4.3Å; Y601-F607 AromaticContact CZ-CZ 3.99Å
602	S	91.3	Very high	93.4	Very high	70 Å²	70	58.1 Å²	58.1	49%	0.49	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-94.4	162.1	175.6	-61.9	0	0	0	0	110.6	V538 E604 D605	V538-S602 WeakPolarHBondContact CG1-O 3.47Å; S602-E604 PolarHBondContact O-N 2.85Å; S602-D605 PolarHBondContact N-OD2 3.2Å; S602-D605 PolarHBondContact O-N 3.01Å
603	N	92.3	Very high	93.2	Very high	101 Å²	101	57.7 Å²	57.7	54%	0.54	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	138.6	166.9	-76.5	-39.7	0	0	0	109.5	V538 L539 D605	V538-N603 WeakPolarHBondContact CA-OD1 3.37Å; L539-N603 PolarHBondContact N-OD1 2.62Å; L539-N603 CarbonylContact O-C 3.56Å; L539-N603 WeakPolarHBondContact O-CA 3.45Å; N603-D605 VanDerWaalsContact C-N 3.26Å; N603-D605 PolarHBondContact O-N 2.82Å
604	E	93.5	Very high	92.9	Very high	123 Å²	123	61 Å²	61	58%	0.575	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	72	12	176.4	-52.1	174.6	-157.9	0	0	114.3	L539 Y541 S602 T606	L539-E604 HydrophobicContact CD2-CG 4.46Å; L539-E604 PolarHBondContact O-N 3.41Å; Y541-E604 HydrophobicContact CD2-CB 3.92Å; Y541-E604 HydrophobicContact CD2-CG 4.34Å; Y541-E604 HydrophobicContact CE2-CB 3.6Å; Y541-E604 HydrophobicContact CE2-CG 3.58Å; S602-E604 PolarHBondContact O-N 2.85Å; E604-T606 PolarHBondContact O-N 3.19Å
605	D	94.8	Very high	92.2	Very high	51 Å²	51	65.6 Å²	65.6	27%	0.273	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.8	133.6	168.1	-83.1	-9	0	0	0	110.9	L540 Y541 Y601 S602 N603 F607	L540-D605 HydrophobicContact CD2-CB 4.13Å; Y541-D605 PolarHBondContact N-O 3.06Å; Y601-D605 WeakPolarHBondContact CA-OD2 3.41Å; S602-D605 PolarHBondContact N-OD2 3.2Å; S602-D605 PolarHBondContact O-N 3.01Å; N603-D605 VanDerWaalsContact C-N 3.26Å; N603-D605 PolarHBondContact O-N 2.82Å; D605-F607 HydrophobicContact CB-CE2 3.65Å; D605-F607 HydrophobicContact CB-CZ 3.93Å
606	T	95.6	Very high	91.4	Very high	54 Å²	54	69.4 Å²	69.4	33%	0.331	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	135.7	-172.3	49.7	0	0	0	0	113.4	Y541 F550 E604	Y541-T606 HydrophobicContact CD2-CG2 4.39Å; Y541-T606 CarbonylContact O-C 3.56Å; Y541-T606 VanDerWaalsContact O-CA 3.31Å; Y541-T606 WeakPolarHBondContact O-CA 3.14Å; F550-T606 HydrophobicContact CE1-CG2 4.06Å; F550-T606 HydrophobicContact CZ-CG2 4.28Å; E604-T606 PolarHBondContact O-N 3.19Å
607	F	96.6	Very high	91.3	Very high	4 Å²	4	65.3 Å²	65.3	2%	0.018	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	151.5	-179	-53.9	-88.3	0	0	0	113.4	L540 Y541 V542 R543 Y601 D605 L622 M623 E624	L540-F607 HydrophobicContact CB-CE2 4.47Å; L540-F607 HydrophobicContact CD1-CE2 4.36Å; L540-F607 HydrophobicContact CD2-CE2 4.21Å; Y541-F607 PolarHBondContact O-N 3.33Å; V542-F607 WeakPolarHBondContact CA-O 3.44Å; V542-F607 HydrophobicContact CG1-CB 4.33Å; V542-F607 HydrophobicContact CG1-CD2 4.42Å; R543-F607 PolarHBondContact N-O 2.88Å; R543-F607 VanDerWaalsContact N-O 3.1Å; Y601-F607 HydrophobicContact CD1-CE1 4.44Å; Y601-F607 HydrophobicContact CD1-CE2 4.49Å; Y601-F607 AromaticContact CD1-CZ 3.64Å; Y601-F607 HydrophobicContact CD1-CZ 3.64Å; Y601-F607 AromaticContact CE1-CE1 3.84Å; Y601-F607 HydrophobicContact CE1-CE1 3.84Å; Y601-F607 AromaticContact CE1-CZ 3.46Å; Y601-F607 HydrophobicContact CE1-CZ 3.46Å; Y601-F607 VanDerWaalsContact CE1-CZ 3.46Å; Y601-F607 HydrophobicContact CG-CZ 4.3Å; Y601-F607 AromaticContact CZ-CZ 3.99Å; D605-F607 HydrophobicContact CB-CE2 3.65Å; D605-F607 HydrophobicContact CB-CZ 3.93Å; F607-L622 HydrophobicContact CB-CB 4.14Å; F607-L622 HydrophobicContact CB-CD2 4.06Å; F607-L622 HydrophobicContact CD1-CB 3.98Å; F607-L622 HydrophobicContact CD2-CD1 4.49Å; F607-L622 HydrophobicContact CG-CB 4.09Å; F607-L622 HydrophobicContact CG-CD1 4.45Å; F607-M623 CarbonylContact C-O 3.47Å; F607-M623 VanDerWaalsContact CA-O 3.22Å; F607-M623 WeakPolarHBondContact CA-O 3.26Å; F607-E624 HydrophobicContact CD1-CG 4.31Å; F607-E624 HydrophobicContact CE1-CG 3.97Å
608	I	96.1	Very high	91.2	Very high	19 Å²	19	65.9 Å²	65.9	10%	0.097	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	122.8	156.7	-55.1	-58.9	0	0	0	108.7	R543 E545 M623 I625	R543-I608 HydrophobicContact CG-CD1 3.66Å; R543-I608 CarbonylContact O-C 3.59Å; R543-I608 VanDerWaalsContact O-CA 3.27Å; R543-I608 WeakPolarHBondContact O-CA 3.25Å; E545-I608 HydrophobicContact CB-CG2 3.99Å; I608-M623 HydrophobicContact CB-CB 4.3Å; I608-M623 HydrophobicContact CB-CE 4.15Å; I608-M623 HydrophobicContact CG2-CE 4.27Å; I608-M623 PolarHBondContact N-O 3.28Å; I608-M623 PolarHBondContact O-N 3.05Å; I608-I625 HydrophobicContact CD1-CD1 3.68Å; I608-I625 HydrophobicContact CD1-CG1 4.19Å; I608-I625 HydrophobicContact CG1-CD1 4Å; I608-I625 HydrophobicContact CG1-CG1 3.94Å
609	L	95.6	Very high	91.3	Very high	2 Å²	2	67.5 Å²	67.5	1%	0.01	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	115.3	175.5	171.9	65.3	0	0	0	110	V542 R543 Y571 M611 V620 L622	V542-L609 HydrophobicContact CB-CB 4.09Å; V542-L609 HydrophobicContact CG2-CB 4.45Å; V542-L609 HydrophobicContact CG2-CD2 4.04Å; R543-L609 PolarHBondContact O-N 3.46Å; Y571-L609 HydrophobicContact CD2-CD2 4.11Å; Y571-L609 HydrophobicContact CE2-CD2 3.31Å; L609-M611 HydrophobicContact CD1-CG 3.77Å; L609-M611 HydrophobicContact CD1-SD 4.2Å; L609-M611 HydrophobicContact CD2-CE 3.9Å; L609-M611 HydrophobicContact CD2-CG 4.37Å; L609-M611 HydrophobicContact CD2-SD 4.01Å; L609-M611 HydrophobicContact CG-CE 4.33Å; L609-M611 HydrophobicContact CG-CG 3.92Å; L609-M611 HydrophobicContact CG-SD 4.23Å; L609-V620 HydrophobicContact CD1-CG1 3.46Å; L609-V620 VanDerWaalsContact CD1-CG1 3.46Å; L609-L622 HydrophobicContact CB-CD2 4.04Å; L609-L622 HydrophobicContact CD1-CD2 3.71Å; L609-L622 HydrophobicContact CG-CD2 4.46Å
610	N	94.3	Very high	91.5	Very high	71 Å²	71	62.9 Å²	62.9	38%	0.38	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	136.7	167.2	176.7	23.8	0	0	0	109.5	E612 V620 T621	N610-E612 PolarHBondContact ND2-OE1 3.35Å; N610-V620 WeakPolarHBondContact O-CA 3.42Å; N610-T621 PolarHBondContact N-O 2.71Å; N610-T621 PolarHBondContact O-N 3.2Å
611	M	92.4	Very high	91.8	Very high	51 Å²	51	58 Å²	58	25%	0.251	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	102.5	-179.3	-61.7	-168.8	-75.5	0	0	109.4	I567 Y571 L573 L609 V620	I567-M611 HydrophobicContact CG2-SD 4.44Å; Y571-M611 HydrophobicContact CD1-CE 4.25Å; Y571-M611 HydrophobicContact CD2-CE 4.21Å; Y571-M611 HydrophobicContact CD2-SD 4.42Å; Y571-M611 HydrophobicContact CG-CE 4.06Å; L573-M611 HydrophobicContact CD1-SD 3.66Å; L609-M611 HydrophobicContact CD1-CG 3.77Å; L609-M611 HydrophobicContact CD1-SD 4.2Å; L609-M611 HydrophobicContact CD2-CE 3.9Å; L609-M611 HydrophobicContact CD2-CG 4.37Å; L609-M611 HydrophobicContact CD2-SD 4.01Å; L609-M611 HydrophobicContact CG-CE 4.33Å; L609-M611 HydrophobicContact CG-CG 3.92Å; L609-M611 HydrophobicContact CG-SD 4.23Å; M611-V620 HydrophobicContact CG-CG1 4.37Å; M611-V620 HydrophobicContact CG-CG2 4.15Å
612	E	91.8	Very high	91.9	Very high	65 Å²	65	57.6 Å²	57.6	30%	0.304	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	127.2	-179	-71.3	164.3	-140.7	0	0	109.9	N610 F618 K619	N610-E612 PolarHBondContact ND2-OE1 3.35Å; E612-F618 WeakPolarHBondContact O-CA 3.29Å; E612-K619 HydrophobicContact CB-CB 4.3Å; E612-K619 PolarHBondContact N-O 3.24Å; E612-K619 PolarHBondContact O-N 3.32Å; E612-K619 IonicContact OE1-NZ 2.77Å; E612-K619 PolarHBondContact OE1-NZ 2.69Å; E612-K619 WeakPolarHBondContact OE2-CD 3.25Å; E612-K619 IonicContact OE2-NZ 3.88Å; E612-K619 PolarHBondContact OE2-NZ 2.77Å
613	S	89.8	Confident	92.1	Very high	98 Å²	98	56.4 Å²	56.4	69%	0.685	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.6	138.3	171.1	-169.5	0	0	0	0	110.6
614	M	87.3	Confident	92	Very high	80 Å²	80	54.5 Å²	54.5	39%	0.394	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	162.8	-179.5	-69	-166.5	161.9	0	0	110.2	E616 G617 K619	M614-E616 PolarHBondContact O-N 3.06Å; M614-E616 VanDerWaalsContact O-N 3.12Å; M614-G617 CarbonylContact C-O 3.51Å; M614-G617 WeakPolarHBondContact CA-O 3.39Å; M614-G617 PolarHBondContact N-O 3.22Å; M614-G617 PolarHBondContact O-N 3.07Å; M614-G617 VanDerWaalsContact O-N 3.12Å; M614-K619 HydrophobicContact CE-CB 3.85Å; M614-K619 HydrophobicContact CE-CD 3.55Å; M614-K619 HydrophobicContact CE-CG 4.33Å; M614-K619 HydrophobicContact CG-CB 4.36Å; M614-K619 HydrophobicContact SD-CB 3.79Å; M614-K619 HydrophobicContact SD-CD 4.49Å
615	V	79.6	Confident	91.4	Very high	158 Å²	158	53.2 Å²	53.2	96%	0.958	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-31.3	-178.7	-174.8	0	0	0	0	112.5
616	E	77.4	Confident	91.3	Very high	157 Å²	157	53.3 Å²	53.3	73%	0.734	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.4	10.7	-177.4	-59.6	175.9	141.7	0	0	113.6	M614	M614-E616 PolarHBondContact O-N 3.06Å; M614-E616 VanDerWaalsContact O-N 3.12Å
617	G	88.9	Confident	91.1	Very high	12 Å²	12	53.3 Å²	53.3	12%	0.124	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	138.8	-138.9	179.9	0	0	0	0	0	113.7	K577 M614	K577-G617 CarbonylContact O-C 3.55Å; K577-G617 WeakPolarHBondContact O-CA 3.32Å; M614-G617 CarbonylContact C-O 3.51Å; M614-G617 WeakPolarHBondContact CA-O 3.39Å; M614-G617 PolarHBondContact N-O 3.22Å; M614-G617 PolarHBondContact O-N 3.07Å; M614-G617 VanDerWaalsContact O-N 3.12Å
618	F	91.5	Very high	90.8	Very high	51 Å²	51	56 Å²	56	22%	0.224	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	136.2	178.5	-64.3	-83.4	0	0	0	111	L573 K577 A579 K580 E612	L573-F618 HydrophobicContact CD2-CD2 4.29Å; L573-F618 HydrophobicContact CD2-CE1 4.37Å; L573-F618 HydrophobicContact CD2-CE2 3.81Å; L573-F618 HydrophobicContact CD2-CZ 3.86Å; K577-F618 HydrophobicContact CB-CD2 3.97Å; K577-F618 HydrophobicContact CB-CE2 4.31Å; K577-F618 HydrophobicContact CD-CE2 4.44Å; K577-F618 PolarHBondContact O-N 2.97Å; A579-F618 PolarHBondContact N-O 3.43Å; A579-F618 VanDerWaalsContact N-O 3.15Å; K580-F618 PolarHBondContact N-O 2.94Å; E612-F618 WeakPolarHBondContact O-CA 3.29Å
619	K	93.9	Very high	90.4	Very high	34 Å²	34	58.2 Å²	58.2	15%	0.148	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	117.4	162.7	166.8	-172.8	163.4	-132.6	0	107.9	K580 Y582 E612 M614	K580-K619 HydrophobicContact CB-CB 4.32Å; K580-K619 HydrophobicContact CB-CG 4.44Å; K580-K619 WeakPolarHBondContact O-CA 3.5Å; Y582-K619 HydrophobicContact CD2-CD 4.17Å; Y582-K619 HydrophobicContact CD2-CG 3.85Å; Y582-K619 HydrophobicContact CE2-CD 4.03Å; Y582-K619 HydrophobicContact CE2-CG 3.89Å; E612-K619 HydrophobicContact CB-CB 4.3Å; E612-K619 PolarHBondContact N-O 3.24Å; E612-K619 PolarHBondContact O-N 3.32Å; E612-K619 IonicContact OE1-NZ 2.77Å; E612-K619 PolarHBondContact OE1-NZ 2.69Å; E612-K619 WeakPolarHBondContact OE2-CD 3.25Å; E612-K619 IonicContact OE2-NZ 3.88Å; E612-K619 PolarHBondContact OE2-NZ 2.77Å; M614-K619 HydrophobicContact CE-CB 3.85Å; M614-K619 HydrophobicContact CE-CD 3.55Å; M614-K619 HydrophobicContact CE-CG 4.33Å; M614-K619 HydrophobicContact CG-CB 4.36Å; M614-K619 HydrophobicContact SD-CB 3.79Å; M614-K619 HydrophobicContact SD-CD 4.49Å
620	V	95.4	Very high	90.1	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	138.8	174.1	-179.9	0	0	0	0	109.6	I567 I578 K580 L581 Y582 L609 N610 M611	I567-V620 HydrophobicContact CD1-CG1 4.14Å; I578-V620 HydrophobicContact CG2-CB 4.43Å; I578-V620 HydrophobicContact CG2-CG2 3.83Å; K580-V620 PolarHBondContact O-N 3.45Å; L581-V620 WeakPolarHBondContact CA-O 3.43Å; L581-V620 HydrophobicContact CD1-CB 3.71Å; L581-V620 HydrophobicContact CD1-CG1 3.72Å; Y582-V620 PolarHBondContact N-O 3.17Å; L609-V620 HydrophobicContact CD1-CG1 3.46Å; L609-V620 VanDerWaalsContact CD1-CG1 3.46Å; N610-V620 WeakPolarHBondContact O-CA 3.42Å; M611-V620 HydrophobicContact CG-CG1 4.37Å; M611-V620 HydrophobicContact CG-CG2 4.15Å
621	T	96.2	Very high	89.8	Confident	8 Å²	8	61.1 Å²	61.1	5%	0.049	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	122.3	175	-56.5	0	0	0	0	110.2	Y582 K584 L590 N610	Y582-T621 CarbonylContact O-C 3.54Å; Y582-T621 VanDerWaalsContact O-CA 3.32Å; Y582-T621 WeakPolarHBondContact O-CA 3.48Å; K584-T621 HydrophobicContact CB-CG2 3.84Å; L590-T621 HydrophobicContact CD1-CG2 3.75Å; N610-T621 PolarHBondContact N-O 2.71Å; N610-T621 PolarHBondContact O-N 3.2Å
622	L	96.4	Very high	89.6	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	121	168.6	-66.7	-177.3	0	0	0	109.5	V542 L563 Y582 K583 K584 M593 F607 L609	V542-L622 HydrophobicContact CG1-CD2 3.91Å; L563-L622 HydrophobicContact CD1-CD1 4.34Å; L563-L622 HydrophobicContact CD2-CD1 4.02Å; Y582-L622 PolarHBondContact O-N 3.08Å; K583-L622 CarbonylContact C-O 3.56Å; K583-L622 WeakPolarHBondContact CA-O 3.43Å; K584-L622 PolarHBondContact N-O 3.37Å; M593-L622 HydrophobicContact CE-CB 3.86Å; M593-L622 HydrophobicContact CE-CD1 3.86Å; M593-L622 HydrophobicContact CE-CG 4.11Å; F607-L622 HydrophobicContact CB-CB 4.14Å; F607-L622 HydrophobicContact CB-CD2 4.06Å; F607-L622 HydrophobicContact CD1-CB 3.98Å; F607-L622 HydrophobicContact CD2-CD1 4.49Å; F607-L622 HydrophobicContact CG-CB 4.09Å; F607-L622 HydrophobicContact CG-CD1 4.45Å; L609-L622 HydrophobicContact CB-CD2 4.04Å; L609-L622 HydrophobicContact CD1-CD2 3.71Å; L609-L622 HydrophobicContact CG-CD2 4.46Å
623	M	95.3	Very high	89.5	Confident	45 Å²	45	61.5 Å²	61.5	22%	0.222	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	125.4	179.1	178.3	161.8	53.5	0	0	110.6	K584 F607 I608	K584-M623 HydrophobicContact CB-CB 4.04Å; K584-M623 HydrophobicContact CB-CG 4.2Å; K584-M623 HydrophobicContact CD-CG 4.23Å; K584-M623 HydrophobicContact CD-SD 3.55Å; K584-M623 VanDerWaalsContact CD-SD 3.55Å; K584-M623 VanDerWaalsContact CE-SD 3.53Å; K584-M623 HydrophobicContact CG-CG 4.22Å; K584-M623 HydrophobicContact CG-SD 4.12Å; K584-M623 PolarHBondContact NZ-SD 3.4Å; K584-M623 VanDerWaalsContact O-CA 3.28Å; K584-M623 WeakPolarHBondContact O-CA 3.38Å; F607-M623 CarbonylContact C-O 3.47Å; F607-M623 VanDerWaalsContact CA-O 3.22Å; F607-M623 WeakPolarHBondContact CA-O 3.26Å; I608-M623 HydrophobicContact CB-CB 4.3Å; I608-M623 HydrophobicContact CB-CE 4.15Å; I608-M623 HydrophobicContact CG2-CE 4.27Å; I608-M623 PolarHBondContact N-O 3.28Å; I608-M623 PolarHBondContact O-N 3.05Å
624	E	88.9	Confident	89.5	Confident	61 Å²	61	58.5 Å²	58.5	29%	0.285	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	136.6	178.2	-66.4	172.5	143.2	0	0	111.5	K583 K584 S585 K586 F607	K583-E624 WeakPolarHBondContact CE-OE1 3.41Å; K583-E624 IonicContact NZ-OE1 3.02Å; K583-E624 PolarHBondContact NZ-OE1 3.43Å; K584-E624 PolarHBondContact O-N 2.85Å; S585-E624 VanDerWaalsContact CA-OE2 3.29Å; S585-E624 WeakPolarHBondContact CA-OE2 3.23Å; K586-E624 HydrophobicContact CG-CB 3.87Å; F607-E624 HydrophobicContact CD1-CG 4.31Å; F607-E624 HydrophobicContact CE1-CG 3.97Å
625	I	82.7	Confident	89.7	Confident	96 Å²	96	56.5 Å²	56.5	49%	0.492	29%	0.294	S	S	.	.			trans	-95.7	0	176	-55.6	-179.9	0	0	0	109.9	F550 K586 I608	F550-I625 HydrophobicContact CE1-CD1 3.68Å; F550-I625 HydrophobicContact CZ-CD1 3.7Å; K586-I625 WeakPolarHBondContact CE-O 3.39Å; K586-I625 WeakPolarHBondContact CE-OXT 3.47Å; K586-I625 PolarHBondContact NZ-O 3.38Å; K586-I625 PolarHBondContact NZ-OXT 2.85Å; I608-I625 HydrophobicContact CD1-CD1 3.68Å; I608-I625 HydrophobicContact CD1-CG1 4.19Å; I608-I625 HydrophobicContact CG1-CD1 4Å; I608-I625 HydrophobicContact CG1-CG1 3.94Å

Retrieved 625 of 625 residues in 136.3 ms (Link to these results)

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