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Transcription factor COE2

Transcription factor that, in osteoblasts, activates the decoy receptor for RANKL, TNFRSF11B, which in turn regulates osteoclast differentiation. Acts in synergy with the Wnt-responsive LEF1/CTNNB1 pathway. Recognizes variations of the palindromic sequence 5'-ATTCCCNNGGGAATT-3'.

AlphaFold DB (A0A2K5Z2U8), UniProt , Accession A0A096N690, Species PAPAN (Papio anubis, Olive baboon), Gene EBF2, Length 575 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	33.6	Very low	30	Very low	223 Å²	223	145.5 Å²	145.5	100%	1.099	80%	0.803	S	S	*	*				0	105.6	0	-63.9	174.8	171.3	0	0	105.7
2	F	31.6	Very low	30.5	Very low	199 Å²	199	144 Å²	144	87%	0.873	81%	0.805	S	S	*	*				78.9	131.8	87.2	-71	-58.2	0	0	0	111.9	I4	F2-I4 HydrophobicContact CD1-CD1 4.35Å
3	G	30.9	Very low	30.5	Very low	62 Å²	62	140.7 Å²	140.7	64%	0.639	81%	0.807	S	S	*	*			cis	-136.7	162.7	4.9	0	0	0	0	0	113.9
4	I	35.3	Very low	30.5	Very low	137 Å²	137	143.5 Å²	143.5	70%	0.703	82%	0.817	S	S	*	*				86.1	102.9	80.2	-68.7	164.4	0	0	0	109.8	F2	F2-I4 HydrophobicContact CD1-CD1 4.35Å
5	Q	31.9	Very low	30.5	Very low	166 Å²	166	147.3 Å²	147.3	78%	0.776	82%	0.821	S	S	*	*				72.5	138.9	81.7	-83.3	-164.9	-51.9	0	0	114.4
6	D	32.1	Very low	30.4	Very low	126 Å²	126	150.5 Å²	150.5	67%	0.674	83%	0.827	S	S	*	*			cis	-167.9	-175.4	-15.3	-143.5	-40.1	0	0	0	111.3
7	T	27.2	Very low	30.3	Very low	116 Å²	116	152.9 Å²	152.9	71%	0.712	83%	0.828	S	S	*	*			trans	102	94.3	158.2	68.6	0	0	0	0	121.6
8	L	29.7	Very low	30.2	Very low	174 Å²	174	150.9 Å²	150.9	91%	0.911	83%	0.827	S	S	*	*				55.8	113.9	125.8	-65.7	165.8	0	0	0	121.4
9	G	25.4	Very low	30.4	Very low	77 Å²	77	151.9 Å²	151.9	79%	0.794	83%	0.83	S	S	*	*			trans	-161.6	81	170.9	0	0	0	0	0	117.6
10	R	26	Very low	30.6	Very low	253 Å²	253	148.4 Å²	148.4	96%	0.955	83%	0.831	S	S	*	*			trans	63.9	108	150.6	-158.1	179.9	-142.5	-165.2	5.8	120.4
11	G	26.9	Very low	30.9	Very low	68 Å²	68	146.1 Å²	146.1	70%	0.701	83%	0.831	S	S	*	*			trans	-88.4	172.2	160.2	0	0	0	0	0	114.3
12	P	35.7	Very low	30.8	Very low	127 Å²	127	144.9 Å²	144.9	83%	0.825	82%	0.822	S	S	*	*			trans	-105.9	154.1	-159.6	38.8	-35.3	0	0	0	117.8
13	A	30.9	Very low	31.1	Very low	101 Å²	101	144 Å²	144	84%	0.835	82%	0.823	S	S	*	*			trans	37.4	116.9	146.8	0	0	0	0	0	121.4
14	L	30.2	Very low	31.4	Very low	180 Å²	180	145.1 Å²	145.1	94%	0.942	81%	0.814	S	S	*	*			trans	-131.6	156.4	154.6	-103.5	170.8	0	0	0	110.7
15	K	30.6	Very low	31.6	Very low	201 Å²	201	143.5 Å²	143.5	87%	0.874	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-71.5	154.4	-171.5	-82.3	-179.4	174.1	176.7	0	113.9
16	E	28.5	Very low	31.8	Very low	198 Å²	198	140.9 Å²	140.9	93%	0.925	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-63.9	150.1	179.1	-162.3	165.5	-161.6	0	0	113
17	K	29.4	Very low	32	Very low	192 Å²	192	143.5 Å²	143.5	84%	0.835	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-85.3	142.8	-167.9	-79.6	-173.1	171.4	-171.9	0	113.8
18	S	27.8	Very low	32.6	Very low	116 Å²	116	141.3 Å²	141.3	81%	0.811	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-72.1	146.4	157.1	-174.9	0	0	0	0	110.6
19	L	34.2	Very low	32.9	Very low	170 Å²	170	143.1 Å²	143.1	89%	0.89	80%	0.795	S	S	*	*			trans	-116.6	128.2	173.4	-79.7	169.1	0	0	0	110.1
20	G	34.6	Very low	33.6	Very low	82 Å²	82	144.8 Å²	144.8	85%	0.845	79%	0.79	S	S	*	*	S	Bend	trans	110.1	48	164.3	0	0	0	0	0	117.9
21	A	36	Very low	34.6	Very low	100 Å²	100	141.4 Å²	141.4	83%	0.826	78%	0.777	S	S	*	*			trans	-156.8	26.3	163.8	0	0	0	0	0	115.4	M23	A21-M23 PolarHBondContact O-N 2.77Å
22	E	32.7	Very low	35.6	Very low	198 Å²	198	142.3 Å²	142.3	93%	0.925	77%	0.766	S	S	*	*			trans	-91.2	78.8	-179.9	-163.8	158.3	-142.6	0	0	111.2
23	M	37.5	Very low	36.3	Very low	181 Å²	181	141.8 Å²	141.8	89%	0.892	76%	0.76	S	S	*	*			trans	-106.9	104.5	168.3	-78.8	-176.7	69.8	0	0	110.3	A21 S25	A21-M23 PolarHBondContact O-N 2.77Å; M23-S25 PolarHBondContact O-N 3.13Å
24	D	36.6	Very low	38.2	Very low	84 Å²	84	139.5 Å²	139.5	45%	0.449	75%	0.746	S	S	.	*			trans	14.7	90.1	166.1	-70.3	-25.5	0	0	0	117.3	V26 R27 S28	D24-V26 PolarHBondContact O-N 3.1Å; D24-V26 VanDerWaalsContact O-N 3.08Å; D24-R27 HydrophobicContact CB-CB 3.68Å; D24-R27 HydrophobicContact CB-CG 3.59Å; D24-R27 PolarHBondContact O-N 3.32Å; D24-R27 WeakPolarHBondContact OD2-CD 3.43Å; D24-R27 WeakPolarHBondContact OD2-CG 3.2Å; D24-R27 IonicContact OD2-CZ 3.83Å; D24-R27 IonicContact OD2-NE 2.77Å; D24-R27 PolarHBondContact OD2-NE 3.21Å; D24-S28 PolarHBondContact O-N 2.97Å
25	S	40.7	Very low	40.7	Very low	104 Å²	104	133 Å²	133	73%	0.727	71%	0.714	S	S	*	*	H	α-helix	trans	-52.6	-28.9	161.9	-61.4	0	0	0	0	112	M23 S28 W29	M23-S25 PolarHBondContact O-N 3.13Å; S25-S28 WeakPolarHBondContact O-CB 3.35Å; S25-S28 PolarHBondContact O-N 3.37Å; S25-W29 PolarHBondContact O-N 3.34Å; S25-W29 VanDerWaalsContact O-N 3.17Å
26	V	34.7	Very low	43.5	Very low	111 Å²	111	125.8 Å²	125.8	67%	0.673	69%	0.686	S	S	*	*	H	α-helix	trans	-66.2	-39.8	175.3	-173.9	0	0	0	0	112.2	D24 S28 W29 V30	D24-V26 PolarHBondContact O-N 3.1Å; D24-V26 VanDerWaalsContact O-N 3.08Å; V26-S28 VanDerWaalsContact C-N 3.31Å; V26-S28 PolarHBondContact O-N 3.46Å; V26-W29 PolarHBondContact O-N 3.41Å; V26-V30 PolarHBondContact O-N 3.5Å
27	R	37.8	Very low	46.4	Very low	180 Å²	180	119.9 Å²	119.9	68%	0.679	66%	0.661	S	S	*	*	H	α-helix	trans	-71.5	-26.5	174.4	-73.1	-175.2	-170.2	-125.2	-3.3	112.6	D24	D24-R27 HydrophobicContact CB-CB 3.68Å; D24-R27 HydrophobicContact CB-CG 3.59Å; D24-R27 PolarHBondContact O-N 3.32Å; D24-R27 WeakPolarHBondContact OD2-CD 3.43Å; D24-R27 WeakPolarHBondContact OD2-CG 3.2Å; D24-R27 IonicContact OD2-CZ 3.83Å; D24-R27 IonicContact OD2-NE 2.77Å; D24-R27 PolarHBondContact OD2-NE 3.21Å
28	S	37.7	Very low	49.1	Very low	70 Å²	70	111.4 Å²	111.4	49%	0.49	63%	0.627	S	S	.	*	H	α-helix	trans	-65.1	-49.6	172.8	-168.4	0	0	0	0	110.7	D24 S25 V26 V30 R31	D24-S28 PolarHBondContact O-N 2.97Å; S25-S28 WeakPolarHBondContact O-CB 3.35Å; S25-S28 PolarHBondContact O-N 3.37Å; V26-S28 VanDerWaalsContact C-N 3.31Å; V26-S28 PolarHBondContact O-N 3.46Å; S28-V30 PolarHBondContact O-N 3.17Å; S28-R31 PolarHBondContact O-N 3.08Å; S28-R31 VanDerWaalsContact O-N 3.13Å
29	W	36.4	Very low	51.9	Low	212 Å²	212	111.4 Å²	111.4	80%	0.803	62%	0.618	S	S	*	*	H	α-helix	trans	-56.1	-49.2	179.5	-109.4	62	0	0	0	113.2	S25 V26 R31 N32	S25-W29 PolarHBondContact O-N 3.34Å; S25-W29 VanDerWaalsContact O-N 3.17Å; V26-W29 PolarHBondContact O-N 3.41Å; W29-R31 PolarHBondContact O-N 3.22Å; W29-R31 VanDerWaalsContact O-N 3.1Å; W29-N32 PolarHBondContact O-N 2.89Å; W29-N32 VanDerWaalsContact O-N 3.15Å
30	V	40.5	Very low	54.5	Low	112 Å²	112	106.9 Å²	106.9	68%	0.679	60%	0.597	S	S	*	*	H	α-helix	trans	-62	-21	-178.6	177.8	0	0	0	0	112.9	V26 S28	V26-V30 PolarHBondContact O-N 3.5Å; S28-V30 PolarHBondContact O-N 3.17Å
31	R	47.8	Very low	57	Low	182 Å²	182	103.2 Å²	103.2	69%	0.687	56%	0.558	S	S	*	*	H	α-helix	trans	-90.9	-10.5	179.2	-79.1	-178.2	162.7	-168.5	-6.3	115.4	S28 W29	S28-R31 PolarHBondContact O-N 3.08Å; S28-R31 VanDerWaalsContact O-N 3.13Å; W29-R31 PolarHBondContact O-N 3.22Å; W29-R31 VanDerWaalsContact O-N 3.1Å
32	N	46.7	Very low	59.4	Low	88 Å²	88	99.8 Å²	99.8	47%	0.471	53%	0.53	S	S	.	.	H	α-helix	trans	-105.5	-1.1	-179.5	-75.4	11.7	0	0	0	113.3	W29 G34	W29-N32 PolarHBondContact O-N 2.89Å; W29-N32 VanDerWaalsContact O-N 3.15Å; N32-G34 PolarHBondContact O-N 3.44Å
33	V	50.2	Low	61.9	Low	116 Å²	116	98.2 Å²	98.2	70%	0.703	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	115.8	174.6	-177.1	0	0	0	0	109.7
34	G	71.8	Confident	64.1	Low	52 Å²	52	94.4 Å²	94.4	54%	0.536	51%	0.514	S	S	.	.	T	Hydrogen-bonded Turn	trans	91	16.9	173.8	0	0	0	0	0	116.5	N32	N32-G34 PolarHBondContact O-N 3.44Å
35	V	83.1	Confident	66.4	Low	44 Å²	44	91.5 Å²	91.5	27%	0.267	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	126.6	164.9	-172.8	0	0	0	0	109.1	R120 E122	V35-R120 HydrophobicContact CB-CB 4.45Å; V35-R120 HydrophobicContact CG2-CB 4.1Å; V35-E122 HydrophobicContact CG1-CB 4.14Å
36	V	89.7	Confident	68.7	Low	50 Å²	50	87.1 Å²	87.1	30%	0.303	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	147.1	-174.9	-173.2	0	0	0	0	110.5	V40 A41 R120 T121 E122	V36-V40 HydrophobicContact CG1-CB 3.83Å; V36-V40 HydrophobicContact CG1-CG1 3.79Å; V36-A41 HydrophobicContact CG1-CB 4.25Å; V36-R120 PolarHBondContact N-O 3.34Å; V36-T121 CarbonylContact O-C 3.51Å; V36-T121 WeakPolarHBondContact O-CA 3.48Å; V36-T121 WeakPolarHBondContact O-CB 3.23Å; V36-E122 PolarHBondContact O-N 2.92Å
37	D	88.9	Confident	71.4	Confident	74 Å²	74	82.3 Å²	82.3	40%	0.396	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	140.2	171	178.1	-94.2	0	0	0	111.3	N39 V40 A41	D37-N39 PolarHBondContact O-N 2.8Å; D37-N39 VanDerWaalsContact O-N 3.17Å; D37-N39 WeakPolarHBondContact OD1-CA 3.3Å; D37-N39 WeakPolarHBondContact OD1-CB 3.37Å; D37-N39 PolarHBondContact OD1-N 2.75Å; D37-N39 PolarHBondContact OD1-ND2 3.48Å; D37-V40 HydrophobicContact CB-CG2 4.23Å; D37-V40 PolarHBondContact O-N 2.73Å; D37-A41 PolarHBondContact O-N 2.7Å
38	A	86.3	Confident	74.1	Confident	13 Å²	13	74.3 Å²	74.3	11%	0.107	42%	0.415	C	S	.	.	H	α-helix	trans	-55.1	-34.1	-178.4	0	0	0	0	0	114.1	A42 E122 Q123	A38-A42 VanDerWaalsContact O-CB 3.22Å; A38-A42 WeakPolarHBondContact O-CB 3.4Å; A38-A42 PolarHBondContact O-N 2.74Å; A38-E122 WeakPolarHBondContact CB-O 3.05Å; A38-E122 PolarHBondContact N-O 3.26Å; A38-E122 VanDerWaalsContact N-O 3.17Å; A38-Q123 HydrophobicContact CB-CB 4.38Å
39	N	87.2	Confident	76.7	Confident	117 Å²	117	73.1 Å²	73.1	63%	0.626	41%	0.407	S	S	*	.	H	α-helix	trans	-71.8	-36.4	179.3	-54.5	-83.1	0	0	0	111.5	D37 Q43	D37-N39 PolarHBondContact O-N 2.8Å; D37-N39 VanDerWaalsContact O-N 3.17Å; D37-N39 WeakPolarHBondContact OD1-CA 3.3Å; D37-N39 WeakPolarHBondContact OD1-CB 3.37Å; D37-N39 PolarHBondContact OD1-N 2.75Å; D37-N39 PolarHBondContact OD1-ND2 3.48Å; N39-Q43 PolarHBondContact O-N 3.15Å
40	V	88.2	Confident	79.5	Confident	75 Å²	75	69.4 Å²	69.4	46%	0.455	39%	0.393	S	S	.	.	H	α-helix	trans	-71.4	-43	175.6	179.4	0	0	0	0	110.3	V36 D37 A42 Q43	V36-V40 HydrophobicContact CG1-CB 3.83Å; V36-V40 HydrophobicContact CG1-CG1 3.79Å; D37-V40 HydrophobicContact CB-CG2 4.23Å; D37-V40 PolarHBondContact O-N 2.73Å; V40-A42 VanDerWaalsContact C-N 3.31Å; V40-A42 PolarHBondContact O-N 3.22Å; V40-Q43 WeakPolarHBondContact O-CB 3.33Å; V40-Q43 PolarHBondContact O-N 2.89Å
41	A	85.8	Confident	82.3	Confident	4 Å²	4	64.4 Å²	64.4	3%	0.033	36%	0.363	C	S	.	.	H	α-helix	trans	-62	-37.7	174.9	0	0	0	0	0	112.4	V36 D37 Q43 S44 G45 V46 T121	V36-A41 HydrophobicContact CG1-CB 4.25Å; D37-A41 PolarHBondContact O-N 2.7Å; A41-Q43 VanDerWaalsContact C-N 3.29Å; A41-Q43 PolarHBondContact O-N 2.82Å; A41-S44 CarbonylContact O-C 3.56Å; A41-S44 WeakPolarHBondContact O-CA 3.32Å; A41-S44 WeakPolarHBondContact O-CB 3.33Å; A41-S44 PolarHBondContact O-N 2.97Å; A41-G45 PolarHBondContact O-N 3.07Å; A41-V46 CarbonylContact C-O 3.58Å; A41-V46 HydrophobicContact CB-CB 4.29Å; A41-V46 WeakPolarHBondContact CB-O 3.47Å; A41-V46 PolarHBondContact O-N 2.91Å; A41-T121 HydrophobicContact CB-CG2 3.46Å; A41-T121 VanDerWaalsContact CB-CG2 3.46Å
42	A	86.6	Confident	84.6	Confident	29 Å²	29	60 Å²	60	24%	0.24	35%	0.35	C	S	.	.	H	α-helix	trans	-65.2	-27.2	178.3	0	0	0	0	0	113.8	A38 V40 S44 G45 V46 A47	A38-A42 VanDerWaalsContact O-CB 3.22Å; A38-A42 WeakPolarHBondContact O-CB 3.4Å; A38-A42 PolarHBondContact O-N 2.74Å; V40-A42 VanDerWaalsContact C-N 3.31Å; V40-A42 PolarHBondContact O-N 3.22Å; A42-S44 VanDerWaalsContact C-N 3.33Å; A42-G45 PolarHBondContact O-N 3.1Å; A42-G45 VanDerWaalsContact O-N 3.1Å; A42-V46 PolarHBondContact N-O 2.85Å; A42-A47 HydrophobicContact CB-CB 4.01Å
43	Q	86.6	Confident	87.1	Confident	165 Å²	165	56.4 Å²	56.4	77%	0.771	33%	0.331	S	S	*	.	H	α-helix	trans	-65.8	-37.2	171.4	-66.2	173.3	11.7	0	0	111.2	N39 V40 A41 G45	N39-Q43 PolarHBondContact O-N 3.15Å; V40-Q43 WeakPolarHBondContact O-CB 3.33Å; V40-Q43 PolarHBondContact O-N 2.89Å; A41-Q43 VanDerWaalsContact C-N 3.29Å; A41-Q43 PolarHBondContact O-N 2.82Å; Q43-G45 PolarHBondContact O-N 3.46Å
44	S	83.3	Confident	89.4	Confident	100 Å²	100	54.9 Å²	54.9	70%	0.699	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	10.3	171.1	-55.4	0	0	0	0	113.5	A41 A42 V46	A41-S44 CarbonylContact O-C 3.56Å; A41-S44 WeakPolarHBondContact O-CA 3.32Å; A41-S44 WeakPolarHBondContact O-CB 3.33Å; A41-S44 PolarHBondContact O-N 2.97Å; A42-S44 VanDerWaalsContact C-N 3.33Å; S44-V46 VanDerWaalsContact C-N 3.26Å; S44-V46 PolarHBondContact O-N 2.95Å
45	G	85.4	Confident	90.6	Very high	24 Å²	24	57.7 Å²	57.7	25%	0.247	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.6	-0.9	-179.4	0	0	0	0	0	115.6	A41 A42 Q43 A47	A41-G45 PolarHBondContact O-N 3.07Å; A42-G45 PolarHBondContact O-N 3.1Å; A42-G45 VanDerWaalsContact O-N 3.1Å; Q43-G45 PolarHBondContact O-N 3.46Å; G45-A47 PolarHBondContact O-N 2.96Å
46	V	89	Confident	91.4	Very high	11 Å²	11	58.7 Å²	58.7	7%	0.067	32%	0.315	C	S	.	.			trans	-91.9	101.2	-178	-176.1	0	0	0	0	109.2	A41 A42 S44 Y115 N117 V119	A41-V46 CarbonylContact C-O 3.58Å; A41-V46 HydrophobicContact CB-CB 4.29Å; A41-V46 WeakPolarHBondContact CB-O 3.47Å; A41-V46 PolarHBondContact O-N 2.91Å; A42-V46 PolarHBondContact N-O 2.85Å; S44-V46 VanDerWaalsContact C-N 3.26Å; S44-V46 PolarHBondContact O-N 2.95Å; V46-Y115 HydrophobicContact CG1-CD1 3.65Å; V46-Y115 HydrophobicContact CG1-CD2 3.67Å; V46-Y115 HydrophobicContact CG1-CE1 3.89Å; V46-Y115 HydrophobicContact CG1-CE2 3.94Å; V46-Y115 HydrophobicContact CG1-CG 3.53Å; V46-N117 VanDerWaalsContact CG2-ND2 3.33Å; V46-N117 WeakPolarHBondContact CG2-ND2 3.27Å; V46-V119 HydrophobicContact CG1-CB 4.4Å; V46-V119 HydrophobicContact CG1-CG1 4.33Å
47	A	91.3	Very high	91.8	Very high	10 Å²	10	56.7 Å²	56.7	8%	0.083	30%	0.303	C	S	.	.			trans	-153.3	155.6	179.7	0	0	0	0	0	111.5	A42 G45 S49 D75 R76	A42-A47 HydrophobicContact CB-CB 4.01Å; G45-A47 PolarHBondContact O-N 2.96Å; A47-S49 PolarHBondContact O-N 2.95Å; A47-D75 WeakPolarHBondContact O-CA 3.44Å; A47-R76 PolarHBondContact O-N 2.98Å
48	L	93.6	Very high	92.2	Very high	12 Å²	12	55.5 Å²	55.5	6%	0.063	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	134.4	163.4	-70.5	-173	0	0	0	109.7	L73 V81 L113 Y115 Q123 T216 L225	L48-L73 HydrophobicContact CD1-CD1 4.3Å; L48-L73 HydrophobicContact CD1-CD2 4.46Å; L48-L73 HydrophobicContact CD2-CB 4.01Å; L48-L73 HydrophobicContact CD2-CD1 4.45Å; L48-V81 HydrophobicContact CD2-CB 4.29Å; L48-V81 HydrophobicContact CD2-CG1 4.38Å; L48-V81 HydrophobicContact CD2-CG2 4.04Å; L48-L113 HydrophobicContact CD1-CD1 3.91Å; L48-L113 HydrophobicContact CD2-CD1 3.92Å; L48-L113 HydrophobicContact CG-CD1 3.83Å; L48-Y115 PolarHBondContact N-OH 3.34Å; L48-Y115 VanDerWaalsContact N-OH 3.08Å; L48-Q123 HydrophobicContact CD1-CG 3.88Å; L48-Q123 HydrophobicContact CG-CG 4.43Å; L48-T216 HydrophobicContact CB-CG2 4.49Å; L48-L225 HydrophobicContact CB-CD2 4.02Å; L48-L225 HydrophobicContact CD1-CD1 4.08Å
49	S	93.2	Very high	92.7	Very high	45 Å²	45	58.1 Å²	58.1	32%	0.315	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	-34.4	175.4	-163	0	0	0	0	112.3	A47 Y74 D75 H223	A47-S49 PolarHBondContact O-N 2.95Å; S49-Y74 PolarHBondContact N-O 2.88Å; S49-D75 WeakPolarHBondContact CB-O 3.47Å; S49-H223 PolarHBondContact O-CE1 3.16Å
50	R	95.4	Very high	93.2	Very high	135 Å²	135	55.5 Å²	55.5	51%	0.509	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	148.1	-172.5	-172.3	-179.6	67	159.1	2.5	111.3	Y74	R50-Y74 PolarHBondContact N-O 2.84Å; R50-Y74 PolarHBondContact O-N 3.33Å
51	A	97.6	Very high	93.6	Very high	6 Å²	6	52.3 Å²	52.3	5%	0.05	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	158.4	163.5	0	0	0	0	0	110.2	A72 L73 L214 L225 A226	A51-A72 CarbonylContact C-O 3.52Å; A51-A72 WeakPolarHBondContact CA-O 3.34Å; A51-L73 HydrophobicContact CB-CD2 3.93Å; A51-L214 HydrophobicContact CB-CD1 4.25Å; A51-L225 HydrophobicContact CB-CB 3.97Å; A51-L225 PolarHBondContact N-O 3.5Å; A51-A226 HydrophobicContact CB-CB 3.96Å; A51-A226 WeakPolarHBondContact O-CB 3.15Å
52	H	97.8	Very high	94.1	Very high	89 Å²	89	56.7 Å²	56.7	41%	0.412	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	136.1	173	-177.2	-114.2	0	0	0	110.9	E54 L71 A72 Y74	H52-E54 IonicContact CE1-OE1 2.69Å; H52-E54 IonicContact CG-OE1 2.89Å; H52-E54 IonicContact ND1-OE1 2.66Å; H52-E54 PolarHBondContact ND1-OE1 2.92Å; H52-E54 IonicContact ND1-OE2 2.73Å; H52-E54 PolarHBondContact O-N 3.39Å; H52-E54 VanDerWaalsContact O-N 3.11Å; H52-L71 CarbonylContact O-C 3.56Å; H52-L71 VanDerWaalsContact O-CA 3.23Å; H52-L71 WeakPolarHBondContact O-CA 3.38Å; H52-A72 PolarHBondContact N-O 3.27Å; H52-A72 PolarHBondContact O-N 3.1Å; H52-Y74 HydrophobicContact CB-CE2 3.8Å
53	F	98.4	Very high	94.5	Very high	14 Å²	14	57.5 Å²	57.5	6%	0.061	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	76.5	178.6	-78.2	-87.1	0	0	0	111.3	K55 Q56 F69 V70 L71 V212 L214 A226	F53-K55 PolarHBondContact O-N 2.87Å; F53-K55 VanDerWaalsContact O-N 3.07Å; F53-Q56 HydrophobicContact CB-CG 4.24Å; F53-F69 HydrophobicContact CD1-CB 4.13Å; F53-F69 HydrophobicContact CD1-CD2 4.22Å; F53-F69 HydrophobicContact CD1-CG 4.37Å; F53-F69 HydrophobicContact CE1-CB 4.16Å; F53-F69 AromaticContact CE1-CD2 3.75Å; F53-F69 HydrophobicContact CE1-CD2 3.75Å; F53-F69 HydrophobicContact CE1-CE2 4.28Å; F53-F69 AromaticContact CE1-CG 3.95Å; F53-F69 HydrophobicContact CE1-CG 3.95Å; F53-V70 CarbonylContact C-O 3.56Å; F53-L71 HydrophobicContact CD1-CD2 3.57Å; F53-L71 HydrophobicContact CD2-CD2 4.44Å; F53-L71 HydrophobicContact CE1-CD2 3.63Å; F53-L71 HydrophobicContact CE2-CD2 4.48Å; F53-L71 HydrophobicContact CG-CD2 4Å; F53-L71 HydrophobicContact CZ-CD2 4.1Å; F53-V212 HydrophobicContact CE1-CB 4.48Å; F53-V212 HydrophobicContact CZ-CB 4.2Å; F53-V212 HydrophobicContact CZ-CG1 4.24Å; F53-L214 HydrophobicContact CE1-CD1 4.08Å; F53-L214 HydrophobicContact CE2-CD1 3.69Å; F53-L214 HydrophobicContact CZ-CD1 3.38Å; F53-L214 HydrophobicContact CZ-CG 4.05Å; F53-A226 HydrophobicContact CD2-CB 4.1Å; F53-A226 HydrophobicContact CE2-CB 3.77Å
54	E	98	Very high	94.9	Very high	84 Å²	84	51.9 Å²	51.9	39%	0.393	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-50.4	-30.7	169.8	-59.2	-54	144.6	0	0	112.6	H52 V70 A72 F186	H52-E54 IonicContact CE1-OE1 2.69Å; H52-E54 IonicContact CG-OE1 2.89Å; H52-E54 IonicContact ND1-OE1 2.66Å; H52-E54 PolarHBondContact ND1-OE1 2.92Å; H52-E54 IonicContact ND1-OE2 2.73Å; H52-E54 PolarHBondContact O-N 3.39Å; H52-E54 VanDerWaalsContact O-N 3.11Å; E54-V70 HydrophobicContact CB-CB 4.4Å; E54-V70 HydrophobicContact CB-CG1 4.23Å; E54-V70 PolarHBondContact N-O 2.86Å; E54-V70 VanDerWaalsContact N-O 3.07Å; E54-A72 HydrophobicContact CG-CB 3.84Å; E54-A72 WeakPolarHBondContact OE1-CB 3.45Å; E54-F186 HydrophobicContact CG-CD1 3.83Å; E54-F186 HydrophobicContact CG-CE1 3.81Å
55	K	98.3	Very high	95.5	Very high	110 Å²	110	51 Å²	51	48%	0.478	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	107.8	164.9	-170.1	167.6	-173	167.4	0	110.8	F53 F69 V70	F53-K55 PolarHBondContact O-N 2.87Å; F53-K55 VanDerWaalsContact O-N 3.07Å; K55-F69 CarbonylContact O-C 3.49Å; K55-F69 WeakPolarHBondContact O-CA 3.22Å; K55-F69 WeakPolarHBondContact O-CB 3.21Å; K55-V70 HydrophobicContact CB-CB 3.73Å; K55-V70 HydrophobicContact CB-CG2 3.83Å; K55-V70 HydrophobicContact CD-CG2 4.4Å; K55-V70 PolarHBondContact N-O 2.91Å; K55-V70 VanDerWaalsContact N-O 3.07Å; K55-V70 PolarHBondContact O-N 3.46Å
56	Q	98.5	Very high	96.1	Very high	66 Å²	66	52.7 Å²	52.7	31%	0.308	26%	0.264	S	S	.	.	P	Polyproline II helix	trans	-56.6	149.7	172.4	-67	-77.3	17.1	0	0	112.2	F53 D229	F53-Q56 HydrophobicContact CB-CG 4.24Å; Q56-D229 HydrophobicContact CB-CB 4.47Å; Q56-D229 VanDerWaalsContact CD-CG 3.43Å; Q56-D229 HydrophobicContact CG-CB 4.28Å; Q56-D229 WeakPolarHBondContact CG-OD2 3.25Å; Q56-D229 PolarHBondContact NE2-OD1 3.34Å; Q56-D229 PolarHBondContact NE2-OD2 3.12Å
57	P	98.4	Very high	96.6	Very high	7 Å²	7	52.3 Å²	52.3	5%	0.045	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-65	159.2	169.6	30.5	-34.7	0	0	0	111.1	S59 F67 F69 V212 S228	P57-S59 PolarHBondContact O-N 2.87Å; P57-F67 HydrophobicContact CB-CD2 3.98Å; P57-F67 HydrophobicContact CB-CE2 4.25Å; P57-F69 HydrophobicContact CB-CB 4.45Å; P57-V212 HydrophobicContact CB-CG2 4.31Å; P57-V212 HydrophobicContact CG-CG2 3.97Å; P57-S228 WeakPolarHBondContact CG-OG 3.36Å
58	P	97.9	Very high	96.9	Very high	49 Å²	49	55.8 Å²	55.8	32%	0.318	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-66.1	127.4	-176.6	27	-34.7	0	0	0	111.9	N60 L61 F67 M231	P58-N60 PolarHBondContact O-N 3.05Å; P58-L61 HydrophobicContact CG-CB 4.38Å; P58-L61 HydrophobicContact CG-CD1 4.32Å; P58-F67 HydrophobicContact CG-CB 3.76Å; P58-M231 VanDerWaalsContact O-CG 3.3Å; P58-M231 WeakPolarHBondContact O-CG 3.4Å
59	S	96.9	Very high	97.2	Very high	69 Å²	69	55.2 Å²	55.2	48%	0.483	27%	0.273	S	S	.	.	S	Bend	trans	-59.9	-19.5	-178.4	62	0	0	0	0	114.7	P57 N230 F232	P57-S59 PolarHBondContact O-N 2.87Å; S59-N230 WeakPolarHBondContact CA-O 3.26Å; S59-F232 PolarHBondContact O-N 2.97Å
60	N	96.1	Very high	97.4	Very high	61 Å²	61	54 Å²	54	33%	0.326	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	128.4	169.3	-56.1	-90.1	0	0	0	108.8	P58 F232 H239	P58-N60 PolarHBondContact O-N 3.05Å; N60-F232 CarbonylContact C-O 3.47Å; N60-F232 WeakPolarHBondContact CA-O 3.13Å; N60-H239 PolarHBondContact OD1-NE2 3.44Å
61	L	97.6	Very high	97.5	Very high	9 Å²	9	47.6 Å²	47.6	5%	0.047	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	131	-175.2	176.5	61.4	0	0	0	111.1	P58 N65 F67 C193 M231 F232 V233 H234	P58-L61 HydrophobicContact CG-CB 4.38Å; P58-L61 HydrophobicContact CG-CD1 4.32Å; L61-N65 HydrophobicContact CD1-CB 4.37Å; L61-F67 HydrophobicContact CD1-CB 3.98Å; L61-F67 HydrophobicContact CD2-CB 3.94Å; L61-F67 HydrophobicContact CD2-CD1 3.5Å; L61-F67 HydrophobicContact CD2-CE1 4.22Å; L61-F67 HydrophobicContact CD2-CG 3.88Å; L61-C193 HydrophobicContact CD2-CB 4.03Å; L61-M231 HydrophobicContact CB-CG 4.11Å; L61-M231 HydrophobicContact CB-SD 3.93Å; L61-M231 HydrophobicContact CD2-SD 3.6Å; L61-M231 VanDerWaalsContact CD2-SD 3.6Å; L61-M231 HydrophobicContact CG-SD 4.4Å; L61-F232 PolarHBondContact N-O 2.92Å; L61-V233 HydrophobicContact CB-CG2 4.39Å; L61-V233 HydrophobicContact CD2-CG2 4.38Å; L61-V233 WeakPolarHBondContact O-CA 3.48Å; L61-H234 PolarHBondContact O-CD2 3.47Å; L61-H234 VanDerWaalsContact O-CD2 3.28Å; L61-H234 PolarHBondContact O-N 3.48Å
62	R	96.9	Very high	97.6	Very high	96 Å²	96	47.5 Å²	47.5	36%	0.362	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	119	166.1	-166.2	-176.6	174.6	-154.6	-5.4	110.2	S64 N65 H234	R62-S64 VanDerWaalsContact CD-OG 3.25Å; R62-S64 WeakPolarHBondContact CD-OG 3.3Å; R62-S64 WeakPolarHBondContact CG-OG 3.34Å; R62-S64 PolarHBondContact NE-OG 3.38Å; R62-S64 PolarHBondContact O-N 2.89Å; R62-N65 WeakPolarHBondContact O-CB 3.4Å; R62-N65 PolarHBondContact O-N 2.93Å; R62-H234 CarbonylContact C-O 3.59Å; R62-H234 VanDerWaalsContact CA-O 3.25Å; R62-H234 WeakPolarHBondContact CA-O 3.43Å
63	K	95	Very high	97.6	Very high	45 Å²	45	43.3 Å²	43.3	20%	0.196	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-46.8	-25.4	179.1	165.2	168.9	171.3	167.7	0	115.7	N65 K192 N194 N196 V233 H234	K63-N65 VanDerWaalsContact C-N 3.26Å; K63-N65 PolarHBondContact O-N 3.07Å; K63-K192 WeakPolarHBondContact O-CE 3.48Å; K63-N194 WeakPolarHBondContact CE-O 3.1Å; K63-N194 WeakPolarHBondContact CE-OD1 3.32Å; K63-N194 PolarHBondContact NZ-O 3.05Å; K63-N194 PolarHBondContact NZ-OD1 3.08Å; K63-N196 WeakPolarHBondContact CD-OD1 3.35Å; K63-V233 HydrophobicContact CB-CG1 4.14Å; K63-H234 PolarHBondContact N-O 3.49Å
64	S	93.4	Very high	97.5	Very high	47 Å²	47	44.9 Å²	44.9	33%	0.329	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-26.5	174.6	49.2	0	0	0	0	113.7	R62 K192	R62-S64 VanDerWaalsContact CD-OG 3.25Å; R62-S64 WeakPolarHBondContact CD-OG 3.3Å; R62-S64 WeakPolarHBondContact CG-OG 3.34Å; R62-S64 PolarHBondContact NE-OG 3.38Å; R62-S64 PolarHBondContact O-N 2.89Å; S64-K192 VanDerWaalsContact O-CE 3.25Å; S64-K192 WeakPolarHBondContact O-CE 3.16Å; S64-K192 PolarHBondContact O-NZ 2.92Å; S64-K192 VanDerWaalsContact O-NZ 3.11Å
65	N	97.1	Very high	97.4	Very high	82 Å²	82	41.1 Å²	41.1	44%	0.439	21%	0.207	S	C	.	.	S	Bend	trans	-100	155.1	-166.4	-57.1	16.9	0	0	0	111.5	L61 R62 K63	L61-N65 HydrophobicContact CD1-CB 4.37Å; R62-N65 WeakPolarHBondContact O-CB 3.4Å; R62-N65 PolarHBondContact O-N 2.93Å; K63-N65 VanDerWaalsContact C-N 3.26Å; K63-N65 PolarHBondContact O-N 3.07Å
66	F	98.1	Very high	97.1	Very high	59 Å²	59	42.7 Å²	42.7	26%	0.259	21%	0.211	S	C	.	.			trans	-73.1	156.7	162.5	-68.3	-90.6	0	0	0	111	H156 M159 T175 L191 K192	F66-H156 HydrophobicContact CE1-CB 3.96Å; F66-H156 HydrophobicContact CZ-CB 3.8Å; F66-H156 AromaticContact CZ-ND1 3.75Å; F66-M159 HydrophobicContact CE1-CE 3.65Å; F66-M159 HydrophobicContact CE2-CE 4.41Å; F66-M159 HydrophobicContact CZ-CE 3.41Å; F66-M159 VanDerWaalsContact CZ-CE 3.41Å; F66-T175 HydrophobicContact CB-CG2 4.11Å; F66-T175 HydrophobicContact CD1-CG2 4.28Å; F66-T175 HydrophobicContact CD2-CG2 4.15Å; F66-T175 HydrophobicContact CG-CG2 3.92Å; F66-L191 CarbonylContact C-O 3.59Å; F66-L191 VanDerWaalsContact CA-O 3.29Å; F66-L191 WeakPolarHBondContact CA-O 3.41Å; F66-K192 HydrophobicContact CD1-CB 3.93Å; F66-K192 HydrophobicContact CE1-CB 4.03Å; F66-K192 HydrophobicContact CG-CB 4.49Å
67	F	98.6	Very high	96.7	Very high	4 Å²	4	45.5 Å²	45.5	2%	0.018	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	161	165.9	72.2	-77.1	0	0	0	109.5	P57 P58 L61 F69 L153 L191 C193 V212 M231	P57-F67 HydrophobicContact CB-CD2 3.98Å; P57-F67 HydrophobicContact CB-CE2 4.25Å; P58-F67 HydrophobicContact CG-CB 3.76Å; L61-F67 HydrophobicContact CD1-CB 3.98Å; L61-F67 HydrophobicContact CD2-CB 3.94Å; L61-F67 HydrophobicContact CD2-CD1 3.5Å; L61-F67 HydrophobicContact CD2-CE1 4.22Å; L61-F67 HydrophobicContact CD2-CG 3.88Å; F67-F69 HydrophobicContact CD2-CD1 4.31Å; F67-F69 AromaticContact CE2-CD1 3.92Å; F67-F69 HydrophobicContact CE2-CD1 3.92Å; F67-F69 HydrophobicContact CE2-CE1 4.04Å; F67-L153 HydrophobicContact CE1-CD2 4.12Å; F67-L153 HydrophobicContact CZ-CD2 3.98Å; F67-L191 HydrophobicContact CD1-CB 4.26Å; F67-L191 WeakPolarHBondContact CD1-O 3.41Å; F67-L191 HydrophobicContact CE1-CB 3.61Å; F67-L191 HydrophobicContact CE2-CB 4.46Å; F67-L191 HydrophobicContact CZ-CB 3.73Å; F67-L191 HydrophobicContact CZ-CD1 4.4Å; F67-L191 PolarHBondContact N-O 2.97Å; F67-L191 PolarHBondContact O-N 3.33Å; F67-C193 HydrophobicContact CE1-CB 4.12Å; F67-V212 HydrophobicContact CE2-CG2 4.08Å; F67-M231 HydrophobicContact CD2-SD 4.26Å; F67-M231 HydrophobicContact CE1-CE 4.49Å; F67-M231 HydrophobicContact CE2-CE 4.14Å; F67-M231 HydrophobicContact CE2-SD 4.39Å; F67-M231 HydrophobicContact CG-SD 4.41Å; F67-M231 HydrophobicContact CZ-CE 4.09Å
68	H	98.5	Very high	96.5	Very high	82 Å²	82	47 Å²	47	38%	0.38	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	156.1	173.5	61.5	-98.7	0	0	0	110	F189 F190	H68-F189 WeakPolarHBondContact CA-O 3.29Å; H68-F189 WeakPolarHBondContact CB-O 3.31Å; H68-F190 HydrophobicContact CB-CD1 4.03Å; H68-F190 HydrophobicContact CB-CE1 4.3Å
69	F	98.7	Very high	96.4	Very high	1 Å²	1	49.2 Å²	49.2	0%	0.004	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	162.2	168.1	54.3	-96.1	0	0	0	108.1	F53 K55 P57 F67 L71 V127 K188 F189 L191 V212 L214	F53-F69 HydrophobicContact CD1-CB 4.13Å; F53-F69 HydrophobicContact CD1-CD2 4.22Å; F53-F69 HydrophobicContact CD1-CG 4.37Å; F53-F69 HydrophobicContact CE1-CB 4.16Å; F53-F69 AromaticContact CE1-CD2 3.75Å; F53-F69 HydrophobicContact CE1-CD2 3.75Å; F53-F69 HydrophobicContact CE1-CE2 4.28Å; F53-F69 AromaticContact CE1-CG 3.95Å; F53-F69 HydrophobicContact CE1-CG 3.95Å; K55-F69 CarbonylContact O-C 3.49Å; K55-F69 WeakPolarHBondContact O-CA 3.22Å; K55-F69 WeakPolarHBondContact O-CB 3.21Å; P57-F69 HydrophobicContact CB-CB 4.45Å; F67-F69 HydrophobicContact CD2-CD1 4.31Å; F67-F69 AromaticContact CE2-CD1 3.92Å; F67-F69 HydrophobicContact CE2-CD1 3.92Å; F67-F69 HydrophobicContact CE2-CE1 4.04Å; F69-L71 HydrophobicContact CD2-CD2 3.71Å; F69-L71 HydrophobicContact CD2-CG 3.93Å; F69-L71 HydrophobicContact CE2-CD1 4.05Å; F69-L71 HydrophobicContact CE2-CD2 4.01Å; F69-L71 HydrophobicContact CE2-CG 3.97Å; F69-V127 HydrophobicContact CE1-CG1 4.25Å; F69-V127 HydrophobicContact CZ-CG1 3.79Å; F69-V127 HydrophobicContact CZ-CG2 4.36Å; F69-K188 WeakPolarHBondContact O-CA 3.44Å; F69-F189 HydrophobicContact CD1-CB 4.48Å; F69-F189 HydrophobicContact CD2-CB 4.23Å; F69-F189 AromaticContact CD2-CD2 3.99Å; F69-F189 HydrophobicContact CD2-CD2 3.99Å; F69-F189 HydrophobicContact CD2-CG 4.37Å; F69-F189 HydrophobicContact CE1-CB 3.97Å; F69-F189 HydrophobicContact CE2-CB 3.7Å; F69-F189 HydrophobicContact CE2-CD1 4.41Å; F69-F189 AromaticContact CE2-CD2 3.36Å; F69-F189 HydrophobicContact CE2-CD2 3.36Å; F69-F189 HydrophobicContact CE2-CE2 4.12Å; F69-F189 AromaticContact CE2-CG 3.56Å; F69-F189 HydrophobicContact CE2-CG 3.56Å; F69-F189 HydrophobicContact CZ-CB 3.54Å; F69-F189 HydrophobicContact CZ-CD1 4.26Å; F69-F189 AromaticContact CZ-CD2 3.99Å; F69-F189 HydrophobicContact CZ-CD2 3.99Å; F69-F189 AromaticContact CZ-CG 3.66Å; F69-F189 HydrophobicContact CZ-CG 3.66Å; F69-F189 PolarHBondContact O-N 3.48Å; F69-F189 VanDerWaalsContact O-N 3.12Å; F69-L191 HydrophobicContact CE1-CD1 4.19Å; F69-V212 HydrophobicContact CD1-CG2 4.45Å; F69-V212 HydrophobicContact CE1-CG1 3.89Å; F69-V212 HydrophobicContact CE1-CG2 4.34Å; F69-V212 HydrophobicContact CZ-CG1 3.98Å; F69-L214 HydrophobicContact CE2-CD2 4.37Å
70	V	98.6	Very high	96.3	Very high	19 Å²	19	48.9 Å²	48.9	12%	0.115	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	134	177.6	-176.3	0	0	0	0	108.9	F53 E54 K55 F186 L187 K188	F53-V70 CarbonylContact C-O 3.56Å; E54-V70 HydrophobicContact CB-CB 4.4Å; E54-V70 HydrophobicContact CB-CG1 4.23Å; E54-V70 PolarHBondContact N-O 2.86Å; E54-V70 VanDerWaalsContact N-O 3.07Å; K55-V70 HydrophobicContact CB-CB 3.73Å; K55-V70 HydrophobicContact CB-CG2 3.83Å; K55-V70 HydrophobicContact CD-CG2 4.4Å; K55-V70 PolarHBondContact N-O 2.91Å; K55-V70 VanDerWaalsContact N-O 3.07Å; K55-V70 PolarHBondContact O-N 3.46Å; V70-F186 HydrophobicContact CG1-CB 3.92Å; V70-L187 CarbonylContact C-O 3.06Å; V70-L187 VanDerWaalsContact CA-O 3.32Å; V70-L187 WeakPolarHBondContact CA-O 3.26Å; V70-K188 HydrophobicContact CG2-CB 4.07Å; V70-K188 HydrophobicContact CG2-CD 4.41Å; V70-K188 HydrophobicContact CG2-CG 3.98Å
71	L	98.2	Very high	96.4	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	145.2	-179.6	-53.4	-176.1	0	0	0	112	H52 F53 F69 F186 L187 F189 L214	H52-L71 CarbonylContact O-C 3.56Å; H52-L71 VanDerWaalsContact O-CA 3.23Å; H52-L71 WeakPolarHBondContact O-CA 3.38Å; F53-L71 HydrophobicContact CD1-CD2 3.57Å; F53-L71 HydrophobicContact CD2-CD2 4.44Å; F53-L71 HydrophobicContact CE1-CD2 3.63Å; F53-L71 HydrophobicContact CE2-CD2 4.48Å; F53-L71 HydrophobicContact CG-CD2 4Å; F53-L71 HydrophobicContact CZ-CD2 4.1Å; F69-L71 HydrophobicContact CD2-CD2 3.71Å; F69-L71 HydrophobicContact CD2-CG 3.93Å; F69-L71 HydrophobicContact CE2-CD1 4.05Å; F69-L71 HydrophobicContact CE2-CD2 4.01Å; F69-L71 HydrophobicContact CE2-CG 3.97Å; L71-F186 CarbonylContact O-C 3.55Å; L71-F186 WeakPolarHBondContact O-CA 3.49Å; L71-L187 PolarHBondContact N-O 2.96Å; L71-L187 PolarHBondContact O-N 3.42Å; L71-F189 HydrophobicContact CD1-CD2 4.21Å; L71-F189 HydrophobicContact CD1-CE2 3.6Å; L71-F189 HydrophobicContact CD1-CZ 4.26Å; L71-F189 HydrophobicContact CG-CD2 4.32Å; L71-F189 HydrophobicContact CG-CE2 4.05Å; L71-L214 HydrophobicContact CD1-CD1 3.43Å; L71-L214 VanDerWaalsContact CD1-CD1 3.43Å; L71-L214 HydrophobicContact CD1-CD2 3.96Å; L71-L214 HydrophobicContact CD1-CG 4.33Å; L71-L214 HydrophobicContact CD2-CD1 3.5Å; L71-L214 VanDerWaalsContact CD2-CD1 3.5Å; L71-L214 HydrophobicContact CG-CD1 4.11Å
72	A	98.1	Very high	96.4	Very high	4 Å²	4	46.8 Å²	46.8	3%	0.033	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	147.2	153.1	0	0	0	0	0	109.5	A51 H52 E54 Y74 F186	A51-A72 CarbonylContact C-O 3.52Å; A51-A72 WeakPolarHBondContact CA-O 3.34Å; H52-A72 PolarHBondContact N-O 3.27Å; H52-A72 PolarHBondContact O-N 3.1Å; E54-A72 HydrophobicContact CG-CB 3.84Å; E54-A72 WeakPolarHBondContact OE1-CB 3.45Å; A72-Y74 HydrophobicContact CB-CE2 3.72Å; A72-F186 HydrophobicContact CB-CD1 3.98Å; A72-F186 HydrophobicContact CB-CE1 4.05Å
73	L	97.9	Very high	96.4	Very high	2 Å²	2	42.4 Å²	42.4	1%	0.01	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	139.2	180	-63.1	-179	0	0	0	111	L48 A51 V81 I83 L111 L113 L187	L48-L73 HydrophobicContact CD1-CD1 4.3Å; L48-L73 HydrophobicContact CD1-CD2 4.46Å; L48-L73 HydrophobicContact CD2-CB 4.01Å; L48-L73 HydrophobicContact CD2-CD1 4.45Å; A51-L73 HydrophobicContact CB-CD2 3.93Å; L73-V81 HydrophobicContact CB-CB 4.34Å; L73-V81 PolarHBondContact O-N 2.87Å; L73-I83 HydrophobicContact CD1-CD1 4.39Å; L73-I83 HydrophobicContact CD1-CG1 4.13Å; L73-L111 HydrophobicContact CD1-CD1 3.98Å; L73-L113 HydrophobicContact CD1-CD2 3.97Å; L73-L187 HydrophobicContact CD1-CD1 4.17Å
74	Y	97	Very high	96.4	Very high	47 Å²	47	43.2 Å²	43.2	18%	0.184	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	140.4	-176.9	-60.4	-88.7	0	0	0	112.4	S49 R50 H52 A72 G78 Q79 P80	S49-Y74 PolarHBondContact N-O 2.88Å; R50-Y74 PolarHBondContact N-O 2.84Å; R50-Y74 PolarHBondContact O-N 3.33Å; H52-Y74 HydrophobicContact CB-CE2 3.8Å; A72-Y74 HydrophobicContact CB-CE2 3.72Å; Y74-G78 WeakPolarHBondContact CD1-O 3.5Å; Y74-Q79 VanDerWaalsContact CA-O 3.3Å; Y74-Q79 WeakPolarHBondContact CA-O 3.46Å; Y74-P80 HydrophobicContact CE1-CB 4.45Å
75	D	95.3	Very high	96.6	Very high	4 Å²	4	46.1 Å²	46.1	2%	0.021	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	-177.5	175.4	69	21.6	0	0	0	113.1	A47 S49 Q77 G78 Q79 V81 Y115	A47-D75 WeakPolarHBondContact O-CA 3.44Å; S49-D75 WeakPolarHBondContact CB-O 3.47Å; D75-Q77 PolarHBondContact O-N 3.08Å; D75-Q77 WeakPolarHBondContact OD1-CA 3.37Å; D75-Q77 WeakPolarHBondContact OD1-CB 3.45Å; D75-Q77 PolarHBondContact OD1-N 3.23Å; D75-Q77 PolarHBondContact OD1-OE1 2.93Å; D75-G78 PolarHBondContact O-N 3.41Å; D75-G78 PolarHBondContact OD1-N 3.06Å; D75-Q79 PolarHBondContact N-O 3.43Å; D75-Q79 PolarHBondContact OD1-N 3.34Å; D75-Q79 WeakPolarHBondContact OD2-CB 3.38Å; D75-V81 HydrophobicContact CB-CG2 3.85Å; D75-Y115 HydrophobicContact CB-CD1 3.7Å; D75-Y115 HydrophobicContact CB-CE1 3.69Å
76	R	91.5	Very high	96.6	Very high	144 Å²	144	43.7 Å²	43.7	54%	0.543	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-19.9	178	-73	-176.6	174.6	172.6	1.1	114.2	A47 G78	A47-R76 PolarHBondContact O-N 2.98Å; R76-G78 VanDerWaalsContact C-N 3.32Å
77	Q	91.8	Very high	96.6	Very high	124 Å²	124	42.9 Å²	42.9	58%	0.579	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90	1	171.8	-63.9	82.1	9.2	0	0	112.3	D75 Q79	D75-Q77 PolarHBondContact O-N 3.08Å; D75-Q77 WeakPolarHBondContact OD1-CA 3.37Å; D75-Q77 WeakPolarHBondContact OD1-CB 3.45Å; D75-Q77 PolarHBondContact OD1-N 3.23Å; D75-Q77 PolarHBondContact OD1-OE1 2.93Å; Q77-Q79 VanDerWaalsContact C-N 3.27Å; Q77-Q79 HydrophobicContact CB-CG 4.24Å; Q77-Q79 PolarHBondContact O-N 3.27Å
78	G	92.9	Very high	96.6	Very high	39 Å²	39	44.9 Å²	44.9	40%	0.402	22%	0.224	S	C	.	.	S	Bend	trans	74.2	13.4	-177.6	0	0	0	0	0	114.2	Y74 D75 R76	Y74-G78 WeakPolarHBondContact CD1-O 3.5Å; D75-G78 PolarHBondContact O-N 3.41Å; D75-G78 PolarHBondContact OD1-N 3.06Å; R76-G78 VanDerWaalsContact C-N 3.32Å
79	Q	95.3	Very high	96.5	Very high	96 Å²	96	44.1 Å²	44.1	45%	0.449	22%	0.224	S	C	.	.	P	Polyproline II helix	trans	-79	148.7	175.3	-55.9	-57.7	-52.2	0	0	110.5	Y74 D75 Q77	Y74-Q79 VanDerWaalsContact CA-O 3.3Å; Y74-Q79 WeakPolarHBondContact CA-O 3.46Å; D75-Q79 PolarHBondContact N-O 3.43Å; D75-Q79 PolarHBondContact OD1-N 3.34Å; D75-Q79 WeakPolarHBondContact OD2-CB 3.38Å; Q77-Q79 VanDerWaalsContact C-N 3.27Å; Q77-Q79 HydrophobicContact CB-CG 4.24Å; Q77-Q79 PolarHBondContact O-N 3.27Å
80	P	95.9	Very high	96.3	Very high	61 Å²	61	45.4 Å²	45.4	40%	0.396	23%	0.232	S	C	.	.	B	Isolated β-bridge	trans	-68.3	135.2	175.1	29.6	-34.9	0	0	0	110.5	Y74 F185	Y74-P80 HydrophobicContact CE1-CB 4.45Å; P80-F185 HydrophobicContact CB-CD1 3.91Å; P80-F185 HydrophobicContact CB-CE1 4.24Å; P80-F185 HydrophobicContact CG-CE1 4.45Å
81	V	97.4	Very high	96.2	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-100.3	128	179.1	-177	0	0	0	0	109.4	L48 L73 D75 L113 Y115	L48-V81 HydrophobicContact CD2-CB 4.29Å; L48-V81 HydrophobicContact CD2-CG1 4.38Å; L48-V81 HydrophobicContact CD2-CG2 4.04Å; L73-V81 HydrophobicContact CB-CB 4.34Å; L73-V81 PolarHBondContact O-N 2.87Å; D75-V81 HydrophobicContact CB-CG2 3.85Å; V81-L113 HydrophobicContact CG1-CB 3.86Å; V81-L113 HydrophobicContact CG1-CD1 4.3Å; V81-L113 HydrophobicContact CG1-CD2 4.23Å; V81-L113 HydrophobicContact CG1-CG 4.36Å; V81-Y115 HydrophobicContact CG1-CD1 4.27Å; V81-Y115 HydrophobicContact CG1-CD2 4.34Å; V81-Y115 HydrophobicContact CG1-CE1 4.21Å; V81-Y115 HydrophobicContact CG1-CE2 4.26Å; V81-Y115 HydrophobicContact CG1-CG 4.33Å; V81-Y115 HydrophobicContact CG2-CD1 3.82Å; V81-Y115 HydrophobicContact CG2-CE1 3.77Å
82	E	97.4	Very high	96	Very high	27 Å²	27	45.3 Å²	45.3	13%	0.126	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	145.4	178.8	-160.4	-167.5	138.2	0	0	110.5	L113 L114 R184 F185	E82-L113 CarbonylContact O-C 3.57Å; E82-L113 WeakPolarHBondContact O-CA 3.49Å; E82-L114 HydrophobicContact CB-CB 4.22Å; E82-L114 PolarHBondContact N-O 2.88Å; E82-L114 PolarHBondContact O-N 3.08Å; E82-R184 VanDerWaalsContact CD-NE 3.25Å; E82-R184 HydrophobicContact CG-CB 3.67Å; E82-R184 WeakPolarHBondContact CG-O 3.15Å; E82-R184 IonicContact OE1-CZ 3.12Å; E82-R184 IonicContact OE1-NE 2.75Å; E82-R184 PolarHBondContact OE1-NE 2.77Å; E82-R184 IonicContact OE1-NH2 2.73Å; E82-R184 PolarHBondContact OE1-NH2 2.92Å; E82-R184 IonicContact OE2-CZ 3.3Å; E82-R184 VanDerWaalsContact OE2-CZ 3.3Å; E82-R184 IonicContact OE2-NE 3.48Å; E82-R184 PolarHBondContact OE2-NE 2.89Å; E82-R184 IonicContact OE2-NH2 2.8Å; E82-R184 PolarHBondContact OE2-NH2 3.27Å; E82-F185 HydrophobicContact CB-CD1 4.18Å; E82-F185 HydrophobicContact CB-CE1 3.73Å; E82-F185 HydrophobicContact CB-CZ 4.3Å; E82-F185 HydrophobicContact CG-CD1 4.46Å; E82-F185 HydrophobicContact CG-CE1 4.11Å; E82-F185 HydrophobicContact CG-CZ 4.29Å
83	I	97.5	Very high	95.6	Very high	3 Å²	3	47.2 Å²	47.2	2%	0.015	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	116.9	175.4	-46.7	90.6	0	0	0	109.9	L73 R85 T86 L113 I181 R184 L187	L73-I83 HydrophobicContact CD1-CD1 4.39Å; L73-I83 HydrophobicContact CD1-CG1 4.13Å; I83-R85 WeakPolarHBondContact CG2-O 3.49Å; I83-T86 HydrophobicContact CG2-CG2 3.88Å; I83-L113 HydrophobicContact CB-CD2 4.35Å; I83-L113 HydrophobicContact CG1-CD2 3.75Å; I83-L113 HydrophobicContact CG2-CD2 4.2Å; I83-I181 HydrophobicContact CB-CG1 4.38Å; I83-I181 HydrophobicContact CG2-CD1 4.2Å; I83-I181 HydrophobicContact CG2-CG1 4.23Å; I83-R184 PolarHBondContact N-O 3.43Å; I83-L187 HydrophobicContact CB-CD2 4.12Å; I83-L187 HydrophobicContact CD1-CD1 4.49Å; I83-L187 HydrophobicContact CD1-CD2 4.19Å; I83-L187 HydrophobicContact CD1-CG 3.91Å; I83-L187 HydrophobicContact CG1-CD1 4.09Å; I83-L187 HydrophobicContact CG1-CD2 4.05Å; I83-L187 HydrophobicContact CG1-CG 3.95Å; I83-L187 HydrophobicContact CG2-CD2 4.04Å
84	E	96.1	Very high	95	Very high	62 Å²	62	51 Å²	51	29%	0.29	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	-33.5	178.3	-65.5	-172.1	135.1	0	0	112.6	Q112 L114 R120	E84-Q112 HydrophobicContact CB-CG 4.25Å; E84-Q112 PolarHBondContact N-O 2.88Å; E84-Q112 PolarHBondContact OE2-NE2 3.46Å; E84-L114 HydrophobicContact CG-CB 4.17Å; E84-R120 VanDerWaalsContact CD-NE 3.25Å; E84-R120 IonicContact OE1-CZ 3.26Å; E84-R120 VanDerWaalsContact OE1-CZ 3.26Å; E84-R120 IonicContact OE1-NE 2.97Å; E84-R120 PolarHBondContact OE1-NE 2.92Å; E84-R120 IonicContact OE1-NH2 2.7Å; E84-R120 PolarHBondContact OE1-NH2 3.17Å; E84-R120 VanDerWaalsContact OE2-CD 3.3Å; E84-R120 WeakPolarHBondContact OE2-CD 3.2Å; E84-R120 IonicContact OE2-CZ 3.85Å; E84-R120 IonicContact OE2-NE 2.82Å; E84-R120 PolarHBondContact OE2-NE 3.46Å
85	R	96.6	Very high	94.1	Very high	108 Å²	108	56.9 Å²	56.9	41%	0.408	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	156.9	178.3	-53.8	-174.8	-172.4	150.7	7.9	112.3	I83 L111 Q112	I83-R85 WeakPolarHBondContact CG2-O 3.49Å; R85-L111 WeakPolarHBondContact O-CA 3.32Å; R85-Q112 HydrophobicContact CB-CB 3.8Å; R85-Q112 VanDerWaalsContact CD-OE1 3.3Å; R85-Q112 HydrophobicContact CG-CB 4.21Å; R85-Q112 PolarHBondContact N-O 2.9Å; R85-Q112 PolarHBondContact O-N 2.89Å
86	T	97.6	Very high	93.3	Very high	32 Å²	32	61.5 Å²	61.5	20%	0.196	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	139.4	179.6	50.1	0	0	0	0	109.1	I83 L111 P179 I181 L187	I83-T86 HydrophobicContact CG2-CG2 3.88Å; T86-L111 HydrophobicContact CG2-CD2 3.81Å; T86-P179 WeakPolarHBondContact CB-O 3.07Å; T86-P179 HydrophobicContact CG2-CB 4.21Å; T86-P179 PolarHBondContact OG1-O 2.82Å; T86-I181 HydrophobicContact CG2-CD1 4.09Å; T86-I181 HydrophobicContact CG2-CG1 3.76Å; T86-L187 HydrophobicContact CG2-CD1 4.42Å; T86-L187 HydrophobicContact CG2-CD2 3.56Å
87	A	97.9	Very high	92.8	Very high	41 Å²	41	55.6 Å²	55.6	34%	0.339	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	138.2	170	0	0	0	0	0	110.8	Y109 K110 D178	A87-Y109 CarbonylContact O-C 3.5Å; A87-Y109 VanDerWaalsContact O-CA 3.27Å; A87-Y109 WeakPolarHBondContact O-CA 3.33Å; A87-K110 PolarHBondContact N-O 2.87Å; A87-K110 PolarHBondContact O-N 3.17Å; A87-D178 WeakPolarHBondContact CA-OD1 3.26Å
88	F	97.9	Very high	91.7	Very high	46 Å²	46	55 Å²	55	20%	0.202	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	130.9	159.9	173.6	-102.4	0	0	0	109.4	D90 F91 T107 Y109 T155 D178	F88-D90 WeakPolarHBondContact CE2-O 3.47Å; F88-D90 WeakPolarHBondContact CZ-O 3.26Å; F88-F91 HydrophobicContact CE1-CE2 4.4Å; F88-F91 HydrophobicContact CE2-CE1 4.42Å; F88-F91 HydrophobicContact CE2-CZ 4.42Å; F88-F91 HydrophobicContact CZ-CD1 4.47Å; F88-F91 HydrophobicContact CZ-CD2 4.06Å; F88-F91 HydrophobicContact CZ-CE1 4.17Å; F88-F91 AromaticContact CZ-CE2 3.73Å; F88-F91 HydrophobicContact CZ-CE2 3.73Å; F88-F91 HydrophobicContact CZ-CG 4.4Å; F88-F91 AromaticContact CZ-CZ 3.77Å; F88-F91 HydrophobicContact CZ-CZ 3.77Å; F88-T107 HydrophobicContact CE2-CG2 4Å; F88-Y109 HydrophobicContact CB-CD1 4.1Å; F88-Y109 HydrophobicContact CB-CE1 3.93Å; F88-Y109 HydrophobicContact CD2-CD1 4.21Å; F88-Y109 AromaticContact CD2-CE1 3.71Å; F88-Y109 HydrophobicContact CD2-CE1 3.71Å; F88-Y109 HydrophobicContact CG-CE1 4.31Å; F88-T155 HydrophobicContact CD2-CG2 3.89Å; F88-T155 HydrophobicContact CE2-CG2 3.7Å; F88-T155 HydrophobicContact CG-CG2 4.41Å; F88-T155 HydrophobicContact CZ-CG2 4.07Å; F88-D178 PolarHBondContact N-OD1 2.82Å
89	V	96.6	Very high	90.3	Very high	66 Å²	66	56 Å²	56	40%	0.4	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	-61.2	179.8	-165.1	0	0	0	0	110	H108 K110	V89-H108 PolarHBondContact N-O 2.92Å; V89-K110 HydrophobicContact CG2-CB 3.79Å
90	D	95.3	Very high	88.9	Confident	29 Å²	29	60 Å²	60	16%	0.155	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.2	-173.8	-171.1	56	71.1	0	0	0	113.6	F88 K96 H108	F88-D90 WeakPolarHBondContact CE2-O 3.47Å; F88-D90 WeakPolarHBondContact CZ-O 3.26Å; D90-K96 IonicContact OD1-NZ 3.14Å; D90-K96 PolarHBondContact OD1-NZ 2.92Å; D90-K96 IonicContact OD2-NZ 2.67Å; D90-K96 PolarHBondContact OD2-NZ 3.17Å; D90-H108 PolarHBondContact N-O 2.86Å; D90-H108 PolarHBondContact O-N 2.8Å; D90-H108 WeakPolarHBondContact OD1-CB 3.22Å; D90-H108 IonicContact OD1-CG 3.67Å; D90-H108 IonicContact OD1-ND1 3.72Å; D90-H108 PolarHBondContact OD1-ND1 2.83Å; D90-H108 IonicContact OD2-CE1 3.78Å; D90-H108 IonicContact OD2-ND1 2.73Å; D90-H108 PolarHBondContact OD2-ND1 2.89Å; D90-H108 VanDerWaalsContact OD2-ND1 3.16Å
91	F	96.1	Very high	87.8	Confident	16 Å²	16	62.3 Å²	62.3	7%	0.07	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	149.9	173.6	-63.9	-80	0	0	0	111.3	F88 E93 G106 T107 T155 V158	F88-F91 HydrophobicContact CE1-CE2 4.4Å; F88-F91 HydrophobicContact CE2-CE1 4.42Å; F88-F91 HydrophobicContact CE2-CZ 4.42Å; F88-F91 HydrophobicContact CZ-CD1 4.47Å; F88-F91 HydrophobicContact CZ-CD2 4.06Å; F88-F91 HydrophobicContact CZ-CE1 4.17Å; F88-F91 AromaticContact CZ-CE2 3.73Å; F88-F91 HydrophobicContact CZ-CE2 3.73Å; F88-F91 HydrophobicContact CZ-CG 4.4Å; F88-F91 AromaticContact CZ-CZ 3.77Å; F88-F91 HydrophobicContact CZ-CZ 3.77Å; F91-E93 HydrophobicContact CB-CG 4.34Å; F91-E93 PolarHBondContact O-N 3.06Å; F91-G106 WeakPolarHBondContact CA-O 3.32Å; F91-T107 HydrophobicContact CD1-CG2 3.63Å; F91-T107 HydrophobicContact CE1-CG2 3.56Å; F91-T155 HydrophobicContact CE1-CG2 4.39Å; F91-T155 HydrophobicContact CZ-CG2 4.28Å; F91-V158 HydrophobicContact CE2-CB 4.2Å; F91-V158 HydrophobicContact CE2-CG1 4.12Å; F91-V158 HydrophobicContact CE2-CG2 4.22Å; F91-V158 HydrophobicContact CZ-CB 4.27Å; F91-V158 HydrophobicContact CZ-CG1 3.74Å
92	V	93.6	Very high	87.3	Confident	1 Å²	1	68.7 Å²	68.7	1%	0.006	36%	0.357	C	S	.	.	S	Bend	trans	-80.1	99.1	171.6	176.9	0	0	0	0	108.7	E97 N105 G106 Y126 V218	V92-E97 HydrophobicContact CG1-CG 4.03Å; V92-N105 PolarHBondContact O-N 2.9Å; V92-G106 PolarHBondContact N-O 2.86Å; V92-Y126 HydrophobicContact CG2-CD1 3.85Å; V92-Y126 HydrophobicContact CG2-CE1 4.34Å; V92-V218 HydrophobicContact CG1-CG1 3.64Å
93	E	89.6	Confident	87	Confident	43 Å²	43	67.6 Å²	67.6	20%	0.201	35%	0.352	C	S	.	.			trans	-158.8	157.3	-179.9	60.2	-173.7	-174.9	0	0	111.5	F91 D95 K96 R151	F91-E93 HydrophobicContact CB-CG 4.34Å; F91-E93 PolarHBondContact O-N 3.06Å; E93-D95 PolarHBondContact O-N 2.91Å; E93-K96 PolarHBondContact O-N 2.72Å; E93-R151 IonicContact OE1-CZ 2.73Å; E93-R151 IonicContact OE1-NE 3.24Å; E93-R151 PolarHBondContact OE1-NE 3.41Å; E93-R151 IonicContact OE1-NH2 3.17Å; E93-R151 PolarHBondContact OE1-NH2 2.87Å; E93-R151 IonicContact OE2-CZ 3.41Å; E93-R151 IonicContact OE2-NE 3.7Å; E93-R151 PolarHBondContact OE2-NE 3.23Å; E93-R151 IonicContact OE2-NH2 2.65Å; E93-R151 PolarHBondContact OE2-NH2 3.03Å
94	N	85.1	Confident	86.9	Confident	83 Å²	83	68.6 Å²	68.6	44%	0.444	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	55.1	-130	178.7	-48.2	-58.4	0	0	0	111.4	K96 E97 K102	N94-K96 PolarHBondContact O-N 2.79Å; N94-E97 PolarHBondContact N-OE2 2.81Å; N94-E97 PolarHBondContact O-N 2.92Å; N94-K102 PolarHBondContact OD1-NZ 2.91Å
95	D	78.7	Confident	86.9	Confident	169 Å²	169	65.7 Å²	65.7	90%	0.904	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-62.6	-5.7	-172.7	-42.1	-41.3	0	0	0	114.9	E93	E93-D95 PolarHBondContact O-N 2.91Å
96	K	79.3	Confident	86.9	Confident	101 Å²	101	60.6 Å²	60.6	44%	0.439	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-93.3	-10.1	174.2	-66.7	177.9	-179	172.7	0	113.5	D90 E93 N94 V218	D90-K96 IonicContact OD1-NZ 3.14Å; D90-K96 PolarHBondContact OD1-NZ 2.92Å; D90-K96 IonicContact OD2-NZ 2.67Å; D90-K96 PolarHBondContact OD2-NZ 3.17Å; E93-K96 PolarHBondContact O-N 2.72Å; N94-K96 PolarHBondContact O-N 2.79Å; K96-V218 WeakPolarHBondContact O-CG1 3.28Å
97	E	81	Confident	86.9	Confident	20 Å²	20	59.1 Å²	59.1	9%	0.093	32%	0.316	C	S	.	.	S	Bend	trans	-78.8	139.3	172.8	-58.9	-169.5	99.6	0	0	109.8	V92 N94 T103 N104	V92-E97 HydrophobicContact CG1-CG 4.03Å; N94-E97 PolarHBondContact N-OE2 2.81Å; N94-E97 PolarHBondContact O-N 2.92Å; E97-T103 VanDerWaalsContact OE1-CA 3.27Å; E97-T103 WeakPolarHBondContact OE1-CA 3.49Å; E97-T103 VanDerWaalsContact OE1-CB 3.28Å; E97-T103 WeakPolarHBondContact OE1-CB 3.49Å; E97-T103 PolarHBondContact OE1-N 3.5Å; E97-T103 PolarHBondContact OE1-OG1 3.24Å; E97-T103 PolarHBondContact OE2-N 3.16Å; E97-N104 PolarHBondContact OE1-N 2.77Å
98	Q	68	Low	86.9	Confident	111 Å²	111	58 Å²	58	52%	0.519	30%	0.304	S	S	.	.	S	Bend	trans	-88.9	122.2	179.6	-70.7	-170.2	-8.3	0	0	110.2	V218 N219	Q98-V218 HydrophobicContact CG-CB 4.47Å; Q98-N219 PolarHBondContact OE1-ND2 3.28Å; Q98-N219 VanDerWaalsContact OE1-ND2 3.13Å
99	G	64	Low	86.9	Confident	62 Å²	62	55.8 Å²	55.8	64%	0.639	29%	0.294	S	S	*	.	S	Bend	trans	79.2	-178.4	-172	0	0	0	0	0	112.8	E101	G99-E101 PolarHBondContact O-N 2.73Å; G99-E101 VanDerWaalsContact O-N 3.12Å
100	N	64.7	Low	86.9	Confident	180 Å²	180	55.7 Å²	55.7	96%	0.963	29%	0.289	S	S	*	.	S	Bend	trans	-78.1	15.4	-178.5	-73.2	-17.9	0	0	0	113.9	K102	N100-K102 PolarHBondContact O-N 2.89Å
101	E	74	Confident	87.1	Confident	108 Å²	108	54.4 Å²	54.4	51%	0.505	28%	0.281	S	S	.	.			trans	-83.4	103.6	-179.6	-70.6	-142.3	137.5	0	0	112	G99 T103	G99-E101 PolarHBondContact O-N 2.73Å; G99-E101 VanDerWaalsContact O-N 3.12Å; E101-T103 HydrophobicContact CB-CG2 4.16Å; E101-T103 PolarHBondContact O-N 2.96Å; E101-T103 VanDerWaalsContact O-N 3.14Å
102	K	86.7	Confident	87.1	Confident	134 Å²	134	54.6 Å²	54.6	58%	0.583	28%	0.283	S	S	*	.			trans	-81.6	88.8	173.7	-169.7	160.6	-166	133.4	0	111.3	N94 N100 N104	N94-K102 PolarHBondContact OD1-NZ 2.91Å; N100-K102 PolarHBondContact O-N 2.89Å; K102-N104 WeakPolarHBondContact CE-OD1 3.43Å
103	T	92	Very high	87.3	Confident	4 Å²	4	54.5 Å²	54.5	3%	0.025	28%	0.282	C	S	.	.			trans	-93	-29.5	-178.6	75.6	0	0	0	0	112.9	E97 E101 N105 R128 P137 Y140	E97-T103 VanDerWaalsContact OE1-CA 3.27Å; E97-T103 WeakPolarHBondContact OE1-CA 3.49Å; E97-T103 VanDerWaalsContact OE1-CB 3.28Å; E97-T103 WeakPolarHBondContact OE1-CB 3.49Å; E97-T103 PolarHBondContact OE1-N 3.5Å; E97-T103 PolarHBondContact OE1-OG1 3.24Å; E97-T103 PolarHBondContact OE2-N 3.16Å; E101-T103 HydrophobicContact CB-CG2 4.16Å; E101-T103 PolarHBondContact O-N 2.96Å; E101-T103 VanDerWaalsContact O-N 3.14Å; T103-N105 PolarHBondContact O-N 3.34Å; T103-N105 WeakPolarHBondContact OG1-CB 3.35Å; T103-N105 PolarHBondContact OG1-N 2.91Å; T103-R128 PolarHBondContact OG1-NH2 2.65Å; T103-P137 HydrophobicContact CG2-CB 4.16Å; T103-P137 HydrophobicContact CG2-CG 4.03Å; T103-Y140 PolarHBondContact O-N 3.47Å
104	N	94.9	Very high	87.6	Confident	25 Å²	25	53.7 Å²	53.7	13%	0.134	28%	0.279	C	S	.	.			trans	47.4	44.6	-169.3	-66.6	6.4	0	0	0	111.9	E97 K102 C150 R151 V152	E97-N104 PolarHBondContact OE1-N 2.77Å; K102-N104 WeakPolarHBondContact CE-OD1 3.43Å; N104-C150 VanDerWaalsContact CB-O 3.31Å; N104-C150 WeakPolarHBondContact CB-O 3.4Å; N104-C150 PolarHBondContact ND2-O 3.47Å; N104-R151 CarbonylContact O-C 3.51Å; N104-R151 VanDerWaalsContact O-CA 3.31Å; N104-R151 WeakPolarHBondContact O-CA 3.45Å; N104-V152 PolarHBondContact O-N 3.27Å
105	N	96.1	Very high	88.1	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.259	C	S	.	.			trans	-135.1	93.9	-169.6	174	17.7	0	0	0	112	V92 T103 R128 L129 I138 V152	V92-N105 PolarHBondContact O-N 2.9Å; T103-N105 PolarHBondContact O-N 3.34Å; T103-N105 WeakPolarHBondContact OG1-CB 3.35Å; T103-N105 PolarHBondContact OG1-N 2.91Å; N105-R128 PolarHBondContact O-NE 2.87Å; N105-L129 PolarHBondContact ND2-O 3.07Å; N105-L129 PolarHBondContact OD1-N 3.38Å; N105-I138 WeakPolarHBondContact CB-O 3.34Å; N105-I138 VanDerWaalsContact CG-O 3.31Å; N105-I138 PolarHBondContact ND2-N 2.88Å; N105-I138 VanDerWaalsContact ND2-N 3.18Å; N105-I138 PolarHBondContact ND2-O 3.47Å; N105-V152 HydrophobicContact CB-CB 3.74Å; N105-V152 HydrophobicContact CB-CG1 4.41Å; N105-V152 HydrophobicContact CB-CG2 3.7Å
106	G	95.9	Very high	88.7	Confident	2 Å²	2	46 Å²	46	2%	0.021	24%	0.244	C	C	.	.			trans	165.3	161.8	161.9	0	0	0	0	0	112	F91 V92 V127	F91-G106 WeakPolarHBondContact CA-O 3.32Å; V92-G106 PolarHBondContact N-O 2.86Å; G106-V127 CarbonylContact C-O 3.57Å; G106-V127 WeakPolarHBondContact CA-O 3.39Å
107	T	97.4	Very high	89.2	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	131.5	170.8	42	0	0	0	0	108.9	F88 F91 Y109 V127 L153 T155 L191	F88-T107 HydrophobicContact CE2-CG2 4Å; F91-T107 HydrophobicContact CD1-CG2 3.63Å; F91-T107 HydrophobicContact CE1-CG2 3.56Å; T107-Y109 WeakPolarHBondContact OG1-CE2 3.43Å; T107-V127 PolarHBondContact N-O 3.37Å; T107-V127 PolarHBondContact O-N 3Å; T107-L153 HydrophobicContact CG2-CB 4.28Å; T107-T155 HydrophobicContact CG2-CG2 4.28Å; T107-L191 HydrophobicContact CG2-CD2 3.83Å
108	H	97.6	Very high	89.7	Confident	17 Å²	17	46.8 Å²	46.8	8%	0.079	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	130.2	-175.8	174	-147.2	0	0	0	109.9	V89 D90 D124 Y126	V89-H108 PolarHBondContact N-O 2.92Å; D90-H108 PolarHBondContact N-O 2.86Å; D90-H108 PolarHBondContact O-N 2.8Å; D90-H108 WeakPolarHBondContact OD1-CB 3.22Å; D90-H108 IonicContact OD1-CG 3.67Å; D90-H108 IonicContact OD1-ND1 3.72Å; D90-H108 PolarHBondContact OD1-ND1 2.83Å; D90-H108 IonicContact OD2-CE1 3.78Å; D90-H108 IonicContact OD2-ND1 2.73Å; D90-H108 PolarHBondContact OD2-ND1 2.89Å; D90-H108 VanDerWaalsContact OD2-ND1 3.16Å; H108-D124 IonicContact NE2-OD1 3.33Å; H108-Y126 HydrophobicContact CB-CD1 4.01Å; H108-Y126 HydrophobicContact CB-CE1 3.8Å; H108-Y126 AromaticContact CD2-CD1 3.98Å; H108-Y126 AromaticContact CD2-CE1 3.37Å; H108-Y126 WeakPolarHBondContact CD2-CE1 3.31Å; H108-Y126 AromaticContact CD2-CZ 3.43Å; H108-Y126 VanDerWaalsContact CD2-CZ 3.43Å; H108-Y126 AromaticContact CG-CE1 3.55Å; H108-Y126 AromaticContact NE2-CZ 3.7Å; H108-Y126 PolarHBondContact NE2-OH 3.44Å
109	Y	98.1	Very high	90.9	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	147.7	-177	-62.9	-80.9	0	0	0	110.5	A87 F88 T107 D124 L125 V127 S177 P179 F189	A87-Y109 CarbonylContact O-C 3.5Å; A87-Y109 VanDerWaalsContact O-CA 3.27Å; A87-Y109 WeakPolarHBondContact O-CA 3.33Å; F88-Y109 HydrophobicContact CB-CD1 4.1Å; F88-Y109 HydrophobicContact CB-CE1 3.93Å; F88-Y109 HydrophobicContact CD2-CD1 4.21Å; F88-Y109 AromaticContact CD2-CE1 3.71Å; F88-Y109 HydrophobicContact CD2-CE1 3.71Å; F88-Y109 HydrophobicContact CG-CE1 4.31Å; T107-Y109 WeakPolarHBondContact OG1-CE2 3.43Å; Y109-D124 CarbonylContact O-C 3.54Å; Y109-D124 WeakPolarHBondContact O-CA 3.18Å; Y109-L125 PolarHBondContact N-O 3.32Å; Y109-L125 PolarHBondContact O-N 2.87Å; Y109-V127 HydrophobicContact CD2-CG2 3.91Å; Y109-V127 HydrophobicContact CE2-CB 4.33Å; Y109-V127 HydrophobicContact CE2-CG2 3.65Å; Y109-S177 WeakPolarHBondContact CE1-O 3.48Å; Y109-P179 VanDerWaalsContact CD1-CD 3.48Å; Y109-P179 HydrophobicContact CD1-CG 3.49Å; Y109-P179 VanDerWaalsContact CD1-CG 3.49Å; Y109-P179 HydrophobicContact CE1-CG 3.62Å; Y109-P179 HydrophobicContact CG-CG 4.1Å; Y109-F189 HydrophobicContact CD1-CE1 4.43Å; Y109-F189 HydrophobicContact CD2-CD1 4.28Å; Y109-F189 AromaticContact CD2-CE1 3.73Å; Y109-F189 HydrophobicContact CD2-CE1 3.73Å; Y109-F189 HydrophobicContact CE1-CD1 4.44Å; Y109-F189 HydrophobicContact CE1-CE1 4.43Å; Y109-F189 AromaticContact CE2-CD1 3.76Å; Y109-F189 HydrophobicContact CE2-CD1 3.76Å; Y109-F189 AromaticContact CE2-CE1 3.7Å; Y109-F189 HydrophobicContact CE2-CE1 3.7Å; Y109-F189 HydrophobicContact CG-CE1 4.08Å; Y109-F189 AromaticContact CZ-CD1 3.85Å
110	K	97.8	Very high	92.4	Very high	65 Å²	65	44.6 Å²	44.6	28%	0.283	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	130.7	172	-152.9	164.5	-162.6	-149.7	0	110.3	A87 V89 E122 D124	A87-K110 PolarHBondContact N-O 2.87Å; A87-K110 PolarHBondContact O-N 3.17Å; V89-K110 HydrophobicContact CG2-CB 3.79Å; K110-E122 HydrophobicContact CD-CG 4.18Å; K110-E122 VanDerWaalsContact CD-OE1 3.26Å; K110-E122 WeakPolarHBondContact CD-OE1 3.34Å; K110-E122 VanDerWaalsContact CE-OE1 3.26Å; K110-E122 WeakPolarHBondContact CE-OE1 3.47Å; K110-E122 WeakPolarHBondContact CE-OE2 3.33Å; K110-E122 HydrophobicContact CG-CG 4.07Å; K110-E122 IonicContact NZ-OE1 3.44Å; K110-E122 PolarHBondContact NZ-OE1 3.29Å; K110-E122 IonicContact NZ-OE2 3.54Å; K110-E122 PolarHBondContact NZ-OE2 3.38Å; K110-D124 WeakPolarHBondContact CE-OD1 3.19Å; K110-D124 WeakPolarHBondContact CG-OD1 3.46Å
111	L	97.7	Very high	93.8	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.005	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	133.3	-174.4	-52.7	-178.6	0	0	0	110	L73 R85 T86 L113 E122 Q123 L125 L187	L73-L111 HydrophobicContact CD1-CD1 3.98Å; R85-L111 WeakPolarHBondContact O-CA 3.32Å; T86-L111 HydrophobicContact CG2-CD2 3.81Å; L111-L113 HydrophobicContact CB-CD2 3.91Å; L111-L113 HydrophobicContact CB-CG 4.09Å; L111-L113 HydrophobicContact CD1-CD2 4.24Å; L111-E122 WeakPolarHBondContact O-CA 3.45Å; L111-Q123 PolarHBondContact N-O 3.5Å; L111-Q123 PolarHBondContact O-N 3.41Å; L111-L125 HydrophobicContact CD1-CB 3.97Å; L111-L125 HydrophobicContact CD1-CD2 3.8Å; L111-L125 HydrophobicContact CD1-CG 4.49Å; L111-L125 HydrophobicContact CG-CB 4.32Å; L111-L187 HydrophobicContact CD1-CD1 3.91Å; L111-L187 HydrophobicContact CD2-CD1 3.85Å
112	Q	97.3	Very high	94.9	Very high	20 Å²	20	34.9 Å²	34.9	9%	0.093	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	110.9	163.9	-174.6	175.6	-32.9	0	0	107.6	E84 R85	E84-Q112 HydrophobicContact CB-CG 4.25Å; E84-Q112 PolarHBondContact N-O 2.88Å; E84-Q112 PolarHBondContact OE2-NE2 3.46Å; R85-Q112 HydrophobicContact CB-CB 3.8Å; R85-Q112 VanDerWaalsContact CD-OE1 3.3Å; R85-Q112 HydrophobicContact CG-CB 4.21Å; R85-Q112 PolarHBondContact N-O 2.9Å; R85-Q112 PolarHBondContact O-N 2.89Å
113	L	96.6	Very high	95.3	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	148.2	-175.1	-59.1	178.5	0	0	0	110.7	L48 L73 V81 E82 I83 L111 Y115 R120 T121 Q123	L48-L113 HydrophobicContact CD1-CD1 3.91Å; L48-L113 HydrophobicContact CD2-CD1 3.92Å; L48-L113 HydrophobicContact CG-CD1 3.83Å; L73-L113 HydrophobicContact CD1-CD2 3.97Å; V81-L113 HydrophobicContact CG1-CB 3.86Å; V81-L113 HydrophobicContact CG1-CD1 4.3Å; V81-L113 HydrophobicContact CG1-CD2 4.23Å; V81-L113 HydrophobicContact CG1-CG 4.36Å; E82-L113 CarbonylContact O-C 3.57Å; E82-L113 WeakPolarHBondContact O-CA 3.49Å; I83-L113 HydrophobicContact CB-CD2 4.35Å; I83-L113 HydrophobicContact CG1-CD2 3.75Å; I83-L113 HydrophobicContact CG2-CD2 4.2Å; L111-L113 HydrophobicContact CB-CD2 3.91Å; L111-L113 HydrophobicContact CB-CG 4.09Å; L111-L113 HydrophobicContact CD1-CD2 4.24Å; L113-Y115 HydrophobicContact CB-CE2 4.07Å; L113-Y115 HydrophobicContact CD1-CE2 4.5Å; L113-R120 CarbonylContact O-C 3.54Å; L113-R120 WeakPolarHBondContact O-CA 3.41Å; L113-T121 PolarHBondContact N-O 3Å; L113-T121 PolarHBondContact O-N 3.29Å; L113-Q123 HydrophobicContact CD1-CB 3.62Å; L113-Q123 HydrophobicContact CD1-CG 3.87Å; L113-Q123 HydrophobicContact CG-CB 4.25Å
114	L	96.3	Very high	95.5	Very high	25 Å²	25	31.5 Å²	31.5	13%	0.131	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	118.7	172.3	171.3	66.4	0	0	0	108.8	E82 E84 R120	E82-L114 HydrophobicContact CB-CB 4.22Å; E82-L114 PolarHBondContact N-O 2.88Å; E82-L114 PolarHBondContact O-N 3.08Å; E84-L114 HydrophobicContact CG-CB 4.17Å; L114-R120 HydrophobicContact CB-CG 4.41Å; L114-R120 HydrophobicContact CD1-CG 3.82Å
115	Y	95.1	Very high	95.6	Very high	9 Å²	9	30.3 Å²	30.3	4%	0.035	17%	0.168	C	C	.	.			trans	-87.4	162.3	-178.4	-71.4	-101	0	0	0	111.7	V46 L48 D75 V81 L113 N117 G118 V119 T121	V46-Y115 HydrophobicContact CG1-CD1 3.65Å; V46-Y115 HydrophobicContact CG1-CD2 3.67Å; V46-Y115 HydrophobicContact CG1-CE1 3.89Å; V46-Y115 HydrophobicContact CG1-CE2 3.94Å; V46-Y115 HydrophobicContact CG1-CG 3.53Å; L48-Y115 PolarHBondContact N-OH 3.34Å; L48-Y115 VanDerWaalsContact N-OH 3.08Å; D75-Y115 HydrophobicContact CB-CD1 3.7Å; D75-Y115 HydrophobicContact CB-CE1 3.69Å; V81-Y115 HydrophobicContact CG1-CD1 4.27Å; V81-Y115 HydrophobicContact CG1-CD2 4.34Å; V81-Y115 HydrophobicContact CG1-CE1 4.21Å; V81-Y115 HydrophobicContact CG1-CE2 4.26Å; V81-Y115 HydrophobicContact CG1-CG 4.33Å; V81-Y115 HydrophobicContact CG2-CD1 3.82Å; V81-Y115 HydrophobicContact CG2-CE1 3.77Å; L113-Y115 HydrophobicContact CB-CE2 4.07Å; L113-Y115 HydrophobicContact CD1-CE2 4.5Å; Y115-N117 WeakPolarHBondContact CB-OD1 3.42Å; Y115-N117 PolarHBondContact O-N 2.99Å; Y115-N117 VanDerWaalsContact O-N 3.1Å; Y115-G118 PolarHBondContact O-N 3.22Å; Y115-V119 PolarHBondContact N-O 2.81Å; Y115-T121 HydrophobicContact CD2-CG2 4.12Å; Y115-T121 HydrophobicContact CE2-CG2 3.61Å; Y115-T121 WeakPolarHBondContact CE2-OG1 3.39Å
116	S	92.2	Very high	95.7	Very high	82 Å²	82	31.8 Å²	31.8	57%	0.573	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54	-27.8	178.4	57	0	0	0	0	114.4	G118	S116-G118 VanDerWaalsContact C-N 3.34Å
117	N	90.3	Very high	95.8	Very high	92 Å²	92	31.8 Å²	31.8	49%	0.492	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	5.2	176.3	66	3.1	0	0	0	114.5	V46 Y115 V119	V46-N117 VanDerWaalsContact CG2-ND2 3.33Å; V46-N117 WeakPolarHBondContact CG2-ND2 3.27Å; Y115-N117 WeakPolarHBondContact CB-OD1 3.42Å; Y115-N117 PolarHBondContact O-N 2.99Å; Y115-N117 VanDerWaalsContact O-N 3.1Å; N117-V119 VanDerWaalsContact C-N 3.31Å; N117-V119 PolarHBondContact O-N 2.73Å; N117-V119 WeakPolarHBondContact OD1-CB 3.43Å; N117-V119 WeakPolarHBondContact OD1-CG2 3.29Å; N117-V119 PolarHBondContact OD1-N 3.24Å
118	G	90.9	Very high	95.8	Very high	46 Å²	46	32.4 Å²	32.4	47%	0.474	18%	0.175	S	C	.	.	S	Bend	trans	82.7	-3.8	-180	0	0	0	0	0	115.6	Y115 S116	Y115-G118 PolarHBondContact O-N 3.22Å; S116-G118 VanDerWaalsContact C-N 3.34Å
119	V	92.9	Very high	95.8	Very high	49 Å²	49	31.6 Å²	31.6	30%	0.297	17%	0.171	S	C	.	.			trans	-69.6	133.5	175.1	177	0	0	0	0	109.6	V46 Y115 N117 T121	V46-V119 HydrophobicContact CG1-CB 4.4Å; V46-V119 HydrophobicContact CG1-CG1 4.33Å; Y115-V119 PolarHBondContact N-O 2.81Å; N117-V119 VanDerWaalsContact C-N 3.31Å; N117-V119 PolarHBondContact O-N 2.73Å; N117-V119 WeakPolarHBondContact OD1-CB 3.43Å; N117-V119 WeakPolarHBondContact OD1-CG2 3.29Å; N117-V119 PolarHBondContact OD1-N 3.24Å; V119-T121 HydrophobicContact CG1-CG2 4.21Å
120	R	95.7	Very high	95.7	Very high	78 Å²	78	31.8 Å²	31.8	29%	0.294	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	137.7	169.8	-72.4	177.7	173	72.1	10	110.6	V35 V36 E84 L113 L114	V35-R120 HydrophobicContact CB-CB 4.45Å; V35-R120 HydrophobicContact CG2-CB 4.1Å; V36-R120 PolarHBondContact N-O 3.34Å; E84-R120 VanDerWaalsContact CD-NE 3.25Å; E84-R120 IonicContact OE1-CZ 3.26Å; E84-R120 VanDerWaalsContact OE1-CZ 3.26Å; E84-R120 IonicContact OE1-NE 2.97Å; E84-R120 PolarHBondContact OE1-NE 2.92Å; E84-R120 IonicContact OE1-NH2 2.7Å; E84-R120 PolarHBondContact OE1-NH2 3.17Å; E84-R120 VanDerWaalsContact OE2-CD 3.3Å; E84-R120 WeakPolarHBondContact OE2-CD 3.2Å; E84-R120 IonicContact OE2-CZ 3.85Å; E84-R120 IonicContact OE2-NE 2.82Å; E84-R120 PolarHBondContact OE2-NE 3.46Å; L113-R120 CarbonylContact O-C 3.54Å; L113-R120 WeakPolarHBondContact O-CA 3.41Å; L114-R120 HydrophobicContact CB-CG 4.41Å; L114-R120 HydrophobicContact CD1-CG 3.82Å
121	T	94.7	Very high	95.7	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.006	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	151.1	171.2	76	0	0	0	0	112.5	V36 A41 L113 Y115 V119	V36-T121 CarbonylContact O-C 3.51Å; V36-T121 WeakPolarHBondContact O-CA 3.48Å; V36-T121 WeakPolarHBondContact O-CB 3.23Å; A41-T121 HydrophobicContact CB-CG2 3.46Å; A41-T121 VanDerWaalsContact CB-CG2 3.46Å; L113-T121 PolarHBondContact N-O 3Å; L113-T121 PolarHBondContact O-N 3.29Å; Y115-T121 HydrophobicContact CD2-CG2 4.12Å; Y115-T121 HydrophobicContact CE2-CG2 3.61Å; Y115-T121 WeakPolarHBondContact CE2-OG1 3.39Å; V119-T121 HydrophobicContact CG1-CG2 4.21Å
122	E	95.9	Very high	95.6	Very high	83 Å²	83	30 Å²	30	39%	0.388	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	124.9	160.6	-142.5	-174	177.4	0	0	108.5	V35 V36 A38 K110 L111	V35-E122 HydrophobicContact CG1-CB 4.14Å; V36-E122 PolarHBondContact O-N 2.92Å; A38-E122 WeakPolarHBondContact CB-O 3.05Å; A38-E122 PolarHBondContact N-O 3.26Å; A38-E122 VanDerWaalsContact N-O 3.17Å; K110-E122 HydrophobicContact CD-CG 4.18Å; K110-E122 VanDerWaalsContact CD-OE1 3.26Å; K110-E122 WeakPolarHBondContact CD-OE1 3.34Å; K110-E122 VanDerWaalsContact CE-OE1 3.26Å; K110-E122 WeakPolarHBondContact CE-OE1 3.47Å; K110-E122 WeakPolarHBondContact CE-OE2 3.33Å; K110-E122 HydrophobicContact CG-CG 4.07Å; K110-E122 IonicContact NZ-OE1 3.44Å; K110-E122 PolarHBondContact NZ-OE1 3.29Å; K110-E122 IonicContact NZ-OE2 3.54Å; K110-E122 PolarHBondContact NZ-OE2 3.38Å; L111-E122 WeakPolarHBondContact O-CA 3.45Å
123	Q	95.6	Very high	95.5	Very high	14 Å²	14	34.6 Å²	34.6	7%	0.065	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	122.8	-170.7	174.3	66.5	83.8	0	0	110.8	A38 L48 L111 L113	A38-Q123 HydrophobicContact CB-CB 4.38Å; L48-Q123 HydrophobicContact CD1-CG 3.88Å; L48-Q123 HydrophobicContact CG-CG 4.43Å; L111-Q123 PolarHBondContact N-O 3.5Å; L111-Q123 PolarHBondContact O-N 3.41Å; L113-Q123 HydrophobicContact CD1-CB 3.62Å; L113-Q123 HydrophobicContact CD1-CG 3.87Å; L113-Q123 HydrophobicContact CG-CB 4.25Å
124	D	96.3	Very high	95.4	Very high	52 Å²	52	38.7 Å²	38.7	28%	0.278	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	138.3	169.7	-57.5	-32.3	0	0	0	110.2	H108 Y109 K110 Y126	H108-D124 IonicContact NE2-OD1 3.33Å; Y109-D124 CarbonylContact O-C 3.54Å; Y109-D124 WeakPolarHBondContact O-CA 3.18Å; K110-D124 WeakPolarHBondContact CE-OD1 3.19Å; K110-D124 WeakPolarHBondContact CG-OD1 3.46Å; D124-Y126 HydrophobicContact CB-CE2 4Å
125	L	97.2	Very high	95.3	Very high	1 Å²	1	42 Å²	42	1%	0.005	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	129	177.5	177.8	68.8	0	0	0	109.8	Y109 L111 F189 L225	Y109-L125 PolarHBondContact N-O 3.32Å; Y109-L125 PolarHBondContact O-N 2.87Å; L111-L125 HydrophobicContact CD1-CB 3.97Å; L111-L125 HydrophobicContact CD1-CD2 3.8Å; L111-L125 HydrophobicContact CD1-CG 4.49Å; L111-L125 HydrophobicContact CG-CB 4.32Å; L125-F189 HydrophobicContact CD2-CE1 4.36Å; L125-F189 HydrophobicContact CD2-CZ 3.74Å; L125-L225 HydrophobicContact CD1-CD1 3.73Å
126	Y	97.4	Very high	95.2	Very high	31 Å²	31	45.3 Å²	45.3	12%	0.122	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	136.8	179	-60.9	-90.9	0	0	0	110.3	V92 H108 D124 L214 S215 T217 V218	V92-Y126 HydrophobicContact CG2-CD1 3.85Å; V92-Y126 HydrophobicContact CG2-CE1 4.34Å; H108-Y126 HydrophobicContact CB-CD1 4.01Å; H108-Y126 HydrophobicContact CB-CE1 3.8Å; H108-Y126 AromaticContact CD2-CD1 3.98Å; H108-Y126 AromaticContact CD2-CE1 3.37Å; H108-Y126 WeakPolarHBondContact CD2-CE1 3.31Å; H108-Y126 AromaticContact CD2-CZ 3.43Å; H108-Y126 VanDerWaalsContact CD2-CZ 3.43Å; H108-Y126 AromaticContact CG-CE1 3.55Å; H108-Y126 AromaticContact NE2-CZ 3.7Å; H108-Y126 PolarHBondContact NE2-OH 3.44Å; D124-Y126 HydrophobicContact CB-CE2 4Å; Y126-L214 WeakPolarHBondContact O-CA 3.45Å; Y126-S215 PolarHBondContact N-O 2.78Å; Y126-S215 PolarHBondContact O-N 2.92Å; Y126-T217 WeakPolarHBondContact CD2-O 3.17Å; Y126-V218 HydrophobicContact CD1-CG2 3.81Å; Y126-V218 HydrophobicContact CE1-CG2 3.43Å; Y126-V218 VanDerWaalsContact CE1-CG2 3.43Å; Y126-V218 HydrophobicContact CE2-CG2 4.44Å; Y126-V218 HydrophobicContact CG-CG2 4.44Å
127	V	98.1	Very high	95.3	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.006	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	118.2	170.3	-172.6	0	0	0	0	107.6	F69 G106 T107 Y109 L153 F189 L191 V212 L214	F69-V127 HydrophobicContact CE1-CG1 4.25Å; F69-V127 HydrophobicContact CZ-CG1 3.79Å; F69-V127 HydrophobicContact CZ-CG2 4.36Å; G106-V127 CarbonylContact C-O 3.57Å; G106-V127 WeakPolarHBondContact CA-O 3.39Å; T107-V127 PolarHBondContact N-O 3.37Å; T107-V127 PolarHBondContact O-N 3Å; Y109-V127 HydrophobicContact CD2-CG2 3.91Å; Y109-V127 HydrophobicContact CE2-CB 4.33Å; Y109-V127 HydrophobicContact CE2-CG2 3.65Å; V127-L153 HydrophobicContact CG1-CD1 4.42Å; V127-F189 HydrophobicContact CG2-CD1 4.07Å; V127-F189 HydrophobicContact CG2-CE1 3.96Å; V127-L191 HydrophobicContact CB-CD1 4.46Å; V127-L191 HydrophobicContact CG1-CD1 3.87Å; V127-V212 HydrophobicContact CG1-CG1 3.55Å; V127-L214 HydrophobicContact CB-CD2 4.32Å; V127-L214 HydrophobicContact CG1-CD2 4.22Å; V127-L214 HydrophobicContact CG2-CD2 3.76Å
128	R	97.3	Very high	95.6	Very high	13 Å²	13	37.8 Å²	37.8	5%	0.049	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	163.4	176.7	-53.7	-175	72.1	-167.1	-0.6	109.9	T103 N105 V213 V218 V220	T103-R128 PolarHBondContact OG1-NH2 2.65Å; N105-R128 PolarHBondContact O-NE 2.87Å; R128-V213 HydrophobicContact CB-CG1 3.86Å; R128-V213 PolarHBondContact N-O 2.9Å; R128-V213 VanDerWaalsContact N-O 3.13Å; R128-V213 WeakPolarHBondContact O-CG1 3.26Å; R128-V213 PolarHBondContact O-N 3.02Å; R128-V218 VanDerWaalsContact CD-O 3.32Å; R128-V218 WeakPolarHBondContact CD-O 3.44Å; R128-V218 PolarHBondContact NH1-O 3.26Å; R128-V220 HydrophobicContact CB-CG1 4.28Å; R128-V220 HydrophobicContact CG-CG1 4.43Å
129	L	98.1	Very high	95.8	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	134.2	167	-61.8	-168.9	0	0	0	111.1	N105 I138 V152 L153 C193 F210 Q211 V212 M231	N105-L129 PolarHBondContact ND2-O 3.07Å; N105-L129 PolarHBondContact OD1-N 3.38Å; L129-I138 HydrophobicContact CB-CB 4.36Å; L129-I138 HydrophobicContact CB-CG1 4.03Å; L129-I138 PolarHBondContact O-N 3.07Å; L129-V152 HydrophobicContact CB-CG1 4.2Å; L129-V152 HydrophobicContact CD1-CG1 3.81Å; L129-V152 HydrophobicContact CG-CG1 4.19Å; L129-L153 HydrophobicContact CD1-CD2 3.98Å; L129-L153 HydrophobicContact CD2-CD2 4.22Å; L129-L153 HydrophobicContact CG-CD1 4.23Å; L129-L153 HydrophobicContact CG-CD2 3.89Å; L129-L153 HydrophobicContact CG-CG 4.1Å; L129-C193 HydrophobicContact CD1-CB 4.16Å; L129-C193 WeakPolarHBondContact CD1-SG 3.48Å; L129-F210 HydrophobicContact CD1-CB 4.37Å; L129-F210 HydrophobicContact CD1-CD2 3.87Å; L129-F210 HydrophobicContact CD1-CG 4.46Å; L129-Q211 WeakPolarHBondContact CA-O 3.28Å; L129-V212 HydrophobicContact CD2-CB 4.31Å; L129-V212 HydrophobicContact CD2-CG2 3.72Å; L129-M231 HydrophobicContact CD1-CE 4.17Å; L129-M231 HydrophobicContact CD2-CE 4.1Å
130	I	97.3	Very high	95.9	Very high	5 Å²	5	36.5 Å²	36.5	3%	0.026	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	160	172.9	56.5	170.5	0	0	0	111.4	K135 Q136 F210 Q211 V213 V220 V227	I130-K135 WeakPolarHBondContact CB-O 3.27Å; I130-K135 HydrophobicContact CD1-CD 4.26Å; I130-K135 VanDerWaalsContact CG2-O 3.24Å; I130-K135 WeakPolarHBondContact CG2-O 3.17Å; I130-Q136 CarbonylContact C-O 3.55Å; I130-Q136 WeakPolarHBondContact CA-O 3.47Å; I130-F210 CarbonylContact O-C 3.01Å; I130-F210 VanDerWaalsContact O-CA 3.29Å; I130-F210 WeakPolarHBondContact O-CA 3.44Å; I130-Q211 HydrophobicContact CG1-CB 4.09Å; I130-Q211 PolarHBondContact N-O 3.47Å; I130-Q211 PolarHBondContact O-N 2.9Å; I130-V213 HydrophobicContact CD1-CB 4.06Å; I130-V213 HydrophobicContact CD1-CG2 4.49Å; I130-V213 HydrophobicContact CG1-CB 4.16Å; I130-V213 HydrophobicContact CG1-CG1 4.29Å; I130-V213 HydrophobicContact CG2-CB 4.34Å; I130-V213 HydrophobicContact CG2-CG1 3.65Å; I130-V220 HydrophobicContact CG2-CB 4.09Å; I130-V220 HydrophobicContact CG2-CG1 4.36Å; I130-V220 HydrophobicContact CG2-CG2 4Å; I130-V227 HydrophobicContact CD1-CG1 4.06Å; I130-V227 HydrophobicContact CD1-CG2 4.4Å
131	D	96.4	Very high	95.7	Very high	12 Å²	12	36.6 Å²	36.6	6%	0.064	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	133.1	172.4	-159	-68.3	0	0	0	111.5	V133 T134 K135 Q136 I138 R208	D131-V133 PolarHBondContact O-N 2.96Å; D131-V133 VanDerWaalsContact O-N 3.15Å; D131-V133 PolarHBondContact OD1-N 2.75Å; D131-T134 WeakPolarHBondContact CB-OG1 3.37Å; D131-K135 VanDerWaalsContact O-CA 3.26Å; D131-K135 WeakPolarHBondContact O-CA 3.23Å; D131-K135 PolarHBondContact O-N 3.07Å; D131-Q136 PolarHBondContact N-O 3.11Å; D131-I138 HydrophobicContact CB-CD1 3.87Å; D131-R208 VanDerWaalsContact OD2-CG 3.26Å; D131-R208 WeakPolarHBondContact OD2-CG 3.46Å; D131-R208 IonicContact OD2-CZ 3.72Å; D131-R208 IonicContact OD2-NE 3.94Å; D131-R208 PolarHBondContact OD2-NE 2.92Å; D131-R208 IonicContact OD2-NH2 2.73Å; D131-R208 PolarHBondContact OD2-NH2 3.49Å
132	S	96.1	Very high	95.4	Very high	17 Å²	17	38 Å²	38	12%	0.119	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56	-28.6	176.9	58.2	0	0	0	0	114.5	K135 R209 N230	S132-K135 PolarHBondContact O-NZ 3.01Å; S132-R209 WeakPolarHBondContact CB-O 3.44Å; S132-R209 PolarHBondContact N-O 2.88Å; S132-R209 PolarHBondContact OG-N 3.12Å; S132-R209 PolarHBondContact OG-O 3.02Å; S132-N230 WeakPolarHBondContact CB-OD1 3.35Å
133	V	94.3	Very high	94.8	Very high	116 Å²	116	43.9 Å²	43.9	70%	0.703	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.8	-57.4	-176.5	-177	0	0	0	0	111.1	D131 K135	D131-V133 PolarHBondContact O-N 2.96Å; D131-V133 VanDerWaalsContact O-N 3.15Å; D131-V133 PolarHBondContact OD1-N 2.75Å; V133-K135 PolarHBondContact O-N 3.2Å
134	T	94.4	Very high	94.4	Very high	85 Å²	85	46.7 Å²	46.7	52%	0.521	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-10.6	-173.6	65.1	0	0	0	0	114	D131 Q136	D131-T134 WeakPolarHBondContact CB-OG1 3.37Å; T134-Q136 PolarHBondContact O-N 2.84Å
135	K	94.6	Very high	94.1	Very high	96 Å²	96	54.2 Å²	54.2	42%	0.417	28%	0.28	S	S	.	.			trans	58.8	-3.2	-173	-51.5	-48.6	-171.4	-164.1	0	116.1	I130 D131 S132 V133	I130-K135 WeakPolarHBondContact CB-O 3.27Å; I130-K135 HydrophobicContact CD1-CD 4.26Å; I130-K135 VanDerWaalsContact CG2-O 3.24Å; I130-K135 WeakPolarHBondContact CG2-O 3.17Å; D131-K135 VanDerWaalsContact O-CA 3.26Å; D131-K135 WeakPolarHBondContact O-CA 3.23Å; D131-K135 PolarHBondContact O-N 3.07Å; S132-K135 PolarHBondContact O-NZ 3.01Å; V133-K135 PolarHBondContact O-N 3.2Å
136	Q	94.2	Very high	93.5	Very high	78 Å²	78	57.6 Å²	57.6	36%	0.364	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-67	150.2	176.8	-66.7	-57.8	-74.4	0	0	112.1	I130 D131 T134 D221	I130-Q136 CarbonylContact C-O 3.55Å; I130-Q136 WeakPolarHBondContact CA-O 3.47Å; D131-Q136 PolarHBondContact N-O 3.11Å; T134-Q136 PolarHBondContact O-N 2.84Å; Q136-D221 PolarHBondContact NE2-OD1 2.96Å
137	P	94.4	Very high	93.1	Very high	15 Å²	15	60.5 Å²	60.5	10%	0.097	32%	0.32	C	S	.	.	B	Isolated β-bridge	trans	-60.4	138.6	176.9	26.1	-34.4	0	0	0	111.2	T103 A139 V220	T103-P137 HydrophobicContact CG2-CB 4.16Å; T103-P137 HydrophobicContact CG2-CG 4.03Å; P137-A139 PolarHBondContact O-N 2.86Å; P137-V220 HydrophobicContact CB-CG2 4.39Å; P137-V220 HydrophobicContact CG-CG2 4.43Å
138	I	95.8	Very high	92.5	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-70.4	120.7	174.2	-57.8	-55	0	0	0	109.1	N105 L129 D131 V152 Q195 F210	N105-I138 WeakPolarHBondContact CB-O 3.34Å; N105-I138 VanDerWaalsContact CG-O 3.31Å; N105-I138 PolarHBondContact ND2-N 2.88Å; N105-I138 VanDerWaalsContact ND2-N 3.18Å; N105-I138 PolarHBondContact ND2-O 3.47Å; L129-I138 HydrophobicContact CB-CB 4.36Å; L129-I138 HydrophobicContact CB-CG1 4.03Å; L129-I138 PolarHBondContact O-N 3.07Å; D131-I138 HydrophobicContact CB-CD1 3.87Å; I138-V152 HydrophobicContact CB-CG1 4.38Å; I138-V152 HydrophobicContact CG2-CG1 4.17Å; I138-V152 HydrophobicContact CG2-CG2 4.19Å; I138-V152 WeakPolarHBondContact O-CG2 3.23Å; I138-Q195 HydrophobicContact CG2-CB 4.3Å; I138-Q195 HydrophobicContact CG2-CG 3.73Å; I138-F210 HydrophobicContact CD1-CD1 3.41Å; I138-F210 VanDerWaalsContact CD1-CD1 3.41Å; I138-F210 HydrophobicContact CD1-CE1 3.4Å; I138-F210 HydrophobicContact CD1-CG 4.33Å; I138-F210 HydrophobicContact CD1-CZ 4.29Å; I138-F210 HydrophobicContact CG1-CD1 3.61Å; I138-F210 HydrophobicContact CG1-CE1 3.75Å; I138-F210 HydrophobicContact CG1-CG 4.06Å; I138-F210 HydrophobicContact CG1-CZ 4.28Å; I138-F210 HydrophobicContact CG2-CE1 4.01Å; I138-F210 HydrophobicContact CG2-CE2 4.3Å; I138-F210 HydrophobicContact CG2-CZ 3.8Å
139	A	95	Very high	92.1	Very high	36 Å²	36	65.3 Å²	65.3	30%	0.298	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-76.8	148.2	168.4	0	0	0	0	0	111.5	P137 E141	P137-A139 PolarHBondContact O-N 2.86Å; A139-E141 PolarHBondContact O-N 3.37Å
140	Y	95.1	Very high	91.9	Very high	33 Å²	33	66.5 Å²	66.5	13%	0.129	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-77.8	117.3	167.9	-177.9	-103.3	0	0	0	110.7	T103 G142 M149 C150 R151 V152 N194	T103-Y140 PolarHBondContact O-N 3.47Å; Y140-G142 WeakPolarHBondContact CE1-O 3.06Å; Y140-G142 VanDerWaalsContact CZ-CA 3.48Å; Y140-M149 PolarHBondContact OH-O 3.45Å; Y140-C150 VanDerWaalsContact CD1-C 3.41Å; Y140-C150 HydrophobicContact CD1-CB 4.05Å; Y140-C150 VanDerWaalsContact CD1-O 3.26Å; Y140-C150 WeakPolarHBondContact CD1-O 3.16Å; Y140-C150 HydrophobicContact CE1-CB 3.71Å; Y140-R151 VanDerWaalsContact CD2-C 3.46Å; Y140-R151 VanDerWaalsContact CD2-O 3.29Å; Y140-R151 WeakPolarHBondContact CD2-O 3.43Å; Y140-V152 HydrophobicContact CD2-CG2 4.49Å; Y140-N194 VanDerWaalsContact CE2-ND2 3.26Å; Y140-N194 WeakPolarHBondContact CE2-ND2 3.22Å
141	E	91.7	Very high	91.8	Very high	80 Å²	80	66.7 Å²	66.7	37%	0.374	35%	0.352	S	S	.	.			trans	-111	8.3	-175.4	-55.7	178.6	-148.1	0	0	112.6	A139 K199 R208	A139-E141 PolarHBondContact O-N 3.37Å; E141-K199 WeakPolarHBondContact OE1-CE 3.13Å; E141-K199 IonicContact OE1-NZ 2.67Å; E141-K199 PolarHBondContact OE1-NZ 3.16Å; E141-K199 WeakPolarHBondContact OE2-CD 3.39Å; E141-K199 WeakPolarHBondContact OE2-CE 3.37Å; E141-K199 IonicContact OE2-NZ 3.87Å; E141-K199 PolarHBondContact OE2-NZ 3.24Å; E141-R208 IonicContact OE1-NH1 2.7Å; E141-R208 PolarHBondContact OE1-NH1 3.24Å
142	G	87.4	Confident	91.9	Very high	29 Å²	29	66.1 Å²	66.1	30%	0.299	35%	0.349	S	S	.	.			trans	-81.5	149	-175.8	0	0	0	0	0	113.5	Y140	Y140-G142 WeakPolarHBondContact CE1-O 3.06Å; Y140-G142 VanDerWaalsContact CZ-CA 3.48Å
143	Q	85.1	Confident	91.9	Very high	207 Å²	207	65.4 Å²	65.4	97%	0.967	34%	0.344	S	S	*	.			trans	-98.7	112.8	166.4	-67.5	-179.9	-7.8	0	0	109
144	N	87	Confident	92.1	Very high	74 Å²	74	59.9 Å²	59.9	40%	0.396	31%	0.31	S	S	.	.			trans	-130	148.3	173.6	-157.9	-31.7	0	0	0	110.1	N146 M149	N144-N146 PolarHBondContact OD1-N 2.66Å; N144-M149 HydrophobicContact CB-CB 4.43Å; N144-M149 WeakPolarHBondContact ND2-CB 3.17Å
145	K	88.8	Confident	92.2	Very high	210 Å²	210	55.9 Å²	55.9	91%	0.913	29%	0.286	S	S	*	.	S	Bend	trans	-80.2	-22.6	177.5	-65.9	-169.9	176	-169.3	0	113.1
146	N	86.2	Confident	92.3	Very high	71 Å²	71	52 Å²	52	38%	0.38	27%	0.269	S	S	.	.	S	Bend	trans	-96.5	116.5	175.5	-178.7	-0.5	0	0	0	109.2	N144 E148 M149	N144-N146 PolarHBondContact OD1-N 2.66Å; N146-E148 VanDerWaalsContact C-N 3.26Å; N146-E148 PolarHBondContact O-N 3.22Å; N146-E148 WeakPolarHBondContact OD1-CB 3.43Å; N146-E148 PolarHBondContact OD1-N 3.09Å; N146-E148 VanDerWaalsContact OD1-N 3.08Å; N146-M149 HydrophobicContact CB-CB 4.31Å; N146-M149 HydrophobicContact CB-CG 3.92Å; N146-M149 WeakPolarHBondContact O-CB 3.37Å; N146-M149 PolarHBondContact O-N 3.27Å
147	P	87.4	Confident	92.3	Very high	93 Å²	93	50 Å²	50	60%	0.604	26%	0.26	S	S	*	.	G	3₁₀ helix	trans	-61.3	-31.9	179.6	25.6	-34.6	0	0	0	112.9	M149 C150	P147-M149 PolarHBondContact O-N 3.25Å; P147-C150 VanDerWaalsContact O-CB 3.32Å; P147-C150 WeakPolarHBondContact O-CB 3.03Å; P147-C150 PolarHBondContact O-N 3.1Å
148	E	86.4	Confident	92.2	Very high	80 Å²	80	50.8 Å²	50.8	37%	0.374	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-62.3	-19	176.2	-64.2	-56.9	142.5	0	0	113.2	N146 R151 L154 V158	N146-E148 VanDerWaalsContact C-N 3.26Å; N146-E148 PolarHBondContact O-N 3.22Å; N146-E148 WeakPolarHBondContact OD1-CB 3.43Å; N146-E148 PolarHBondContact OD1-N 3.09Å; N146-E148 VanDerWaalsContact OD1-N 3.08Å; E148-R151 PolarHBondContact O-NH1 2.85Å; E148-R151 IonicContact OE1-NH2 4Å; E148-R151 IonicContact OE2-CZ 3.24Å; E148-R151 VanDerWaalsContact OE2-CZ 3.25Å; E148-R151 IonicContact OE2-NH1 3.68Å; E148-R151 PolarHBondContact OE2-NH1 3.35Å; E148-R151 IonicContact OE2-NH2 3.16Å; E148-R151 PolarHBondContact OE2-NH2 2.93Å; E148-L154 WeakPolarHBondContact O-CD2 3.32Å; E148-V158 HydrophobicContact CB-CG2 4.07Å; E148-V158 HydrophobicContact CG-CG2 4.44Å; E148-V158 WeakPolarHBondContact OE2-CG2 3.47Å
149	M	88.3	Confident	92	Very high	35 Å²	35	53.2 Å²	53.2	17%	0.172	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-97.9	4.4	177.1	-59.1	-64.1	-57.9	0	0	112.9	Y140 N144 N146 P147 R151 L154 M159 N194	Y140-M149 PolarHBondContact OH-O 3.45Å; N144-M149 HydrophobicContact CB-CB 4.43Å; N144-M149 WeakPolarHBondContact ND2-CB 3.17Å; N146-M149 HydrophobicContact CB-CB 4.31Å; N146-M149 HydrophobicContact CB-CG 3.92Å; N146-M149 WeakPolarHBondContact O-CB 3.37Å; N146-M149 PolarHBondContact O-N 3.27Å; P147-M149 PolarHBondContact O-N 3.25Å; M149-R151 VanDerWaalsContact C-N 3.26Å; M149-R151 PolarHBondContact O-N 3.14Å; M149-L154 HydrophobicContact CE-CD1 3.58Å; M149-L154 HydrophobicContact SD-CD1 4.12Å; M149-M159 HydrophobicContact CE-CG 4.1Å; M149-M159 HydrophobicContact CE-SD 4.01Å; M149-M159 HydrophobicContact SD-CG 3.79Å; M149-M159 HydrophobicContact SD-SD 4.5Å; M149-N194 PolarHBondContact O-ND2 2.81Å
150	C	93.8	Very high	91.9	Very high	24 Å²	24	52.3 Å²	52.3	16%	0.162	27%	0.267	C	S	.	.			trans	-91.4	41.6	-177.5	-68.6	0	0	0	0	112.9	N104 Y140 P147	N104-C150 VanDerWaalsContact CB-O 3.31Å; N104-C150 WeakPolarHBondContact CB-O 3.4Å; N104-C150 PolarHBondContact ND2-O 3.47Å; Y140-C150 VanDerWaalsContact CD1-C 3.41Å; Y140-C150 HydrophobicContact CD1-CB 4.05Å; Y140-C150 VanDerWaalsContact CD1-O 3.26Å; Y140-C150 WeakPolarHBondContact CD1-O 3.16Å; Y140-C150 HydrophobicContact CE1-CB 3.71Å; P147-C150 VanDerWaalsContact O-CB 3.32Å; P147-C150 WeakPolarHBondContact O-CB 3.03Å; P147-C150 PolarHBondContact O-N 3.1Å
151	R	95.7	Very high	91.8	Very high	10 Å²	10	54.6 Å²	54.6	4%	0.038	29%	0.288	C	S	.	.	S	Bend	trans	-126.8	153.4	-175.8	-55.2	179.7	-180	115.5	-7.7	111.7	E93 N104 Y140 E148 M149 L153 L154 N194	E93-R151 IonicContact OE1-CZ 2.73Å; E93-R151 IonicContact OE1-NE 3.24Å; E93-R151 PolarHBondContact OE1-NE 3.41Å; E93-R151 IonicContact OE1-NH2 3.17Å; E93-R151 PolarHBondContact OE1-NH2 2.87Å; E93-R151 IonicContact OE2-CZ 3.41Å; E93-R151 IonicContact OE2-NE 3.7Å; E93-R151 PolarHBondContact OE2-NE 3.23Å; E93-R151 IonicContact OE2-NH2 2.65Å; E93-R151 PolarHBondContact OE2-NH2 3.03Å; N104-R151 CarbonylContact O-C 3.51Å; N104-R151 VanDerWaalsContact O-CA 3.31Å; N104-R151 WeakPolarHBondContact O-CA 3.45Å; Y140-R151 VanDerWaalsContact CD2-C 3.46Å; Y140-R151 VanDerWaalsContact CD2-O 3.29Å; Y140-R151 WeakPolarHBondContact CD2-O 3.43Å; E148-R151 PolarHBondContact O-NH1 2.85Å; E148-R151 IonicContact OE1-NH2 4Å; E148-R151 IonicContact OE2-CZ 3.24Å; E148-R151 VanDerWaalsContact OE2-CZ 3.25Å; E148-R151 IonicContact OE2-NH1 3.68Å; E148-R151 PolarHBondContact OE2-NH1 3.35Å; E148-R151 IonicContact OE2-NH2 3.16Å; E148-R151 PolarHBondContact OE2-NH2 2.93Å; M149-R151 VanDerWaalsContact C-N 3.26Å; M149-R151 PolarHBondContact O-N 3.14Å; R151-L153 WeakPolarHBondContact CB-O 3.32Å; R151-L154 HydrophobicContact CB-CD2 3.91Å; R151-L154 HydrophobicContact CG-CD2 4.35Å; R151-N194 WeakPolarHBondContact O-CB 3.32Å; R151-N194 PolarHBondContact O-ND2 3.43Å
152	V	97.3	Very high	92	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	30%	0.296	C	S	.	.	S	Bend	trans	-71.8	-42.8	174.3	175	0	0	0	0	111.7	N104 N105 L129 I138 Y140 C193 N194 Q195	N104-V152 PolarHBondContact O-N 3.27Å; N105-V152 HydrophobicContact CB-CB 3.74Å; N105-V152 HydrophobicContact CB-CG1 4.41Å; N105-V152 HydrophobicContact CB-CG2 3.7Å; L129-V152 HydrophobicContact CB-CG1 4.2Å; L129-V152 HydrophobicContact CD1-CG1 3.81Å; L129-V152 HydrophobicContact CG-CG1 4.19Å; I138-V152 HydrophobicContact CB-CG1 4.38Å; I138-V152 HydrophobicContact CG2-CG1 4.17Å; I138-V152 HydrophobicContact CG2-CG2 4.19Å; I138-V152 WeakPolarHBondContact O-CG2 3.23Å; Y140-V152 HydrophobicContact CD2-CG2 4.49Å; V152-C193 CarbonylContact O-C 3.56Å; V152-C193 WeakPolarHBondContact O-CA 3.43Å; V152-N194 PolarHBondContact O-N 3.07Å; V152-Q195 HydrophobicContact CB-CB 4.42Å; V152-Q195 HydrophobicContact CG1-CB 4.05Å; V152-Q195 HydrophobicContact CG2-CB 4.11Å
153	L	97.9	Very high	92.4	Very high	1 Å²	1	57.1 Å²	57.1	1%	0.005	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	141.8	176	-69.7	174.9	0	0	0	110.3	F67 T107 V127 L129 R151 L191	F67-L153 HydrophobicContact CE1-CD2 4.12Å; F67-L153 HydrophobicContact CZ-CD2 3.98Å; T107-L153 HydrophobicContact CG2-CB 4.28Å; V127-L153 HydrophobicContact CG1-CD1 4.42Å; L129-L153 HydrophobicContact CD1-CD2 3.98Å; L129-L153 HydrophobicContact CD2-CD2 4.22Å; L129-L153 HydrophobicContact CG-CD1 4.23Å; L129-L153 HydrophobicContact CG-CD2 3.89Å; L129-L153 HydrophobicContact CG-CG 4.1Å; R151-L153 WeakPolarHBondContact CB-O 3.32Å; L153-L191 HydrophobicContact CD1-CD1 4.31Å; L153-L191 HydrophobicContact CD2-CB 4.48Å; L153-L191 HydrophobicContact CD2-CD1 4.36Å
154	L	97.1	Very high	92.7	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	139.7	177.6	-65.2	172.5	0	0	0	110.4	E148 M149 R151 V158 M159 K192 N194	E148-L154 WeakPolarHBondContact O-CD2 3.32Å; M149-L154 HydrophobicContact CE-CD1 3.58Å; M149-L154 HydrophobicContact SD-CD1 4.12Å; R151-L154 HydrophobicContact CB-CD2 3.91Å; R151-L154 HydrophobicContact CG-CD2 4.35Å; L154-V158 HydrophobicContact CD2-CG1 4.17Å; L154-M159 HydrophobicContact CB-CE 3.95Å; L154-M159 HydrophobicContact CB-CG 4.43Å; L154-M159 HydrophobicContact CB-SD 4.19Å; L154-M159 HydrophobicContact CD1-CG 4.22Å; L154-M159 HydrophobicContact CD1-SD 3.87Å; L154-K192 HydrophobicContact CB-CB 4.47Å; L154-K192 PolarHBondContact N-O 2.93Å; L154-K192 PolarHBondContact O-N 2.79Å; L154-N194 HydrophobicContact CD1-CB 3.79Å; L154-N194 HydrophobicContact CG-CB 4.31Å
155	T	97.4	Very high	93	Very high	1 Å²	1	52.8 Å²	52.8	1%	0.006	27%	0.273	C	S	.	.			trans	-85.8	168.9	167.1	60.2	0	0	0	0	110.8	F88 F91 T107 M159 S177 L191	F88-T155 HydrophobicContact CD2-CG2 3.89Å; F88-T155 HydrophobicContact CE2-CG2 3.7Å; F88-T155 HydrophobicContact CG-CG2 4.41Å; F88-T155 HydrophobicContact CZ-CG2 4.07Å; F91-T155 HydrophobicContact CE1-CG2 4.39Å; F91-T155 HydrophobicContact CZ-CG2 4.28Å; T107-T155 HydrophobicContact CG2-CG2 4.28Å; T155-M159 WeakPolarHBondContact O-CE 3.39Å; T155-S177 VanDerWaalsContact CB-OG 3.31Å; T155-S177 WeakPolarHBondContact CB-OG 3.32Å; T155-S177 PolarHBondContact OG1-OG 2.93Å; T155-L191 HydrophobicContact CG2-CD2 4.22Å
156	H	95.6	Very high	93.2	Very high	16 Å²	16	52.2 Å²	52.2	7%	0.074	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-41	176.9	176.4	68.1	0	0	0	112.7	F66 V158 M159 C160 C169 N171 T175	F66-H156 HydrophobicContact CE1-CB 3.96Å; F66-H156 HydrophobicContact CZ-CB 3.8Å; F66-H156 AromaticContact CZ-ND1 3.75Å; H156-V158 PolarHBondContact O-N 2.78Å; H156-M159 PolarHBondContact O-N 3.13Å; H156-M159 VanDerWaalsContact O-N 3.1Å; H156-C160 WeakPolarHBondContact NE2-CB 3.27Å; H156-C160 WeakPolarHBondContact O-CB 3.1Å; H156-C160 PolarHBondContact O-N 2.88Å; H156-C169 PolarHBondContact NE2-SG 2.89Å; H156-N171 WeakPolarHBondContact CE1-CB 3.44Å; H156-N171 WeakPolarHBondContact NE2-CB 3.48Å; H156-T175 WeakPolarHBondContact CB-O 3.3Å
157	E	94.4	Very high	93.7	Very high	35 Å²	35	54.7 Å²	54.7	16%	0.164	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-71.1	-38.8	-162.8	-63.5	174	-148.4	0	0	112	M159 C160 C163 C164 R172 S177	E157-M159 PolarHBondContact O-N 2.97Å; E157-C160 PolarHBondContact O-N 2.91Å; E157-C160 VanDerWaalsContact O-N 3.09Å; E157-C163 HydrophobicContact CB-CB 3.73Å; E157-C163 HydrophobicContact CG-CB 3.89Å; E157-C164 PolarHBondContact O-SG 2.66Å; E157-R172 VanDerWaalsContact CD-NH2 3.34Å; E157-R172 HydrophobicContact CG-CG 4.16Å; E157-R172 IonicContact OE1-CZ 2.67Å; E157-R172 IonicContact OE1-NE 3.28Å; E157-R172 PolarHBondContact OE1-NE 3.38Å; E157-R172 IonicContact OE1-NH2 2.86Å; E157-R172 PolarHBondContact OE1-NH2 3.27Å; E157-R172 IonicContact OE2-CZ 2.72Å; E157-R172 VanDerWaalsContact OE2-CZ 3.23Å; E157-R172 IonicContact OE2-NE 3.23Å; E157-R172 PolarHBondContact OE2-NE 2.74Å; E157-R172 IonicContact OE2-NH2 2.92Å; E157-R172 PolarHBondContact OE2-NH2 3.06Å; E157-S177 WeakPolarHBondContact CB-OG 3.25Å; E157-S177 VanDerWaalsContact CG-OG 3.26Å; E157-S177 WeakPolarHBondContact CG-OG 3.4Å; E157-S177 WeakPolarHBondContact OE1-CB 3.42Å; E157-S177 PolarHBondContact OE1-N 2.85Å; E157-S177 PolarHBondContact OE1-OG 2.97Å
158	V	92.9	Very high	94	Very high	32 Å²	32	55.4 Å²	55.4	19%	0.194	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-64	-23.9	174.2	73.2	0	0	0	0	113.2	F91 E148 L154 H156	F91-V158 HydrophobicContact CE2-CB 4.2Å; F91-V158 HydrophobicContact CE2-CG1 4.12Å; F91-V158 HydrophobicContact CE2-CG2 4.22Å; F91-V158 HydrophobicContact CZ-CB 4.27Å; F91-V158 HydrophobicContact CZ-CG1 3.74Å; E148-V158 HydrophobicContact CB-CG2 4.07Å; E148-V158 HydrophobicContact CG-CG2 4.44Å; E148-V158 WeakPolarHBondContact OE2-CG2 3.47Å; L154-V158 HydrophobicContact CD2-CG1 4.17Å; H156-V158 PolarHBondContact O-N 2.78Å
159	M	91.2	Very high	94.5	Very high	51 Å²	51	52.1 Å²	52.1	25%	0.251	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-90.4	-7.1	176.9	-66.4	-171.1	-81.9	0	0	113.5	F66 M149 L154 T155 H156 E157 K192	F66-M159 HydrophobicContact CE1-CE 3.65Å; F66-M159 HydrophobicContact CE2-CE 4.41Å; F66-M159 HydrophobicContact CZ-CE 3.41Å; F66-M159 VanDerWaalsContact CZ-CE 3.41Å; M149-M159 HydrophobicContact CE-CG 4.1Å; M149-M159 HydrophobicContact CE-SD 4.01Å; M149-M159 HydrophobicContact SD-CG 3.79Å; M149-M159 HydrophobicContact SD-SD 4.5Å; L154-M159 HydrophobicContact CB-CE 3.95Å; L154-M159 HydrophobicContact CB-CG 4.43Å; L154-M159 HydrophobicContact CB-SD 4.19Å; L154-M159 HydrophobicContact CD1-CG 4.22Å; L154-M159 HydrophobicContact CD1-SD 3.87Å; T155-M159 WeakPolarHBondContact O-CE 3.39Å; H156-M159 PolarHBondContact O-N 3.13Å; H156-M159 VanDerWaalsContact O-N 3.1Å; E157-M159 PolarHBondContact O-N 2.97Å; M159-K192 HydrophobicContact CE-CB 4.02Å; M159-K192 HydrophobicContact CE-CD 3.52Å; M159-K192 HydrophobicContact CE-CG 4.42Å; M159-K192 HydrophobicContact SD-CD 3.68Å
160	C	93.9	Very high	94.8	Very high	17 Å²	17	52.9 Å²	52.9	12%	0.115	29%	0.288	C	S	.	.			trans	-118.2	109.9	-167.5	-174	0	0	0	0	111.7	H156 E157 R162 C163 C164	H156-C160 WeakPolarHBondContact NE2-CB 3.27Å; H156-C160 WeakPolarHBondContact O-CB 3.1Å; H156-C160 PolarHBondContact O-N 2.88Å; E157-C160 PolarHBondContact O-N 2.91Å; E157-C160 VanDerWaalsContact O-N 3.09Å; C160-R162 PolarHBondContact O-N 2.98Å; C160-R162 VanDerWaalsContact O-N 3.14Å; C160-C163 HydrophobicContact CB-CB 4Å; C160-C163 WeakPolarHBondContact O-CA 3.38Å; C160-C163 WeakPolarHBondContact O-CB 3.22Å; C160-C163 PolarHBondContact O-N 3.22Å; C160-C163 VanDerWaalsContact SG-SG 3.7Å; C160-C164 PolarHBondContact O-N 3.42Å; C160-C164 PolarHBondContact O-SG 2.7Å; C160-C164 VanDerWaalsContact O-SG 3.41Å
161	S	93.3	Very high	94.8	Very high	80 Å²	80	55.8 Å²	55.8	56%	0.559	30%	0.302	S	S	*	.	H	α-helix	trans	-51.4	-40.5	178	53.8	0	0	0	0	113.3	C163 C164 E165	S161-C163 VanDerWaalsContact C-N 3.32Å; S161-C163 PolarHBondContact O-N 2.9Å; S161-C164 PolarHBondContact O-N 2.87Å; S161-E165 WeakPolarHBondContact O-CB 3.43Å; S161-E165 VanDerWaalsContact O-CG 3.23Å; S161-E165 WeakPolarHBondContact O-CG 3.29Å; S161-E165 PolarHBondContact O-N 2.74Å
162	R	95.7	Very high	94.8	Very high	146 Å²	146	60.2 Å²	60.2	55%	0.551	32%	0.319	S	S	*	.	H	α-helix	trans	-59.2	-40.5	175.1	-66.7	179.5	177.2	-108.5	-2	112.5	C160 E165 K166 K167 C169	C160-R162 PolarHBondContact O-N 2.98Å; C160-R162 VanDerWaalsContact O-N 3.14Å; R162-E165 CarbonylContact O-C 3.55Å; R162-E165 PolarHBondContact O-N 3.38Å; R162-K166 PolarHBondContact O-N 3.44Å; R162-K167 HydrophobicContact CB-CB 4.49Å; R162-K167 WeakPolarHBondContact O-CA 3.36Å; R162-K167 WeakPolarHBondContact O-CB 3.41Å; R162-K167 PolarHBondContact O-N 3.35Å; R162-C169 HydrophobicContact CB-CB 4.13Å
163	C	94.4	Very high	94.7	Very high	16 Å²	16	66.9 Å²	66.9	11%	0.108	35%	0.354	C	S	.	.	H	α-helix	trans	-73.4	-41.2	179.3	-58.9	0	0	0	0	111.3	E157 C160 S161 E165 K166	E157-C163 HydrophobicContact CB-CB 3.73Å; E157-C163 HydrophobicContact CG-CB 3.89Å; C160-C163 HydrophobicContact CB-CB 4Å; C160-C163 WeakPolarHBondContact O-CA 3.38Å; C160-C163 WeakPolarHBondContact O-CB 3.22Å; C160-C163 PolarHBondContact O-N 3.22Å; C160-C163 VanDerWaalsContact SG-SG 3.7Å; S161-C163 VanDerWaalsContact C-N 3.32Å; S161-C163 PolarHBondContact O-N 2.9Å; C163-E165 VanDerWaalsContact C-N 3.27Å; C163-E165 PolarHBondContact O-N 2.87Å; C163-K166 WeakPolarHBondContact O-CA 3.49Å; C163-K166 PolarHBondContact O-N 2.73Å
164	C	91.6	Very high	94.5	Very high	86 Å²	86	73 Å²	73	58%	0.581	38%	0.382	S	S	*	.	H	α-helix	trans	-58.6	-39.5	172.1	-57.9	0	0	0	0	112	E157 C160 S161 K166	E157-C164 PolarHBondContact O-SG 2.66Å; C160-C164 PolarHBondContact O-N 3.42Å; C160-C164 PolarHBondContact O-SG 2.7Å; C160-C164 VanDerWaalsContact O-SG 3.41Å; S161-C164 PolarHBondContact O-N 2.87Å; C164-K166 PolarHBondContact O-N 3.28Å
165	E	93.9	Very high	94.5	Very high	104 Å²	104	73.8 Å²	73.8	49%	0.486	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	3.7	173.8	-68	168	-144.7	0	0	113.6	S161 R162 C163 K167	S161-E165 WeakPolarHBondContact O-CB 3.43Å; S161-E165 VanDerWaalsContact O-CG 3.23Å; S161-E165 WeakPolarHBondContact O-CG 3.29Å; S161-E165 PolarHBondContact O-N 2.74Å; R162-E165 CarbonylContact O-C 3.55Å; R162-E165 PolarHBondContact O-N 3.38Å; C163-E165 VanDerWaalsContact C-N 3.27Å; C163-E165 PolarHBondContact O-N 2.87Å; E165-K167 HydrophobicContact CB-CD 3.98Å; E165-K167 HydrophobicContact CB-CG 4.12Å; E165-K167 PolarHBondContact O-N 2.75Å; E165-K167 VanDerWaalsContact O-N 3.16Å; E165-K167 WeakPolarHBondContact OE2-CD 3.38Å; E165-K167 VanDerWaalsContact OE2-CE 3.27Å; E165-K167 WeakPolarHBondContact OE2-CE 3.46Å; E165-K167 IonicContact OE2-NZ 2.77Å; E165-K167 PolarHBondContact OE2-NZ 3.03Å
166	K	93.8	Very high	94.5	Very high	199 Å²	199	74.6 Å²	74.6	87%	0.865	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.7	25.4	-176.1	-58.6	-175.6	179.1	-178.3	0	114.7	R162 C163 C164	R162-K166 PolarHBondContact O-N 3.44Å; C163-K166 WeakPolarHBondContact O-CA 3.49Å; C163-K166 PolarHBondContact O-N 2.73Å; C164-K166 PolarHBondContact O-N 3.28Å
167	K	95.1	Very high	94.6	Very high	123 Å²	123	74 Å²	74	54%	0.535	39%	0.391	S	S	.	.			trans	-87.9	159	176.5	-66.4	172.2	-175.1	169	0	111	R162 E165 C169	R162-K167 HydrophobicContact CB-CB 4.49Å; R162-K167 WeakPolarHBondContact O-CA 3.36Å; R162-K167 WeakPolarHBondContact O-CB 3.41Å; R162-K167 PolarHBondContact O-N 3.35Å; E165-K167 HydrophobicContact CB-CD 3.98Å; E165-K167 HydrophobicContact CB-CG 4.12Å; E165-K167 PolarHBondContact O-N 2.75Å; E165-K167 VanDerWaalsContact O-N 3.16Å; E165-K167 WeakPolarHBondContact OE2-CD 3.38Å; E165-K167 VanDerWaalsContact OE2-CE 3.27Å; E165-K167 WeakPolarHBondContact OE2-CE 3.46Å; E165-K167 IonicContact OE2-NZ 2.77Å; E165-K167 PolarHBondContact OE2-NZ 3.03Å; K167-C169 PolarHBondContact O-N 2.79Å
168	S	94.2	Very high	94.7	Very high	108 Å²	108	74.9 Å²	74.9	76%	0.755	40%	0.396	S	S	*	.			trans	-61.9	136	174.8	52.1	0	0	0	0	111.9
169	C	96.3	Very high	95	Very high	11 Å²	11	73.5 Å²	73.5	7%	0.074	39%	0.388	C	S	.	.			trans	-141.3	119.7	-177.7	-176.6	0	0	0	0	110	H156 R162 K167 N171 R172	H156-C169 PolarHBondContact NE2-SG 2.89Å; R162-C169 HydrophobicContact CB-CB 4.13Å; K167-C169 PolarHBondContact O-N 2.79Å; C169-N171 VanDerWaalsContact C-N 3.29Å; C169-N171 PolarHBondContact O-N 2.91Å; C169-R172 HydrophobicContact CB-CB 4.12Å; C169-R172 WeakPolarHBondContact O-CB 3.5Å; C169-R172 PolarHBondContact O-N 2.91Å; C169-R172 VanDerWaalsContact O-N 3.08Å
170	G	95.3	Very high	95.3	Very high	51 Å²	51	73.8 Å²	73.8	53%	0.526	39%	0.392	S	S	.	.	H	α-helix	trans	-60.4	-37.4	179.3	0	0	0	0	0	113	R172 N173 E174	G170-R172 PolarHBondContact O-N 2.97Å; G170-N173 WeakPolarHBondContact O-CB 3.39Å; G170-N173 PolarHBondContact O-N 2.8Å; G170-E174 PolarHBondContact O-N 3.13Å
171	N	94.9	Very high	95.5	Very high	84 Å²	84	75.7 Å²	75.7	45%	0.449	40%	0.401	S	S	.	.	H	α-helix	trans	-67.7	-20.8	177.2	-61.9	99	0	0	0	113.5	H156 C169 N173 E174 T175	H156-N171 WeakPolarHBondContact CE1-CB 3.44Å; H156-N171 WeakPolarHBondContact NE2-CB 3.48Å; C169-N171 VanDerWaalsContact C-N 3.29Å; C169-N171 PolarHBondContact O-N 2.91Å; N171-N173 VanDerWaalsContact C-N 3.27Å; N171-E174 PolarHBondContact O-N 3.31Å; N171-T175 PolarHBondContact O-N 3.44Å; N171-T175 PolarHBondContact O-OG1 2.93Å
172	R	95.6	Very high	95.7	Very high	104 Å²	104	74.7 Å²	74.7	39%	0.392	39%	0.389	S	S	.	.	H	α-helix	trans	-68.4	-29.5	170.1	-166.2	-175.2	-172.6	-164.4	8.3	111.5	E157 C169 G170 T175 P176	E157-R172 VanDerWaalsContact CD-NH2 3.34Å; E157-R172 HydrophobicContact CG-CG 4.16Å; E157-R172 IonicContact OE1-CZ 2.67Å; E157-R172 IonicContact OE1-NE 3.28Å; E157-R172 PolarHBondContact OE1-NE 3.38Å; E157-R172 IonicContact OE1-NH2 2.86Å; E157-R172 PolarHBondContact OE1-NH2 3.27Å; E157-R172 IonicContact OE2-CZ 2.72Å; E157-R172 VanDerWaalsContact OE2-CZ 3.23Å; E157-R172 IonicContact OE2-NE 3.23Å; E157-R172 PolarHBondContact OE2-NE 2.74Å; E157-R172 IonicContact OE2-NH2 2.92Å; E157-R172 PolarHBondContact OE2-NH2 3.06Å; C169-R172 HydrophobicContact CB-CB 4.12Å; C169-R172 WeakPolarHBondContact O-CB 3.5Å; C169-R172 PolarHBondContact O-N 2.91Å; C169-R172 VanDerWaalsContact O-N 3.08Å; G170-R172 PolarHBondContact O-N 2.97Å; R172-T175 CarbonylContact O-C 3.58Å; R172-P176 VanDerWaalsContact O-CA 3.23Å; R172-P176 WeakPolarHBondContact O-CA 3.41Å; R172-P176 WeakPolarHBondContact O-CB 3.33Å; R172-P176 WeakPolarHBondContact O-CD 3.43Å
173	N	93.6	Very high	95.7	Very high	139 Å²	139	73.7 Å²	73.7	74%	0.743	39%	0.394	S	S	*	.	H	α-helix	trans	-75.8	-30.7	177.5	-54.8	-5.8	0	0	0	111.8	G170 N171	G170-N173 WeakPolarHBondContact O-CB 3.39Å; G170-N173 PolarHBondContact O-N 2.8Å; N171-N173 VanDerWaalsContact C-N 3.27Å
174	E	94.6	Very high	95.8	Very high	129 Å²	129	80 Å²	80	60%	0.603	42%	0.416	S	S	*	.	H	α-helix	trans	-82.8	-37.2	176.3	-63.7	-176.3	150.5	0	0	112.9	G170 N171 F190	G170-E174 PolarHBondContact O-N 3.13Å; N171-E174 PolarHBondContact O-N 3.31Å; E174-F190 WeakPolarHBondContact O-CE1 3.31Å; E174-F190 WeakPolarHBondContact O-CZ 3.27Å
175	T	96.8	Very high	96	Very high	17 Å²	17	79.3 Å²	79.3	10%	0.104	40%	0.403	C	S	.	.	S	Bend	trans	-138	72.8	-176.3	54.6	0	0	0	0	110.2	F66 H156 N171 R172 F190	F66-T175 HydrophobicContact CB-CG2 4.11Å; F66-T175 HydrophobicContact CD1-CG2 4.28Å; F66-T175 HydrophobicContact CD2-CG2 4.15Å; F66-T175 HydrophobicContact CG-CG2 3.92Å; H156-T175 WeakPolarHBondContact CB-O 3.3Å; N171-T175 PolarHBondContact O-N 3.44Å; N171-T175 PolarHBondContact O-OG1 2.93Å; R172-T175 CarbonylContact O-C 3.58Å; T175-F190 HydrophobicContact CG2-CB 4.38Å; T175-F190 HydrophobicContact CG2-CD1 3.86Å; T175-F190 HydrophobicContact CG2-CE1 4.48Å; T175-F190 HydrophobicContact CG2-CG 4.4Å
176	P	97.1	Very high	96.2	Very high	19 Å²	19	77.5 Å²	77.5	12%	0.123	39%	0.394	C	S	.	.			trans	-65.7	156.8	174.8	26.9	-34.4	0	0	0	111.6	R172 D178 V180 F190	R172-P176 VanDerWaalsContact O-CA 3.23Å; R172-P176 WeakPolarHBondContact O-CA 3.41Å; R172-P176 WeakPolarHBondContact O-CB 3.33Å; R172-P176 WeakPolarHBondContact O-CD 3.43Å; P176-D178 WeakPolarHBondContact CG-O 3.25Å; P176-V180 HydrophobicContact CG-CG2 3.64Å; P176-F190 HydrophobicContact CG-CD2 4.04Å; P176-F190 HydrophobicContact CG-CE2 4.19Å
177	S	97.3	Very high	96.4	Very high	3 Å²	3	68 Å²	68	2%	0.021	35%	0.352	C	S	.	.	S	Bend	trans	-66.9	-42.1	165.4	-67.9	0	0	0	0	111.1	Y109 T155 E157	Y109-S177 WeakPolarHBondContact CE1-O 3.48Å; T155-S177 VanDerWaalsContact CB-OG 3.31Å; T155-S177 WeakPolarHBondContact CB-OG 3.32Å; T155-S177 PolarHBondContact OG1-OG 2.93Å; E157-S177 WeakPolarHBondContact CB-OG 3.25Å; E157-S177 VanDerWaalsContact CG-OG 3.26Å; E157-S177 WeakPolarHBondContact CG-OG 3.4Å; E157-S177 WeakPolarHBondContact OE1-CB 3.42Å; E157-S177 PolarHBondContact OE1-N 2.85Å; E157-S177 PolarHBondContact OE1-OG 2.97Å
178	D	97.8	Very high	96.6	Very high	54 Å²	54	64.8 Å²	64.8	29%	0.289	34%	0.339	S	S	.	.	S	Bend	trans	-70	131.2	-178.8	-55.2	-54.2	0	0	0	111	A87 F88 P176 V180	A87-D178 WeakPolarHBondContact CA-OD1 3.26Å; F88-D178 PolarHBondContact N-OD1 2.82Å; P176-D178 WeakPolarHBondContact CG-O 3.25Å; D178-V180 PolarHBondContact O-N 3.37Å
179	P	97.9	Very high	96.8	Very high	2 Å²	2	59.7 Å²	59.7	1%	0.013	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-60.5	133.8	176.8	-23.7	33.3	0	0	0	111.8	T86 Y109 K188 F189	T86-P179 WeakPolarHBondContact CB-O 3.07Å; T86-P179 HydrophobicContact CG2-CB 4.21Å; T86-P179 PolarHBondContact OG1-O 2.82Å; Y109-P179 VanDerWaalsContact CD1-CD 3.48Å; Y109-P179 HydrophobicContact CD1-CG 3.49Å; Y109-P179 VanDerWaalsContact CD1-CG 3.49Å; Y109-P179 HydrophobicContact CE1-CG 3.62Å; Y109-P179 HydrophobicContact CG-CG 4.1Å; P179-K188 WeakPolarHBondContact CA-O 3.43Å; P179-F189 HydrophobicContact CB-CD1 4.11Å; P179-F189 HydrophobicContact CB-CD2 4.47Å; P179-F189 HydrophobicContact CB-CE1 3.9Å; P179-F189 HydrophobicContact CB-CE2 4.26Å; P179-F189 HydrophobicContact CB-CG 4.38Å; P179-F189 HydrophobicContact CB-CZ 3.97Å; P179-F189 HydrophobicContact CG-CD1 3.71Å; P179-F189 HydrophobicContact CG-CE1 3.36Å; P179-F189 HydrophobicContact CG-CG 4.45Å; P179-F189 HydrophobicContact CG-CZ 3.85Å
180	V	98.2	Very high	96.9	Very high	57 Å²	57	60 Å²	60	35%	0.345	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	120.9	-178.7	176.9	0	0	0	0	110	P176 D178 I182 K188 F190	P176-V180 HydrophobicContact CG-CG2 3.64Å; D178-V180 PolarHBondContact O-N 3.37Å; V180-I182 HydrophobicContact CG1-CG1 4.27Å; V180-K188 HydrophobicContact CB-CB 4.42Å; V180-K188 PolarHBondContact N-O 2.77Å; V180-K188 PolarHBondContact O-N 3Å; V180-F190 HydrophobicContact CB-CE2 4.41Å; V180-F190 HydrophobicContact CG2-CE2 3.84Å
181	I	98.1	Very high	97	Very high	58 Å²	58	57.6 Å²	57.6	30%	0.297	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	130.8	171.3	-55.3	161.2	0	0	0	109	I83 T86 F186 L187	I83-I181 HydrophobicContact CB-CG1 4.38Å; I83-I181 HydrophobicContact CG2-CD1 4.2Å; I83-I181 HydrophobicContact CG2-CG1 4.23Å; T86-I181 HydrophobicContact CG2-CD1 4.09Å; T86-I181 HydrophobicContact CG2-CG1 3.76Å; I181-F186 CarbonylContact C-O 3.45Å; I181-F186 WeakPolarHBondContact CA-O 3.18Å; I181-L187 HydrophobicContact CB-CD2 4.38Å; I181-L187 HydrophobicContact CG1-CD2 3.72Å
182	I	97.5	Very high	97.2	Very high	58 Å²	58	55.4 Å²	55.4	30%	0.297	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	131.4	176.5	-58.3	174.3	0	0	0	107.4	V180 R184 F185 F186 K188	V180-I182 HydrophobicContact CG1-CG1 4.27Å; I182-R184 PolarHBondContact O-N 3.11Å; I182-F185 PolarHBondContact O-N 3.33Å; I182-F186 HydrophobicContact CB-CB 4.19Å; I182-F186 PolarHBondContact N-O 3.43Å; I182-F186 WeakPolarHBondContact O-CB 3.25Å; I182-F186 PolarHBondContact O-N 3.3Å; I182-K188 HydrophobicContact CD1-CB 3.85Å; I182-K188 HydrophobicContact CD1-CD 3.95Å
183	D	96.2	Very high	97.3	Very high	125 Å²	125	50.5 Å²	50.5	67%	0.668	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	46.6	33.2	178.6	-50.5	-34	0	0	0	114.7	F185 F186	D183-F185 WeakPolarHBondContact O-CD2 3.38Å; D183-F185 PolarHBondContact O-N 2.77Å; D183-F186 HydrophobicContact CB-CD2 4.1Å; D183-F186 HydrophobicContact CB-CE2 4.29Å
184	R	95.7	Very high	97.4	Very high	148 Å²	148	44.3 Å²	44.3	56%	0.558	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.1	-26.5	-179.9	-49.2	171.9	70.5	-179.7	-2.8	116.2	E82 I83 I182	E82-R184 VanDerWaalsContact CD-NE 3.25Å; E82-R184 HydrophobicContact CG-CB 3.67Å; E82-R184 WeakPolarHBondContact CG-O 3.15Å; E82-R184 IonicContact OE1-CZ 3.12Å; E82-R184 IonicContact OE1-NE 2.75Å; E82-R184 PolarHBondContact OE1-NE 2.77Å; E82-R184 IonicContact OE1-NH2 2.73Å; E82-R184 PolarHBondContact OE1-NH2 2.92Å; E82-R184 IonicContact OE2-CZ 3.3Å; E82-R184 VanDerWaalsContact OE2-CZ 3.3Å; E82-R184 IonicContact OE2-NE 3.48Å; E82-R184 PolarHBondContact OE2-NE 2.89Å; E82-R184 IonicContact OE2-NH2 2.8Å; E82-R184 PolarHBondContact OE2-NH2 3.27Å; I83-R184 PolarHBondContact N-O 3.43Å; I182-R184 PolarHBondContact O-N 3.11Å
185	F	96.9	Very high	97.5	Very high	73 Å²	73	38.7 Å²	38.7	32%	0.32	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.2	-11.8	-175.8	-64.1	-76.3	0	0	0	115	P80 E82 I182 D183	P80-F185 HydrophobicContact CB-CD1 3.91Å; P80-F185 HydrophobicContact CB-CE1 4.24Å; P80-F185 HydrophobicContact CG-CE1 4.45Å; E82-F185 HydrophobicContact CB-CD1 4.18Å; E82-F185 HydrophobicContact CB-CE1 3.73Å; E82-F185 HydrophobicContact CB-CZ 4.3Å; E82-F185 HydrophobicContact CG-CD1 4.46Å; E82-F185 HydrophobicContact CG-CE1 4.11Å; E82-F185 HydrophobicContact CG-CZ 4.29Å; I182-F185 PolarHBondContact O-N 3.33Å; D183-F185 WeakPolarHBondContact O-CD2 3.38Å; D183-F185 PolarHBondContact O-N 2.77Å
186	F	98.3	Very high	97.5	Very high	65 Å²	65	40 Å²	40	29%	0.285	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	140.4	-176.1	-52	-64.9	0	0	0	112.7	E54 V70 L71 A72 I181 I182 D183	E54-F186 HydrophobicContact CG-CD1 3.83Å; E54-F186 HydrophobicContact CG-CE1 3.81Å; V70-F186 HydrophobicContact CG1-CB 3.92Å; L71-F186 CarbonylContact O-C 3.55Å; L71-F186 WeakPolarHBondContact O-CA 3.49Å; A72-F186 HydrophobicContact CB-CD1 3.98Å; A72-F186 HydrophobicContact CB-CE1 4.05Å; I181-F186 CarbonylContact C-O 3.45Å; I181-F186 WeakPolarHBondContact CA-O 3.18Å; I182-F186 HydrophobicContact CB-CB 4.19Å; I182-F186 PolarHBondContact N-O 3.43Å; I182-F186 WeakPolarHBondContact O-CB 3.25Å; I182-F186 PolarHBondContact O-N 3.3Å; D183-F186 HydrophobicContact CB-CD2 4.1Å; D183-F186 HydrophobicContact CB-CE2 4.29Å
187	L	97.9	Very high	97.4	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	123.7	174.9	-70.2	-173.5	0	0	0	112.1	V70 L71 L73 I83 T86 L111 I181 F189	V70-L187 CarbonylContact C-O 3.06Å; V70-L187 VanDerWaalsContact CA-O 3.32Å; V70-L187 WeakPolarHBondContact CA-O 3.26Å; L71-L187 PolarHBondContact N-O 2.96Å; L71-L187 PolarHBondContact O-N 3.42Å; L73-L187 HydrophobicContact CD1-CD1 4.17Å; I83-L187 HydrophobicContact CB-CD2 4.12Å; I83-L187 HydrophobicContact CD1-CD1 4.49Å; I83-L187 HydrophobicContact CD1-CD2 4.19Å; I83-L187 HydrophobicContact CD1-CG 3.91Å; I83-L187 HydrophobicContact CG1-CD1 4.09Å; I83-L187 HydrophobicContact CG1-CD2 4.05Å; I83-L187 HydrophobicContact CG1-CG 3.95Å; I83-L187 HydrophobicContact CG2-CD2 4.04Å; T86-L187 HydrophobicContact CG2-CD1 4.42Å; T86-L187 HydrophobicContact CG2-CD2 3.56Å; L111-L187 HydrophobicContact CD1-CD1 3.91Å; L111-L187 HydrophobicContact CD2-CD1 3.85Å; I181-L187 HydrophobicContact CB-CD2 4.38Å; I181-L187 HydrophobicContact CG1-CD2 3.72Å; L187-F189 HydrophobicContact CB-CD2 4.38Å; L187-F189 HydrophobicContact CB-CE2 3.62Å; L187-F189 HydrophobicContact CB-CZ 4.33Å; L187-F189 HydrophobicContact CD1-CE2 4.27Å; L187-F189 HydrophobicContact CD1-CZ 4.19Å
188	K	98.4	Very high	97.1	Very high	56 Å²	56	40.9 Å²	40.9	24%	0.243	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	116.8	176.3	-175.6	179.7	178.3	-167.9	0	111.4	F69 V70 P179 V180 I182 F190	F69-K188 WeakPolarHBondContact O-CA 3.44Å; V70-K188 HydrophobicContact CG2-CB 4.07Å; V70-K188 HydrophobicContact CG2-CD 4.41Å; V70-K188 HydrophobicContact CG2-CG 3.98Å; P179-K188 WeakPolarHBondContact CA-O 3.43Å; V180-K188 HydrophobicContact CB-CB 4.42Å; V180-K188 PolarHBondContact N-O 2.77Å; V180-K188 PolarHBondContact O-N 3Å; I182-K188 HydrophobicContact CD1-CB 3.85Å; I182-K188 HydrophobicContact CD1-CD 3.95Å; K188-F190 HydrophobicContact CD-CE1 4.44Å; K188-F190 HydrophobicContact CD-CE2 4.04Å; K188-F190 HydrophobicContact CD-CZ 3.73Å; K188-F190 HydrophobicContact CG-CE2 4.02Å; K188-F190 HydrophobicContact CG-CZ 4.12Å
189	F	98.6	Very high	96.7	Very high	1 Å²	1	45 Å²	45	0%	0.004	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	146	179.9	-67.7	-103.4	0	0	0	110.9	H68 F69 L71 Y109 L125 V127 P179 L187	H68-F189 WeakPolarHBondContact CA-O 3.29Å; H68-F189 WeakPolarHBondContact CB-O 3.31Å; F69-F189 HydrophobicContact CD1-CB 4.48Å; F69-F189 HydrophobicContact CD2-CB 4.23Å; F69-F189 AromaticContact CD2-CD2 3.99Å; F69-F189 HydrophobicContact CD2-CD2 3.99Å; F69-F189 HydrophobicContact CD2-CG 4.37Å; F69-F189 HydrophobicContact CE1-CB 3.97Å; F69-F189 HydrophobicContact CE2-CB 3.7Å; F69-F189 HydrophobicContact CE2-CD1 4.41Å; F69-F189 AromaticContact CE2-CD2 3.36Å; F69-F189 HydrophobicContact CE2-CD2 3.36Å; F69-F189 HydrophobicContact CE2-CE2 4.12Å; F69-F189 AromaticContact CE2-CG 3.56Å; F69-F189 HydrophobicContact CE2-CG 3.56Å; F69-F189 HydrophobicContact CZ-CB 3.54Å; F69-F189 HydrophobicContact CZ-CD1 4.26Å; F69-F189 AromaticContact CZ-CD2 3.99Å; F69-F189 HydrophobicContact CZ-CD2 3.99Å; F69-F189 AromaticContact CZ-CG 3.66Å; F69-F189 HydrophobicContact CZ-CG 3.66Å; F69-F189 PolarHBondContact O-N 3.48Å; F69-F189 VanDerWaalsContact O-N 3.12Å; L71-F189 HydrophobicContact CD1-CD2 4.21Å; L71-F189 HydrophobicContact CD1-CE2 3.6Å; L71-F189 HydrophobicContact CD1-CZ 4.26Å; L71-F189 HydrophobicContact CG-CD2 4.32Å; L71-F189 HydrophobicContact CG-CE2 4.05Å; Y109-F189 HydrophobicContact CD1-CE1 4.43Å; Y109-F189 HydrophobicContact CD2-CD1 4.28Å; Y109-F189 AromaticContact CD2-CE1 3.73Å; Y109-F189 HydrophobicContact CD2-CE1 3.73Å; Y109-F189 HydrophobicContact CE1-CD1 4.44Å; Y109-F189 HydrophobicContact CE1-CE1 4.43Å; Y109-F189 AromaticContact CE2-CD1 3.76Å; Y109-F189 HydrophobicContact CE2-CD1 3.76Å; Y109-F189 AromaticContact CE2-CE1 3.7Å; Y109-F189 HydrophobicContact CE2-CE1 3.7Å; Y109-F189 HydrophobicContact CG-CE1 4.08Å; Y109-F189 AromaticContact CZ-CD1 3.85Å; L125-F189 HydrophobicContact CD2-CE1 4.36Å; L125-F189 HydrophobicContact CD2-CZ 3.74Å; V127-F189 HydrophobicContact CG2-CD1 4.07Å; V127-F189 HydrophobicContact CG2-CE1 3.96Å; P179-F189 HydrophobicContact CB-CD1 4.11Å; P179-F189 HydrophobicContact CB-CD2 4.47Å; P179-F189 HydrophobicContact CB-CE1 3.9Å; P179-F189 HydrophobicContact CB-CE2 4.26Å; P179-F189 HydrophobicContact CB-CG 4.38Å; P179-F189 HydrophobicContact CB-CZ 3.97Å; P179-F189 HydrophobicContact CG-CD1 3.71Å; P179-F189 HydrophobicContact CG-CE1 3.36Å; P179-F189 HydrophobicContact CG-CG 4.45Å; P179-F189 HydrophobicContact CG-CZ 3.85Å; L187-F189 HydrophobicContact CB-CD2 4.38Å; L187-F189 HydrophobicContact CB-CE2 3.62Å; L187-F189 HydrophobicContact CB-CZ 4.33Å; L187-F189 HydrophobicContact CD1-CE2 4.27Å; L187-F189 HydrophobicContact CD1-CZ 4.19Å
190	F	98.4	Very high	96.1	Very high	17 Å²	17	50.5 Å²	50.5	8%	0.075	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	113.3	174.5	-63.8	-90.5	0	0	0	110.2	H68 E174 T175 P176 V180 K188	H68-F190 HydrophobicContact CB-CD1 4.03Å; H68-F190 HydrophobicContact CB-CE1 4.3Å; E174-F190 WeakPolarHBondContact O-CE1 3.31Å; E174-F190 WeakPolarHBondContact O-CZ 3.27Å; T175-F190 HydrophobicContact CG2-CB 4.38Å; T175-F190 HydrophobicContact CG2-CD1 3.86Å; T175-F190 HydrophobicContact CG2-CE1 4.48Å; T175-F190 HydrophobicContact CG2-CG 4.4Å; P176-F190 HydrophobicContact CG-CD2 4.04Å; P176-F190 HydrophobicContact CG-CE2 4.19Å; V180-F190 HydrophobicContact CB-CE2 4.41Å; V180-F190 HydrophobicContact CG2-CE2 3.84Å; K188-F190 HydrophobicContact CD-CE1 4.44Å; K188-F190 HydrophobicContact CD-CE2 4.04Å; K188-F190 HydrophobicContact CD-CZ 3.73Å; K188-F190 HydrophobicContact CG-CE2 4.02Å; K188-F190 HydrophobicContact CG-CZ 4.12Å
191	L	98.3	Very high	95.5	Very high	1 Å²	1	52.9 Å²	52.9	1%	0.005	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	162.4	-173.3	-73.7	173.3	0	0	0	111	F66 F67 F69 T107 V127 L153 T155	F66-L191 CarbonylContact C-O 3.59Å; F66-L191 VanDerWaalsContact CA-O 3.29Å; F66-L191 WeakPolarHBondContact CA-O 3.41Å; F67-L191 HydrophobicContact CD1-CB 4.26Å; F67-L191 WeakPolarHBondContact CD1-O 3.41Å; F67-L191 HydrophobicContact CE1-CB 3.61Å; F67-L191 HydrophobicContact CE2-CB 4.46Å; F67-L191 HydrophobicContact CZ-CB 3.73Å; F67-L191 HydrophobicContact CZ-CD1 4.4Å; F67-L191 PolarHBondContact N-O 2.97Å; F67-L191 PolarHBondContact O-N 3.33Å; F69-L191 HydrophobicContact CE1-CD1 4.19Å; T107-L191 HydrophobicContact CG2-CD2 3.83Å; V127-L191 HydrophobicContact CB-CD1 4.46Å; V127-L191 HydrophobicContact CG1-CD1 3.87Å; L153-L191 HydrophobicContact CD1-CD1 4.31Å; L153-L191 HydrophobicContact CD2-CB 4.48Å; L153-L191 HydrophobicContact CD2-CD1 4.36Å; T155-L191 HydrophobicContact CG2-CD2 4.22Å
192	K	97.7	Very high	94.8	Very high	38 Å²	38	53.5 Å²	53.5	17%	0.165	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	123	171.5	179.2	175.5	-178	171.4	0	109.7	K63 S64 F66 L154 M159	K63-K192 WeakPolarHBondContact O-CE 3.48Å; S64-K192 VanDerWaalsContact O-CE 3.25Å; S64-K192 WeakPolarHBondContact O-CE 3.16Å; S64-K192 PolarHBondContact O-NZ 2.92Å; S64-K192 VanDerWaalsContact O-NZ 3.11Å; F66-K192 HydrophobicContact CD1-CB 3.93Å; F66-K192 HydrophobicContact CE1-CB 4.03Å; F66-K192 HydrophobicContact CG-CB 4.49Å; L154-K192 HydrophobicContact CB-CB 4.47Å; L154-K192 PolarHBondContact N-O 2.93Å; L154-K192 PolarHBondContact O-N 2.79Å; M159-K192 HydrophobicContact CE-CB 4.02Å; M159-K192 HydrophobicContact CE-CD 3.52Å; M159-K192 HydrophobicContact CE-CG 4.42Å; M159-K192 HydrophobicContact SD-CD 3.68Å
193	C	97.8	Very high	94.1	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	122.8	172.3	-174.3	0	0	0	0	109.9	L61 F67 L129 V152 Q195 V233	L61-C193 HydrophobicContact CD2-CB 4.03Å; F67-C193 HydrophobicContact CE1-CB 4.12Å; L129-C193 HydrophobicContact CD1-CB 4.16Å; L129-C193 WeakPolarHBondContact CD1-SG 3.48Å; V152-C193 CarbonylContact O-C 3.56Å; V152-C193 WeakPolarHBondContact O-CA 3.43Å; C193-Q195 PolarHBondContact SG-O 3.32Å; C193-Q195 VanDerWaalsContact SG-O 3.37Å; C193-V233 HydrophobicContact CB-CG1 4.14Å; C193-V233 HydrophobicContact CB-CG2 4.11Å
194	N	96.6	Very high	93.4	Very high	10 Å²	10	55 Å²	55	5%	0.053	30%	0.304	C	S	.	.			trans	-111.6	5.9	-176.4	175.9	58.2	0	0	0	112.5	K63 Y140 M149 R151 V152 L154	K63-N194 WeakPolarHBondContact CE-O 3.1Å; K63-N194 WeakPolarHBondContact CE-OD1 3.32Å; K63-N194 PolarHBondContact NZ-O 3.05Å; K63-N194 PolarHBondContact NZ-OD1 3.08Å; Y140-N194 VanDerWaalsContact CE2-ND2 3.26Å; Y140-N194 WeakPolarHBondContact CE2-ND2 3.22Å; M149-N194 PolarHBondContact O-ND2 2.81Å; R151-N194 WeakPolarHBondContact O-CB 3.32Å; R151-N194 PolarHBondContact O-ND2 3.43Å; V152-N194 PolarHBondContact O-N 3.07Å; L154-N194 HydrophobicContact CD1-CB 3.79Å; L154-N194 HydrophobicContact CG-CB 4.31Å
195	Q	96.4	Very high	92.5	Very high	11 Å²	11	58.7 Å²	58.7	5%	0.051	32%	0.318	C	S	.	.	S	Bend	trans	-101.1	141.3	164.3	-176.6	51	41.3	0	0	110.3	I138 V152 C193 F210 V233	I138-Q195 HydrophobicContact CG2-CB 4.3Å; I138-Q195 HydrophobicContact CG2-CG 3.73Å; V152-Q195 HydrophobicContact CB-CB 4.42Å; V152-Q195 HydrophobicContact CG1-CB 4.05Å; V152-Q195 HydrophobicContact CG2-CB 4.11Å; C193-Q195 PolarHBondContact SG-O 3.32Å; C193-Q195 VanDerWaalsContact SG-O 3.37Å; Q195-F210 HydrophobicContact CB-CE2 4.35Å; Q195-F210 HydrophobicContact CG-CE2 4.31Å; Q195-F210 HydrophobicContact CG-CZ 4.04Å; Q195-V233 VanDerWaalsContact O-CG1 3.28Å; Q195-V233 WeakPolarHBondContact O-CG1 3.27Å
196	N	95.6	Very high	91.5	Very high	44 Å²	44	61 Å²	61	24%	0.235	33%	0.333	C	S	.	.			trans	-85	147.8	169.9	-72.5	12.7	0	0	0	109.5	K63 L198 F210	K63-N196 WeakPolarHBondContact CD-OD1 3.35Å; N196-L198 VanDerWaalsContact C-N 3.31Å; N196-L198 WeakPolarHBondContact CB-O 3.4Å; N196-L198 PolarHBondContact ND2-O 3.32Å; N196-F210 WeakPolarHBondContact O-CZ 3.36Å
197	C	95	Very high	90.6	Very high	2 Å²	2	64.8 Å²	64.8	1%	0.014	35%	0.354	C	S	.	.	S	Bend	trans	-65.3	-36.9	165.3	-65.5	0	0	0	0	111.9	R208 F210 F232 V233	C197-R208 HydrophobicContact CB-CB 4.41Å; C197-R208 VanDerWaalsContact CB-O 3.25Å; C197-R208 WeakPolarHBondContact CB-O 3.26Å; C197-R208 VanDerWaalsContact O-CD 3.27Å; C197-R208 WeakPolarHBondContact O-CD 3.24Å; C197-F210 HydrophobicContact CB-CE1 4.26Å; C197-F210 HydrophobicContact CB-CZ 4.17Å; C197-F210 VanDerWaalsContact SG-CD2 3.57Å; C197-F210 VanDerWaalsContact SG-CE2 3.56Å; C197-F232 HydrophobicContact CB-CD2 3.93Å; C197-F232 HydrophobicContact CB-CE2 4.04Å; C197-V233 PolarHBondContact N-O 3.49Å; C197-V233 PolarHBondContact SG-N 3.15Å
198	L	92.5	Very high	90.4	Very high	39 Å²	39	67.3 Å²	67.3	20%	0.204	36%	0.364	C	S	.	.			trans	-101	125.3	177.5	-52.9	-177.8	0	0	0	111	N196 P204 D206 F232	N196-L198 VanDerWaalsContact C-N 3.31Å; N196-L198 WeakPolarHBondContact CB-O 3.4Å; N196-L198 PolarHBondContact ND2-O 3.32Å; L198-P204 HydrophobicContact CD1-CB 3.74Å; L198-P204 HydrophobicContact CD1-CG 3.59Å; L198-D206 WeakPolarHBondContact CD2-O 3.29Å; L198-F232 HydrophobicContact CD1-CE2 4.1Å; L198-F232 HydrophobicContact CD1-CZ 3.85Å; L198-F232 HydrophobicContact CD2-CE2 4.26Å; L198-F232 HydrophobicContact CG-CE2 3.91Å; L198-F232 HydrophobicContact CG-CZ 4.11Å
199	K	87.8	Confident	90.3	Very high	140 Å²	140	68 Å²	68	61%	0.609	37%	0.365	S	S	*	.			trans	-74.8	-43.3	-178.5	-53.6	-175.8	-177.9	-145.7	0	112.2	E141	E141-K199 WeakPolarHBondContact OE1-CE 3.13Å; E141-K199 IonicContact OE1-NZ 2.67Å; E141-K199 PolarHBondContact OE1-NZ 3.16Å; E141-K199 WeakPolarHBondContact OE2-CD 3.39Å; E141-K199 WeakPolarHBondContact OE2-CE 3.37Å; E141-K199 IonicContact OE2-NZ 3.87Å; E141-K199 PolarHBondContact OE2-NZ 3.24Å
200	T	86.3	Confident	90.3	Very high	118 Å²	118	68 Å²	68	72%	0.724	36%	0.364	S	S	*	.	S	Bend	trans	-104.2	161.9	-172.3	47.9	0	0	0	0	112.7
201	A	84.8	Confident	90.3	Very high	106 Å²	106	68.3 Å²	68.3	88%	0.876	37%	0.366	S	S	*	.	S	Bend	trans	-85.6	144.4	166.9	0	0	0	0	0	110.5
202	G	84.2	Confident	90.3	Very high	71 Å²	71	68.2 Å²	68.2	73%	0.732	37%	0.366	S	S	*	.	S	Bend	trans	150.8	-170.7	-179.5	0	0	0	0	0	111.7
203	N	82.6	Confident	90.3	Very high	145 Å²	145	66.5 Å²	66.5	78%	0.775	36%	0.358	S	S	*	.	S	Bend	trans	-74.9	129.4	164.4	-170.8	46.5	0	0	0	108.8	R205	N203-R205 PolarHBondContact O-N 2.78Å
204	P	80.7	Confident	90.3	Very high	70 Å²	70	66.5 Å²	66.5	46%	0.455	36%	0.358	S	S	.	.			trans	-57.6	125	178.1	-23.6	34.1	0	0	0	111.3	L198	L198-P204 HydrophobicContact CD1-CB 3.74Å; L198-P204 HydrophobicContact CD1-CG 3.59Å
205	R	78	Confident	90.3	Very high	225 Å²	225	66 Å²	66	85%	0.849	36%	0.356	S	S	*	.			trans	-103.8	-52	166.3	-66.4	-174.2	177.5	-167.8	-1.2	109.4	N203 M207	N203-R205 PolarHBondContact O-N 2.78Å; R205-M207 PolarHBondContact O-N 3.06Å
206	D	75.8	Confident	90.2	Very high	121 Å²	121	67.5 Å²	67.5	65%	0.647	37%	0.366	S	S	*	.	S	Bend	trans	-76.5	121.5	177.4	-42	-47.6	0	0	0	110.1	L198 R208	L198-D206 WeakPolarHBondContact CD2-O 3.29Å; D206-R208 PolarHBondContact O-N 3.12Å
207	M	79.9	Confident	90.1	Very high	146 Å²	146	68.7 Å²	68.7	72%	0.719	38%	0.375	S	S	*	.			trans	-90.3	40.2	-179.4	-67.6	-172.3	63.8	0	0	112.8	R205 R209	R205-M207 PolarHBondContact O-N 3.06Å; M207-R209 PolarHBondContact O-N 2.85Å
208	R	93.6	Very high	89.9	Confident	53 Å²	53	69.2 Å²	69.2	20%	0.2	38%	0.378	C	S	.	.			trans	-53.9	131.1	177.8	-162.3	-177	-167.2	-174.5	6.1	110	D131 E141 C197 D206 F210	D131-R208 VanDerWaalsContact OD2-CG 3.26Å; D131-R208 WeakPolarHBondContact OD2-CG 3.46Å; D131-R208 IonicContact OD2-CZ 3.72Å; D131-R208 IonicContact OD2-NE 3.94Å; D131-R208 PolarHBondContact OD2-NE 2.92Å; D131-R208 IonicContact OD2-NH2 2.73Å; D131-R208 PolarHBondContact OD2-NH2 3.49Å; E141-R208 IonicContact OE1-NH1 2.7Å; E141-R208 PolarHBondContact OE1-NH1 3.24Å; C197-R208 HydrophobicContact CB-CB 4.41Å; C197-R208 VanDerWaalsContact CB-O 3.25Å; C197-R208 WeakPolarHBondContact CB-O 3.26Å; C197-R208 VanDerWaalsContact O-CD 3.27Å; C197-R208 WeakPolarHBondContact O-CD 3.24Å; D206-R208 PolarHBondContact O-N 3.12Å; R208-F210 HydrophobicContact CG-CE1 4.28Å
209	R	96.5	Very high	89.7	Confident	70 Å²	70	70 Å²	70	26%	0.264	38%	0.382	S	S	.	.			trans	-136.2	157	174	-67.4	176.2	177.4	-95	-3.7	109	S132 M207 N230 F232	S132-R209 WeakPolarHBondContact CB-O 3.44Å; S132-R209 PolarHBondContact N-O 2.88Å; S132-R209 PolarHBondContact OG-N 3.12Å; S132-R209 PolarHBondContact OG-O 3.02Å; M207-R209 PolarHBondContact O-N 2.85Å; R209-N230 HydrophobicContact CB-CB 4.23Å; R209-F232 HydrophobicContact CG-CB 4.35Å; R209-F232 HydrophobicContact CG-CD2 4.46Å
210	F	98.2	Very high	89.7	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	149.5	179	-55.5	-24.4	0	0	0	110.2	L129 I130 I138 Q195 N196 C197 R208 M231 V233	L129-F210 HydrophobicContact CD1-CB 4.37Å; L129-F210 HydrophobicContact CD1-CD2 3.87Å; L129-F210 HydrophobicContact CD1-CG 4.46Å; I130-F210 CarbonylContact O-C 3.01Å; I130-F210 VanDerWaalsContact O-CA 3.29Å; I130-F210 WeakPolarHBondContact O-CA 3.44Å; I138-F210 HydrophobicContact CD1-CD1 3.41Å; I138-F210 VanDerWaalsContact CD1-CD1 3.41Å; I138-F210 HydrophobicContact CD1-CE1 3.4Å; I138-F210 HydrophobicContact CD1-CG 4.33Å; I138-F210 HydrophobicContact CD1-CZ 4.29Å; I138-F210 HydrophobicContact CG1-CD1 3.61Å; I138-F210 HydrophobicContact CG1-CE1 3.75Å; I138-F210 HydrophobicContact CG1-CG 4.06Å; I138-F210 HydrophobicContact CG1-CZ 4.28Å; I138-F210 HydrophobicContact CG2-CE1 4.01Å; I138-F210 HydrophobicContact CG2-CE2 4.3Å; I138-F210 HydrophobicContact CG2-CZ 3.8Å; Q195-F210 HydrophobicContact CB-CE2 4.35Å; Q195-F210 HydrophobicContact CG-CE2 4.31Å; Q195-F210 HydrophobicContact CG-CZ 4.04Å; N196-F210 WeakPolarHBondContact O-CZ 3.36Å; C197-F210 HydrophobicContact CB-CE1 4.26Å; C197-F210 HydrophobicContact CB-CZ 4.17Å; C197-F210 VanDerWaalsContact SG-CD2 3.57Å; C197-F210 VanDerWaalsContact SG-CE2 3.56Å; R208-F210 HydrophobicContact CG-CE1 4.28Å; F210-M231 PolarHBondContact N-O 3.25Å; F210-M231 PolarHBondContact O-N 2.83Å; F210-V233 HydrophobicContact CD2-CB 4.32Å; F210-V233 HydrophobicContact CD2-CG2 3.71Å; F210-V233 HydrophobicContact CE2-CB 4.25Å; F210-V233 HydrophobicContact CE2-CG2 4.12Å
211	Q	98.4	Very high	89.6	Confident	24 Å²	24	63.2 Å²	63.2	11%	0.112	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	145.1	165.6	-59.2	179.7	-85.9	0	0	108.4	L129 I130 V227 S228 N230	L129-Q211 WeakPolarHBondContact CA-O 3.28Å; I130-Q211 HydrophobicContact CG1-CB 4.09Å; I130-Q211 PolarHBondContact N-O 3.47Å; I130-Q211 PolarHBondContact O-N 2.9Å; Q211-V227 HydrophobicContact CB-CG1 3.58Å; Q211-V227 HydrophobicContact CG-CG1 4.18Å; Q211-S228 WeakPolarHBondContact CG-O 3.02Å; Q211-S228 PolarHBondContact NE2-O 2.67Å; Q211-N230 VanDerWaalsContact CG-OD1 3.22Å; Q211-N230 WeakPolarHBondContact CG-OD1 3.05Å
212	V	98.4	Very high	89.6	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	126.2	168.3	-177.8	0	0	0	0	107.2	F53 P57 F67 F69 V127 L129 V227 S228	F53-V212 HydrophobicContact CE1-CB 4.48Å; F53-V212 HydrophobicContact CZ-CB 4.2Å; F53-V212 HydrophobicContact CZ-CG1 4.24Å; P57-V212 HydrophobicContact CB-CG2 4.31Å; P57-V212 HydrophobicContact CG-CG2 3.97Å; F67-V212 HydrophobicContact CE2-CG2 4.08Å; F69-V212 HydrophobicContact CD1-CG2 4.45Å; F69-V212 HydrophobicContact CE1-CG1 3.89Å; F69-V212 HydrophobicContact CE1-CG2 4.34Å; F69-V212 HydrophobicContact CZ-CG1 3.98Å; V127-V212 HydrophobicContact CG1-CG1 3.55Å; L129-V212 HydrophobicContact CD2-CB 4.31Å; L129-V212 HydrophobicContact CD2-CG2 3.72Å; V212-V227 CarbonylContact O-C 3.58Å; V212-V227 WeakPolarHBondContact O-CA 3.26Å; V212-S228 PolarHBondContact N-OG 2.89Å; V212-S228 PolarHBondContact O-N 3.35Å
213	V	98.1	Very high	89.7	Confident	1 Å²	1	63.3 Å²	63.3	1%	0.006	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	145.2	172.9	63.4	0	0	0	0	110.1	R128 I130 V220 V224 V227	R128-V213 HydrophobicContact CB-CG1 3.86Å; R128-V213 PolarHBondContact N-O 2.9Å; R128-V213 VanDerWaalsContact N-O 3.13Å; R128-V213 WeakPolarHBondContact O-CG1 3.26Å; R128-V213 PolarHBondContact O-N 3.02Å; I130-V213 HydrophobicContact CD1-CB 4.06Å; I130-V213 HydrophobicContact CD1-CG2 4.49Å; I130-V213 HydrophobicContact CG1-CB 4.16Å; I130-V213 HydrophobicContact CG1-CG1 4.29Å; I130-V213 HydrophobicContact CG2-CB 4.34Å; I130-V213 HydrophobicContact CG2-CG1 3.65Å; V213-V220 HydrophobicContact CG1-CB 4.27Å; V213-V220 HydrophobicContact CG1-CG1 3.62Å; V213-V220 HydrophobicContact CG2-CG1 4.49Å; V213-V224 HydrophobicContact CG2-CB 3.8Å; V213-V224 HydrophobicContact CG2-CG1 3.57Å; V213-V224 HydrophobicContact CG2-CG2 4.21Å; V213-V227 HydrophobicContact CG2-CG2 4.1Å
214	L	97.7	Very high	90.4	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	128.8	-175.3	-64.2	166.9	0	0	0	109.6	A51 F53 F69 L71 Y126 V127 V224 L225 A226	A51-L214 HydrophobicContact CB-CD1 4.25Å; F53-L214 HydrophobicContact CE1-CD1 4.08Å; F53-L214 HydrophobicContact CE2-CD1 3.69Å; F53-L214 HydrophobicContact CZ-CD1 3.38Å; F53-L214 HydrophobicContact CZ-CG 4.05Å; F69-L214 HydrophobicContact CE2-CD2 4.37Å; L71-L214 HydrophobicContact CD1-CD1 3.43Å; L71-L214 VanDerWaalsContact CD1-CD1 3.43Å; L71-L214 HydrophobicContact CD1-CD2 3.96Å; L71-L214 HydrophobicContact CD1-CG 4.33Å; L71-L214 HydrophobicContact CD2-CD1 3.5Å; L71-L214 VanDerWaalsContact CD2-CD1 3.5Å; L71-L214 HydrophobicContact CG-CD1 4.11Å; Y126-L214 WeakPolarHBondContact O-CA 3.45Å; V127-L214 HydrophobicContact CB-CD2 4.32Å; V127-L214 HydrophobicContact CG1-CD2 4.22Å; V127-L214 HydrophobicContact CG2-CD2 3.76Å; L214-V224 CarbonylContact O-C 3.58Å; L214-L225 HydrophobicContact CB-CB 4.37Å; L214-L225 PolarHBondContact O-N 3.32Å; L214-A226 HydrophobicContact CD1-CB 4.2Å; L214-A226 PolarHBondContact N-O 2.54Å
215	S	96.1	Very high	91.1	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	151.2	-173.3	49.8	0	0	0	0	111.5	Y126 T217	Y126-S215 PolarHBondContact N-O 2.78Å; Y126-S215 PolarHBondContact O-N 2.92Å; S215-T217 VanDerWaalsContact CB-O 3.27Å; S215-T217 WeakPolarHBondContact CB-O 3.35Å; S215-T217 PolarHBondContact OG-O 2.82Å
216	T	94.5	Very high	92	Very high	43 Å²	43	45.4 Å²	45.4	26%	0.264	25%	0.246	S	C	.	.	S	Bend	trans	-81.2	-2.9	172.2	50.5	0	0	0	0	113	L48 L225	L48-T216 HydrophobicContact CB-CG2 4.49Å; T216-L225 HydrophobicContact CG2-CD1 3.98Å; T216-L225 HydrophobicContact CG2-CD2 4.35Å; T216-L225 HydrophobicContact CG2-CG 4.35Å
217	T	92.9	Very high	93.1	Very high	68 Å²	68	42.3 Å²	42.3	42%	0.417	23%	0.231	S	C	.	.	S	Bend	trans	-133.4	166.2	173.9	75.4	0	0	0	0	109.9	Y126 S215 N219	Y126-T217 WeakPolarHBondContact CD2-O 3.17Å; S215-T217 VanDerWaalsContact CB-O 3.27Å; S215-T217 WeakPolarHBondContact CB-O 3.35Å; S215-T217 PolarHBondContact OG-O 2.82Å; T217-N219 PolarHBondContact O-N 3.03Å; T217-N219 PolarHBondContact OG1-N 3.46Å
218	V	91.2	Very high	94	Very high	13 Å²	13	35.4 Å²	35.4	8%	0.079	20%	0.197	C	C	.	.	S	Bend	trans	-63.1	-25.3	176.2	178	0	0	0	0	112.7	V92 K96 Q98 Y126 R128	V92-V218 HydrophobicContact CG1-CG1 3.64Å; K96-V218 WeakPolarHBondContact O-CG1 3.28Å; Q98-V218 HydrophobicContact CG-CB 4.47Å; Y126-V218 HydrophobicContact CD1-CG2 3.81Å; Y126-V218 HydrophobicContact CE1-CG2 3.43Å; Y126-V218 VanDerWaalsContact CE1-CG2 3.43Å; Y126-V218 HydrophobicContact CE2-CG2 4.44Å; Y126-V218 HydrophobicContact CG-CG2 4.44Å; R128-V218 VanDerWaalsContact CD-O 3.32Å; R128-V218 WeakPolarHBondContact CD-O 3.44Å; R128-V218 PolarHBondContact NH1-O 3.26Å
219	N	88.9	Confident	94.2	Very high	55 Å²	55	37.4 Å²	37.4	29%	0.294	21%	0.212	S	C	.	.			trans	-69.6	143.1	-176.3	-157.9	-45.7	0	0	0	111.8	Q98 T217 D221	Q98-N219 PolarHBondContact OE1-ND2 3.28Å; Q98-N219 VanDerWaalsContact OE1-ND2 3.13Å; T217-N219 PolarHBondContact O-N 3.03Å; T217-N219 PolarHBondContact OG1-N 3.46Å; N219-D221 PolarHBondContact OD1-N 2.88Å
220	V	87.6	Confident	94.3	Very high	13 Å²	13	37.4 Å²	37.4	8%	0.079	22%	0.217	C	C	.	.	S	Bend	trans	-120.8	-12.8	-179.6	-60.9	0	0	0	0	113.7	R128 I130 P137 V213 G222	R128-V220 HydrophobicContact CB-CG1 4.28Å; R128-V220 HydrophobicContact CG-CG1 4.43Å; I130-V220 HydrophobicContact CG2-CB 4.09Å; I130-V220 HydrophobicContact CG2-CG1 4.36Å; I130-V220 HydrophobicContact CG2-CG2 4Å; P137-V220 HydrophobicContact CB-CG2 4.39Å; P137-V220 HydrophobicContact CG-CG2 4.43Å; V213-V220 HydrophobicContact CG1-CB 4.27Å; V213-V220 HydrophobicContact CG1-CG1 3.62Å; V213-V220 HydrophobicContact CG2-CG1 4.49Å; V220-G222 VanDerWaalsContact C-N 3.34Å
221	D	84.5	Confident	94.3	Very high	104 Å²	104	37.4 Å²	37.4	56%	0.556	22%	0.217	S	C	*	.	S	Bend	trans	-84.2	-12	177.6	-55.2	-72.7	0	0	0	112.5	Q136 N219	Q136-D221 PolarHBondContact NE2-OD1 2.96Å; N219-D221 PolarHBondContact OD1-N 2.88Å
222	G	83	Confident	94.2	Very high	48 Å²	48	37.4 Å²	37.4	50%	0.495	22%	0.217	S	C	.	.	S	Bend	trans	-99	-147.6	179.2	0	0	0	0	0	114.4	V220 V224	V220-G222 VanDerWaalsContact C-N 3.34Å; G222-V224 PolarHBondContact O-N 3.18Å
223	H	88.1	Confident	94.1	Very high	130 Å²	130	37.4 Å²	37.4	60%	0.602	22%	0.217	S	C	*	.			trans	-71.5	114.1	177.8	179.7	-75.2	0	0	0	111.7	S49	S49-H223 PolarHBondContact O-CE1 3.16Å
224	V	95.4	Very high	94	Very high	41 Å²	41	38.5 Å²	38.5	25%	0.248	22%	0.222	C	C	.	.			trans	-109.9	144.3	177	-60.6	0	0	0	0	110.8	V213 L214 G222 V227	V213-V224 HydrophobicContact CG2-CB 3.8Å; V213-V224 HydrophobicContact CG2-CG1 3.57Å; V213-V224 HydrophobicContact CG2-CG2 4.21Å; L214-V224 CarbonylContact O-C 3.58Å; G222-V224 PolarHBondContact O-N 3.18Å; V224-V227 HydrophobicContact CG2-CG2 3.96Å
225	L	96.6	Very high	93.8	Very high	7 Å²	7	42.8 Å²	42.8	4%	0.037	25%	0.245	C	C	.	.	S	Bend	trans	-69.3	-36.4	-179.3	-66.1	175.9	0	0	0	112.4	L48 A51 L125 L214 T216	L48-L225 HydrophobicContact CB-CD2 4.02Å; L48-L225 HydrophobicContact CD1-CD1 4.08Å; A51-L225 HydrophobicContact CB-CB 3.97Å; A51-L225 PolarHBondContact N-O 3.5Å; L125-L225 HydrophobicContact CD1-CD1 3.73Å; L214-L225 HydrophobicContact CB-CB 4.37Å; L214-L225 PolarHBondContact O-N 3.32Å; T216-L225 HydrophobicContact CG2-CD1 3.98Å; T216-L225 HydrophobicContact CG2-CD2 4.35Å; T216-L225 HydrophobicContact CG2-CG 4.35Å
226	A	97.2	Very high	93.7	Very high	17 Å²	17	46.8 Å²	46.8	14%	0.14	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.4	162.9	175	0	0	0	0	0	112.2	A51 F53 L214	A51-A226 HydrophobicContact CB-CB 3.96Å; A51-A226 WeakPolarHBondContact O-CB 3.15Å; F53-A226 HydrophobicContact CD2-CB 4.1Å; F53-A226 HydrophobicContact CE2-CB 3.77Å; L214-A226 HydrophobicContact CD1-CB 4.2Å; L214-A226 PolarHBondContact N-O 2.54Å
227	V	98.2	Very high	93.5	Very high	56 Å²	56	48 Å²	48	34%	0.339	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	136.7	170.2	-177.4	0	0	0	0	108.7	I130 Q211 V212 V213 V224	I130-V227 HydrophobicContact CD1-CG1 4.06Å; I130-V227 HydrophobicContact CD1-CG2 4.4Å; Q211-V227 HydrophobicContact CB-CG1 3.58Å; Q211-V227 HydrophobicContact CG-CG1 4.18Å; V212-V227 CarbonylContact O-C 3.58Å; V212-V227 WeakPolarHBondContact O-CA 3.26Å; V213-V227 HydrophobicContact CG2-CG2 4.1Å; V224-V227 HydrophobicContact CG2-CG2 3.96Å
228	S	98.4	Very high	93.4	Very high	1 Å²	1	51.9 Å²	51.9	1%	0.007	29%	0.287	C	S	.	.			trans	-80.7	171.8	-176.7	80.6	0	0	0	0	114.2	P57 Q211 V212	P57-S228 WeakPolarHBondContact CG-OG 3.36Å; Q211-S228 WeakPolarHBondContact CG-O 3.02Å; Q211-S228 PolarHBondContact NE2-O 2.67Å; V212-S228 PolarHBondContact N-OG 2.89Å; V212-S228 PolarHBondContact O-N 3.35Å
229	D	98.4	Very high	93.3	Very high	95 Å²	95	54.8 Å²	54.8	51%	0.508	30%	0.3	S	S	.	.			trans	-60	161.9	161.9	-75.1	-19.5	0	0	0	112.5	Q56 M231	Q56-D229 HydrophobicContact CB-CB 4.47Å; Q56-D229 VanDerWaalsContact CD-CG 3.43Å; Q56-D229 HydrophobicContact CG-CB 4.28Å; Q56-D229 WeakPolarHBondContact CG-OD2 3.25Å; Q56-D229 PolarHBondContact NE2-OD1 3.34Å; Q56-D229 PolarHBondContact NE2-OD2 3.12Å; D229-M231 PolarHBondContact O-N 3.14Å
230	N	98	Very high	93	Very high	70 Å²	70	55.9 Å²	55.9	37%	0.374	32%	0.324	S	S	.	.			trans	-72.3	114.3	-175.5	-74.2	-38.8	0	0	0	113.6	S59 S132 R209 Q211	S59-N230 WeakPolarHBondContact CA-O 3.26Å; S132-N230 WeakPolarHBondContact CB-OD1 3.35Å; R209-N230 HydrophobicContact CB-CB 4.23Å; Q211-N230 VanDerWaalsContact CG-OD1 3.22Å; Q211-N230 WeakPolarHBondContact CG-OD1 3.05Å
231	M	97.8	Very high	92.9	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	35%	0.354	C	S	.	.	B	Isolated β-bridge	trans	-96.1	128.2	172.9	173.6	169.4	63.5	0	0	111.8	P58 L61 F67 L129 F210 D229 V233	P58-M231 VanDerWaalsContact O-CG 3.3Å; P58-M231 WeakPolarHBondContact O-CG 3.4Å; L61-M231 HydrophobicContact CB-CG 4.11Å; L61-M231 HydrophobicContact CB-SD 3.93Å; L61-M231 HydrophobicContact CD2-SD 3.6Å; L61-M231 VanDerWaalsContact CD2-SD 3.6Å; L61-M231 HydrophobicContact CG-SD 4.4Å; F67-M231 HydrophobicContact CD2-SD 4.26Å; F67-M231 HydrophobicContact CE1-CE 4.49Å; F67-M231 HydrophobicContact CE2-CE 4.14Å; F67-M231 HydrophobicContact CE2-SD 4.39Å; F67-M231 HydrophobicContact CG-SD 4.41Å; F67-M231 HydrophobicContact CZ-CE 4.09Å; L129-M231 HydrophobicContact CD1-CE 4.17Å; L129-M231 HydrophobicContact CD2-CE 4.1Å; F210-M231 PolarHBondContact N-O 3.25Å; F210-M231 PolarHBondContact O-N 2.83Å; D229-M231 PolarHBondContact O-N 3.14Å; M231-V233 HydrophobicContact CE-CG2 4.05Å; M231-V233 HydrophobicContact CG-CG2 3.84Å; M231-V233 HydrophobicContact SD-CG2 4.13Å
232	F	97.1	Very high	92.6	Very high	24 Å²	24	70.9 Å²	70.9	11%	0.105	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	108.4	172.9	177.1	-112.8	0	0	0	111.5	S59 N60 L61 C197 L198 R209 H234 H239	S59-F232 PolarHBondContact O-N 2.97Å; N60-F232 CarbonylContact C-O 3.47Å; N60-F232 WeakPolarHBondContact CA-O 3.13Å; L61-F232 PolarHBondContact N-O 2.92Å; C197-F232 HydrophobicContact CB-CD2 3.93Å; C197-F232 HydrophobicContact CB-CE2 4.04Å; L198-F232 HydrophobicContact CD1-CE2 4.1Å; L198-F232 HydrophobicContact CD1-CZ 3.85Å; L198-F232 HydrophobicContact CD2-CE2 4.26Å; L198-F232 HydrophobicContact CG-CE2 3.91Å; L198-F232 HydrophobicContact CG-CZ 4.11Å; R209-F232 HydrophobicContact CG-CB 4.35Å; R209-F232 HydrophobicContact CG-CD2 4.46Å; F232-H234 HydrophobicContact CD1-CB 4.47Å; F232-H234 AromaticContact CD1-CD2 3.84Å; F232-H234 HydrophobicContact CE1-CB 3.95Å; F232-H234 HydrophobicContact CZ-CB 4.43Å; F232-H239 AromaticContact CD1-CE1 3.99Å
233	V	97.2	Very high	92.2	Very high	0 Å²	0	73.3 Å²	73.3	0%	0	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	118.7	-176.7	-168.7	0	0	0	0	111.5	L61 K63 C193 Q195 C197 F210 M231	L61-V233 HydrophobicContact CB-CG2 4.39Å; L61-V233 HydrophobicContact CD2-CG2 4.38Å; L61-V233 WeakPolarHBondContact O-CA 3.48Å; K63-V233 HydrophobicContact CB-CG1 4.14Å; C193-V233 HydrophobicContact CB-CG1 4.14Å; C193-V233 HydrophobicContact CB-CG2 4.11Å; Q195-V233 VanDerWaalsContact O-CG1 3.28Å; Q195-V233 WeakPolarHBondContact O-CG1 3.27Å; C197-V233 PolarHBondContact N-O 3.49Å; C197-V233 PolarHBondContact SG-N 3.15Å; F210-V233 HydrophobicContact CD2-CB 4.32Å; F210-V233 HydrophobicContact CD2-CG2 3.71Å; F210-V233 HydrophobicContact CE2-CB 4.25Å; F210-V233 HydrophobicContact CE2-CG2 4.12Å; M231-V233 HydrophobicContact CE-CG2 4.05Å; M231-V233 HydrophobicContact CG-CG2 3.84Å; M231-V233 HydrophobicContact SD-CG2 4.13Å
234	H	94.6	Very high	91.3	Very high	23 Å²	23	77.5 Å²	77.5	11%	0.106	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	164.4	-176.1	60.5	84.1	0	0	0	112.4	L61 R62 K63 F232 N236 H239	L61-H234 PolarHBondContact O-CD2 3.47Å; L61-H234 VanDerWaalsContact O-CD2 3.28Å; L61-H234 PolarHBondContact O-N 3.48Å; R62-H234 CarbonylContact C-O 3.59Å; R62-H234 VanDerWaalsContact CA-O 3.25Å; R62-H234 WeakPolarHBondContact CA-O 3.43Å; K63-H234 PolarHBondContact N-O 3.49Å; F232-H234 HydrophobicContact CD1-CB 4.47Å; F232-H234 AromaticContact CD1-CD2 3.84Å; F232-H234 HydrophobicContact CE1-CB 3.95Å; F232-H234 HydrophobicContact CZ-CB 4.43Å; H234-N236 PolarHBondContact CE1-O 3.34Å; H234-N236 VanDerWaalsContact CE1-O 3.26Å; H234-N236 PolarHBondContact ND1-N 3.2Å; H234-N236 PolarHBondContact ND1-O 3.42Å; H234-H239 AromaticContact CD2-CG 3.94Å; H234-H239 WeakPolarHBondContact CE1-CB 3.16Å; H234-H239 AromaticContact CE1-CG 3.7Å; H234-H239 AromaticContact NE2-CD2 3.53Å; H234-H239 AromaticContact NE2-CG 3.5Å
235	N	94.9	Very high	89.8	Confident	91 Å²	91	85.7 Å²	85.7	49%	0.487	42%	0.424	S	S	.	.			trans	-108.3	8.2	168.3	-158.3	12	0	0	0	113.8
236	N	92.9	Very high	88	Confident	83 Å²	83	93.1 Å²	93.1	44%	0.444	46%	0.463	S	S	.	.			trans	-75.6	123.8	177.8	-173.9	1.5	0	0	0	111.6	H234 K238 H239	H234-N236 PolarHBondContact CE1-O 3.34Å; H234-N236 VanDerWaalsContact CE1-O 3.26Å; H234-N236 PolarHBondContact ND1-N 3.2Å; H234-N236 PolarHBondContact ND1-O 3.42Å; N236-K238 WeakPolarHBondContact OD1-CA 3.14Å; N236-K238 WeakPolarHBondContact OD1-CB 2.99Å; N236-K238 PolarHBondContact OD1-N 3.21Å; N236-H239 HydrophobicContact CB-CB 4.36Å
237	S	91.7	Very high	86.1	Confident	69 Å²	69	94.6 Å²	94.6	48%	0.483	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-13.5	173.8	58.3	0	0	0	0	114.1
238	K	90.4	Very high	84.1	Confident	150 Å²	150	95 Å²	95	65%	0.652	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	3.3	177.1	-54.6	178.4	-177.3	176.8	0	112.9	N236 R241	N236-K238 WeakPolarHBondContact OD1-CA 3.14Å; N236-K238 WeakPolarHBondContact OD1-CB 2.99Å; N236-K238 PolarHBondContact OD1-N 3.21Å; K238-R241 WeakPolarHBondContact O-CB 3.17Å; K238-R241 PolarHBondContact O-N 2.73Å; K238-R241 VanDerWaalsContact O-N 3.12Å
239	H	88.4	Confident	82	Confident	73 Å²	73	97 Å²	97	34%	0.338	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	145	177.2	-177.3	87.2	0	0	0	111.1	N60 F232 H234 N236 R241	N60-H239 PolarHBondContact OD1-NE2 3.44Å; F232-H239 AromaticContact CD1-CE1 3.99Å; H234-H239 AromaticContact CD2-CG 3.94Å; H234-H239 WeakPolarHBondContact CE1-CB 3.16Å; H234-H239 AromaticContact CE1-CG 3.7Å; H234-H239 AromaticContact NE2-CD2 3.53Å; H234-H239 AromaticContact NE2-CG 3.5Å; N236-H239 HydrophobicContact CB-CB 4.36Å; H239-R241 PolarHBondContact O-N 2.66Å
240	G	83.2	Confident	80.2	Confident	78 Å²	78	101.5 Å²	101.5	80%	0.804	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.9	-14.5	-173.7	0	0	0	0	0	115.5
241	R	85.4	Confident	79.1	Confident	189 Å²	189	100 Å²	100	71%	0.713	50%	0.501	S	S	*	.	P	Polyproline II helix	trans	-86.4	128.6	177.2	-55	-175.2	-179.8	-167.5	-4.5	109.8	K238 H239	K238-R241 WeakPolarHBondContact O-CB 3.17Å; K238-R241 PolarHBondContact O-N 2.73Å; K238-R241 VanDerWaalsContact O-N 3.12Å; H239-R241 PolarHBondContact O-N 2.66Å
242	R	77.9	Confident	78.6	Confident	244 Å²	244	104.2 Å²	104.2	92%	0.921	53%	0.527	S	S	*	.	P	Polyproline II helix	trans	-57.4	144.3	167.1	-65.4	-177.7	-179.5	179.7	0.1	109.2	R244	R242-R244 PolarHBondContact O-N 2.89Å
243	A	74.9	Confident	78.4	Confident	99 Å²	99	103.2 Å²	103.2	82%	0.818	52%	0.523	S	S	*	.	P	Polyproline II helix	trans	-60.6	121.9	174.3	0	0	0	0	0	109.4	R245	A243-R245 PolarHBondContact O-N 2.69Å
244	R	69.3	Low	78.2	Confident	217 Å²	217	105.1 Å²	105.1	82%	0.819	54%	0.536	S	S	*	.	P	Polyproline II helix	trans	-64.4	130	165.6	-64.5	-171.1	-176.5	-169.7	-0.6	107.2	R242 L246	R242-R244 PolarHBondContact O-N 2.89Å; R244-L246 PolarHBondContact O-N 3.33Å
245	R	62.9	Low	78.3	Confident	213 Å²	213	105 Å²	105	80%	0.804	54%	0.536	S	S	*	.	P	Polyproline II helix	trans	-61.9	129.8	168.9	-77.5	-176.2	172.3	156.8	-3.4	107.8	A243 D247	A243-R245 PolarHBondContact O-N 2.69Å; R245-D247 PolarHBondContact O-N 3.28Å
246	L	59.8	Low	78.4	Confident	163 Å²	163	107.2 Å²	107.2	85%	0.853	54%	0.541	S	S	*	.			trans	-81.9	50	170.2	-63.3	174.3	0	0	0	109.7	R244	R244-L246 PolarHBondContact O-N 3.33Å
247	D	55.7	Low	78.6	Confident	49 Å²	49	105.4 Å²	105.4	26%	0.262	54%	0.538	S	S	.	.			trans	-99.8	115.5	164.2	-72.9	-49	0	0	0	106.2	R245 S249 K321	R245-D247 PolarHBondContact O-N 3.28Å; D247-S249 PolarHBondContact O-N 3.48Å; D247-K321 IonicContact OD1-NZ 3.49Å; D247-K321 PolarHBondContact OD1-NZ 2.76Å
248	P	57.9	Low	78.9	Confident	64 Å²	64	103 Å²	103	42%	0.416	52%	0.519	S	S	.	.			trans	-65.5	3.8	173.5	26.8	-33.8	0	0	0	113.7	E250 A251 F279	P248-E250 PolarHBondContact O-N 2.67Å; P248-A251 PolarHBondContact O-N 2.86Å; P248-F279 HydrophobicContact CB-CB 4.48Å; P248-F279 HydrophobicContact CB-CD1 4.09Å; P248-F279 HydrophobicContact CB-CG 4.2Å; P248-F279 HydrophobicContact CG-CB 4.09Å; P248-F279 HydrophobicContact CG-CD1 3.67Å; P248-F279 HydrophobicContact CG-CD2 3.65Å; P248-F279 HydrophobicContact CG-CE1 3.97Å; P248-F279 HydrophobicContact CG-CE2 3.96Å; P248-F279 HydrophobicContact CG-CG 3.51Å; P248-F279 HydrophobicContact CG-CZ 4.12Å
249	S	54.5	Low	79.2	Confident	42 Å²	42	99.1 Å²	99.1	29%	0.294	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	9.9	-179.5	-175.2	0	0	0	0	115.6	D247 A251	D247-S249 PolarHBondContact O-N 3.48Å; S249-A251 PolarHBondContact O-N 3.39Å
250	E	60	Low	79.6	Confident	191 Å²	191	98.6 Å²	98.6	89%	0.893	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-23.2	166.6	-75.1	-174.7	172.4	0	0	111.3	P248	P248-E250 PolarHBondContact O-N 2.67Å
251	A	74.1	Confident	80.2	Confident	37 Å²	37	97.9 Å²	97.9	31%	0.306	50%	0.497	S	S	.	.	S	Bend	trans	-113.8	132.5	163.9	0	0	0	0	0	110.2	P248 S249 N277	P248-A251 PolarHBondContact O-N 2.86Å; S249-A251 PolarHBondContact O-N 3.39Å; A251-N277 HydrophobicContact CB-CB 3.95Å; A251-N277 VanDerWaalsContact CB-CG 3.46Å
252	T	87.4	Confident	80.6	Confident	90 Å²	90	94.3 Å²	94.3	55%	0.552	49%	0.488	S	S	*	.			trans	-78.5	129.4	179.9	-57.1	0	0	0	0	110.2	N277 F325	T252-N277 PolarHBondContact O-ND2 3.16Å; T252-F325 HydrophobicContact CG2-CD1 3.92Å
253	P	93.1	Very high	81.4	Confident	2 Å²	2	83.4 Å²	83.4	1%	0.013	45%	0.452	C	S	.	.			trans	-70.1	131.6	174.8	29.8	-34.8	0	0	0	110.9	D276 F278 F279 L282 L318 F325	P253-D276 WeakPolarHBondContact CA-O 3.39Å; P253-F278 HydrophobicContact CB-CD1 4.2Å; P253-F279 HydrophobicContact CG-CE1 4.36Å; P253-L282 HydrophobicContact CB-CD2 4.18Å; P253-L282 HydrophobicContact CG-CD1 4.35Å; P253-L318 HydrophobicContact CB-CD1 3.84Å; P253-L318 HydrophobicContact CG-CD1 4.39Å; P253-F325 HydrophobicContact CG-CB 4.2Å; P253-F325 HydrophobicContact CG-CD1 4.08Å; P253-F325 HydrophobicContact CG-CD2 3.69Å; P253-F325 HydrophobicContact CG-CE1 4.36Å; P253-F325 HydrophobicContact CG-CE2 4.02Å; P253-F325 HydrophobicContact CG-CG 3.73Å; P253-F325 HydrophobicContact CG-CZ 4.33Å
254	C	93.8	Very high	82.2	Confident	40 Å²	40	84.7 Å²	84.7	27%	0.27	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	148.1	-178.2	71.6	0	0	0	0	111.7	G275 D276 F278	C254-G275 WeakPolarHBondContact O-CA 3.47Å; C254-D276 PolarHBondContact N-O 2.94Å; C254-D276 VanDerWaalsContact N-O 3.16Å; C254-D276 PolarHBondContact O-N 2.8Å; C254-F278 WeakPolarHBondContact O-CE1 3.46Å; C254-F278 WeakPolarHBondContact O-CZ 3.17Å
255	I	96.9	Very high	83.4	Confident	22 Å²	22	75.8 Å²	75.8	11%	0.113	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	136.4	170.1	-60.8	173	0	0	0	108.3	I258 I273 V316 L318 C326	I255-I258 HydrophobicContact CG2-CD1 4.37Å; I255-I258 HydrophobicContact CG2-CG1 4.05Å; I255-I273 HydrophobicContact CB-CG2 4.44Å; I255-I273 HydrophobicContact CD1-CG2 4.28Å; I255-I273 HydrophobicContact CG1-CG2 3.9Å; I255-I273 HydrophobicContact CG2-CG2 3.92Å; I255-V316 HydrophobicContact CD1-CG1 4.23Å; I255-V316 WeakPolarHBondContact CD1-O 3.33Å; I255-L318 HydrophobicContact CD1-CD2 3.91Å; I255-L318 HydrophobicContact CD1-CG 3.97Å; I255-L318 HydrophobicContact CG1-CD1 3.93Å; I255-L318 HydrophobicContact CG1-CD2 4.02Å; I255-L318 HydrophobicContact CG1-CG 3.94Å; I255-C326 HydrophobicContact CD1-CB 4.47Å; I255-C326 PolarHBondContact N-SG 3.46Å; I255-C326 VanDerWaalsContact N-SG 3.43Å
256	K	96.1	Very high	84.8	Confident	136 Å²	136	70.4 Å²	70.4	59%	0.591	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.3	-41	171.8	-70.9	174.7	177.8	167.7	0	112.2	I274 D276	K256-I274 PolarHBondContact N-O 3.14Å; K256-D276 WeakPolarHBondContact CE-OD2 3.42Å; K256-D276 IonicContact NZ-OD1 3.22Å; K256-D276 PolarHBondContact NZ-OD1 3Å; K256-D276 IonicContact NZ-OD2 2.66Å; K256-D276 PolarHBondContact NZ-OD2 2.93Å
257	A	96.7	Very high	86.4	Confident	46 Å²	46	63.1 Å²	63.1	38%	0.38	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	162.1	179.9	0	0	0	0	0	111.6	I274	A257-I274 HydrophobicContact CB-CB 4.34Å; A257-I274 PolarHBondContact N-O 3.15Å; A257-I274 PolarHBondContact O-N 3.02Å
258	I	97.7	Very high	88.2	Confident	17 Å²	17	62.7 Å²	62.7	9%	0.087	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	127.5	176	-59.8	-170	0	0	0	107.2	I255 V271 I273 V316 F333	I255-I258 HydrophobicContact CG2-CD1 4.37Å; I255-I258 HydrophobicContact CG2-CG1 4.05Å; I258-V271 HydrophobicContact CG2-CG1 3.36Å; I258-I273 HydrophobicContact CD1-CD1 4.33Å; I258-I273 HydrophobicContact CD1-CG1 4.32Å; I258-I273 HydrophobicContact CG1-CG1 4.14Å; I258-I273 HydrophobicContact CG1-CG2 4.3Å; I258-I273 HydrophobicContact CG2-CG1 4.35Å; I258-V316 HydrophobicContact CD1-CB 3.5Å; I258-V316 HydrophobicContact CD1-CG1 3.72Å; I258-V316 HydrophobicContact CD1-CG2 3.7Å; I258-F333 HydrophobicContact CG2-CD2 4.21Å
259	S	96.4	Very high	89.9	Confident	69 Å²	69	61.6 Å²	61.6	48%	0.483	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	122.5	-174.4	-170.7	0	0	0	0	111.8	I272	S259-I272 PolarHBondContact N-O 3.36Å; S259-I272 PolarHBondContact O-N 3.07Å
260	P	96.9	Very high	91.9	Very high	62 Å²	62	64.3 Å²	64.3	40%	0.403	37%	0.373	S	S	.	.	S	Bend	cis	-62.4	154.7	-11.2	28.8	-36.1	0	0	0	111.9	E262 V271 F333	P260-E262 VanDerWaalsContact C-N 3.3Å; P260-V271 HydrophobicContact CG-CG2 4.19Å; P260-F333 WeakPolarHBondContact O-CE2 3.37Å
261	S	96	Very high	93.7	Very high	64 Å²	64	55.2 Å²	55.2	45%	0.448	33%	0.331	S	S	.	.	S	Bend	trans	-86.3	2	177.3	53.8	0	0	0	0	113.7	F333 I334	S261-F333 CarbonylContact O-C 3.59Å; S261-F333 VanDerWaalsContact O-CA 3.31Å; S261-F333 WeakPolarHBondContact O-CA 3.4Å; S261-I334 PolarHBondContact O-N 2.98Å
262	E	94.5	Very high	94.8	Very high	113 Å²	113	56.8 Å²	56.8	53%	0.528	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	162.3	-178.5	62.8	178.3	-146.9	0	0	112.2	P260 F333 I334	P260-E262 VanDerWaalsContact C-N 3.3Å; E262-F333 WeakPolarHBondContact O-CZ 3.45Å; E262-I334 CarbonylContact C-O 3.57Å; E262-I334 WeakPolarHBondContact CA-O 3.18Å; E262-I334 HydrophobicContact CB-CB 3.96Å
263	G	93.8	Very high	95.3	Very high	15 Å²	15	52.5 Å²	52.5	16%	0.155	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	179	178.2	177.2	0	0	0	0	0	113.7	F333 I334 Y335 T336	G263-F333 VanDerWaalsContact N-CZ 3.33Å; G263-I334 PolarHBondContact N-O 2.99Å; G263-Y335 CarbonylContact O-C 3.6Å; G263-Y335 WeakPolarHBondContact O-CA 3.31Å; G263-T336 PolarHBondContact O-N 3.3Å
264	W	93.5	Very high	95.5	Very high	126 Å²	126	56 Å²	56	48%	0.477	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	146	-172.4	-59.5	115.6	0	0	0	113.9	T266 G267 T336 L338	W264-T266 WeakPolarHBondContact CB-OG1 3.27Å; W264-T266 PolarHBondContact O-N 3.2Å; W264-G267 PolarHBondContact O-N 3.46Å; W264-T336 WeakPolarHBondContact CA-O 3.38Å; W264-T336 HydrophobicContact CZ3-CG2 3.98Å; W264-L338 HydrophobicContact CD2-CG 4.43Å; W264-L338 HydrophobicContact CE3-CD2 4.12Å; W264-L338 HydrophobicContact CE3-CG 3.82Å; W264-L338 HydrophobicContact CH2-CD2 3.47Å; W264-L338 VanDerWaalsContact CH2-CD2 3.47Å; W264-L338 HydrophobicContact CH2-CG 4.13Å; W264-L338 HydrophobicContact CZ2-CD2 4.09Å; W264-L338 HydrophobicContact CZ3-CD2 3.48Å; W264-L338 VanDerWaalsContact CZ3-CD2 3.48Å; W264-L338 HydrophobicContact CZ3-CG 3.66Å
265	T	93.8	Very high	95.6	Very high	30 Å²	30	54.2 Å²	54.2	18%	0.184	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54	-20.2	170.9	42.5	0	0	0	0	114.6	G267 R308 P311 T336 A337	T265-G267 PolarHBondContact O-N 3.24Å; T265-R308 WeakPolarHBondContact CA-O 3.47Å; T265-R308 WeakPolarHBondContact CB-O 3.36Å; T265-R308 VanDerWaalsContact CG2-O 3.23Å; T265-R308 WeakPolarHBondContact CG2-O 3.39Å; T265-R308 CarbonylContact O-C 3.58Å; T265-R308 PolarHBondContact O-N 2.79Å; T265-R308 VanDerWaalsContact O-O 3.11Å; T265-P311 HydrophobicContact CG2-CB 4.31Å; T265-T336 PolarHBondContact N-O 3.33Å; T265-A337 HydrophobicContact CG2-CB 3.85Å
266	T	92.9	Very high	95.5	Very high	100 Å²	100	55 Å²	55	61%	0.613	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-21.8	171.8	55.6	0	0	0	0	113.8	W264 P307	W264-T266 WeakPolarHBondContact CB-OG1 3.27Å; W264-T266 PolarHBondContact O-N 3.2Å; T266-P307 WeakPolarHBondContact O-CB 3.4Å; T266-P307 WeakPolarHBondContact O-CG 3.41Å
267	G	92.8	Very high	95.3	Very high	10 Å²	10	51.6 Å²	51.6	10%	0.103	31%	0.306	C	S	.	.			trans	66.4	-158.5	-167.4	0	0	0	0	0	112.3	W264 T265 A269 T305	W264-G267 PolarHBondContact O-N 3.46Å; T265-G267 PolarHBondContact O-N 3.24Å; G267-A269 VanDerWaalsContact C-N 3.28Å; G267-A269 PolarHBondContact O-N 2.93Å; G267-T305 CarbonylContact C-O 3.52Å; G267-T305 VanDerWaalsContact CA-O 3.31Å; G267-T305 WeakPolarHBondContact CA-O 3.4Å; G267-T305 WeakPolarHBondContact CA-OG1 3.24Å
268	G	93.1	Very high	95.2	Very high	41 Å²	41	49.8 Å²	49.8	42%	0.423	29%	0.289	S	S	.	.			trans	83.2	-15.6	177.8	0	0	0	0	0	115.9	Q304 T305	G268-Q304 WeakPolarHBondContact O-CG 3.31Å; G268-Q304 PolarHBondContact O-NE2 3.07Å; G268-T305 PolarHBondContact N-O 2.82Å; G268-T305 PolarHBondContact N-OG1 2.88Å
269	A	94	Very high	95	Very high	40 Å²	40	50.1 Å²	50.1	33%	0.331	29%	0.29	S	S	.	.			trans	-71	144.2	178.4	0	0	0	0	0	112.3	G267 Q304 T305	G267-A269 VanDerWaalsContact C-N 3.28Å; G267-A269 PolarHBondContact O-N 2.93Å; A269-Q304 CarbonylContact O-C 3.55Å; A269-Q304 WeakPolarHBondContact O-CA 3.2Å; A269-T305 PolarHBondContact N-OG1 3.31Å; A269-T305 VanDerWaalsContact N-OG1 3.11Å; A269-T305 PolarHBondContact O-N 2.84Å; A269-T305 PolarHBondContact O-OG1 2.88Å
270	M	96.1	Very high	94.8	Very high	99 Å²	99	53.1 Å²	53.1	49%	0.488	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	130.5	176.5	-60	-53.1	-62.6	0	0	110.6	R302 Q304	M270-R302 HydrophobicContact CE-CG 3.46Å; M270-R302 VanDerWaalsContact CE-CG 3.46Å; M270-Q304 HydrophobicContact CE-CB 4.36Å; M270-Q304 HydrophobicContact SD-CB 3.83Å; M270-Q304 HydrophobicContact SD-CG 3.82Å
271	V	97.2	Very high	94.5	Very high	1 Å²	1	51.9 Å²	51.9	1%	0.006	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	139.3	-178.3	170.9	0	0	0	0	109.4	I258 P260 I273 V303 T305 F333	I258-V271 HydrophobicContact CG2-CG1 3.36Å; P260-V271 HydrophobicContact CG-CG2 4.19Å; V271-I273 HydrophobicContact CG1-CG1 4.41Å; V271-V303 PolarHBondContact N-O 3.34Å; V271-V303 PolarHBondContact O-N 2.92Å; V271-T305 HydrophobicContact CB-CG2 4.43Å; V271-T305 HydrophobicContact CG2-CG2 3.51Å; V271-F333 HydrophobicContact CG2-CD2 4.48Å; V271-F333 HydrophobicContact CG2-CE2 3.74Å; V271-F333 HydrophobicContact CG2-CZ 4.37Å
272	I	97.6	Very high	94.4	Very high	70 Å²	70	48.9 Å²	48.9	36%	0.359	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	122.5	172.5	-57.9	176.4	0	0	0	108	S259 I274 I296 A300 I301	S259-I272 PolarHBondContact N-O 3.36Å; S259-I272 PolarHBondContact O-N 3.07Å; I272-I274 HydrophobicContact CG2-CG1 4.13Å; I272-I296 HydrophobicContact CD1-CD1 4.44Å; I272-I296 HydrophobicContact CG1-CD1 4.5Å; I272-I296 HydrophobicContact CG2-CD1 4.44Å; I272-A300 HydrophobicContact CG2-CB 4.24Å; I272-I301 WeakPolarHBondContact CA-O 3.28Å
273	I	97.8	Very high	94.4	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	127.4	171.3	-58.7	-177.8	0	0	0	107.6	I255 I258 V271 F278 V284 A300 I301 V303 V316	I255-I273 HydrophobicContact CB-CG2 4.44Å; I255-I273 HydrophobicContact CD1-CG2 4.28Å; I255-I273 HydrophobicContact CG1-CG2 3.9Å; I255-I273 HydrophobicContact CG2-CG2 3.92Å; I258-I273 HydrophobicContact CD1-CD1 4.33Å; I258-I273 HydrophobicContact CD1-CG1 4.32Å; I258-I273 HydrophobicContact CG1-CG1 4.14Å; I258-I273 HydrophobicContact CG1-CG2 4.3Å; I258-I273 HydrophobicContact CG2-CG1 4.35Å; V271-I273 HydrophobicContact CG1-CG1 4.41Å; I273-F278 HydrophobicContact CG2-CZ 4.14Å; I273-F278 WeakPolarHBondContact O-CE2 3.2Å; I273-V284 HydrophobicContact CD1-CB 4.45Å; I273-V284 HydrophobicContact CD1-CG1 3.59Å; I273-V284 HydrophobicContact CD1-CG2 3.97Å; I273-A300 WeakPolarHBondContact O-CA 3.45Å; I273-I301 HydrophobicContact CB-CD1 4.29Å; I273-I301 HydrophobicContact CB-CG1 3.79Å; I273-I301 HydrophobicContact CG2-CG1 4.4Å; I273-I301 PolarHBondContact N-O 2.9Å; I273-I301 PolarHBondContact O-N 3.47Å; I273-V303 HydrophobicContact CD1-CG2 3.93Å; I273-V303 HydrophobicContact CG1-CG2 4.2Å; I273-V316 HydrophobicContact CD1-CG1 3.75Å
274	I	97.7	Very high	94.5	Very high	76 Å²	76	45 Å²	45	39%	0.39	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	137.2	-177.5	-56.5	174.8	0	0	0	108.5	K256 A257 I272 H299	K256-I274 PolarHBondContact N-O 3.14Å; A257-I274 HydrophobicContact CB-CB 4.34Å; A257-I274 PolarHBondContact N-O 3.15Å; A257-I274 PolarHBondContact O-N 3.02Å; I272-I274 HydrophobicContact CG2-CG1 4.13Å; I274-H299 CarbonylContact C-O 3.57Å; I274-H299 WeakPolarHBondContact CA-O 3.5Å
275	G	96.1	Very high	94.7	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.01	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-176.7	-150.2	-172.7	0	0	0	0	0	113.2	C254 H299	C254-G275 WeakPolarHBondContact O-CA 3.47Å; G275-H299 PolarHBondContact N-O 2.98Å; G275-H299 VanDerWaalsContact O-CA 3.24Å; G275-H299 WeakPolarHBondContact O-CA 3.48Å; G275-H299 VanDerWaalsContact O-CB 3.27Å; G275-H299 WeakPolarHBondContact O-CB 3.36Å; G275-H299 PolarHBondContact O-ND1 3.12Å; G275-H299 VanDerWaalsContact O-ND1 3.07Å
276	D	94.1	Very high	94.8	Very high	38 Å²	38	38.3 Å²	38.3	20%	0.203	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	159.9	172.6	-54.8	-39.3	0	0	0	111.8	P253 C254 K256 F278 P298 H299	P253-D276 WeakPolarHBondContact CA-O 3.39Å; C254-D276 PolarHBondContact N-O 2.94Å; C254-D276 VanDerWaalsContact N-O 3.16Å; C254-D276 PolarHBondContact O-N 2.8Å; K256-D276 WeakPolarHBondContact CE-OD2 3.42Å; K256-D276 IonicContact NZ-OD1 3.22Å; K256-D276 PolarHBondContact NZ-OD1 3Å; K256-D276 IonicContact NZ-OD2 2.66Å; K256-D276 PolarHBondContact NZ-OD2 2.93Å; D276-F278 VanDerWaalsContact C-N 3.28Å; D276-F278 WeakPolarHBondContact O-CD1 3.41Å; D276-F278 PolarHBondContact O-N 2.81Å; D276-P298 CarbonylContact C-O 3.59Å; D276-H299 IonicContact OD1-CE1 2.79Å; D276-H299 PolarHBondContact OD1-CE1 2.67Å; D276-H299 IonicContact OD1-ND1 2.76Å; D276-H299 PolarHBondContact OD1-ND1 3.43Å
277	N	93.2	Very high	94.8	Very high	66 Å²	66	35.3 Å²	35.3	35%	0.353	22%	0.218	S	C	.	.	S	Bend	trans	60.1	32.2	172	-43.7	-53.9	0	0	0	114	A251 T252 F279 P298	A251-N277 HydrophobicContact CB-CB 3.95Å; A251-N277 VanDerWaalsContact CB-CG 3.46Å; T252-N277 PolarHBondContact O-ND2 3.16Å; N277-F279 VanDerWaalsContact O-CD1 3.28Å; N277-F279 WeakPolarHBondContact O-CD1 3.39Å; N277-P298 PolarHBondContact N-O 3.04Å; N277-P298 VanDerWaalsContact N-O 3.07Å
278	F	94.7	Very high	94.7	Very high	7 Å²	7	41.3 Å²	41.3	3%	0.031	25%	0.252	C	S	.	.			trans	-73.8	146.5	171	-56.4	-25.4	0	0	0	111.2	P253 C254 I273 D276 L282 L295 P298 I301 L318	P253-F278 HydrophobicContact CB-CD1 4.2Å; C254-F278 WeakPolarHBondContact O-CE1 3.46Å; C254-F278 WeakPolarHBondContact O-CZ 3.17Å; I273-F278 HydrophobicContact CG2-CZ 4.14Å; I273-F278 WeakPolarHBondContact O-CE2 3.2Å; D276-F278 VanDerWaalsContact C-N 3.28Å; D276-F278 WeakPolarHBondContact O-CD1 3.41Å; D276-F278 PolarHBondContact O-N 2.81Å; F278-L282 HydrophobicContact CB-CD2 4.12Å; F278-L282 HydrophobicContact CD1-CD2 3.69Å; F278-L282 HydrophobicContact CG-CD2 4.18Å; F278-L295 HydrophobicContact CB-CD1 3.66Å; F278-P298 PolarHBondContact N-O 2.86Å; F278-P298 WeakPolarHBondContact O-CA 3.5Å; F278-I301 HydrophobicContact CB-CG2 3.8Å; F278-I301 HydrophobicContact CD2-CB 4.3Å; F278-I301 HydrophobicContact CD2-CD1 4.35Å; F278-I301 HydrophobicContact CD2-CG1 4.08Å; F278-I301 HydrophobicContact CD2-CG2 3.7Å; F278-I301 HydrophobicContact CE2-CD1 4.3Å; F278-I301 HydrophobicContact CE2-CG1 4.01Å; F278-I301 HydrophobicContact CE2-CG2 4.48Å; F278-I301 HydrophobicContact CG-CG2 3.9Å; F278-I301 HydrophobicContact CZ-CD1 4.4Å; F278-L318 HydrophobicContact CD1-CD1 4.28Å; F278-L318 HydrophobicContact CE1-CD1 3.67Å
279	F	93	Very high	94.7	Very high	24 Å²	24	43.4 Å²	43.4	11%	0.105	25%	0.252	C	S	.	.			trans	-149.9	165.4	-176.8	54.6	-99.2	0	0	0	110.5	P248 P253 N277 L282 Y320	P248-F279 HydrophobicContact CB-CB 4.48Å; P248-F279 HydrophobicContact CB-CD1 4.09Å; P248-F279 HydrophobicContact CB-CG 4.2Å; P248-F279 HydrophobicContact CG-CB 4.09Å; P248-F279 HydrophobicContact CG-CD1 3.67Å; P248-F279 HydrophobicContact CG-CD2 3.65Å; P248-F279 HydrophobicContact CG-CE1 3.97Å; P248-F279 HydrophobicContact CG-CE2 3.96Å; P248-F279 HydrophobicContact CG-CG 3.51Å; P248-F279 HydrophobicContact CG-CZ 4.12Å; P253-F279 HydrophobicContact CG-CE1 4.36Å; N277-F279 VanDerWaalsContact O-CD1 3.28Å; N277-F279 WeakPolarHBondContact O-CD1 3.39Å; F279-L282 HydrophobicContact CD2-CB 4.36Å; F279-L282 HydrophobicContact CE1-CD1 4.46Å; F279-L282 HydrophobicContact CE2-CB 4.23Å; F279-L282 HydrophobicContact CE2-CD1 4.34Å; F279-L282 HydrophobicContact CZ-CD1 3.98Å; F279-L282 WeakPolarHBondContact O-CB 3.32Å; F279-L282 PolarHBondContact O-N 3.29Å; F279-Y320 HydrophobicContact CD2-CE2 4.47Å; F279-Y320 AromaticContact CE2-CD1 3.77Å; F279-Y320 HydrophobicContact CE2-CD1 3.77Å; F279-Y320 AromaticContact CE2-CD2 3.66Å; F279-Y320 HydrophobicContact CE2-CD2 3.66Å; F279-Y320 AromaticContact CE2-CE1 3.86Å; F279-Y320 HydrophobicContact CE2-CE1 3.86Å; F279-Y320 AromaticContact CE2-CE2 3.75Å; F279-Y320 HydrophobicContact CE2-CE2 3.75Å; F279-Y320 AromaticContact CE2-CG 3.65Å; F279-Y320 HydrophobicContact CE2-CG 3.65Å; F279-Y320 AromaticContact CE2-CZ 3.83Å; F279-Y320 AromaticContact CZ-CD1 3.87Å; F279-Y320 HydrophobicContact CZ-CD1 3.87Å; F279-Y320 HydrophobicContact CZ-CD2 4.36Å; F279-Y320 HydrophobicContact CZ-CE1 4.28Å; F279-Y320 AromaticContact CZ-CG 3.89Å; F279-Y320 HydrophobicContact CZ-CG 3.89Å
280	D	91.3	Very high	94.7	Very high	132 Å²	132	46.5 Å²	46.5	71%	0.706	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	141.8	-175.3	-173	25.2	0	0	0	112.8	L282	D280-L282 VanDerWaalsContact C-N 3.28Å; D280-L282 PolarHBondContact O-N 3.03Å
281	G	90.4	Very high	94.7	Very high	36 Å²	36	42.8 Å²	42.8	37%	0.371	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.8	6.2	-172.1	0	0	0	0	0	115.5	Y320	G281-Y320 WeakPolarHBondContact O-CD2 3.37Å
282	L	93.9	Very high	94.4	Very high	2 Å²	2	52.6 Å²	52.6	1%	0.01	28%	0.283	C	S	.	.			trans	-67.1	129.9	169.3	-174.5	64.2	0	0	0	110	P253 F278 F279 D280 S293 I301 L318	P253-L282 HydrophobicContact CB-CD2 4.18Å; P253-L282 HydrophobicContact CG-CD1 4.35Å; F278-L282 HydrophobicContact CB-CD2 4.12Å; F278-L282 HydrophobicContact CD1-CD2 3.69Å; F278-L282 HydrophobicContact CG-CD2 4.18Å; F279-L282 HydrophobicContact CD2-CB 4.36Å; F279-L282 HydrophobicContact CE1-CD1 4.46Å; F279-L282 HydrophobicContact CE2-CB 4.23Å; F279-L282 HydrophobicContact CE2-CD1 4.34Å; F279-L282 HydrophobicContact CZ-CD1 3.98Å; F279-L282 WeakPolarHBondContact O-CB 3.32Å; F279-L282 PolarHBondContact O-N 3.29Å; D280-L282 VanDerWaalsContact C-N 3.28Å; D280-L282 PolarHBondContact O-N 3.03Å; L282-S293 PolarHBondContact O-OG 2.87Å; L282-I301 HydrophobicContact CD2-CD1 4.5Å; L282-L318 HydrophobicContact CD1-CB 4.24Å; L282-L318 HydrophobicContact CD2-CD1 4.39Å
283	Q	94.9	Very high	94.2	Very high	47 Å²	47	50.2 Å²	50.2	22%	0.22	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	156.2	178.5	-62.6	175.7	-38.2	0	0	110.6	L290 L318 S319	Q283-L290 HydrophobicContact CB-CD2 4.05Å; Q283-L318 CarbonylContact O-C 3.54Å; Q283-L318 WeakPolarHBondContact O-CA 3.44Å; Q283-S319 WeakPolarHBondContact CB-O 3.2Å; Q283-S319 PolarHBondContact N-O 2.73Å; Q283-S319 PolarHBondContact O-N 2.84Å
284	V	96.6	Very high	94.2	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	143	177.4	172.4	0	0	0	0	108.8	I273 F286 V291 I301 V303 V316 L318	I273-V284 HydrophobicContact CD1-CB 4.45Å; I273-V284 HydrophobicContact CD1-CG1 3.59Å; I273-V284 HydrophobicContact CD1-CG2 3.97Å; V284-F286 HydrophobicContact CG1-CD2 3.95Å; V284-F286 HydrophobicContact CG1-CE2 3.66Å; V284-V291 PolarHBondContact N-O 2.87Å; V284-V291 PolarHBondContact O-N 2.99Å; V284-I301 HydrophobicContact CG2-CD1 3.51Å; V284-V303 HydrophobicContact CB-CG1 4.25Å; V284-V303 HydrophobicContact CB-CG2 4.27Å; V284-V303 HydrophobicContact CG1-CG1 4.34Å; V284-V303 HydrophobicContact CG1-CG2 4.38Å; V284-V303 HydrophobicContact CG2-CG2 3.86Å; V284-V316 HydrophobicContact CG1-CG1 3.7Å; V284-L318 HydrophobicContact CG2-CD2 3.88Å
285	V	96.6	Very high	94.1	Very high	8 Å²	8	54.4 Å²	54.4	5%	0.048	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	118.5	178.4	-153.3	0	0	0	0	109.2	G287 M289 L290 V316 T317	V285-G287 WeakPolarHBondContact CG1-O 3.38Å; V285-M289 CarbonylContact C-O 3.52Å; V285-M289 WeakPolarHBondContact CA-O 3.4Å; V285-L290 HydrophobicContact CG1-CG 4.45Å; V285-L290 HydrophobicContact CG2-CD2 3.84Å; V285-V316 VanDerWaalsContact O-CA 3.31Å; V285-V316 WeakPolarHBondContact O-CA 3.31Å; V285-T317 WeakPolarHBondContact CB-OG1 3.48Å; V285-T317 PolarHBondContact N-O 3.02Å; V285-T317 PolarHBondContact O-N 2.88Å
286	F	96.3	Very high	94.1	Very high	7 Å²	7	58.7 Å²	58.7	3%	0.031	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	96.3	168.9	-77.1	-103.9	0	0	0	108	V284 T288 M289 V291 V303 T305 P306 V314 V316 F333 Y335	V284-F286 HydrophobicContact CG1-CD2 3.95Å; V284-F286 HydrophobicContact CG1-CE2 3.66Å; F286-T288 PolarHBondContact O-N 3.11Å; F286-M289 PolarHBondContact N-O 3.01Å; F286-M289 PolarHBondContact O-N 3.5Å; F286-V291 HydrophobicContact CD2-CG2 3.84Å; F286-V291 HydrophobicContact CE2-CG2 4.41Å; F286-V303 HydrophobicContact CE2-CG1 3.9Å; F286-T305 HydrophobicContact CE1-CG2 4.28Å; F286-T305 HydrophobicContact CZ-CG2 4.34Å; F286-P306 HydrophobicContact CB-CG 3.81Å; F286-P306 HydrophobicContact CD2-CG 4.24Å; F286-P306 HydrophobicContact CG-CG 4.05Å; F286-V314 HydrophobicContact CB-CG1 4.1Å; F286-V316 HydrophobicContact CD1-CG2 3.81Å; F286-V316 HydrophobicContact CE1-CG2 3.87Å; F286-V316 HydrophobicContact CG-CG2 4.36Å; F286-V316 HydrophobicContact CZ-CG2 4.46Å; F286-F333 HydrophobicContact CD1-CB 4.34Å; F286-F333 HydrophobicContact CD1-CD1 4.33Å; F286-F333 HydrophobicContact CD1-CG 4.39Å; F286-F333 HydrophobicContact CE1-CB 4.01Å; F286-F333 HydrophobicContact CE1-CD1 4.05Å; F286-F333 HydrophobicContact CE1-CD2 4.26Å; F286-F333 AromaticContact CE1-CG 3.83Å; F286-F333 HydrophobicContact CE1-CG 3.83Å; F286-Y335 HydrophobicContact CD1-CE2 4.36Å
287	G	92.8	Very high	94.2	Very high	37 Å²	37	59.8 Å²	59.8	38%	0.381	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.6	-96.2	-170.9	0	0	0	0	0	110.9	V285 V314 E315	V285-G287 WeakPolarHBondContact CG1-O 3.38Å; G287-V314 VanDerWaalsContact N-CG1 3.28Å; G287-E315 WeakPolarHBondContact CA-O 3.43Å; G287-E315 PolarHBondContact N-O 2.78Å
288	T	90.8	Very high	94.3	Very high	136 Å²	136	60.1 Å²	60.1	83%	0.834	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.1	-12.3	175.8	53.3	0	0	0	0	113.6	F286 L290	F286-T288 PolarHBondContact O-N 3.11Å; T288-L290 PolarHBondContact O-N 3Å
289	M	94	Very high	94.3	Very high	84 Å²	84	64.3 Å²	64.3	41%	0.414	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	114.6	-175.7	-65.1	-173.7	74.9	0	0	111.2	V285 F286 P306	V285-M289 CarbonylContact C-O 3.52Å; V285-M289 WeakPolarHBondContact CA-O 3.4Å; F286-M289 PolarHBondContact N-O 3.01Å; F286-M289 PolarHBondContact O-N 3.5Å; M289-P306 HydrophobicContact CB-CB 4.38Å; M289-P306 HydrophobicContact CB-CG 4.13Å; M289-P306 HydrophobicContact CE-CB 3.77Å; M289-P306 HydrophobicContact SD-CB 4.03Å; M289-P306 HydrophobicContact SD-CG 4.33Å
290	L	93.8	Very high	94.5	Very high	105 Å²	105	64 Å²	64	55%	0.55	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	137.6	172.1	-84.9	161.6	0	0	0	111.3	Q283 V285 T288	Q283-L290 HydrophobicContact CB-CD2 4.05Å; V285-L290 HydrophobicContact CG1-CG 4.45Å; V285-L290 HydrophobicContact CG2-CD2 3.84Å; T288-L290 PolarHBondContact O-N 3Å
291	V	95.3	Very high	94.8	Very high	22 Å²	22	57.7 Å²	57.7	13%	0.133	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	141.1	-179.1	-163.2	0	0	0	0	109.4	V284 F286 V303 Q304 P306	V284-V291 PolarHBondContact N-O 2.87Å; V284-V291 PolarHBondContact O-N 2.99Å; F286-V291 HydrophobicContact CD2-CG2 3.84Å; F286-V291 HydrophobicContact CE2-CG2 4.41Å; V291-V303 HydrophobicContact CB-CG1 3.96Å; V291-V303 HydrophobicContact CG1-CG1 3.59Å; V291-Q304 WeakPolarHBondContact CG1-O 3.32Å; V291-P306 HydrophobicContact CG2-CB 4.36Å; V291-P306 HydrophobicContact CG2-CG 3.89Å
292	W	91.1	Very high	95.2	Very high	207 Å²	207	61 Å²	61	78%	0.784	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68	135.2	170.2	-61.1	99.9	0	0	0	110.2
293	S	94.4	Very high	95.3	Very high	20 Å²	20	61 Å²	61	14%	0.14	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	150.6	171.1	88.2	0	0	0	0	110.7	L282 R302	L282-S293 PolarHBondContact O-OG 2.87Å; S293-R302 WeakPolarHBondContact CA-O 3.45Å
294	E	96.4	Very high	95.4	Very high	98 Å²	98	63.9 Å²	63.9	46%	0.458	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	125.5	179.4	179.7	-170.7	178.3	0	0	108.7	I296 I301 R302	E294-I296 PolarHBondContact O-N 3.12Å; E294-I301 CarbonylContact O-C 3.4Å; E294-I301 WeakPolarHBondContact O-CA 3.32Å; E294-R302 HydrophobicContact CB-CB 4.31Å; E294-R302 PolarHBondContact N-O 2.9Å; E294-R302 PolarHBondContact O-N 2.89Å; E294-R302 IonicContact OE1-CZ 3.25Å; E294-R302 IonicContact OE1-NE 3.38Å; E294-R302 IonicContact OE1-NH2 3.35Å; E294-R302 PolarHBondContact OE1-NH2 3.21Å; E294-R302 IonicContact OE2-CZ 3.45Å; E294-R302 IonicContact OE2-NE 2.74Å; E294-R302 PolarHBondContact OE2-NE 2.92Å; E294-R302 IonicContact OE2-NH2 2.69Å; E294-R302 PolarHBondContact OE2-NH2 2.78Å
295	L	96.6	Very high	95.4	Very high	66 Å²	66	64 Å²	64	35%	0.346	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	112	-176.6	-171	72.5	0	0	0	111	F278 T297 I301	F278-L295 HydrophobicContact CB-CD1 3.66Å; L295-T297 WeakPolarHBondContact CD1-O 3.2Å; L295-I301 HydrophobicContact CD1-CG2 3.81Å
296	I	96.4	Very high	95.4	Very high	91 Å²	91	64.3 Å²	64.3	47%	0.467	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	-51.3	168	-48.4	172.3	0	0	0	108.9	I272 E294 A300 R302	I272-I296 HydrophobicContact CD1-CD1 4.44Å; I272-I296 HydrophobicContact CG1-CD1 4.5Å; I272-I296 HydrophobicContact CG2-CD1 4.44Å; E294-I296 PolarHBondContact O-N 3.12Å; I296-A300 HydrophobicContact CB-CB 4.33Å; I296-A300 WeakPolarHBondContact CB-O 3.28Å; I296-A300 HydrophobicContact CD1-CB 4.45Å; I296-A300 PolarHBondContact N-O 2.84Å; I296-R302 HydrophobicContact CD1-CB 4.07Å; I296-R302 HydrophobicContact CG1-CB 4.15Å
297	T	95.6	Very high	95.4	Very high	60 Å²	60	68 Å²	68	37%	0.368	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	167.4	177.1	74.3	0	0	0	0	110.1	L295 H299 A300	L295-T297 WeakPolarHBondContact CD1-O 3.2Å; T297-H299 PolarHBondContact O-N 2.91Å; T297-H299 PolarHBondContact OG1-N 2.81Å; T297-H299 VanDerWaalsContact OG1-N 3.14Å; T297-A300 PolarHBondContact N-O 2.68Å; T297-A300 CarbonylContact O-C 3.54Å; T297-A300 PolarHBondContact O-N 2.96Å; T297-A300 PolarHBondContact OG1-N 2.82Å; T297-A300 VanDerWaalsContact OG1-N 3.11Å
298	P	94.8	Very high	95.4	Very high	73 Å²	73	69.7 Å²	69.7	47%	0.474	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-7.4	170.9	-26	36.4	0	0	0	115.9	D276 N277 F278	D276-P298 CarbonylContact C-O 3.59Å; N277-P298 PolarHBondContact N-O 3.04Å; N277-P298 VanDerWaalsContact N-O 3.07Å; F278-P298 PolarHBondContact N-O 2.86Å; F278-P298 WeakPolarHBondContact O-CA 3.5Å
299	H	96.6	Very high	95.2	Very high	96 Å²	96	71.5 Å²	71.5	44%	0.444	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.6	-2.5	176.4	-59.3	-80.8	0	0	0	113.9	I274 G275 D276 T297	I274-H299 CarbonylContact C-O 3.57Å; I274-H299 WeakPolarHBondContact CA-O 3.5Å; G275-H299 PolarHBondContact N-O 2.98Å; G275-H299 VanDerWaalsContact O-CA 3.24Å; G275-H299 WeakPolarHBondContact O-CA 3.48Å; G275-H299 VanDerWaalsContact O-CB 3.27Å; G275-H299 WeakPolarHBondContact O-CB 3.36Å; G275-H299 PolarHBondContact O-ND1 3.12Å; G275-H299 VanDerWaalsContact O-ND1 3.07Å; D276-H299 IonicContact OD1-CE1 2.79Å; D276-H299 PolarHBondContact OD1-CE1 2.67Å; D276-H299 IonicContact OD1-ND1 2.76Å; D276-H299 PolarHBondContact OD1-ND1 3.43Å; T297-H299 PolarHBondContact O-N 2.91Å; T297-H299 PolarHBondContact OG1-N 2.81Å; T297-H299 VanDerWaalsContact OG1-N 3.14Å
300	A	97	Very high	95	Very high	16 Å²	16	71.8 Å²	71.8	13%	0.132	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	123.3	-178.7	0	0	0	0	0	112.7	I272 I273 I296 T297	I272-A300 HydrophobicContact CG2-CB 4.24Å; I273-A300 WeakPolarHBondContact O-CA 3.45Å; I296-A300 HydrophobicContact CB-CB 4.33Å; I296-A300 WeakPolarHBondContact CB-O 3.28Å; I296-A300 HydrophobicContact CD1-CB 4.45Å; I296-A300 PolarHBondContact N-O 2.84Å; T297-A300 PolarHBondContact N-O 2.68Å; T297-A300 CarbonylContact O-C 3.54Å; T297-A300 PolarHBondContact O-N 2.96Å; T297-A300 PolarHBondContact OG1-N 2.82Å; T297-A300 VanDerWaalsContact OG1-N 3.11Å
301	I	97.8	Very high	94.9	Very high	0 Å²	0	69.8 Å²	69.8	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	140.8	171	56.6	-174.2	0	0	0	110.5	I272 I273 F278 L282 V284 E294 L295 V303 L318	I272-I301 WeakPolarHBondContact CA-O 3.28Å; I273-I301 HydrophobicContact CB-CD1 4.29Å; I273-I301 HydrophobicContact CB-CG1 3.79Å; I273-I301 HydrophobicContact CG2-CG1 4.4Å; I273-I301 PolarHBondContact N-O 2.9Å; I273-I301 PolarHBondContact O-N 3.47Å; F278-I301 HydrophobicContact CB-CG2 3.8Å; F278-I301 HydrophobicContact CD2-CB 4.3Å; F278-I301 HydrophobicContact CD2-CD1 4.35Å; F278-I301 HydrophobicContact CD2-CG1 4.08Å; F278-I301 HydrophobicContact CD2-CG2 3.7Å; F278-I301 HydrophobicContact CE2-CD1 4.3Å; F278-I301 HydrophobicContact CE2-CG1 4.01Å; F278-I301 HydrophobicContact CE2-CG2 4.48Å; F278-I301 HydrophobicContact CG-CG2 3.9Å; F278-I301 HydrophobicContact CZ-CD1 4.4Å; L282-I301 HydrophobicContact CD2-CD1 4.5Å; V284-I301 HydrophobicContact CG2-CD1 3.51Å; E294-I301 CarbonylContact O-C 3.4Å; E294-I301 WeakPolarHBondContact O-CA 3.32Å; L295-I301 HydrophobicContact CD1-CG2 3.81Å; I301-V303 HydrophobicContact CG1-CG2 4.45Å; I301-L318 HydrophobicContact CD1-CD2 4.03Å
302	R	97.6	Very high	94.7	Very high	106 Å²	106	70.2 Å²	70.2	40%	0.4	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	137.2	174	-179	161.2	72.2	176.7	-0.9	109.7	M270 S293 E294 I296	M270-R302 HydrophobicContact CE-CG 3.46Å; M270-R302 VanDerWaalsContact CE-CG 3.46Å; S293-R302 WeakPolarHBondContact CA-O 3.45Å; E294-R302 HydrophobicContact CB-CB 4.31Å; E294-R302 PolarHBondContact N-O 2.9Å; E294-R302 PolarHBondContact O-N 2.89Å; E294-R302 IonicContact OE1-CZ 3.25Å; E294-R302 IonicContact OE1-NE 3.38Å; E294-R302 IonicContact OE1-NH2 3.35Å; E294-R302 PolarHBondContact OE1-NH2 3.21Å; E294-R302 IonicContact OE2-CZ 3.45Å; E294-R302 IonicContact OE2-NE 2.74Å; E294-R302 PolarHBondContact OE2-NE 2.92Å; E294-R302 IonicContact OE2-NH2 2.69Å; E294-R302 PolarHBondContact OE2-NH2 2.78Å; I296-R302 HydrophobicContact CD1-CB 4.07Å; I296-R302 HydrophobicContact CG1-CB 4.15Å
303	V	97.2	Very high	94.9	Very high	2 Å²	2	64.6 Å²	64.6	1%	0.012	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	150.6	-178.1	-160.1	0	0	0	0	109.4	V271 I273 V284 F286 V291 I301	V271-V303 PolarHBondContact N-O 3.34Å; V271-V303 PolarHBondContact O-N 2.92Å; I273-V303 HydrophobicContact CD1-CG2 3.93Å; I273-V303 HydrophobicContact CG1-CG2 4.2Å; V284-V303 HydrophobicContact CB-CG1 4.25Å; V284-V303 HydrophobicContact CB-CG2 4.27Å; V284-V303 HydrophobicContact CG1-CG1 4.34Å; V284-V303 HydrophobicContact CG1-CG2 4.38Å; V284-V303 HydrophobicContact CG2-CG2 3.86Å; F286-V303 HydrophobicContact CE2-CG1 3.9Å; V291-V303 HydrophobicContact CB-CG1 3.96Å; V291-V303 HydrophobicContact CG1-CG1 3.59Å; I301-V303 HydrophobicContact CG1-CG2 4.45Å
304	Q	96.9	Very high	95	Very high	107 Å²	107	63.9 Å²	63.9	50%	0.5	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	128.9	169.3	-167.5	174.1	31.7	0	0	109.5	G268 A269 M270 V291	G268-Q304 WeakPolarHBondContact O-CG 3.31Å; G268-Q304 PolarHBondContact O-NE2 3.07Å; A269-Q304 CarbonylContact O-C 3.55Å; A269-Q304 WeakPolarHBondContact O-CA 3.2Å; M270-Q304 HydrophobicContact CE-CB 4.36Å; M270-Q304 HydrophobicContact SD-CB 3.83Å; M270-Q304 HydrophobicContact SD-CG 3.82Å; V291-Q304 WeakPolarHBondContact CG1-O 3.32Å
305	T	96.7	Very high	95.1	Very high	3 Å²	3	64.1 Å²	64.1	2%	0.018	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-65.1	130.4	-177.8	54.2	0	0	0	0	111	G267 G268 A269 V271 F286 F333	G267-T305 CarbonylContact C-O 3.52Å; G267-T305 VanDerWaalsContact CA-O 3.31Å; G267-T305 WeakPolarHBondContact CA-O 3.4Å; G267-T305 WeakPolarHBondContact CA-OG1 3.24Å; G268-T305 PolarHBondContact N-O 2.82Å; G268-T305 PolarHBondContact N-OG1 2.88Å; A269-T305 PolarHBondContact N-OG1 3.31Å; A269-T305 VanDerWaalsContact N-OG1 3.11Å; A269-T305 PolarHBondContact O-N 2.84Å; A269-T305 PolarHBondContact O-OG1 2.88Å; V271-T305 HydrophobicContact CB-CG2 4.43Å; V271-T305 HydrophobicContact CG2-CG2 3.51Å; F286-T305 HydrophobicContact CE1-CG2 4.28Å; F286-T305 HydrophobicContact CZ-CG2 4.34Å; T305-F333 HydrophobicContact CG2-CE1 3.98Å; T305-F333 HydrophobicContact CG2-CE2 4.04Å; T305-F333 HydrophobicContact CG2-CZ 3.56Å
306	P	96.6	Very high	95.1	Very high	14 Å²	14	61 Å²	61	9%	0.091	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-71.6	153.2	175.3	27.6	-31.4	0	0	0	111.1	F286 M289 V291 Y335	F286-P306 HydrophobicContact CB-CG 3.81Å; F286-P306 HydrophobicContact CD2-CG 4.24Å; F286-P306 HydrophobicContact CG-CG 4.05Å; M289-P306 HydrophobicContact CB-CB 4.38Å; M289-P306 HydrophobicContact CB-CG 4.13Å; M289-P306 HydrophobicContact CE-CB 3.77Å; M289-P306 HydrophobicContact SD-CB 4.03Å; M289-P306 HydrophobicContact SD-CG 4.33Å; V291-P306 HydrophobicContact CG2-CB 4.36Å; V291-P306 HydrophobicContact CG2-CG 3.89Å; P306-Y335 VanDerWaalsContact CD-OH 3.29Å; P306-Y335 WeakPolarHBondContact CD-OH 3.42Å; P306-Y335 WeakPolarHBondContact CG-OH 3.17Å; P306-Y335 WeakPolarHBondContact O-CE1 3.28Å; P306-Y335 PolarHBondContact O-OH 3.12Å
307	P	94.8	Very high	95.1	Very high	85 Å²	85	57 Å²	57	55%	0.552	30%	0.303	S	S	*	.	P	Polyproline II helix	trans	-64	139.1	171	-19	31.6	0	0	0	111.5	T266	T266-P307 WeakPolarHBondContact O-CB 3.4Å; T266-P307 WeakPolarHBondContact O-CG 3.41Å
308	R	92.9	Very high	95.1	Very high	73 Å²	73	54.1 Å²	54.1	28%	0.275	29%	0.285	S	S	.	.			trans	-143.3	119.4	-179.9	-170.8	-174.7	-172	-125	14.3	110.9	T265 I310 P311 Y335	T265-R308 WeakPolarHBondContact CA-O 3.47Å; T265-R308 WeakPolarHBondContact CB-O 3.36Å; T265-R308 VanDerWaalsContact CG2-O 3.23Å; T265-R308 WeakPolarHBondContact CG2-O 3.39Å; T265-R308 CarbonylContact O-C 3.58Å; T265-R308 PolarHBondContact O-N 2.79Å; T265-R308 VanDerWaalsContact O-O 3.11Å; R308-I310 VanDerWaalsContact C-N 3.3Å; R308-I310 WeakPolarHBondContact CD-O 3.46Å; R308-I310 PolarHBondContact NH1-O 2.78Å; R308-I310 PolarHBondContact O-N 2.96Å; R308-P311 PolarHBondContact NH1-O 2.89Å; R308-Y335 HydrophobicContact CB-CD1 4.03Å; R308-Y335 HydrophobicContact CB-CD2 4.37Å; R308-Y335 HydrophobicContact CB-CE1 3.88Å; R308-Y335 HydrophobicContact CB-CE2 4.25Å; R308-Y335 HydrophobicContact CB-CG 4.23Å
309	H	86.3	Confident	95	Very high	174 Å²	174	51.2 Å²	51.2	81%	0.806	27%	0.267	S	S	*	.	S	Bend	trans	-74.3	-14.7	-176.3	66.1	-84.3	0	0	0	115
310	I	90.4	Very high	94.8	Very high	89 Å²	89	49 Å²	49	46%	0.456	26%	0.255	S	S	.	.	S	Bend	trans	-105.1	125.5	178.8	-56.6	172.9	0	0	0	108.9	R308	R308-I310 VanDerWaalsContact C-N 3.3Å; R308-I310 WeakPolarHBondContact CD-O 3.46Å; R308-I310 PolarHBondContact NH1-O 2.78Å; R308-I310 PolarHBondContact O-N 2.96Å
311	P	90.9	Very high	94.3	Very high	63 Å²	63	54 Å²	54	41%	0.409	27%	0.274	S	S	.	.			trans	-72.9	178.8	172.7	30.1	-34	0	0	0	112.8	T265 R308 Y335 A337	T265-P311 HydrophobicContact CG2-CB 4.31Å; R308-P311 PolarHBondContact NH1-O 2.89Å; P311-Y335 CarbonylContact C-O 3.57Å; P311-Y335 WeakPolarHBondContact CA-O 3.49Å; P311-Y335 VanDerWaalsContact CB-O 3.28Å; P311-Y335 WeakPolarHBondContact CB-O 3.48Å; P311-A337 HydrophobicContact CB-CB 4.13Å; P311-A337 HydrophobicContact CG-CB 4.43Å
312	G	92.9	Very high	93.6	Very high	32 Å²	32	60 Å²	60	33%	0.33	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	93.7	-172.8	179.5	0	0	0	0	0	114.4	Y335	G312-Y335 PolarHBondContact N-O 2.91Å; G312-Y335 PolarHBondContact O-N 3.11Å
313	V	95.5	Very high	93.2	Very high	88 Å²	88	60.8 Å²	60.8	53%	0.533	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	142.3	-170.5	-168.8	0	0	0	0	112	R332 I334	V313-R332 HydrophobicContact CG1-CB 4.2Å; V313-R332 HydrophobicContact CG1-CG 4.31Å; V313-I334 HydrophobicContact CG2-CG1 4.4Å
314	V	96.4	Very high	92.9	Very high	5 Å²	5	64.2 Å²	64.2	3%	0.03	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	134.5	173.6	171.5	0	0	0	0	109.6	F286 G287 R332 F333 Y335	F286-V314 HydrophobicContact CB-CG1 4.1Å; G287-V314 VanDerWaalsContact N-CG1 3.28Å; V314-R332 WeakPolarHBondContact O-CA 3.48Å; V314-F333 PolarHBondContact N-O 3.47Å; V314-F333 PolarHBondContact O-N 3.35Å; V314-Y335 HydrophobicContact CB-CD2 4.25Å; V314-Y335 HydrophobicContact CB-CE2 4.28Å; V314-Y335 HydrophobicContact CG2-CD2 3.58Å; V314-Y335 HydrophobicContact CG2-CE2 3.84Å
315	E	96.8	Very high	92.7	Very high	104 Å²	104	60.3 Å²	60.3	49%	0.486	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	131.8	169.1	-64.9	-167.6	151.8	0	0	110.6	G287 P330 G331	G287-E315 WeakPolarHBondContact CA-O 3.43Å; G287-E315 PolarHBondContact N-O 2.78Å; E315-P330 HydrophobicContact CB-CB 3.9Å; E315-P330 HydrophobicContact CB-CG 4.14Å; E315-P330 HydrophobicContact CG-CB 4.28Å; E315-P330 HydrophobicContact CG-CG 3.96Å; E315-G331 CarbonylContact C-O 3.56Å; E315-G331 WeakPolarHBondContact CA-O 3.48Å
316	V	97.4	Very high	92.4	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	125.6	178	-175.1	0	0	0	0	109	I255 I258 I273 V284 V285 F286 P330 G331 F333	I255-V316 HydrophobicContact CD1-CG1 4.23Å; I255-V316 WeakPolarHBondContact CD1-O 3.33Å; I258-V316 HydrophobicContact CD1-CB 3.5Å; I258-V316 HydrophobicContact CD1-CG1 3.72Å; I258-V316 HydrophobicContact CD1-CG2 3.7Å; I273-V316 HydrophobicContact CD1-CG1 3.75Å; V284-V316 HydrophobicContact CG1-CG1 3.7Å; V285-V316 VanDerWaalsContact O-CA 3.31Å; V285-V316 WeakPolarHBondContact O-CA 3.31Å; F286-V316 HydrophobicContact CD1-CG2 3.81Å; F286-V316 HydrophobicContact CE1-CG2 3.87Å; F286-V316 HydrophobicContact CG-CG2 4.36Å; F286-V316 HydrophobicContact CZ-CG2 4.46Å; V316-P330 WeakPolarHBondContact O-CA 3.42Å; V316-G331 PolarHBondContact N-O 3.48Å; V316-G331 PolarHBondContact O-N 2.85Å; V316-F333 HydrophobicContact CG2-CB 3.81Å
317	T	96.5	Very high	92	Very high	6 Å²	6	67 Å²	67	4%	0.037	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	172.8	-178.5	55.2	0	0	0	0	110.9	V285 Q324 F325 P330	V285-T317 WeakPolarHBondContact CB-OG1 3.48Å; V285-T317 PolarHBondContact N-O 3.02Å; V285-T317 PolarHBondContact O-N 2.88Å; T317-Q324 PolarHBondContact OG1-NE2 3.41Å; T317-F325 WeakPolarHBondContact CB-O 3.41Å; T317-P330 HydrophobicContact CG2-CB 3.92Å
318	L	95.6	Very high	91.7	Very high	0 Å²	0	67 Å²	67	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	150.6	-177.2	-51.2	173.7	0	0	0	110.1	P253 I255 F278 L282 Q283 V284 I301 Q324 F325	P253-L318 HydrophobicContact CB-CD1 3.84Å; P253-L318 HydrophobicContact CG-CD1 4.39Å; I255-L318 HydrophobicContact CD1-CD2 3.91Å; I255-L318 HydrophobicContact CD1-CG 3.97Å; I255-L318 HydrophobicContact CG1-CD1 3.93Å; I255-L318 HydrophobicContact CG1-CD2 4.02Å; I255-L318 HydrophobicContact CG1-CG 3.94Å; F278-L318 HydrophobicContact CD1-CD1 4.28Å; F278-L318 HydrophobicContact CE1-CD1 3.67Å; L282-L318 HydrophobicContact CD1-CB 4.24Å; L282-L318 HydrophobicContact CD2-CD1 4.39Å; Q283-L318 CarbonylContact O-C 3.54Å; Q283-L318 WeakPolarHBondContact O-CA 3.44Å; V284-L318 HydrophobicContact CG2-CD2 3.88Å; I301-L318 HydrophobicContact CD1-CD2 4.03Å; L318-Q324 CarbonylContact O-C 3.57Å; L318-Q324 VanDerWaalsContact O-CA 3.28Å; L318-Q324 WeakPolarHBondContact O-CA 3.33Å; L318-Q324 WeakPolarHBondContact O-CG 3.18Å; L318-F325 HydrophobicContact CB-CB 4.32Å; L318-F325 HydrophobicContact CB-CD2 4.33Å; L318-F325 PolarHBondContact O-N 2.82Å
319	S	93	Very high	91.6	Very high	13 Å²	13	67 Å²	67	9%	0.091	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	138.8	-178	176.5	0	0	0	0	112.2	Q283 K323	Q283-S319 WeakPolarHBondContact CB-O 3.2Å; Q283-S319 PolarHBondContact N-O 2.73Å; Q283-S319 PolarHBondContact O-N 2.84Å; S319-K323 CarbonylContact C-O 3.51Å; S319-K323 WeakPolarHBondContact CA-O 3.32Å
320	Y	91.6	Very high	92	Very high	48 Å²	48	60 Å²	60	19%	0.188	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	130.9	171.4	-175.7	-114.2	0	0	0	111.1	F279 G281 S322 K323	F279-Y320 HydrophobicContact CD2-CE2 4.47Å; F279-Y320 AromaticContact CE2-CD1 3.77Å; F279-Y320 HydrophobicContact CE2-CD1 3.77Å; F279-Y320 AromaticContact CE2-CD2 3.66Å; F279-Y320 HydrophobicContact CE2-CD2 3.66Å; F279-Y320 AromaticContact CE2-CE1 3.86Å; F279-Y320 HydrophobicContact CE2-CE1 3.86Å; F279-Y320 AromaticContact CE2-CE2 3.75Å; F279-Y320 HydrophobicContact CE2-CE2 3.75Å; F279-Y320 AromaticContact CE2-CG 3.65Å; F279-Y320 HydrophobicContact CE2-CG 3.65Å; F279-Y320 AromaticContact CE2-CZ 3.83Å; F279-Y320 AromaticContact CZ-CD1 3.87Å; F279-Y320 HydrophobicContact CZ-CD1 3.87Å; F279-Y320 HydrophobicContact CZ-CD2 4.36Å; F279-Y320 HydrophobicContact CZ-CE1 4.28Å; F279-Y320 AromaticContact CZ-CG 3.89Å; F279-Y320 HydrophobicContact CZ-CG 3.89Å; G281-Y320 WeakPolarHBondContact O-CD2 3.37Å; Y320-S322 PolarHBondContact O-N 2.79Å; Y320-K323 PolarHBondContact N-O 3.47Å; Y320-K323 WeakPolarHBondContact O-CB 3.38Å; Y320-K323 PolarHBondContact O-N 3.4Å
321	K	86.7	Confident	92.3	Very high	122 Å²	122	56.3 Å²	56.3	53%	0.53	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	46	47.5	-178.8	-62.6	176.7	-176.4	163.8	0	112.8	D247 K323	D247-K321 IonicContact OD1-NZ 3.49Å; D247-K321 PolarHBondContact OD1-NZ 2.76Å; K321-K323 PolarHBondContact O-N 2.91Å; K321-K323 VanDerWaalsContact O-N 3.12Å
322	S	83.7	Confident	92.5	Very high	127 Å²	127	61.4 Å²	61.4	89%	0.888	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.5	11	-177.1	-48	0	0	0	0	116.3	Y320	Y320-S322 PolarHBondContact O-N 2.79Å
323	K	89.5	Confident	92.8	Very high	122 Å²	122	60 Å²	60	53%	0.53	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	131.8	165.2	-62.4	-178	179.8	180	0	109.5	S319 Y320 K321 F325	S319-K323 CarbonylContact C-O 3.51Å; S319-K323 WeakPolarHBondContact CA-O 3.32Å; Y320-K323 PolarHBondContact N-O 3.47Å; Y320-K323 WeakPolarHBondContact O-CB 3.38Å; Y320-K323 PolarHBondContact O-N 3.4Å; K321-K323 PolarHBondContact O-N 2.91Å; K321-K323 VanDerWaalsContact O-N 3.12Å; K323-F325 HydrophobicContact CB-CE2 4.29Å; K323-F325 HydrophobicContact CB-CZ 3.97Å
324	Q	90.9	Very high	92.8	Very high	74 Å²	74	58.9 Å²	58.9	35%	0.346	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	130.7	178	-170.6	-178.9	12.9	0	0	110.2	T317 L318 K327	T317-Q324 PolarHBondContact OG1-NE2 3.41Å; L318-Q324 CarbonylContact O-C 3.57Å; L318-Q324 VanDerWaalsContact O-CA 3.28Å; L318-Q324 WeakPolarHBondContact O-CA 3.33Å; L318-Q324 WeakPolarHBondContact O-CG 3.18Å; Q324-K327 HydrophobicContact CG-CG 4.39Å
325	F	92.4	Very high	92.7	Very high	25 Å²	25	58.8 Å²	58.8	11%	0.11	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	174.1	-176.3	-47.1	-88	0	0	0	111.1	T252 P253 T317 L318 K323 K327	T252-F325 HydrophobicContact CG2-CD1 3.92Å; P253-F325 HydrophobicContact CG-CB 4.2Å; P253-F325 HydrophobicContact CG-CD1 4.08Å; P253-F325 HydrophobicContact CG-CD2 3.69Å; P253-F325 HydrophobicContact CG-CE1 4.36Å; P253-F325 HydrophobicContact CG-CE2 4.02Å; P253-F325 HydrophobicContact CG-CG 3.73Å; P253-F325 HydrophobicContact CG-CZ 4.33Å; T317-F325 WeakPolarHBondContact CB-O 3.41Å; L318-F325 HydrophobicContact CB-CB 4.32Å; L318-F325 HydrophobicContact CB-CD2 4.33Å; L318-F325 PolarHBondContact O-N 2.82Å; K323-F325 HydrophobicContact CB-CE2 4.29Å; K323-F325 HydrophobicContact CB-CZ 3.97Å; F325-K327 PolarHBondContact O-N 3.04Å; F325-K327 VanDerWaalsContact O-N 3.12Å
326	C	90.3	Very high	92.5	Very high	21 Å²	21	55.7 Å²	55.7	14%	0.142	31%	0.308	C	S	.	.			trans	61.2	9.4	-179.4	-55.4	0	0	0	0	116.4	I255 G328 A329 P330	I255-C326 HydrophobicContact CD1-CB 4.47Å; I255-C326 PolarHBondContact N-SG 3.46Å; I255-C326 VanDerWaalsContact N-SG 3.43Å; C326-G328 VanDerWaalsContact C-N 3.26Å; C326-G328 PolarHBondContact O-N 3.34Å; C326-G328 VanDerWaalsContact O-N 3.15Å; C326-A329 CarbonylContact O-C 3.55Å; C326-A329 PolarHBondContact O-N 3.31Å; C326-P330 WeakPolarHBondContact O-CA 3.2Å
327	K	88.3	Confident	91.9	Very high	136 Å²	136	56 Å²	56	59%	0.591	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-35	-178.6	-63.7	-162.1	-176.9	-131.5	0	115	Q324 F325	Q324-K327 HydrophobicContact CG-CG 4.39Å; F325-K327 PolarHBondContact O-N 3.04Å; F325-K327 VanDerWaalsContact O-N 3.12Å
328	G	87.4	Confident	90.8	Very high	86 Å²	86	59.8 Å²	59.8	89%	0.887	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-7.1	178.3	0	0	0	0	0	114.8	C326	C326-G328 VanDerWaalsContact C-N 3.26Å; C326-G328 PolarHBondContact O-N 3.34Å; C326-G328 VanDerWaalsContact O-N 3.15Å
329	A	91.6	Very high	89.5	Confident	72 Å²	72	65.4 Å²	65.4	60%	0.595	36%	0.36	S	S	*	.	S	Bend	trans	-151.5	65.8	177.9	0	0	0	0	0	109.1	C326	C326-A329 CarbonylContact O-C 3.55Å; C326-A329 PolarHBondContact O-N 3.31Å
330	P	95.2	Very high	88.4	Confident	28 Å²	28	69.3 Å²	69.3	18%	0.182	38%	0.376	C	S	.	.			trans	-71.8	148.7	-177.9	29.3	-33.9	0	0	0	110.2	E315 V316 T317 C326	E315-P330 HydrophobicContact CB-CB 3.9Å; E315-P330 HydrophobicContact CB-CG 4.14Å; E315-P330 HydrophobicContact CG-CB 4.28Å; E315-P330 HydrophobicContact CG-CG 3.96Å; V316-P330 WeakPolarHBondContact O-CA 3.42Å; T317-P330 HydrophobicContact CG2-CB 3.92Å; C326-P330 WeakPolarHBondContact O-CA 3.2Å
331	G	95.3	Very high	87.4	Confident	10 Å²	10	72.1 Å²	72.1	10%	0.103	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	162.2	162.2	0	0	0	0	0	110.1	E315 V316	E315-G331 CarbonylContact C-O 3.56Å; E315-G331 WeakPolarHBondContact CA-O 3.48Å; V316-G331 PolarHBondContact N-O 3.48Å; V316-G331 PolarHBondContact O-N 2.85Å
332	R	96.6	Very high	86.7	Confident	171 Å²	171	70.3 Å²	70.3	65%	0.645	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.9	136.1	176.6	-67.6	-177.6	176.7	-173.1	-2.7	110	V313 V314	V313-R332 HydrophobicContact CG1-CB 4.2Å; V313-R332 HydrophobicContact CG1-CG 4.31Å; V314-R332 WeakPolarHBondContact O-CA 3.48Å
333	F	97.4	Very high	86.4	Confident	1 Å²	1	66.5 Å²	66.5	0%	0.004	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	137.3	174.8	-174.2	-92.6	0	0	0	109.4	I258 P260 S261 E262 G263 V271 F286 T305 V314 V316 Y335	I258-F333 HydrophobicContact CG2-CD2 4.21Å; P260-F333 WeakPolarHBondContact O-CE2 3.37Å; S261-F333 CarbonylContact O-C 3.59Å; S261-F333 VanDerWaalsContact O-CA 3.31Å; S261-F333 WeakPolarHBondContact O-CA 3.4Å; E262-F333 WeakPolarHBondContact O-CZ 3.45Å; G263-F333 VanDerWaalsContact N-CZ 3.33Å; V271-F333 HydrophobicContact CG2-CD2 4.48Å; V271-F333 HydrophobicContact CG2-CE2 3.74Å; V271-F333 HydrophobicContact CG2-CZ 4.37Å; F286-F333 HydrophobicContact CD1-CB 4.34Å; F286-F333 HydrophobicContact CD1-CD1 4.33Å; F286-F333 HydrophobicContact CD1-CG 4.39Å; F286-F333 HydrophobicContact CE1-CB 4.01Å; F286-F333 HydrophobicContact CE1-CD1 4.05Å; F286-F333 HydrophobicContact CE1-CD2 4.26Å; F286-F333 AromaticContact CE1-CG 3.83Å; F286-F333 HydrophobicContact CE1-CG 3.83Å; T305-F333 HydrophobicContact CG2-CE1 3.98Å; T305-F333 HydrophobicContact CG2-CE2 4.04Å; T305-F333 HydrophobicContact CG2-CZ 3.56Å; V314-F333 PolarHBondContact N-O 3.47Å; V314-F333 PolarHBondContact O-N 3.35Å; V316-F333 HydrophobicContact CG2-CB 3.81Å; F333-Y335 AromaticContact CD1-CD2 3.82Å; F333-Y335 HydrophobicContact CD1-CD2 3.82Å; F333-Y335 AromaticContact CD1-CE2 3.66Å; F333-Y335 HydrophobicContact CD1-CE2 3.66Å; F333-Y335 HydrophobicContact CD1-CG 4.41Å; F333-Y335 HydrophobicContact CE1-CD1 4.23Å; F333-Y335 HydrophobicContact CE1-CD2 4.09Å; F333-Y335 HydrophobicContact CE1-CE1 4.12Å; F333-Y335 AromaticContact CE1-CE2 3.94Å; F333-Y335 HydrophobicContact CE1-CE2 3.94Å; F333-Y335 HydrophobicContact CE1-CG 4.26Å; F333-Y335 AromaticContact CE1-CZ 3.99Å
334	I	96.7	Very high	85.9	Confident	65 Å²	65	62.8 Å²	62.8	33%	0.333	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	123	-176.5	-51.6	-178.6	0	0	0	109.7	S261 E262 G263 V313	S261-I334 PolarHBondContact O-N 2.98Å; E262-I334 CarbonylContact C-O 3.57Å; E262-I334 WeakPolarHBondContact CA-O 3.18Å; E262-I334 HydrophobicContact CB-CB 3.96Å; G263-I334 PolarHBondContact N-O 2.99Å; V313-I334 HydrophobicContact CG2-CG1 4.4Å
335	Y	95.1	Very high	85.5	Confident	3 Å²	3	66.6 Å²	66.6	1%	0.012	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	116.3	171.3	-81	-85.5	0	0	0	110.7	G263 F286 P306 R308 P311 G312 V314 F333	G263-Y335 CarbonylContact O-C 3.6Å; G263-Y335 WeakPolarHBondContact O-CA 3.31Å; F286-Y335 HydrophobicContact CD1-CE2 4.36Å; P306-Y335 VanDerWaalsContact CD-OH 3.29Å; P306-Y335 WeakPolarHBondContact CD-OH 3.42Å; P306-Y335 WeakPolarHBondContact CG-OH 3.17Å; P306-Y335 WeakPolarHBondContact O-CE1 3.28Å; P306-Y335 PolarHBondContact O-OH 3.12Å; R308-Y335 HydrophobicContact CB-CD1 4.03Å; R308-Y335 HydrophobicContact CB-CD2 4.37Å; R308-Y335 HydrophobicContact CB-CE1 3.88Å; R308-Y335 HydrophobicContact CB-CE2 4.25Å; R308-Y335 HydrophobicContact CB-CG 4.23Å; P311-Y335 CarbonylContact C-O 3.57Å; P311-Y335 WeakPolarHBondContact CA-O 3.49Å; P311-Y335 VanDerWaalsContact CB-O 3.28Å; P311-Y335 WeakPolarHBondContact CB-O 3.48Å; G312-Y335 PolarHBondContact N-O 2.91Å; G312-Y335 PolarHBondContact O-N 3.11Å; V314-Y335 HydrophobicContact CB-CD2 4.25Å; V314-Y335 HydrophobicContact CB-CE2 4.28Å; V314-Y335 HydrophobicContact CG2-CD2 3.58Å; V314-Y335 HydrophobicContact CG2-CE2 3.84Å; F333-Y335 AromaticContact CD1-CD2 3.82Å; F333-Y335 HydrophobicContact CD1-CD2 3.82Å; F333-Y335 AromaticContact CD1-CE2 3.66Å; F333-Y335 HydrophobicContact CD1-CE2 3.66Å; F333-Y335 HydrophobicContact CD1-CG 4.41Å; F333-Y335 HydrophobicContact CE1-CD1 4.23Å; F333-Y335 HydrophobicContact CE1-CD2 4.09Å; F333-Y335 HydrophobicContact CE1-CE1 4.12Å; F333-Y335 AromaticContact CE1-CE2 3.94Å; F333-Y335 HydrophobicContact CE1-CE2 3.94Å; F333-Y335 HydrophobicContact CE1-CG 4.26Å; F333-Y335 AromaticContact CE1-CZ 3.99Å
336	T	90.7	Very high	85.1	Confident	40 Å²	40	66.8 Å²	66.8	25%	0.245	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	145	176.9	-54.6	0	0	0	0	109.7	G263 W264 T265 I343	G263-T336 PolarHBondContact O-N 3.3Å; W264-T336 WeakPolarHBondContact CA-O 3.38Å; W264-T336 HydrophobicContact CZ3-CG2 3.98Å; T265-T336 PolarHBondContact N-O 3.33Å; T336-I343 HydrophobicContact CG2-CD1 4.43Å
337	A	86.2	Confident	84.9	Confident	6 Å²	6	66.8 Å²	66.8	5%	0.05	37%	0.374	C	S	.	.			trans	-120.1	137.7	-177.8	0	0	0	0	0	111.6	T265 P311 N339 E340	T265-A337 HydrophobicContact CG2-CB 3.85Å; P311-A337 HydrophobicContact CB-CB 4.13Å; P311-A337 HydrophobicContact CG-CB 4.43Å; A337-N339 VanDerWaalsContact CB-OD1 3.31Å; A337-N339 WeakPolarHBondContact CB-OD1 3.29Å; A337-N339 PolarHBondContact O-N 3.28Å; A337-N339 VanDerWaalsContact O-N 3.15Å; A337-E340 PolarHBondContact O-N 3.37Å
338	L	72	Confident	84.7	Confident	86 Å²	86	65.7 Å²	65.7	45%	0.45	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-5.1	-177.5	-75.6	169.8	0	0	0	114.6	W264 K366	W264-L338 HydrophobicContact CD2-CG 4.43Å; W264-L338 HydrophobicContact CE3-CD2 4.12Å; W264-L338 HydrophobicContact CE3-CG 3.82Å; W264-L338 HydrophobicContact CH2-CD2 3.47Å; W264-L338 VanDerWaalsContact CH2-CD2 3.47Å; W264-L338 HydrophobicContact CH2-CG 4.13Å; W264-L338 HydrophobicContact CZ2-CD2 4.09Å; W264-L338 HydrophobicContact CZ3-CD2 3.48Å; W264-L338 VanDerWaalsContact CZ3-CD2 3.48Å; W264-L338 HydrophobicContact CZ3-CG 3.66Å; L338-K366 PolarHBondContact O-NZ 3.16Å
339	N	68.8	Low	84.6	Confident	118 Å²	118	69.9 Å²	69.9	63%	0.631	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.8	21.8	-178.3	67.6	-40.8	0	0	0	113.1	A337 D344	A337-N339 VanDerWaalsContact CB-OD1 3.31Å; A337-N339 WeakPolarHBondContact CB-OD1 3.29Å; A337-N339 PolarHBondContact O-N 3.28Å; A337-N339 VanDerWaalsContact O-N 3.15Å; N339-D344 WeakPolarHBondContact CA-OD2 3.31Å
340	E	69.4	Low	84.3	Confident	94 Å²	94	69 Å²	69	44%	0.439	35%	0.345	S	S	.	.			trans	-66.1	132.2	169.1	-157.5	-177.8	-122	0	0	109.2	A337 T342 I343 D344	A337-E340 PolarHBondContact O-N 3.37Å; E340-T342 VanDerWaalsContact CD-OG1 3.22Å; E340-T342 WeakPolarHBondContact CG-OG1 3.38Å; E340-T342 PolarHBondContact O-N 3.39Å; E340-T342 PolarHBondContact OE2-OG1 3.45Å; E340-I343 HydrophobicContact CB-CB 4.37Å; E340-I343 HydrophobicContact CB-CD1 3.98Å; E340-I343 HydrophobicContact CB-CG1 4.16Å; E340-I343 WeakPolarHBondContact O-CA 3.31Å; E340-I343 WeakPolarHBondContact O-CB 3.38Å; E340-I343 PolarHBondContact O-N 3.2Å; E340-D344 PolarHBondContact O-N 2.99Å
341	P	70.9	Confident	83.8	Confident	107 Å²	107	70.2 Å²	70.2	70%	0.695	35%	0.348	S	S	*	.	H	α-helix	trans	-62.3	-27.7	-172.3	21.7	-34	0	0	0	113.9	Y345	P341-Y345 WeakPolarHBondContact O-CB 3.47Å; P341-Y345 PolarHBondContact O-N 3.08Å
342	T	72.9	Confident	83.3	Confident	85 Å²	85	78.3 Å²	78.3	52%	0.521	38%	0.38	S	S	.	.	H	α-helix	trans	-55.9	-51.4	166.7	42.7	0	0	0	0	112.3	E340 G346	E340-T342 VanDerWaalsContact CD-OG1 3.22Å; E340-T342 WeakPolarHBondContact CG-OG1 3.38Å; E340-T342 PolarHBondContact O-N 3.39Å; E340-T342 PolarHBondContact OE2-OG1 3.45Å; T342-G346 PolarHBondContact O-N 2.98Å
343	I	76.9	Confident	82.7	Confident	47 Å²	47	75 Å²	75	24%	0.241	38%	0.379	C	S	.	.	H	α-helix	trans	-69	-45.9	-178.9	-65	175.1	0	0	0	109.8	T336 E340 Y345 G346 F347	T336-I343 HydrophobicContact CG2-CD1 4.43Å; E340-I343 HydrophobicContact CB-CB 4.37Å; E340-I343 HydrophobicContact CB-CD1 3.98Å; E340-I343 HydrophobicContact CB-CG1 4.16Å; E340-I343 WeakPolarHBondContact O-CA 3.31Å; E340-I343 WeakPolarHBondContact O-CB 3.38Å; E340-I343 PolarHBondContact O-N 3.2Å; I343-Y345 PolarHBondContact O-N 2.96Å; I343-G346 WeakPolarHBondContact O-CA 3.42Å; I343-G346 PolarHBondContact O-N 2.82Å; I343-G346 VanDerWaalsContact O-N 3.11Å; I343-F347 HydrophobicContact CG2-CD2 3.81Å; I343-F347 HydrophobicContact CG2-CE2 3.7Å; I343-F347 VanDerWaalsContact O-CD2 3.3Å; I343-F347 WeakPolarHBondContact O-CD2 3.38Å; I343-F347 PolarHBondContact O-N 2.74Å
344	D	79.3	Confident	82.1	Confident	43 Å²	43	75.6 Å²	75.6	23%	0.23	38%	0.382	C	S	.	.	H	α-helix	trans	-65	-36.5	177.4	-88.5	-42.2	0	0	0	112.8	N339 E340 F347 Q348 K366	N339-D344 WeakPolarHBondContact CA-OD2 3.31Å; E340-D344 PolarHBondContact O-N 2.99Å; D344-F347 PolarHBondContact O-N 3.49Å; D344-Q348 VanDerWaalsContact O-CG 3.3Å; D344-Q348 WeakPolarHBondContact O-CG 3.31Å; D344-Q348 PolarHBondContact O-N 2.96Å; D344-K366 VanDerWaalsContact OD1-CE 3.23Å; D344-K366 WeakPolarHBondContact OD1-CE 3.4Å; D344-K366 IonicContact OD1-NZ 3.55Å; D344-K366 PolarHBondContact OD1-NZ 2.77Å; D344-K366 IonicContact OD2-NZ 3.57Å
345	Y	82.4	Confident	81.3	Confident	155 Å²	155	76 Å²	76	61%	0.608	39%	0.389	S	S	*	.	H	α-helix	trans	-62.8	-40.9	169.3	177.7	-97.5	0	0	0	112	P341 I343 F347 Q348 R349	P341-Y345 WeakPolarHBondContact O-CB 3.47Å; P341-Y345 PolarHBondContact O-N 3.08Å; I343-Y345 PolarHBondContact O-N 2.96Å; Y345-F347 PolarHBondContact O-N 2.87Å; Y345-Q348 PolarHBondContact O-N 2.97Å; Y345-R349 PolarHBondContact O-N 2.69Å
346	G	84	Confident	80.5	Confident	28 Å²	28	81.8 Å²	81.8	29%	0.289	41%	0.411	S	S	.	.	H	α-helix	trans	-56.4	-47.3	171.9	0	0	0	0	0	112.5	T342 I343 R349 L350	T342-G346 PolarHBondContact O-N 2.98Å; I343-G346 WeakPolarHBondContact O-CA 3.42Å; I343-G346 PolarHBondContact O-N 2.82Å; I343-G346 VanDerWaalsContact O-N 3.11Å; G346-R349 PolarHBondContact O-N 3.11Å; G346-L350 WeakPolarHBondContact O-CG 3.46Å; G346-L350 PolarHBondContact O-N 3.08Å
347	F	85.8	Confident	79.9	Confident	22 Å²	22	85 Å²	85	10%	0.096	42%	0.423	C	S	.	.	H	α-helix	trans	-63.7	-41	175	-84.5	-72.7	0	0	0	113.2	I343 D344 Y345 R349 L350 Q351 K366 L369 L370	I343-F347 HydrophobicContact CG2-CD2 3.81Å; I343-F347 HydrophobicContact CG2-CE2 3.7Å; I343-F347 VanDerWaalsContact O-CD2 3.3Å; I343-F347 WeakPolarHBondContact O-CD2 3.38Å; I343-F347 PolarHBondContact O-N 2.74Å; D344-F347 PolarHBondContact O-N 3.49Å; Y345-F347 PolarHBondContact O-N 2.87Å; F347-R349 VanDerWaalsContact C-N 3.3Å; F347-R349 PolarHBondContact O-N 3.31Å; F347-L350 PolarHBondContact O-N 3Å; F347-Q351 WeakPolarHBondContact O-CB 3.29Å; F347-Q351 PolarHBondContact O-N 3.28Å; F347-K366 HydrophobicContact CD1-CB 4.14Å; F347-K366 HydrophobicContact CD1-CD 4.37Å; F347-K366 HydrophobicContact CD1-CG 3.81Å; F347-K366 HydrophobicContact CD2-CD 3.87Å; F347-K366 HydrophobicContact CD2-CG 4.23Å; F347-K366 HydrophobicContact CE1-CB 3.57Å; F347-K366 HydrophobicContact CE1-CD 4.23Å; F347-K366 HydrophobicContact CE1-CG 3.72Å; F347-K366 WeakPolarHBondContact CE1-O 3.5Å; F347-K366 HydrophobicContact CE2-CB 4.46Å; F347-K366 HydrophobicContact CE2-CD 3.73Å; F347-K366 HydrophobicContact CE2-CG 4.16Å; F347-K366 HydrophobicContact CG-CD 4.21Å; F347-K366 HydrophobicContact CG-CG 4.07Å; F347-K366 HydrophobicContact CZ-CB 3.76Å; F347-K366 HydrophobicContact CZ-CD 3.92Å; F347-K366 HydrophobicContact CZ-CG 3.91Å; F347-L369 HydrophobicContact CD1-CB 4.31Å; F347-L369 HydrophobicContact CD1-CD1 4.07Å; F347-L369 HydrophobicContact CE1-CB 4.43Å; F347-L370 HydrophobicContact CE1-CD1 4.28Å; F347-L370 HydrophobicContact CE1-CD2 4.33Å; F347-L370 HydrophobicContact CE1-CG 3.84Å; F347-L370 HydrophobicContact CZ-CD1 3.88Å; F347-L370 HydrophobicContact CZ-CD2 4.34Å; F347-L370 HydrophobicContact CZ-CG 3.92Å
348	Q	84.1	Confident	79.5	Confident	113 Å²	113	91.2 Å²	91.2	53%	0.528	46%	0.463	S	S	.	.	H	α-helix	trans	-63	-35.3	174.4	-71.9	173.7	31.7	0	0	112.4	D344 Y345 K352	D344-Q348 VanDerWaalsContact O-CG 3.3Å; D344-Q348 WeakPolarHBondContact O-CG 3.31Å; D344-Q348 PolarHBondContact O-N 2.96Å; Y345-Q348 PolarHBondContact O-N 2.97Å; Q348-K352 WeakPolarHBondContact O-CG 3.17Å
349	R	86.1	Confident	79.7	Confident	173 Å²	173	91.2 Å²	91.2	65%	0.653	48%	0.483	S	S	*	.	H	α-helix	trans	-69.3	-46.2	173.8	-175.9	178.9	174.6	-165	-2.6	111.1	Y345 G346 F347 Q351 K352 V353	Y345-R349 PolarHBondContact O-N 2.69Å; G346-R349 PolarHBondContact O-N 3.11Å; F347-R349 VanDerWaalsContact C-N 3.3Å; F347-R349 PolarHBondContact O-N 3.31Å; R349-Q351 VanDerWaalsContact C-N 3.35Å; R349-Q351 PolarHBondContact O-N 2.84Å; R349-K352 PolarHBondContact O-N 3.32Å; R349-K352 VanDerWaalsContact O-N 3.13Å; R349-V353 PolarHBondContact O-N 2.92Å
350	L	85.2	Confident	80.3	Confident	55 Å²	55	87.2 Å²	87.2	29%	0.288	46%	0.462	S	S	.	.	H	α-helix	trans	-58.4	-44.1	175.9	-74.6	172.5	0	0	0	111.9	G346 F347 K352 V353 I354 L370 A373	G346-L350 WeakPolarHBondContact O-CG 3.46Å; G346-L350 PolarHBondContact O-N 3.08Å; F347-L350 PolarHBondContact O-N 3Å; L350-K352 PolarHBondContact O-N 3.03Å; L350-K352 VanDerWaalsContact O-N 3.08Å; L350-V353 PolarHBondContact O-N 3.48Å; L350-I354 HydrophobicContact CB-CD1 3.87Å; L350-I354 HydrophobicContact CD2-CD1 4.46Å; L350-I354 WeakPolarHBondContact O-CD1 3.23Å; L350-I354 WeakPolarHBondContact O-CG1 3.23Å; L350-I354 PolarHBondContact O-N 3.16Å; L350-L370 HydrophobicContact CD1-CD2 4.3Å; L350-A373 HydrophobicContact CD2-CB 4.18Å
351	Q	84.2	Confident	80.9	Confident	52 Å²	52	86.4 Å²	86.4	24%	0.243	46%	0.464	C	S	.	.	H	α-helix	trans	-61.8	-16.3	177.8	-167.6	-179.7	-0.7	0	0	114.1	F347 R349 L369	F347-Q351 WeakPolarHBondContact O-CB 3.29Å; F347-Q351 PolarHBondContact O-N 3.28Å; R349-Q351 VanDerWaalsContact C-N 3.35Å; R349-Q351 PolarHBondContact O-N 2.84Å; Q351-L369 HydrophobicContact CB-CD1 4.21Å; Q351-L369 HydrophobicContact CB-CD2 4.07Å; Q351-L369 HydrophobicContact CG-CD2 4.22Å
352	K	83.7	Confident	80.9	Confident	181 Å²	181	89.6 Å²	89.6	79%	0.787	47%	0.47	S	S	*	.	H	α-helix	trans	-93.8	-17.8	173.8	-67.4	175.9	-177.1	-177.6	0	114.1	Q348 R349 L350	Q348-K352 WeakPolarHBondContact O-CG 3.17Å; R349-K352 PolarHBondContact O-N 3.32Å; R349-K352 VanDerWaalsContact O-N 3.13Å; L350-K352 PolarHBondContact O-N 3.03Å; L350-K352 VanDerWaalsContact O-N 3.08Å
353	V	84.1	Confident	81.2	Confident	102 Å²	102	95 Å²	95	62%	0.618	48%	0.481	S	S	*	.	H	α-helix	trans	-104.6	-32.1	-175.1	176.9	0	0	0	0	111.9	R349 L350	R349-V353 PolarHBondContact O-N 2.92Å; L350-V353 PolarHBondContact O-N 3.48Å
354	I	84.8	Confident	81.4	Confident	13 Å²	13	93.2 Å²	93.2	7%	0.067	47%	0.472	C	S	.	.	S	Bend	trans	-73	128.3	179.9	-66.7	160.4	0	0	0	110.3	L350 R356 L369 R372 A373	L350-I354 HydrophobicContact CB-CD1 3.87Å; L350-I354 HydrophobicContact CD2-CD1 4.46Å; L350-I354 WeakPolarHBondContact O-CD1 3.23Å; L350-I354 WeakPolarHBondContact O-CG1 3.23Å; L350-I354 PolarHBondContact O-N 3.16Å; I354-R356 PolarHBondContact O-N 3.44Å; I354-L369 HydrophobicContact CD1-CB 4.01Å; I354-L369 HydrophobicContact CD1-CD2 3.73Å; I354-L369 WeakPolarHBondContact CD1-O 3.09Å; I354-R372 HydrophobicContact CG2-CB 3.6Å; I354-R372 HydrophobicContact CG2-CG 4.42Å; I354-A373 HydrophobicContact CD1-CB 4.16Å; I354-A373 HydrophobicContact CG1-CB 4.48Å
355	P	80.1	Confident	81.6	Confident	73 Å²	73	93.1 Å²	93.1	47%	0.474	48%	0.477	S	S	.	.	P	Polyproline II helix	trans	-58.4	133.9	173.5	-26.3	35.7	0	0	0	113.3	H357 R372 L376	P355-H357 PolarHBondContact O-ND1 3.17Å; P355-R372 PolarHBondContact O-NH1 3.05Å; P355-L376 HydrophobicContact CG-CD1 4.34Å
356	R	78.4	Confident	81.7	Confident	125 Å²	125	89.1 Å²	89.1	47%	0.472	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-85.5	143.8	169	-68.2	-175.3	-178.6	-124.7	6.7	110.5	I354 D360 P361 E362	I354-R356 PolarHBondContact O-N 3.44Å; R356-D360 VanDerWaalsContact CA-OD2 3.24Å; R356-D360 WeakPolarHBondContact CA-OD2 3.46Å; R356-P361 PolarHBondContact NH1-O 3.48Å; R356-E362 VanDerWaalsContact CZ-O 3.3Å; R356-E362 PolarHBondContact NH1-O 3.15Å; R356-E362 PolarHBondContact NH2-O 3.11Å
357	H	79.5	Confident	81.8	Confident	107 Å²	107	94.8 Å²	94.8	50%	0.495	48%	0.482	S	S	.	.	P	Polyproline II helix	trans	-104	151.9	176.9	-64.9	65.9	0	0	0	109.7	P355 G359 D360 R372	P355-H357 PolarHBondContact O-ND1 3.17Å; H357-G359 PolarHBondContact O-N 2.77Å; H357-D360 PolarHBondContact N-OD2 2.8Å; H357-D360 WeakPolarHBondContact O-CB 3.45Å; H357-D360 PolarHBondContact O-N 2.99Å; H357-D360 VanDerWaalsContact O-N 3.09Å; H357-R372 PolarHBondContact ND1-NH1 3.32Å
358	P	76.9	Confident	81.7	Confident	137 Å²	137	97.2 Å²	97.2	89%	0.89	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	128.1	173.2	-24.4	34.8	0	0	0	111.2
359	G	77	Confident	81.8	Confident	85 Å²	85	92 Å²	92	88%	0.876	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.3	-1	-175.8	0	0	0	0	0	115.7	H357	H357-G359 PolarHBondContact O-N 2.77Å
360	D	80.9	Confident	82	Confident	35 Å²	35	88.4 Å²	88.4	19%	0.187	46%	0.463	C	S	.	.			trans	-62.1	138.7	172.9	-83.5	-19.3	0	0	0	112.5	R356 H357 L364 R372	R356-D360 VanDerWaalsContact CA-OD2 3.24Å; R356-D360 WeakPolarHBondContact CA-OD2 3.46Å; H357-D360 PolarHBondContact N-OD2 2.8Å; H357-D360 WeakPolarHBondContact O-CB 3.45Å; H357-D360 PolarHBondContact O-N 2.99Å; H357-D360 VanDerWaalsContact O-N 3.09Å; D360-L364 HydrophobicContact CB-CD2 4.2Å; D360-R372 IonicContact OD1-CZ 3.44Å; D360-R372 IonicContact OD1-NH1 2.87Å; D360-R372 PolarHBondContact OD1-NH1 2.94Å; D360-R372 IonicContact OD1-NH2 2.73Å; D360-R372 PolarHBondContact OD1-NH2 2.97Å; D360-R372 IonicContact OD2-CZ 3.48Å; D360-R372 IonicContact OD2-NH1 3.95Å; D360-R372 PolarHBondContact OD2-NH1 3.01Å; D360-R372 IonicContact OD2-NH2 2.71Å
361	P	80.8	Confident	82.1	Confident	76 Å²	76	92 Å²	92	49%	0.494	48%	0.477	S	S	.	.			trans	-65.5	154.6	169.8	29.2	-35.5	0	0	0	111.6	R356 R363 L364	R356-P361 PolarHBondContact NH1-O 3.48Å; P361-R363 PolarHBondContact O-N 3.34Å; P361-R363 VanDerWaalsContact O-N 3.12Å; P361-L364 HydrophobicContact CG-CD2 4.23Å
362	E	72.6	Confident	82.3	Confident	175 Å²	175	91.3 Å²	91.3	82%	0.818	47%	0.472	S	S	*	.	S	Bend	trans	-54.1	-37.3	-178.6	-169.9	-178.6	-176.7	0	0	112.4	R356	R356-E362 VanDerWaalsContact CZ-O 3.3Å; R356-E362 PolarHBondContact NH1-O 3.15Å; R356-E362 PolarHBondContact NH2-O 3.11Å
363	R	78.9	Confident	82.5	Confident	197 Å²	197	83.7 Å²	83.7	74%	0.743	44%	0.443	S	S	*	.	S	Bend	trans	-116	112.5	171.4	-172.7	176.6	-173.4	168.4	2.3	110.5	P361	P361-R363 PolarHBondContact O-N 3.34Å; P361-R363 VanDerWaalsContact O-N 3.12Å
364	L	80.9	Confident	82.7	Confident	10 Å²	10	81 Å²	81	5%	0.052	43%	0.431	C	S	.	.			trans	-72.2	148.3	172.2	-71.5	169.6	0	0	0	111.2	D360 P361 M368 L369	D360-L364 HydrophobicContact CB-CD2 4.2Å; P361-L364 HydrophobicContact CG-CD2 4.23Å; L364-M368 HydrophobicContact CD2-CE 4.18Å; L364-L369 HydrophobicContact CB-CD1 4.4Å; L364-L369 HydrophobicContact CB-CD2 3.91Å; L364-L369 HydrophobicContact CB-CG 3.9Å; L364-L369 HydrophobicContact CD1-CD2 3.83Å
365	A	84.1	Confident	82.8	Confident	42 Å²	42	83.9 Å²	83.9	35%	0.347	45%	0.447	S	S	.	.			trans	-66.9	151	173	0	0	0	0	0	111.7	E367 M368 L369	A365-E367 VanDerWaalsContact C-N 3.28Å; A365-E367 HydrophobicContact CB-CG 4.06Å; A365-E367 PolarHBondContact O-N 3.17Å; A365-M368 HydrophobicContact CB-CB 4.38Å; A365-M368 HydrophobicContact CB-CG 4.33Å; A365-M368 WeakPolarHBondContact O-CB 3.49Å; A365-M368 PolarHBondContact O-N 3.31Å; A365-M368 VanDerWaalsContact O-N 3.14Å; A365-L369 WeakPolarHBondContact O-CG 3.39Å; A365-L369 PolarHBondContact O-N 2.9Å
366	K	84.2	Confident	83.1	Confident	70 Å²	70	83.7 Å²	83.7	30%	0.304	44%	0.441	S	S	.	.	H	α-helix	trans	-58.3	-38.8	179.7	-75.5	-171.6	170.8	-179.1	0	112.3	L338 D344 F347 L369 L370	L338-K366 PolarHBondContact O-NZ 3.16Å; D344-K366 VanDerWaalsContact OD1-CE 3.23Å; D344-K366 WeakPolarHBondContact OD1-CE 3.4Å; D344-K366 IonicContact OD1-NZ 3.55Å; D344-K366 PolarHBondContact OD1-NZ 2.77Å; D344-K366 IonicContact OD2-NZ 3.57Å; F347-K366 HydrophobicContact CD1-CB 4.14Å; F347-K366 HydrophobicContact CD1-CD 4.37Å; F347-K366 HydrophobicContact CD1-CG 3.81Å; F347-K366 HydrophobicContact CD2-CD 3.87Å; F347-K366 HydrophobicContact CD2-CG 4.23Å; F347-K366 HydrophobicContact CE1-CB 3.57Å; F347-K366 HydrophobicContact CE1-CD 4.23Å; F347-K366 HydrophobicContact CE1-CG 3.72Å; F347-K366 WeakPolarHBondContact CE1-O 3.5Å; F347-K366 HydrophobicContact CE2-CB 4.46Å; F347-K366 HydrophobicContact CE2-CD 3.73Å; F347-K366 HydrophobicContact CE2-CG 4.16Å; F347-K366 HydrophobicContact CG-CD 4.21Å; F347-K366 HydrophobicContact CG-CG 4.07Å; F347-K366 HydrophobicContact CZ-CB 3.76Å; F347-K366 HydrophobicContact CZ-CD 3.92Å; F347-K366 HydrophobicContact CZ-CG 3.91Å; K366-L369 PolarHBondContact O-N 2.61Å; K366-L370 PolarHBondContact O-N 2.87Å
367	E	85.4	Confident	83.6	Confident	148 Å²	148	81.3 Å²	81.3	69%	0.692	44%	0.44	S	S	*	.	H	α-helix	trans	-63.2	-43.4	175.2	69.4	-155.6	147.3	0	0	112.9	A365 L369 L370 K371	A365-E367 VanDerWaalsContact C-N 3.28Å; A365-E367 HydrophobicContact CB-CG 4.06Å; A365-E367 PolarHBondContact O-N 3.17Å; E367-L369 VanDerWaalsContact C-N 3.32Å; E367-L369 PolarHBondContact O-N 3.35Å; E367-L370 PolarHBondContact O-N 2.93Å; E367-K371 WeakPolarHBondContact O-CB 3.43Å; E367-K371 PolarHBondContact O-N 2.99Å
368	M	84.2	Confident	83.9	Confident	73 Å²	73	82.6 Å²	82.6	36%	0.36	45%	0.447	S	S	.	.	H	α-helix	trans	-64.2	-37.4	177.1	-78.5	-82.4	-75.1	0	0	111.8	L364 A365 R372	L364-M368 HydrophobicContact CD2-CE 4.18Å; A365-M368 HydrophobicContact CB-CB 4.38Å; A365-M368 HydrophobicContact CB-CG 4.33Å; A365-M368 WeakPolarHBondContact O-CB 3.49Å; A365-M368 PolarHBondContact O-N 3.31Å; A365-M368 VanDerWaalsContact O-N 3.14Å; M368-R372 WeakPolarHBondContact O-CB 3.45Å; M368-R372 WeakPolarHBondContact O-CG 3.31Å; M368-R372 PolarHBondContact O-N 3.15Å
369	L	86.4	Confident	84.2	Confident	4 Å²	4	79 Å²	79	2%	0.021	43%	0.429	C	S	.	.	H	α-helix	trans	-67.4	-48	175.4	-69.2	168.9	0	0	0	111.4	F347 Q351 I354 L364 A365 K366 E367 A373	F347-L369 HydrophobicContact CD1-CB 4.31Å; F347-L369 HydrophobicContact CD1-CD1 4.07Å; F347-L369 HydrophobicContact CE1-CB 4.43Å; Q351-L369 HydrophobicContact CB-CD1 4.21Å; Q351-L369 HydrophobicContact CB-CD2 4.07Å; Q351-L369 HydrophobicContact CG-CD2 4.22Å; I354-L369 HydrophobicContact CD1-CB 4.01Å; I354-L369 HydrophobicContact CD1-CD2 3.73Å; I354-L369 WeakPolarHBondContact CD1-O 3.09Å; L364-L369 HydrophobicContact CB-CD1 4.4Å; L364-L369 HydrophobicContact CB-CD2 3.91Å; L364-L369 HydrophobicContact CB-CG 3.9Å; L364-L369 HydrophobicContact CD1-CD2 3.83Å; A365-L369 WeakPolarHBondContact O-CG 3.39Å; A365-L369 PolarHBondContact O-N 2.9Å; K366-L369 PolarHBondContact O-N 2.61Å; E367-L369 VanDerWaalsContact C-N 3.32Å; E367-L369 PolarHBondContact O-N 3.35Å; L369-A373 WeakPolarHBondContact O-CB 3.42Å; L369-A373 PolarHBondContact O-N 3Å
370	L	89.2	Confident	84.4	Confident	96 Å²	96	80.8 Å²	80.8	50%	0.503	42%	0.417	S	S	.	.	H	α-helix	trans	-63.7	-42.1	176.8	-75.9	176.7	0	0	0	112.1	F347 L350 K366 E367 A373 A374	F347-L370 HydrophobicContact CE1-CD1 4.28Å; F347-L370 HydrophobicContact CE1-CD2 4.33Å; F347-L370 HydrophobicContact CE1-CG 3.84Å; F347-L370 HydrophobicContact CZ-CD1 3.88Å; F347-L370 HydrophobicContact CZ-CD2 4.34Å; F347-L370 HydrophobicContact CZ-CG 3.92Å; L350-L370 HydrophobicContact CD1-CD2 4.3Å; K366-L370 PolarHBondContact O-N 2.87Å; E367-L370 PolarHBondContact O-N 2.93Å; L370-A373 PolarHBondContact O-N 3.26Å; L370-A374 PolarHBondContact O-N 3.07Å
371	K	88.3	Confident	84.2	Confident	131 Å²	131	88.7 Å²	88.7	57%	0.57	45%	0.446	S	S	*	.	H	α-helix	trans	-58.3	-54.8	177.1	-174.9	-178.7	173.4	-179.5	0	111	E367 A373 A374 D375	E367-K371 WeakPolarHBondContact O-CB 3.43Å; E367-K371 PolarHBondContact O-N 2.99Å; K371-A373 PolarHBondContact O-N 3.3Å; K371-A374 CarbonylContact O-C 3.54Å; K371-A374 WeakPolarHBondContact O-CA 3.23Å; K371-A374 WeakPolarHBondContact O-CB 3.37Å; K371-A374 PolarHBondContact O-N 2.81Å; K371-D375 PolarHBondContact O-N 3.43Å
372	R	87.9	Confident	83.5	Confident	37 Å²	37	87.8 Å²	87.8	14%	0.14	45%	0.45	C	S	.	.	H	α-helix	trans	-64.6	-27.1	179.8	-70.6	-176.9	-177.1	172	5.9	113.8	I354 P355 H357 D360 M368 D375 L376	I354-R372 HydrophobicContact CG2-CB 3.6Å; I354-R372 HydrophobicContact CG2-CG 4.42Å; P355-R372 PolarHBondContact O-NH1 3.05Å; H357-R372 PolarHBondContact ND1-NH1 3.32Å; D360-R372 IonicContact OD1-CZ 3.44Å; D360-R372 IonicContact OD1-NH1 2.87Å; D360-R372 PolarHBondContact OD1-NH1 2.94Å; D360-R372 IonicContact OD1-NH2 2.73Å; D360-R372 PolarHBondContact OD1-NH2 2.97Å; D360-R372 IonicContact OD2-CZ 3.48Å; D360-R372 IonicContact OD2-NH1 3.95Å; D360-R372 PolarHBondContact OD2-NH1 3.01Å; D360-R372 IonicContact OD2-NH2 2.71Å; M368-R372 WeakPolarHBondContact O-CB 3.45Å; M368-R372 WeakPolarHBondContact O-CG 3.31Å; M368-R372 PolarHBondContact O-N 3.15Å; R372-D375 WeakPolarHBondContact CA-OD2 3.39Å; R372-L376 VanDerWaalsContact O-CB 3.23Å; R372-L376 WeakPolarHBondContact O-CB 3.46Å; R372-L376 PolarHBondContact O-N 2.98Å; R372-L376 VanDerWaalsContact O-N 3.07Å
373	A	88.3	Confident	82.8	Confident	22 Å²	22	83.9 Å²	83.9	18%	0.182	44%	0.439	C	S	.	.	H	α-helix	trans	-68	-41.4	170.9	0	0	0	0	0	111.7	L350 I354 L369 L370 K371 V377	L350-A373 HydrophobicContact CD2-CB 4.18Å; I354-A373 HydrophobicContact CD1-CB 4.16Å; I354-A373 HydrophobicContact CG1-CB 4.48Å; L369-A373 WeakPolarHBondContact O-CB 3.42Å; L369-A373 PolarHBondContact O-N 3Å; L370-A373 PolarHBondContact O-N 3.26Å; K371-A373 PolarHBondContact O-N 3.3Å; A373-V377 VanDerWaalsContact O-CG2 3.31Å; A373-V377 WeakPolarHBondContact O-CG2 3.35Å; A373-V377 PolarHBondContact O-N 2.92Å; A373-V377 VanDerWaalsContact O-N 3.08Å
374	A	88.4	Confident	81.6	Confident	44 Å²	44	79.4 Å²	79.4	36%	0.364	44%	0.435	S	S	.	.	H	α-helix	trans	-65.2	-51.3	172.5	0	0	0	0	0	111.3	L370 K371 L376 V377 E378	L370-A374 PolarHBondContact O-N 3.07Å; K371-A374 CarbonylContact O-C 3.54Å; K371-A374 WeakPolarHBondContact O-CA 3.23Å; K371-A374 WeakPolarHBondContact O-CB 3.37Å; K371-A374 PolarHBondContact O-N 2.81Å; A374-L376 PolarHBondContact O-N 2.86Å; A374-L376 VanDerWaalsContact O-N 3.15Å; A374-V377 PolarHBondContact O-N 3.11Å; A374-E378 WeakPolarHBondContact O-CB 3.44Å; A374-E378 WeakPolarHBondContact O-CG 3.3Å; A374-E378 PolarHBondContact O-N 3.27Å
375	D	87.4	Confident	80.4	Confident	75 Å²	75	85.5 Å²	85.5	40%	0.401	46%	0.463	S	S	.	.	H	α-helix	trans	-51.1	-41.2	177.4	-56	-31.3	0	0	0	111.4	K371 R372 A379	K371-D375 PolarHBondContact O-N 3.43Å; R372-D375 WeakPolarHBondContact CA-OD2 3.39Å; D375-A379 WeakPolarHBondContact O-CB 3.3Å; D375-A379 PolarHBondContact O-N 3.47Å
376	L	85.8	Confident	79.1	Confident	69 Å²	69	88.5 Å²	88.5	36%	0.361	47%	0.473	S	S	.	.	H	α-helix	trans	-73.1	-37.4	178.6	-178.3	147.5	0	0	0	113.2	P355 R372 A374 L380	P355-L376 HydrophobicContact CG-CD1 4.34Å; R372-L376 VanDerWaalsContact O-CB 3.23Å; R372-L376 WeakPolarHBondContact O-CB 3.46Å; R372-L376 PolarHBondContact O-N 2.98Å; R372-L376 VanDerWaalsContact O-N 3.07Å; A374-L376 PolarHBondContact O-N 2.86Å; A374-L376 VanDerWaalsContact O-N 3.15Å; L376-L380 HydrophobicContact CD2-CD1 3.76Å; L376-L380 VanDerWaalsContact O-CG 3.31Å; L376-L380 WeakPolarHBondContact O-CG 3.42Å; L376-L380 PolarHBondContact O-N 3.33Å
377	V	87.7	Confident	77.6	Confident	74 Å²	74	91.7 Å²	91.7	45%	0.448	49%	0.493	S	S	.	.	H	α-helix	trans	-69.2	-40.8	174	169.6	0	0	0	0	110.5	A373 A374 A379 L380 Y381	A373-V377 VanDerWaalsContact O-CG2 3.31Å; A373-V377 WeakPolarHBondContact O-CG2 3.35Å; A373-V377 PolarHBondContact O-N 2.92Å; A373-V377 VanDerWaalsContact O-N 3.08Å; A374-V377 PolarHBondContact O-N 3.11Å; V377-A379 VanDerWaalsContact C-N 3.34Å; V377-A379 PolarHBondContact O-N 2.91Å; V377-L380 PolarHBondContact O-N 2.91Å; V377-L380 VanDerWaalsContact O-N 3.16Å; V377-Y381 HydrophobicContact CG1-CD2 3.84Å; V377-Y381 HydrophobicContact CG1-CE2 4.15Å; V377-Y381 WeakPolarHBondContact O-CD2 3.44Å; V377-Y381 PolarHBondContact O-N 2.91Å
378	E	87	Confident	76.1	Confident	134 Å²	134	91.3 Å²	91.3	63%	0.626	49%	0.492	S	S	*	.	H	α-helix	trans	-62.9	-38.9	174.4	-72	179.9	-165.6	0	0	111.6	A374 L380 Y381 G382	A374-E378 WeakPolarHBondContact O-CB 3.44Å; A374-E378 WeakPolarHBondContact O-CG 3.3Å; A374-E378 PolarHBondContact O-N 3.27Å; E378-L380 VanDerWaalsContact C-N 3.33Å; E378-L380 PolarHBondContact O-N 2.96Å; E378-Y381 PolarHBondContact O-N 2.67Å; E378-G382 VanDerWaalsContact O-CA 3.29Å; E378-G382 WeakPolarHBondContact O-CA 3.21Å; E378-G382 PolarHBondContact O-N 3.48Å
379	A	83.6	Confident	74.7	Confident	63 Å²	63	92 Å²	92	52%	0.521	50%	0.497	S	S	.	.	H	α-helix	trans	-62.6	-37	172.5	0	0	0	0	0	113.3	D375 V377 T383	D375-A379 WeakPolarHBondContact O-CB 3.3Å; D375-A379 PolarHBondContact O-N 3.47Å; V377-A379 VanDerWaalsContact C-N 3.34Å; V377-A379 PolarHBondContact O-N 2.91Å; A379-T383 PolarHBondContact O-OG1 2.74Å; A379-T383 VanDerWaalsContact O-OG1 3.11Å
380	L	81.1	Confident	73.4	Confident	121 Å²	121	96.5 Å²	96.5	63%	0.634	52%	0.52	S	S	*	.	H	α-helix	trans	-74.6	-30.8	179.6	-73.2	170.4	0	0	0	114.1	L376 V377 E378	L376-L380 HydrophobicContact CD2-CD1 3.76Å; L376-L380 VanDerWaalsContact O-CG 3.31Å; L376-L380 WeakPolarHBondContact O-CG 3.42Å; L376-L380 PolarHBondContact O-N 3.33Å; V377-L380 PolarHBondContact O-N 2.91Å; V377-L380 VanDerWaalsContact O-N 3.16Å; E378-L380 VanDerWaalsContact C-N 3.33Å; E378-L380 PolarHBondContact O-N 2.96Å
381	Y	76.8	Confident	71.9	Confident	202 Å²	202	97.5 Å²	97.5	79%	0.792	53%	0.525	S	S	*	.	H	α-helix	trans	-106.6	-16.1	-178.4	-72.5	-79.4	0	0	0	114.3	V377 E378	V377-Y381 HydrophobicContact CG1-CD2 3.84Å; V377-Y381 HydrophobicContact CG1-CE2 4.15Å; V377-Y381 WeakPolarHBondContact O-CD2 3.44Å; V377-Y381 PolarHBondContact O-N 2.91Å; E378-Y381 PolarHBondContact O-N 2.67Å
382	G	65.6	Low	70.6	Confident	56 Å²	56	97.1 Å²	97.1	58%	0.577	53%	0.528	S	S	*	.	S	Bend	trans	-85.3	1.5	-178	0	0	0	0	0	115.5	E378 P384	E378-G382 VanDerWaalsContact O-CA 3.29Å; E378-G382 WeakPolarHBondContact O-CA 3.21Å; E378-G382 PolarHBondContact O-N 3.48Å; G382-P384 WeakPolarHBondContact O-CD 3.23Å
383	T	58.2	Low	69.2	Low	94 Å²	94	102.4 Å²	102.4	58%	0.577	55%	0.552	S	S	*	*			trans	-113.1	82.7	-175.2	42.3	0	0	0	0	113.4	A379	A379-T383 PolarHBondContact O-OG1 2.74Å; A379-T383 VanDerWaalsContact O-OG1 3.11Å
384	P	53.3	Low	67.8	Low	102 Å²	102	110 Å²	110	66%	0.662	58%	0.576	S	S	*	*			trans	-71.7	139.7	159.9	31.7	-32.2	0	0	0	109.8	G382	G382-P384 WeakPolarHBondContact O-CD 3.23Å
385	H	55	Low	66.3	Low	138 Å²	138	110.4 Å²	110.4	64%	0.639	58%	0.58	S	S	*	*			trans	78	106.4	-173.5	-49.8	79.5	0	0	0	115.6
386	N	57.3	Low	65.1	Low	106 Å²	106	109.3 Å²	109.3	57%	0.567	58%	0.581	S	S	*	*	S	Bend	trans	-167.7	-35.1	152.9	-120.2	-41.2	0	0	0	110.3	Q388 D389 I390	N386-Q388 VanDerWaalsContact C-N 3.31Å; N386-Q388 PolarHBondContact O-N 3.13Å; N386-D389 PolarHBondContact O-N 3.39Å; N386-I390 WeakPolarHBondContact O-CG1 3.39Å; N386-I390 PolarHBondContact O-N 3.32Å
387	N	53.4	Low	63.9	Low	136 Å²	136	110.6 Å²	110.6	73%	0.727	59%	0.588	S	S	*	*	H	α-helix	trans	-66.7	-26.5	179.7	-72.4	-8.1	0	0	0	114	I391	N387-I391 VanDerWaalsContact O-CD1 3.32Å; N387-I391 WeakPolarHBondContact O-CD1 3.49Å; N387-I391 WeakPolarHBondContact O-CG1 3.33Å
388	Q	52.5	Low	62.7	Low	141 Å²	141	112.2 Å²	112.2	66%	0.659	59%	0.593	S	S	*	*	H	α-helix	trans	-77.9	-47.3	175.1	-81.7	-175.5	-41.4	0	0	111.7	N386 I390 I391 L392	N386-Q388 VanDerWaalsContact C-N 3.31Å; N386-Q388 PolarHBondContact O-N 3.13Å; Q388-I390 VanDerWaalsContact C-N 3.33Å; Q388-I390 PolarHBondContact O-N 2.91Å; Q388-I391 PolarHBondContact O-N 3.43Å; Q388-L392 WeakPolarHBondContact O-CB 3.4Å; Q388-L392 PolarHBondContact O-N 3.08Å
389	D	55.1	Low	61.4	Low	86 Å²	86	107.8 Å²	107.8	46%	0.46	58%	0.579	S	S	.	*	H	α-helix	trans	-64.3	-34.5	-175.5	-55.8	-79.8	0	0	0	113.2	N386 I391 L392 K393	N386-D389 PolarHBondContact O-N 3.39Å; D389-I391 VanDerWaalsContact C-N 3.31Å; D389-I391 PolarHBondContact O-N 3.26Å; D389-L392 PolarHBondContact O-N 3.37Å; D389-K393 WeakPolarHBondContact O-CB 3.45Å; D389-K393 PolarHBondContact O-N 3.44Å
390	I	58.8	Low	60.2	Low	99 Å²	99	112.1 Å²	112.1	51%	0.508	59%	0.589	S	S	.	*	H	α-helix	trans	-65	-35.8	174	-65.7	169	0	0	0	111.5	N386 Q388 R394	N386-I390 WeakPolarHBondContact O-CG1 3.39Å; N386-I390 PolarHBondContact O-N 3.32Å; Q388-I390 VanDerWaalsContact C-N 3.33Å; Q388-I390 PolarHBondContact O-N 2.91Å; I390-R394 PolarHBondContact O-N 3.02Å
391	I	59.5	Low	59	Low	118 Å²	118	110.1 Å²	110.1	61%	0.605	59%	0.59	S	S	*	*	H	α-helix	trans	-75.3	-43.9	176.1	-64.8	172.7	0	0	0	110.2	N387 Q388 D389 K393 R394 A395	N387-I391 VanDerWaalsContact O-CD1 3.32Å; N387-I391 WeakPolarHBondContact O-CD1 3.49Å; N387-I391 WeakPolarHBondContact O-CG1 3.33Å; Q388-I391 PolarHBondContact O-N 3.43Å; D389-I391 VanDerWaalsContact C-N 3.31Å; D389-I391 PolarHBondContact O-N 3.26Å; I391-K393 VanDerWaalsContact C-N 3.35Å; I391-K393 PolarHBondContact O-N 2.89Å; I391-R394 PolarHBondContact O-N 2.94Å; I391-A395 WeakPolarHBondContact O-CB 3.13Å; I391-A395 PolarHBondContact O-N 2.99Å
392	L	60.9	Low	57.8	Low	122 Å²	122	107 Å²	107	64%	0.639	59%	0.586	S	S	*	*	H	α-helix	trans	-65.3	-38.2	-179.1	-140	73.7	0	0	0	111.8	Q388 D389 A395 A396	Q388-L392 WeakPolarHBondContact O-CB 3.4Å; Q388-L392 PolarHBondContact O-N 3.08Å; D389-L392 PolarHBondContact O-N 3.37Å; L392-A395 PolarHBondContact O-N 3.4Å; L392-A396 PolarHBondContact O-N 3.45Å
393	K	57.8	Low	57.1	Low	148 Å²	148	114 Å²	114	64%	0.643	60%	0.596	S	S	*	*	H	α-helix	trans	-67.2	-46	176.1	-166	164.6	-174	171.9	0	111.8	D389 I391 A395 A396 D397	D389-K393 WeakPolarHBondContact O-CB 3.45Å; D389-K393 PolarHBondContact O-N 3.44Å; I391-K393 VanDerWaalsContact C-N 3.35Å; I391-K393 PolarHBondContact O-N 2.89Å; K393-A395 VanDerWaalsContact C-N 3.27Å; K393-A395 PolarHBondContact O-N 3.07Å; K393-A396 WeakPolarHBondContact O-CB 3.48Å; K393-A396 PolarHBondContact O-N 3.04Å; K393-A396 VanDerWaalsContact O-N 3.12Å; K393-D397 PolarHBondContact O-N 3.14Å
394	R	58.4	Low	56.6	Low	181 Å²	181	114.5 Å²	114.5	68%	0.683	60%	0.604	S	S	*	*	H	α-helix	trans	-58.4	-37.6	170.4	-89.4	-177.1	168.1	164.2	-2.2	113	I390 I391 I398	I390-R394 PolarHBondContact O-N 3.02Å; I391-R394 PolarHBondContact O-N 2.94Å; R394-I398 WeakPolarHBondContact O-CB 3.44Å; R394-I398 WeakPolarHBondContact O-CD1 3.46Å; R394-I398 VanDerWaalsContact O-CG1 3.23Å; R394-I398 WeakPolarHBondContact O-CG1 3.43Å; R394-I398 PolarHBondContact O-N 3.3Å; R394-I398 VanDerWaalsContact O-N 3.11Å
395	A	57.6	Low	56	Low	54 Å²	54	115.8 Å²	115.8	45%	0.446	61%	0.61	S	S	.	*	H	α-helix	trans	-68.2	-36.5	176.4	0	0	0	0	0	112.2	I391 L392 K393 A399	I391-A395 WeakPolarHBondContact O-CB 3.13Å; I391-A395 PolarHBondContact O-N 2.99Å; L392-A395 PolarHBondContact O-N 3.4Å; K393-A395 VanDerWaalsContact C-N 3.27Å; K393-A395 PolarHBondContact O-N 3.07Å; A395-A399 VanDerWaalsContact O-CB 3.31Å; A395-A399 WeakPolarHBondContact O-CB 3.4Å; A395-A399 PolarHBondContact O-N 3.42Å
396	A	62.3	Low	55.2	Low	52 Å²	52	115.2 Å²	115.2	43%	0.43	62%	0.618	S	S	.	*	H	α-helix	trans	-67.8	-46.8	174.1	0	0	0	0	0	112.2	L392 K393 I398 A399 E400	L392-A396 PolarHBondContact O-N 3.45Å; K393-A396 WeakPolarHBondContact O-CB 3.48Å; K393-A396 PolarHBondContact O-N 3.04Å; K393-A396 VanDerWaalsContact O-N 3.12Å; A396-I398 VanDerWaalsContact C-N 3.26Å; A396-I398 PolarHBondContact O-N 3.46Å; A396-A399 WeakPolarHBondContact O-CB 3.48Å; A396-A399 PolarHBondContact O-N 3.32Å; A396-E400 PolarHBondContact O-N 2.78Å
397	D	61	Low	54.5	Low	95 Å²	95	121.4 Å²	121.4	51%	0.508	63%	0.634	S	S	.	*	H	α-helix	trans	-58.9	-38	177.6	-58.6	-25.8	0	0	0	111.4	K393	K393-D397 PolarHBondContact O-N 3.14Å
398	I	62.7	Low	53.3	Low	109 Å²	109	122.7 Å²	122.7	56%	0.559	64%	0.64	S	S	*	*	H	α-helix	trans	-72.8	-33.4	174.3	-68.7	167.6	0	0	0	111.7	R394 A396 L402	R394-I398 WeakPolarHBondContact O-CB 3.44Å; R394-I398 WeakPolarHBondContact O-CD1 3.46Å; R394-I398 VanDerWaalsContact O-CG1 3.23Å; R394-I398 WeakPolarHBondContact O-CG1 3.43Å; R394-I398 PolarHBondContact O-N 3.3Å; R394-I398 VanDerWaalsContact O-N 3.11Å; A396-I398 VanDerWaalsContact C-N 3.26Å; A396-I398 PolarHBondContact O-N 3.46Å; I398-L402 HydrophobicContact CG2-CD1 4.11Å; I398-L402 WeakPolarHBondContact O-CG 3.24Å; I398-L402 PolarHBondContact O-N 2.69Å
399	A	57.9	Low	52.9	Low	40 Å²	40	120.9 Å²	120.9	33%	0.331	64%	0.641	S	S	.	*	H	α-helix	trans	-70.6	-43.4	179.3	0	0	0	0	0	112.6	A395 A396 A401 L402 Y403	A395-A399 VanDerWaalsContact O-CB 3.31Å; A395-A399 WeakPolarHBondContact O-CB 3.4Å; A395-A399 PolarHBondContact O-N 3.42Å; A396-A399 WeakPolarHBondContact O-CB 3.48Å; A396-A399 PolarHBondContact O-N 3.32Å; A399-A401 VanDerWaalsContact C-N 3.29Å; A399-A401 PolarHBondContact O-N 3.35Å; A399-L402 PolarHBondContact O-N 3.49Å; A399-L402 VanDerWaalsContact O-N 3.08Å; A399-Y403 WeakPolarHBondContact O-CD2 3.38Å; A399-Y403 PolarHBondContact O-N 2.83Å
400	E	59.4	Low	51.8	Low	155 Å²	155	122.2 Å²	122.2	72%	0.724	66%	0.657	S	S	*	*	H	α-helix	trans	-60	-40.2	175.7	-77.5	-159.2	130.4	0	0	111.9	A396 L402 Y403	A396-E400 PolarHBondContact O-N 2.78Å; E400-L402 PolarHBondContact O-N 2.71Å; E400-L402 VanDerWaalsContact O-N 3.16Å; E400-Y403 PolarHBondContact O-N 2.84Å
401	A	55.8	Low	50.5	Low	79 Å²	79	125.4 Å²	125.4	65%	0.653	67%	0.67	S	S	*	*	H	α-helix	trans	-61.8	-21.1	176.4	0	0	0	0	0	113.9	A399	A399-A401 VanDerWaalsContact C-N 3.29Å; A399-A401 PolarHBondContact O-N 3.35Å
402	L	52.3	Low	49.4	Very low	136 Å²	136	126.7 Å²	126.7	71%	0.712	68%	0.677	S	S	*	*	H	α-helix	trans	-97.9	-10.6	-178.4	-70.3	171	0	0	0	114.4	I398 A399 E400	I398-L402 HydrophobicContact CG2-CD1 4.11Å; I398-L402 WeakPolarHBondContact O-CG 3.24Å; I398-L402 PolarHBondContact O-N 2.69Å; A399-L402 PolarHBondContact O-N 3.49Å; A399-L402 VanDerWaalsContact O-N 3.08Å; E400-L402 PolarHBondContact O-N 2.71Å; E400-L402 VanDerWaalsContact O-N 3.16Å
403	Y	50.8	Low	48.6	Very low	202 Å²	202	126.1 Å²	126.1	79%	0.792	68%	0.681	S	S	*	*	S	Bend	trans	-94.2	1.1	-177.7	-90.5	-71.8	0	0	0	115.4	A399 E400 V405	A399-Y403 WeakPolarHBondContact O-CD2 3.38Å; A399-Y403 PolarHBondContact O-N 2.83Å; E400-Y403 PolarHBondContact O-N 2.84Å; Y403-V405 PolarHBondContact O-N 3.22Å
404	S	46.3	Very low	47.4	Very low	105 Å²	105	123.3 Å²	123.3	73%	0.734	69%	0.685	S	S	*	*	S	Bend	trans	-97.8	60.9	179.3	-67.1	0	0	0	0	114.2
405	V	41.6	Very low	46.1	Very low	130 Å²	130	122.4 Å²	122.4	79%	0.788	69%	0.693	S	S	*	*	S	Bend	trans	-168.7	146.2	156.4	130.5	0	0	0	0	109.8	Y403	Y403-V405 PolarHBondContact O-N 3.22Å
406	P	38.1	Very low	44.7	Very low	125 Å²	125	124.9 Å²	124.9	81%	0.812	71%	0.707	S	S	*	*			trans	-85.2	162.6	-159.9	32	-37.3	0	0	0	118
407	R	41.9	Very low	43.3	Very low	236 Å²	236	127.4 Å²	127.4	89%	0.891	72%	0.721	S	S	*	*			trans	-75	162.9	-178.7	-69.4	175.2	163.7	143	-5.3	115.3
408	N	28.8	Very low	41.8	Very low	163 Å²	163	128.4 Å²	128.4	87%	0.872	74%	0.736	S	S	*	*				-150.4	153.1	123.1	-138.8	14.7	0	0	0	112.2
409	P	44.8	Very low	41	Very low	104 Å²	104	129 Å²	129	68%	0.675	75%	0.747	S	S	*	*			trans	-122.2	150.6	-168.6	40.9	-29.8	0	0	0	117.4
410	S	30.9	Very low	39.7	Very low	114 Å²	114	131.1 Å²	131.1	80%	0.797	77%	0.765	S	S	*	*			trans	-179.9	152.3	162.1	30.2	0	0	0	0	110
411	Q	32.8	Very low	38.3	Very low	166 Å²	166	133 Å²	133	78%	0.776	77%	0.773	S	S	*	*			cis	-165.1	154.4	-16	-121.5	-178.1	-3	0	0	111.1
412	L	34.9	Very low	37	Very low	145 Å²	145	134.5 Å²	134.5	76%	0.759	78%	0.778	S	S	*	*			trans	74.6	169	153.9	-59.8	166.8	0	0	0	118.2
413	P	45.5	Very low	35.8	Very low	109 Å²	109	131.6 Å²	131.6	71%	0.708	78%	0.781	S	S	*	*				-145.1	-179.4	-84.3	41.7	-21	0	0	0	118.3
414	A	31.3	Very low	34.8	Very low	90 Å²	90	130.2 Å²	130.2	74%	0.744	78%	0.784	S	S	*	*			trans	71.5	154.2	146.1	0	0	0	0	0	121.4
415	L	31.8	Very low	34	Very low	162 Å²	162	134 Å²	134	85%	0.848	79%	0.792	S	S	*	*			cis	-170.1	171	-40.1	-119.4	172.6	0	0	0	110.6
416	S	28.1	Very low	33.3	Very low	105 Å²	105	131.4 Å²	131.4	73%	0.734	79%	0.793	S	S	*	*			trans	69.2	156.4	166.1	84.3	0	0	0	0	119.6
417	S	32	Very low	32.9	Very low	105 Å²	105	132.4 Å²	132.4	73%	0.734	79%	0.79	S	S	*	*			cis	-165.8	136.8	-37.9	52.7	0	0	0	0	112.8
418	S	30	Very low	32.2	Very low	116 Å²	116	127.8 Å²	127.8	81%	0.811	78%	0.782	S	S	*	*			trans	-3.8	170.6	150.2	-54.9	0	0	0	0	122.8
419	P	46.6	Very low	32.3	Very low	123 Å²	123	124.2 Å²	124.2	80%	0.799	77%	0.771	S	S	*	*			cis	-135	-178.2	-7.9	31.4	-9.4	0	0	0	115.5
420	A	30	Very low	31.5	Very low	84 Å²	84	130.8 Å²	130.8	69%	0.694	78%	0.784	S	S	*	*				147.1	129.9	111.3	0	0	0	0	0	117.8
421	H	29.9	Very low	31.5	Very low	194 Å²	194	128.7 Å²	128.7	90%	0.898	78%	0.78	S	S	*	*			trans	63.7	167.5	152.1	-82.9	-67.7	0	0	0	122.7
422	S	28.5	Very low	31.5	Very low	110 Å²	110	126.8 Å²	126.8	77%	0.769	79%	0.785	S	S	*	*			trans	-143	140.1	-152.6	55.1	0	0	0	0	111.8
423	G	27.9	Very low	31.3	Very low	75 Å²	75	129 Å²	129	77%	0.773	79%	0.791	S	S	*	*			trans	164.8	99.1	164.2	0	0	0	0	0	118.5
424	M	28.6	Very low	30.6	Very low	174 Å²	174	132 Å²	132	86%	0.857	80%	0.8	S	S	*	*			trans	66.7	135.5	134.4	-166.3	147.9	66.8	0	0	121.7
425	M	29.8	Very low	30.5	Very low	183 Å²	183	131 Å²	131	90%	0.901	80%	0.799	S	S	*	*			trans	67.3	148.7	172	-65.3	-68.7	-170.3	0	0	117.6
426	G	26.7	Very low	30.3	Very low	77 Å²	77	130.4 Å²	130.4	79%	0.794	80%	0.802	S	S	*	*			trans	163.9	54.8	177.3	0	0	0	0	0	118.8
427	I	29.2	Very low	30.3	Very low	146 Å²	146	130.3 Å²	130.3	75%	0.749	80%	0.801	S	S	*	*			trans	-35.4	156.9	169.1	-42.5	162.9	0	0	0	116
428	N	28.2	Very low	30.2	Very low	138 Å²	138	132.6 Å²	132.6	74%	0.738	80%	0.803	S	S	*	*			trans	103.9	160.7	157	-66.5	-61.8	0	0	0	118.8
429	S	30.6	Very low	30.1	Very low	89 Å²	89	131.3 Å²	131.3	62%	0.622	79%	0.794	S	S	*	*			cis	-176	160	-34.8	-92.6	0	0	0	0	110.2
430	Y	27.9	Very low	29.2	Very low	242 Å²	242	133.5 Å²	133.5	95%	0.949	79%	0.794	S	S	*	*			trans	-144.9	141.6	156.5	-68.4	-82	0	0	0	109.3
431	G	32.1	Very low	29.1	Very low	70 Å²	70	133.6 Å²	133.6	72%	0.722	79%	0.79	S	S	*	*			cis	148.3	95	-10.6	0	0	0	0	0	114.1
432	S	31.1	Very low	29	Very low	125 Å²	125	130.1 Å²	130.1	87%	0.874	78%	0.782	S	S	*	*			trans	-177.7	103.8	163.7	-77.3	0	0	0	0	108.1
433	Q	31.3	Very low	29.1	Very low	191 Å²	191	134.2 Å²	134.2	89%	0.893	79%	0.789	S	S	*	*				80.4	122.2	62.5	-84.4	-152.8	-19.2	0	0	117.4
434	L	31.1	Very low	29	Very low	173 Å²	173	134.1 Å²	134.1	91%	0.906	79%	0.788	S	S	*	*			trans	121.4	123.6	165.3	-70.1	168.8	0	0	0	110.1
435	G	28.6	Very low	29	Very low	70 Å²	70	132.8 Å²	132.8	72%	0.722	79%	0.785	S	S	*	*			cis	116.3	127.4	19.6	0	0	0	0	0	107.7
436	V	28.4	Very low	29	Very low	148 Å²	148	129.7 Å²	129.7	90%	0.897	77%	0.771	S	S	*	*			cis	-141.6	166.4	27.9	169.4	0	0	0	0	111.3
437	S	28.8	Very low	29.2	Very low	103 Å²	103	134.6 Å²	134.6	72%	0.72	77%	0.774	S	S	*	*			trans	-114	170.1	-174	56.5	0	0	0	0	114.7
438	I	29.1	Very low	29.2	Very low	153 Å²	153	131 Å²	131	79%	0.785	77%	0.773	S	S	*	*			trans	178.1	111.1	151.7	-94.3	147.8	0	0	0	104.8
439	S	28.2	Very low	29.2	Very low	89 Å²	89	135.4 Å²	135.4	62%	0.622	78%	0.78	S	S	*	*				66.9	140.5	72.8	81.3	0	0	0	0	113.4
440	E	26.8	Very low	29.4	Very low	169 Å²	169	138.4 Å²	138.4	79%	0.79	79%	0.788	S	S	*	*			cis	-158.3	174	9.1	-139.2	168.6	127.6	0	0	114.2
441	S	28	Very low	29.4	Very low	87 Å²	87	138.7 Å²	138.7	61%	0.608	79%	0.787	S	S	*	*			trans	5.3	154.2	150.7	57.4	0	0	0	0	123.1
442	T	28.2	Very low	29.4	Very low	120 Å²	120	142.4 Å²	142.4	74%	0.736	79%	0.791	S	S	*	*			cis	-173.6	166.5	-15.8	31.4	0	0	0	0	111.7
443	Q	29.5	Very low	29.2	Very low	197 Å²	197	141.9 Å²	141.9	92%	0.921	78%	0.782	S	S	*	*			trans	75.5	152.7	152.1	-78	177.7	18.1	0	0	121.6
444	G	26.8	Very low	29.1	Very low	72 Å²	72	137.8 Å²	137.8	74%	0.742	78%	0.775	S	S	*	*			trans	109.5	63.1	170.8	0	0	0	0	0	115.8
445	N	28.6	Very low	29.1	Very low	147 Å²	147	134.3 Å²	134.3	79%	0.786	77%	0.765	S	S	*	*				86	145.5	73	-167	30.9	0	0	0	115.5
446	N	30.8	Very low	29.1	Very low	117 Å²	117	138.3 Å²	138.3	63%	0.626	77%	0.768	S	S	*	*			trans	80.4	127.1	166.8	-89.4	-34.1	0	0	0	122.3
447	Q	30.5	Very low	29.3	Very low	181 Å²	181	136.6 Å²	136.6	85%	0.846	76%	0.763	S	S	*	*			trans	67.9	137.8	146.8	-59.5	166.9	16.7	0	0	119.2
448	G	28.5	Very low	30.1	Very low	70 Å²	70	137.9 Å²	137.9	72%	0.722	77%	0.769	S	S	*	*			cis	179.1	158.6	-7	0	0	0	0	0	114.9
449	Y	29.2	Very low	30.4	Very low	230 Å²	230	141.6 Å²	141.6	90%	0.902	77%	0.773	S	S	*	*			trans	48.6	96.8	162.5	-76.2	-80.4	0	0	0	122.6
450	I	33.6	Very low	30.3	Very low	152 Å²	152	140.8 Å²	140.8	78%	0.779	78%	0.779	S	S	*	*			trans	-18.1	135	136	-63.6	162.5	0	0	0	116.1
451	R	28.1	Very low	30.5	Very low	249 Å²	249	143 Å²	143	94%	0.94	78%	0.782	S	S	*	*				-157.2	166.1	127.3	-107.9	167.1	-157.9	-127.5	2.7	112.6
452	N	31.9	Very low	30.5	Very low	148 Å²	148	144 Å²	144	79%	0.791	79%	0.789	S	S	*	*			trans	-137.2	-171.2	-163.4	-167.2	-1.6	0	0	0	109.9
453	T	27.1	Very low	30.5	Very low	113 Å²	113	144.3 Å²	144.3	69%	0.693	80%	0.796	S	S	*	*			trans	81.5	94.4	164.2	74.3	0	0	0	0	119.7
454	S	30.4	Very low	30.7	Very low	106 Å²	106	140.3 Å²	140.3	74%	0.741	79%	0.789	S	S	*	*				42.7	135	123	63.3	0	0	0	0	122.6
455	S	29.3	Very low	30.8	Very low	100 Å²	100	142.6 Å²	142.6	70%	0.699	79%	0.794	S	S	*	*				155.7	164.1	101.8	62	0	0	0	0	115.8
456	I	28.9	Very low	31.1	Very low	154 Å²	154	141.7 Å²	141.7	79%	0.79	79%	0.794	S	S	*	*			trans	74.2	139.6	154.1	-70.4	157.4	0	0	0	120.4
457	S	33.3	Very low	32	Very low	111 Å²	111	141.3 Å²	141.3	78%	0.776	80%	0.797	S	S	*	*			trans	-124.7	157.3	163.6	-48.5	0	0	0	0	109.6
458	P	45.5	Very low	32.1	Very low	130 Å²	130	140.4 Å²	140.4	84%	0.844	79%	0.793	S	S	*	*				-150	-173.1	120.1	36.8	-18.2	0	0	0	116
459	R	36	Very low	32.1	Very low	231 Å²	231	145.4 Å²	145.4	87%	0.872	80%	0.798	S	S	*	*			trans	-78.6	161.2	-171.9	-63.5	167.9	166	165.7	-7.6	115.4
460	G	26.4	Very low	32.3	Very low	73 Å²	73	139.6 Å²	139.6	75%	0.753	79%	0.791	S	S	*	*			trans	-147.6	161.3	156.7	0	0	0	0	0	111
461	Y	29.5	Very low	31.8	Very low	216 Å²	216	140.3 Å²	140.3	85%	0.847	80%	0.796	S	S	*	*			trans	-125.3	161.2	-173.3	-100.6	-89.8	0	0	0	114.5
462	S	29.3	Very low	32	Very low	108 Å²	108	138.7 Å²	138.7	76%	0.755	79%	0.792	S	S	*	*			trans	-65.1	161.9	-173.7	54.6	0	0	0	0	119.2
463	S	27.7	Very low	31.8	Very low	126 Å²	126	137.3 Å²	137.3	88%	0.881	79%	0.794	S	S	*	*			trans	-150.5	171.4	133.8	62.3	0	0	0	0	112.2
464	S	32.4	Very low	31.9	Very low	112 Å²	112	137.9 Å²	137.9	78%	0.783	80%	0.797	S	S	*	*			trans	-117.7	164	-148.3	54.5	0	0	0	0	117
465	S	29.5	Very low	31.9	Very low	120 Å²	120	138.4 Å²	138.4	84%	0.839	80%	0.801	S	S	*	*			trans	-148.4	163.6	142.8	59.1	0	0	0	0	112.5
466	T	35.8	Very low	31.7	Very low	128 Å²	128	139.6 Å²	139.6	79%	0.785	81%	0.809	S	S	*	*			trans	-147.9	170.2	-167.1	1.1	0	0	0	0	108.1
467	P	48.3	Very low	31.9	Very low	109 Å²	109	140.1 Å²	140.1	71%	0.708	81%	0.814	S	S	*	*				-158.6	174.6	54.1	45.2	-23.4	0	0	0	120.3
468	Q	33	Very low	31.8	Very low	163 Å²	163	140.7 Å²	140.7	76%	0.762	82%	0.818	S	S	*	*			trans	67.1	156.2	160.7	-54.8	-133.7	-2.5	0	0	117.2
469	Q	29.7	Very low	31.2	Very low	174 Å²	174	142.3 Å²	142.3	81%	0.813	82%	0.816	S	S	*	*			cis	-137.1	169.2	8.4	-155.5	160	71.2	0	0	111.9
470	S	32.5	Very low	31.1	Very low	108 Å²	108	138.7 Å²	138.7	76%	0.755	81%	0.814	S	S	*	*			trans	-122.1	152.4	-166.7	55.9	0	0	0	0	113.9
471	N	23.9	Very low	31.2	Very low	167 Å²	167	138.6 Å²	138.6	89%	0.893	81%	0.813	S	S	*	*			trans	-147.9	150.8	157.5	-133.1	-18.6	0	0	0	112.6
472	Y	30.8	Very low	31.2	Very low	215 Å²	215	139.1 Å²	139.1	84%	0.843	82%	0.815	S	S	*	*			trans	-141.9	142.5	-174.1	-136.8	-87.4	0	0	0	108
473	S	27.5	Very low	31.1	Very low	120 Å²	120	138.9 Å²	138.9	84%	0.839	81%	0.813	S	S	*	*			trans	-143.2	123	176.4	58.8	0	0	0	0	112
474	T	29.2	Very low	31.2	Very low	125 Å²	125	139.6 Å²	139.6	77%	0.767	81%	0.807	S	S	*	*			trans	-106.3	149.3	-180	-42.9	0	0	0	0	110
475	S	30.8	Very low	31.1	Very low	116 Å²	116	140.4 Å²	140.4	81%	0.811	81%	0.807	S	S	*	*			trans	-75.4	142	-179.6	54.6	0	0	0	0	114
476	S	26.8	Very low	32.1	Very low	125 Å²	125	140 Å²	140	87%	0.874	80%	0.802	S	S	*	*			trans	-140.7	162.3	160.5	63.4	0	0	0	0	110.7
477	N	32.6	Very low	31.9	Very low	166 Å²	166	143 Å²	143	89%	0.888	81%	0.809	S	S	*	*			trans	-139.1	130.9	-166.8	-165.5	56.2	0	0	0	109.7
478	S	31	Very low	31.2	Very low	123 Å²	123	142 Å²	142	86%	0.86	81%	0.809	S	S	*	*			trans	-157.5	-179.9	175.3	62.6	0	0	0	0	112
479	M	32.6	Very low	31.2	Very low	164 Å²	164	140.9 Å²	140.9	81%	0.808	81%	0.809	S	S	*	*			trans	-133.4	149.3	-143.2	-138.3	139.9	158.6	0	0	114.7
480	N	34.2	Very low	31.4	Very low	155 Å²	155	140.4 Å²	140.4	83%	0.829	81%	0.811	S	S	*	*			trans	62.3	148.6	156.6	-62.7	-11.7	0	0	0	120.7
481	G	27.5	Very low	31.3	Very low	70 Å²	70	138.5 Å²	138.5	72%	0.722	81%	0.809	S	S	*	*			trans	165.2	30.5	159.9	0	0	0	0	0	125
482	Y	29.6	Very low	31.9	Very low	228 Å²	228	137.1 Å²	137.1	89%	0.894	81%	0.806	S	S	*	*			trans	57.4	150.3	154	-89.1	-87.6	0	0	0	124.4
483	S	27	Very low	32.8	Very low	102 Å²	102	133.1 Å²	133.1	71%	0.713	81%	0.806	S	S	*	*			trans	99.3	89.6	148.6	-61.3	0	0	0	0	123.1
484	N	30.1	Very low	32.9	Very low	142 Å²	142	130.7 Å²	130.7	76%	0.759	80%	0.8	S	S	*	*				66.3	108.7	117	-76.4	10.3	0	0	0	125.3
485	V	31.1	Very low	33.3	Very low	129 Å²	129	130.4 Å²	130.4	78%	0.782	80%	0.803	S	S	*	*				41.5	167.2	124	-79.5	0	0	0	0	123
486	P	50.1	Low	34.5	Very low	112 Å²	112	131 Å²	131	73%	0.727	80%	0.804	S	S	*	*			cis	-132.4	168.9	-4.1	34.4	-16	0	0	0	117
487	M	31.2	Very low	34.8	Very low	191 Å²	191	128.1 Å²	128.1	94%	0.941	80%	0.795	S	S	*	*				-162.1	160.5	127.7	-109.4	-59.2	177	0	0	111.5
488	A	34.5	Very low	34.8	Very low	86 Å²	86	129.2 Å²	129.2	71%	0.711	79%	0.792	S	S	*	*			trans	-109.5	-174.9	-175.9	0	0	0	0	0	111.3
489	N	32	Very low	34.9	Very low	141 Å²	141	130.7 Å²	130.7	75%	0.754	79%	0.789	S	S	*	*			cis	-163.7	179.8	19.1	-164.3	10.7	0	0	0	112
490	L	34.8	Very low	35	Very low	163 Å²	163	130.6 Å²	130.6	85%	0.853	79%	0.792	S	S	*	*			trans	76.2	137.7	168	-55.2	161.6	0	0	0	116.4
491	G	30.3	Very low	34.7	Very low	69 Å²	69	126.2 Å²	126.2	71%	0.711	78%	0.783	S	S	*	*			cis	179.3	149.4	-7.8	0	0	0	0	0	111.9
492	V	36.3	Very low	35.1	Very low	138 Å²	138	128.7 Å²	128.7	84%	0.836	79%	0.79	S	S	*	*			trans	-146.7	146.1	-172.6	-174.2	0	0	0	0	111.9
493	P	49.9	Very low	36	Very low	131 Å²	131	124 Å²	124	85%	0.851	79%	0.788	S	S	*	*			trans	-138.4	158.4	131	37.3	-25.3	0	0	0	112.9
494	G	29.9	Very low	36.5	Very low	69 Å²	69	126 Å²	126	71%	0.711	80%	0.795	S	S	*	*			cis	-177.7	177.9	-2	0	0	0	0	0	111.9
495	S	37.4	Very low	36.5	Very low	119 Å²	119	123 Å²	123	83%	0.832	80%	0.798	S	S	*	*			trans	-151	169.7	-175.5	-48.5	0	0	0	0	113.3
496	P	54.9	Low	36.6	Very low	127 Å²	127	122.6 Å²	122.6	83%	0.825	80%	0.801	S	S	*	*				-124	-169.8	124.4	34	-22.3	0	0	0	109.7
497	G	34.2	Very low	36.5	Very low	66 Å²	66	122.6 Å²	122.6	68%	0.68	80%	0.801	S	S	*	*			cis	153.6	154	5.8	0	0	0	0	0	106.3
498	F	32.1	Very low	36.6	Very low	188 Å²	188	124.3 Å²	124.3	83%	0.825	80%	0.798	S	S	*	*			cis	-147.3	145.2	9	-81.5	-93.5	0	0	0	107.4
499	L	34.2	Very low	36.3	Very low	155 Å²	155	123.5 Å²	123.5	81%	0.812	80%	0.799	S	S	*	*				39.4	143.6	103.3	-57.4	179.5	0	0	0	117.7
500	N	33.2	Very low	36.3	Very low	161 Å²	161	125.2 Å²	125.2	86%	0.861	81%	0.806	S	S	*	*			cis	-173.8	161.6	-16.2	-179	28.6	0	0	0	109.3
501	G	29.1	Very low	36.1	Very low	63 Å²	63	125.4 Å²	125.4	65%	0.649	80%	0.804	S	S	*	*			trans	120.7	149.2	154.6	0	0	0	0	0	119.3
502	S	34.6	Very low	36	Very low	122 Å²	122	126.6 Å²	126.6	85%	0.853	80%	0.802	S	S	*	*			trans	-133	170.1	171.2	-50.4	0	0	0	0	109.4
503	P	48.5	Very low	35.6	Very low	131 Å²	131	125.6 Å²	125.6	85%	0.851	80%	0.801	S	S	*	*				-152.5	-166.2	94.2	40.8	-21.3	0	0	0	115.4
504	T	37.3	Very low	34.8	Very low	142 Å²	142	124.4 Å²	124.4	87%	0.871	80%	0.796	S	S	*	*			trans	-96.5	153.6	-172.1	50.9	0	0	0	0	115.2
505	G	30.3	Very low	35.4	Very low	80 Å²	80	127.1 Å²	127.1	83%	0.825	80%	0.801	S	S	*	*			trans	175.8	134	161.6	0	0	0	0	0	117.2
506	S	34.1	Very low	35.1	Very low	121 Å²	121	127.2 Å²	127.2	85%	0.846	80%	0.797	S	S	*	*			trans	-123	167.9	162.4	-60.6	0	0	0	0	106.7
507	P	47.5	Very low	34.1	Very low	111 Å²	111	128.3 Å²	128.3	72%	0.721	80%	0.801	S	S	*	*			cis	-154.9	-165.1	34.5	42.9	-19.1	0	0	0	118.2
508	Y	33.8	Very low	33.8	Very low	227 Å²	227	128.8 Å²	128.8	89%	0.89	81%	0.806	S	S	*	*			trans	59.9	105.8	154.6	-82.3	-72.8	0	0	0	123.2
509	G	28.7	Very low	33.7	Very low	69 Å²	69	125.2 Å²	125.2	71%	0.711	80%	0.804	S	S	*	*				80.8	134.6	106.8	0	0	0	0	0	122.7
510	I	31.9	Very low	33.4	Very low	178 Å²	178	123.2 Å²	123.2	91%	0.913	80%	0.803	S	S	*	*			trans	171.9	160.9	134.8	-89.9	160.4	0	0	0	111
511	M	30.1	Very low	33.2	Very low	166 Å²	166	120.6 Å²	120.6	82%	0.818	80%	0.797	S	S	*	*			trans	-88.7	-176	-177.5	-62.5	175.3	63.5	0	0	111.9
512	S	27.2	Very low	33.2	Very low	95 Å²	95	123.9 Å²	123.9	66%	0.664	81%	0.805	S	S	*	*			cis	-165.7	165.9	31.5	-64	0	0	0	0	114.9
513	S	28.9	Very low	33.1	Very low	116 Å²	116	123.1 Å²	123.1	81%	0.811	80%	0.8	S	S	*	*			trans	61.9	126.1	139.5	58	0	0	0	0	123.3
514	S	32.7	Very low	32.2	Very low	106 Å²	106	121.8 Å²	121.8	74%	0.741	79%	0.794	S	S	*	*			trans	-82	175.2	158.1	-30.7	0	0	0	0	112.9
515	P	42.9	Very low	32	Very low	127 Å²	127	122.6 Å²	122.6	83%	0.825	79%	0.791	S	S	*	*			trans	-124.6	176.7	141	38	-29.4	0	0	0	112.9
516	T	30.5	Very low	32	Very low	120 Å²	120	126.2 Å²	126.2	74%	0.736	79%	0.791	S	S	*	*			trans	-149.7	148.9	-164.2	51.6	0	0	0	0	116.3
517	V	33.3	Very low	32.7	Very low	150 Å²	150	125.6 Å²	125.6	91%	0.909	78%	0.783	S	S	*	*			trans	63.3	133.1	152.2	-65.3	0	0	0	0	124.1
518	G	29.5	Very low	31.8	Very low	77 Å²	77	129.3 Å²	129.3	79%	0.794	79%	0.789	S	S	*	*			trans	133	145.5	138.1	0	0	0	0	0	116.3
519	S	29.8	Very low	31.6	Very low	112 Å²	112	123.1 Å²	123.1	78%	0.783	78%	0.779	S	S	*	*			cis	-168.8	-177.1	-21.8	69	0	0	0	0	110.8
520	S	27.5	Very low	31.6	Very low	113 Å²	113	124.8 Å²	124.8	79%	0.79	78%	0.779	S	S	*	*			trans	85.4	158.4	166.4	80.5	0	0	0	0	120.7
521	S	29.8	Very low	31.4	Very low	106 Å²	106	121.6 Å²	121.6	74%	0.741	77%	0.773	S	S	*	*				179.9	133.7	-72.1	50.4	0	0	0	0	115.4
522	T	27.7	Very low	31.4	Very low	133 Å²	133	120.1 Å²	120.1	82%	0.816	77%	0.773	S	S	*	*			trans	-163.2	110.6	157.3	23.2	0	0	0	0	108.6
523	S	32.7	Very low	31.7	Very low	105 Å²	105	125.4 Å²	125.4	73%	0.734	78%	0.784	S	S	*	*				66.4	131.4	88.5	69.8	0	0	0	0	115.8
524	S	30.5	Very low	32.1	Very low	104 Å²	104	125.3 Å²	125.3	73%	0.727	78%	0.781	S	S	*	*			cis	-169	155.3	-9.5	39.9	0	0	0	0	108.9
525	I	32.7	Very low	32	Very low	158 Å²	158	125.1 Å²	125.1	81%	0.81	79%	0.786	S	S	*	*				173.2	159.3	100.9	-82.3	165.5	0	0	0	108
526	L	29.7	Very low	31.6	Very low	157 Å²	157	125.6 Å²	125.6	82%	0.822	79%	0.786	S	S	*	*			trans	-128.3	-179.1	-174.7	-63.3	172.5	0	0	0	111.3
527	P	49.3	Very low	31.6	Very low	107 Å²	107	129.1 Å²	129.1	70%	0.695	79%	0.791	S	S	*	*			cis	-116	-139.7	-12.8	31.4	-8.6	0	0	0	109.5
528	F	29.3	Very low	31.4	Very low	189 Å²	189	131.5 Å²	131.5	83%	0.829	79%	0.792	S	S	*	*			cis	-162.7	177.1	-4.3	-128.7	-16.3	0	0	0	107
529	S	28.9	Very low	31.6	Very low	97 Å²	97	137.2 Å²	137.2	68%	0.678	80%	0.796	S	S	*	*			cis	-150.5	-135.1	-2.2	-168.1	0	0	0	0	110.3
530	S	27.9	Very low	31.6	Very low	104 Å²	104	136.7 Å²	136.7	73%	0.727	79%	0.792	S	S	*	*			trans	-130.5	147.8	-164.7	60.1	0	0	0	0	117.7
531	S	29.4	Very low	31.7	Very low	111 Å²	111	136.5 Å²	136.5	78%	0.776	80%	0.797	S	S	*	*			trans	179.5	120.6	144.3	28.4	0	0	0	0	109.9
532	V	30	Very low	31.8	Very low	135 Å²	135	140.8 Å²	140.8	82%	0.818	80%	0.803	S	S	*	*				64.1	104.6	83.7	-179.3	0	0	0	0	114.2
533	F	32.3	Very low	32.1	Very low	206 Å²	206	138.8 Å²	138.8	90%	0.904	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-83.7	128.8	171.7	-66.2	-86.9	0	0	0	112.1
534	P	37.3	Very low	32.3	Very low	114 Å²	114	139.5 Å²	139.5	74%	0.74	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-91	123.8	170.2	33	-30.7	0	0	0	112.3
535	A	30.7	Very low	32.4	Very low	102 Å²	102	141.1 Å²	141.1	84%	0.843	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-78.5	120	173.2	0	0	0	0	0	111.7
536	V	34.4	Very low	32.5	Very low	138 Å²	138	141.3 Å²	141.3	84%	0.836	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-87.8	122.4	-179.4	-179.2	0	0	0	0	111.3	Q538	V536-Q538 PolarHBondContact O-N 3.12Å
537	K	30.1	Very low	32.8	Very low	194 Å²	194	144.5 Å²	144.5	84%	0.843	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-76.9	117.7	179.1	-65.6	167.7	179.7	168.7	0	111.1
538	Q	29.3	Very low	31.9	Very low	199 Å²	199	145.3 Å²	145.3	93%	0.93	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-72.3	127.1	163.6	-75.1	-167.8	-15.9	0	0	110.6	V536	V536-Q538 PolarHBondContact O-N 3.12Å
539	K	33.5	Very low	32	Very low	198 Å²	198	145.8 Å²	145.8	86%	0.861	82%	0.819	S	S	*	*			trans	-104.1	127.8	173	-88.6	-177	173.5	178.3	0	110.9
540	S	30.8	Very low	32.2	Very low	100 Å²	100	144.7 Å²	144.7	70%	0.699	82%	0.823	S	S	*	*			trans	34.7	99.5	141	-178.6	0	0	0	0	118.6	F542	S540-F542 PolarHBondContact O-N 3.29Å
541	A	29.4	Very low	32.4	Very low	110 Å²	110	145.3 Å²	145.3	91%	0.909	83%	0.827	S	S	*	*			trans	-82.5	102.3	160.4	0	0	0	0	0	111.2
542	F	31.9	Very low	32.6	Very low	196 Å²	196	146 Å²	146	86%	0.86	83%	0.829	S	S	*	*			trans	-108.6	130.1	157	-103.4	-91.6	0	0	0	107.5	S540	S540-F542 PolarHBondContact O-N 3.29Å
543	A	34.2	Very low	32.9	Very low	91 Å²	91	145 Å²	145	75%	0.752	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-80.4	134.8	-176	0	0	0	0	0	111.7
544	P	35.9	Very low	33.1	Very low	119 Å²	119	141.4 Å²	141.4	77%	0.773	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-75.8	145	171.1	31.9	-33.9	0	0	0	111.1
545	V	33.3	Very low	32.8	Very low	138 Å²	138	140.4 Å²	140.4	84%	0.836	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-87.1	120.6	173.2	177	0	0	0	0	109.2
546	I	35.3	Very low	32.7	Very low	162 Å²	162	142 Å²	142	83%	0.831	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-79.9	133.9	171.7	-59.9	176.3	0	0	0	108.8
547	R	34.6	Very low	32.5	Very low	224 Å²	224	141.3 Å²	141.3	85%	0.845	83%	0.832	S	S	*	*			trans	-122.4	135.4	176.2	-150.9	177.7	-163.8	-177.1	4.1	108.2
548	P	31.6	Very low	32.5	Very low	124 Å²	124	137.9 Å²	137.9	81%	0.805	83%	0.832	S	S	*	*			trans	-66.9	148.1	-178.9	26.8	-34.5	0	0	0	112.2
549	Q	30.4	Very low	32.4	Very low	199 Å²	199	131.7 Å²	131.7	93%	0.93	82%	0.821	S	S	*	*			trans	-77.6	141.9	173.3	-78.5	-93	-3.3	0	0	110.8
550	G	33.3	Very low	32.3	Very low	74 Å²	74	130.4 Å²	130.4	76%	0.763	82%	0.824	S	S	*	*			trans	142.1	61.3	165.7	0	0	0	0	0	118.4
551	S	31.6	Very low	32.2	Very low	117 Å²	117	128.8 Å²	128.8	82%	0.818	82%	0.824	S	S	*	*			trans	-171.5	152.8	153.6	50.5	0	0	0	0	111
552	P	35.5	Very low	32.3	Very low	126 Å²	126	132 Å²	132	82%	0.818	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-84.4	158.5	-167.8	33.1	-36.6	0	0	0	115
553	S	34.4	Very low	32.1	Very low	114 Å²	114	126.2 Å²	126.2	80%	0.797	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-70.7	140.6	177.4	-52.8	0	0	0	0	113.2
554	P	36.5	Very low	31.9	Very low	130 Å²	130	130.7 Å²	130.7	84%	0.844	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-70.5	141.3	167.8	-13.9	29.1	0	0	0	111.7
555	A	32.2	Very low	31.7	Very low	93 Å²	93	136.1 Å²	136.1	77%	0.769	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-82.8	151	175.1	0	0	0	0	0	112.4	S557	A555-S557 PolarHBondContact O-N 3.09Å
556	C	27.9	Very low	31.7	Very low	135 Å²	135	134.7 Å²	134.7	91%	0.912	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-69.8	119.6	173.8	-52.2	0	0	0	0	110.3
557	S	29.7	Very low	31.5	Very low	125 Å²	125	135.5 Å²	135.5	87%	0.874	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-81	124.6	176.2	-63.6	0	0	0	0	111.2	A555	A555-S557 PolarHBondContact O-N 3.09Å
558	S	31.3	Very low	31.4	Very low	122 Å²	122	131.4 Å²	131.4	85%	0.853	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-86.5	148.9	171.1	-174	0	0	0	0	111
559	G	27.1	Very low	31.4	Very low	68 Å²	68	129 Å²	129	70%	0.701	83%	0.832	S	S	*	*			trans	-157.3	131	176	0	0	0	0	0	112.1
560	N	30.3	Very low	31.6	Very low	171 Å²	171	127.9 Å²	127.9	91%	0.914	83%	0.832	S	S	*	*			trans	-65.3	160.3	179.2	-62	-29.1	0	0	0	112
561	G	28.7	Very low	31.6	Very low	67 Å²	67	130.9 Å²	130.9	69%	0.691	84%	0.835	S	S	*	*			cis	157.6	179.5	-1.3	0	0	0	0	0	112.3
562	N	32.1	Very low	32	Very low	178 Å²	178	131.7 Å²	131.7	95%	0.952	83%	0.834	S	S	*	*			trans	68.4	137	179.4	-68.1	-16.7	0	0	0	118
563	G	28.2	Very low	32.7	Very low	74 Å²	74	130.7 Å²	130.7	76%	0.763	83%	0.828	S	S	*	*			trans	177.3	8.2	-178.9	0	0	0	0	0	120.8
564	F	30.2	Very low	33.7	Very low	184 Å²	184	130.7 Å²	130.7	81%	0.807	83%	0.825	S	S	*	*			trans	51	118.7	166	-89.7	-93.7	0	0	0	122.7
565	R	30.9	Very low	33.7	Very low	234 Å²	234	136.8 Å²	136.8	88%	0.883	85%	0.846	S	S	*	*			trans	34.5	120.6	141.4	-66.1	-175.9	175.6	-174.2	-2.3	121.3
566	A	33	Very low	33.8	Very low	108 Å²	108	139 Å²	139	89%	0.893	85%	0.849	S	S	*	*				-153.2	146.3	129.6	0	0	0	0	0	112.6
567	M	31.2	Very low	34.1	Very low	179 Å²	179	139.2 Å²	139.2	88%	0.882	85%	0.846	S	S	*	*			trans	-77.8	146	-168.1	-92.3	163.1	146.7	0	0	117.1
568	T	33.6	Very low	34.3	Very low	137 Å²	137	140 Å²	140	84%	0.84	85%	0.845	S	S	*	*			trans	6.8	135.9	137.7	56.1	0	0	0	0	121.1
569	G	31.5	Very low	34.5	Very low	75 Å²	75	141.1 Å²	141.1	77%	0.773	84%	0.844	S	S	*	*			trans	-170.7	134	156.8	0	0	0	0	0	113
570	L	33.7	Very low	35	Very low	175 Å²	175	145.6 Å²	145.6	92%	0.916	85%	0.853	S	S	*	*			trans	-90.5	163.3	169.3	-72.7	84.5	0	0	0	110.5
571	V	33.7	Very low	35.3	Very low	137 Å²	137	143.9 Å²	143.9	83%	0.83	85%	0.849	S	S	*	*				177.6	141.3	120.7	147.8	0	0	0	0	110.9
572	V	40	Very low	35.7	Very low	133 Å²	133	149.4 Å²	149.4	81%	0.806	86%	0.86	S	S	*	*			trans	-152.7	155.9	167.8	-156.8	0	0	0	0	107.7
573	P	49.8	Very low	36	Very low	106 Å²	106	147.2 Å²	147.2	69%	0.688	85%	0.853	S	S	*	*				-90.5	-156.2	-73.6	35	-17.2	0	0	0	110.6
574	P	55.9	Low	36.7	Very low	113 Å²	113	153.3 Å²	153.3	73%	0.734	86%	0.861	S	S	*	*				-146.5	170.4	98.1	40.5	-26.1	0	0	0	115.6
575	M	36.6	Very low	37.3	Very low	259 Å²	259	150.5 Å²	150.5	100%	1.276	87%	0.866	S	S	*	*			trans	66.1	0	175.9	-57.6	-65.1	-174.4	0	0	115.3

Retrieved 575 of 575 residues in 272.1 ms (Link to these results)

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