A0A087Y3R7_POEFO Loading...

Fibrinogen gamma chain

AlphaFold DB , UniProt , Accession A0A087Y3R7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 432 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.2	Very low	33.5	Very low	250 Å²	250	132.5 Å²	132.5	100%	1.232	81%	0.805	S	S	*	*				0	123.1	0	-58.6	172	-174.3	0	0	106
2	A	35	Very low	33.5	Very low	101 Å²	101	134.5 Å²	134.5	84%	0.835	81%	0.805	S	S	*	*			cis	-142.1	167.1	1.4	0	0	0	0	0	111.2
3	L	31.7	Very low	33.2	Very low	145 Å²	145	138.5 Å²	138.5	76%	0.759	81%	0.805	S	S	*	*			trans	-75	-178.6	171.9	-80.9	97.4	0	0	0	111.8	L5	L3-L5 HydrophobicContact CD2-CD1 4.25Å; L3-L5 HydrophobicContact CD2-CG 4.18Å
4	P	48.8	Very low	33.2	Very low	118 Å²	118	140 Å²	140	77%	0.766	81%	0.808	S	S	*	*			cis	-129.6	-163.2	2.5	15.9	12.4	0	0	0	113.5
5	L	31.2	Very low	33.1	Very low	117 Å²	117	140.8 Å²	140.8	61%	0.613	81%	0.807	S	S	*	*			cis	-166.8	163.6	-45.1	-98.7	170.6	0	0	0	109.4	L3	L3-L5 HydrophobicContact CD2-CD1 4.25Å; L3-L5 HydrophobicContact CD2-CG 4.18Å
6	F	30.5	Very low	32.9	Very low	179 Å²	179	142.6 Å²	142.6	79%	0.785	80%	0.803	S	S	*	*			trans	67.4	147.3	162.9	-65.8	-55	0	0	0	118.5
7	T	31	Very low	32.8	Very low	110 Å²	110	140.5 Å²	140.5	68%	0.675	80%	0.8	S	S	*	*			cis	-159.5	164.5	3.2	0.9	0	0	0	0	112.3
8	T	30.6	Very low	32.8	Very low	139 Å²	139	138.9 Å²	138.9	85%	0.853	79%	0.793	S	S	*	*			trans	72	150.4	169.9	80.6	0	0	0	0	115.6
9	A	32.2	Very low	32.9	Very low	100 Å²	100	136.9 Å²	136.9	83%	0.826	79%	0.789	S	S	*	*			cis	-141.2	166.6	-7.3	0	0	0	0	0	107
10	G	30.2	Very low	33	Very low	72 Å²	72	135.9 Å²	135.9	74%	0.742	79%	0.79	S	S	*	*			cis	110.2	74.4	22.5	0	0	0	0	0	111.6
11	V	32.5	Very low	33.1	Very low	127 Å²	127	133.1 Å²	133.1	77%	0.77	78%	0.783	S	S	*	*			trans	-145.7	124.3	164.6	177.2	0	0	0	0	110.6	F13	V11-F13 HydrophobicContact CG1-CD2 3.85Å
12	I	33.3	Very low	33.3	Very low	156 Å²	156	130.3 Å²	130.3	80%	0.8	77%	0.767	S	S	*	*			trans	-104.8	135.2	157.8	-73.4	167	0	0	0	106.4
13	F	29.4	Very low	33.5	Very low	186 Å²	186	133.8 Å²	133.8	82%	0.816	77%	0.77	S	S	*	*			trans	-121.9	115.2	167.4	-120.1	-78.9	0	0	0	109.6	V11	V11-F13 HydrophobicContact CG1-CD2 3.85Å
14	L	33.7	Very low	34	Very low	160 Å²	160	138.9 Å²	138.9	84%	0.838	78%	0.779	S	S	*	*			trans	-89.9	144.2	164.8	-89.3	163.4	0	0	0	109.2
15	L	30.8	Very low	33.4	Very low	152 Å²	152	136.9 Å²	136.9	80%	0.796	78%	0.779	S	S	*	*			trans	-88.5	133.8	-173.1	-71.5	163.7	0	0	0	112.8
16	F	30.5	Very low	33.9	Very low	170 Å²	170	138.3 Å²	138.3	75%	0.746	79%	0.788	S	S	*	*			trans	21.8	127.8	142.5	-69.1	-91.1	0	0	0	121.7
17	S	31.2	Very low	34.7	Very low	107 Å²	107	138 Å²	138	75%	0.748	79%	0.794	S	S	*	*				-163.3	120.2	113.7	35.4	0	0	0	0	107.8
18	T	33.1	Very low	35.6	Very low	111 Å²	111	138.7 Å²	138.7	68%	0.681	79%	0.793	S	S	*	*				45.2	117.6	73.1	64.7	0	0	0	0	112.4
19	S	33.9	Very low	36.5	Very low	101 Å²	101	137 Å²	137	71%	0.706	79%	0.794	S	S	*	*			cis	-162.7	158.5	49.3	-48	0	0	0	0	114.2
20	S	34.7	Very low	37.4	Very low	116 Å²	116	137.4 Å²	137.4	81%	0.811	79%	0.786	S	S	*	*			trans	19.4	149.7	142.6	53.2	0	0	0	0	122.4
21	A	36.5	Very low	38.5	Very low	78 Å²	78	139.8 Å²	139.8	65%	0.645	79%	0.79	S	S	*	*			cis	-162.9	154.4	3.7	0	0	0	0	0	113.9
22	Q	38.8	Very low	39.7	Very low	191 Å²	191	139 Å²	139	89%	0.893	78%	0.782	S	S	*	*			trans	59.4	140.3	145.3	-77.7	167.8	-60	0	0	123.5
23	I	38.1	Very low	40.7	Very low	174 Å²	174	138 Å²	138	89%	0.892	78%	0.775	S	S	*	*			trans	-83.8	145.4	171.1	-65.3	168.3	0	0	0	109.6
24	R	43.1	Very low	42.1	Very low	252 Å²	252	136.4 Å²	136.4	95%	0.951	78%	0.775	S	S	*	*			trans	-67.4	147.5	-175	-94.5	175.7	165.9	172.5	-4.3	114.9
25	G	37.3	Very low	43.3	Very low	76 Å²	76	132.9 Å²	132.9	78%	0.784	76%	0.757	S	S	*	*			trans	158.7	92.4	160.9	0	0	0	0	0	112.7
26	D	40.1	Very low	44.7	Very low	148 Å²	148	129.1 Å²	129.1	79%	0.791	76%	0.755	S	S	*	*			trans	-74.4	138.9	177.9	-72.3	-62.2	0	0	0	112.5
27	N	46.9	Very low	46.3	Very low	172 Å²	172	129.4 Å²	129.4	92%	0.92	76%	0.756	S	S	*	*			trans	-154.2	116.2	151.5	-106.5	-37.8	0	0	0	109.9
28	L	50.4	Low	48.1	Very low	124 Å²	124	126.6 Å²	126.6	65%	0.649	74%	0.744	S	S	*	*			trans	-91.4	131.8	-177.6	-89.8	70.8	0	0	0	111.6	T30	L28-T30 HydrophobicContact CD2-CG2 4.18Å
29	A	49.1	Very low	49.6	Very low	105 Å²	105	130.3 Å²	130.3	87%	0.868	75%	0.751	S	S	*	*			trans	-132	70.9	154.8	0	0	0	0	0	108.6
30	T	51.7	Low	51.4	Low	108 Å²	108	132 Å²	132	66%	0.663	74%	0.743	S	S	*	*			trans	-32.7	132.5	-176.2	36	0	0	0	0	117.3	L28	L28-T30 HydrophobicContact CD2-CG2 4.18Å
31	C	53.8	Low	53	Low	121 Å²	121	131.6 Å²	131.6	82%	0.818	74%	0.739	S	S	*	*			trans	-115.4	114.6	137.2	-156.6	0	0	0	0	107.8
32	N	57.8	Low	54.7	Low	112 Å²	112	133.1 Å²	133.1	60%	0.599	74%	0.742	S	S	*	*			trans	-128.3	110.8	-172.6	-174.8	18.6	0	0	0	107.9
33	M	53.1	Low	56.6	Low	135 Å²	135	128.6 Å²	128.6	67%	0.665	73%	0.727	S	S	*	*			trans	-111.6	109.2	167.4	-77.5	-71.2	173.5	0	0	106.1	D35 Y40	M33-D35 PolarHBondContact O-N 3.05Å; M33-Y40 HydrophobicContact CB-CE2 4.38Å
34	N	60.4	Low	58.5	Low	152 Å²	152	126 Å²	126	81%	0.813	72%	0.72	S	S	*	*			trans	-88.4	72.4	-163.8	-168.6	30.9	0	0	0	111.1
35	D	58.8	Low	60.2	Low	85 Å²	85	118.5 Å²	118.5	46%	0.455	71%	0.705	S	S	.	*	S	Bend	trans	-111.2	2.1	-178.6	67.8	-3.5	0	0	0	113.8	M33 F37 Y40	M33-D35 PolarHBondContact O-N 3.05Å; D35-F37 HydrophobicContact CB-CD2 4.42Å; D35-F37 PolarHBondContact OD1-N 2.87Å; D35-F37 VanDerWaalsContact OD1-N 3.11Å; D35-Y40 PolarHBondContact OD1-OH 3.11Å; D35-Y40 PolarHBondContact OD2-OH 3.32Å
36	G	59.1	Low	62.1	Low	73 Å²	73	116.7 Å²	116.7	75%	0.753	69%	0.686	S	S	*	*	S	Bend	trans	93.4	-4.6	177.9	0	0	0	0	0	115.4
37	F	65.5	Low	63.9	Low	176 Å²	176	113.1 Å²	113.1	77%	0.772	67%	0.67	S	S	*	*	S	Bend	trans	-87.1	-1.5	-176.6	-72.4	-86.2	0	0	0	115.3	D35	D35-F37 HydrophobicContact CB-CD2 4.42Å; D35-F37 PolarHBondContact OD1-N 2.87Å; D35-F37 VanDerWaalsContact OD1-N 3.11Å
38	G	67.8	Low	65.4	Low	49 Å²	49	106.8 Å²	106.8	51%	0.505	64%	0.641	S	S	.	*			trans	95.7	-151.1	174	0	0	0	0	0	114.1
39	K	64.9	Low	66.9	Low	188 Å²	188	104.5 Å²	104.5	82%	0.817	63%	0.63	S	S	*	*			trans	-90.5	126.2	-178.9	-69.7	-175.9	180	178.9	0	110.7
40	Y	71.9	Confident	68.5	Low	137 Å²	137	106.4 Å²	106.4	54%	0.537	62%	0.615	S	S	.	*			trans	-76.7	130.3	173.8	-65.5	-89.4	0	0	0	111.3	M33 D35	M33-Y40 HydrophobicContact CB-CE2 4.38Å; D35-Y40 PolarHBondContact OD1-OH 3.11Å; D35-Y40 PolarHBondContact OD2-OH 3.32Å
41	C	67	Low	69.6	Low	108 Å²	108	105.9 Å²	105.9	73%	0.73	61%	0.607	S	S	*	*			trans	-106.3	156.9	169.9	-67.3	0	0	0	0	110
42	P	74.1	Confident	71	Confident	109 Å²	109	107.8 Å²	107.8	71%	0.708	60%	0.601	S	S	*	*			trans	-54	141.9	170.2	-24.2	34.4	0	0	0	111.4	V47	P42-V47 HydrophobicContact CB-CG2 4.32Å
43	T	78.4	Confident	72	Confident	96 Å²	96	111.1 Å²	111.1	59%	0.589	61%	0.606	S	S	*	*			trans	-66.4	154.5	177.1	64.7	0	0	0	0	110.6	C45 G46 V47	T43-C45 PolarHBondContact O-N 2.69Å; T43-C45 VanDerWaalsContact O-N 3.14Å; T43-G46 WeakPolarHBondContact O-CA 3.46Å; T43-G46 PolarHBondContact O-N 3.32Å; T43-G46 PolarHBondContact OG1-N 3.12Å; T43-V47 PolarHBondContact O-N 3.4Å
44	T	76.8	Confident	73.2	Confident	121 Å²	121	111.2 Å²	111.2	74%	0.742	60%	0.6	S	S	*	*	H	α-helix	trans	-57.1	-28.7	175.2	47.6	0	0	0	0	112.5	A48	T44-A48 VanDerWaalsContact O-CB 3.26Å; T44-A48 WeakPolarHBondContact O-CB 3.49Å; T44-A48 PolarHBondContact O-N 3.48Å
45	C	79.4	Confident	74.1	Confident	94 Å²	94	108.5 Å²	108.5	64%	0.635	58%	0.584	S	S	*	*	H	α-helix	trans	-65.4	-42.2	170.9	-58.9	0	0	0	0	112.9	T43 A48 D49	T43-C45 PolarHBondContact O-N 2.69Å; T43-C45 VanDerWaalsContact O-N 3.14Å; C45-A48 PolarHBondContact O-N 3.34Å; C45-D49 PolarHBondContact O-N 2.99Å
46	G	78.2	Confident	75.2	Confident	37 Å²	37	108 Å²	108	38%	0.381	59%	0.586	S	S	.	*	H	α-helix	trans	-67.7	-36.1	175.8	0	0	0	0	0	112.8	T43 Y50	T43-G46 WeakPolarHBondContact O-CA 3.46Å; T43-G46 PolarHBondContact O-N 3.32Å; T43-G46 PolarHBondContact OG1-N 3.12Å; G46-Y50 WeakPolarHBondContact O-CB 3.42Å; G46-Y50 PolarHBondContact O-N 3.46Å; G46-Y50 VanDerWaalsContact O-N 3.12Å
47	V	77.6	Confident	76.1	Confident	74 Å²	74	106.1 Å²	106.1	45%	0.448	57%	0.566	S	S	.	*	H	α-helix	trans	-67.1	-42.2	172.2	-179.6	0	0	0	0	111	P42 T43 Y50 M51	P42-V47 HydrophobicContact CB-CG2 4.32Å; T43-V47 PolarHBondContact O-N 3.4Å; V47-Y50 PolarHBondContact O-N 2.91Å; V47-M51 WeakPolarHBondContact O-CG 3.37Å; V47-M51 PolarHBondContact O-N 3.36Å
48	A	78.6	Confident	76.8	Confident	39 Å²	39	100 Å²	100	32%	0.322	54%	0.543	S	S	.	.	H	α-helix	trans	-64	-46.1	177.8	0	0	0	0	0	112.5	T44 C45 Y50 M51 F52	T44-A48 VanDerWaalsContact O-CB 3.26Å; T44-A48 WeakPolarHBondContact O-CB 3.49Å; T44-A48 PolarHBondContact O-N 3.48Å; C45-A48 PolarHBondContact O-N 3.34Å; A48-Y50 VanDerWaalsContact C-N 3.34Å; A48-Y50 PolarHBondContact O-N 3.36Å; A48-M51 PolarHBondContact O-N 3.48Å; A48-F52 HydrophobicContact CB-CE2 4.49Å; A48-F52 WeakPolarHBondContact O-CD2 3.17Å; A48-F52 PolarHBondContact O-N 2.89Å
49	D	81.7	Confident	77.4	Confident	76 Å²	76	101 Å²	101	41%	0.406	54%	0.543	S	S	.	.	H	α-helix	trans	-61.5	-40.7	175.9	179.4	42.2	0	0	0	111.7	C45 M51 F52 R53	C45-D49 PolarHBondContact O-N 2.99Å; D49-M51 PolarHBondContact O-N 3.09Å; D49-F52 PolarHBondContact O-N 3.34Å; D49-R53 WeakPolarHBondContact O-CG 3.3Å; D49-R53 PolarHBondContact O-N 3.14Å; D49-R53 VanDerWaalsContact O-N 3.09Å; D49-R53 IonicContact OD1-CZ 3.6Å; D49-R53 IonicContact OD1-NE 2.99Å; D49-R53 PolarHBondContact OD1-NE 3.28Å; D49-R53 IonicContact OD1-NH2 3.32Å; D49-R53 PolarHBondContact OD1-NH2 3.18Å; D49-R53 IonicContact OD2-CZ 3.31Å; D49-R53 VanDerWaalsContact OD2-CZ 3.31Å; D49-R53 IonicContact OD2-NE 3.34Å; D49-R53 PolarHBondContact OD2-NE 3.34Å; D49-R53 IonicContact OD2-NH2 2.69Å; D49-R53 PolarHBondContact OD2-NH2 2.98Å
50	Y	81.1	Confident	78.3	Confident	144 Å²	144	99 Å²	99	57%	0.565	54%	0.536	S	S	*	.	H	α-helix	trans	-59.2	-46.7	172	-178	-91	0	0	0	112	G46 V47 A48 R53 Y54	G46-Y50 WeakPolarHBondContact O-CB 3.42Å; G46-Y50 PolarHBondContact O-N 3.46Å; G46-Y50 VanDerWaalsContact O-N 3.12Å; V47-Y50 PolarHBondContact O-N 2.91Å; A48-Y50 VanDerWaalsContact C-N 3.34Å; A48-Y50 PolarHBondContact O-N 3.36Å; Y50-R53 PolarHBondContact O-N 2.94Å; Y50-Y54 HydrophobicContact CE1-CG 4.29Å; Y50-Y54 VanDerWaalsContact O-CB 3.3Å; Y50-Y54 WeakPolarHBondContact O-CB 3.33Å; Y50-Y54 PolarHBondContact O-N 3.25Å
51	M	76.8	Confident	78.8	Confident	97 Å²	97	97.4 Å²	97.4	48%	0.478	54%	0.537	S	S	.	.	H	α-helix	trans	-64.5	-40.8	177.4	-69.8	-165.1	81.1	0	0	112.5	V47 A48 D49 R53 Y54 L55	V47-M51 WeakPolarHBondContact O-CG 3.37Å; V47-M51 PolarHBondContact O-N 3.36Å; A48-M51 PolarHBondContact O-N 3.48Å; D49-M51 PolarHBondContact O-N 3.09Å; M51-R53 VanDerWaalsContact C-N 3.27Å; M51-R53 PolarHBondContact O-N 2.96Å; M51-Y54 PolarHBondContact O-N 3.03Å; M51-L55 HydrophobicContact CB-CD1 4.15Å; M51-L55 HydrophobicContact CE-CD1 4.2Å; M51-L55 HydrophobicContact CE-CD2 4.49Å; M51-L55 VanDerWaalsContact O-CB 3.25Å; M51-L55 WeakPolarHBondContact O-CB 3.24Å; M51-L55 VanDerWaalsContact O-CG 3.24Å; M51-L55 WeakPolarHBondContact O-CG 3.25Å; M51-L55 PolarHBondContact O-N 2.85Å
52	F	81.8	Confident	79.5	Confident	162 Å²	162	97.1 Å²	97.1	71%	0.711	53%	0.528	S	S	*	.	H	α-helix	trans	-65.2	-27.7	177.5	-80.7	-61.9	0	0	0	113.6	A48 D49 P56	A48-F52 HydrophobicContact CB-CE2 4.49Å; A48-F52 WeakPolarHBondContact O-CD2 3.17Å; A48-F52 PolarHBondContact O-N 2.89Å; D49-F52 PolarHBondContact O-N 3.34Å; F52-P56 WeakPolarHBondContact O-CD 3.46Å; F52-P56 WeakPolarHBondContact O-CG 3.15Å
53	R	79.3	Confident	80	Confident	182 Å²	182	95.4 Å²	95.4	69%	0.687	52%	0.515	S	S	*	.	H	α-helix	trans	-82.4	-34.5	173	-64.7	178.3	-160.3	-159	8.7	113.2	D49 Y50 M51	D49-R53 WeakPolarHBondContact O-CG 3.3Å; D49-R53 PolarHBondContact O-N 3.14Å; D49-R53 VanDerWaalsContact O-N 3.09Å; D49-R53 IonicContact OD1-CZ 3.6Å; D49-R53 IonicContact OD1-NE 2.99Å; D49-R53 PolarHBondContact OD1-NE 3.28Å; D49-R53 IonicContact OD1-NH2 3.32Å; D49-R53 PolarHBondContact OD1-NH2 3.18Å; D49-R53 IonicContact OD2-CZ 3.31Å; D49-R53 VanDerWaalsContact OD2-CZ 3.31Å; D49-R53 IonicContact OD2-NE 3.34Å; D49-R53 PolarHBondContact OD2-NE 3.34Å; D49-R53 IonicContact OD2-NH2 2.69Å; D49-R53 PolarHBondContact OD2-NH2 2.98Å; Y50-R53 PolarHBondContact O-N 2.94Å; M51-R53 VanDerWaalsContact C-N 3.27Å; M51-R53 PolarHBondContact O-N 2.96Å
54	Y	78.7	Confident	80.3	Confident	137 Å²	137	93.8 Å²	93.8	54%	0.537	51%	0.508	S	S	.	.	H	α-helix	trans	-86.7	-38.8	-173.1	-169	-109.8	0	0	0	113.5	Y50 M51 G57 V58	Y50-Y54 HydrophobicContact CE1-CG 4.29Å; Y50-Y54 VanDerWaalsContact O-CB 3.3Å; Y50-Y54 WeakPolarHBondContact O-CB 3.33Å; Y50-Y54 PolarHBondContact O-N 3.25Å; M51-Y54 PolarHBondContact O-N 3.03Å; Y54-G57 PolarHBondContact O-N 3.32Å; Y54-V58 HydrophobicContact CD1-CG2 3.95Å; Y54-V58 HydrophobicContact CD2-CG2 4.45Å; Y54-V58 HydrophobicContact CE1-CG2 3.51Å; Y54-V58 HydrophobicContact CE2-CG2 4.05Å; Y54-V58 HydrophobicContact CG-CG2 4.4Å; Y54-V58 PolarHBondContact O-N 2.87Å
55	L	78.9	Confident	80.5	Confident	94 Å²	94	92.8 Å²	92.8	49%	0.492	50%	0.496	S	S	.	.	H	α-helix	trans	-59.1	-42.3	-177.8	-74.9	169.4	0	0	0	114.4	M51 S59	M51-L55 HydrophobicContact CB-CD1 4.15Å; M51-L55 HydrophobicContact CE-CD1 4.2Å; M51-L55 HydrophobicContact CE-CD2 4.49Å; M51-L55 VanDerWaalsContact O-CB 3.25Å; M51-L55 WeakPolarHBondContact O-CB 3.24Å; M51-L55 VanDerWaalsContact O-CG 3.24Å; M51-L55 WeakPolarHBondContact O-CG 3.25Å; M51-L55 PolarHBondContact O-N 2.85Å; L55-S59 WeakPolarHBondContact O-CB 3.26Å; L55-S59 PolarHBondContact O-N 3.01Å
56	P	81.2	Confident	80.7	Confident	76 Å²	76	94.4 Å²	94.4	49%	0.494	49%	0.494	S	S	.	.	H	α-helix	trans	-62.8	-45.8	-179.2	-23.9	35.4	0	0	0	112.7	F52 S59 E60	F52-P56 WeakPolarHBondContact O-CD 3.46Å; F52-P56 WeakPolarHBondContact O-CG 3.15Å; P56-S59 WeakPolarHBondContact O-CB 3.33Å; P56-S59 PolarHBondContact O-N 3.36Å; P56-E60 PolarHBondContact O-N 3.19Å
57	G	79.2	Confident	81.2	Confident	32 Å²	32	97.3 Å²	97.3	33%	0.33	50%	0.501	S	S	.	.	H	α-helix	trans	-63.1	-45.4	179.7	0	0	0	0	0	112.5	Y54 S59 E60 D61	Y54-G57 PolarHBondContact O-N 3.32Å; G57-S59 VanDerWaalsContact C-N 3.28Å; G57-S59 PolarHBondContact O-N 2.99Å; G57-E60 PolarHBondContact O-N 2.97Å; G57-D61 PolarHBondContact O-N 3.36Å
58	V	80.1	Confident	81.5	Confident	48 Å²	48	99.3 Å²	99.3	29%	0.291	51%	0.505	S	S	.	.	H	α-helix	trans	-64.7	-33.3	176	176.8	0	0	0	0	112	Y54 L62	Y54-V58 HydrophobicContact CD1-CG2 3.95Å; Y54-V58 HydrophobicContact CD2-CG2 4.45Å; Y54-V58 HydrophobicContact CE1-CG2 3.51Å; Y54-V58 HydrophobicContact CE2-CG2 4.05Å; Y54-V58 HydrophobicContact CG-CG2 4.4Å; Y54-V58 PolarHBondContact O-N 2.87Å; V58-L62 HydrophobicContact CG1-CD1 3.95Å; V58-L62 HydrophobicContact CG1-CG 4.47Å; V58-L62 WeakPolarHBondContact O-CB 3.26Å; V58-L62 WeakPolarHBondContact O-CD1 3.46Å; V58-L62 VanDerWaalsContact O-CG 3.26Å; V58-L62 WeakPolarHBondContact O-CG 3.32Å; V58-L62 PolarHBondContact O-N 2.92Å
59	S	80.8	Confident	81.8	Confident	71 Å²	71	102.9 Å²	102.9	50%	0.497	52%	0.518	S	S	.	.	H	α-helix	trans	-69.3	-34.6	175.2	-167.6	0	0	0	0	112.7	L55 P56 G57 T63	L55-S59 WeakPolarHBondContact O-CB 3.26Å; L55-S59 PolarHBondContact O-N 3.01Å; P56-S59 WeakPolarHBondContact O-CB 3.33Å; P56-S59 PolarHBondContact O-N 3.36Å; G57-S59 VanDerWaalsContact C-N 3.28Å; G57-S59 PolarHBondContact O-N 2.99Å; S59-T63 PolarHBondContact O-N 3.4Å; S59-T63 VanDerWaalsContact O-N 3.13Å; S59-T63 PolarHBondContact O-OG1 2.94Å
60	E	82.2	Confident	82	Confident	146 Å²	146	105 Å²	105	68%	0.682	53%	0.526	S	S	*	.	H	α-helix	trans	-71.3	-46.2	176	-166.4	168.7	-166.8	0	0	110.7	P56 G57 L62 T63 S64	P56-E60 PolarHBondContact O-N 3.19Å; G57-E60 PolarHBondContact O-N 2.97Å; E60-L62 VanDerWaalsContact C-N 3.35Å; E60-L62 PolarHBondContact O-N 3.15Å; E60-T63 PolarHBondContact O-N 2.75Å; E60-T63 VanDerWaalsContact O-N 3.15Å; E60-S64 PolarHBondContact O-N 3.13Å
61	D	82.8	Confident	82.1	Confident	103 Å²	103	103.4 Å²	103.4	55%	0.551	53%	0.527	S	S	*	.	H	α-helix	trans	-58.4	-42.9	173.7	-72.4	-25.8	0	0	0	112.3	G57 T63 S64 M65	G57-D61 PolarHBondContact O-N 3.36Å; D61-T63 VanDerWaalsContact C-N 3.35Å; D61-S64 PolarHBondContact O-N 3.2Å; D61-M65 HydrophobicContact CB-CE 4.5Å; D61-M65 WeakPolarHBondContact O-CE 3.42Å; D61-M65 PolarHBondContact O-N 2.97Å
62	L	82.1	Confident	82.3	Confident	102 Å²	102	103.7 Å²	103.7	53%	0.534	53%	0.529	S	S	.	.	H	α-helix	trans	-64.6	-37.6	176.2	-80.6	166.8	0	0	0	112.6	V58 E60 M65 Q66	V58-L62 HydrophobicContact CG1-CD1 3.95Å; V58-L62 HydrophobicContact CG1-CG 4.47Å; V58-L62 WeakPolarHBondContact O-CB 3.26Å; V58-L62 WeakPolarHBondContact O-CD1 3.46Å; V58-L62 VanDerWaalsContact O-CG 3.26Å; V58-L62 WeakPolarHBondContact O-CG 3.32Å; V58-L62 PolarHBondContact O-N 2.92Å; E60-L62 VanDerWaalsContact C-N 3.35Å; E60-L62 PolarHBondContact O-N 3.15Å; L62-M65 HydrophobicContact CD2-CE 4.14Å; L62-M65 PolarHBondContact O-N 3.01Å; L62-Q66 WeakPolarHBondContact O-CB 3.46Å; L62-Q66 PolarHBondContact O-N 3.46Å
63	T	84.1	Confident	82.2	Confident	73 Å²	73	98.4 Å²	98.4	45%	0.448	52%	0.515	S	S	.	.	H	α-helix	trans	-68.2	-41.7	176.2	-55	0	0	0	0	110.4	S59 E60 D61 M65 Q66 D67	S59-T63 PolarHBondContact O-N 3.4Å; S59-T63 VanDerWaalsContact O-N 3.13Å; S59-T63 PolarHBondContact O-OG1 2.94Å; E60-T63 PolarHBondContact O-N 2.75Å; E60-T63 VanDerWaalsContact O-N 3.15Å; D61-T63 VanDerWaalsContact C-N 3.35Å; T63-M65 VanDerWaalsContact C-N 3.34Å; T63-M65 PolarHBondContact O-N 3.15Å; T63-Q66 WeakPolarHBondContact O-CB 3.49Å; T63-Q66 PolarHBondContact O-N 3.41Å; T63-Q66 VanDerWaalsContact O-N 3.15Å; T63-D67 PolarHBondContact O-N 3.4Å
64	S	85.4	Confident	82.2	Confident	62 Å²	62	94.7 Å²	94.7	43%	0.434	51%	0.509	S	S	.	.	H	α-helix	trans	-61.3	-40.1	175.2	-170.5	0	0	0	0	112.7	E60 D61 Q68	E60-S64 PolarHBondContact O-N 3.13Å; D61-S64 PolarHBondContact O-N 3.2Å; S64-Q68 WeakPolarHBondContact O-CG 3.49Å; S64-Q68 PolarHBondContact O-N 3.01Å; S64-Q68 VanDerWaalsContact O-N 3.14Å
65	M	79.8	Confident	82.4	Confident	99 Å²	99	93.8 Å²	93.8	49%	0.488	51%	0.513	S	S	.	.	H	α-helix	trans	-67.8	-35.1	174.2	-75.1	-175.3	-79	0	0	112.9	D61 L62 T63 L69	D61-M65 HydrophobicContact CB-CE 4.5Å; D61-M65 WeakPolarHBondContact O-CE 3.42Å; D61-M65 PolarHBondContact O-N 2.97Å; L62-M65 HydrophobicContact CD2-CE 4.14Å; L62-M65 PolarHBondContact O-N 3.01Å; T63-M65 VanDerWaalsContact C-N 3.34Å; T63-M65 PolarHBondContact O-N 3.15Å; M65-L69 PolarHBondContact O-N 3.12Å
66	Q	85.6	Confident	82.3	Confident	128 Å²	128	93.3 Å²	93.3	60%	0.598	51%	0.514	S	S	*	.	H	α-helix	trans	-61.7	-49.6	174.5	-173.4	80.1	20.9	0	0	110.9	L62 T63 Q68 L69 E70	L62-Q66 WeakPolarHBondContact O-CB 3.46Å; L62-Q66 PolarHBondContact O-N 3.46Å; T63-Q66 WeakPolarHBondContact O-CB 3.49Å; T63-Q66 PolarHBondContact O-N 3.41Å; T63-Q66 VanDerWaalsContact O-N 3.15Å; Q66-Q68 VanDerWaalsContact C-N 3.32Å; Q66-Q68 PolarHBondContact O-N 3.01Å; Q66-L69 WeakPolarHBondContact O-CB 3.48Å; Q66-L69 PolarHBondContact O-N 3.46Å; Q66-L69 VanDerWaalsContact O-N 3.16Å; Q66-E70 PolarHBondContact O-N 3.14Å
67	D	86.7	Confident	82	Confident	98 Å²	98	95.3 Å²	95.3	52%	0.524	52%	0.52	S	S	.	.	H	α-helix	trans	-62.2	-38.7	179.4	-66.7	-12.8	0	0	0	111.9	T63 E70 L71	T63-D67 PolarHBondContact O-N 3.4Å; D67-E70 PolarHBondContact O-N 2.97Å; D67-L71 PolarHBondContact O-N 3.16Å
68	Q	85.6	Confident	81.8	Confident	117 Å²	117	95.7 Å²	95.7	55%	0.547	52%	0.524	S	S	.	.	H	α-helix	trans	-66	-39.1	174.9	-75.3	-172.5	-13.5	0	0	112.6	S64 Q66 L71 I72	S64-Q68 WeakPolarHBondContact O-CG 3.49Å; S64-Q68 PolarHBondContact O-N 3.01Å; S64-Q68 VanDerWaalsContact O-N 3.14Å; Q66-Q68 VanDerWaalsContact C-N 3.32Å; Q66-Q68 PolarHBondContact O-N 3.01Å; Q68-L71 PolarHBondContact O-N 2.97Å; Q68-I72 WeakPolarHBondContact O-CD1 3.38Å; Q68-I72 VanDerWaalsContact O-CG1 3.25Å; Q68-I72 WeakPolarHBondContact O-CG1 3.25Å; Q68-I72 PolarHBondContact O-N 3.43Å
69	L	84.1	Confident	81.5	Confident	114 Å²	114	95.6 Å²	95.6	60%	0.597	53%	0.529	S	S	*	.	H	α-helix	trans	-64.3	-40.1	175.3	-92.8	159.3	0	0	0	112	M65 Q66 I72 A73	M65-L69 PolarHBondContact O-N 3.12Å; Q66-L69 WeakPolarHBondContact O-CB 3.48Å; Q66-L69 PolarHBondContact O-N 3.46Å; Q66-L69 VanDerWaalsContact O-N 3.16Å; L69-I72 PolarHBondContact O-N 3.12Å; L69-A73 WeakPolarHBondContact O-CB 3.36Å; L69-A73 PolarHBondContact O-N 3.36Å
70	E	84.9	Confident	81.1	Confident	120 Å²	120	96.9 Å²	96.9	56%	0.561	53%	0.53	S	S	*	.	H	α-helix	trans	-69.3	-36.1	177.1	-168.7	165.2	-160.5	0	0	112.2	Q66 D67 A73 N74	Q66-E70 PolarHBondContact O-N 3.14Å; D67-E70 PolarHBondContact O-N 2.97Å; E70-A73 PolarHBondContact O-N 2.75Å; E70-N74 PolarHBondContact O-N 3.09Å; E70-N74 VanDerWaalsContact O-N 3.11Å; E70-N74 PolarHBondContact O-ND2 2.88Å
71	L	83.8	Confident	80.9	Confident	111 Å²	111	97.1 Å²	97.1	58%	0.581	53%	0.531	S	S	*	.	H	α-helix	trans	-63.7	-44	170.7	-179.5	63.8	0	0	0	112	D67 Q68 L75	D67-L71 PolarHBondContact O-N 3.16Å; Q68-L71 PolarHBondContact O-N 2.97Å; L71-L75 HydrophobicContact CG-CD1 4.31Å; L71-L75 WeakPolarHBondContact O-CG 3.35Å; L71-L75 PolarHBondContact O-N 3.04Å; L71-L75 VanDerWaalsContact O-N 3.12Å
72	I	80.5	Confident	80.5	Confident	103 Å²	103	99.1 Å²	99.1	53%	0.528	54%	0.535	S	S	.	.	H	α-helix	trans	-62.8	-44.5	176.8	-70.5	164.7	0	0	0	110.3	Q68 L69 N74 L75 T76	Q68-I72 WeakPolarHBondContact O-CD1 3.38Å; Q68-I72 VanDerWaalsContact O-CG1 3.25Å; Q68-I72 WeakPolarHBondContact O-CG1 3.25Å; Q68-I72 PolarHBondContact O-N 3.43Å; L69-I72 PolarHBondContact O-N 3.12Å; I72-N74 PolarHBondContact O-N 3.03Å; I72-L75 WeakPolarHBondContact O-CB 3.46Å; I72-L75 PolarHBondContact O-N 3.02Å; I72-L75 VanDerWaalsContact O-N 3.12Å; I72-T76 PolarHBondContact O-N 2.86Å; I72-T76 PolarHBondContact O-OG1 3.43Å
73	A	80.3	Confident	80.2	Confident	50 Å²	50	98.6 Å²	98.6	41%	0.413	53%	0.532	S	S	.	.	H	α-helix	trans	-56.8	-49.5	178.5	0	0	0	0	0	112	L69 E70 L75 T76 D77	L69-A73 WeakPolarHBondContact O-CB 3.36Å; L69-A73 PolarHBondContact O-N 3.36Å; E70-A73 PolarHBondContact O-N 2.75Å; A73-L75 VanDerWaalsContact C-N 3.29Å; A73-L75 PolarHBondContact O-N 3.11Å; A73-T76 WeakPolarHBondContact CA-OG1 3.43Å; A73-T76 PolarHBondContact O-N 3.26Å; A73-T76 VanDerWaalsContact O-N 3.12Å; A73-T76 PolarHBondContact O-OG1 3.12Å; A73-D77 PolarHBondContact O-N 3.06Å
74	N	80.5	Confident	79.8	Confident	105 Å²	105	98.2 Å²	98.2	56%	0.561	53%	0.529	S	S	*	.	H	α-helix	trans	-61.3	-34.8	176.3	-78	-62.2	0	0	0	112.9	E70 I72 G78	E70-N74 PolarHBondContact O-N 3.09Å; E70-N74 VanDerWaalsContact O-N 3.11Å; E70-N74 PolarHBondContact O-ND2 2.88Å; I72-N74 PolarHBondContact O-N 3.03Å; N74-G78 PolarHBondContact O-N 3.12Å; N74-G78 VanDerWaalsContact O-N 3.12Å
75	L	81.6	Confident	79.4	Confident	118 Å²	118	103.4 Å²	103.4	62%	0.618	54%	0.54	S	S	*	.	H	α-helix	trans	-70.1	-34	174.9	-72.3	169.9	0	0	0	112.5	L71 I72 A73 A79	L71-L75 HydrophobicContact CG-CD1 4.31Å; L71-L75 WeakPolarHBondContact O-CG 3.35Å; L71-L75 PolarHBondContact O-N 3.04Å; L71-L75 VanDerWaalsContact O-N 3.12Å; I72-L75 WeakPolarHBondContact O-CB 3.46Å; I72-L75 PolarHBondContact O-N 3.02Å; I72-L75 VanDerWaalsContact O-N 3.12Å; A73-L75 VanDerWaalsContact C-N 3.29Å; A73-L75 PolarHBondContact O-N 3.11Å; L75-A79 WeakPolarHBondContact O-CB 3.36Å; L75-A79 PolarHBondContact O-N 3.46Å; L75-A79 VanDerWaalsContact O-N 3.09Å
76	T	77.1	Confident	78.9	Confident	84 Å²	84	103.8 Å²	103.8	52%	0.515	54%	0.542	S	S	.	.	H	α-helix	trans	-68	-45.1	172.8	22.9	0	0	0	0	112.9	I72 A73 G78 A79 D80	I72-T76 PolarHBondContact O-N 2.86Å; I72-T76 PolarHBondContact O-OG1 3.43Å; A73-T76 WeakPolarHBondContact CA-OG1 3.43Å; A73-T76 PolarHBondContact O-N 3.26Å; A73-T76 VanDerWaalsContact O-N 3.12Å; A73-T76 PolarHBondContact O-OG1 3.12Å; T76-G78 PolarHBondContact O-N 3.35Å; T76-A79 WeakPolarHBondContact O-CB 3.34Å; T76-A79 PolarHBondContact O-N 3.11Å; T76-A79 VanDerWaalsContact O-N 3.11Å; T76-D80 PolarHBondContact O-N 3.49Å
77	D	74.6	Confident	78.3	Confident	118 Å²	118	104.2 Å²	104.2	63%	0.631	54%	0.542	S	S	*	.	H	α-helix	trans	-61.9	-45.7	177.4	-88.1	10.9	0	0	0	111.2	A73 A79 D80 E81	A73-D77 PolarHBondContact O-N 3.06Å; D77-A79 PolarHBondContact O-N 3.48Å; D77-D80 PolarHBondContact O-N 3.33Å; D77-D80 VanDerWaalsContact O-N 3.1Å; D77-E81 PolarHBondContact O-N 2.93Å
78	G	75.6	Confident	77.5	Confident	40 Å²	40	104.2 Å²	104.2	41%	0.412	54%	0.542	S	S	.	.	H	α-helix	trans	-64.4	-24.1	175.1	0	0	0	0	0	114.1	N74 T76 K82	N74-G78 PolarHBondContact O-N 3.12Å; N74-G78 VanDerWaalsContact O-N 3.12Å; T76-G78 PolarHBondContact O-N 3.35Å; G78-K82 WeakPolarHBondContact O-CB 3.31Å
79	A	73.4	Confident	76.7	Confident	46 Å²	46	101.9 Å²	101.9	38%	0.38	54%	0.539	S	S	.	.	H	α-helix	trans	-76.9	-39.3	171.1	0	0	0	0	0	111.8	L75 T76 D77 K82 I83	L75-A79 WeakPolarHBondContact O-CB 3.36Å; L75-A79 PolarHBondContact O-N 3.46Å; L75-A79 VanDerWaalsContact O-N 3.09Å; T76-A79 WeakPolarHBondContact O-CB 3.34Å; T76-A79 PolarHBondContact O-N 3.11Å; T76-A79 VanDerWaalsContact O-N 3.11Å; D77-A79 PolarHBondContact O-N 3.48Å; A79-K82 PolarHBondContact O-N 2.9Å; A79-I83 VanDerWaalsContact O-CG1 3.31Å; A79-I83 WeakPolarHBondContact O-CG1 3.44Å; A79-I83 PolarHBondContact O-N 2.86Å
80	D	73.4	Confident	75.6	Confident	98 Å²	98	100 Å²	100	52%	0.524	53%	0.532	S	S	.	.	H	α-helix	trans	-72	-38.2	-178.6	-158.1	52.9	0	0	0	112.5	T76 D77 K82 I83 T84	T76-D80 PolarHBondContact O-N 3.49Å; D77-D80 PolarHBondContact O-N 3.33Å; D77-D80 VanDerWaalsContact O-N 3.1Å; D80-K82 PolarHBondContact O-N 3.32Å; D80-I83 PolarHBondContact O-N 3.1Å; D80-T84 WeakPolarHBondContact O-CB 3.33Å; D80-T84 PolarHBondContact O-N 2.86Å; D80-T84 PolarHBondContact O-OG1 2.99Å
81	E	76.4	Confident	74.5	Confident	150 Å²	150	97.6 Å²	97.6	70%	0.701	53%	0.526	S	S	*	.	H	α-helix	trans	-57.1	-41	168	-75	-162.7	149.4	0	0	111.4	D77 T84 Y85	D77-E81 PolarHBondContact O-N 2.93Å; E81-T84 WeakPolarHBondContact O-CB 3.49Å; E81-T84 PolarHBondContact O-N 3.34Å; E81-Y85 PolarHBondContact O-N 3.23Å
82	K	75.4	Confident	73.3	Confident	145 Å²	145	96.6 Å²	96.6	63%	0.63	53%	0.528	S	S	*	.	H	α-helix	trans	-74.6	-34.2	-178.2	-158.7	159.5	-170.5	166.8	0	112.5	G78 A79 D80 T84 M86	G78-K82 WeakPolarHBondContact O-CB 3.31Å; A79-K82 PolarHBondContact O-N 2.9Å; D80-K82 PolarHBondContact O-N 3.32Å; K82-T84 VanDerWaalsContact C-N 3.35Å; K82-M86 WeakPolarHBondContact O-CB 3.5Å; K82-M86 WeakPolarHBondContact O-CG 3.4Å; K82-M86 PolarHBondContact O-N 2.89Å
83	I	75.2	Confident	72.1	Confident	92 Å²	92	94.5 Å²	94.5	47%	0.472	53%	0.526	S	S	.	.	H	α-helix	trans	-63.3	-43.3	168.8	-73.2	166.1	0	0	0	109.9	A79 D80 M86 K87	A79-I83 VanDerWaalsContact O-CG1 3.31Å; A79-I83 WeakPolarHBondContact O-CG1 3.44Å; A79-I83 PolarHBondContact O-N 2.86Å; D80-I83 PolarHBondContact O-N 3.1Å; I83-M86 HydrophobicContact CG1-CE 4.25Å; I83-M86 PolarHBondContact O-N 2.98Å; I83-K87 WeakPolarHBondContact O-CB 3.43Å; I83-K87 PolarHBondContact O-N 3.09Å
84	T	76.1	Confident	70.9	Confident	64 Å²	64	98.9 Å²	98.9	39%	0.393	54%	0.538	S	S	.	.	H	α-helix	trans	-62.6	-46.8	177.3	-59.5	0	0	0	0	111.4	D80 E81 K82 M86 K87 D88	D80-T84 WeakPolarHBondContact O-CB 3.33Å; D80-T84 PolarHBondContact O-N 2.86Å; D80-T84 PolarHBondContact O-OG1 2.99Å; E81-T84 WeakPolarHBondContact O-CB 3.49Å; E81-T84 PolarHBondContact O-N 3.34Å; K82-T84 VanDerWaalsContact C-N 3.35Å; T84-M86 PolarHBondContact O-N 3.38Å; T84-K87 WeakPolarHBondContact O-CB 3.49Å; T84-K87 PolarHBondContact O-N 3.5Å; T84-K87 VanDerWaalsContact O-N 3.12Å; T84-D88 PolarHBondContact O-N 3.14Å
85	Y	76	Confident	69.7	Low	171 Å²	171	102.8 Å²	102.8	67%	0.671	55%	0.55	S	S	*	.	H	α-helix	trans	-59.8	-42.3	173.6	179.8	-96.5	0	0	0	112.9	E81 K87 D88 S89	E81-Y85 PolarHBondContact O-N 3.23Å; Y85-K87 VanDerWaalsContact C-N 3.32Å; Y85-K87 PolarHBondContact O-N 3Å; Y85-D88 PolarHBondContact O-N 3.21Å; Y85-S89 VanDerWaalsContact O-CB 3.31Å; Y85-S89 WeakPolarHBondContact O-CB 3.39Å; Y85-S89 PolarHBondContact O-N 3.38Å
86	M	69.4	Low	68.2	Low	107 Å²	107	102.3 Å²	102.3	53%	0.527	56%	0.556	S	S	.	*	H	α-helix	trans	-65	-35.7	174.6	-74.4	-170.8	-62.3	0	0	112.3	K82 I83 T84 T90	K82-M86 WeakPolarHBondContact O-CB 3.5Å; K82-M86 WeakPolarHBondContact O-CG 3.4Å; K82-M86 PolarHBondContact O-N 2.89Å; I83-M86 HydrophobicContact CG1-CE 4.25Å; I83-M86 PolarHBondContact O-N 2.98Å; T84-M86 PolarHBondContact O-N 3.38Å; M86-T90 WeakPolarHBondContact O-CB 3.42Å; M86-T90 WeakPolarHBondContact O-CG2 3.31Å; M86-T90 PolarHBondContact O-N 3.2Å; M86-T90 PolarHBondContact O-OG1 3.23Å
87	K	73.3	Confident	66.9	Low	138 Å²	138	102.2 Å²	102.2	60%	0.6	56%	0.559	S	S	*	*	H	α-helix	trans	-66.3	-43	176.3	-168.8	178.8	-178.5	-178.9	0	111.7	I83 T84 Y85 T90 T91	I83-K87 WeakPolarHBondContact O-CB 3.43Å; I83-K87 PolarHBondContact O-N 3.09Å; T84-K87 WeakPolarHBondContact O-CB 3.49Å; T84-K87 PolarHBondContact O-N 3.5Å; T84-K87 VanDerWaalsContact O-N 3.12Å; Y85-K87 VanDerWaalsContact C-N 3.32Å; Y85-K87 PolarHBondContact O-N 3Å; K87-T90 WeakPolarHBondContact CA-OG1 3.34Å; K87-T90 PolarHBondContact O-N 3Å; K87-T90 PolarHBondContact O-OG1 2.95Å; K87-T91 VanDerWaalsContact O-CB 3.31Å; K87-T91 WeakPolarHBondContact O-CB 3.39Å; K87-T91 PolarHBondContact O-N 2.77Å; K87-T91 PolarHBondContact O-OG1 3.41Å
88	D	71.3	Confident	65.9	Low	98 Å²	98	104 Å²	104	52%	0.524	56%	0.564	S	S	.	*	H	α-helix	trans	-70.2	-36.4	177.1	-71.7	-16.2	0	0	0	112.2	T84 Y85 S92	T84-D88 PolarHBondContact O-N 3.14Å; Y85-D88 PolarHBondContact O-N 3.21Å; D88-S92 WeakPolarHBondContact O-CB 3.41Å; D88-S92 PolarHBondContact O-N 3.4Å; D88-S92 PolarHBondContact O-OG 2.95Å
89	S	68.4	Low	64.8	Low	67 Å²	67	105.2 Å²	105.2	47%	0.469	56%	0.564	S	S	.	*	H	α-helix	trans	-64.1	-46.5	172.3	-172.4	0	0	0	0	112	Y85 S92 A93	Y85-S89 VanDerWaalsContact O-CB 3.31Å; Y85-S89 WeakPolarHBondContact O-CB 3.39Å; Y85-S89 PolarHBondContact O-N 3.38Å; S89-S92 WeakPolarHBondContact O-CB 3.47Å; S89-S92 PolarHBondContact O-N 3.35Å; S89-A93 PolarHBondContact O-N 3.04Å
90	T	60.9	Low	64.2	Low	76 Å²	76	107.5 Å²	107.5	47%	0.466	57%	0.57	S	S	.	*	H	α-helix	trans	-67.9	-35.8	176.1	46.8	0	0	0	0	112.9	M86 K87 S92 A93 Q94	M86-T90 WeakPolarHBondContact O-CB 3.42Å; M86-T90 WeakPolarHBondContact O-CG2 3.31Å; M86-T90 PolarHBondContact O-N 3.2Å; M86-T90 PolarHBondContact O-OG1 3.23Å; K87-T90 WeakPolarHBondContact CA-OG1 3.34Å; K87-T90 PolarHBondContact O-N 3Å; K87-T90 PolarHBondContact O-OG1 2.95Å; T90-S92 VanDerWaalsContact C-N 3.28Å; T90-S92 PolarHBondContact O-N 3.44Å; T90-A93 PolarHBondContact O-N 3.25Å; T90-Q94 WeakPolarHBondContact O-CB 3.42Å; T90-Q94 WeakPolarHBondContact O-CG 3.26Å; T90-Q94 PolarHBondContact O-N 3.02Å
91	T	61.8	Low	63.9	Low	69 Å²	69	107.4 Å²	107.4	42%	0.423	58%	0.575	S	S	.	*	H	α-helix	trans	-65.7	-33.7	174	-55.5	0	0	0	0	111.6	K87	K87-T91 VanDerWaalsContact O-CB 3.31Å; K87-T91 WeakPolarHBondContact O-CB 3.39Å; K87-T91 PolarHBondContact O-N 2.77Å; K87-T91 PolarHBondContact O-OG1 3.41Å
92	S	58.7	Low	63.4	Low	89 Å²	89	105.5 Å²	105.5	62%	0.622	57%	0.569	S	S	*	*	H	α-helix	trans	-70.8	-36.7	172.6	-59.1	0	0	0	0	112.2	D88 S89 T90	D88-S92 WeakPolarHBondContact O-CB 3.41Å; D88-S92 PolarHBondContact O-N 3.4Å; D88-S92 PolarHBondContact O-OG 2.95Å; S89-S92 WeakPolarHBondContact O-CB 3.47Å; S89-S92 PolarHBondContact O-N 3.35Å; T90-S92 VanDerWaalsContact C-N 3.28Å; T90-S92 PolarHBondContact O-N 3.44Å
93	A	54.6	Low	62.9	Low	59 Å²	59	106.8 Å²	106.8	49%	0.488	57%	0.571	S	S	.	*	H	α-helix	trans	-72.1	-33.2	175.1	0	0	0	0	0	113.7	S89 T90 K95 S96	S89-A93 PolarHBondContact O-N 3.04Å; T90-A93 PolarHBondContact O-N 3.25Å; A93-K95 VanDerWaalsContact C-N 3.26Å; A93-K95 PolarHBondContact O-N 3.26Å; A93-S96 PolarHBondContact O-N 3.35Å; A93-S96 PolarHBondContact O-OG 2.91Å; A93-S96 VanDerWaalsContact O-OG 3.05Å
94	Q	55.8	Low	62.6	Low	142 Å²	142	108.9 Å²	108.9	66%	0.664	57%	0.573	S	S	*	*	H	α-helix	trans	-71.2	-16.1	178.9	-79.2	-178.7	-16.4	0	0	114	T90 S96	T90-Q94 WeakPolarHBondContact O-CB 3.42Å; T90-Q94 WeakPolarHBondContact O-CG 3.26Å; T90-Q94 PolarHBondContact O-N 3.02Å; Q94-S96 PolarHBondContact O-N 3.38Å
95	K	54.3	Low	62.7	Low	188 Å²	188	112.4 Å²	112.4	82%	0.817	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.7	-7.8	175.1	-81.3	-179.4	177	172.9	0	114.4	A93	A93-K95 VanDerWaalsContact C-N 3.26Å; A93-K95 PolarHBondContact O-N 3.26Å
96	S	50.6	Low	62.8	Low	107 Å²	107	108 Å²	108	75%	0.748	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.3	0.4	-179.7	65.2	0	0	0	0	115.4	A93 Q94	A93-S96 PolarHBondContact O-N 3.35Å; A93-S96 PolarHBondContact O-OG 2.91Å; A93-S96 VanDerWaalsContact O-OG 3.05Å; Q94-S96 PolarHBondContact O-N 3.38Å
97	S	49.7	Very low	63.2	Low	82 Å²	82	105.6 Å²	105.6	57%	0.573	57%	0.571	S	S	*	*			trans	-138.1	126.5	177.9	56.8	0	0	0	0	113.5
98	Q	53.5	Low	63.7	Low	157 Å²	157	102 Å²	102	73%	0.734	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-75.2	130.9	168.8	-80.1	-85.3	-7.5	0	0	109.5	R104	Q98-R104 VanDerWaalsContact OE1-NH2 3.08Å
99	P	53.5	Low	64.3	Low	65 Å²	65	102.8 Å²	102.8	42%	0.422	57%	0.565	S	S	.	*	P	Polyproline II helix	trans	-65.6	141.8	172.8	-19	30.5	0	0	0	112.5
100	D	58.8	Low	65.1	Low	93 Å²	93	105 Å²	105	50%	0.497	57%	0.571	S	S	.	*	P	Polyproline II helix	trans	-55.7	134.1	176.2	-171.5	-57.6	0	0	0	111.6	N102 Y103 R104	D100-N102 PolarHBondContact O-N 3.37Å; D100-N102 WeakPolarHBondContact OD1-CB 3.47Å; D100-N102 PolarHBondContact OD1-N 2.99Å; D100-N102 PolarHBondContact OD1-ND2 3.38Å; D100-Y103 WeakPolarHBondContact O-CB 3.27Å; D100-Y103 PolarHBondContact O-N 3.47Å; D100-Y103 VanDerWaalsContact O-N 3.11Å; D100-R104 PolarHBondContact O-N 3.22Å
101	P	69.1	Low	66.2	Low	96 Å²	96	106.2 Å²	106.2	62%	0.623	58%	0.575	S	S	*	*	H	α-helix	trans	-58.9	-28.1	-179.4	23	-34.1	0	0	0	114.2	K105	P101-K105 PolarHBondContact O-N 3.44Å; P101-K105 VanDerWaalsContact O-N 3.17Å
102	N	65.8	Low	67.5	Low	111 Å²	111	106.1 Å²	106.1	59%	0.594	57%	0.572	S	S	*	*	H	α-helix	trans	-69.7	-37.6	177.1	-62	-61.7	0	0	0	111.7	D100 K105 S106	D100-N102 PolarHBondContact O-N 3.37Å; D100-N102 WeakPolarHBondContact OD1-CB 3.47Å; D100-N102 PolarHBondContact OD1-N 2.99Å; D100-N102 PolarHBondContact OD1-ND2 3.38Å; N102-K105 PolarHBondContact O-N 2.8Å; N102-S106 PolarHBondContact O-N 3.28Å; N102-S106 PolarHBondContact O-OG 3.33Å
103	Y	64.1	Low	68.9	Low	171 Å²	171	106.1 Å²	106.1	67%	0.671	57%	0.568	S	S	*	*	H	α-helix	trans	-65.5	-44	177.1	-174.8	-94.2	0	0	0	111.5	D100 K105 S106 S107	D100-Y103 WeakPolarHBondContact O-CB 3.27Å; D100-Y103 PolarHBondContact O-N 3.47Å; D100-Y103 VanDerWaalsContact O-N 3.11Å; Y103-K105 VanDerWaalsContact C-N 3.29Å; Y103-K105 PolarHBondContact O-N 3.05Å; Y103-S106 PolarHBondContact O-N 2.87Å; Y103-S107 PolarHBondContact O-N 3.08Å
104	R	68.8	Low	70.4	Confident	136 Å²	136	107.3 Å²	107.3	51%	0.513	57%	0.566	S	S	.	*	H	α-helix	trans	-57.8	-41.4	173.4	-75	-175.5	174.2	154.3	3.8	112	Q98 D100 S107 S108	Q98-R104 VanDerWaalsContact OE1-NH2 3.08Å; D100-R104 PolarHBondContact O-N 3.22Å; R104-S107 PolarHBondContact O-N 3.47Å; R104-S108 PolarHBondContact O-N 3.11Å
105	K	78.8	Confident	72.1	Confident	139 Å²	139	108.8 Å²	108.8	60%	0.604	57%	0.565	S	S	*	*	H	α-helix	trans	-67.7	-41.5	-179.3	-152.5	176.7	-174.2	179.9	0	112	P101 N102 Y103 S108 M109	P101-K105 PolarHBondContact O-N 3.44Å; P101-K105 VanDerWaalsContact O-N 3.17Å; N102-K105 PolarHBondContact O-N 2.8Å; Y103-K105 VanDerWaalsContact C-N 3.29Å; Y103-K105 PolarHBondContact O-N 3.05Å; K105-S108 PolarHBondContact O-N 3.35Å; K105-M109 HydrophobicContact CG-CE 4.3Å; K105-M109 WeakPolarHBondContact O-CG 3.5Å; K105-M109 PolarHBondContact O-N 3.09Å; K105-M109 VanDerWaalsContact O-N 3.09Å
106	S	78.1	Confident	74	Confident	78 Å²	78	105.9 Å²	105.9	55%	0.545	55%	0.553	S	S	.	*	H	α-helix	trans	-65.6	-40.4	174.7	-59.1	0	0	0	0	112.7	N102 Y103 M109 L110	N102-S106 PolarHBondContact O-N 3.28Å; N102-S106 PolarHBondContact O-OG 3.33Å; Y103-S106 PolarHBondContact O-N 2.87Å; S106-M109 PolarHBondContact O-N 3.18Å; S106-L110 PolarHBondContact O-N 3.49Å; S106-L110 VanDerWaalsContact O-N 3.08Å
107	S	76.9	Confident	76.1	Confident	56 Å²	56	106 Å²	106	39%	0.392	54%	0.541	S	S	.	.	H	α-helix	trans	-62.2	-44.3	174.9	-164.9	0	0	0	0	111.7	Y103 R104 M109 L110 D111	Y103-S107 PolarHBondContact O-N 3.08Å; R104-S107 PolarHBondContact O-N 3.47Å; S107-M109 VanDerWaalsContact C-N 3.34Å; S107-M109 PolarHBondContact O-N 3.03Å; S107-L110 WeakPolarHBondContact O-CB 3.45Å; S107-L110 PolarHBondContact O-N 3.14Å; S107-L110 VanDerWaalsContact O-N 3.11Å; S107-D111 PolarHBondContact O-N 3.48Å
108	S	83.7	Confident	78	Confident	64 Å²	64	109.4 Å²	109.4	45%	0.448	55%	0.546	S	S	.	.	H	α-helix	trans	-60.7	-40.7	176.3	-173.6	0	0	0	0	112.4	R104 K105 L110 D111 D112	R104-S108 PolarHBondContact O-N 3.11Å; K105-S108 PolarHBondContact O-N 3.35Å; S108-L110 VanDerWaalsContact C-N 3.3Å; S108-L110 PolarHBondContact O-N 2.98Å; S108-D111 PolarHBondContact O-N 3.17Å; S108-D112 PolarHBondContact O-N 3.29Å
109	M	84.8	Confident	80	Confident	114 Å²	114	104.8 Å²	104.8	56%	0.562	53%	0.528	S	S	*	.	H	α-helix	trans	-64.6	-35	174.9	-70.7	179.1	-173.7	0	0	112.1	K105 S106 S107 D112 V113	K105-M109 HydrophobicContact CG-CE 4.3Å; K105-M109 WeakPolarHBondContact O-CG 3.5Å; K105-M109 PolarHBondContact O-N 3.09Å; K105-M109 VanDerWaalsContact O-N 3.09Å; S106-M109 PolarHBondContact O-N 3.18Å; S107-M109 VanDerWaalsContact C-N 3.34Å; S107-M109 PolarHBondContact O-N 3.03Å; M109-D112 PolarHBondContact O-N 3.44Å; M109-V113 VanDerWaalsContact O-CG2 3.27Å; M109-V113 WeakPolarHBondContact O-CG2 3.34Å; M109-V113 PolarHBondContact O-N 3.02Å
110	L	84.6	Confident	81.9	Confident	113 Å²	113	105.7 Å²	105.7	59%	0.592	53%	0.529	S	S	*	.	H	α-helix	trans	-69.4	-41	178.3	-153.4	76.4	0	0	0	111.7	S106 S107 S108 V113 L114	S106-L110 PolarHBondContact O-N 3.49Å; S106-L110 VanDerWaalsContact O-N 3.08Å; S107-L110 WeakPolarHBondContact O-CB 3.45Å; S107-L110 PolarHBondContact O-N 3.14Å; S107-L110 VanDerWaalsContact O-N 3.11Å; S108-L110 VanDerWaalsContact C-N 3.3Å; S108-L110 PolarHBondContact O-N 2.98Å; L110-V113 PolarHBondContact O-N 2.78Å; L110-L114 WeakPolarHBondContact O-CG 3.38Å; L110-L114 PolarHBondContact O-N 3.12Å
111	D	84.2	Confident	83.6	Confident	101 Å²	101	106.1 Å²	106.1	54%	0.54	53%	0.531	S	S	.	.	H	α-helix	trans	-62.8	-41.4	173	-72.8	-32	0	0	0	111.7	S107 S108 L114 R115	S107-D111 PolarHBondContact O-N 3.48Å; S108-D111 PolarHBondContact O-N 3.17Å; D111-L114 PolarHBondContact O-N 2.84Å; D111-R115 WeakPolarHBondContact O-CB 3.45Å; D111-R115 PolarHBondContact O-N 3.48Å
112	D	88.6	Confident	84.7	Confident	67 Å²	67	104.8 Å²	104.8	36%	0.358	52%	0.523	S	S	.	.	H	α-helix	trans	-63.7	-41.5	173.9	-78.8	-35.6	0	0	0	111.7	S108 M109 R115 F116	S108-D112 PolarHBondContact O-N 3.29Å; M109-D112 PolarHBondContact O-N 3.44Å; D112-R115 WeakPolarHBondContact O-CB 3.49Å; D112-R115 PolarHBondContact O-N 2.98Å; D112-F116 HydrophobicContact CB-CD2 4.42Å; D112-F116 HydrophobicContact CB-CE2 4.13Å; D112-F116 WeakPolarHBondContact O-CD2 3.43Å; D112-F116 WeakPolarHBondContact O-CG 3.42Å; D112-F116 PolarHBondContact O-N 2.87Å
113	V	89.1	Confident	86.1	Confident	89 Å²	89	104.5 Å²	104.5	54%	0.539	52%	0.518	S	S	.	.	H	α-helix	trans	-60.9	-47.1	175	166.1	0	0	0	0	111.4	M109 L110 R115 F116 E117	M109-V113 VanDerWaalsContact O-CG2 3.27Å; M109-V113 WeakPolarHBondContact O-CG2 3.34Å; M109-V113 PolarHBondContact O-N 3.02Å; L110-V113 PolarHBondContact O-N 2.78Å; V113-R115 PolarHBondContact O-N 2.69Å; V113-F116 PolarHBondContact O-N 3.45Å; V113-E117 PolarHBondContact O-N 3.45Å
114	L	86	Confident	87.5	Confident	84 Å²	84	100.7 Å²	100.7	44%	0.44	51%	0.507	S	S	.	.	H	α-helix	trans	-63.7	-29.4	176.4	-70.2	169	0	0	0	112.6	L110 D111 K118	L110-L114 WeakPolarHBondContact O-CG 3.38Å; L110-L114 PolarHBondContact O-N 3.12Å; D111-L114 PolarHBondContact O-N 2.84Å; L114-K118 WeakPolarHBondContact O-CG 3.49Å; L114-K118 PolarHBondContact O-N 3.41Å
115	R	92	Very high	88.7	Confident	174 Å²	174	100.1 Å²	100.1	66%	0.657	51%	0.51	S	S	*	.	H	α-helix	trans	-74.9	-40.3	173.2	-174.9	-175.6	179.1	-160.7	-0.3	112	D111 D112 V113 T119	D111-R115 WeakPolarHBondContact O-CB 3.45Å; D111-R115 PolarHBondContact O-N 3.48Å; D112-R115 WeakPolarHBondContact O-CB 3.49Å; D112-R115 PolarHBondContact O-N 2.98Å; V113-R115 PolarHBondContact O-N 2.69Å; R115-T119 PolarHBondContact O-N 3.28Å; R115-T119 VanDerWaalsContact O-N 3.15Å; R115-T119 PolarHBondContact O-OG1 3.29Å
116	F	93.9	Very high	89.5	Confident	127 Å²	127	98.9 Å²	98.9	56%	0.557	51%	0.506	S	S	*	.	H	α-helix	trans	-66.7	-41.9	175.7	-72.4	-52.2	0	0	0	111.2	D112 V113 K118 T119 I120	D112-F116 HydrophobicContact CB-CD2 4.42Å; D112-F116 HydrophobicContact CB-CE2 4.13Å; D112-F116 WeakPolarHBondContact O-CD2 3.43Å; D112-F116 WeakPolarHBondContact O-CG 3.42Å; D112-F116 PolarHBondContact O-N 2.87Å; V113-F116 PolarHBondContact O-N 3.45Å; F116-K118 PolarHBondContact O-N 3.26Å; F116-T119 CarbonylContact O-C 3.23Å; F116-T119 WeakPolarHBondContact O-CA 3.37Å; F116-T119 WeakPolarHBondContact O-CB 3.31Å; F116-T119 PolarHBondContact O-N 2.98Å; F116-I120 HydrophobicContact CB-CD1 4.44Å; F116-I120 WeakPolarHBondContact O-CB 3.34Å; F116-I120 VanDerWaalsContact O-CG1 3.26Å; F116-I120 WeakPolarHBondContact O-CG1 3.47Å; F116-I120 PolarHBondContact O-N 3.21Å
117	E	93.4	Very high	90.4	Very high	108 Å²	108	100.7 Å²	100.7	51%	0.505	51%	0.507	S	S	.	.	H	α-helix	trans	-52.4	-52.2	174.9	-176.4	-178.3	-166.5	0	0	111.9	V113 T119 I120 L121	V113-E117 PolarHBondContact O-N 3.45Å; E117-T119 VanDerWaalsContact C-N 3.25Å; E117-T119 PolarHBondContact O-N 2.94Å; E117-I120 PolarHBondContact O-N 2.99Å; E117-L121 HydrophobicContact CG-CD1 4.27Å; E117-L121 WeakPolarHBondContact O-CG 3.31Å; E117-L121 PolarHBondContact O-N 3.18Å
118	K	91.1	Very high	91.3	Very high	155 Å²	155	102.3 Å²	102.3	67%	0.674	51%	0.511	S	S	*	.	H	α-helix	trans	-60.8	-33.5	175.7	-69.1	175.5	-176.8	175.5	0	113.2	L114 F116 S122	L114-K118 WeakPolarHBondContact O-CG 3.49Å; L114-K118 PolarHBondContact O-N 3.41Å; F116-K118 PolarHBondContact O-N 3.26Å; K118-S122 WeakPolarHBondContact O-CB 3.34Å; K118-S122 PolarHBondContact O-N 2.99Å
119	T	94.4	Very high	91.8	Very high	59 Å²	59	104.9 Å²	104.9	36%	0.362	52%	0.516	S	S	.	.	H	α-helix	trans	-74.2	-42.1	179.4	-54.4	0	0	0	0	111.2	R115 F116 E117 S122 Q123	R115-T119 PolarHBondContact O-N 3.28Å; R115-T119 VanDerWaalsContact O-N 3.15Å; R115-T119 PolarHBondContact O-OG1 3.29Å; F116-T119 CarbonylContact O-C 3.23Å; F116-T119 WeakPolarHBondContact O-CA 3.37Å; F116-T119 WeakPolarHBondContact O-CB 3.31Å; F116-T119 PolarHBondContact O-N 2.98Å; E117-T119 VanDerWaalsContact C-N 3.25Å; E117-T119 PolarHBondContact O-N 2.94Å; T119-S122 WeakPolarHBondContact O-CB 3.37Å; T119-S122 PolarHBondContact O-N 3.39Å; T119-Q123 WeakPolarHBondContact O-CG 3.48Å; T119-Q123 PolarHBondContact O-N 3.02Å
120	I	94.6	Very high	92.4	Very high	84 Å²	84	104.5 Å²	104.5	43%	0.431	52%	0.516	S	S	.	.	H	α-helix	trans	-61.5	-50	176.4	-69.9	162.6	0	0	0	109.6	F116 E117 S122 Q123 E124	F116-I120 HydrophobicContact CB-CD1 4.44Å; F116-I120 WeakPolarHBondContact O-CB 3.34Å; F116-I120 VanDerWaalsContact O-CG1 3.26Å; F116-I120 WeakPolarHBondContact O-CG1 3.47Å; F116-I120 PolarHBondContact O-N 3.21Å; E117-I120 PolarHBondContact O-N 2.99Å; I120-S122 VanDerWaalsContact C-N 3.28Å; I120-S122 PolarHBondContact O-N 3.45Å; I120-Q123 CarbonylContact O-C 3.59Å; I120-Q123 PolarHBondContact O-N 3.06Å; I120-E124 HydrophobicContact CG2-CG 4.31Å; I120-E124 WeakPolarHBondContact O-CG 3.35Å; I120-E124 PolarHBondContact O-N 3.48Å
121	L	92.8	Very high	92.9	Very high	103 Å²	103	105.5 Å²	105.5	54%	0.539	52%	0.517	S	S	.	.	H	α-helix	trans	-57.4	-39.5	176.5	-69.7	168.9	0	0	0	112.5	E117 Q125	E117-L121 HydrophobicContact CG-CD1 4.27Å; E117-L121 WeakPolarHBondContact O-CG 3.31Å; E117-L121 PolarHBondContact O-N 3.18Å; L121-Q125 PolarHBondContact O-N 3.45Å; L121-Q125 VanDerWaalsContact O-N 3.14Å
122	S	92.9	Very high	93.5	Very high	67 Å²	67	105.7 Å²	105.7	47%	0.469	52%	0.518	S	S	.	.	H	α-helix	trans	-66.7	-40.6	175	-172.4	0	0	0	0	112.5	K118 T119 I120 Q125 Q126	K118-S122 WeakPolarHBondContact O-CB 3.34Å; K118-S122 PolarHBondContact O-N 2.99Å; T119-S122 WeakPolarHBondContact O-CB 3.37Å; T119-S122 PolarHBondContact O-N 3.39Å; I120-S122 VanDerWaalsContact C-N 3.28Å; I120-S122 PolarHBondContact O-N 3.45Å; S122-Q125 PolarHBondContact O-N 3.05Å; S122-Q126 WeakPolarHBondContact O-CG 3.44Å; S122-Q126 PolarHBondContact O-N 3.28Å; S122-Q126 VanDerWaalsContact O-N 3.14Å
123	Q	95	Very high	93.9	Very high	105 Å²	105	106.4 Å²	106.4	49%	0.491	52%	0.521	S	S	.	.	H	α-helix	trans	-70.4	-39.4	177.4	-74.3	176.8	-19.7	0	0	112.3	T119 I120 Q125 Q126 M127	T119-Q123 WeakPolarHBondContact O-CG 3.48Å; T119-Q123 PolarHBondContact O-N 3.02Å; I120-Q123 CarbonylContact O-C 3.59Å; I120-Q123 PolarHBondContact O-N 3.06Å; Q123-Q125 VanDerWaalsContact C-N 3.33Å; Q123-Q125 PolarHBondContact O-N 3.31Å; Q123-Q126 PolarHBondContact O-N 3.46Å; Q123-M127 WeakPolarHBondContact O-CG 3.37Å; Q123-M127 PolarHBondContact O-N 3.41Å
124	E	94.4	Very high	94.3	Very high	92 Å²	92	106.8 Å²	106.8	43%	0.43	52%	0.519	S	S	.	.	H	α-helix	trans	-59	-44.1	173.1	-74.3	-178.6	157.4	0	0	111.3	I120 Q126 M127 I128	I120-E124 HydrophobicContact CG2-CG 4.31Å; I120-E124 WeakPolarHBondContact O-CG 3.35Å; I120-E124 PolarHBondContact O-N 3.48Å; E124-Q126 VanDerWaalsContact C-N 3.35Å; E124-Q126 PolarHBondContact O-N 3.25Å; E124-M127 HydrophobicContact CB-CE 4.48Å; E124-M127 HydrophobicContact CG-CE 4.02Å; E124-M127 PolarHBondContact O-N 3.05Å; E124-I128 WeakPolarHBondContact O-CG1 3.34Å; E124-I128 PolarHBondContact O-N 3.13Å
125	Q	94.3	Very high	94.8	Very high	123 Å²	123	104.8 Å²	104.8	58%	0.575	51%	0.512	S	S	*	.	H	α-helix	trans	-60.3	-42.8	174.7	-173.2	63.1	26.4	0	0	112.1	L121 S122 Q123 I128 E129	L121-Q125 PolarHBondContact O-N 3.45Å; L121-Q125 VanDerWaalsContact O-N 3.14Å; S122-Q125 PolarHBondContact O-N 3.05Å; Q123-Q125 VanDerWaalsContact C-N 3.33Å; Q123-Q125 PolarHBondContact O-N 3.31Å; Q125-I128 PolarHBondContact O-N 3.45Å; Q125-E129 PolarHBondContact O-N 2.92Å
126	Q	95.8	Very high	95	Very high	113 Å²	113	99 Å²	99	53%	0.528	50%	0.499	S	S	.	.	H	α-helix	trans	-64.9	-38.4	175.4	-72.7	-179.8	-25	0	0	112.7	S122 Q123 E124 E129 L130	S122-Q126 WeakPolarHBondContact O-CG 3.44Å; S122-Q126 PolarHBondContact O-N 3.28Å; S122-Q126 VanDerWaalsContact O-N 3.14Å; Q123-Q126 PolarHBondContact O-N 3.46Å; E124-Q126 VanDerWaalsContact C-N 3.35Å; E124-Q126 PolarHBondContact O-N 3.25Å; Q126-E129 PolarHBondContact O-N 2.85Å; Q126-L130 WeakPolarHBondContact O-CG 3.4Å; Q126-L130 PolarHBondContact O-N 3.25Å
127	M	95.8	Very high	95.1	Very high	116 Å²	116	97 Å²	97	57%	0.571	49%	0.494	S	S	*	.	H	α-helix	trans	-62.5	-44.6	174.5	-71.1	-166.3	-62.8	0	0	111.3	Q123 E124 E129 L130 Q131	Q123-M127 WeakPolarHBondContact O-CG 3.37Å; Q123-M127 PolarHBondContact O-N 3.41Å; E124-M127 HydrophobicContact CB-CE 4.48Å; E124-M127 HydrophobicContact CG-CE 4.02Å; E124-M127 PolarHBondContact O-N 3.05Å; M127-E129 VanDerWaalsContact C-N 3.35Å; M127-E129 PolarHBondContact O-N 2.86Å; M127-L130 PolarHBondContact O-N 3.43Å; M127-Q131 VanDerWaalsContact O-CB 3.31Å; M127-Q131 WeakPolarHBondContact O-CB 3.32Å; M127-Q131 PolarHBondContact O-N 3.48Å
128	I	95.1	Very high	95.3	Very high	90 Å²	90	97.7 Å²	97.7	46%	0.462	50%	0.497	S	S	.	.	H	α-helix	trans	-61.5	-43.2	177.5	-67.7	164.5	0	0	0	110.9	E124 Q125 Q131 N132	E124-I128 WeakPolarHBondContact O-CG1 3.34Å; E124-I128 PolarHBondContact O-N 3.13Å; Q125-I128 PolarHBondContact O-N 3.45Å; I128-Q131 PolarHBondContact O-N 3Å; I128-N132 PolarHBondContact O-N 3.19Å; I128-N132 PolarHBondContact O-ND2 2.86Å; I128-N132 VanDerWaalsContact O-ND2 3.09Å
129	E	96.2	Very high	95.6	Very high	118 Å²	118	98.8 Å²	98.8	55%	0.551	50%	0.497	S	S	*	.	H	α-helix	trans	-61.4	-48.9	176.8	-173.8	172.9	-171.8	0	0	112	Q125 Q126 M127 Q131 N132 I133	Q125-E129 PolarHBondContact O-N 2.92Å; Q126-E129 PolarHBondContact O-N 2.85Å; M127-E129 VanDerWaalsContact C-N 3.35Å; M127-E129 PolarHBondContact O-N 2.86Å; E129-Q131 VanDerWaalsContact C-N 3.3Å; E129-Q131 PolarHBondContact O-N 2.83Å; E129-N132 WeakPolarHBondContact O-CB 3.27Å; E129-N132 PolarHBondContact O-N 2.91Å; E129-I133 HydrophobicContact CG-CD1 4.33Å; E129-I133 WeakPolarHBondContact O-CG1 3.36Å; E129-I133 PolarHBondContact O-N 2.85Å
130	L	96.1	Very high	95.7	Very high	107 Å²	107	99.9 Å²	99.9	56%	0.56	50%	0.5	S	S	*	.	H	α-helix	trans	-60.8	-38.6	176.1	-72	170.7	0	0	0	112.3	Q126 M127 I133 I134	Q126-L130 WeakPolarHBondContact O-CG 3.4Å; Q126-L130 PolarHBondContact O-N 3.25Å; M127-L130 PolarHBondContact O-N 3.43Å; L130-I133 PolarHBondContact O-N 2.83Å; L130-I134 WeakPolarHBondContact O-CG1 3.42Å; L130-I134 PolarHBondContact O-N 2.83Å
131	Q	96.4	Very high	95.8	Very high	133 Å²	133	100.8 Å²	100.8	62%	0.621	50%	0.504	S	S	*	.	H	α-helix	trans	-70.1	-32.6	-179.9	-165.1	154.8	-2.6	0	0	112.5	M127 I128 E129 S135	M127-Q131 VanDerWaalsContact O-CB 3.31Å; M127-Q131 WeakPolarHBondContact O-CB 3.32Å; M127-Q131 PolarHBondContact O-N 3.48Å; I128-Q131 PolarHBondContact O-N 3Å; E129-Q131 VanDerWaalsContact C-N 3.3Å; E129-Q131 PolarHBondContact O-N 2.83Å; Q131-S135 WeakPolarHBondContact O-CB 3.33Å; Q131-S135 PolarHBondContact O-N 3.38Å; Q131-S135 PolarHBondContact O-OG 3.4Å
132	N	96.1	Very high	96	Very high	106 Å²	106	97.9 Å²	97.9	57%	0.567	50%	0.499	S	S	*	.	H	α-helix	trans	-65.8	-41.3	168.7	-73.4	-41.6	0	0	0	111.9	I128 E129 S135 S136	I128-N132 PolarHBondContact O-N 3.19Å; I128-N132 PolarHBondContact O-ND2 2.86Å; I128-N132 VanDerWaalsContact O-ND2 3.09Å; E129-N132 WeakPolarHBondContact O-CB 3.27Å; E129-N132 PolarHBondContact O-N 2.91Å; N132-S135 PolarHBondContact O-N 2.96Å; N132-S136 WeakPolarHBondContact O-CB 3.37Å; N132-S136 PolarHBondContact O-N 2.91Å
133	I	96.6	Very high	96.1	Very high	82 Å²	82	101.1 Å²	101.1	42%	0.421	51%	0.507	S	S	.	.	H	α-helix	trans	-63.8	-44.7	176.4	-67.5	166.6	0	0	0	111.1	E129 L130 S136 N137	E129-I133 HydrophobicContact CG-CD1 4.33Å; E129-I133 WeakPolarHBondContact O-CG1 3.36Å; E129-I133 PolarHBondContact O-N 2.85Å; L130-I133 PolarHBondContact O-N 2.83Å; I133-S136 WeakPolarHBondContact O-CB 3.47Å; I133-S136 PolarHBondContact O-N 3.4Å; I133-N137 WeakPolarHBondContact O-CB 3.46Å; I133-N137 PolarHBondContact O-N 2.9Å
134	I	96.8	Very high	96.3	Very high	97 Å²	97	101.5 Å²	101.5	50%	0.497	51%	0.511	S	S	.	.	H	α-helix	trans	-58.6	-49.8	175.2	-69.2	165.7	0	0	0	110.3	L130 S136 N137 E138	L130-I134 WeakPolarHBondContact O-CG1 3.42Å; L130-I134 PolarHBondContact O-N 2.83Å; I134-S136 PolarHBondContact O-N 3.11Å; I134-N137 PolarHBondContact O-N 3.21Å; I134-N137 VanDerWaalsContact O-N 3.11Å; I134-E138 WeakPolarHBondContact O-CG 3.45Å; I134-E138 PolarHBondContact O-N 3.06Å
135	S	96.4	Very high	96.4	Very high	42 Å²	42	103.8 Å²	103.8	29%	0.294	52%	0.52	S	S	.	.	H	α-helix	trans	-59.4	-34.1	178.2	-57	0	0	0	0	113	Q131 N132 R139	Q131-S135 WeakPolarHBondContact O-CB 3.33Å; Q131-S135 PolarHBondContact O-N 3.38Å; Q131-S135 PolarHBondContact O-OG 3.4Å; N132-S135 PolarHBondContact O-N 2.96Å; S135-R139 WeakPolarHBondContact O-CG 3.49Å; S135-R139 PolarHBondContact O-N 2.88Å
136	S	97	Very high	96.5	Very high	53 Å²	53	104.7 Å²	104.7	37%	0.371	52%	0.522	S	S	.	.	H	α-helix	trans	-70.4	-46.4	174.2	-168.2	0	0	0	0	111.6	N132 I133 I134 E138 R139 N140	N132-S136 WeakPolarHBondContact O-CB 3.37Å; N132-S136 PolarHBondContact O-N 2.91Å; I133-S136 WeakPolarHBondContact O-CB 3.47Å; I133-S136 PolarHBondContact O-N 3.4Å; I134-S136 PolarHBondContact O-N 3.11Å; S136-E138 VanDerWaalsContact C-N 3.34Å; S136-E138 PolarHBondContact O-N 3.01Å; S136-R139 WeakPolarHBondContact O-CB 3.31Å; S136-R139 PolarHBondContact O-N 3.2Å; S136-N140 VanDerWaalsContact O-CG 3.25Å; S136-N140 PolarHBondContact O-N 2.92Å; S136-N140 PolarHBondContact O-ND2 2.89Å
137	N	96.6	Very high	96.5	Very high	85 Å²	85	104.3 Å²	104.3	46%	0.455	52%	0.523	S	S	.	.	H	α-helix	trans	-63.6	-36	178.4	-74.9	-20.1	0	0	0	112.8	I133 I134 N140 M141	I133-N137 WeakPolarHBondContact O-CB 3.46Å; I133-N137 PolarHBondContact O-N 2.9Å; I134-N137 PolarHBondContact O-N 3.21Å; I134-N137 VanDerWaalsContact O-N 3.11Å; N137-N140 PolarHBondContact O-N 3.29Å; N137-M141 WeakPolarHBondContact O-CB 3.45Å; N137-M141 WeakPolarHBondContact O-CG 3.36Å; N137-M141 PolarHBondContact O-N 2.77Å
138	E	96.8	Very high	96.6	Very high	121 Å²	121	102.7 Å²	102.7	57%	0.565	52%	0.519	S	S	*	.	H	α-helix	trans	-63	-41.6	173.7	-73.3	-175.9	157.1	0	0	112.5	I134 S136 M141 G142	I134-E138 WeakPolarHBondContact O-CG 3.45Å; I134-E138 PolarHBondContact O-N 3.06Å; S136-E138 VanDerWaalsContact C-N 3.34Å; S136-E138 PolarHBondContact O-N 3.01Å; E138-M141 HydrophobicContact CG-CE 4.43Å; E138-M141 PolarHBondContact O-N 3.41Å; E138-G142 PolarHBondContact O-N 2.99Å
139	R	96.7	Very high	96.6	Very high	179 Å²	179	103.6 Å²	103.6	68%	0.675	53%	0.525	S	S	*	.	H	α-helix	trans	-62.4	-49.1	173.2	-67.9	170.1	-173.4	156.1	4.5	110.8	S135 S136 M141 G142 E143	S135-R139 WeakPolarHBondContact O-CG 3.49Å; S135-R139 PolarHBondContact O-N 2.88Å; S136-R139 WeakPolarHBondContact O-CB 3.31Å; S136-R139 PolarHBondContact O-N 3.2Å; R139-M141 VanDerWaalsContact C-N 3.31Å; R139-M141 PolarHBondContact O-N 3.47Å; R139-G142 WeakPolarHBondContact O-CA 3.39Å; R139-G142 PolarHBondContact O-N 3.39Å; R139-E143 PolarHBondContact O-N 2.92Å
140	N	96.9	Very high	96.6	Very high	81 Å²	81	102.8 Å²	102.8	43%	0.433	52%	0.521	S	S	.	.	H	α-helix	trans	-58.3	-41.2	177.5	-65	-19.4	0	0	0	111.6	S136 N137 G142 E143 L144	S136-N140 VanDerWaalsContact O-CG 3.25Å; S136-N140 PolarHBondContact O-N 2.92Å; S136-N140 PolarHBondContact O-ND2 2.89Å; N137-N140 PolarHBondContact O-N 3.29Å; N140-G142 PolarHBondContact O-N 2.82Å; N140-E143 PolarHBondContact O-N 3.3Å; N140-L144 VanDerWaalsContact O-CB 3.31Å; N140-L144 WeakPolarHBondContact O-CB 3.38Å; N140-L144 PolarHBondContact O-N 3.46Å
141	M	96.9	Very high	96.6	Very high	104 Å²	104	102.7 Å²	102.7	51%	0.512	52%	0.52	S	S	.	.	H	α-helix	trans	-64.3	-37	173.4	-77	-159.7	-59.2	0	0	112.8	N137 E138 R139 L144 K145	N137-M141 WeakPolarHBondContact O-CB 3.45Å; N137-M141 WeakPolarHBondContact O-CG 3.36Å; N137-M141 PolarHBondContact O-N 2.77Å; E138-M141 HydrophobicContact CG-CE 4.43Å; E138-M141 PolarHBondContact O-N 3.41Å; R139-M141 VanDerWaalsContact C-N 3.31Å; R139-M141 PolarHBondContact O-N 3.47Å; M141-L144 PolarHBondContact O-N 3.29Å; M141-K145 WeakPolarHBondContact O-CB 3.42Å; M141-K145 VanDerWaalsContact O-CG 3.27Å; M141-K145 WeakPolarHBondContact O-CG 3.45Å; M141-K145 PolarHBondContact O-N 3.09Å
142	G	96.5	Very high	96.5	Very high	41 Å²	41	102.5 Å²	102.5	42%	0.423	52%	0.519	S	S	.	.	H	α-helix	trans	-62.7	-45.4	174.3	0	0	0	0	0	112.2	E138 R139 N140 K146	E138-G142 PolarHBondContact O-N 2.99Å; R139-G142 WeakPolarHBondContact O-CA 3.39Å; R139-G142 PolarHBondContact O-N 3.39Å; N140-G142 PolarHBondContact O-N 2.82Å; G142-K146 PolarHBondContact O-N 3.21Å; G142-K146 VanDerWaalsContact O-N 3.09Å
143	E	96.8	Very high	96.4	Very high	136 Å²	136	104.4 Å²	104.4	64%	0.636	53%	0.525	S	S	*	.	H	α-helix	trans	-65.1	-43.3	174.3	-66.3	-170.3	163.8	0	0	112	R139 N140 K145 K146 L147	R139-E143 PolarHBondContact O-N 2.92Å; N140-E143 PolarHBondContact O-N 3.3Å; E143-K145 PolarHBondContact O-N 3.43Å; E143-K146 WeakPolarHBondContact O-CB 3.04Å; E143-K146 PolarHBondContact O-N 3.45Å; E143-K146 VanDerWaalsContact O-N 3.13Å; E143-L147 PolarHBondContact O-N 3.03Å
144	L	97.2	Very high	96.3	Very high	112 Å²	112	108.7 Å²	108.7	59%	0.586	54%	0.54	S	S	*	.	H	α-helix	trans	-61.6	-43.5	177.5	-154.9	86	0	0	0	111.5	N140 M141 K146 L147 V148	N140-L144 VanDerWaalsContact O-CB 3.31Å; N140-L144 WeakPolarHBondContact O-CB 3.38Å; N140-L144 PolarHBondContact O-N 3.46Å; M141-L144 PolarHBondContact O-N 3.29Å; L144-K146 VanDerWaalsContact C-N 3.32Å; L144-K146 PolarHBondContact O-N 3.43Å; L144-L147 PolarHBondContact O-N 3.02Å; L144-V148 VanDerWaalsContact O-CG2 3.32Å; L144-V148 WeakPolarHBondContact O-CG2 3.48Å; L144-V148 PolarHBondContact O-N 3.46Å
145	K	97.1	Very high	96.1	Very high	141 Å²	141	108.5 Å²	108.5	61%	0.613	55%	0.547	S	S	*	.	H	α-helix	trans	-59.1	-42.7	173.4	-77.6	172.2	-179.5	178	0	111.5	M141 E143 V148 L149	M141-K145 WeakPolarHBondContact O-CB 3.42Å; M141-K145 VanDerWaalsContact O-CG 3.27Å; M141-K145 WeakPolarHBondContact O-CG 3.45Å; M141-K145 PolarHBondContact O-N 3.09Å; E143-K145 PolarHBondContact O-N 3.43Å; K145-V148 PolarHBondContact O-N 2.98Å; K145-L149 WeakPolarHBondContact O-CG 3.42Å; K145-L149 PolarHBondContact O-N 3.37Å
146	K	96.6	Very high	96	Very high	142 Å²	142	112.7 Å²	112.7	62%	0.617	56%	0.564	S	S	*	*	H	α-helix	trans	-64.4	-41	177	-165.9	178.9	-177	-178.6	0	111.7	G142 E143 L144 L149 Q150	G142-K146 PolarHBondContact O-N 3.21Å; G142-K146 VanDerWaalsContact O-N 3.09Å; E143-K146 WeakPolarHBondContact O-CB 3.04Å; E143-K146 PolarHBondContact O-N 3.45Å; E143-K146 VanDerWaalsContact O-N 3.13Å; L144-K146 VanDerWaalsContact C-N 3.32Å; L144-K146 PolarHBondContact O-N 3.43Å; K146-L149 PolarHBondContact O-N 3.29Å; K146-Q150 WeakPolarHBondContact O-CG 3.45Å; K146-Q150 PolarHBondContact O-N 3.17Å
147	L	96.8	Very high	95.8	Very high	104 Å²	104	113.9 Å²	113.9	55%	0.545	58%	0.577	S	S	.	*	H	α-helix	trans	-66.5	-41.2	176.1	-177.3	63.1	0	0	0	112.1	E143 L144 Q150 L151	E143-L147 PolarHBondContact O-N 3.03Å; L144-L147 PolarHBondContact O-N 3.02Å; L147-Q150 PolarHBondContact O-N 3.32Å; L147-L151 WeakPolarHBondContact O-CB 3.4Å; L147-L151 PolarHBondContact O-N 3.14Å
148	V	96.6	Very high	95.6	Very high	82 Å²	82	115.5 Å²	115.5	50%	0.497	59%	0.593	S	S	.	*	H	α-helix	trans	-60.9	-44.3	174.9	167.9	0	0	0	0	110.9	L144 K145 Q150 L151 Q152	L144-V148 VanDerWaalsContact O-CG2 3.32Å; L144-V148 WeakPolarHBondContact O-CG2 3.48Å; L144-V148 PolarHBondContact O-N 3.46Å; K145-V148 PolarHBondContact O-N 2.98Å; V148-Q150 PolarHBondContact O-N 3.11Å; V148-L151 PolarHBondContact O-N 3.34Å; V148-Q152 WeakPolarHBondContact O-CB 3.46Å; V148-Q152 PolarHBondContact O-N 3.02Å
149	L	95.8	Very high	95.4	Very high	110 Å²	110	115.8 Å²	115.8	58%	0.576	61%	0.606	S	S	*	*	H	α-helix	trans	-62.8	-40.4	175.4	-69.9	170.9	0	0	0	112.2	K145 K146 Q153	K145-L149 WeakPolarHBondContact O-CG 3.42Å; K145-L149 PolarHBondContact O-N 3.37Å; K146-L149 PolarHBondContact O-N 3.29Å; L149-Q153 WeakPolarHBondContact O-CB 3.47Å; L149-Q153 PolarHBondContact O-N 3.23Å
150	Q	95.9	Very high	95.2	Very high	101 Å²	101	117 Å²	117	47%	0.472	61%	0.611	S	S	.	*	H	α-helix	trans	-65.1	-39.4	174.5	-74.6	179	-19.2	0	0	112.8	K146 L147 V148 Q153 K154	K146-Q150 WeakPolarHBondContact O-CG 3.45Å; K146-Q150 PolarHBondContact O-N 3.17Å; L147-Q150 PolarHBondContact O-N 3.32Å; V148-Q150 PolarHBondContact O-N 3.11Å; Q150-Q153 PolarHBondContact O-N 2.77Å; Q150-K154 WeakPolarHBondContact O-CG 3.39Å; Q150-K154 PolarHBondContact O-N 2.98Å
151	L	95.6	Very high	95	Very high	105 Å²	105	118.1 Å²	118.1	55%	0.55	62%	0.617	S	S	.	*	H	α-helix	trans	-67	-46.7	176.4	-177.3	63	0	0	0	110.8	L147 V148 Q153 K154 C155	L147-L151 WeakPolarHBondContact O-CB 3.4Å; L147-L151 PolarHBondContact O-N 3.14Å; V148-L151 PolarHBondContact O-N 3.34Å; L151-Q153 VanDerWaalsContact C-N 3.26Å; L151-Q153 PolarHBondContact O-N 3.15Å; L151-K154 PolarHBondContact O-N 3.03Å; L151-C155 PolarHBondContact O-N 3.05Å; L151-C155 VanDerWaalsContact O-N 3.08Å; L151-C155 PolarHBondContact O-SG 3.34Å
152	Q	95.6	Very high	94.7	Very high	128 Å²	128	119.3 Å²	119.3	60%	0.598	63%	0.63	S	S	*	*	H	α-helix	trans	-55.3	-42.5	174.7	-175.4	177.8	-0.2	0	0	111.3	V148 K154 C155 I156	V148-Q152 WeakPolarHBondContact O-CB 3.46Å; V148-Q152 PolarHBondContact O-N 3.02Å; Q152-K154 VanDerWaalsContact C-N 3.34Å; Q152-K154 PolarHBondContact O-N 3.25Å; Q152-C155 PolarHBondContact O-N 3.42Å; Q152-I156 WeakPolarHBondContact O-CG1 3.42Å; Q152-I156 PolarHBondContact O-N 2.85Å
153	Q	93.9	Very high	94.5	Very high	146 Å²	146	120.3 Å²	120.3	68%	0.682	63%	0.628	S	S	*	*	H	α-helix	trans	-66.3	-32.3	177.9	-167.2	171.5	20.7	0	0	113.5	L149 Q150 L151 I156	L149-Q153 WeakPolarHBondContact O-CB 3.47Å; L149-Q153 PolarHBondContact O-N 3.23Å; Q150-Q153 PolarHBondContact O-N 2.77Å; L151-Q153 VanDerWaalsContact C-N 3.26Å; L151-Q153 PolarHBondContact O-N 3.15Å; Q153-I156 HydrophobicContact CG-CD1 4.28Å
154	K	92.9	Very high	94.3	Very high	172 Å²	172	118.2 Å²	118.2	75%	0.748	62%	0.618	S	S	*	*	H	α-helix	trans	-72.5	-29.8	174.2	-72.8	176.8	177.6	-177.4	0	112.9	Q150 L151 Q152	Q150-K154 WeakPolarHBondContact O-CG 3.39Å; Q150-K154 PolarHBondContact O-N 2.98Å; L151-K154 PolarHBondContact O-N 3.03Å; Q152-K154 VanDerWaalsContact C-N 3.34Å; Q152-K154 PolarHBondContact O-N 3.25Å
155	C	93.7	Very high	94.3	Very high	94 Å²	94	116.2 Å²	116.2	64%	0.635	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.4	15.7	-176.7	-62.1	0	0	0	0	114.3	L151 Q152	L151-C155 PolarHBondContact O-N 3.05Å; L151-C155 VanDerWaalsContact O-N 3.08Å; L151-C155 PolarHBondContact O-SG 3.34Å; Q152-C155 PolarHBondContact O-N 3.42Å
156	I	94.8	Very high	94.3	Very high	129 Å²	129	112.5 Å²	112.5	66%	0.662	59%	0.592	S	S	*	*	S	Bend	trans	-73.1	-39.5	177	-61.6	179.3	0	0	0	111.7	Q152 Q153	Q152-I156 WeakPolarHBondContact O-CG1 3.42Å; Q152-I156 PolarHBondContact O-N 2.85Å; Q153-I156 HydrophobicContact CG-CD1 4.28Å
157	A	91.3	Very high	94.3	Very high	78 Å²	78	111.4 Å²	111.4	65%	0.645	60%	0.6	S	S	*	*	S	Bend	trans	-78.5	137.8	-176.5	0	0	0	0	0	111
158	P	92.9	Very high	94.4	Very high	119 Å²	119	108.7 Å²	108.7	77%	0.773	59%	0.587	S	S	*	*	P	Polyproline II helix	trans	-68.2	171.1	169.1	32.3	-36.1	0	0	0	110.7	R160	P158-R160 PolarHBondContact O-N 2.86Å
159	C	92.4	Very high	94.4	Very high	127 Å²	127	107.8 Å²	107.8	86%	0.858	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-54.1	133.2	166.3	-60.4	0	0	0	0	109.8	D161	C159-D161 PolarHBondContact O-N 3.44Å
160	R	92.1	Very high	94.4	Very high	205 Å²	205	102.9 Å²	102.9	77%	0.774	56%	0.559	S	S	*	*			trans	-72.8	115.6	170.1	-179.8	176.7	-178.7	-179.3	1	108.2	P158 E164	P158-R160 PolarHBondContact O-N 2.86Å; R160-E164 IonicContact CZ-OE1 2.71Å; R160-E164 IonicContact NE-OE1 2.73Å; R160-E164 PolarHBondContact NE-OE1 2.99Å; R160-E164 VanDerWaalsContact NE-OE1 3.16Å; R160-E164 IonicContact NH2-OE1 3.25Å; R160-E164 PolarHBondContact NH2-OE1 2.83Å; R160-E164 IonicContact NH2-OE2 2.89Å
161	D	92.6	Very high	94.5	Very high	105 Å²	105	101 Å²	101	56%	0.561	55%	0.554	S	S	*	*			trans	-66.2	139.6	168.3	-161.4	-18.1	0	0	0	109.6	C159 V163	C159-D161 PolarHBondContact O-N 3.44Å; D161-V163 VanDerWaalsContact C-N 3.34Å; D161-V163 WeakPolarHBondContact OD1-CB 3.49Å; D161-V163 PolarHBondContact OD1-N 3.2Å
162	T	91.6	Very high	94.5	Very high	128 Å²	128	97.1 Å²	97.1	79%	0.785	53%	0.534	S	S	*	.	S	Bend	trans	-83.1	-15.7	172	49.7	0	0	0	0	112	E164	T162-E164 PolarHBondContact O-N 2.96Å; T162-E164 VanDerWaalsContact O-N 3.1Å
163	V	93.1	Very high	94.6	Very high	63 Å²	63	91 Å²	91	38%	0.382	51%	0.505	S	S	.	.			trans	-82.4	79.5	177.8	-174.8	0	0	0	0	110.1	D161 L186 P240	D161-V163 VanDerWaalsContact C-N 3.34Å; D161-V163 WeakPolarHBondContact OD1-CB 3.49Å; D161-V163 PolarHBondContact OD1-N 3.2Å; V163-L186 HydrophobicContact CG1-CD1 3.6Å; V163-P240 HydrophobicContact CB-CG 4.47Å; V163-P240 HydrophobicContact CG1-CG 4.12Å
164	E	92.9	Very high	94.7	Very high	92 Å²	92	84.3 Å²	84.3	43%	0.43	47%	0.474	S	S	.	.			trans	-86.4	115.9	177	-65.7	-175	-176.8	0	0	111.3	R160 T162	R160-E164 IonicContact CZ-OE1 2.71Å; R160-E164 IonicContact NE-OE1 2.73Å; R160-E164 PolarHBondContact NE-OE1 2.99Å; R160-E164 VanDerWaalsContact NE-OE1 3.16Å; R160-E164 IonicContact NH2-OE1 3.25Å; R160-E164 PolarHBondContact NH2-OE1 2.83Å; R160-E164 IonicContact NH2-OE2 2.89Å; T162-E164 PolarHBondContact O-N 2.96Å; T162-E164 VanDerWaalsContact O-N 3.1Å
165	I	97	Very high	94.9	Very high	70 Å²	70	77.9 Å²	77.9	36%	0.359	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	131.9	172.9	-58.4	171.3	0	0	0	109.2	L186 Y188 L199	I165-L186 HydrophobicContact CG1-CB 4.22Å; I165-L186 HydrophobicContact CG1-CD1 4.42Å; I165-Y188 HydrophobicContact CD1-CE2 4.13Å; I165-Y188 HydrophobicContact CG2-CD2 3.89Å; I165-Y188 HydrophobicContact CG2-CE2 3.89Å; I165-L199 HydrophobicContact CD1-CD1 3.95Å; I165-L199 HydrophobicContact CD1-CD2 4.17Å; I165-L199 HydrophobicContact CG1-CD1 4.17Å; I165-L199 HydrophobicContact CG2-CD1 3.74Å
166	Q	96.9	Very high	95.1	Very high	62 Å²	62	73.4 Å²	73.4	29%	0.29	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	141.2	-176.6	-61	-61.1	-38.2	0	0	111.5	T168 L186 Y187	Q166-T168 PolarHBondContact O-N 2.68Å; Q166-L186 WeakPolarHBondContact CB-O 3.41Å; Q166-L186 PolarHBondContact N-O 3.29Å; Q166-Y187 HydrophobicContact CB-CD1 3.52Å; Q166-Y187 HydrophobicContact CB-CD2 4.34Å; Q166-Y187 HydrophobicContact CB-CE1 3.24Å; Q166-Y187 HydrophobicContact CB-CE2 4.11Å; Q166-Y187 HydrophobicContact CB-CG 4.07Å; Q166-Y187 HydrophobicContact CG-CD1 4.38Å; Q166-Y187 HydrophobicContact CG-CD2 4.43Å; Q166-Y187 HydrophobicContact CG-CE1 3.85Å; Q166-Y187 HydrophobicContact CG-CE2 3.9Å
167	P	96.6	Very high	95.2	Very high	120 Å²	120	67.7 Å²	67.7	78%	0.779	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.8	-17.7	-172.3	30.9	-36.7	0	0	0	114.2
168	T	97.4	Very high	95.5	Very high	46 Å²	46	68.7 Å²	68.7	28%	0.282	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	139.8	178.7	-51.5	0	0	0	0	110.3	Q166 I176 K179 Y187	Q166-T168 PolarHBondContact O-N 2.68Å; T168-I176 HydrophobicContact CG2-CG2 4.15Å; T168-K179 HydrophobicContact CG2-CB 4.08Å; T168-K179 HydrophobicContact CG2-CD 4.49Å; T168-Y187 WeakPolarHBondContact O-CD1 3.47Å
169	T	97.8	Very high	95.7	Very high	64 Å²	64	68.5 Å²	68.5	39%	0.393	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	155.5	177.4	-173.1	0	0	0	0	111.8	K179 Y188	T169-K179 WeakPolarHBondContact O-CD 3.39Å; T169-K179 PolarHBondContact O-NZ 3.15Å; T169-Y188 WeakPolarHBondContact CA-O 3.26Å; T169-Y188 WeakPolarHBondContact CB-O 2.91Å; T169-Y188 PolarHBondContact OG1-O 2.93Å
170	G	96.6	Very high	95.9	Very high	7 Å²	7	65.1 Å²	65.1	7%	0.072	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.8	-176.4	-179.1	0	0	0	0	0	113.7	D172 D175 V189 K190	G170-D172 VanDerWaalsContact C-N 3.29Å; G170-D175 WeakPolarHBondContact CA-OD2 3.41Å; G170-V189 CarbonylContact O-C 3.55Å; G170-V189 VanDerWaalsContact O-CA 3.23Å; G170-V189 WeakPolarHBondContact O-CA 3.36Å; G170-K190 PolarHBondContact O-N 3.43Å
171	T	96.1	Very high	96.2	Very high	60 Å²	60	55.9 Å²	55.9	37%	0.368	33%	0.325	S	S	.	.	S	Bend	trans	-68.7	-31.7	176.2	52.3	0	0	0	0	112.6	D175	T171-D175 PolarHBondContact N-OD2 2.89Å; T171-D175 WeakPolarHBondContact OG1-CB 3.42Å
172	D	96.4	Very high	96.3	Very high	25 Å²	25	56.2 Å²	56.2	13%	0.134	33%	0.332	C	S	.	.	S	Bend	trans	-157.5	177.6	179.8	55.3	59	0	0	0	109.4	G170 Q174 D175 I176 L256	G170-D172 VanDerWaalsContact C-N 3.29Å; D172-Q174 PolarHBondContact O-N 3.21Å; D172-Q174 VanDerWaalsContact OD1-CA 3.3Å; D172-Q174 WeakPolarHBondContact OD1-CA 3.46Å; D172-Q174 VanDerWaalsContact OD1-CB 3.28Å; D172-Q174 WeakPolarHBondContact OD1-CB 3.42Å; D172-Q174 PolarHBondContact OD1-N 2.86Å; D172-D175 PolarHBondContact O-N 3.27Å; D172-D175 PolarHBondContact OD1-N 3.45Å; D172-I176 WeakPolarHBondContact O-CG1 3.41Å; D172-I176 PolarHBondContact O-N 3.03Å; D172-I176 VanDerWaalsContact O-N 3.16Å; D172-L256 HydrophobicContact CB-CD2 4.13Å
173	C	97.7	Very high	96.5	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-64.2	-22.1	178.3	-66.4	0	0	0	0	114.3	A177 C202 G210 T212	C173-A177 PolarHBondContact O-N 3.35Å; C173-C202 VanDerWaalsContact CA-SG 3.55Å; C173-C202 HydrophobicContact CB-CB 3.62Å; C173-C202 WeakPolarHBondContact CB-SG 3.42Å; C173-C202 WeakPolarHBondContact SG-CA 3.34Å; C173-C202 WeakPolarHBondContact SG-CB 3.24Å; C173-C202 CovalentContact SG-SG 2.03Å; C173-C202 PolarHBondContact SG-SG 3.08Å; C173-G210 CarbonylContact C-O 3.52Å; C173-T212 WeakPolarHBondContact CB-OG1 3.44Å; C173-T212 PolarHBondContact N-OG1 2.92Å; C173-T212 PolarHBondContact SG-OG1 2.92Å; C173-T212 VanDerWaalsContact SG-OG1 3.32Å
174	Q	96.9	Very high	96.8	Very high	4 Å²	4	52.8 Å²	52.8	2%	0.019	31%	0.312	C	S	.	.	H	α-helix	trans	-80	-37.4	178.2	-177.1	58.7	80.1	0	0	111.6	D172 I176 A177 N178 G208 G210 P409 R412	D172-Q174 PolarHBondContact O-N 3.21Å; D172-Q174 VanDerWaalsContact OD1-CA 3.3Å; D172-Q174 WeakPolarHBondContact OD1-CA 3.46Å; D172-Q174 VanDerWaalsContact OD1-CB 3.28Å; D172-Q174 WeakPolarHBondContact OD1-CB 3.42Å; D172-Q174 PolarHBondContact OD1-N 2.86Å; Q174-I176 VanDerWaalsContact C-N 3.31Å; Q174-A177 PolarHBondContact O-N 2.85Å; Q174-N178 PolarHBondContact NE2-OD1 3.49Å; Q174-N178 WeakPolarHBondContact O-CB 3.23Å; Q174-N178 PolarHBondContact O-N 3.33Å; Q174-N178 PolarHBondContact O-ND2 2.85Å; Q174-N178 PolarHBondContact O-OD1 3.16Å; Q174-G208 PolarHBondContact NE2-O 3.08Å; Q174-G210 PolarHBondContact N-O 3.33Å; Q174-P409 HydrophobicContact CB-CG 4.04Å; Q174-P409 HydrophobicContact CG-CG 4.24Å; Q174-R412 HydrophobicContact CG-CG 3.83Å
175	D	96.5	Very high	97	Very high	37 Å²	37	48.4 Å²	48.4	20%	0.198	29%	0.292	C	S	.	.	H	α-helix	trans	-62.2	-40.1	168.9	178.4	40.2	0	0	0	111.2	G170 T171 D172 N178 K179	G170-D175 WeakPolarHBondContact CA-OD2 3.41Å; T171-D175 PolarHBondContact N-OD2 2.89Å; T171-D175 WeakPolarHBondContact OG1-CB 3.42Å; D172-D175 PolarHBondContact O-N 3.27Å; D172-D175 PolarHBondContact OD1-N 3.45Å; D175-N178 PolarHBondContact O-N 2.78Å; D175-K179 WeakPolarHBondContact O-CD 3.5Å; D175-K179 WeakPolarHBondContact O-CG 3.3Å; D175-K179 PolarHBondContact O-N 3.25Å; D175-K179 VanDerWaalsContact OD1-CE 3.26Å; D175-K179 WeakPolarHBondContact OD1-CE 3.48Å; D175-K179 IonicContact OD1-NZ 3.43Å; D175-K179 PolarHBondContact OD1-NZ 2.92Å; D175-K179 WeakPolarHBondContact OD2-CE 3.02Å; D175-K179 IonicContact OD2-NZ 2.68Å; D175-K179 PolarHBondContact OD2-NZ 3.47Å
176	I	98	Very high	97.1	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-58.8	-47.5	171.6	-74.2	163.5	0	0	0	111.8	T168 D172 Q174 K179 A181 Y187 V189 I204	T168-I176 HydrophobicContact CG2-CG2 4.15Å; D172-I176 WeakPolarHBondContact O-CG1 3.41Å; D172-I176 PolarHBondContact O-N 3.03Å; D172-I176 VanDerWaalsContact O-N 3.16Å; Q174-I176 VanDerWaalsContact C-N 3.31Å; I176-K179 WeakPolarHBondContact O-CB 3.28Å; I176-K179 PolarHBondContact O-N 3.08Å; I176-A181 HydrophobicContact CG2-CB 3.54Å; I176-A181 WeakPolarHBondContact O-CB 3.49Å; I176-A181 PolarHBondContact O-N 2.67Å; I176-Y187 HydrophobicContact CD1-CD1 4.11Å; I176-Y187 HydrophobicContact CD1-CG 4.09Å; I176-Y187 HydrophobicContact CG2-CD1 3.52Å; I176-Y187 HydrophobicContact CG2-CE1 3.51Å; I176-Y187 HydrophobicContact CG2-CG 4.11Å; I176-V189 HydrophobicContact CD1-CG1 3.53Å; I176-I204 HydrophobicContact CG2-CD1 4.27Å
177	A	97.4	Very high	97.1	Very high	10 Å²	10	42.4 Å²	42.4	8%	0.083	26%	0.262	C	S	.	.	H	α-helix	trans	-64.8	-38.3	175.9	0	0	0	0	0	112.3	C173 Q174 K179 G180 I204	C173-A177 PolarHBondContact O-N 3.35Å; Q174-A177 PolarHBondContact O-N 2.85Å; A177-K179 PolarHBondContact O-N 3.42Å; A177-G180 PolarHBondContact O-N 3.01Å; A177-I204 HydrophobicContact CB-CD1 4.34Å; A177-I204 HydrophobicContact CB-CG2 4.12Å
178	N	96.7	Very high	97.2	Very high	99 Å²	99	40.8 Å²	40.8	53%	0.529	24%	0.241	S	C	.	.	H	α-helix	trans	-63.2	-27.7	175.1	-67.1	-21.5	0	0	0	112.5	Q174 D175 G180	Q174-N178 PolarHBondContact NE2-OD1 3.49Å; Q174-N178 WeakPolarHBondContact O-CB 3.23Å; Q174-N178 PolarHBondContact O-N 3.33Å; Q174-N178 PolarHBondContact O-ND2 2.85Å; Q174-N178 PolarHBondContact O-OD1 3.16Å; D175-N178 PolarHBondContact O-N 2.78Å; N178-G180 PolarHBondContact O-N 3Å
179	K	97.4	Very high	97.3	Very high	114 Å²	114	38.6 Å²	38.6	50%	0.496	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	4.9	173.3	-71.7	161.9	176.6	166.6	0	113.9	T168 T169 D175 I176 A177	T168-K179 HydrophobicContact CG2-CB 4.08Å; T168-K179 HydrophobicContact CG2-CD 4.49Å; T169-K179 WeakPolarHBondContact O-CD 3.39Å; T169-K179 PolarHBondContact O-NZ 3.15Å; D175-K179 WeakPolarHBondContact O-CD 3.5Å; D175-K179 WeakPolarHBondContact O-CG 3.3Å; D175-K179 PolarHBondContact O-N 3.25Å; D175-K179 VanDerWaalsContact OD1-CE 3.26Å; D175-K179 WeakPolarHBondContact OD1-CE 3.48Å; D175-K179 IonicContact OD1-NZ 3.43Å; D175-K179 PolarHBondContact OD1-NZ 2.92Å; D175-K179 WeakPolarHBondContact OD2-CE 3.02Å; D175-K179 IonicContact OD2-NZ 2.68Å; D175-K179 PolarHBondContact OD2-NZ 3.47Å; I176-K179 WeakPolarHBondContact O-CB 3.28Å; I176-K179 PolarHBondContact O-N 3.08Å; A177-K179 PolarHBondContact O-N 3.42Å
180	G	96.6	Very high	97.2	Very high	57 Å²	57	40.3 Å²	40.3	59%	0.588	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	94.5	12.2	174.6	0	0	0	0	0	115.1	A177 N178	A177-G180 PolarHBondContact O-N 3.01Å; N178-G180 PolarHBondContact O-N 3Å
181	A	97.3	Very high	97.2	Very high	10 Å²	10	40 Å²	40	8%	0.083	23%	0.227	C	C	.	.			trans	-69.5	132.8	168.4	0	0	0	0	0	110.6	I176 Y187 I204	I176-A181 HydrophobicContact CG2-CB 3.54Å; I176-A181 WeakPolarHBondContact O-CB 3.49Å; I176-A181 PolarHBondContact O-N 2.67Å; A181-Y187 HydrophobicContact CB-CE1 4.04Å; A181-I204 HydrophobicContact CB-CD1 3.74Å
182	T	96.1	Very high	97	Very high	113 Å²	113	41.2 Å²	41.2	69%	0.693	24%	0.243	S	C	*	.			trans	-123.3	-1.4	-176.6	57.1	0	0	0	0	114
183	T	96	Very high	96.7	Very high	78 Å²	78	43.4 Å²	43.4	48%	0.479	26%	0.26	S	S	.	.	S	Bend	trans	-115.5	125.6	-169.8	-50.7	0	0	0	0	109	Y187	T183-Y187 WeakPolarHBondContact O-CE2 3.43Å; T183-Y187 PolarHBondContact O-OH 2.84Å
184	S	97.8	Very high	96.5	Very high	40 Å²	40	43.7 Å²	43.7	28%	0.28	26%	0.263	S	S	.	.			trans	-64.5	147.4	170.1	-57.3	0	0	0	0	111	Y201 C202 I204	S184-Y201 WeakPolarHBondContact CB-OH 3.39Å; S184-C202 CarbonylContact C-O 3.6Å; S184-C202 WeakPolarHBondContact CA-O 3.02Å; S184-C202 WeakPolarHBondContact CB-O 3.42Å; S184-I204 PolarHBondContact OG-N 3.01Å; S184-I204 PolarHBondContact OG-O 2.03Å
185	G	97.8	Very high	96.3	Very high	1 Å²	1	52.6 Å²	52.6	1%	0.01	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	154.1	-157	-179.4	0	0	0	0	0	113.5	Y187 Y201 C202	G185-Y187 WeakPolarHBondContact O-CD2 3.42Å; G185-Y201 WeakPolarHBondContact O-CA 3.11Å; G185-C202 PolarHBondContact N-O 3.16Å; G185-C202 PolarHBondContact O-N 3Å
186	L	98.4	Very high	96.3	Very high	2 Å²	2	54 Å²	54	1%	0.01	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	126.9	-174.1	-55.5	-174.6	0	0	0	111.9	V163 I165 Q166 L199 V200 Y201 L238 P240	V163-L186 HydrophobicContact CG1-CD1 3.6Å; I165-L186 HydrophobicContact CG1-CB 4.22Å; I165-L186 HydrophobicContact CG1-CD1 4.42Å; Q166-L186 WeakPolarHBondContact CB-O 3.41Å; Q166-L186 PolarHBondContact N-O 3.29Å; L186-L199 HydrophobicContact CB-CD1 4.27Å; L186-L199 HydrophobicContact CD1-CD2 4.4Å; L186-V200 WeakPolarHBondContact CA-O 3.04Å; L186-Y201 HydrophobicContact CD2-CD2 4.18Å; L186-L238 HydrophobicContact CD2-CB 3.56Å; L186-P240 HydrophobicContact CD1-CG 3.94Å; L186-P240 HydrophobicContact CG-CB 4.39Å; L186-P240 HydrophobicContact CG-CG 4.06Å
187	Y	98.6	Very high	96.2	Very high	4 Å²	4	59 Å²	59	2%	0.016	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	150.6	179.7	-68.7	-97.2	0	0	0	111.5	Q166 T168 I176 A181 T183 G185 V200 C202 I204	Q166-Y187 HydrophobicContact CB-CD1 3.52Å; Q166-Y187 HydrophobicContact CB-CD2 4.34Å; Q166-Y187 HydrophobicContact CB-CE1 3.24Å; Q166-Y187 HydrophobicContact CB-CE2 4.11Å; Q166-Y187 HydrophobicContact CB-CG 4.07Å; Q166-Y187 HydrophobicContact CG-CD1 4.38Å; Q166-Y187 HydrophobicContact CG-CD2 4.43Å; Q166-Y187 HydrophobicContact CG-CE1 3.85Å; Q166-Y187 HydrophobicContact CG-CE2 3.9Å; T168-Y187 WeakPolarHBondContact O-CD1 3.47Å; I176-Y187 HydrophobicContact CD1-CD1 4.11Å; I176-Y187 HydrophobicContact CD1-CG 4.09Å; I176-Y187 HydrophobicContact CG2-CD1 3.52Å; I176-Y187 HydrophobicContact CG2-CE1 3.51Å; I176-Y187 HydrophobicContact CG2-CG 4.11Å; A181-Y187 HydrophobicContact CB-CE1 4.04Å; T183-Y187 WeakPolarHBondContact O-CE2 3.43Å; T183-Y187 PolarHBondContact O-OH 2.84Å; G185-Y187 WeakPolarHBondContact O-CD2 3.42Å; Y187-V200 PolarHBondContact N-O 3.19Å; Y187-V200 WeakPolarHBondContact O-CG2 3.12Å; Y187-V200 PolarHBondContact O-N 3.31Å; Y187-C202 HydrophobicContact CD2-CB 3.61Å; Y187-C202 HydrophobicContact CE2-CB 4.02Å; Y187-C202 HydrophobicContact CG-CB 4.45Å; Y187-I204 HydrophobicContact CE2-CD1 4.26Å
188	Y	98.6	Very high	96.3	Very high	85 Å²	85	59.6 Å²	59.6	33%	0.333	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	126.9	168.2	-80.1	-74.7	0	0	0	111.1	I165 T169 Q197 F198 L199	I165-Y188 HydrophobicContact CD1-CE2 4.13Å; I165-Y188 HydrophobicContact CG2-CD2 3.89Å; I165-Y188 HydrophobicContact CG2-CE2 3.89Å; T169-Y188 WeakPolarHBondContact CA-O 3.26Å; T169-Y188 WeakPolarHBondContact CB-O 2.91Å; T169-Y188 PolarHBondContact OG1-O 2.93Å; Y188-Q197 HydrophobicContact CD1-CG 3.86Å; Y188-Q197 HydrophobicContact CG-CG 4.4Å; Y188-F198 WeakPolarHBondContact CA-O 3.43Å; Y188-L199 HydrophobicContact CD1-CB 4.36Å; Y188-L199 HydrophobicContact CD1-CD1 4.26Å; Y188-L199 HydrophobicContact CD2-CD1 4.09Å; Y188-L199 HydrophobicContact CE1-CB 4.04Å; Y188-L199 HydrophobicContact CE1-CD1 4.13Å; Y188-L199 HydrophobicContact CE2-CD1 3.96Å; Y188-L199 HydrophobicContact CG-CD1 4.24Å
189	V	98.1	Very high	96.4	Very high	0 Å²	0	57 Å²	57	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	149.4	172	-66.4	0	0	0	0	111.4	G170 I176 Q197 F198 V200	G170-V189 CarbonylContact O-C 3.55Å; G170-V189 VanDerWaalsContact O-CA 3.23Å; G170-V189 WeakPolarHBondContact O-CA 3.36Å; I176-V189 HydrophobicContact CD1-CG1 3.53Å; V189-Q197 CarbonylContact O-C 3.54Å; V189-Q197 VanDerWaalsContact O-CA 3.24Å; V189-Q197 WeakPolarHBondContact O-CA 3.43Å; V189-Q197 WeakPolarHBondContact O-CB 3.19Å; V189-F198 HydrophobicContact CG2-CD2 3.79Å; V189-F198 HydrophobicContact CG2-CE2 3.45Å; V189-F198 VanDerWaalsContact CG2-CE2 3.45Å; V189-F198 HydrophobicContact CG2-CZ 3.93Å; V189-F198 PolarHBondContact N-O 2.7Å; V189-F198 PolarHBondContact O-N 3.28Å; V189-V200 HydrophobicContact CB-CG2 4.32Å; V189-V200 HydrophobicContact CG1-CG2 3.63Å; V189-V200 HydrophobicContact CG2-CB 4.37Å; V189-V200 HydrophobicContact CG2-CG1 3.62Å; V189-V200 HydrophobicContact CG2-CG2 3.78Å
190	K	97.4	Very high	96.4	Very high	100 Å²	100	51.5 Å²	51.5	44%	0.435	31%	0.307	S	S	.	.			trans	-135.2	91.3	171.8	-169.3	-179.4	-179.6	175.6	0	110.3	G170 A194 Q195 Q197	G170-K190 PolarHBondContact O-N 3.43Å; K190-A194 WeakPolarHBondContact CE-O 3.31Å; K190-A194 HydrophobicContact CG-CB 4.49Å; K190-Q195 WeakPolarHBondContact CE-O 3.4Å; K190-Q195 PolarHBondContact NZ-O 2.85Å; K190-Q197 HydrophobicContact CB-CB 3.98Å; K190-Q197 HydrophobicContact CG-CB 4.43Å
191	P	95.8	Very high	96.5	Very high	2 Å²	2	49.5 Å²	49.5	1%	0.013	28%	0.282	C	S	.	.			trans	-56	153.1	171.3	-23.3	33	0	0	0	112	S193 A194 F198 L255 L256 S259	P191-S193 VanDerWaalsContact C-N 3.32Å; P191-S193 PolarHBondContact O-N 3.37Å; P191-A194 HydrophobicContact CB-CB 4.16Å; P191-A194 HydrophobicContact CG-CB 4.34Å; P191-A194 VanDerWaalsContact O-CB 3.28Å; P191-A194 WeakPolarHBondContact O-CB 3.37Å; P191-A194 PolarHBondContact O-N 2.81Å; P191-F198 HydrophobicContact CG-CE1 3.94Å; P191-F198 HydrophobicContact CG-CZ 3.81Å; P191-L255 HydrophobicContact CB-CB 4.38Å; P191-L255 HydrophobicContact CG-CB 4.37Å; P191-L256 HydrophobicContact CG-CD2 3.87Å; P191-L256 HydrophobicContact CG-CG 4.15Å; P191-S259 WeakPolarHBondContact CB-OG 3.31Å
192	A	91	Very high	96.6	Very high	85 Å²	85	49 Å²	49	70%	0.702	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-32.7	-170	0	0	0	0	0	114.7	S259	A192-S259 PolarHBondContact N-OG 2.83Å
193	S	90.2	Very high	96.7	Very high	70 Å²	70	45.8 Å²	45.8	49%	0.49	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-5.2	174.8	61.1	0	0	0	0	113.9	P191 L255 S259	P191-S193 VanDerWaalsContact C-N 3.32Å; P191-S193 PolarHBondContact O-N 3.37Å; S193-L255 VanDerWaalsContact OG-CD2 3.3Å; S193-L255 WeakPolarHBondContact OG-CD2 3.41Å; S193-S259 PolarHBondContact N-OG 3Å; S193-S259 PolarHBondContact OG-OG 3.05Å
194	A	93.9	Very high	96.7	Very high	7 Å²	7	42.6 Å²	42.6	6%	0.058	24%	0.235	C	C	.	.			trans	-77.6	128.4	-176.9	0	0	0	0	0	111.9	K190 P191 L255	K190-A194 WeakPolarHBondContact CE-O 3.31Å; K190-A194 HydrophobicContact CG-CB 4.49Å; P191-A194 HydrophobicContact CB-CB 4.16Å; P191-A194 HydrophobicContact CG-CB 4.34Å; P191-A194 VanDerWaalsContact O-CB 3.28Å; P191-A194 WeakPolarHBondContact O-CB 3.37Å; P191-A194 PolarHBondContact O-N 2.81Å; A194-L255 HydrophobicContact CB-CD1 4.02Å
195	Q	93.1	Very high	96.6	Very high	190 Å²	190	42.4 Å²	42.4	89%	0.888	23%	0.231	S	C	*	.	S	Bend	trans	-65.4	-46.5	177.9	-61	-177	9.3	0	0	111.3	K190	K190-Q195 WeakPolarHBondContact CE-O 3.4Å; K190-Q195 PolarHBondContact NZ-O 2.85Å
196	A	95.9	Very high	96.3	Very high	68 Å²	68	50.4 Å²	50.4	56%	0.562	27%	0.273	S	S	*	.	S	Bend	trans	-116.1	157.4	179.2	0	0	0	0	0	111.7
197	Q	97.5	Very high	96.1	Very high	103 Å²	103	58.1 Å²	58.1	48%	0.481	31%	0.307	S	S	.	.			trans	-77.8	154.2	168	72.9	-177.5	28.9	0	0	110.5	Y188 V189 K190	Y188-Q197 HydrophobicContact CD1-CG 3.86Å; Y188-Q197 HydrophobicContact CG-CG 4.4Å; V189-Q197 CarbonylContact O-C 3.54Å; V189-Q197 VanDerWaalsContact O-CA 3.24Å; V189-Q197 WeakPolarHBondContact O-CA 3.43Å; V189-Q197 WeakPolarHBondContact O-CB 3.19Å; K190-Q197 HydrophobicContact CB-CB 3.98Å; K190-Q197 HydrophobicContact CG-CB 4.43Å
198	F	98.3	Very high	95.8	Very high	24 Å²	24	59 Å²	59	11%	0.105	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	157.8	175.1	53.8	-96.4	0	0	0	111.5	Y188 V189 P191 V200 K252 L256	Y188-F198 WeakPolarHBondContact CA-O 3.43Å; V189-F198 HydrophobicContact CG2-CD2 3.79Å; V189-F198 HydrophobicContact CG2-CE2 3.45Å; V189-F198 VanDerWaalsContact CG2-CE2 3.45Å; V189-F198 HydrophobicContact CG2-CZ 3.93Å; V189-F198 PolarHBondContact N-O 2.7Å; V189-F198 PolarHBondContact O-N 3.28Å; P191-F198 HydrophobicContact CG-CE1 3.94Å; P191-F198 HydrophobicContact CG-CZ 3.81Å; F198-V200 HydrophobicContact CD2-CG1 3.8Å; F198-V200 HydrophobicContact CE2-CG1 3.68Å; F198-K252 HydrophobicContact CB-CD 4.1Å; F198-K252 HydrophobicContact CD1-CD 4.37Å; F198-K252 HydrophobicContact CD1-CG 4.16Å; F198-K252 HydrophobicContact CD2-CB 4.24Å; F198-K252 HydrophobicContact CD2-CD 3.65Å; F198-K252 HydrophobicContact CD2-CG 4.07Å; F198-K252 HydrophobicContact CE1-CB 4.27Å; F198-K252 HydrophobicContact CE1-CG 4.2Å; F198-K252 HydrophobicContact CE2-CB 3.8Å; F198-K252 HydrophobicContact CE2-CD 4.09Å; F198-K252 HydrophobicContact CE2-CG 4.11Å; F198-K252 HydrophobicContact CG-CD 3.8Å; F198-K252 HydrophobicContact CG-CG 4.08Å; F198-K252 HydrophobicContact CZ-CB 3.8Å; F198-K252 HydrophobicContact CZ-CG 4.17Å; F198-L256 HydrophobicContact CE2-CD1 4.14Å; F198-L256 HydrophobicContact CE2-CG 4.44Å; F198-L256 HydrophobicContact CZ-CD1 4.2Å; F198-L256 HydrophobicContact CZ-CD2 4.45Å; F198-L256 HydrophobicContact CZ-CG 4.05Å
199	L	98.4	Very high	95.7	Very high	43 Å²	43	58.4 Å²	58.4	23%	0.225	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	138.3	-179.6	-163.5	70.1	0	0	0	110.1	I165 L186 Y188 L238	I165-L199 HydrophobicContact CD1-CD1 3.95Å; I165-L199 HydrophobicContact CD1-CD2 4.17Å; I165-L199 HydrophobicContact CG1-CD1 4.17Å; I165-L199 HydrophobicContact CG2-CD1 3.74Å; L186-L199 HydrophobicContact CB-CD1 4.27Å; L186-L199 HydrophobicContact CD1-CD2 4.4Å; Y188-L199 HydrophobicContact CD1-CB 4.36Å; Y188-L199 HydrophobicContact CD1-CD1 4.26Å; Y188-L199 HydrophobicContact CD2-CD1 4.09Å; Y188-L199 HydrophobicContact CE1-CB 4.04Å; Y188-L199 HydrophobicContact CE1-CD1 4.13Å; Y188-L199 HydrophobicContact CE2-CD1 3.96Å; Y188-L199 HydrophobicContact CG-CD1 4.24Å; L199-L238 HydrophobicContact CB-CD1 4.15Å; L199-L238 HydrophobicContact CD2-CD1 4.12Å; L199-L238 HydrophobicContact CG-CD1 3.98Å
200	V	98.6	Very high	95.7	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	157.4	173.4	-67.6	0	0	0	0	110.2	L186 Y187 V189 F198 T212 L248	L186-V200 WeakPolarHBondContact CA-O 3.04Å; Y187-V200 PolarHBondContact N-O 3.19Å; Y187-V200 WeakPolarHBondContact O-CG2 3.12Å; Y187-V200 PolarHBondContact O-N 3.31Å; V189-V200 HydrophobicContact CB-CG2 4.32Å; V189-V200 HydrophobicContact CG1-CG2 3.63Å; V189-V200 HydrophobicContact CG2-CB 4.37Å; V189-V200 HydrophobicContact CG2-CG1 3.62Å; V189-V200 HydrophobicContact CG2-CG2 3.78Å; F198-V200 HydrophobicContact CD2-CG1 3.8Å; F198-V200 HydrophobicContact CE2-CG1 3.68Å; V200-T212 HydrophobicContact CB-CG2 4.04Å; V200-T212 HydrophobicContact CG1-CG2 3.92Å; V200-T212 HydrophobicContact CG2-CG2 4.3Å; V200-L248 HydrophobicContact CG1-CD1 3.93Å; V200-L248 HydrophobicContact CG1-CD2 4.06Å
201	Y	98.6	Very high	95.7	Very high	14 Å²	14	54 Å²	54	6%	0.055	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	122	160.8	-179.8	-89.8	0	0	0	109.3	S184 G185 L186 E203 V213 S239 D242	S184-Y201 WeakPolarHBondContact CB-OH 3.39Å; G185-Y201 WeakPolarHBondContact O-CA 3.11Å; L186-Y201 HydrophobicContact CD2-CD2 4.18Å; Y201-E203 HydrophobicContact CE1-CB 4.01Å; Y201-V213 HydrophobicContact CD1-CB 4.06Å; Y201-V213 HydrophobicContact CD1-CG2 3.63Å; Y201-V213 HydrophobicContact CE1-CG2 4.15Å; Y201-V213 PolarHBondContact O-N 3.36Å; Y201-V213 VanDerWaalsContact O-N 3.12Å; Y201-S239 VanDerWaalsContact CD2-O 3.28Å; Y201-S239 WeakPolarHBondContact CD2-O 3.43Å; Y201-D242 HydrophobicContact CE1-CB 4.42Å; Y201-D242 HydrophobicContact CE2-CB 3.95Å; Y201-D242 WeakPolarHBondContact OH-CB 3.28Å
202	C	98.6	Very high	95.8	Very high	0 Å²	0	54 Å²	54	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	126.2	172.6	-63.3	0	0	0	0	110	C173 S184 G185 Y187 I204 F211	C173-C202 VanDerWaalsContact CA-SG 3.55Å; C173-C202 HydrophobicContact CB-CB 3.62Å; C173-C202 WeakPolarHBondContact CB-SG 3.42Å; C173-C202 WeakPolarHBondContact SG-CA 3.34Å; C173-C202 WeakPolarHBondContact SG-CB 3.24Å; C173-C202 CovalentContact SG-SG 2.03Å; C173-C202 PolarHBondContact SG-SG 3.08Å; S184-C202 CarbonylContact C-O 3.6Å; S184-C202 WeakPolarHBondContact CA-O 3.02Å; S184-C202 WeakPolarHBondContact CB-O 3.42Å; G185-C202 PolarHBondContact N-O 3.16Å; G185-C202 PolarHBondContact O-N 3Å; Y187-C202 HydrophobicContact CD2-CB 3.61Å; Y187-C202 HydrophobicContact CE2-CB 4.02Å; Y187-C202 HydrophobicContact CG-CB 4.45Å; C202-I204 HydrophobicContact CB-CG1 4.25Å; C202-F211 WeakPolarHBondContact CA-O 3.35Å
203	E	98.3	Very high	96.2	Very high	46 Å²	46	50 Å²	50	22%	0.215	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	110	167.9	-169.8	-169.1	118.4	0	0	107.8	Y201 F211 V213 K406	Y201-E203 HydrophobicContact CE1-CB 4.01Å; E203-F211 HydrophobicContact CB-CB 4.29Å; E203-F211 PolarHBondContact N-O 2.69Å; E203-F211 PolarHBondContact O-N 2.96Å; E203-V213 HydrophobicContact CB-CG2 4.36Å; E203-K406 IonicContact OE1-NZ 3.97Å; E203-K406 PolarHBondContact OE1-NZ 3.12Å; E203-K406 IonicContact OE2-NZ 3.88Å; E203-K406 PolarHBondContact OE2-NZ 2.99Å
204	I	97.1	Very high	96.6	Very high	11 Å²	11	46.7 Å²	46.7	6%	0.056	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	121.6	-178.3	-54.1	-178.5	0	0	0	108.7	I176 A177 A181 S184 Y187 C202 R209	I176-I204 HydrophobicContact CG2-CD1 4.27Å; A177-I204 HydrophobicContact CB-CD1 4.34Å; A177-I204 HydrophobicContact CB-CG2 4.12Å; A181-I204 HydrophobicContact CB-CD1 3.74Å; S184-I204 PolarHBondContact OG-N 3.01Å; S184-I204 PolarHBondContact OG-O 2.03Å; Y187-I204 HydrophobicContact CE2-CD1 4.26Å; C202-I204 HydrophobicContact CB-CG1 4.25Å; I204-R209 WeakPolarHBondContact CA-O 3.38Å
205	D	94.1	Very high	96.8	Very high	36 Å²	36	46.3 Å²	46.3	19%	0.193	24%	0.236	C	C	.	.			trans	-92.8	169.9	178.1	79.9	5.3	0	0	0	113.8	F207 G208 R209	D205-F207 PolarHBondContact O-N 2.87Å; D205-F207 VanDerWaalsContact OD1-CA 3.31Å; D205-F207 WeakPolarHBondContact OD1-CA 3.49Å; D205-F207 WeakPolarHBondContact OD1-CB 3.46Å; D205-F207 PolarHBondContact OD1-N 3.1Å; D205-G208 PolarHBondContact O-N 3.36Å; D205-G208 PolarHBondContact OD1-N 2.75Å; D205-G208 VanDerWaalsContact OD1-N 3.15Å; D205-R209 PolarHBondContact N-O 2.89Å; D205-R209 VanDerWaalsContact N-O 3.08Å; D205-R209 WeakPolarHBondContact OD1-CB 3.33Å; D205-R209 PolarHBondContact OD1-N 2.88Å; D205-R209 IonicContact OD1-NE 3.93Å; D205-R209 IonicContact OD2-CZ 2.67Å; D205-R209 IonicContact OD2-NE 3.33Å; D205-R209 PolarHBondContact OD2-NE 3.34Å; D205-R209 IonicContact OD2-NH2 3.16Å; D205-R209 PolarHBondContact OD2-NH2 2.96Å
206	N	92.8	Very high	97.1	Very high	168 Å²	168	37.9 Å²	37.9	90%	0.898	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-8.7	178.3	-64.5	-26.2	0	0	0	114.3
207	F	92.6	Very high	97.2	Very high	164 Å²	164	34.9 Å²	34.9	72%	0.719	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.5	6.2	175.5	-52.5	-74.3	0	0	0	112	D205 R209	D205-F207 PolarHBondContact O-N 2.87Å; D205-F207 VanDerWaalsContact OD1-CA 3.31Å; D205-F207 WeakPolarHBondContact OD1-CA 3.49Å; D205-F207 WeakPolarHBondContact OD1-CB 3.46Å; D205-F207 PolarHBondContact OD1-N 3.1Å; F207-R209 VanDerWaalsContact C-N 3.29Å; F207-R209 PolarHBondContact O-N 3.29Å
208	G	93.8	Very high	97.1	Very high	23 Å²	23	33.6 Å²	33.6	24%	0.237	16%	0.161	C	C	.	.			trans	69.7	23.9	-177.9	0	0	0	0	0	113.1	Q174 D205 R412	Q174-G208 PolarHBondContact NE2-O 3.08Å; D205-G208 PolarHBondContact O-N 3.36Å; D205-G208 PolarHBondContact OD1-N 2.75Å; D205-G208 VanDerWaalsContact OD1-N 3.15Å; G208-R412 PolarHBondContact O-NH2 2.77Å
209	R	95.9	Very high	97	Very high	73 Å²	73	36.5 Å²	36.5	28%	0.275	18%	0.178	S	C	.	.			trans	-84	116.8	170.3	-64.2	-176.9	-62.3	-177.4	3.5	108.3	I204 D205 F207 F211 I408 R412	I204-R209 WeakPolarHBondContact CA-O 3.38Å; D205-R209 PolarHBondContact N-O 2.89Å; D205-R209 VanDerWaalsContact N-O 3.08Å; D205-R209 WeakPolarHBondContact OD1-CB 3.33Å; D205-R209 PolarHBondContact OD1-N 2.88Å; D205-R209 IonicContact OD1-NE 3.93Å; D205-R209 IonicContact OD2-CZ 2.67Å; D205-R209 IonicContact OD2-NE 3.33Å; D205-R209 PolarHBondContact OD2-NE 3.34Å; D205-R209 IonicContact OD2-NH2 3.16Å; D205-R209 PolarHBondContact OD2-NH2 2.96Å; F207-R209 VanDerWaalsContact C-N 3.29Å; F207-R209 PolarHBondContact O-N 3.29Å; R209-F211 HydrophobicContact CB-CE2 4.09Å; R209-I408 HydrophobicContact CB-CD1 3.75Å; R209-I408 HydrophobicContact CG-CD1 4.31Å; R209-R412 WeakPolarHBondContact CD-O 3.47Å
210	G	97.3	Very high	97	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	97.3	-179.6	0	0	0	0	0	110.6	C173 Q174	C173-G210 CarbonylContact C-O 3.52Å; Q174-G210 PolarHBondContact N-O 3.33Å
211	F	98.2	Very high	96.9	Very high	6 Å²	6	39.7 Å²	39.7	3%	0.026	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	136.7	174.1	-68.6	-96.2	0	0	0	110.2	C202 E203 R209 R267 K406 I407 I408	C202-F211 WeakPolarHBondContact CA-O 3.35Å; E203-F211 HydrophobicContact CB-CB 4.29Å; E203-F211 PolarHBondContact N-O 2.69Å; E203-F211 PolarHBondContact O-N 2.96Å; R209-F211 HydrophobicContact CB-CE2 4.09Å; F211-R267 HydrophobicContact CE1-CB 4.42Å; F211-K406 HydrophobicContact CB-CB 4.2Å; F211-K406 HydrophobicContact CB-CD 3.89Å; F211-K406 HydrophobicContact CB-CG 4.16Å; F211-K406 HydrophobicContact CD1-CB 4.46Å; F211-K406 HydrophobicContact CD1-CD 4.01Å; F211-K406 HydrophobicContact CD1-CG 3.82Å; F211-K406 HydrophobicContact CG-CD 4Å; F211-K406 HydrophobicContact CG-CG 4.25Å; F211-I407 WeakPolarHBondContact CA-O 3.45Å; F211-I408 HydrophobicContact CD1-CB 3.71Å; F211-I408 HydrophobicContact CD1-CD1 4.23Å; F211-I408 HydrophobicContact CD1-CG2 3.88Å; F211-I408 HydrophobicContact CD2-CD1 4.13Å; F211-I408 HydrophobicContact CE1-CB 3.86Å; F211-I408 HydrophobicContact CE1-CD1 4.08Å; F211-I408 HydrophobicContact CE1-CG2 3.51Å; F211-I408 HydrophobicContact CE2-CD1 3.96Å; F211-I408 HydrophobicContact CG-CB 4.32Å; F211-I408 HydrophobicContact CG-CD1 4.26Å; F211-I408 HydrophobicContact CZ-CD1 3.93Å; F211-I408 HydrophobicContact CZ-CG2 4.21Å
212	T	98.4	Very high	96.9	Very high	4 Å²	4	39.6 Å²	39.6	3%	0.025	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	115.5	169.5	-46.8	0	0	0	0	108.1	C173 V200 L256 K406 I407	C173-T212 WeakPolarHBondContact CB-OG1 3.44Å; C173-T212 PolarHBondContact N-OG1 2.92Å; C173-T212 PolarHBondContact SG-OG1 2.92Å; C173-T212 VanDerWaalsContact SG-OG1 3.32Å; V200-T212 HydrophobicContact CB-CG2 4.04Å; V200-T212 HydrophobicContact CG1-CG2 3.92Å; V200-T212 HydrophobicContact CG2-CG2 4.3Å; T212-L256 HydrophobicContact CG2-CD1 3.93Å; T212-K406 CarbonylContact O-C 3.44Å; T212-K406 VanDerWaalsContact O-CA 3.29Å; T212-K406 WeakPolarHBondContact O-CA 3.49Å; T212-I407 PolarHBondContact N-O 2.94Å; T212-I407 PolarHBondContact O-N 3.33Å
213	V	98.8	Very high	96.8	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	127.2	179.3	-177.2	0	0	0	0	109.3	Y201 E203 Q215 F246 T404 K406	Y201-V213 HydrophobicContact CD1-CB 4.06Å; Y201-V213 HydrophobicContact CD1-CG2 3.63Å; Y201-V213 HydrophobicContact CE1-CG2 4.15Å; Y201-V213 PolarHBondContact O-N 3.36Å; Y201-V213 VanDerWaalsContact O-N 3.12Å; E203-V213 HydrophobicContact CB-CG2 4.36Å; V213-Q215 WeakPolarHBondContact CG1-O 3.35Å; V213-F246 HydrophobicContact CB-CZ 4.01Å; V213-F246 HydrophobicContact CG1-CE1 4.38Å; V213-F246 HydrophobicContact CG1-CE2 4.27Å; V213-F246 HydrophobicContact CG1-CZ 3.59Å; V213-T404 HydrophobicContact CG1-CG2 3.93Å; V213-T404 HydrophobicContact CG2-CG2 4.46Å; V213-K406 HydrophobicContact CB-CB 4.37Å; V213-K406 HydrophobicContact CG2-CB 3.94Å; V213-K406 HydrophobicContact CG2-CD 4.38Å
214	I	98.8	Very high	96.9	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	-21.4	-175.3	66.5	169.6	0	0	0	113.2	L248 I253 L266 F285 M405 I407	I214-L248 HydrophobicContact CB-CB 4.38Å; I214-L248 HydrophobicContact CB-CD2 4.37Å; I214-L248 HydrophobicContact CG2-CD2 3.95Å; I214-L248 VanDerWaalsContact O-CB 3.25Å; I214-L248 WeakPolarHBondContact O-CB 3.49Å; I214-L248 PolarHBondContact O-N 3.32Å; I214-I253 HydrophobicContact CB-CD1 3.96Å; I214-I253 HydrophobicContact CB-CG1 3.91Å; I214-I253 HydrophobicContact CD1-CD1 4.21Å; I214-I253 HydrophobicContact CD1-CG1 4.43Å; I214-I253 HydrophobicContact CD1-CG2 4.01Å; I214-I253 HydrophobicContact CG1-CD1 4.5Å; I214-I253 HydrophobicContact CG2-CG1 4.02Å; I214-L266 HydrophobicContact CD1-CD1 4.24Å; I214-F285 HydrophobicContact CD1-CE1 4.17Å; I214-F285 HydrophobicContact CD1-CZ 4.13Å; I214-M405 HydrophobicContact CD1-CB 4.12Å; I214-M405 HydrophobicContact CD1-CE 4.49Å; I214-M405 HydrophobicContact CG1-CB 3.63Å; I214-M405 WeakPolarHBondContact CG1-O 3.49Å; I214-M405 PolarHBondContact N-O 3.48Å; I214-I407 HydrophobicContact CD1-CG2 4.08Å; I214-I407 HydrophobicContact CG2-CD1 4.03Å; I214-I407 HydrophobicContact CG2-CG1 4.02Å; I214-I407 HydrophobicContact CG2-CG2 4.47Å
215	Q	98.8	Very high	96.9	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	145.1	173.6	-175.8	-97.2	39.3	0	0	109.8	V213 F224 F246 W247 L364 N365 T403 M405	V213-Q215 WeakPolarHBondContact CG1-O 3.35Å; Q215-F224 HydrophobicContact CG-CE1 4.31Å; Q215-F246 WeakPolarHBondContact CA-O 3.32Å; Q215-W247 HydrophobicContact CB-CE3 3.65Å; Q215-W247 HydrophobicContact CB-CZ3 3.7Å; Q215-W247 HydrophobicContact CG-CE3 3.54Å; Q215-W247 HydrophobicContact CG-CZ3 3.76Å; Q215-L364 PolarHBondContact NE2-O 3.23Å; Q215-N365 PolarHBondContact NE2-OD1 3.44Å; Q215-T403 PolarHBondContact NE2-OG1 3.22Å; Q215-T403 PolarHBondContact OE1-OG1 2.73Å; Q215-M405 HydrophobicContact CB-CB 3.88Å; Q215-M405 HydrophobicContact CB-CG 3.93Å; Q215-M405 HydrophobicContact CB-SD 3.99Å; Q215-M405 HydrophobicContact CG-SD 4.4Å; Q215-M405 PolarHBondContact N-O 2.9Å; Q215-M405 PolarHBondContact O-N 3.43Å
216	R	98.5	Very high	97.1	Very high	13 Å²	13	46.5 Å²	46.5	5%	0.049	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	131.5	173.2	-170.5	66.8	66.9	134.9	12.7	111.4	R218 D242 T244 E245 F246 T404	R216-R218 HydrophobicContact CG-CG 3.93Å; R216-D242 VanDerWaalsContact CZ-CG 3.41Å; R216-D242 IonicContact CZ-OD1 3.14Å; R216-D242 IonicContact CZ-OD2 3.14Å; R216-D242 IonicContact NE-OD1 3.8Å; R216-D242 PolarHBondContact NE-OD1 3.1Å; R216-D242 IonicContact NH1-OD1 3.86Å; R216-D242 IonicContact NH1-OD2 3.33Å; R216-D242 PolarHBondContact NH1-OD2 2.94Å; R216-D242 IonicContact NH2-OD1 3.59Å; R216-D242 PolarHBondContact NH2-OD1 2.9Å; R216-D242 IonicContact NH2-OD2 2.69Å; R216-D242 PolarHBondContact NH2-OD2 3.36Å; R216-T244 VanDerWaalsContact CG-O 3.3Å; R216-T244 WeakPolarHBondContact CG-O 3.35Å; R216-E245 VanDerWaalsContact O-CA 3.32Å; R216-E245 WeakPolarHBondContact O-CA 3.49Å; R216-E245 WeakPolarHBondContact O-CB 3.43Å; R216-F246 HydrophobicContact CB-CD1 3.73Å; R216-F246 HydrophobicContact CB-CE1 3.56Å; R216-F246 HydrophobicContact CB-CG 4.5Å; R216-F246 HydrophobicContact CB-CZ 4.21Å; R216-F246 HydrophobicContact CG-CE1 4.39Å; R216-F246 PolarHBondContact N-O 2.82Å; R216-F246 PolarHBondContact O-N 2.89Å; R216-F246 VanDerWaalsContact O-N 3.14Å; R216-T404 WeakPolarHBondContact CD-OG1 3.36Å; R216-T404 PolarHBondContact NE-OG1 3.25Å; R216-T404 PolarHBondContact NH1-OG1 2.94Å
217	R	98.4	Very high	97.4	Very high	4 Å²	4	40.7 Å²	40.7	2%	0.015	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	136.2	167	-49.6	-64.1	-64.6	-80.1	12.2	109.5	F224 E245 L364 G366 I388 E402 T403	R217-F224 VanDerWaalsContact NE-CE2 3.26Å; R217-E245 WeakPolarHBondContact CA-OE1 3.47Å; R217-E245 IonicContact NE-OE1 3.47Å; R217-E245 IonicContact NE-OE2 3.52Å; R217-L364 PolarHBondContact NH1-O 2.77Å; R217-G366 PolarHBondContact NH1-O 3.37Å; R217-G366 PolarHBondContact NH2-O 3.02Å; R217-I388 HydrophobicContact CB-CD1 4.18Å; R217-I388 HydrophobicContact CG-CD1 4.24Å; R217-E402 CarbonylContact O-C 3.55Å; R217-E402 WeakPolarHBondContact O-CA 3.45Å; R217-T403 WeakPolarHBondContact CB-OG1 3.15Å; R217-T403 WeakPolarHBondContact CG-OG1 3.28Å; R217-T403 PolarHBondContact N-O 2.81Å; R217-T403 PolarHBondContact O-N 3.23Å
218	R	95.9	Very high	97.7	Very high	77 Å²	77	33.4 Å²	33.4	29%	0.291	18%	0.176	S	C	.	.	S	Bend	trans	-152.3	-23.6	-178.9	-50.5	-166.3	76.2	-160.6	-9	115.5	R216 D242 E245 Y368 E402	R216-R218 HydrophobicContact CG-CG 3.93Å; R218-D242 PolarHBondContact NH1-O 2.78Å; R218-E245 PolarHBondContact N-OE1 2.94Å; R218-Y368 PolarHBondContact O-OH 2.98Å; R218-E402 HydrophobicContact CB-CG 4.39Å; R218-E402 IonicContact CZ-OE2 2.74Å; R218-E402 VanDerWaalsContact CZ-OE2 3.25Å; R218-E402 IonicContact NE-OE2 2.75Å; R218-E402 PolarHBondContact NE-OE2 2.96Å; R218-E402 IonicContact NH2-OE1 3.56Å; R218-E402 IonicContact NH2-OE2 2.7Å; R218-E402 PolarHBondContact NH2-OE2 3.24Å
219	D	96	Very high	97.9	Very high	84 Å²	84	37 Å²	37	45%	0.449	19%	0.189	S	C	.	.	S	Bend	trans	-147.7	-11.5	-168.4	72.3	-10	0	0	0	115.4	S221 E245	D219-S221 VanDerWaalsContact C-N 3.32Å; D219-S221 VanDerWaalsContact CG-OG 3.32Å; D219-S221 WeakPolarHBondContact OD1-CB 3.5Å; D219-S221 PolarHBondContact OD1-N 3.2Å; D219-S221 PolarHBondContact OD1-OG 3.36Å; D219-S221 WeakPolarHBondContact OD2-CB 3.44Å; D219-S221 PolarHBondContact OD2-OG 2.95Å; D219-E245 PolarHBondContact N-OE1 2.97Å; D219-E245 VanDerWaalsContact OD1-CD 3.3Å; D219-E245 WeakPolarHBondContact OD1-CG 3.29Å
220	G	96.8	Very high	98.1	Very high	34 Å²	34	36.7 Å²	36.7	35%	0.351	19%	0.19	S	C	.	.	S	Bend	trans	75.4	15.7	-176.1	0	0	0	0	0	114.6	V222 E245	G220-V222 VanDerWaalsContact C-N 3.3Å; G220-V222 PolarHBondContact O-N 2.84Å; G220-E245 VanDerWaalsContact N-CD 3.35Å; G220-E245 PolarHBondContact N-OE1 2.83Å
221	S	97.5	Very high	98.2	Very high	76 Å²	76	36.7 Å²	36.7	53%	0.531	19%	0.19	S	C	.	.			trans	-69.1	-24.7	179.7	58.8	0	0	0	0	113.8	D219 E245	D219-S221 VanDerWaalsContact C-N 3.32Å; D219-S221 VanDerWaalsContact CG-OG 3.32Å; D219-S221 WeakPolarHBondContact OD1-CB 3.5Å; D219-S221 PolarHBondContact OD1-N 3.2Å; D219-S221 PolarHBondContact OD1-OG 3.36Å; D219-S221 WeakPolarHBondContact OD2-CB 3.44Å; D219-S221 PolarHBondContact OD2-OG 2.95Å; S221-E245 PolarHBondContact N-OE2 2.87Å
222	V	98.2	Very high	98.2	Very high	13 Å²	13	39.2 Å²	39.2	8%	0.079	20%	0.2	C	C	.	.	S	Bend	trans	-107.8	127.9	179.3	175.3	0	0	0	0	109.7	G220 F224 F235 E245	G220-V222 VanDerWaalsContact C-N 3.3Å; G220-V222 PolarHBondContact O-N 2.84Å; V222-F224 HydrophobicContact CB-CD2 4.49Å; V222-F224 HydrophobicContact CB-CE2 4.07Å; V222-F224 HydrophobicContact CG1-CD2 4.17Å; V222-F224 HydrophobicContact CG1-CE2 3.89Å; V222-F224 WeakPolarHBondContact O-CD2 3.28Å; V222-F235 HydrophobicContact CG1-CD2 3.79Å; V222-F235 HydrophobicContact CG1-CE2 4.05Å; V222-E245 HydrophobicContact CB-CB 3.83Å; V222-E245 HydrophobicContact CG2-CB 3.83Å; V222-E245 WeakPolarHBondContact CG2-O 3.31Å; V222-E245 PolarHBondContact N-OE2 2.81Å
223	D	97.9	Very high	98.2	Very high	87 Å²	87	43.6 Å²	43.6	47%	0.465	22%	0.22	S	C	.	.			trans	-73.7	127.3	169.9	174.3	25.8	0	0	0	110.5	F225 R226	D223-F225 WeakPolarHBondContact OD1-CB 3.49Å; D223-F225 PolarHBondContact OD1-N 3.32Å; D223-R226 PolarHBondContact O-NE 3.12Å; D223-R226 PolarHBondContact O-NH2 3.49Å; D223-R226 VanDerWaalsContact O-NH2 3.14Å
224	F	98.5	Very high	98.2	Very high	4 Å²	4	44.7 Å²	44.7	2%	0.018	23%	0.231	C	C	.	.			trans	-101.2	-0.6	178.9	-84.3	-110.2	0	0	0	112.7	Q215 R217 V222 R226 Y231 F235 E245 W247 N365	Q215-F224 HydrophobicContact CG-CE1 4.31Å; R217-F224 VanDerWaalsContact NE-CE2 3.26Å; V222-F224 HydrophobicContact CB-CD2 4.49Å; V222-F224 HydrophobicContact CB-CE2 4.07Å; V222-F224 HydrophobicContact CG1-CD2 4.17Å; V222-F224 HydrophobicContact CG1-CE2 3.89Å; V222-F224 WeakPolarHBondContact O-CD2 3.28Å; F224-R226 VanDerWaalsContact C-N 3.35Å; F224-R226 PolarHBondContact O-N 2.9Å; F224-Y231 WeakPolarHBondContact O-CE2 3.26Å; F224-Y231 PolarHBondContact O-OH 3.04Å; F224-F235 HydrophobicContact CB-CE2 4.47Å; F224-F235 HydrophobicContact CB-CZ 4.45Å; F224-F235 AromaticContact CD1-CE2 3.73Å; F224-F235 HydrophobicContact CD1-CE2 3.73Å; F224-F235 AromaticContact CD1-CZ 3.61Å; F224-F235 HydrophobicContact CD1-CZ 3.61Å; F224-F235 AromaticContact CD2-CE2 3.97Å; F224-F235 HydrophobicContact CD2-CE2 3.97Å; F224-F235 AromaticContact CE1-CE2 3.81Å; F224-F235 HydrophobicContact CE1-CE2 3.81Å; F224-F235 AromaticContact CE1-CZ 3.89Å; F224-F235 HydrophobicContact CE1-CZ 3.89Å; F224-F235 HydrophobicContact CE2-CE2 4.03Å; F224-F235 AromaticContact CG-CE2 3.8Å; F224-F235 HydrophobicContact CG-CE2 3.8Å; F224-F235 AromaticContact CG-CZ 3.99Å; F224-F235 HydrophobicContact CG-CZ 3.99Å; F224-F235 AromaticContact CZ-CE2 3.95Å; F224-F235 HydrophobicContact CZ-CE2 3.95Å; F224-F235 HydrophobicContact CZ-CZ 4.49Å; F224-E245 HydrophobicContact CE2-CB 4.38Å; F224-W247 HydrophobicContact CE1-CB 4.19Å; F224-N365 VanDerWaalsContact CB-O 3.31Å; F224-N365 WeakPolarHBondContact CB-O 3.36Å; F224-N365 HydrophobicContact CD1-CB 3.93Å
225	F	98	Very high	98.2	Very high	79 Å²	79	45.9 Å²	45.9	35%	0.346	24%	0.237	S	C	.	.			trans	-77	87	168.5	-173.7	-134.2	0	0	0	109.9	D223 H335 G351	D223-F225 WeakPolarHBondContact OD1-CB 3.49Å; D223-F225 PolarHBondContact OD1-N 3.32Å; F225-H335 HydrophobicContact CE2-CB 3.67Å; F225-H335 AromaticContact CE2-CG 3.75Å; F225-H335 HydrophobicContact CZ-CB 4.16Å; F225-H335 AromaticContact CZ-CD2 3.99Å; F225-H335 AromaticContact CZ-CG 3.97Å; F225-G351 WeakPolarHBondContact CA-O 3.3Å; F225-G351 WeakPolarHBondContact CB-O 3.38Å
226	R	98.6	Very high	98.1	Very high	67 Å²	67	47.4 Å²	47.4	25%	0.253	25%	0.252	S	S	.	.			trans	-126.7	157.1	-169.8	-59.7	-65.3	178.8	-172.5	-1.7	112.2	D223 F224 Q230 Y231 F235 H335	D223-R226 PolarHBondContact O-NE 3.12Å; D223-R226 PolarHBondContact O-NH2 3.49Å; D223-R226 VanDerWaalsContact O-NH2 3.14Å; F224-R226 VanDerWaalsContact C-N 3.35Å; F224-R226 PolarHBondContact O-N 2.9Å; R226-Q230 HydrophobicContact CB-CB 3.83Å; R226-Q230 VanDerWaalsContact CB-OE1 3.28Å; R226-Q230 HydrophobicContact CG-CB 4.46Å; R226-Y231 HydrophobicContact CB-CD2 3.7Å; R226-Y231 HydrophobicContact CB-CE2 3.56Å; R226-Y231 HydrophobicContact CG-CE2 4.37Å; R226-F235 HydrophobicContact CB-CD1 4.26Å; R226-F235 HydrophobicContact CB-CE1 3.94Å; R226-F235 HydrophobicContact CB-CZ 4.37Å; R226-F235 HydrophobicContact CG-CD1 3.87Å; R226-F235 HydrophobicContact CG-CD2 4.18Å; R226-F235 HydrophobicContact CG-CE1 3.68Å; R226-F235 HydrophobicContact CG-CE2 4.02Å; R226-F235 HydrophobicContact CG-CG 4.12Å; R226-F235 HydrophobicContact CG-CZ 3.77Å; R226-H335 PolarHBondContact O-ND1 2.85Å
227	D	98.8	Very high	98.1	Very high	46 Å²	46	55 Å²	55	25%	0.246	28%	0.282	C	S	.	.			trans	-77.5	171.5	176.3	69.5	55.2	0	0	0	112.8	I229 Q230 Y231 D336	D227-I229 VanDerWaalsContact C-N 3.29Å; D227-I229 PolarHBondContact O-N 2.89Å; D227-I229 WeakPolarHBondContact OD1-CA 3.41Å; D227-I229 WeakPolarHBondContact OD1-CB 3.3Å; D227-I229 PolarHBondContact OD1-N 3.31Å; D227-Q230 VanDerWaalsContact N-OE1 3.07Å; D227-Q230 PolarHBondContact O-N 2.74Å; D227-Q230 WeakPolarHBondContact OD1-CG 3.48Å; D227-Q230 PolarHBondContact OD1-N 2.7Å; D227-Q230 WeakPolarHBondContact OD2-CG 3.45Å; D227-Q230 PolarHBondContact OD2-NE2 2.96Å; D227-Q230 PolarHBondContact OD2-OE1 2.84Å; D227-Y231 PolarHBondContact O-N 3.2Å; D227-D336 WeakPolarHBondContact CA-OD1 3.09Å
228	W	98.8	Very high	98	Very high	12 Å²	12	56.8 Å²	56.8	5%	0.045	29%	0.292	C	S	.	.	H	α-helix	trans	-57.3	-41	-179.7	-179.6	-99.4	0	0	0	113	Y231 R232 E290 M293 Y294 F332 T334 D336 K337	W228-Y231 PolarHBondContact O-N 3.39Å; W228-R232 WeakPolarHBondContact O-CB 3.44Å; W228-R232 PolarHBondContact O-N 3.42Å; W228-E290 HydrophobicContact CZ2-CG 4.21Å; W228-E290 PolarHBondContact NE1-OE1 3.23Å; W228-M293 HydrophobicContact CH2-CB 4.01Å; W228-M293 HydrophobicContact CH2-SD 4.27Å; W228-M293 HydrophobicContact CZ2-SD 4.24Å; W228-Y294 AromaticContact CH2-CD2 3.76Å; W228-Y294 HydrophobicContact CH2-CD2 3.76Å; W228-Y294 HydrophobicContact CH2-CE2 4.47Å; W228-Y294 AromaticContact CZ2-CD2 3.5Å; W228-Y294 HydrophobicContact CZ2-CD2 3.5Å; W228-Y294 AromaticContact CZ2-CE2 3.77Å; W228-Y294 HydrophobicContact CZ2-CE2 3.77Å; W228-F332 HydrophobicContact CE3-CD1 4.48Å; W228-F332 HydrophobicContact CH2-CB 4.34Å; W228-F332 HydrophobicContact CZ3-CB 4.13Å; W228-F332 HydrophobicContact CZ3-CD1 4.02Å; W228-F332 WeakPolarHBondContact CZ3-O 3.36Å; W228-T334 WeakPolarHBondContact CA-OG1 3.09Å; W228-T334 HydrophobicContact CE3-CG2 4.2Å; W228-T334 PolarHBondContact N-OG1 2.86Å; W228-D336 VanDerWaalsContact CB-OD2 3.28Å; W228-D336 WeakPolarHBondContact CB-OD2 3.44Å; W228-D336 VanDerWaalsContact N-CG 3.34Å; W228-D336 PolarHBondContact N-OD1 3.12Å; W228-D336 PolarHBondContact N-OD2 2.86Å; W228-K337 HydrophobicContact CB-CB 4.16Å; W228-K337 HydrophobicContact CB-CD 4.38Å; W228-K337 HydrophobicContact CD2-CB 4.21Å; W228-K337 HydrophobicContact CD2-CD 3.29Å; W228-K337 HydrophobicContact CD2-CG 4.38Å; W228-K337 HydrophobicContact CE3-CB 3.95Å; W228-K337 HydrophobicContact CE3-CD 3.5Å; W228-K337 VanDerWaalsContact CE3-CD 3.5Å; W228-K337 HydrophobicContact CE3-CG 4.26Å; W228-K337 HydrophobicContact CG-CB 4.3Å; W228-K337 HydrophobicContact CG-CD 3.68Å; W228-K337 HydrophobicContact CH2-CD 4.1Å; W228-K337 HydrophobicContact CZ2-CD 3.96Å; W228-K337 HydrophobicContact CZ3-CD 3.89Å
229	I	98.8	Very high	98	Very high	97 Å²	97	53.7 Å²	53.7	50%	0.497	28%	0.282	S	S	.	.	H	α-helix	trans	-72.3	-41.2	-176.1	-58.9	177.3	0	0	0	109.4	D227 R232 E233	D227-I229 VanDerWaalsContact C-N 3.29Å; D227-I229 PolarHBondContact O-N 2.89Å; D227-I229 WeakPolarHBondContact OD1-CA 3.41Å; D227-I229 WeakPolarHBondContact OD1-CB 3.3Å; D227-I229 PolarHBondContact OD1-N 3.31Å; I229-R232 WeakPolarHBondContact O-CB 3.41Å; I229-R232 PolarHBondContact O-N 2.78Å; I229-E233 HydrophobicContact CG2-CG 4.16Å; I229-E233 WeakPolarHBondContact O-CG 3.39Å; I229-E233 PolarHBondContact O-N 2.69Å
230	Q	98.8	Very high	97.8	Very high	67 Å²	67	51.4 Å²	51.4	31%	0.313	27%	0.272	S	S	.	.	H	α-helix	trans	-61.2	-45.3	173.7	-71.3	171.7	-18	0	0	111.4	R226 D227 R232 G234 F235	R226-Q230 HydrophobicContact CB-CB 3.83Å; R226-Q230 VanDerWaalsContact CB-OE1 3.28Å; R226-Q230 HydrophobicContact CG-CB 4.46Å; D227-Q230 VanDerWaalsContact N-OE1 3.07Å; D227-Q230 PolarHBondContact O-N 2.74Å; D227-Q230 WeakPolarHBondContact OD1-CG 3.48Å; D227-Q230 PolarHBondContact OD1-N 2.7Å; D227-Q230 WeakPolarHBondContact OD2-CG 3.45Å; D227-Q230 PolarHBondContact OD2-NE2 2.96Å; D227-Q230 PolarHBondContact OD2-OE1 2.84Å; Q230-R232 VanDerWaalsContact C-N 3.31Å; Q230-R232 PolarHBondContact O-N 3.35Å; Q230-G234 CarbonylContact O-C 3.6Å; Q230-G234 WeakPolarHBondContact O-CA 3.24Å; Q230-G234 PolarHBondContact O-N 3.01Å; Q230-F235 HydrophobicContact CB-CD1 4.36Å
231	Y	98.9	Very high	97.6	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-66.3	-31.4	173.7	-92.7	-73.5	0	0	0	113.4	F224 R226 D227 W228 F235 W247 G249 N250 F332 T334 G353 N365	F224-Y231 WeakPolarHBondContact O-CE2 3.26Å; F224-Y231 PolarHBondContact O-OH 3.04Å; R226-Y231 HydrophobicContact CB-CD2 3.7Å; R226-Y231 HydrophobicContact CB-CE2 3.56Å; R226-Y231 HydrophobicContact CG-CE2 4.37Å; D227-Y231 PolarHBondContact O-N 3.2Å; W228-Y231 PolarHBondContact O-N 3.39Å; Y231-F235 AromaticContact CD1-CE1 3.7Å; Y231-F235 HydrophobicContact CD1-CE1 3.7Å; Y231-F235 HydrophobicContact CD1-CZ 4.28Å; Y231-F235 HydrophobicContact CD2-CE1 4.12Å; Y231-F235 AromaticContact CE1-CE1 3.57Å; Y231-F235 HydrophobicContact CE1-CE1 3.57Å; Y231-F235 AromaticContact CE1-CZ 3.67Å; Y231-F235 HydrophobicContact CE1-CZ 3.67Å; Y231-F235 HydrophobicContact CE2-CE1 4.01Å; Y231-F235 HydrophobicContact CE2-CZ 4.23Å; Y231-F235 AromaticContact CG-CE1 3.97Å; Y231-F235 HydrophobicContact CG-CE1 3.97Å; Y231-F235 AromaticContact CZ-CE1 3.73Å; Y231-F235 AromaticContact CZ-CZ 3.63Å; Y231-W247 AromaticContact CD1-CD1 3.66Å; Y231-W247 HydrophobicContact CD1-CD2 4.21Å; Y231-W247 HydrophobicContact CD1-CG 4.04Å; Y231-W247 AromaticContact CD1-NE1 3.65Å; Y231-W247 HydrophobicContact CE1-CD2 4.18Å; Y231-W247 HydrophobicContact CE1-CG 4.12Å; Y231-W247 PolarHBondContact O-NE1 2.58Å; Y231-W247 VanDerWaalsContact O-NE1 3.15Å; Y231-G249 CarbonylContact O-C 3.59Å; Y231-G249 WeakPolarHBondContact O-CA 3.29Å; Y231-N250 VanDerWaalsContact O-CG 3.25Å; Y231-N250 PolarHBondContact O-N 2.71Å; Y231-N250 PolarHBondContact O-OD1 3.47Å; Y231-F332 AromaticContact CD1-CE1 3.67Å; Y231-F332 HydrophobicContact CD1-CE1 3.67Å; Y231-F332 AromaticContact CD1-CZ 3.41Å; Y231-F332 HydrophobicContact CD1-CZ 3.41Å; Y231-F332 VanDerWaalsContact CD1-CZ 3.41Å; Y231-F332 HydrophobicContact CD2-CE1 4.23Å; Y231-F332 HydrophobicContact CE1-CE1 4.38Å; Y231-F332 AromaticContact CE1-CZ 3.85Å; Y231-F332 HydrophobicContact CE1-CZ 3.85Å; Y231-F332 AromaticContact CG-CE1 3.59Å; Y231-F332 HydrophobicContact CG-CE1 3.59Å; Y231-F332 AromaticContact CG-CZ 3.86Å; Y231-F332 HydrophobicContact CG-CZ 3.86Å; Y231-T334 HydrophobicContact CD2-CG2 3.59Å; Y231-T334 HydrophobicContact CE2-CG2 4.38Å; Y231-T334 HydrophobicContact CG-CG2 4.1Å; Y231-G353 VanDerWaalsContact CZ-CA 3.47Å; Y231-G353 PolarHBondContact OH-N 3.08Å; Y231-G353 VanDerWaalsContact OH-N 3.13Å; Y231-N365 WeakPolarHBondContact CE1-ND2 3.33Å
232	R	98.7	Very high	97.4	Very high	60 Å²	60	52 Å²	52	23%	0.226	26%	0.261	C	S	.	.	H	α-helix	trans	-66.7	-54.2	174.2	-174.4	179.5	78	-161	0.3	112.7	W228 I229 Q230 G249 N250 E251 E290 Y294	W228-R232 WeakPolarHBondContact O-CB 3.44Å; W228-R232 PolarHBondContact O-N 3.42Å; I229-R232 WeakPolarHBondContact O-CB 3.41Å; I229-R232 PolarHBondContact O-N 2.78Å; Q230-R232 VanDerWaalsContact C-N 3.31Å; Q230-R232 PolarHBondContact O-N 3.35Å; R232-G249 CarbonylContact O-C 3.51Å; R232-G249 VanDerWaalsContact O-C 3.23Å; R232-G249 VanDerWaalsContact O-CA 3.27Å; R232-G249 WeakPolarHBondContact O-CA 3.4Å; R232-N250 PolarHBondContact O-N 2.75Å; R232-E251 HydrophobicContact CG-CB 4.05Å; R232-E251 PolarHBondContact O-N 2.96Å; R232-E290 WeakPolarHBondContact CD-OE1 3.35Å; R232-E290 WeakPolarHBondContact CD-OE2 3.26Å; R232-E290 IonicContact NH1-OE1 3.15Å; R232-E290 PolarHBondContact NH1-OE1 2.83Å; R232-E290 VanDerWaalsContact NH1-OE1 3.14Å; R232-E290 IonicContact NH1-OE2 2.69Å; R232-E290 PolarHBondContact NH1-OE2 3.01Å; R232-Y294 HydrophobicContact CB-CE2 4.34Å; R232-Y294 WeakPolarHBondContact CD-OH 3.39Å; R232-Y294 HydrophobicContact CG-CE2 3.9Å; R232-Y294 VanDerWaalsContact CG-OH 3.26Å; R232-Y294 WeakPolarHBondContact CG-OH 3.38Å
233	E	98.6	Very high	97.3	Very high	95 Å²	95	54.8 Å²	54.8	44%	0.444	28%	0.278	S	S	.	.	H	α-helix	trans	-80	-23.5	-174.4	-58.8	-55.3	152.3	0	0	113	I229 K252	I229-E233 HydrophobicContact CG2-CG 4.16Å; I229-E233 WeakPolarHBondContact O-CG 3.39Å; I229-E233 PolarHBondContact O-N 2.69Å; E233-K252 WeakPolarHBondContact O-CE 3.26Å; E233-K252 PolarHBondContact O-NZ 3.24Å
234	G	98.7	Very high	97.2	Very high	23 Å²	23	52.1 Å²	52.1	24%	0.237	27%	0.265	C	S	.	.			trans	92.3	157.3	-174.5	0	0	0	0	0	113.6	Q230 W247 G249	Q230-G234 CarbonylContact O-C 3.6Å; Q230-G234 WeakPolarHBondContact O-CA 3.24Å; Q230-G234 PolarHBondContact O-N 3.01Å; G234-W247 CarbonylContact C-O 3.57Å; G234-W247 WeakPolarHBondContact CA-O 3.4Å; G234-G249 VanDerWaalsContact CA-CA 3.47Å
235	F	98.8	Very high	97.2	Very high	26 Å²	26	52 Å²	52	11%	0.114	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	171.4	-176.4	60	-97.1	0	0	0	111.7	V222 F224 R226 Q230 Y231 F246 W247	V222-F235 HydrophobicContact CG1-CD2 3.79Å; V222-F235 HydrophobicContact CG1-CE2 4.05Å; F224-F235 HydrophobicContact CB-CE2 4.47Å; F224-F235 HydrophobicContact CB-CZ 4.45Å; F224-F235 AromaticContact CD1-CE2 3.73Å; F224-F235 HydrophobicContact CD1-CE2 3.73Å; F224-F235 AromaticContact CD1-CZ 3.61Å; F224-F235 HydrophobicContact CD1-CZ 3.61Å; F224-F235 AromaticContact CD2-CE2 3.97Å; F224-F235 HydrophobicContact CD2-CE2 3.97Å; F224-F235 AromaticContact CE1-CE2 3.81Å; F224-F235 HydrophobicContact CE1-CE2 3.81Å; F224-F235 AromaticContact CE1-CZ 3.89Å; F224-F235 HydrophobicContact CE1-CZ 3.89Å; F224-F235 HydrophobicContact CE2-CE2 4.03Å; F224-F235 AromaticContact CG-CE2 3.8Å; F224-F235 HydrophobicContact CG-CE2 3.8Å; F224-F235 AromaticContact CG-CZ 3.99Å; F224-F235 HydrophobicContact CG-CZ 3.99Å; F224-F235 AromaticContact CZ-CE2 3.95Å; F224-F235 HydrophobicContact CZ-CE2 3.95Å; F224-F235 HydrophobicContact CZ-CZ 4.49Å; R226-F235 HydrophobicContact CB-CD1 4.26Å; R226-F235 HydrophobicContact CB-CE1 3.94Å; R226-F235 HydrophobicContact CB-CZ 4.37Å; R226-F235 HydrophobicContact CG-CD1 3.87Å; R226-F235 HydrophobicContact CG-CD2 4.18Å; R226-F235 HydrophobicContact CG-CE1 3.68Å; R226-F235 HydrophobicContact CG-CE2 4.02Å; R226-F235 HydrophobicContact CG-CG 4.12Å; R226-F235 HydrophobicContact CG-CZ 3.77Å; Q230-F235 HydrophobicContact CB-CD1 4.36Å; Y231-F235 AromaticContact CD1-CE1 3.7Å; Y231-F235 HydrophobicContact CD1-CE1 3.7Å; Y231-F235 HydrophobicContact CD1-CZ 4.28Å; Y231-F235 HydrophobicContact CD2-CE1 4.12Å; Y231-F235 AromaticContact CE1-CE1 3.57Å; Y231-F235 HydrophobicContact CE1-CE1 3.57Å; Y231-F235 AromaticContact CE1-CZ 3.67Å; Y231-F235 HydrophobicContact CE1-CZ 3.67Å; Y231-F235 HydrophobicContact CE2-CE1 4.01Å; Y231-F235 HydrophobicContact CE2-CZ 4.23Å; Y231-F235 AromaticContact CG-CE1 3.97Å; Y231-F235 HydrophobicContact CG-CE1 3.97Å; Y231-F235 AromaticContact CZ-CE1 3.73Å; Y231-F235 AromaticContact CZ-CZ 3.63Å; F235-F246 VanDerWaalsContact O-CA 3.31Å; F235-F246 WeakPolarHBondContact O-CA 3.14Å; F235-F246 WeakPolarHBondContact O-CB 3.29Å; F235-W247 HydrophobicContact CD1-CB 4.02Å; F235-W247 HydrophobicContact CD2-CB 4.32Å; F235-W247 HydrophobicContact CE1-CB 3.6Å; F235-W247 HydrophobicContact CE1-CG 4.04Å; F235-W247 HydrophobicContact CE2-CB 3.93Å; F235-W247 HydrophobicContact CG-CB 4.36Å; F235-W247 HydrophobicContact CZ-CB 3.55Å; F235-W247 HydrophobicContact CZ-CG 4.28Å; F235-W247 PolarHBondContact N-O 3.23Å; F235-W247 PolarHBondContact O-N 3.3Å
236	G	98	Very high	97.2	Very high	32 Å²	32	48.4 Å²	48.4	33%	0.33	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	83.2	-163.3	-169.9	0	0	0	0	0	111.7	E245	G236-E245 WeakPolarHBondContact CA-O 3.35Å
237	Y	96.6	Very high	97.3	Very high	172 Å²	172	45.3 Å²	45.3	68%	0.675	24%	0.237	S	C	*	.			trans	-127.8	143.6	-173.1	-58.5	-81.1	0	0	0	111.1	T244 E245 F246	Y237-T244 VanDerWaalsContact O-CB 3.29Å; Y237-T244 WeakPolarHBondContact O-CB 3.39Å; Y237-T244 PolarHBondContact O-OG1 2.84Å; Y237-E245 PolarHBondContact N-O 3.34Å; Y237-F246 WeakPolarHBondContact O-CD1 3.38Å
238	L	97.1	Very high	97.3	Very high	41 Å²	41	43.4 Å²	43.4	22%	0.215	23%	0.227	C	C	.	.			trans	-99.3	128.2	169.3	-57.8	175.2	0	0	0	108.5	L186 L199 F246	L186-L238 HydrophobicContact CD2-CB 3.56Å; L199-L238 HydrophobicContact CB-CD1 4.15Å; L199-L238 HydrophobicContact CD2-CD1 4.12Å; L199-L238 HydrophobicContact CG-CD1 3.98Å; L238-F246 HydrophobicContact CD2-CB 4.45Å; L238-F246 HydrophobicContact CD2-CD1 3.66Å; L238-F246 HydrophobicContact CD2-CD2 3.56Å; L238-F246 HydrophobicContact CD2-CE1 3.58Å; L238-F246 HydrophobicContact CD2-CE2 3.5Å; L238-F246 VanDerWaalsContact CD2-CE2 3.5Å; L238-F246 HydrophobicContact CD2-CG 3.64Å; L238-F246 HydrophobicContact CD2-CZ 3.49Å; L238-F246 VanDerWaalsContact CD2-CZ 3.49Å
239	S	95.3	Very high	97.3	Very high	12 Å²	12	42.8 Å²	42.8	8%	0.084	22%	0.224	C	C	.	.			trans	-119.7	150.2	174.1	83.6	0	0	0	0	111.6	Y201 D241 D242 T243 T244	Y201-S239 VanDerWaalsContact CD2-O 3.28Å; Y201-S239 WeakPolarHBondContact CD2-O 3.43Å; S239-D241 WeakPolarHBondContact CB-OD1 3.48Å; S239-D241 PolarHBondContact O-N 3.42Å; S239-D241 PolarHBondContact OG-OD1 2.96Å; S239-D242 PolarHBondContact OG-N 2.66Å; S239-T243 PolarHBondContact OG-N 3.26Å; S239-T243 VanDerWaalsContact OG-N 3.11Å; S239-T243 PolarHBondContact OG-OG1 2.99Å; S239-T244 PolarHBondContact N-OG1 3.24Å
240	P	93.1	Very high	97.3	Very high	36 Å²	36	38.2 Å²	38.2	23%	0.234	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-24.4	179.8	-15.2	28.9	0	0	0	113.2	V163 L186	V163-P240 HydrophobicContact CB-CG 4.47Å; V163-P240 HydrophobicContact CG1-CG 4.12Å; L186-P240 HydrophobicContact CD1-CG 3.94Å; L186-P240 HydrophobicContact CG-CB 4.39Å; L186-P240 HydrophobicContact CG-CG 4.06Å
241	D	92.9	Very high	97.2	Very high	101 Å²	101	37.8 Å²	37.8	54%	0.54	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	2.5	-177.4	66.1	-36	0	0	0	114.1	S239 T243	S239-D241 WeakPolarHBondContact CB-OD1 3.48Å; S239-D241 PolarHBondContact O-N 3.42Å; S239-D241 PolarHBondContact OG-OD1 2.96Å; D241-T243 VanDerWaalsContact C-N 3.35Å; D241-T243 HydrophobicContact CB-CG2 4.43Å; D241-T243 PolarHBondContact O-N 3.44Å; D241-T243 PolarHBondContact OD1-OG1 3.46Å; D241-T243 VanDerWaalsContact OD1-OG1 3.04Å; D241-T243 WeakPolarHBondContact OD2-CG2 3.36Å; D241-T243 PolarHBondContact OD2-OG1 2.9Å
242	D	93.2	Very high	97.2	Very high	23 Å²	23	40.1 Å²	40.1	12%	0.123	21%	0.209	C	C	.	.	S	Bend	trans	63.5	33.2	173.5	-158.4	37.2	0	0	0	114.8	Y201 R216 R218 S239	Y201-D242 HydrophobicContact CE1-CB 4.42Å; Y201-D242 HydrophobicContact CE2-CB 3.95Å; Y201-D242 WeakPolarHBondContact OH-CB 3.28Å; R216-D242 VanDerWaalsContact CZ-CG 3.41Å; R216-D242 IonicContact CZ-OD1 3.14Å; R216-D242 IonicContact CZ-OD2 3.14Å; R216-D242 IonicContact NE-OD1 3.8Å; R216-D242 PolarHBondContact NE-OD1 3.1Å; R216-D242 IonicContact NH1-OD1 3.86Å; R216-D242 IonicContact NH1-OD2 3.33Å; R216-D242 PolarHBondContact NH1-OD2 2.94Å; R216-D242 IonicContact NH2-OD1 3.59Å; R216-D242 PolarHBondContact NH2-OD1 2.9Å; R216-D242 IonicContact NH2-OD2 2.69Å; R216-D242 PolarHBondContact NH2-OD2 3.36Å; R218-D242 PolarHBondContact NH1-O 2.78Å; S239-D242 PolarHBondContact OG-N 2.66Å
243	T	94.7	Very high	97.2	Very high	71 Å²	71	37.3 Å²	37.3	44%	0.436	20%	0.199	S	C	.	.			trans	-99.5	-3	-175.3	51.3	0	0	0	0	114.3	S239 D241	S239-T243 PolarHBondContact OG-N 3.26Å; S239-T243 VanDerWaalsContact OG-N 3.11Å; S239-T243 PolarHBondContact OG-OG1 2.99Å; D241-T243 VanDerWaalsContact C-N 3.35Å; D241-T243 HydrophobicContact CB-CG2 4.43Å; D241-T243 PolarHBondContact O-N 3.44Å; D241-T243 PolarHBondContact OD1-OG1 3.46Å; D241-T243 VanDerWaalsContact OD1-OG1 3.04Å; D241-T243 WeakPolarHBondContact OD2-CG2 3.36Å; D241-T243 PolarHBondContact OD2-OG1 2.9Å
244	T	96.6	Very high	97.2	Very high	31 Å²	31	34.3 Å²	34.3	19%	0.19	18%	0.184	C	C	.	.			trans	-109.4	159.5	-174.6	54.7	0	0	0	0	114.1	R216 Y237 S239	R216-T244 VanDerWaalsContact CG-O 3.3Å; R216-T244 WeakPolarHBondContact CG-O 3.35Å; Y237-T244 VanDerWaalsContact O-CB 3.29Å; Y237-T244 WeakPolarHBondContact O-CB 3.39Å; Y237-T244 PolarHBondContact O-OG1 2.84Å; S239-T244 PolarHBondContact N-OG1 3.24Å
245	E	98.6	Very high	97.1	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.179	C	C	.	.			trans	-95.8	146.9	170.3	-59.5	-166.1	149	0	0	112	R216 R217 R218 D219 G220 S221 V222 F224 G236 Y237	R216-E245 VanDerWaalsContact O-CA 3.32Å; R216-E245 WeakPolarHBondContact O-CA 3.49Å; R216-E245 WeakPolarHBondContact O-CB 3.43Å; R217-E245 WeakPolarHBondContact CA-OE1 3.47Å; R217-E245 IonicContact NE-OE1 3.47Å; R217-E245 IonicContact NE-OE2 3.52Å; R218-E245 PolarHBondContact N-OE1 2.94Å; D219-E245 PolarHBondContact N-OE1 2.97Å; D219-E245 VanDerWaalsContact OD1-CD 3.3Å; D219-E245 WeakPolarHBondContact OD1-CG 3.29Å; G220-E245 VanDerWaalsContact N-CD 3.35Å; G220-E245 PolarHBondContact N-OE1 2.83Å; S221-E245 PolarHBondContact N-OE2 2.87Å; V222-E245 HydrophobicContact CB-CB 3.83Å; V222-E245 HydrophobicContact CG2-CB 3.83Å; V222-E245 WeakPolarHBondContact CG2-O 3.31Å; V222-E245 PolarHBondContact N-OE2 2.81Å; F224-E245 HydrophobicContact CE2-CB 4.38Å; G236-E245 WeakPolarHBondContact CA-O 3.35Å; Y237-E245 PolarHBondContact N-O 3.34Å
246	F	98.8	Very high	97	Very high	4 Å²	4	33.6 Å²	33.6	2%	0.018	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.4	160.7	175.6	64.7	-87.4	0	0	0	113.9	V213 Q215 R216 F235 Y237 L238 L248	V213-F246 HydrophobicContact CB-CZ 4.01Å; V213-F246 HydrophobicContact CG1-CE1 4.38Å; V213-F246 HydrophobicContact CG1-CE2 4.27Å; V213-F246 HydrophobicContact CG1-CZ 3.59Å; Q215-F246 WeakPolarHBondContact CA-O 3.32Å; R216-F246 HydrophobicContact CB-CD1 3.73Å; R216-F246 HydrophobicContact CB-CE1 3.56Å; R216-F246 HydrophobicContact CB-CG 4.5Å; R216-F246 HydrophobicContact CB-CZ 4.21Å; R216-F246 HydrophobicContact CG-CE1 4.39Å; R216-F246 PolarHBondContact N-O 2.82Å; R216-F246 PolarHBondContact O-N 2.89Å; R216-F246 VanDerWaalsContact O-N 3.14Å; F235-F246 VanDerWaalsContact O-CA 3.31Å; F235-F246 WeakPolarHBondContact O-CA 3.14Å; F235-F246 WeakPolarHBondContact O-CB 3.29Å; Y237-F246 WeakPolarHBondContact O-CD1 3.38Å; L238-F246 HydrophobicContact CD2-CB 4.45Å; L238-F246 HydrophobicContact CD2-CD1 3.66Å; L238-F246 HydrophobicContact CD2-CD2 3.56Å; L238-F246 HydrophobicContact CD2-CE1 3.58Å; L238-F246 HydrophobicContact CD2-CE2 3.5Å; L238-F246 VanDerWaalsContact CD2-CE2 3.5Å; L238-F246 HydrophobicContact CD2-CG 3.64Å; L238-F246 HydrophobicContact CD2-CZ 3.49Å; L238-F246 VanDerWaalsContact CD2-CZ 3.49Å; F246-L248 HydrophobicContact CE2-CB 4.47Å
247	W	98.9	Very high	96.9	Very high	2 Å²	2	32.2 Å²	32.2	1%	0.008	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	124.3	158.8	-177.9	-106.5	0	0	0	108.6	Q215 F224 Y231 G234 F235 G249 N250 I253 F332 W354 W355 N365 M405	Q215-W247 HydrophobicContact CB-CE3 3.65Å; Q215-W247 HydrophobicContact CB-CZ3 3.7Å; Q215-W247 HydrophobicContact CG-CE3 3.54Å; Q215-W247 HydrophobicContact CG-CZ3 3.76Å; F224-W247 HydrophobicContact CE1-CB 4.19Å; Y231-W247 AromaticContact CD1-CD1 3.66Å; Y231-W247 HydrophobicContact CD1-CD2 4.21Å; Y231-W247 HydrophobicContact CD1-CG 4.04Å; Y231-W247 AromaticContact CD1-NE1 3.65Å; Y231-W247 HydrophobicContact CE1-CD2 4.18Å; Y231-W247 HydrophobicContact CE1-CG 4.12Å; Y231-W247 PolarHBondContact O-NE1 2.58Å; Y231-W247 VanDerWaalsContact O-NE1 3.15Å; G234-W247 CarbonylContact C-O 3.57Å; G234-W247 WeakPolarHBondContact CA-O 3.4Å; F235-W247 HydrophobicContact CD1-CB 4.02Å; F235-W247 HydrophobicContact CD2-CB 4.32Å; F235-W247 HydrophobicContact CE1-CB 3.6Å; F235-W247 HydrophobicContact CE1-CG 4.04Å; F235-W247 HydrophobicContact CE2-CB 3.93Å; F235-W247 HydrophobicContact CG-CB 4.36Å; F235-W247 HydrophobicContact CZ-CB 3.55Å; F235-W247 HydrophobicContact CZ-CG 4.28Å; F235-W247 PolarHBondContact N-O 3.23Å; F235-W247 PolarHBondContact O-N 3.3Å; W247-G249 VanDerWaalsContact C-N 3.28Å; W247-G249 VanDerWaalsContact CD1-N 3.34Å; W247-G249 PolarHBondContact O-N 2.65Å; W247-N250 VanDerWaalsContact CE2-OD1 3.25Å; W247-N250 WeakPolarHBondContact CZ2-OD1 3.14Å; W247-N250 PolarHBondContact NE1-OD1 2.75Å; W247-I253 HydrophobicContact CH2-CD1 4.21Å; W247-I253 HydrophobicContact CZ2-CD1 3.67Å; W247-F332 HydrophobicContact CZ2-CE2 4.21Å; W247-F332 HydrophobicContact CZ2-CZ 4.42Å; W247-W354 HydrophobicContact CZ3-CZ3 4.46Å; W247-W355 AromaticContact CH2-CH2 3.77Å; W247-W355 HydrophobicContact CH2-CH2 3.77Å; W247-W355 HydrophobicContact CH2-CZ3 4.28Å; W247-W355 HydrophobicContact CZ2-CH2 4.33Å; W247-N365 WeakPolarHBondContact CZ3-ND2 3.19Å; W247-M405 HydrophobicContact CZ3-SD 4.14Å
248	L	98.8	Very high	96.7	Very high	6 Å²	6	26.7 Å²	26.7	3%	0.031	15%	0.145	C	C	.	.			trans	-65	-32.1	-173.7	179.6	61.8	0	0	0	112.7	V200 I214 F246 K252 I253 L256	V200-L248 HydrophobicContact CG1-CD1 3.93Å; V200-L248 HydrophobicContact CG1-CD2 4.06Å; I214-L248 HydrophobicContact CB-CB 4.38Å; I214-L248 HydrophobicContact CB-CD2 4.37Å; I214-L248 HydrophobicContact CG2-CD2 3.95Å; I214-L248 VanDerWaalsContact O-CB 3.25Å; I214-L248 WeakPolarHBondContact O-CB 3.49Å; I214-L248 PolarHBondContact O-N 3.32Å; F246-L248 HydrophobicContact CE2-CB 4.47Å; L248-K252 HydrophobicContact CD1-CD 4.03Å; L248-K252 HydrophobicContact CD2-CB 4.33Å; L248-K252 HydrophobicContact CG-CB 4.05Å; L248-K252 HydrophobicContact CG-CD 4.2Å; L248-K252 VanDerWaalsContact O-CD 3.29Å; L248-K252 WeakPolarHBondContact O-CD 3.41Å; L248-K252 WeakPolarHBondContact O-CE 3.29Å; L248-K252 PolarHBondContact O-NZ 3.31Å; L248-I253 HydrophobicContact CB-CG1 4.4Å; L248-I253 HydrophobicContact CD2-CG1 4.35Å; L248-L256 HydrophobicContact CD2-CD1 3.8Å
249	G	98.8	Very high	96.1	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.145	C	C	.	.			trans	114.4	128.8	-177.7	0	0	0	0	0	112.3	Y231 R232 G234 W247 E251 K252 I253	Y231-G249 CarbonylContact O-C 3.59Å; Y231-G249 WeakPolarHBondContact O-CA 3.29Å; R232-G249 CarbonylContact O-C 3.51Å; R232-G249 VanDerWaalsContact O-C 3.23Å; R232-G249 VanDerWaalsContact O-CA 3.27Å; R232-G249 WeakPolarHBondContact O-CA 3.4Å; G234-G249 VanDerWaalsContact CA-CA 3.47Å; W247-G249 VanDerWaalsContact C-N 3.28Å; W247-G249 VanDerWaalsContact CD1-N 3.34Å; W247-G249 PolarHBondContact O-N 2.65Å; G249-E251 VanDerWaalsContact C-N 3.26Å; G249-E251 PolarHBondContact O-N 2.66Å; G249-K252 PolarHBondContact O-N 2.89Å; G249-K252 VanDerWaalsContact O-N 3.08Å; G249-I253 WeakPolarHBondContact O-CG1 3.32Å; G249-I253 PolarHBondContact O-N 3.11Å
250	N	98.8	Very high	95.5	Very high	1 Å²	1	27 Å²	27	1%	0.005	15%	0.151	C	C	.	.	H	α-helix	trans	-57	-38.4	-173.6	-63	-6.6	0	0	0	112.4	Y231 R232 W247 I253 H254 Y294 F332	Y231-N250 VanDerWaalsContact O-CG 3.25Å; Y231-N250 PolarHBondContact O-N 2.71Å; Y231-N250 PolarHBondContact O-OD1 3.47Å; R232-N250 PolarHBondContact O-N 2.75Å; W247-N250 VanDerWaalsContact CE2-OD1 3.25Å; W247-N250 WeakPolarHBondContact CZ2-OD1 3.14Å; W247-N250 PolarHBondContact NE1-OD1 2.75Å; N250-I253 PolarHBondContact O-N 2.71Å; N250-H254 WeakPolarHBondContact O-CB 3.39Å; N250-H254 PolarHBondContact O-N 3.19Å; N250-Y294 HydrophobicContact CB-CD1 3.66Å; N250-Y294 HydrophobicContact CB-CD2 3.62Å; N250-Y294 HydrophobicContact CB-CE1 3.98Å; N250-Y294 HydrophobicContact CB-CE2 3.92Å; N250-Y294 HydrophobicContact CB-CG 3.49Å; N250-Y294 VanDerWaalsContact CB-CG 3.49Å; N250-F332 VanDerWaalsContact ND2-CD1 3.29Å; N250-F332 WeakPolarHBondContact ND2-CD1 3.29Å; N250-F332 WeakPolarHBondContact ND2-CE1 3.48Å
251	E	98.5	Very high	95	Very high	57 Å²	57	31 Å²	31	27%	0.266	18%	0.177	S	C	.	.	H	α-helix	trans	-66.5	-41	178.7	-175.1	57	-156.6	0	0	111.7	R232 G249 I253 H254 L255 Y294	R232-E251 HydrophobicContact CG-CB 4.05Å; R232-E251 PolarHBondContact O-N 2.96Å; G249-E251 VanDerWaalsContact C-N 3.26Å; G249-E251 PolarHBondContact O-N 2.66Å; E251-I253 VanDerWaalsContact C-N 3.33Å; E251-I253 PolarHBondContact O-N 2.76Å; E251-H254 WeakPolarHBondContact O-CB 3.46Å; E251-H254 PolarHBondContact O-N 2.81Å; E251-H254 IonicContact OE1-CD2 2.71Å; E251-H254 IonicContact OE2-CD2 3.55Å; E251-L255 HydrophobicContact CG-CD1 4.2Å; E251-L255 WeakPolarHBondContact O-CB 3.37Å; E251-L255 VanDerWaalsContact O-CG 3.24Å; E251-L255 WeakPolarHBondContact O-CG 3.33Å; E251-L255 PolarHBondContact O-N 2.88Å; E251-Y294 HydrophobicContact CB-CE1 4.37Å; E251-Y294 VanDerWaalsContact OE2-CE1 3.29Å; E251-Y294 WeakPolarHBondContact OE2-CE1 3.38Å; E251-Y294 PolarHBondContact OE2-OH 3.47Å
252	K	98.5	Very high	94.8	Very high	50 Å²	50	29.8 Å²	29.8	22%	0.217	17%	0.17	C	C	.	.	H	α-helix	trans	-65.7	-38.7	177.2	-60.5	-179.6	-148.8	145.9	0	111.2	F198 E233 L248 G249 L255 L256	F198-K252 HydrophobicContact CB-CD 4.1Å; F198-K252 HydrophobicContact CD1-CD 4.37Å; F198-K252 HydrophobicContact CD1-CG 4.16Å; F198-K252 HydrophobicContact CD2-CB 4.24Å; F198-K252 HydrophobicContact CD2-CD 3.65Å; F198-K252 HydrophobicContact CD2-CG 4.07Å; F198-K252 HydrophobicContact CE1-CB 4.27Å; F198-K252 HydrophobicContact CE1-CG 4.2Å; F198-K252 HydrophobicContact CE2-CB 3.8Å; F198-K252 HydrophobicContact CE2-CD 4.09Å; F198-K252 HydrophobicContact CE2-CG 4.11Å; F198-K252 HydrophobicContact CG-CD 3.8Å; F198-K252 HydrophobicContact CG-CG 4.08Å; F198-K252 HydrophobicContact CZ-CB 3.8Å; F198-K252 HydrophobicContact CZ-CG 4.17Å; E233-K252 WeakPolarHBondContact O-CE 3.26Å; E233-K252 PolarHBondContact O-NZ 3.24Å; L248-K252 HydrophobicContact CD1-CD 4.03Å; L248-K252 HydrophobicContact CD2-CB 4.33Å; L248-K252 HydrophobicContact CG-CB 4.05Å; L248-K252 HydrophobicContact CG-CD 4.2Å; L248-K252 VanDerWaalsContact O-CD 3.29Å; L248-K252 WeakPolarHBondContact O-CD 3.41Å; L248-K252 WeakPolarHBondContact O-CE 3.29Å; L248-K252 PolarHBondContact O-NZ 3.31Å; G249-K252 PolarHBondContact O-N 2.89Å; G249-K252 VanDerWaalsContact O-N 3.08Å; K252-L255 PolarHBondContact O-N 3.34Å; K252-L256 WeakPolarHBondContact O-CB 3.27Å; K252-L256 WeakPolarHBondContact O-CD1 3.04Å; K252-L256 VanDerWaalsContact O-CG 3.26Å; K252-L256 WeakPolarHBondContact O-CG 3.41Å; K252-L256 PolarHBondContact O-N 2.84Å
253	I	98.4	Very high	94.8	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.005	18%	0.175	C	C	.	.	H	α-helix	trans	-69.1	-40.7	176.7	-57.1	163.1	0	0	0	110.8	I214 W247 L248 G249 N250 E251 L256 T257 F285 I287	I214-I253 HydrophobicContact CB-CD1 3.96Å; I214-I253 HydrophobicContact CB-CG1 3.91Å; I214-I253 HydrophobicContact CD1-CD1 4.21Å; I214-I253 HydrophobicContact CD1-CG1 4.43Å; I214-I253 HydrophobicContact CD1-CG2 4.01Å; I214-I253 HydrophobicContact CG1-CD1 4.5Å; I214-I253 HydrophobicContact CG2-CG1 4.02Å; W247-I253 HydrophobicContact CH2-CD1 4.21Å; W247-I253 HydrophobicContact CZ2-CD1 3.67Å; L248-I253 HydrophobicContact CB-CG1 4.4Å; L248-I253 HydrophobicContact CD2-CG1 4.35Å; G249-I253 WeakPolarHBondContact O-CG1 3.32Å; G249-I253 PolarHBondContact O-N 3.11Å; N250-I253 PolarHBondContact O-N 2.71Å; E251-I253 VanDerWaalsContact C-N 3.33Å; E251-I253 PolarHBondContact O-N 2.76Å; I253-L256 PolarHBondContact O-N 2.73Å; I253-T257 HydrophobicContact CG2-CG2 4.34Å; I253-T257 WeakPolarHBondContact O-CB 3.48Å; I253-T257 WeakPolarHBondContact O-CG2 3.47Å; I253-T257 PolarHBondContact O-N 3.45Å; I253-T257 PolarHBondContact O-OG1 3.07Å; I253-F285 HydrophobicContact CG2-CE1 4.06Å; I253-F285 HydrophobicContact CG2-CZ 4.3Å; I253-I287 HydrophobicContact CB-CG1 4.44Å; I253-I287 HydrophobicContact CG2-CB 4.3Å; I253-I287 HydrophobicContact CG2-CG1 3.56Å
254	H	98.1	Very high	94.8	Very high	31 Å²	31	27.5 Å²	27.5	14%	0.144	16%	0.158	C	C	.	.	H	α-helix	trans	-56.6	-52.1	171.1	171.6	55.8	0	0	0	111.1	N250 E251 L256 T257 T258 I287 G288 Y294	N250-H254 WeakPolarHBondContact O-CB 3.39Å; N250-H254 PolarHBondContact O-N 3.19Å; E251-H254 WeakPolarHBondContact O-CB 3.46Å; E251-H254 PolarHBondContact O-N 2.81Å; E251-H254 IonicContact OE1-CD2 2.71Å; E251-H254 IonicContact OE2-CD2 3.55Å; H254-L256 PolarHBondContact O-N 2.69Å; H254-T257 PolarHBondContact O-N 3.36Å; H254-T257 PolarHBondContact O-OG1 3.08Å; H254-T258 WeakPolarHBondContact O-CB 3.25Å; H254-T258 WeakPolarHBondContact O-CG2 3.15Å; H254-T258 PolarHBondContact O-N 3.23Å; H254-T258 PolarHBondContact O-OG1 2.86Å; H254-I287 HydrophobicContact CB-CG2 4.3Å; H254-I287 PolarHBondContact ND1-O 3.09Å; H254-G288 PolarHBondContact ND1-O 3.1Å; H254-Y294 HydrophobicContact CB-CD1 4.31Å; H254-Y294 HydrophobicContact CB-CE1 4.21Å
255	L	97.4	Very high	94.8	Very high	24 Å²	24	26 Å²	26	13%	0.126	15%	0.149	C	C	.	.	H	α-helix	trans	-60	-43.5	179.2	-68.9	168.6	0	0	0	112.2	P191 S193 A194 E251 K252 S259	P191-L255 HydrophobicContact CB-CB 4.38Å; P191-L255 HydrophobicContact CG-CB 4.37Å; S193-L255 VanDerWaalsContact OG-CD2 3.3Å; S193-L255 WeakPolarHBondContact OG-CD2 3.41Å; A194-L255 HydrophobicContact CB-CD1 4.02Å; E251-L255 HydrophobicContact CG-CD1 4.2Å; E251-L255 WeakPolarHBondContact O-CB 3.37Å; E251-L255 VanDerWaalsContact O-CG 3.24Å; E251-L255 WeakPolarHBondContact O-CG 3.33Å; E251-L255 PolarHBondContact O-N 2.88Å; K252-L255 PolarHBondContact O-N 3.34Å; L255-S259 WeakPolarHBondContact O-CB 3.37Å; L255-S259 PolarHBondContact O-N 2.85Å; L255-S259 PolarHBondContact O-OG 3.4Å
256	L	96.9	Very high	94.8	Very high	11 Å²	11	26 Å²	26	6%	0.058	15%	0.149	C	C	.	.	H	α-helix	trans	-63.6	-40.3	177.1	-75.4	161.3	0	0	0	112.9	D172 P191 F198 T212 L248 K252 I253 H254 I407	D172-L256 HydrophobicContact CB-CD2 4.13Å; P191-L256 HydrophobicContact CG-CD2 3.87Å; P191-L256 HydrophobicContact CG-CG 4.15Å; F198-L256 HydrophobicContact CE2-CD1 4.14Å; F198-L256 HydrophobicContact CE2-CG 4.44Å; F198-L256 HydrophobicContact CZ-CD1 4.2Å; F198-L256 HydrophobicContact CZ-CD2 4.45Å; F198-L256 HydrophobicContact CZ-CG 4.05Å; T212-L256 HydrophobicContact CG2-CD1 3.93Å; L248-L256 HydrophobicContact CD2-CD1 3.8Å; K252-L256 WeakPolarHBondContact O-CB 3.27Å; K252-L256 WeakPolarHBondContact O-CD1 3.04Å; K252-L256 VanDerWaalsContact O-CG 3.26Å; K252-L256 WeakPolarHBondContact O-CG 3.41Å; K252-L256 PolarHBondContact O-N 2.84Å; I253-L256 PolarHBondContact O-N 2.73Å; H254-L256 PolarHBondContact O-N 2.69Å; L256-I407 HydrophobicContact CB-CD1 3.78Å; L256-I407 HydrophobicContact CD1-CD1 4.24Å
257	T	95.9	Very high	94.8	Very high	3 Å²	3	28 Å²	28	2%	0.018	16%	0.156	C	C	.	.	H	α-helix	trans	-86.1	-13.4	-175.1	58	0	0	0	0	114.3	I253 H254 F285 I287 I407	I253-T257 HydrophobicContact CG2-CG2 4.34Å; I253-T257 WeakPolarHBondContact O-CB 3.48Å; I253-T257 WeakPolarHBondContact O-CG2 3.47Å; I253-T257 PolarHBondContact O-N 3.45Å; I253-T257 PolarHBondContact O-OG1 3.07Å; H254-T257 PolarHBondContact O-N 3.36Å; H254-T257 PolarHBondContact O-OG1 3.08Å; T257-F285 HydrophobicContact CG2-CD1 3.6Å; T257-F285 HydrophobicContact CG2-CE1 3.64Å; T257-I287 PolarHBondContact OG1-N 3.23Å; T257-I407 HydrophobicContact CG2-CD1 4.02Å
258	T	92.6	Very high	94.8	Very high	55 Å²	55	27.9 Å²	27.9	34%	0.337	16%	0.155	S	C	.	.	H	α-helix	trans	-116.6	-19.2	-178.1	63.3	0	0	0	0	115.1	H254 S260	H254-T258 WeakPolarHBondContact O-CB 3.25Å; H254-T258 WeakPolarHBondContact O-CG2 3.15Å; H254-T258 PolarHBondContact O-N 3.23Å; H254-T258 PolarHBondContact O-OG1 2.86Å; T258-S260 VanDerWaalsContact C-N 3.28Å; T258-S260 PolarHBondContact O-N 3.04Å
259	S	84.5	Confident	94.8	Very high	29 Å²	29	30.3 Å²	30.3	20%	0.203	17%	0.167	C	C	.	.	S	Bend	trans	-66	-26.3	177.6	-74	0	0	0	0	114.5	P191 A192 S193 L255	P191-S259 WeakPolarHBondContact CB-OG 3.31Å; A192-S259 PolarHBondContact N-OG 2.83Å; S193-S259 PolarHBondContact N-OG 3Å; S193-S259 PolarHBondContact OG-OG 3.05Å; L255-S259 WeakPolarHBondContact O-CB 3.37Å; L255-S259 PolarHBondContact O-N 2.85Å; L255-S259 PolarHBondContact O-OG 3.4Å
260	S	82.4	Confident	94.8	Very high	30 Å²	30	30.4 Å²	30.4	21%	0.21	17%	0.167	C	C	.	.			trans	-101.5	137.9	-175.1	-171.7	0	0	0	0	111.3	T258 I262	T258-S260 VanDerWaalsContact C-N 3.28Å; T258-S260 PolarHBondContact O-N 3.04Å; S260-I262 PolarHBondContact O-N 2.83Å; S260-I262 PolarHBondContact OG-N 3.3Å
261	P	82.4	Confident	94.8	Very high	122 Å²	122	31.1 Å²	31.1	79%	0.792	17%	0.172	S	C	*	.	S	Bend	trans	-69	-17.2	168.3	30.7	-35.4	0	0	0	112.1	P263	P261-P263 WeakPolarHBondContact O-CD 3.41Å
262	I	88.3	Confident	94.8	Very high	74 Å²	74	28.5 Å²	28.5	38%	0.379	16%	0.159	S	C	.	.	S	Bend	trans	-80.5	122.1	177.2	-53.1	176.3	0	0	0	108.2	S260 P409 V410	S260-I262 PolarHBondContact O-N 2.83Å; S260-I262 PolarHBondContact OG-N 3.3Å; I262-P409 HydrophobicContact CG2-CB 3.96Å; I262-V410 HydrophobicContact CG2-CG1 4.15Å
263	P	92.6	Very high	94.8	Very high	37 Å²	37	29.6 Å²	29.6	24%	0.24	16%	0.162	C	C	.	.	P	Polyproline II helix	trans	-58.4	146.8	175.8	-22.6	32.9	0	0	0	111.8	P261 M284 V410	P261-P263 WeakPolarHBondContact O-CD 3.41Å; P263-M284 HydrophobicContact CB-CB 4.45Å; P263-M284 HydrophobicContact CB-CG 4.07Å; P263-V410 HydrophobicContact CB-CB 4.5Å; P263-V410 HydrophobicContact CB-CG1 4.02Å; P263-V410 HydrophobicContact CG-CG1 4.25Å; P263-V410 WeakPolarHBondContact O-CB 3.44Å; P263-V410 WeakPolarHBondContact O-CG1 3.27Å; P263-V410 PolarHBondContact O-N 2.85Å
264	T	95.2	Very high	94.8	Very high	10 Å²	10	36.8 Å²	36.8	6%	0.061	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	148.9	173.1	51.1	0	0	0	0	110.8	M284 F285 I408	T264-M284 CarbonylContact O-C 3.51Å; T264-M284 WeakPolarHBondContact O-CA 3.44Å; T264-M284 PolarHBondContact O-N 2.91Å; T264-M284 VanDerWaalsContact O-N 3.1Å; T264-F285 PolarHBondContact O-N 2.85Å; T264-F285 PolarHBondContact OG1-O 2.88Å; T264-I408 CarbonylContact C-O 3.55Å; T264-I408 WeakPolarHBondContact CA-O 3.48Å
265	V	97.4	Very high	94.7	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	130.7	166.4	179.3	0	0	0	0	107.2	D281 Y282 I407 I408 V410 I413	V265-D281 HydrophobicContact CG1-CB 4.13Å; V265-Y282 WeakPolarHBondContact CA-O 3.36Å; V265-Y282 WeakPolarHBondContact CG1-O 3.38Å; V265-I407 WeakPolarHBondContact O-CA 3.49Å; V265-I408 PolarHBondContact N-O 3.1Å; V265-I408 PolarHBondContact O-N 2.74Å; V265-I408 VanDerWaalsContact O-N 3.12Å; V265-V410 HydrophobicContact CG2-CB 3.92Å; V265-V410 HydrophobicContact CG2-CG2 3.8Å; V265-I413 HydrophobicContact CB-CD1 3.8Å; V265-I413 HydrophobicContact CG1-CD1 3.68Å; V265-I413 HydrophobicContact CG2-CD1 4.18Å
266	L	98.5	Very high	94.8	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	126.5	164	166.8	67.1	0	0	0	108.4	I214 I268 D281 Y282 F285 F310 M405 I407	I214-L266 HydrophobicContact CD1-CD1 4.24Å; L266-I268 HydrophobicContact CD1-CG1 4.2Å; L266-I268 HydrophobicContact CD2-CD1 4Å; L266-I268 HydrophobicContact CD2-CG1 4.01Å; L266-I268 HydrophobicContact CG-CG1 4.02Å; L266-D281 CarbonylContact O-C 3.54Å; L266-D281 VanDerWaalsContact O-CA 3.31Å; L266-D281 WeakPolarHBondContact O-CA 3.33Å; L266-Y282 HydrophobicContact CD2-CD2 4.37Å; L266-Y282 PolarHBondContact N-O 3.03Å; L266-Y282 PolarHBondContact O-N 2.88Å; L266-F285 HydrophobicContact CB-CB 3.69Å; L266-F285 HydrophobicContact CB-CD1 3.91Å; L266-F285 HydrophobicContact CB-CD2 3.69Å; L266-F285 HydrophobicContact CB-CE1 4.45Å; L266-F285 HydrophobicContact CB-CE2 4.24Å; L266-F285 HydrophobicContact CB-CG 3.49Å; L266-F285 VanDerWaalsContact CB-CG 3.49Å; L266-F285 HydrophobicContact CD2-CD2 3.66Å; L266-F285 HydrophobicContact CD2-CE2 3.59Å; L266-F285 HydrophobicContact CD2-CG 4.34Å; L266-F285 HydrophobicContact CD2-CZ 4.22Å; L266-F285 HydrophobicContact CG-CD2 4.27Å; L266-F285 HydrophobicContact CG-CE2 4.4Å; L266-F285 HydrophobicContact CG-CG 4.47Å; L266-F310 HydrophobicContact CD2-CE2 3.97Å; L266-M405 HydrophobicContact CD1-CB 4.04Å; L266-M405 HydrophobicContact CD1-CE 4.08Å; L266-M405 HydrophobicContact CD2-CE 3.88Å; L266-I407 HydrophobicContact CB-CG2 4.38Å; L266-I407 HydrophobicContact CD1-CG2 4.14Å
267	R	98.4	Very high	94.8	Very high	44 Å²	44	47.3 Å²	47.3	17%	0.166	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	126.6	162.8	174.7	160.4	-66.8	-166.8	-6.8	109.3	F211 E269 D281 K406	F211-R267 HydrophobicContact CE1-CB 4.42Å; R267-E269 WeakPolarHBondContact CD-OE1 3.12Å; R267-E269 HydrophobicContact CG-CG 3.97Å; R267-D281 WeakPolarHBondContact CA-OD1 3.21Å; R267-D281 VanDerWaalsContact CB-OD1 3.29Å; R267-D281 WeakPolarHBondContact CB-OD1 3.3Å; R267-D281 VanDerWaalsContact CG-OD1 3.32Å; R267-D281 WeakPolarHBondContact CG-OD1 3.16Å; R267-D281 IonicContact CZ-OD1 3.9Å; R267-D281 IonicContact CZ-OD2 2.88Å; R267-D281 IonicContact NE-OD1 3.8Å; R267-D281 PolarHBondContact NE-OD1 3.13Å; R267-D281 IonicContact NE-OD2 3.94Å; R267-D281 IonicContact NH2-OD1 2.83Å; R267-D281 PolarHBondContact NH2-OD1 3.2Å; R267-D281 IonicContact NH2-OD2 3.23Å; R267-D281 PolarHBondContact NH2-OD2 3.5Å; R267-K406 HydrophobicContact CB-CG 4.2Å; R267-K406 PolarHBondContact N-O 2.79Å; R267-K406 PolarHBondContact O-N 2.68Å
268	I	98.8	Very high	95	Very high	0 Å²	0	50 Å²	50	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	124.8	167.2	-66.2	176.4	0	0	0	107	L266 L270 Y279 A280 Y282 F310 L364 W390 T404 M405	L266-I268 HydrophobicContact CD1-CG1 4.2Å; L266-I268 HydrophobicContact CD2-CD1 4Å; L266-I268 HydrophobicContact CD2-CG1 4.01Å; L266-I268 HydrophobicContact CG-CG1 4.02Å; I268-L270 HydrophobicContact CG2-CD1 4.39Å; I268-L270 HydrophobicContact CG2-CD2 3.4Å; I268-L270 VanDerWaalsContact CG2-CD2 3.4Å; I268-L270 HydrophobicContact CG2-CG 3.84Å; I268-Y279 CarbonylContact O-C 3.48Å; I268-Y279 WeakPolarHBondContact O-CA 3.24Å; I268-Y279 WeakPolarHBondContact O-CB 3.33Å; I268-A280 HydrophobicContact CB-CB 4.46Å; I268-A280 PolarHBondContact N-O 3.34Å; I268-A280 PolarHBondContact O-N 2.87Å; I268-Y282 HydrophobicContact CD1-CD2 4.41Å; I268-Y282 HydrophobicContact CD1-CE2 4.01Å; I268-F310 HydrophobicContact CD1-CE2 3.71Å; I268-F310 HydrophobicContact CD1-CZ 3.67Å; I268-L364 HydrophobicContact CD1-CD1 4.05Å; I268-L364 HydrophobicContact CG1-CD1 4.29Å; I268-L364 HydrophobicContact CG2-CD1 3.69Å; I268-W390 HydrophobicContact CD1-CH2 3.57Å; I268-W390 HydrophobicContact CD1-CZ3 3.68Å; I268-W390 HydrophobicContact CG2-CH2 4.48Å; I268-W390 HydrophobicContact CG2-CZ3 4.31Å; I268-T404 WeakPolarHBondContact CA-O 3.45Å; I268-M405 HydrophobicContact CD1-CE 4.39Å; I268-M405 HydrophobicContact CG1-CE 4.49Å; I268-M405 HydrophobicContact CG1-CG 4.33Å
269	E	98.7	Very high	95.3	Very high	58 Å²	58	51.5 Å²	51.5	27%	0.271	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	134.3	171.5	-77.8	169.7	-165.9	0	0	109.3	R267 T403 T404 K406	R267-E269 WeakPolarHBondContact CD-OE1 3.12Å; R267-E269 HydrophobicContact CG-CG 3.97Å; E269-T403 CarbonylContact O-C 3.43Å; E269-T403 WeakPolarHBondContact O-CA 3.29Å; E269-T404 PolarHBondContact N-O 2.95Å; E269-T404 PolarHBondContact O-N 2.89Å; E269-K406 WeakPolarHBondContact OE1-CE 3.5Å; E269-K406 IonicContact OE1-NZ 2.75Å; E269-K406 PolarHBondContact OE1-NZ 3.19Å; E269-K406 WeakPolarHBondContact OE2-CE 3.38Å; E269-K406 IonicContact OE2-NZ 3.89Å; E269-K406 PolarHBondContact OE2-NZ 2.69Å
270	L	98.8	Very high	95.9	Very high	1 Å²	1	50.1 Å²	50.1	1%	0.005	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	141	-171	-51.1	175.7	0	0	0	109.5	I268 K277 K278 A306 L364 W390 W393 L400 E402 T403	I268-L270 HydrophobicContact CG2-CD1 4.39Å; I268-L270 HydrophobicContact CG2-CD2 3.4Å; I268-L270 VanDerWaalsContact CG2-CD2 3.4Å; I268-L270 HydrophobicContact CG2-CG 3.84Å; L270-K277 WeakPolarHBondContact O-CA 3.4Å; L270-K278 PolarHBondContact N-O 3.05Å; L270-K278 PolarHBondContact O-N 2.88Å; L270-A306 HydrophobicContact CD1-CB 3.99Å; L270-L364 HydrophobicContact CD2-CD1 4.4Å; L270-L364 HydrophobicContact CD2-CD2 3.72Å; L270-W390 HydrophobicContact CD1-CB 3.89Å; L270-W390 HydrophobicContact CD1-CD2 3.73Å; L270-W390 HydrophobicContact CD1-CE3 4.32Å; L270-W390 HydrophobicContact CD1-CG 3.51Å; L270-W393 HydrophobicContact CB-CE3 4.07Å; L270-W393 HydrophobicContact CB-CZ3 3.57Å; L270-W393 HydrophobicContact CD1-CE3 4.05Å; L270-W393 HydrophobicContact CD1-CZ3 4.41Å; L270-L400 HydrophobicContact CB-CD1 4.05Å; L270-L400 HydrophobicContact CD1-CD1 4.05Å; L270-L400 HydrophobicContact CD2-CD1 3.78Å; L270-L400 HydrophobicContact CG-CD1 4.17Å; L270-E402 CarbonylContact C-O 3.56Å; L270-T403 HydrophobicContact CD2-CG2 3.78Å
271	V	98.7	Very high	96.7	Very high	17 Å²	17	49 Å²	49	10%	0.103	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	131.5	176.6	-168.5	0	0	0	0	109.5	N276 K277 K401 E402	V271-N276 WeakPolarHBondContact CA-O 3.19Å; V271-K277 HydrophobicContact CG1-CG 4.25Å; V271-K277 HydrophobicContact CG2-CD 4.28Å; V271-K277 HydrophobicContact CG2-CG 4.08Å; V271-K401 WeakPolarHBondContact O-CB 3.21Å; V271-K401 PolarHBondContact O-N 2.88Å; V271-E402 HydrophobicContact CB-CB 3.85Å; V271-E402 HydrophobicContact CB-CG 4.19Å; V271-E402 HydrophobicContact CG2-CB 3.93Å; V271-E402 PolarHBondContact N-O 2.8Å; V271-E402 PolarHBondContact O-N 2.95Å; V271-E402 VanDerWaalsContact O-N 3.1Å
272	D	98.4	Very high	97.4	Very high	2 Å²	2	43.1 Å²	43.1	1%	0.011	21%	0.212	C	C	.	.			trans	-90.5	-179.1	176.7	78.8	4.7	0	0	0	112.2	E274 G275 N276 W393 H394 Y398 L400	D272-E274 VanDerWaalsContact C-N 3.27Å; D272-E274 PolarHBondContact O-N 2.95Å; D272-E274 WeakPolarHBondContact OD1-CA 3.41Å; D272-E274 WeakPolarHBondContact OD1-CB 3.32Å; D272-E274 PolarHBondContact OD1-N 3.14Å; D272-G275 PolarHBondContact O-N 3.43Å; D272-G275 PolarHBondContact OD1-N 3.05Å; D272-N276 PolarHBondContact N-O 2.84Å; D272-N276 VanDerWaalsContact N-O 3.1Å; D272-N276 PolarHBondContact OD1-N 2.79Å; D272-N276 WeakPolarHBondContact OD2-CB 3.43Å; D272-N276 PolarHBondContact OD2-ND2 2.86Å; D272-W393 HydrophobicContact CB-CH2 3.73Å; D272-W393 HydrophobicContact CB-CZ2 3.98Å; D272-H394 IonicContact OD2-CE1 3.23Å; D272-H394 IonicContact OD2-NE2 2.66Å; D272-Y398 HydrophobicContact CB-CE1 4.05Å; D272-Y398 WeakPolarHBondContact CB-OH 3.3Å; D272-L400 HydrophobicContact CB-CD2 4.49Å
273	W	98.1	Very high	97.8	Very high	72 Å²	72	40 Å²	40	27%	0.273	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-9.8	-179.8	-66.7	83.5	0	0	0	114	Y368 Y369 Q370 G371 Y398 S399 K401	W273-Y368 AromaticContact CH2-CE1 3.82Å; W273-Y368 HydrophobicContact CH2-CE1 3.82Å; W273-Y368 AromaticContact CH2-CZ 3.9Å; W273-Y368 WeakPolarHBondContact CH2-OH 3.47Å; W273-Y368 AromaticContact CZ2-CE1 3.92Å; W273-Y368 HydrophobicContact CZ2-CE1 3.92Å; W273-Y368 AromaticContact CZ2-CZ 3.87Å; W273-Y369 WeakPolarHBondContact CZ2-O 3.24Å; W273-Q370 HydrophobicContact CH2-CB 4.25Å; W273-Q370 HydrophobicContact CH2-CG 3.84Å; W273-Q370 HydrophobicContact CZ3-CG 4.15Å; W273-G371 VanDerWaalsContact CH2-N 3.28Å; W273-G371 VanDerWaalsContact CZ2-N 3.31Å; W273-Y398 AromaticContact CD1-CZ 3.88Å; W273-Y398 PolarHBondContact N-OH 2.99Å; W273-S399 PolarHBondContact NE1-O 2.91Å; W273-K401 HydrophobicContact CD2-CB 3.81Å; W273-K401 HydrophobicContact CD2-CD 4.38Å; W273-K401 HydrophobicContact CD2-CG 3.91Å; W273-K401 HydrophobicContact CE3-CB 4.39Å; W273-K401 HydrophobicContact CE3-CD 4.2Å; W273-K401 HydrophobicContact CE3-CG 3.96Å; W273-K401 HydrophobicContact CG-CB 4.03Å; W273-K401 HydrophobicContact CH2-CG 4Å; W273-K401 HydrophobicContact CZ2-CB 4.06Å; W273-K401 HydrophobicContact CZ2-CG 3.96Å; W273-K401 HydrophobicContact CZ3-CD 4.47Å; W273-K401 HydrophobicContact CZ3-CG 4.02Å
274	E	97.9	Very high	97.9	Very high	153 Å²	153	42.8 Å²	42.8	72%	0.715	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.7	-9.5	174.5	-64.5	174.2	-165.8	0	0	111.5	D272	D272-E274 VanDerWaalsContact C-N 3.27Å; D272-E274 PolarHBondContact O-N 2.95Å; D272-E274 WeakPolarHBondContact OD1-CA 3.41Å; D272-E274 WeakPolarHBondContact OD1-CB 3.32Å; D272-E274 PolarHBondContact OD1-N 3.14Å
275	G	97.5	Very high	98	Very high	47 Å²	47	42.3 Å²	42.3	49%	0.485	20%	0.204	S	C	.	.			trans	90.4	6.2	-179.8	0	0	0	0	0	113.8	D272	D272-G275 PolarHBondContact O-N 3.43Å; D272-G275 PolarHBondContact OD1-N 3.05Å
276	N	98.3	Very high	98	Very high	81 Å²	81	47.6 Å²	47.6	43%	0.433	22%	0.224	S	C	.	.			trans	-66.4	140	172	-55.4	-61	0	0	0	108.9	V271 D272 W393	V271-N276 WeakPolarHBondContact CA-O 3.19Å; D272-N276 PolarHBondContact N-O 2.84Å; D272-N276 VanDerWaalsContact N-O 3.1Å; D272-N276 PolarHBondContact OD1-N 2.79Å; D272-N276 WeakPolarHBondContact OD2-CB 3.43Å; D272-N276 PolarHBondContact OD2-ND2 2.86Å; N276-W393 HydrophobicContact CB-CZ2 4.04Å
277	K	98.4	Very high	98	Very high	158 Å²	158	47.7 Å²	47.7	69%	0.687	23%	0.225	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-119.1	139.7	179.5	-55.5	-164.1	178	-170.6	0	110	L270 V271	L270-K277 WeakPolarHBondContact O-CA 3.4Å; V271-K277 HydrophobicContact CG1-CG 4.25Å; V271-K277 HydrophobicContact CG2-CD 4.28Å; V271-K277 HydrophobicContact CG2-CG 4.08Å
278	K	98.4	Very high	97.9	Very high	59 Å²	59	46.4 Å²	46.4	26%	0.257	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	162.3	176	-70	-153.8	172.4	-168.9	0	111.8	L270 D305 A306 W393	L270-K278 PolarHBondContact N-O 3.05Å; L270-K278 PolarHBondContact O-N 2.88Å; K278-D305 WeakPolarHBondContact CA-OD1 3.35Å; K278-D305 VanDerWaalsContact CB-OD1 3.3Å; K278-D305 WeakPolarHBondContact CB-OD1 3.2Å; K278-D305 HydrophobicContact CD-CB 4.36Å; K278-D305 VanDerWaalsContact CD-O 3.31Å; K278-D305 WeakPolarHBondContact CD-O 3.34Å; K278-D305 WeakPolarHBondContact CE-O 3.49Å; K278-D305 PolarHBondContact NZ-O 3.41Å; K278-A306 HydrophobicContact CB-CB 3.91Å; K278-A306 HydrophobicContact CD-CB 4.46Å; K278-W393 HydrophobicContact CB-CD2 4.3Å; K278-W393 HydrophobicContact CB-CE3 4.07Å; K278-W393 HydrophobicContact CB-CH2 4.24Å; K278-W393 HydrophobicContact CB-CZ2 4.46Å; K278-W393 HydrophobicContact CB-CZ3 4.05Å; K278-W393 HydrophobicContact CD-CD2 3.58Å; K278-W393 HydrophobicContact CD-CE3 4.2Å; K278-W393 HydrophobicContact CD-CG 3.76Å; K278-W393 HydrophobicContact CD-CZ2 4.1Å; K278-W393 HydrophobicContact CG-CD2 4.05Å; K278-W393 HydrophobicContact CG-CE3 4.29Å; K278-W393 HydrophobicContact CG-CH2 4.08Å; K278-W393 HydrophobicContact CG-CZ2 3.83Å; K278-W393 HydrophobicContact CG-CZ3 4.31Å
279	Y	98.4	Very high	97.9	Very high	88 Å²	88	48.6 Å²	48.6	35%	0.345	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	160	177.1	76.1	-74.1	0	0	0	113.6	I268 G304 D305 A306	I268-Y279 CarbonylContact O-C 3.48Å; I268-Y279 WeakPolarHBondContact O-CA 3.24Å; I268-Y279 WeakPolarHBondContact O-CB 3.33Å; Y279-G304 CarbonylContact O-C 3.54Å; Y279-G304 WeakPolarHBondContact O-CA 3.32Å; Y279-D305 WeakPolarHBondContact CD1-OD1 3.36Å; Y279-D305 PolarHBondContact N-OD1 3.18Å; Y279-D305 PolarHBondContact O-N 3.41Å; Y279-D305 VanDerWaalsContact O-N 3.16Å; Y279-A306 VanDerWaalsContact O-CB 3.24Å; Y279-A306 WeakPolarHBondContact O-CB 3.11Å; Y279-A306 PolarHBondContact O-N 2.98Å
280	A	98.4	Very high	97.9	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	123.9	171.7	0	0	0	0	0	109.7	I268 Y282 Y301 A306 W390	I268-A280 HydrophobicContact CB-CB 4.46Å; I268-A280 PolarHBondContact N-O 3.34Å; I268-A280 PolarHBondContact O-N 2.87Å; A280-Y282 HydrophobicContact CB-CE2 3.8Å; A280-Y301 HydrophobicContact CB-CE2 3.94Å; A280-A306 HydrophobicContact CB-CB 4.22Å; A280-W390 HydrophobicContact CB-CH2 4.32Å; A280-W390 HydrophobicContact CB-CZ2 3.71Å
281	D	98.1	Very high	97.9	Very high	5 Å²	5	53.2 Å²	53.2	3%	0.027	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	135.9	177.3	-70.6	-20.4	0	0	0	111	V265 L266 R267 Y301 F302 G303	V265-D281 HydrophobicContact CG1-CB 4.13Å; L266-D281 CarbonylContact O-C 3.54Å; L266-D281 VanDerWaalsContact O-CA 3.31Å; L266-D281 WeakPolarHBondContact O-CA 3.33Å; R267-D281 WeakPolarHBondContact CA-OD1 3.21Å; R267-D281 VanDerWaalsContact CB-OD1 3.29Å; R267-D281 WeakPolarHBondContact CB-OD1 3.3Å; R267-D281 VanDerWaalsContact CG-OD1 3.32Å; R267-D281 WeakPolarHBondContact CG-OD1 3.16Å; R267-D281 IonicContact CZ-OD1 3.9Å; R267-D281 IonicContact CZ-OD2 2.88Å; R267-D281 IonicContact NE-OD1 3.8Å; R267-D281 PolarHBondContact NE-OD1 3.13Å; R267-D281 IonicContact NE-OD2 3.94Å; R267-D281 IonicContact NH2-OD1 2.83Å; R267-D281 PolarHBondContact NH2-OD1 3.2Å; R267-D281 IonicContact NH2-OD2 3.23Å; R267-D281 PolarHBondContact NH2-OD2 3.5Å; D281-Y301 WeakPolarHBondContact O-CD2 3.38Å; D281-F302 HydrophobicContact CB-CB 3.87Å; D281-F302 HydrophobicContact CB-CD1 4.03Å; D281-F302 HydrophobicContact CB-CG 4.43Å; D281-F302 WeakPolarHBondContact O-CB 3.45Å; D281-F302 PolarHBondContact O-N 3.2Å; D281-G303 PolarHBondContact N-O 2.94Å
282	Y	98	Very high	97.9	Very high	0 Å²	0	55 Å²	55	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	120	178.9	-64.2	-89.8	0	0	0	110.5	V265 L266 I268 A280 Y298 Y301 D308 F310 W390	V265-Y282 WeakPolarHBondContact CA-O 3.36Å; V265-Y282 WeakPolarHBondContact CG1-O 3.38Å; L266-Y282 HydrophobicContact CD2-CD2 4.37Å; L266-Y282 PolarHBondContact N-O 3.03Å; L266-Y282 PolarHBondContact O-N 2.88Å; I268-Y282 HydrophobicContact CD1-CD2 4.41Å; I268-Y282 HydrophobicContact CD1-CE2 4.01Å; A280-Y282 HydrophobicContact CB-CE2 3.8Å; Y282-Y298 HydrophobicContact CD1-CD1 4.26Å; Y282-Y298 AromaticContact CD1-CD2 3.74Å; Y282-Y298 HydrophobicContact CD1-CD2 3.74Å; Y282-Y298 HydrophobicContact CD1-CE1 4.18Å; Y282-Y298 AromaticContact CD1-CE2 3.64Å; Y282-Y298 HydrophobicContact CD1-CE2 3.64Å; Y282-Y298 HydrophobicContact CD1-CG 4.05Å; Y282-Y298 AromaticContact CD1-CZ 3.87Å; Y282-Y298 HydrophobicContact CE1-CE1 4.42Å; Y282-Y298 HydrophobicContact CE1-CE2 4.08Å; Y282-Y298 AromaticContact CE1-CZ 3.98Å; Y282-Y301 HydrophobicContact CD1-CD2 4.05Å; Y282-Y301 AromaticContact CE1-CD2 3.66Å; Y282-Y301 HydrophobicContact CE1-CD2 3.66Å; Y282-Y301 HydrophobicContact CE1-CG 4.4Å; Y282-Y301 HydrophobicContact CE2-CD2 4.4Å; Y282-Y301 AromaticContact CZ-CD2 3.87Å; Y282-D308 WeakPolarHBondContact CE1-OD1 3.38Å; Y282-D308 PolarHBondContact OH-OD1 3.28Å; Y282-F310 HydrophobicContact CD1-CD2 4Å; Y282-F310 AromaticContact CD2-CD2 3.99Å; Y282-F310 HydrophobicContact CD2-CD2 3.99Å; Y282-F310 HydrophobicContact CD2-CE2 4.18Å; Y282-F310 HydrophobicContact CE1-CB 3.73Å; Y282-F310 AromaticContact CE1-CD2 3.64Å; Y282-F310 HydrophobicContact CE1-CD2 3.64Å; Y282-F310 HydrophobicContact CE1-CG 4.06Å; Y282-F310 AromaticContact CE2-CD2 3.62Å; Y282-F310 HydrophobicContact CE2-CD2 3.62Å; Y282-F310 AromaticContact CE2-CE2 3.96Å; Y282-F310 HydrophobicContact CE2-CE2 3.96Å; Y282-F310 HydrophobicContact CE2-CG 4.38Å; Y282-F310 HydrophobicContact CG-CD2 4.16Å; Y282-F310 AromaticContact CZ-CD2 3.42Å; Y282-F310 VanDerWaalsContact CZ-CD2 3.42Å; Y282-F310 AromaticContact CZ-CG 3.82Å; Y282-F310 PolarHBondContact OH-N 3.16Å; Y282-W390 HydrophobicContact CE2-CH2 4.02Å; Y282-W390 HydrophobicContact CE2-CZ2 4.4Å; Y282-W390 WeakPolarHBondContact OH-CH2 3.49Å; Y282-W390 WeakPolarHBondContact OH-CZ2 3.13Å
283	N	95.9	Very high	97.9	Very high	9 Å²	9	57.1 Å²	57.1	5%	0.048	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	152	-175.8	-165.1	9.8	0	0	0	112.1	F285 G299 Y300 F302 V410	N283-F285 PolarHBondContact O-N 2.86Å; N283-G299 PolarHBondContact O-N 2.97Å; N283-Y300 HydrophobicContact CB-CD1 4.31Å; N283-Y300 HydrophobicContact CB-CE1 3.89Å; N283-Y300 HydrophobicContact CB-CE2 4.35Å; N283-Y300 PolarHBondContact N-O 2.79Å; N283-Y300 WeakPolarHBondContact ND2-CE1 3.42Å; N283-Y300 PolarHBondContact ND2-OH 2.79Å; N283-F302 HydrophobicContact CB-CB 4.34Å; N283-F302 HydrophobicContact CB-CD2 4.2Å; N283-V410 WeakPolarHBondContact OD1-CG2 3.26Å
284	M	95.6	Very high	97.9	Very high	94 Å²	94	53.7 Å²	53.7	46%	0.463	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	56	34.5	-176	-49.5	-176.2	179.3	0	0	113.1	P263 T264 R286	P263-M284 HydrophobicContact CB-CB 4.45Å; P263-M284 HydrophobicContact CB-CG 4.07Å; T264-M284 CarbonylContact O-C 3.51Å; T264-M284 WeakPolarHBondContact O-CA 3.44Å; T264-M284 PolarHBondContact O-N 2.91Å; T264-M284 VanDerWaalsContact O-N 3.1Å; M284-R286 PolarHBondContact O-N 2.79Å
285	F	97.6	Very high	98	Very high	1 Å²	1	49.4 Å²	49.4	0%	0.004	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.6	129.1	177.3	171.1	-102	0	0	0	110.8	I214 I253 T257 T264 L266 N283 I287 L296 T297 I407	I214-F285 HydrophobicContact CD1-CE1 4.17Å; I214-F285 HydrophobicContact CD1-CZ 4.13Å; I253-F285 HydrophobicContact CG2-CE1 4.06Å; I253-F285 HydrophobicContact CG2-CZ 4.3Å; T257-F285 HydrophobicContact CG2-CD1 3.6Å; T257-F285 HydrophobicContact CG2-CE1 3.64Å; T264-F285 PolarHBondContact O-N 2.85Å; T264-F285 PolarHBondContact OG1-O 2.88Å; L266-F285 HydrophobicContact CB-CB 3.69Å; L266-F285 HydrophobicContact CB-CD1 3.91Å; L266-F285 HydrophobicContact CB-CD2 3.69Å; L266-F285 HydrophobicContact CB-CE1 4.45Å; L266-F285 HydrophobicContact CB-CE2 4.24Å; L266-F285 HydrophobicContact CB-CG 3.49Å; L266-F285 VanDerWaalsContact CB-CG 3.49Å; L266-F285 HydrophobicContact CD2-CD2 3.66Å; L266-F285 HydrophobicContact CD2-CE2 3.59Å; L266-F285 HydrophobicContact CD2-CG 4.34Å; L266-F285 HydrophobicContact CD2-CZ 4.22Å; L266-F285 HydrophobicContact CG-CD2 4.27Å; L266-F285 HydrophobicContact CG-CE2 4.4Å; L266-F285 HydrophobicContact CG-CG 4.47Å; N283-F285 PolarHBondContact O-N 2.86Å; F285-I287 HydrophobicContact CE1-CD1 4.45Å; F285-I287 HydrophobicContact CE1-CG1 4.18Å; F285-I287 HydrophobicContact CE2-CD1 3.8Å; F285-I287 HydrophobicContact CE2-CG1 4.41Å; F285-I287 HydrophobicContact CZ-CD1 3.6Å; F285-I287 HydrophobicContact CZ-CG1 3.74Å; F285-L296 HydrophobicContact CD2-CD1 3.77Å; F285-L296 HydrophobicContact CE2-CD1 3.41Å; F285-L296 VanDerWaalsContact CE2-CD1 3.41Å; F285-T297 WeakPolarHBondContact CA-O 3.29Å; F285-I407 HydrophobicContact CD1-CG2 3.76Å; F285-I407 HydrophobicContact CE1-CG2 3.74Å
286	R	97	Very high	98	Very high	111 Å²	111	47.2 Å²	47.2	42%	0.419	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	139.8	178.2	-75.6	-176.2	171.1	158.3	-0.9	111.2	M284 T297	M284-R286 PolarHBondContact O-N 2.79Å; R286-T297 WeakPolarHBondContact CB-OG1 3.46Å; R286-T297 PolarHBondContact N-O 2.87Å; R286-T297 PolarHBondContact O-N 2.94Å; R286-T297 VanDerWaalsContact O-O 3.14Å; R286-T297 PolarHBondContact O-OG1 3.45Å; R286-T297 VanDerWaalsContact O-OG1 3.09Å
287	I	97.9	Very high	98	Very high	2 Å²	2	45.9 Å²	45.9	1%	0.01	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	130.5	168.3	-60	-48.2	0	0	0	108.5	I253 H254 T257 F285 Y294 R295 L296 W355	I253-I287 HydrophobicContact CB-CG1 4.44Å; I253-I287 HydrophobicContact CG2-CB 4.3Å; I253-I287 HydrophobicContact CG2-CG1 3.56Å; H254-I287 HydrophobicContact CB-CG2 4.3Å; H254-I287 PolarHBondContact ND1-O 3.09Å; T257-I287 PolarHBondContact OG1-N 3.23Å; F285-I287 HydrophobicContact CE1-CD1 4.45Å; F285-I287 HydrophobicContact CE1-CG1 4.18Å; F285-I287 HydrophobicContact CE2-CD1 3.8Å; F285-I287 HydrophobicContact CE2-CG1 4.41Å; F285-I287 HydrophobicContact CZ-CD1 3.6Å; F285-I287 HydrophobicContact CZ-CG1 3.74Å; I287-Y294 HydrophobicContact CG2-CD1 3.96Å; I287-Y294 HydrophobicContact CG2-CG 4.4Å; I287-R295 CarbonylContact C-O 3.5Å; I287-R295 WeakPolarHBondContact CA-O 3.44Å; I287-L296 HydrophobicContact CD1-CB 4.47Å; I287-L296 HydrophobicContact CD1-CD1 3.97Å; I287-W355 HydrophobicContact CD1-CH2 4.06Å; I287-W355 HydrophobicContact CD1-CZ2 3.29Å; I287-W355 HydrophobicContact CG1-CZ2 4.15Å
288	G	97.8	Very high	98	Very high	16 Å²	16	39.2 Å²	39.2	17%	0.165	20%	0.204	C	C	.	.	P	Polyproline II helix	trans	-65.3	172.8	175.6	0	0	0	0	0	113	H254 Y294 R295	H254-G288 PolarHBondContact ND1-O 3.1Å; G288-Y294 VanDerWaalsContact O-CD1 3.26Å; G288-Y294 WeakPolarHBondContact O-CD1 3.31Å; G288-R295 PolarHBondContact N-O 2.85Å
289	S	98.1	Very high	97.9	Very high	47 Å²	47	38.7 Å²	38.7	33%	0.329	22%	0.215	S	C	.	.	P	Polyproline II helix	trans	-75.2	170.3	175.3	63.6	0	0	0	0	112	A291 D292 M293 Y294	S289-A291 PolarHBondContact O-N 3.36Å; S289-D292 CarbonylContact O-C 3.56Å; S289-D292 PolarHBondContact O-N 2.99Å; S289-M293 PolarHBondContact O-N 2.85Å; S289-Y294 PolarHBondContact O-N 3.14Å
290	E	98.4	Very high	97.8	Very high	62 Å²	62	40 Å²	40	29%	0.29	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-56.5	-33.3	173.9	-165.2	163.5	-160.8	0	0	112.6	W228 R232 D292 M293 Y294	W228-E290 HydrophobicContact CZ2-CG 4.21Å; W228-E290 PolarHBondContact NE1-OE1 3.23Å; R232-E290 WeakPolarHBondContact CD-OE1 3.35Å; R232-E290 WeakPolarHBondContact CD-OE2 3.26Å; R232-E290 IonicContact NH1-OE1 3.15Å; R232-E290 PolarHBondContact NH1-OE1 2.83Å; R232-E290 VanDerWaalsContact NH1-OE1 3.14Å; R232-E290 IonicContact NH1-OE2 2.69Å; R232-E290 PolarHBondContact NH1-OE2 3.01Å; E290-D292 VanDerWaalsContact C-N 3.27Å; E290-D292 PolarHBondContact O-N 3.39Å; E290-M293 WeakPolarHBondContact O-CA 3.4Å; E290-M293 PolarHBondContact O-N 3.2Å; E290-Y294 HydrophobicContact CB-CE1 4.31Å; E290-Y294 HydrophobicContact CB-CE2 3.87Å; E290-Y294 WeakPolarHBondContact CB-OH 3.35Å; E290-Y294 HydrophobicContact CG-CE2 3.75Å
291	A	98.4	Very high	97.8	Very high	93 Å²	93	42.9 Å²	42.9	77%	0.769	23%	0.232	S	C	*	.	G	3₁₀ helix	trans	-67.9	-24.7	177.6	0	0	0	0	0	113.4	S289	S289-A291 PolarHBondContact O-N 3.36Å
292	D	98.6	Very high	97.5	Very high	56 Å²	56	45.3 Å²	45.3	30%	0.299	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-100.1	16.8	170.2	-166	34.2	0	0	0	112	S289 E290 Y294 R295 Q331	S289-D292 CarbonylContact O-C 3.56Å; S289-D292 PolarHBondContact O-N 2.99Å; E290-D292 VanDerWaalsContact C-N 3.27Å; E290-D292 PolarHBondContact O-N 3.39Å; D292-Y294 VanDerWaalsContact C-N 3.32Å; D292-Y294 PolarHBondContact O-N 2.81Å; D292-R295 VanDerWaalsContact CG-NE 3.34Å; D292-R295 PolarHBondContact O-N 3.19Å; D292-R295 IonicContact OD1-CZ 2.75Å; D292-R295 IonicContact OD1-NE 3Å; D292-R295 PolarHBondContact OD1-NE 3.17Å; D292-R295 VanDerWaalsContact OD1-NE 3.14Å; D292-R295 IonicContact OD1-NH2 2.96Å; D292-R295 PolarHBondContact OD1-NH2 2.84Å; D292-R295 VanDerWaalsContact OD2-CB 3.31Å; D292-R295 WeakPolarHBondContact OD2-CB 3.47Å; D292-R295 WeakPolarHBondContact OD2-CD 3.37Å; D292-R295 IonicContact OD2-CZ 3.14Å; D292-R295 IonicContact OD2-NE 3.75Å; D292-R295 PolarHBondContact OD2-NE 2.99Å; D292-R295 IonicContact OD2-NH2 2.65Å; D292-Q331 PolarHBondContact O-NE2 2.78Å; D292-Q331 VanDerWaalsContact O-NE2 3.15Å
293	M	98.8	Very high	97.3	Very high	46 Å²	46	46.4 Å²	46.4	23%	0.227	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.1	41.5	178.7	-49.8	-58.5	175.8	0	0	113.4	W228 S289 E290 R295 Q331 F332 K337 N339	W228-M293 HydrophobicContact CH2-CB 4.01Å; W228-M293 HydrophobicContact CH2-SD 4.27Å; W228-M293 HydrophobicContact CZ2-SD 4.24Å; S289-M293 PolarHBondContact O-N 2.85Å; E290-M293 WeakPolarHBondContact O-CA 3.4Å; E290-M293 PolarHBondContact O-N 3.2Å; M293-R295 PolarHBondContact O-N 3.39Å; M293-Q331 HydrophobicContact CB-CB 3.96Å; M293-Q331 HydrophobicContact CB-CG 4.12Å; M293-F332 WeakPolarHBondContact O-CB 3.32Å; M293-F332 PolarHBondContact O-N 3.01Å; M293-K337 HydrophobicContact SD-CD 4.46Å; M293-K337 WeakPolarHBondContact SD-CE 3.44Å; M293-K337 PolarHBondContact SD-NZ 3.33Å; M293-N339 WeakPolarHBondContact CG-OD1 3.43Å
294	Y	98.8	Very high	97.3	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.3	38.4	176.8	-62.9	-64.7	0	0	0	113.9	W228 R232 N250 E251 H254 I287 G288 S289 E290 D292 L296 W355	W228-Y294 AromaticContact CH2-CD2 3.76Å; W228-Y294 HydrophobicContact CH2-CD2 3.76Å; W228-Y294 HydrophobicContact CH2-CE2 4.47Å; W228-Y294 AromaticContact CZ2-CD2 3.5Å; W228-Y294 HydrophobicContact CZ2-CD2 3.5Å; W228-Y294 AromaticContact CZ2-CE2 3.77Å; W228-Y294 HydrophobicContact CZ2-CE2 3.77Å; R232-Y294 HydrophobicContact CB-CE2 4.34Å; R232-Y294 WeakPolarHBondContact CD-OH 3.39Å; R232-Y294 HydrophobicContact CG-CE2 3.9Å; R232-Y294 VanDerWaalsContact CG-OH 3.26Å; R232-Y294 WeakPolarHBondContact CG-OH 3.38Å; N250-Y294 HydrophobicContact CB-CD1 3.66Å; N250-Y294 HydrophobicContact CB-CD2 3.62Å; N250-Y294 HydrophobicContact CB-CE1 3.98Å; N250-Y294 HydrophobicContact CB-CE2 3.92Å; N250-Y294 HydrophobicContact CB-CG 3.49Å; N250-Y294 VanDerWaalsContact CB-CG 3.49Å; E251-Y294 HydrophobicContact CB-CE1 4.37Å; E251-Y294 VanDerWaalsContact OE2-CE1 3.29Å; E251-Y294 WeakPolarHBondContact OE2-CE1 3.38Å; E251-Y294 PolarHBondContact OE2-OH 3.47Å; H254-Y294 HydrophobicContact CB-CD1 4.31Å; H254-Y294 HydrophobicContact CB-CE1 4.21Å; I287-Y294 HydrophobicContact CG2-CD1 3.96Å; I287-Y294 HydrophobicContact CG2-CG 4.4Å; G288-Y294 VanDerWaalsContact O-CD1 3.26Å; G288-Y294 WeakPolarHBondContact O-CD1 3.31Å; S289-Y294 PolarHBondContact O-N 3.14Å; E290-Y294 HydrophobicContact CB-CE1 4.31Å; E290-Y294 HydrophobicContact CB-CE2 3.87Å; E290-Y294 WeakPolarHBondContact CB-OH 3.35Å; E290-Y294 HydrophobicContact CG-CE2 3.75Å; D292-Y294 VanDerWaalsContact C-N 3.32Å; D292-Y294 PolarHBondContact O-N 2.81Å; Y294-L296 PolarHBondContact O-N 2.82Å; Y294-W355 PolarHBondContact O-NE1 2.88Å
295	R	98.8	Very high	97.4	Very high	63 Å²	63	46.8 Å²	46.8	24%	0.238	26%	0.264	C	S	.	.			trans	-50.3	129.7	-178	-169.5	-173.9	-58.2	-81.9	-4	113	I287 G288 D292 M293 T297 G329 M330 Q331	I287-R295 CarbonylContact C-O 3.5Å; I287-R295 WeakPolarHBondContact CA-O 3.44Å; G288-R295 PolarHBondContact N-O 2.85Å; D292-R295 VanDerWaalsContact CG-NE 3.34Å; D292-R295 PolarHBondContact O-N 3.19Å; D292-R295 IonicContact OD1-CZ 2.75Å; D292-R295 IonicContact OD1-NE 3Å; D292-R295 PolarHBondContact OD1-NE 3.17Å; D292-R295 VanDerWaalsContact OD1-NE 3.14Å; D292-R295 IonicContact OD1-NH2 2.96Å; D292-R295 PolarHBondContact OD1-NH2 2.84Å; D292-R295 VanDerWaalsContact OD2-CB 3.31Å; D292-R295 WeakPolarHBondContact OD2-CB 3.47Å; D292-R295 WeakPolarHBondContact OD2-CD 3.37Å; D292-R295 IonicContact OD2-CZ 3.14Å; D292-R295 IonicContact OD2-NE 3.75Å; D292-R295 PolarHBondContact OD2-NE 2.99Å; D292-R295 IonicContact OD2-NH2 2.65Å; M293-R295 PolarHBondContact O-N 3.39Å; R295-T297 HydrophobicContact CG-CG2 4.32Å; R295-G329 WeakPolarHBondContact CD-O 3.4Å; R295-G329 VanDerWaalsContact CG-O 3.32Å; R295-G329 WeakPolarHBondContact CG-O 3.29Å; R295-G329 PolarHBondContact NH1-O 3.13Å; R295-M330 CarbonylContact C-O 3.57Å; R295-M330 VanDerWaalsContact CA-O 3.29Å; R295-M330 WeakPolarHBondContact CA-O 3.32Å; R295-M330 WeakPolarHBondContact CG-O 3.17Å; R295-Q331 HydrophobicContact CB-CG 4.36Å; R295-Q331 HydrophobicContact CG-CG 4.4Å; R295-Q331 VanDerWaalsContact NH2-CD 3.31Å
296	L	98.7	Very high	97.4	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	128.3	169	173.7	59.2	0	0	0	109.6	F285 I287 Y294 F310 H327 G329 M330 W355	F285-L296 HydrophobicContact CD2-CD1 3.77Å; F285-L296 HydrophobicContact CE2-CD1 3.41Å; F285-L296 VanDerWaalsContact CE2-CD1 3.41Å; I287-L296 HydrophobicContact CD1-CB 4.47Å; I287-L296 HydrophobicContact CD1-CD1 3.97Å; Y294-L296 PolarHBondContact O-N 2.82Å; L296-F310 HydrophobicContact CD2-CD2 4.35Å; L296-F310 HydrophobicContact CD2-CE2 4.22Å; L296-F310 HydrophobicContact CD2-CZ 4.33Å; L296-H327 HydrophobicContact CD2-CB 3.9Å; L296-G329 WeakPolarHBondContact O-CA 3.28Å; L296-G329 PolarHBondContact O-N 2.87Å; L296-M330 PolarHBondContact N-O 3.18Å; L296-W355 HydrophobicContact CB-CB 4.14Å; L296-W355 VanDerWaalsContact CB-CD1 3.44Å; L296-W355 HydrophobicContact CB-CD2 3.74Å; L296-W355 HydrophobicContact CB-CG 3.51Å; L296-W355 HydrophobicContact CD2-CB 4.3Å; L296-W355 HydrophobicContact CD2-CD2 4.04Å; L296-W355 HydrophobicContact CD2-CE3 4.05Å; L296-W355 HydrophobicContact CD2-CG 4.16Å; L296-W355 HydrophobicContact CG-CD2 4.38Å; L296-W355 HydrophobicContact CG-CG 4.45Å
297	T	98.4	Very high	97.5	Very high	53 Å²	53	42.5 Å²	42.5	33%	0.325	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	143.1	166.5	54.5	0	0	0	0	110.4	F285 R286 R295 N328	F285-T297 WeakPolarHBondContact CA-O 3.29Å; R286-T297 WeakPolarHBondContact CB-OG1 3.46Å; R286-T297 PolarHBondContact N-O 2.87Å; R286-T297 PolarHBondContact O-N 2.94Å; R286-T297 VanDerWaalsContact O-O 3.14Å; R286-T297 PolarHBondContact O-OG1 3.45Å; R286-T297 VanDerWaalsContact O-OG1 3.09Å; R295-T297 HydrophobicContact CG-CG2 4.32Å; T297-N328 WeakPolarHBondContact CA-OD1 3.42Å
298	Y	97.8	Very high	97.5	Very high	19 Å²	19	44 Å²	44	8%	0.075	26%	0.263	C	S	.	.			trans	-144.6	154.3	166.9	62.9	-90.2	0	0	0	109.8	Y282 F310 D311 N328	Y282-Y298 HydrophobicContact CD1-CD1 4.26Å; Y282-Y298 AromaticContact CD1-CD2 3.74Å; Y282-Y298 HydrophobicContact CD1-CD2 3.74Å; Y282-Y298 HydrophobicContact CD1-CE1 4.18Å; Y282-Y298 AromaticContact CD1-CE2 3.64Å; Y282-Y298 HydrophobicContact CD1-CE2 3.64Å; Y282-Y298 HydrophobicContact CD1-CG 4.05Å; Y282-Y298 AromaticContact CD1-CZ 3.87Å; Y282-Y298 HydrophobicContact CE1-CE1 4.42Å; Y282-Y298 HydrophobicContact CE1-CE2 4.08Å; Y282-Y298 AromaticContact CE1-CZ 3.98Å; Y298-F310 HydrophobicContact CD1-CD2 4.49Å; Y298-F310 HydrophobicContact CE1-CB 3.7Å; Y298-F310 HydrophobicContact CE1-CD2 4.1Å; Y298-F310 HydrophobicContact CE1-CG 4.33Å; Y298-F310 WeakPolarHBondContact OH-CB 3.34Å; Y298-D311 PolarHBondContact OH-N 3.47Å; Y298-N328 HydrophobicContact CD1-CB 4.07Å; Y298-N328 HydrophobicContact CE1-CB 3.4Å; Y298-N328 PolarHBondContact N-OD1 3.19Å; Y298-N328 PolarHBondContact O-ND2 3.15Å
299	G	96.8	Very high	97.5	Very high	47 Å²	47	43.2 Å²	43.2	49%	0.485	26%	0.255	S	S	.	.	S	Bend	trans	-74.8	-48.3	-176.9	0	0	0	0	0	112.5	N283	N283-G299 PolarHBondContact O-N 2.97Å
300	Y	96.2	Very high	97.5	Very high	117 Å²	117	41 Å²	41	46%	0.459	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.8	158.9	175.9	61.2	-79.8	0	0	0	111	N283 F302	N283-Y300 HydrophobicContact CB-CD1 4.31Å; N283-Y300 HydrophobicContact CB-CE1 3.89Å; N283-Y300 HydrophobicContact CB-CE2 4.35Å; N283-Y300 PolarHBondContact N-O 2.79Å; N283-Y300 WeakPolarHBondContact ND2-CE1 3.42Å; N283-Y300 PolarHBondContact ND2-OH 2.79Å; Y300-F302 AromaticContact CE2-CD2 3.93Å; Y300-F302 HydrophobicContact CE2-CD2 3.93Å; Y300-F302 PolarHBondContact O-N 3.35Å
301	Y	97.6	Very high	97.5	Very high	59 Å²	59	42 Å²	42	23%	0.231	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	121.7	169.1	174.4	-113	0	0	0	110.7	A280 D281 Y282 G303 G304 G307 D308	A280-Y301 HydrophobicContact CB-CE2 3.94Å; D281-Y301 WeakPolarHBondContact O-CD2 3.38Å; Y282-Y301 HydrophobicContact CD1-CD2 4.05Å; Y282-Y301 AromaticContact CE1-CD2 3.66Å; Y282-Y301 HydrophobicContact CE1-CD2 3.66Å; Y282-Y301 HydrophobicContact CE1-CG 4.4Å; Y282-Y301 HydrophobicContact CE2-CD2 4.4Å; Y282-Y301 AromaticContact CZ-CD2 3.87Å; Y301-G303 VanDerWaalsContact CZ-C 3.44Å; Y301-G304 WeakPolarHBondContact OH-CA 3.4Å; Y301-G304 PolarHBondContact OH-N 3.03Å; Y301-G304 PolarHBondContact OH-O 3.2Å; Y301-G304 VanDerWaalsContact OH-O 3.13Å; Y301-G307 WeakPolarHBondContact OH-CA 3.36Å; Y301-G307 PolarHBondContact OH-N 3.4Å; Y301-D308 WeakPolarHBondContact CB-OD2 3.45Å; Y301-D308 HydrophobicContact CD1-CB 3.89Å; Y301-D308 HydrophobicContact CD2-CB 3.86Å; Y301-D308 HydrophobicContact CE1-CB 4.12Å; Y301-D308 HydrophobicContact CE2-CB 4.1Å; Y301-D308 HydrophobicContact CG-CB 3.72Å
302	F	92.4	Very high	97.5	Very high	56 Å²	56	37.7 Å²	37.7	25%	0.246	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	-26	-173.9	-169.2	-106.3	0	0	0	112.5	D281 N283 Y300 I413 A415	D281-F302 HydrophobicContact CB-CB 3.87Å; D281-F302 HydrophobicContact CB-CD1 4.03Å; D281-F302 HydrophobicContact CB-CG 4.43Å; D281-F302 WeakPolarHBondContact O-CB 3.45Å; D281-F302 PolarHBondContact O-N 3.2Å; N283-F302 HydrophobicContact CB-CB 4.34Å; N283-F302 HydrophobicContact CB-CD2 4.2Å; Y300-F302 AromaticContact CE2-CD2 3.93Å; Y300-F302 HydrophobicContact CE2-CD2 3.93Å; Y300-F302 PolarHBondContact O-N 3.35Å; F302-I413 HydrophobicContact CD1-CG2 4.36Å; F302-I413 HydrophobicContact CE1-CG2 3.54Å; F302-I413 HydrophobicContact CZ-CG2 4.05Å; F302-A415 HydrophobicContact CZ-CB 3.95Å
303	G	94.4	Very high	97.4	Very high	23 Å²	23	38.4 Å²	38.4	24%	0.237	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	137	174.4	177.4	0	0	0	0	0	113.1	D281 Y301	D281-G303 PolarHBondContact N-O 2.94Å; Y301-G303 VanDerWaalsContact CZ-C 3.44Å
304	G	95.8	Very high	97.3	Very high	30 Å²	30	40.6 Å²	40.6	31%	0.309	23%	0.225	S	C	.	.			trans	150.4	163.3	-177.3	0	0	0	0	0	111.3	Y279 Y301	Y279-G304 CarbonylContact O-C 3.54Å; Y279-G304 WeakPolarHBondContact O-CA 3.32Å; Y301-G304 WeakPolarHBondContact OH-CA 3.4Å; Y301-G304 PolarHBondContact OH-N 3.03Å; Y301-G304 PolarHBondContact OH-O 3.2Å; Y301-G304 VanDerWaalsContact OH-O 3.13Å
305	D	97.6	Very high	96.9	Very high	82 Å²	82	43 Å²	43	44%	0.439	24%	0.237	S	C	.	.	S	Bend	trans	-90.6	-12.9	176.2	52.1	8.9	0	0	0	112.9	K278 Y279 G307	K278-D305 WeakPolarHBondContact CA-OD1 3.35Å; K278-D305 VanDerWaalsContact CB-OD1 3.3Å; K278-D305 WeakPolarHBondContact CB-OD1 3.2Å; K278-D305 HydrophobicContact CD-CB 4.36Å; K278-D305 VanDerWaalsContact CD-O 3.31Å; K278-D305 WeakPolarHBondContact CD-O 3.34Å; K278-D305 WeakPolarHBondContact CE-O 3.49Å; K278-D305 PolarHBondContact NZ-O 3.41Å; Y279-D305 WeakPolarHBondContact CD1-OD1 3.36Å; Y279-D305 PolarHBondContact N-OD1 3.18Å; Y279-D305 PolarHBondContact O-N 3.41Å; Y279-D305 VanDerWaalsContact O-N 3.16Å; D305-G307 VanDerWaalsContact C-N 3.29Å
306	A	97.5	Very high	96.6	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	26%	0.258	C	S	.	.	S	Bend	trans	-73.9	-16.6	174.1	0	0	0	0	0	113.6	L270 K278 Y279 A280 W390 T392	L270-A306 HydrophobicContact CD1-CB 3.99Å; K278-A306 HydrophobicContact CB-CB 3.91Å; K278-A306 HydrophobicContact CD-CB 4.46Å; Y279-A306 VanDerWaalsContact O-CB 3.24Å; Y279-A306 WeakPolarHBondContact O-CB 3.11Å; Y279-A306 PolarHBondContact O-N 2.98Å; A280-A306 HydrophobicContact CB-CB 4.22Å; A306-W390 PolarHBondContact O-NE1 3.1Å; A306-T392 CarbonylContact O-C 3.53Å; A306-T392 WeakPolarHBondContact O-CB 3.38Å; A306-T392 PolarHBondContact O-OG1 2.96Å
307	G	97.9	Very high	96.1	Very high	22 Å²	22	49.7 Å²	49.7	23%	0.227	29%	0.289	C	S	.	.			trans	76.1	170.7	-171.5	0	0	0	0	0	113.9	Y301 D305 W390	Y301-G307 WeakPolarHBondContact OH-CA 3.36Å; Y301-G307 PolarHBondContact OH-N 3.4Å; D305-G307 VanDerWaalsContact C-N 3.29Å; G307-W390 WeakPolarHBondContact O-CZ2 3.24Å; G307-W390 PolarHBondContact O-NE1 3.47Å
308	D	98.3	Very high	95.8	Very high	33 Å²	33	50.7 Å²	50.7	18%	0.176	29%	0.292	C	S	.	.			trans	-93.9	91.6	179.6	-174.3	-8.1	0	0	0	111	Y282 Y301 F310 D311 T392	Y282-D308 WeakPolarHBondContact CE1-OD1 3.38Å; Y282-D308 PolarHBondContact OH-OD1 3.28Å; Y301-D308 WeakPolarHBondContact CB-OD2 3.45Å; Y301-D308 HydrophobicContact CD1-CB 3.89Å; Y301-D308 HydrophobicContact CD2-CB 3.86Å; Y301-D308 HydrophobicContact CE1-CB 4.12Å; Y301-D308 HydrophobicContact CE2-CB 4.1Å; Y301-D308 HydrophobicContact CG-CB 3.72Å; D308-F310 PolarHBondContact OD1-N 3.49Å; D308-D311 HydrophobicContact CB-CB 4.4Å; D308-D311 VanDerWaalsContact CG-CB 3.49Å; D308-D311 PolarHBondContact OD1-N 2.73Å; D308-D311 WeakPolarHBondContact OD2-CB 3.33Å; D308-T392 WeakPolarHBondContact O-CG2 3.33Å
309	A	98.2	Very high	95.6	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	33%	0.33	C	S	.	.	S	Bend	trans	-85.1	-9.8	173.6	0	0	0	0	0	113.2	G312 H327 A362 W390 T392	A309-G312 PolarHBondContact O-N 2.63Å; A309-H327 PolarHBondContact O-CE1 3.27Å; A309-H327 PolarHBondContact O-ND1 3.36Å; A309-A362 HydrophobicContact CB-CB 3.81Å; A309-W390 HydrophobicContact CB-CD2 3.74Å; A309-W390 VanDerWaalsContact CB-CE2 3.49Å; A309-W390 HydrophobicContact CB-CE3 4.16Å; A309-W390 HydrophobicContact CB-CG 4.19Å; A309-W390 HydrophobicContact CB-CH2 4.15Å; A309-W390 HydrophobicContact CB-CZ2 3.73Å; A309-W390 HydrophobicContact CB-CZ3 4.36Å; A309-T392 HydrophobicContact CB-CG2 4.14Å
310	F	98.5	Very high	95.5	Very high	1 Å²	1	55.5 Å²	55.5	0%	0.004	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-23.6	174.6	-73.8	-20.3	0	0	0	113.1	L266 I268 Y282 L296 Y298 D308 G312 S326 H327 W354 A362 W390	L266-F310 HydrophobicContact CD2-CE2 3.97Å; I268-F310 HydrophobicContact CD1-CE2 3.71Å; I268-F310 HydrophobicContact CD1-CZ 3.67Å; Y282-F310 HydrophobicContact CD1-CD2 4Å; Y282-F310 AromaticContact CD2-CD2 3.99Å; Y282-F310 HydrophobicContact CD2-CD2 3.99Å; Y282-F310 HydrophobicContact CD2-CE2 4.18Å; Y282-F310 HydrophobicContact CE1-CB 3.73Å; Y282-F310 AromaticContact CE1-CD2 3.64Å; Y282-F310 HydrophobicContact CE1-CD2 3.64Å; Y282-F310 HydrophobicContact CE1-CG 4.06Å; Y282-F310 AromaticContact CE2-CD2 3.62Å; Y282-F310 HydrophobicContact CE2-CD2 3.62Å; Y282-F310 AromaticContact CE2-CE2 3.96Å; Y282-F310 HydrophobicContact CE2-CE2 3.96Å; Y282-F310 HydrophobicContact CE2-CG 4.38Å; Y282-F310 HydrophobicContact CG-CD2 4.16Å; Y282-F310 AromaticContact CZ-CD2 3.42Å; Y282-F310 VanDerWaalsContact CZ-CD2 3.42Å; Y282-F310 AromaticContact CZ-CG 3.82Å; Y282-F310 PolarHBondContact OH-N 3.16Å; L296-F310 HydrophobicContact CD2-CD2 4.35Å; L296-F310 HydrophobicContact CD2-CE2 4.22Å; L296-F310 HydrophobicContact CD2-CZ 4.33Å; Y298-F310 HydrophobicContact CD1-CD2 4.49Å; Y298-F310 HydrophobicContact CE1-CB 3.7Å; Y298-F310 HydrophobicContact CE1-CD2 4.1Å; Y298-F310 HydrophobicContact CE1-CG 4.33Å; Y298-F310 WeakPolarHBondContact OH-CB 3.34Å; D308-F310 PolarHBondContact OD1-N 3.49Å; F310-G312 PolarHBondContact O-N 2.87Å; F310-S326 CarbonylContact O-C 3.56Å; F310-S326 WeakPolarHBondContact O-CA 3.4Å; F310-H327 HydrophobicContact CB-CB 4.4Å; F310-H327 HydrophobicContact CD1-CB 3.9Å; F310-H327 AromaticContact CD1-CG 3.76Å; F310-H327 AromaticContact CD1-ND1 3.67Å; F310-H327 HydrophobicContact CE1-CB 4.5Å; F310-H327 HydrophobicContact CG-CB 4.33Å; F310-H327 PolarHBondContact O-N 2.95Å; F310-W354 AromaticContact CE1-CZ2 3.97Å; F310-W354 HydrophobicContact CE1-CZ2 3.97Å; F310-W354 HydrophobicContact CZ-CZ2 4.3Å; F310-A362 HydrophobicContact CD1-CB 3.91Å; F310-A362 HydrophobicContact CE1-CB 3.9Å; F310-W390 HydrophobicContact CD1-CH2 4.38Å; F310-W390 HydrophobicContact CD1-CZ3 4.45Å; F310-W390 HydrophobicContact CE1-CH2 4.37Å; F310-W390 HydrophobicContact CE1-CZ3 4.13Å; F310-W390 HydrophobicContact CZ-CZ3 4.44Å
311	D	98.2	Very high	95.4	Very high	83 Å²	83	50.9 Å²	50.9	44%	0.444	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	0.2	165	-169.7	55.9	0	0	0	112.9	Y298 D308 K322	Y298-D311 PolarHBondContact OH-N 3.47Å; D308-D311 HydrophobicContact CB-CB 4.4Å; D308-D311 VanDerWaalsContact CG-CB 3.49Å; D308-D311 PolarHBondContact OD1-N 2.73Å; D308-D311 WeakPolarHBondContact OD2-CB 3.33Å; D311-K322 PolarHBondContact O-NZ 3.46Å; D311-K322 VanDerWaalsContact OD2-CE 3.25Å; D311-K322 WeakPolarHBondContact OD2-CE 3.16Å; D311-K322 IonicContact OD2-NZ 3.31Å; D311-K322 PolarHBondContact OD2-NZ 3.27Å
312	G	97.7	Very high	95.3	Very high	2 Å²	2	51.9 Å²	51.9	2%	0.021	31%	0.307	C	S	.	.			trans	79.7	165.5	178.3	0	0	0	0	0	113.9	A309 F310 K322	A309-G312 PolarHBondContact O-N 2.63Å; F310-G312 PolarHBondContact O-N 2.87Å; G312-K322 PolarHBondContact O-NZ 2.69Å
313	F	97.4	Very high	95.6	Very high	71 Å²	71	56.2 Å²	56.2	31%	0.311	33%	0.326	S	S	.	.			trans	-129.7	140.4	-173.8	-169.1	-93.8	0	0	0	111.3	L315 D321 K322 T325 A361 L391 T392	F313-L315 HydrophobicContact CD1-CD2 4.08Å; F313-L315 HydrophobicContact CD1-CG 4.36Å; F313-L315 HydrophobicContact CE1-CD2 4.41Å; F313-L315 PolarHBondContact O-N 3.38Å; F313-D321 CarbonylContact O-C 3.57Å; F313-K322 WeakPolarHBondContact O-CA 3.38Å; F313-K322 PolarHBondContact O-N 3.03Å; F313-T325 PolarHBondContact N-OG1 2.88Å; F313-T325 PolarHBondContact O-OG1 3.04Å; F313-T325 VanDerWaalsContact O-OG1 3.11Å; F313-A361 HydrophobicContact CB-CB 3.69Å; F313-L391 HydrophobicContact CB-CB 3.79Å; F313-L391 HydrophobicContact CB-CD1 3.92Å; F313-L391 HydrophobicContact CD1-CB 3.91Å; F313-L391 HydrophobicContact CD1-CD1 3.94Å; F313-L391 HydrophobicContact CD2-CB 3.89Å; F313-L391 HydrophobicContact CE1-CB 4.47Å; F313-L391 HydrophobicContact CE2-CB 4.45Å; F313-L391 VanDerWaalsContact CE2-O 3.31Å; F313-L391 WeakPolarHBondContact CE2-O 3.42Å; F313-L391 HydrophobicContact CG-CB 3.59Å; F313-L391 HydrophobicContact CG-CD1 4.13Å; F313-T392 HydrophobicContact CD2-CG2 4Å
314	D	96	Very high	95.7	Very high	92 Å²	92	57.1 Å²	57.1	49%	0.492	32%	0.324	S	S	.	.			trans	-86.3	106.8	173.9	-175.6	-3	0	0	0	108.6	G316 K322	D314-G316 WeakPolarHBondContact OD1-CA 3.47Å; D314-G316 PolarHBondContact OD1-N 2.66Å; D314-K322 HydrophobicContact CB-CB 4.39Å
315	L	91.1	Very high	95.8	Very high	51 Å²	51	56.1 Å²	56.1	27%	0.267	31%	0.312	S	S	.	.			trans	-77	-13.7	177.8	-71.1	167.7	0	0	0	111.9	F313 E317 D321 L391	F313-L315 HydrophobicContact CD1-CD2 4.08Å; F313-L315 HydrophobicContact CD1-CG 4.36Å; F313-L315 HydrophobicContact CE1-CD2 4.41Å; F313-L315 PolarHBondContact O-N 3.38Å; L315-E317 VanDerWaalsContact C-N 3.27Å; L315-E317 HydrophobicContact CB-CG 4.35Å; L315-D321 HydrophobicContact CB-CB 4.44Å; L315-D321 WeakPolarHBondContact CB-OD2 3.49Å; L315-L391 HydrophobicContact CD2-CD1 3.8Å; L315-L391 HydrophobicContact CG-CD1 4.42Å
316	G	91.9	Very high	95.8	Very high	66 Å²	66	53.1 Å²	53.1	68%	0.68	30%	0.297	S	S	*	.	S	Bend	trans	74.8	13.3	-173.9	0	0	0	0	0	114	D314 D321	D314-G316 WeakPolarHBondContact OD1-CA 3.47Å; D314-G316 PolarHBondContact OD1-N 2.66Å; G316-D321 PolarHBondContact N-OD2 2.79Å
317	E	88.8	Confident	95.9	Very high	136 Å²	136	53.1 Å²	53.1	64%	0.636	30%	0.297	S	S	*	.	S	Bend	trans	-90.3	-42.3	177.9	-67.7	175.6	-160.5	0	0	110.3	L315 D321 R396	L315-E317 VanDerWaalsContact C-N 3.27Å; L315-E317 HydrophobicContact CB-CG 4.35Å; E317-D321 PolarHBondContact N-OD2 2.85Å; E317-R396 IonicContact OE1-NH1 3.05Å; E317-R396 PolarHBondContact OE1-NH1 3.45Å; E317-R396 IonicContact OE2-NH1 3.3Å; E317-R396 PolarHBondContact OE2-NH1 2.81Å
318	D	92.3	Very high	95.9	Very high	74 Å²	74	55 Å²	55	40%	0.396	30%	0.302	S	S	.	.			trans	-140.1	139.9	173	-171.8	-72.4	0	0	0	111.3	S320 D321	D318-S320 PolarHBondContact O-N 3.1Å; D318-S320 VanDerWaalsContact OD1-CB 3.32Å; D318-S320 WeakPolarHBondContact OD1-CB 3.39Å; D318-S320 PolarHBondContact OD1-N 3.16Å; D318-S320 PolarHBondContact OD1-OG 2.81Å; D318-D321 PolarHBondContact N-OD1 2.9Å; D318-D321 PolarHBondContact N-OD2 2.9Å; D318-D321 VanDerWaalsContact O-CB 3.29Å; D318-D321 WeakPolarHBondContact O-CB 3.5Å; D318-D321 PolarHBondContact O-N 3.4Å; D318-D321 VanDerWaalsContact O-OD2 3.13Å
319	P	92.4	Very high	95.9	Very high	133 Å²	133	54.4 Å²	54.4	86%	0.864	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-13.1	177	-25.7	35.2	0	0	0	115.9
320	S	94.9	Very high	95.9	Very high	35 Å²	35	55.7 Å²	55.7	25%	0.245	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-1.7	174.9	65.1	0	0	0	0	114.6	D318 K322 F323 H324	D318-S320 PolarHBondContact O-N 3.1Å; D318-S320 VanDerWaalsContact OD1-CB 3.32Å; D318-S320 WeakPolarHBondContact OD1-CB 3.39Å; D318-S320 PolarHBondContact OD1-N 3.16Å; D318-S320 PolarHBondContact OD1-OG 2.81Å; S320-K322 VanDerWaalsContact C-N 3.32Å; S320-K322 PolarHBondContact O-N 3.15Å; S320-F323 WeakPolarHBondContact O-CB 3.49Å; S320-F323 PolarHBondContact O-N 3.14Å; S320-H324 WeakPolarHBondContact O-CB 3.24Å; S320-H324 PolarHBondContact O-N 2.78Å; S320-H324 PolarHBondContact OG-CD2 2.83Å; S320-H324 VanDerWaalsContact OG-CD2 3.23Å
321	D	94.3	Very high	95.9	Very high	20 Å²	20	57.3 Å²	57.3	11%	0.107	32%	0.317	C	S	.	.	H	α-helix	trans	-49.6	-48.4	-177.9	-75.4	-21.3	0	0	0	112.6	F313 L315 G316 E317 D318 F323 H324 T325	F313-D321 CarbonylContact O-C 3.57Å; L315-D321 HydrophobicContact CB-CB 4.44Å; L315-D321 WeakPolarHBondContact CB-OD2 3.49Å; G316-D321 PolarHBondContact N-OD2 2.79Å; E317-D321 PolarHBondContact N-OD2 2.85Å; D318-D321 PolarHBondContact N-OD1 2.9Å; D318-D321 PolarHBondContact N-OD2 2.9Å; D318-D321 VanDerWaalsContact O-CB 3.29Å; D318-D321 WeakPolarHBondContact O-CB 3.5Å; D318-D321 PolarHBondContact O-N 3.4Å; D318-D321 VanDerWaalsContact O-OD2 3.13Å; D321-F323 VanDerWaalsContact C-N 3.34Å; D321-F323 PolarHBondContact O-N 3.15Å; D321-H324 CarbonylContact O-C 3.41Å; D321-H324 PolarHBondContact O-N 2.88Å; D321-H324 VanDerWaalsContact O-N 3.14Å; D321-T325 WeakPolarHBondContact O-CB 3.31Å; D321-T325 WeakPolarHBondContact O-CG2 3.5Å; D321-T325 PolarHBondContact O-N 3.01Å; D321-T325 PolarHBondContact O-OG1 3.46Å
322	K	96.8	Very high	96	Very high	80 Å²	80	53.3 Å²	53.3	35%	0.348	30%	0.296	S	S	.	.	H	α-helix	trans	-60.6	-41.1	179.6	178.8	166.6	176.9	56.7	0	112.9	D311 G312 F313 D314 S320 S326	D311-K322 PolarHBondContact O-NZ 3.46Å; D311-K322 VanDerWaalsContact OD2-CE 3.25Å; D311-K322 WeakPolarHBondContact OD2-CE 3.16Å; D311-K322 IonicContact OD2-NZ 3.31Å; D311-K322 PolarHBondContact OD2-NZ 3.27Å; G312-K322 PolarHBondContact O-NZ 2.69Å; F313-K322 WeakPolarHBondContact O-CA 3.38Å; F313-K322 PolarHBondContact O-N 3.03Å; D314-K322 HydrophobicContact CB-CB 4.39Å; S320-K322 VanDerWaalsContact C-N 3.32Å; S320-K322 PolarHBondContact O-N 3.15Å; K322-S326 PolarHBondContact O-N 3.05Å
323	F	97.2	Very high	96	Very high	146 Å²	146	53.2 Å²	53.2	64%	0.64	30%	0.295	S	S	*	.	H	α-helix	trans	-66.7	-43	175.9	172.7	-100.4	0	0	0	110.8	S320 D321 T325 S326 N357	S320-F323 WeakPolarHBondContact O-CB 3.49Å; S320-F323 PolarHBondContact O-N 3.14Å; D321-F323 VanDerWaalsContact C-N 3.34Å; D321-F323 PolarHBondContact O-N 3.15Å; F323-T325 VanDerWaalsContact C-N 3.33Å; F323-T325 PolarHBondContact O-N 3.43Å; F323-S326 PolarHBondContact O-N 3.12Å; F323-S326 PolarHBondContact O-OG 3.41Å; F323-N357 PolarHBondContact O-ND2 2.99Å
324	H	97	Very high	96.1	Very high	43 Å²	43	49.9 Å²	49.9	20%	0.199	28%	0.281	C	S	.	.	H	α-helix	trans	-73.5	-17.6	-177.1	-87.8	-40.1	0	0	0	115.3	S320 D321 N357 R358	S320-H324 WeakPolarHBondContact O-CB 3.24Å; S320-H324 PolarHBondContact O-N 2.78Å; S320-H324 PolarHBondContact OG-CD2 2.83Å; S320-H324 VanDerWaalsContact OG-CD2 3.23Å; D321-H324 CarbonylContact O-C 3.41Å; D321-H324 PolarHBondContact O-N 2.88Å; D321-H324 VanDerWaalsContact O-N 3.14Å; H324-N357 WeakPolarHBondContact O-CB 3.38Å; H324-N357 PolarHBondContact O-ND2 3.29Å; H324-N357 PolarHBondContact O-OD1 2.96Å; H324-R358 HydrophobicContact CB-CB 3.82Å; H324-R358 PolarHBondContact NE2-NH1 2.82Å; H324-R358 WeakPolarHBondContact O-CA 3.35Å; H324-R358 WeakPolarHBondContact O-CB 3.37Å; H324-R358 PolarHBondContact O-N 2.6Å
325	T	97.8	Very high	96.2	Very high	8 Å²	8	48.3 Å²	48.3	5%	0.049	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.1	5.1	177.2	59.1	0	0	0	0	113.4	F313 D321 F323 H327 H360 A361	F313-T325 PolarHBondContact N-OG1 2.88Å; F313-T325 PolarHBondContact O-OG1 3.04Å; F313-T325 VanDerWaalsContact O-OG1 3.11Å; D321-T325 WeakPolarHBondContact O-CB 3.31Å; D321-T325 WeakPolarHBondContact O-CG2 3.5Å; D321-T325 PolarHBondContact O-N 3.01Å; D321-T325 PolarHBondContact O-OG1 3.46Å; F323-T325 VanDerWaalsContact C-N 3.33Å; F323-T325 PolarHBondContact O-N 3.43Å; T325-H327 PolarHBondContact O-CE1 3.49Å; T325-H327 PolarHBondContact O-ND1 2.87Å; T325-H327 VanDerWaalsContact O-ND1 3.09Å; T325-H360 VanDerWaalsContact CG2-O 3.3Å; T325-H360 WeakPolarHBondContact CG2-O 3.43Å; T325-A361 PolarHBondContact O-N 2.91Å
326	S	98.2	Very high	96.6	Very high	20 Å²	20	49.8 Å²	49.8	14%	0.14	28%	0.279	C	S	.	.			trans	-76.1	145.7	175.1	68.5	0	0	0	0	112.2	F310 K322 F323 M330 N357	F310-S326 CarbonylContact O-C 3.56Å; F310-S326 WeakPolarHBondContact O-CA 3.4Å; K322-S326 PolarHBondContact O-N 3.05Å; F323-S326 PolarHBondContact O-N 3.12Å; F323-S326 PolarHBondContact O-OG 3.41Å; S326-M330 WeakPolarHBondContact O-CG 3.16Å; S326-N357 VanDerWaalsContact O-CB 3.23Å; S326-N357 WeakPolarHBondContact O-CB 3.47Å; S326-N357 PolarHBondContact O-ND2 2.99Å; S326-N357 PolarHBondContact OG-ND2 3.49Å
327	H	98.6	Very high	96.9	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.258	C	S	.	.			trans	-115	-15.1	-171.3	-49.1	75.2	0	0	0	113.4	L296 A309 F310 T325 G329 M330 W354 W355 A361 A362	L296-H327 HydrophobicContact CD2-CB 3.9Å; A309-H327 PolarHBondContact O-CE1 3.27Å; A309-H327 PolarHBondContact O-ND1 3.36Å; F310-H327 HydrophobicContact CB-CB 4.4Å; F310-H327 HydrophobicContact CD1-CB 3.9Å; F310-H327 AromaticContact CD1-CG 3.76Å; F310-H327 AromaticContact CD1-ND1 3.67Å; F310-H327 HydrophobicContact CE1-CB 4.5Å; F310-H327 HydrophobicContact CG-CB 4.33Å; F310-H327 PolarHBondContact O-N 2.95Å; T325-H327 PolarHBondContact O-CE1 3.49Å; T325-H327 PolarHBondContact O-ND1 2.87Å; T325-H327 VanDerWaalsContact O-ND1 3.09Å; H327-G329 PolarHBondContact O-N 2.93Å; H327-M330 WeakPolarHBondContact O-CB 3.39Å; H327-M330 PolarHBondContact O-N 3.28Å; H327-W354 AromaticContact CD2-NE1 3.5Å; H327-W354 AromaticContact NE2-NE1 3.66Å; H327-W355 PolarHBondContact CD2-O 3.42Å; H327-A361 PolarHBondContact CE1-N 3.03Å; H327-A361 PolarHBondContact NE2-N 3.43Å; H327-A362 PolarHBondContact CE1-N 3.28Å; H327-A362 VanDerWaalsContact CE1-N 3.33Å; H327-A362 PolarHBondContact NE2-N 2.98Å; H327-A362 PolarHBondContact NE2-O 3.08Å; H327-A362 VanDerWaalsContact NE2-O 3.17Å
328	N	98.5	Very high	97.3	Very high	62 Å²	62	46 Å²	46	33%	0.332	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	125.6	179.4	-157.3	-1.4	0	0	0	110.6	T297 Y298 M330	T297-N328 WeakPolarHBondContact CA-OD1 3.42Å; Y298-N328 HydrophobicContact CD1-CB 4.07Å; Y298-N328 HydrophobicContact CE1-CB 3.4Å; Y298-N328 PolarHBondContact N-OD1 3.19Å; Y298-N328 PolarHBondContact O-ND2 3.15Å; N328-M330 VanDerWaalsContact C-N 3.3Å
329	G	98.4	Very high	97.6	Very high	20 Å²	20	43.9 Å²	43.9	21%	0.206	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.6	0.8	-174.2	0	0	0	0	0	114.9	R295 L296 H327	R295-G329 WeakPolarHBondContact CD-O 3.4Å; R295-G329 VanDerWaalsContact CG-O 3.32Å; R295-G329 WeakPolarHBondContact CG-O 3.29Å; R295-G329 PolarHBondContact NH1-O 3.13Å; L296-G329 WeakPolarHBondContact O-CA 3.28Å; L296-G329 PolarHBondContact O-N 2.87Å; H327-G329 PolarHBondContact O-N 2.93Å
330	M	98.8	Very high	97.9	Very high	26 Å²	26	38.1 Å²	38.1	13%	0.128	20%	0.195	C	C	.	.	P	Polyproline II helix	trans	-74.9	144.2	176.9	-68.9	-55.3	110.7	0	0	112.3	R295 L296 S326 H327 N328 K341 W355 N357	R295-M330 CarbonylContact C-O 3.57Å; R295-M330 VanDerWaalsContact CA-O 3.29Å; R295-M330 WeakPolarHBondContact CA-O 3.32Å; R295-M330 WeakPolarHBondContact CG-O 3.17Å; L296-M330 PolarHBondContact N-O 3.18Å; S326-M330 WeakPolarHBondContact O-CG 3.16Å; H327-M330 WeakPolarHBondContact O-CB 3.39Å; H327-M330 PolarHBondContact O-N 3.28Å; N328-M330 VanDerWaalsContact C-N 3.3Å; M330-K341 HydrophobicContact SD-CG 3.87Å; M330-W355 HydrophobicContact CB-CB 4.06Å; M330-N357 HydrophobicContact CG-CB 3.81Å; M330-N357 HydrophobicContact SD-CB 3.64Å
331	Q	98.8	Very high	98	Very high	35 Å²	35	41.2 Å²	41.2	16%	0.164	20%	0.204	C	C	.	.	P	Polyproline II helix	trans	-80.1	153.6	173	-71	-179.9	-71.8	0	0	109.6	D292 M293 R295 N339 W355	D292-Q331 PolarHBondContact O-NE2 2.78Å; D292-Q331 VanDerWaalsContact O-NE2 3.15Å; M293-Q331 HydrophobicContact CB-CB 3.96Å; M293-Q331 HydrophobicContact CB-CG 4.12Å; R295-Q331 HydrophobicContact CB-CG 4.36Å; R295-Q331 HydrophobicContact CG-CG 4.4Å; R295-Q331 VanDerWaalsContact NH2-CD 3.31Å; Q331-N339 HydrophobicContact CB-CB 3.62Å; Q331-W355 WeakPolarHBondContact O-CA 3.45Å
332	F	98.9	Very high	98.1	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	21%	0.214	C	C	.	.	P	Polyproline II helix	trans	-73.9	138.7	174.4	-157.1	-95.3	0	0	0	109.3	W228 Y231 W247 N250 M293 T334 N339 G353 W355	W228-F332 HydrophobicContact CE3-CD1 4.48Å; W228-F332 HydrophobicContact CH2-CB 4.34Å; W228-F332 HydrophobicContact CZ3-CB 4.13Å; W228-F332 HydrophobicContact CZ3-CD1 4.02Å; W228-F332 WeakPolarHBondContact CZ3-O 3.36Å; Y231-F332 AromaticContact CD1-CE1 3.67Å; Y231-F332 HydrophobicContact CD1-CE1 3.67Å; Y231-F332 AromaticContact CD1-CZ 3.41Å; Y231-F332 HydrophobicContact CD1-CZ 3.41Å; Y231-F332 VanDerWaalsContact CD1-CZ 3.41Å; Y231-F332 HydrophobicContact CD2-CE1 4.23Å; Y231-F332 HydrophobicContact CE1-CE1 4.38Å; Y231-F332 AromaticContact CE1-CZ 3.85Å; Y231-F332 HydrophobicContact CE1-CZ 3.85Å; Y231-F332 AromaticContact CG-CE1 3.59Å; Y231-F332 HydrophobicContact CG-CE1 3.59Å; Y231-F332 AromaticContact CG-CZ 3.86Å; Y231-F332 HydrophobicContact CG-CZ 3.86Å; W247-F332 HydrophobicContact CZ2-CE2 4.21Å; W247-F332 HydrophobicContact CZ2-CZ 4.42Å; N250-F332 VanDerWaalsContact ND2-CD1 3.29Å; N250-F332 WeakPolarHBondContact ND2-CD1 3.29Å; N250-F332 WeakPolarHBondContact ND2-CE1 3.48Å; M293-F332 WeakPolarHBondContact O-CB 3.32Å; M293-F332 PolarHBondContact O-N 3.01Å; F332-T334 HydrophobicContact CD1-CG2 4.17Å; F332-T334 HydrophobicContact CE1-CG2 3.85Å; F332-N339 PolarHBondContact O-ND2 2.75Å; F332-G353 WeakPolarHBondContact CZ-O 3.5Å; F332-W355 AromaticContact CD2-CD1 3.81Å; F332-W355 AromaticContact CD2-CD2 3.95Å; F332-W355 HydrophobicContact CD2-CD2 3.95Å; F332-W355 AromaticContact CD2-CE2 3.63Å; F332-W355 HydrophobicContact CD2-CG 4.07Å; F332-W355 HydrophobicContact CD2-CZ2 4.1Å; F332-W355 AromaticContact CD2-NE1 3.55Å; F332-W355 HydrophobicContact CE2-CD2 4.35Å; F332-W355 HydrophobicContact CE2-CZ2 4.27Å
333	S	98.8	Very high	98	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.236	C	C	.	.	B	Isolated β-bridge	trans	-124.7	142.7	176.6	-64.2	0	0	0	0	109.9	K337 N339 D340 G353 W354	S333-K337 WeakPolarHBondContact CA-O 3.44Å; S333-N339 PolarHBondContact OG-N 3.09Å; S333-D340 PolarHBondContact OG-N 2.69Å; S333-D340 VanDerWaalsContact OG-N 3.16Å; S333-G353 VanDerWaalsContact O-CA 3.26Å; S333-G353 WeakPolarHBondContact O-CA 3.39Å; S333-W354 PolarHBondContact N-O 2.86Å; S333-W354 PolarHBondContact O-N 2.92Å; S333-W354 VanDerWaalsContact O-N 3.08Å
334	T	98.8	Very high	97.9	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.219	C	C	.	.	B	Isolated β-bridge	trans	-129.1	164.9	167.2	55.4	0	0	0	0	109	W228 Y231 F332 D336 K337 A347	W228-T334 WeakPolarHBondContact CA-OG1 3.09Å; W228-T334 HydrophobicContact CE3-CG2 4.2Å; W228-T334 PolarHBondContact N-OG1 2.86Å; Y231-T334 HydrophobicContact CD2-CG2 3.59Å; Y231-T334 HydrophobicContact CE2-CG2 4.38Å; Y231-T334 HydrophobicContact CG-CG2 4.1Å; F332-T334 HydrophobicContact CD1-CG2 4.17Å; F332-T334 HydrophobicContact CE1-CG2 3.85Å; T334-D336 WeakPolarHBondContact CB-OD1 3.5Å; T334-D336 PolarHBondContact O-N 3.26Å; T334-D336 VanDerWaalsContact O-N 3.15Å; T334-D336 PolarHBondContact OG1-OD1 2.81Å; T334-K337 PolarHBondContact N-O 3.45Å; T334-K337 CarbonylContact O-C 3.54Å; T334-K337 PolarHBondContact O-N 2.97Å; T334-K337 PolarHBondContact OG1-N 3.2Å; T334-A347 VanDerWaalsContact C-CB 3.46Å
335	H	98.3	Very high	97.9	Very high	60 Å²	60	39.7 Å²	39.7	28%	0.278	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-32.5	-178.2	76.5	-70.1	0	0	0	113.9	F225 R226 N345 Q348	F225-H335 HydrophobicContact CE2-CB 3.67Å; F225-H335 AromaticContact CE2-CG 3.75Å; F225-H335 HydrophobicContact CZ-CB 4.16Å; F225-H335 AromaticContact CZ-CD2 3.99Å; F225-H335 AromaticContact CZ-CG 3.97Å; R226-H335 PolarHBondContact O-ND1 2.85Å; H335-N345 PolarHBondContact O-ND2 3.14Å; H335-Q348 HydrophobicContact CB-CB 3.98Å
336	D	98.6	Very high	97.9	Very high	82 Å²	82	39.3 Å²	39.3	44%	0.439	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-10.3	176.8	64.5	-48.2	0	0	0	114.2	D227 W228 T334	D227-D336 WeakPolarHBondContact CA-OD1 3.09Å; W228-D336 VanDerWaalsContact CB-OD2 3.28Å; W228-D336 WeakPolarHBondContact CB-OD2 3.44Å; W228-D336 VanDerWaalsContact N-CG 3.34Å; W228-D336 PolarHBondContact N-OD1 3.12Å; W228-D336 PolarHBondContact N-OD2 2.86Å; T334-D336 WeakPolarHBondContact CB-OD1 3.5Å; T334-D336 PolarHBondContact O-N 3.26Å; T334-D336 VanDerWaalsContact O-N 3.15Å; T334-D336 PolarHBondContact OG1-OD1 2.81Å
337	K	98.4	Very high	97.9	Very high	56 Å²	56	38.4 Å²	38.4	24%	0.243	21%	0.209	C	C	.	.	B	Isolated β-bridge	trans	-149.2	91.7	-179.6	-161.4	-170.7	-170.2	-176.3	0	111.8	W228 M293 S333 T334 N339	W228-K337 HydrophobicContact CB-CB 4.16Å; W228-K337 HydrophobicContact CB-CD 4.38Å; W228-K337 HydrophobicContact CD2-CB 4.21Å; W228-K337 HydrophobicContact CD2-CD 3.29Å; W228-K337 HydrophobicContact CD2-CG 4.38Å; W228-K337 HydrophobicContact CE3-CB 3.95Å; W228-K337 HydrophobicContact CE3-CD 3.5Å; W228-K337 VanDerWaalsContact CE3-CD 3.5Å; W228-K337 HydrophobicContact CE3-CG 4.26Å; W228-K337 HydrophobicContact CG-CB 4.3Å; W228-K337 HydrophobicContact CG-CD 3.68Å; W228-K337 HydrophobicContact CH2-CD 4.1Å; W228-K337 HydrophobicContact CZ2-CD 3.96Å; W228-K337 HydrophobicContact CZ3-CD 3.89Å; M293-K337 HydrophobicContact SD-CD 4.46Å; M293-K337 WeakPolarHBondContact SD-CE 3.44Å; M293-K337 PolarHBondContact SD-NZ 3.33Å; S333-K337 WeakPolarHBondContact CA-O 3.44Å; T334-K337 PolarHBondContact N-O 3.45Å; T334-K337 CarbonylContact O-C 3.54Å; T334-K337 PolarHBondContact O-N 2.97Å; T334-K337 PolarHBondContact OG1-N 3.2Å; K337-N339 PolarHBondContact O-ND2 3.39Å
338	D	98.6	Very high	97.8	Very high	67 Å²	67	41.6 Å²	41.6	36%	0.358	22%	0.224	S	C	.	.			trans	-82.4	130	-179.8	-166.2	-6.2	0	0	0	112.5	D340 N345	D338-D340 WeakPolarHBondContact OD1-CB 3.34Å; D338-D340 PolarHBondContact OD1-N 3.17Å; D338-N345 WeakPolarHBondContact OD2-CA 3.49Å; D338-N345 VanDerWaalsContact OD2-CB 3.31Å; D338-N345 WeakPolarHBondContact OD2-CB 3.36Å
339	N	98.4	Very high	97.7	Very high	28 Å²	28	40 Å²	40	15%	0.15	22%	0.215	C	C	.	.			trans	-135.2	16.8	173.1	-52.7	-82.8	0	0	0	111.7	M293 Q331 F332 S333 K337 K341	M293-N339 WeakPolarHBondContact CG-OD1 3.43Å; Q331-N339 HydrophobicContact CB-CB 3.62Å; F332-N339 PolarHBondContact O-ND2 2.75Å; S333-N339 PolarHBondContact OG-N 3.09Å; K337-N339 PolarHBondContact O-ND2 3.39Å; N339-K341 PolarHBondContact O-NZ 3.42Å
340	D	97.9	Very high	97.6	Very high	13 Å²	13	39.2 Å²	39.2	7%	0.07	21%	0.206	C	C	.	.	S	Bend	trans	-78.4	-167.8	-171.9	85	35	0	0	0	112.5	S333 D338 Y342 C346 M356 N357	S333-D340 PolarHBondContact OG-N 2.69Å; S333-D340 VanDerWaalsContact OG-N 3.16Å; D338-D340 WeakPolarHBondContact OD1-CB 3.34Å; D338-D340 PolarHBondContact OD1-N 3.17Å; D340-Y342 WeakPolarHBondContact OD1-CA 3.26Å; D340-Y342 VanDerWaalsContact OD1-CB 3.29Å; D340-Y342 WeakPolarHBondContact OD1-CB 3.38Å; D340-Y342 PolarHBondContact OD1-N 3.3Å; D340-C346 VanDerWaalsContact OD2-CB 3.29Å; D340-C346 WeakPolarHBondContact OD2-CB 3.47Å; D340-C346 PolarHBondContact OD2-N 3.49Å; D340-C346 PolarHBondContact OD2-SG 2.95Å; D340-M356 HydrophobicContact CB-CB 3.58Å; D340-N357 WeakPolarHBondContact CB-O 3.35Å
341	K	97.4	Very high	97.5	Very high	99 Å²	99	39.1 Å²	39.1	43%	0.43	21%	0.211	S	C	.	.	S	Bend	trans	-121.6	12.9	-177.7	-54.6	-69.4	155.2	-93.5	0	112.7	M330 N339 N357	M330-K341 HydrophobicContact SD-CG 3.87Å; N339-K341 PolarHBondContact O-NZ 3.42Å; K341-N357 WeakPolarHBondContact CB-OD1 3.44Å; K341-N357 PolarHBondContact N-O 3.16Å
342	Y	95.7	Very high	97.5	Very high	82 Å²	82	37.4 Å²	37.4	32%	0.322	20%	0.203	S	C	.	.	S	Bend	trans	-89.8	174.4	170.5	-172.1	-142.1	0	0	0	110.7	D340 G344 R358	D340-Y342 WeakPolarHBondContact OD1-CA 3.26Å; D340-Y342 VanDerWaalsContact OD1-CB 3.29Å; D340-Y342 WeakPolarHBondContact OD1-CB 3.38Å; D340-Y342 PolarHBondContact OD1-N 3.3Å; Y342-G344 VanDerWaalsContact CD1-N 3.27Å; Y342-R358 HydrophobicContact CD2-CG 3.96Å; Y342-R358 HydrophobicContact CG-CG 4.32Å
343	S	94.9	Very high	97.5	Very high	116 Å²	116	37.4 Å²	37.4	81%	0.811	20%	0.203	S	C	*	.	S	Bend	trans	-98.6	-14.3	173.5	58.1	0	0	0	0	113.1
344	G	94.9	Very high	97.5	Very high	28 Å²	28	37.4 Å²	37.4	29%	0.289	20%	0.203	S	C	.	.	S	Bend	trans	-94.6	-153.3	161.3	0	0	0	0	0	109.6	Y342	Y342-G344 VanDerWaalsContact CD1-N 3.27Å
345	N	97.5	Very high	97.5	Very high	32 Å²	32	37.4 Å²	37.4	17%	0.171	20%	0.203	C	C	.	.			trans	-130.5	105.5	177.9	174.3	-25.2	0	0	0	108.6	H335 D338 A347 Q348 Q349	H335-N345 PolarHBondContact O-ND2 3.14Å; D338-N345 WeakPolarHBondContact OD2-CA 3.49Å; D338-N345 VanDerWaalsContact OD2-CB 3.31Å; D338-N345 WeakPolarHBondContact OD2-CB 3.36Å; N345-A347 VanDerWaalsContact C-N 3.33Å; N345-A347 PolarHBondContact O-N 3.37Å; N345-A347 WeakPolarHBondContact OD1-CB 3.43Å; N345-A347 PolarHBondContact OD1-N 2.93Å; N345-A347 VanDerWaalsContact OD1-N 3.07Å; N345-Q348 HydrophobicContact CB-CB 4.05Å; N345-Q348 PolarHBondContact O-N 2.65Å; N345-Q348 PolarHBondContact OD1-N 2.65Å; N345-Q349 WeakPolarHBondContact O-CG 3.42Å; N345-Q349 PolarHBondContact O-N 2.87Å; N345-Q349 VanDerWaalsContact O-N 3.07Å
346	C	97.9	Very high	97.5	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-65.2	-35.8	-177.2	-65.8	0	0	0	0	112.2	D340 Q348 Q349 D350 M356 C359	D340-C346 VanDerWaalsContact OD2-CB 3.29Å; D340-C346 WeakPolarHBondContact OD2-CB 3.47Å; D340-C346 PolarHBondContact OD2-N 3.49Å; D340-C346 PolarHBondContact OD2-SG 2.95Å; C346-Q348 VanDerWaalsContact C-N 3.29Å; C346-Q348 PolarHBondContact O-N 3.25Å; C346-Q349 PolarHBondContact O-N 2.8Å; C346-D350 WeakPolarHBondContact O-CB 3.42Å; C346-D350 PolarHBondContact O-N 3.26Å; C346-M356 HydrophobicContact CB-CB 4.06Å; C346-M356 HydrophobicContact CB-CE 4.29Å; C346-M356 HydrophobicContact CB-CG 3.87Å; C346-M356 HydrophobicContact CB-SD 4.1Å; C346-C359 HydrophobicContact CB-CB 3.69Å; C346-C359 WeakPolarHBondContact CB-SG 3.31Å; C346-C359 WeakPolarHBondContact SG-CA 3.38Å; C346-C359 WeakPolarHBondContact SG-CB 3.39Å; C346-C359 PolarHBondContact SG-N 2.91Å; C346-C359 CovalentContact SG-SG 2.05Å; C346-C359 PolarHBondContact SG-SG 3.35Å
347	A	97.8	Very high	97.5	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-64.3	-33.9	178.4	0	0	0	0	0	112.6	T334 N345 G351 S352	T334-A347 VanDerWaalsContact C-CB 3.46Å; N345-A347 VanDerWaalsContact C-N 3.33Å; N345-A347 PolarHBondContact O-N 3.37Å; N345-A347 WeakPolarHBondContact OD1-CB 3.43Å; N345-A347 PolarHBondContact OD1-N 2.93Å; N345-A347 VanDerWaalsContact OD1-N 3.07Å; A347-G351 PolarHBondContact O-N 2.78Å; A347-S352 WeakPolarHBondContact CA-O 3.25Å; A347-S352 VanDerWaalsContact CB-O 3.31Å; A347-S352 WeakPolarHBondContact CB-O 3.3Å; A347-S352 PolarHBondContact O-N 3.23Å; A347-S352 VanDerWaalsContact O-O 3.12Å
348	Q	97.3	Very high	97.4	Very high	67 Å²	67	33.7 Å²	33.7	31%	0.313	18%	0.18	S	C	.	.	H	α-helix	trans	-74.4	-38.5	172.3	175.6	59.3	85.1	0	0	112.5	H335 N345 C346	H335-Q348 HydrophobicContact CB-CB 3.98Å; N345-Q348 HydrophobicContact CB-CB 4.05Å; N345-Q348 PolarHBondContact O-N 2.65Å; N345-Q348 PolarHBondContact OD1-N 2.65Å; C346-Q348 VanDerWaalsContact C-N 3.29Å; C346-Q348 PolarHBondContact O-N 3.25Å
349	Q	96.3	Very high	97.3	Very high	29 Å²	29	31.7 Å²	31.7	14%	0.136	17%	0.17	C	C	.	.	H	α-helix	trans	-72.9	-42.5	-179.9	-68.6	-178.6	-54	0	0	112.2	N345 C346 G351 Y382	N345-Q349 WeakPolarHBondContact O-CG 3.42Å; N345-Q349 PolarHBondContact O-N 2.87Å; N345-Q349 VanDerWaalsContact O-N 3.07Å; C346-Q349 PolarHBondContact O-N 2.8Å; Q349-G351 VanDerWaalsContact C-N 3.3Å; Q349-G351 PolarHBondContact O-N 3.03Å; Q349-Y382 HydrophobicContact CB-CD2 3.97Å; Q349-Y382 HydrophobicContact CB-CE2 4.45Å; Q349-Y382 HydrophobicContact CB-CG 4.08Å; Q349-Y382 HydrophobicContact CG-CD1 3.86Å; Q349-Y382 HydrophobicContact CG-CD2 3.92Å; Q349-Y382 HydrophobicContact CG-CE1 4.09Å; Q349-Y382 HydrophobicContact CG-CE2 4.13Å; Q349-Y382 HydrophobicContact CG-CG 3.77Å
350	D	96.4	Very high	97.3	Very high	3 Å²	3	30.9 Å²	30.9	2%	0.016	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.2	2.3	-177.3	-56.3	-21.4	0	0	0	113	C346 S352 M356 H360 N386	C346-D350 WeakPolarHBondContact O-CB 3.42Å; C346-D350 PolarHBondContact O-N 3.26Å; D350-S352 PolarHBondContact O-N 2.83Å; D350-M356 HydrophobicContact CB-CE 3.97Å; D350-M356 WeakPolarHBondContact OD2-CE 3.31Å; D350-H360 IonicContact OD2-CD2 3.47Å; D350-H360 PolarHBondContact OD2-CD2 3.15Å; D350-H360 IonicContact OD2-NE2 3.84Å; D350-H360 PolarHBondContact OD2-NE2 3.05Å; D350-N386 HydrophobicContact CB-CB 3.9Å
351	G	96.6	Very high	97.3	Very high	24 Å²	24	30.2 Å²	30.2	25%	0.247	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.8	45.7	172.4	0	0	0	0	0	114	F225 A347 Q349	F225-G351 WeakPolarHBondContact CA-O 3.3Å; F225-G351 WeakPolarHBondContact CB-O 3.38Å; A347-G351 PolarHBondContact O-N 2.78Å; Q349-G351 VanDerWaalsContact C-N 3.3Å; Q349-G351 PolarHBondContact O-N 3.03Å
352	S	97.9	Very high	97.3	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.142	C	C	.	.	S	Bend	trans	-159.6	173	-171.2	63.8	0	0	0	0	113.5	A347 D350 H363 N365	A347-S352 WeakPolarHBondContact CA-O 3.25Å; A347-S352 VanDerWaalsContact CB-O 3.31Å; A347-S352 WeakPolarHBondContact CB-O 3.3Å; A347-S352 PolarHBondContact O-N 3.23Å; A347-S352 VanDerWaalsContact O-O 3.12Å; D350-S352 PolarHBondContact O-N 2.83Å; S352-H363 WeakPolarHBondContact CB-NE2 3.2Å; S352-H363 PolarHBondContact OG-CE1 2.88Å; S352-H363 PolarHBondContact OG-NE2 3.04Å; S352-N365 WeakPolarHBondContact CB-O 3.23Å
353	G	98.7	Very high	97.5	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	13%	0.126	C	C	.	.			trans	-111.8	128.4	164.5	0	0	0	0	0	110.8	Y231 F332 S333 N365	Y231-G353 VanDerWaalsContact CZ-CA 3.47Å; Y231-G353 PolarHBondContact OH-N 3.08Å; Y231-G353 VanDerWaalsContact OH-N 3.13Å; F332-G353 WeakPolarHBondContact CZ-O 3.5Å; S333-G353 VanDerWaalsContact O-CA 3.26Å; S333-G353 WeakPolarHBondContact O-CA 3.39Å; G353-N365 WeakPolarHBondContact O-CB 3.37Å; G353-N365 PolarHBondContact O-ND2 3.22Å
354	W	98.8	Very high	97.6	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	9%	0.088	C	C	.	.	B	Isolated β-bridge	trans	-160.1	170.5	-175.6	-161.3	-119.3	0	0	0	113.2	W247 F310 H327 S333 M356 A362 H363 L364 N365 M405	W247-W354 HydrophobicContact CZ3-CZ3 4.46Å; F310-W354 AromaticContact CE1-CZ2 3.97Å; F310-W354 HydrophobicContact CE1-CZ2 3.97Å; F310-W354 HydrophobicContact CZ-CZ2 4.3Å; H327-W354 AromaticContact CD2-NE1 3.5Å; H327-W354 AromaticContact NE2-NE1 3.66Å; S333-W354 PolarHBondContact N-O 2.86Å; S333-W354 PolarHBondContact O-N 2.92Å; S333-W354 VanDerWaalsContact O-N 3.08Å; W354-M356 HydrophobicContact CB-CE 3.94Å; W354-M356 HydrophobicContact CB-CG 4.21Å; W354-M356 HydrophobicContact CB-SD 3.93Å; W354-M356 HydrophobicContact CG-SD 4.39Å; W354-M356 PolarHBondContact O-N 2.78Å; W354-A362 VanDerWaalsContact CE2-O 3.28Å; W354-A362 PolarHBondContact NE1-O 3.01Å; W354-H363 AromaticContact CD1-CD2 3.99Å; W354-H363 AromaticContact CG-CD2 3.87Å; W354-L364 HydrophobicContact CH2-CB 3.69Å; W354-L364 HydrophobicContact CH2-CD1 4.18Å; W354-L364 HydrophobicContact CH2-CG 3.81Å; W354-L364 HydrophobicContact CZ2-CB 4.39Å; W354-L364 HydrophobicContact CZ2-CG 4.21Å; W354-L364 HydrophobicContact CZ3-CB 4.16Å; W354-N365 HydrophobicContact CE3-CB 3.92Å; W354-N365 HydrophobicContact CZ3-CB 4.29Å; W354-M405 HydrophobicContact CH2-CE 4.3Å; W354-M405 HydrophobicContact CH2-SD 3.93Å; W354-M405 HydrophobicContact CZ3-SD 4.12Å
355	W	98.8	Very high	97.8	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	7%	0.074	C	C	.	.			trans	-79.5	66	171.5	-60.1	-76.2	0	0	0	111.4	W247 I287 Y294 L296 H327 M330 Q331 F332 M405	W247-W355 AromaticContact CH2-CH2 3.77Å; W247-W355 HydrophobicContact CH2-CH2 3.77Å; W247-W355 HydrophobicContact CH2-CZ3 4.28Å; W247-W355 HydrophobicContact CZ2-CH2 4.33Å; I287-W355 HydrophobicContact CD1-CH2 4.06Å; I287-W355 HydrophobicContact CD1-CZ2 3.29Å; I287-W355 HydrophobicContact CG1-CZ2 4.15Å; Y294-W355 PolarHBondContact O-NE1 2.88Å; L296-W355 HydrophobicContact CB-CB 4.14Å; L296-W355 VanDerWaalsContact CB-CD1 3.44Å; L296-W355 HydrophobicContact CB-CD2 3.74Å; L296-W355 HydrophobicContact CB-CG 3.51Å; L296-W355 HydrophobicContact CD2-CB 4.3Å; L296-W355 HydrophobicContact CD2-CD2 4.04Å; L296-W355 HydrophobicContact CD2-CE3 4.05Å; L296-W355 HydrophobicContact CD2-CG 4.16Å; L296-W355 HydrophobicContact CG-CD2 4.38Å; L296-W355 HydrophobicContact CG-CG 4.45Å; H327-W355 PolarHBondContact CD2-O 3.42Å; M330-W355 HydrophobicContact CB-CB 4.06Å; Q331-W355 WeakPolarHBondContact O-CA 3.45Å; F332-W355 AromaticContact CD2-CD1 3.81Å; F332-W355 AromaticContact CD2-CD2 3.95Å; F332-W355 HydrophobicContact CD2-CD2 3.95Å; F332-W355 AromaticContact CD2-CE2 3.63Å; F332-W355 HydrophobicContact CD2-CG 4.07Å; F332-W355 HydrophobicContact CD2-CZ2 4.1Å; F332-W355 AromaticContact CD2-NE1 3.55Å; F332-W355 HydrophobicContact CE2-CD2 4.35Å; F332-W355 HydrophobicContact CE2-CZ2 4.27Å; W355-M405 HydrophobicContact CH2-CE 4.4Å; W355-M405 HydrophobicContact CZ3-CE 4.1Å
356	M	98.4	Very high	97.8	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	7%	0.066	C	C	.	.			trans	-68.4	136.1	-176.3	-61.8	-57.9	-161.6	0	0	111.8	D340 C346 D350 W354 H360	D340-M356 HydrophobicContact CB-CB 3.58Å; C346-M356 HydrophobicContact CB-CB 4.06Å; C346-M356 HydrophobicContact CB-CE 4.29Å; C346-M356 HydrophobicContact CB-CG 3.87Å; C346-M356 HydrophobicContact CB-SD 4.1Å; D350-M356 HydrophobicContact CB-CE 3.97Å; D350-M356 WeakPolarHBondContact OD2-CE 3.31Å; W354-M356 HydrophobicContact CB-CE 3.94Å; W354-M356 HydrophobicContact CB-CG 4.21Å; W354-M356 HydrophobicContact CB-SD 3.93Å; W354-M356 HydrophobicContact CG-SD 4.39Å; W354-M356 PolarHBondContact O-N 2.78Å; M356-H360 HydrophobicContact SD-CB 4.31Å
357	N	98.3	Very high	97.8	Very high	4 Å²	4	17.9 Å²	17.9	2%	0.021	9%	0.086	C	C	.	.	S	Bend	trans	-100.9	-115.9	167.3	-173.1	-22.5	0	0	0	107.6	F323 H324 S326 M330 D340 K341 C359	F323-N357 PolarHBondContact O-ND2 2.99Å; H324-N357 WeakPolarHBondContact O-CB 3.38Å; H324-N357 PolarHBondContact O-ND2 3.29Å; H324-N357 PolarHBondContact O-OD1 2.96Å; S326-N357 VanDerWaalsContact O-CB 3.23Å; S326-N357 WeakPolarHBondContact O-CB 3.47Å; S326-N357 PolarHBondContact O-ND2 2.99Å; S326-N357 PolarHBondContact OG-ND2 3.49Å; M330-N357 HydrophobicContact CG-CB 3.81Å; M330-N357 HydrophobicContact SD-CB 3.64Å; D340-N357 WeakPolarHBondContact CB-O 3.35Å; K341-N357 WeakPolarHBondContact CB-OD1 3.44Å; K341-N357 PolarHBondContact N-O 3.16Å; N357-C359 PolarHBondContact N-O 2.84Å; N357-C359 PolarHBondContact O-N 2.89Å; N357-C359 VanDerWaalsContact O-N 3.1Å
358	R	96.7	Very high	97.8	Very high	116 Å²	116	19.8 Å²	19.8	44%	0.438	9%	0.094	S	C	.	.	S	Bend	trans	-86.3	64.4	157.7	-165.9	176.1	174.7	-173.2	-8.6	107.4	H324 Y342	H324-R358 HydrophobicContact CB-CB 3.82Å; H324-R358 PolarHBondContact NE2-NH1 2.82Å; H324-R358 WeakPolarHBondContact O-CA 3.35Å; H324-R358 WeakPolarHBondContact O-CB 3.37Å; H324-R358 PolarHBondContact O-N 2.6Å; Y342-R358 HydrophobicContact CD2-CG 3.96Å; Y342-R358 HydrophobicContact CG-CG 4.32Å
359	C	96.4	Very high	97.8	Very high	24 Å²	24	17.7 Å²	17.7	16%	0.162	8%	0.083	C	C	.	.	S	Bend	trans	72.7	-122.5	-167.5	-43.9	0	0	0	0	112.2	C346 N357	C346-C359 HydrophobicContact CB-CB 3.69Å; C346-C359 WeakPolarHBondContact CB-SG 3.31Å; C346-C359 WeakPolarHBondContact SG-CA 3.38Å; C346-C359 WeakPolarHBondContact SG-CB 3.39Å; C346-C359 PolarHBondContact SG-N 2.91Å; C346-C359 CovalentContact SG-SG 2.05Å; C346-C359 PolarHBondContact SG-SG 3.35Å; N357-C359 PolarHBondContact N-O 2.84Å; N357-C359 PolarHBondContact O-N 2.89Å; N357-C359 VanDerWaalsContact O-N 3.1Å
360	H	98.1	Very high	97.8	Very high	11 Å²	11	24.5 Å²	24.5	5%	0.051	12%	0.115	C	C	.	.			trans	-150.9	164.9	-164.4	61.2	79.7	0	0	0	115.3	T325 D350 M356 H363 D385	T325-H360 VanDerWaalsContact CG2-O 3.3Å; T325-H360 WeakPolarHBondContact CG2-O 3.43Å; D350-H360 IonicContact OD2-CD2 3.47Å; D350-H360 PolarHBondContact OD2-CD2 3.15Å; D350-H360 IonicContact OD2-NE2 3.84Å; D350-H360 PolarHBondContact OD2-NE2 3.05Å; M356-H360 HydrophobicContact SD-CB 4.31Å; H360-H363 HydrophobicContact CB-CB 4.4Å; H360-H363 AromaticContact NE2-ND1 3.98Å; H360-D385 PolarHBondContact CE1-O 3.33Å; H360-D385 IonicContact CE1-OD2 2.68Å; H360-D385 PolarHBondContact CE1-OD2 2.76Å; H360-D385 VanDerWaalsContact CE1-OD2 3.31Å; H360-D385 PolarHBondContact NE2-O 2.79Å; H360-D385 VanDerWaalsContact NE2-O 3.12Å
361	A	98	Very high	97.8	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.137	C	C	.	.	S	Bend	trans	-122.5	-1.6	159.2	0	0	0	0	0	112.8	F313 T325 H327 L391	F313-A361 HydrophobicContact CB-CB 3.69Å; T325-A361 PolarHBondContact O-N 2.91Å; H327-A361 PolarHBondContact CE1-N 3.03Å; H327-A361 PolarHBondContact NE2-N 3.43Å; A361-L391 HydrophobicContact CB-CB 4.34Å; A361-L391 HydrophobicContact CB-CD1 3.85Å; A361-L391 HydrophobicContact CB-CG 4.23Å; A361-L391 WeakPolarHBondContact O-CB 3.4Å; A361-L391 VanDerWaalsContact O-CG 3.3Å; A361-L391 WeakPolarHBondContact O-CG 3.17Å; A361-L391 PolarHBondContact O-N 3.45Å
362	A	98.3	Very high	97.8	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	121	179.4	0	0	0	0	0	107	A309 F310 H327 W354 W390	A309-A362 HydrophobicContact CB-CB 3.81Å; F310-A362 HydrophobicContact CD1-CB 3.91Å; F310-A362 HydrophobicContact CE1-CB 3.9Å; H327-A362 PolarHBondContact CE1-N 3.28Å; H327-A362 VanDerWaalsContact CE1-N 3.33Å; H327-A362 PolarHBondContact NE2-N 2.98Å; H327-A362 PolarHBondContact NE2-O 3.08Å; H327-A362 VanDerWaalsContact NE2-O 3.17Å; W354-A362 VanDerWaalsContact CE2-O 3.28Å; W354-A362 PolarHBondContact NE1-O 3.01Å; A362-W390 HydrophobicContact CB-CD2 4.29Å; A362-W390 HydrophobicContact CB-CE3 3.44Å; A362-W390 VanDerWaalsContact CB-CE3 3.44Å; A362-W390 HydrophobicContact CB-CH2 4.28Å; A362-W390 HydrophobicContact CB-CZ3 3.45Å; A362-W390 VanDerWaalsContact CB-CZ3 3.45Å
363	H	98.6	Very high	97.7	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	76.4	-171.4	-169.6	-140.1	0	0	0	112.1	S352 W354 H360 N365 G366 G387 I388 T389	S352-H363 WeakPolarHBondContact CB-NE2 3.2Å; S352-H363 PolarHBondContact OG-CE1 2.88Å; S352-H363 PolarHBondContact OG-NE2 3.04Å; W354-H363 AromaticContact CD1-CD2 3.99Å; W354-H363 AromaticContact CG-CD2 3.87Å; H360-H363 HydrophobicContact CB-CB 4.4Å; H360-H363 AromaticContact NE2-ND1 3.98Å; H363-N365 PolarHBondContact O-N 3.45Å; H363-G366 WeakPolarHBondContact CE1-CA 3.46Å; H363-G366 WeakPolarHBondContact ND1-CA 3.36Å; H363-G366 PolarHBondContact O-N 3.37Å; H363-G387 PolarHBondContact ND1-O 3.48Å; H363-I388 VanDerWaalsContact O-CA 3.3Å; H363-I388 WeakPolarHBondContact O-CA 3.43Å; H363-T389 WeakPolarHBondContact CB-OG1 3.49Å; H363-T389 PolarHBondContact N-O 3.43Å; H363-T389 PolarHBondContact O-N 2.91Å
364	L	98.8	Very high	97.6	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-14.9	-172.9	-50.5	-176.1	0	0	0	113.3	Q215 R217 I268 L270 W354 W390 T403 M405	Q215-L364 PolarHBondContact NE2-O 3.23Å; R217-L364 PolarHBondContact NH1-O 2.77Å; I268-L364 HydrophobicContact CD1-CD1 4.05Å; I268-L364 HydrophobicContact CG1-CD1 4.29Å; I268-L364 HydrophobicContact CG2-CD1 3.69Å; L270-L364 HydrophobicContact CD2-CD1 4.4Å; L270-L364 HydrophobicContact CD2-CD2 3.72Å; W354-L364 HydrophobicContact CH2-CB 3.69Å; W354-L364 HydrophobicContact CH2-CD1 4.18Å; W354-L364 HydrophobicContact CH2-CG 3.81Å; W354-L364 HydrophobicContact CZ2-CB 4.39Å; W354-L364 HydrophobicContact CZ2-CG 4.21Å; W354-L364 HydrophobicContact CZ3-CB 4.16Å; L364-W390 HydrophobicContact CD1-CZ3 4.48Å; L364-W390 HydrophobicContact CD2-CE3 3.94Å; L364-W390 HydrophobicContact CD2-CZ3 4.44Å; L364-T403 HydrophobicContact CD2-CG2 4.04Å; L364-M405 HydrophobicContact CD1-CG 3.72Å; L364-M405 HydrophobicContact CD1-SD 3.96Å
365	N	98.8	Very high	97.4	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	6.3	178.5	-69.8	-3.5	0	0	0	113.5	Q215 F224 Y231 W247 S352 G353 W354 H363	Q215-N365 PolarHBondContact NE2-OD1 3.44Å; F224-N365 VanDerWaalsContact CB-O 3.31Å; F224-N365 WeakPolarHBondContact CB-O 3.36Å; F224-N365 HydrophobicContact CD1-CB 3.93Å; Y231-N365 WeakPolarHBondContact CE1-ND2 3.33Å; W247-N365 WeakPolarHBondContact CZ3-ND2 3.19Å; S352-N365 WeakPolarHBondContact CB-O 3.23Å; G353-N365 WeakPolarHBondContact O-CB 3.37Å; G353-N365 PolarHBondContact O-ND2 3.22Å; W354-N365 HydrophobicContact CE3-CB 3.92Å; W354-N365 HydrophobicContact CZ3-CB 4.29Å; H363-N365 PolarHBondContact O-N 3.45Å
366	G	97.8	Very high	97.2	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.01	21%	0.209	C	C	.	.	S	Bend	trans	-65.9	174.8	177.9	0	0	0	0	0	115	R217 H363 N386	R217-G366 PolarHBondContact NH1-O 3.37Å; R217-G366 PolarHBondContact NH2-O 3.02Å; H363-G366 WeakPolarHBondContact CE1-CA 3.46Å; H363-G366 WeakPolarHBondContact ND1-CA 3.36Å; H363-G366 PolarHBondContact O-N 3.37Å; G366-N386 CarbonylContact C-O 3.16Å; G366-N386 WeakPolarHBondContact CA-O 3.43Å
367	K	97.4	Very high	96.9	Very high	96 Å²	96	53.5 Å²	53.5	42%	0.417	25%	0.249	S	C	.	.	B	Isolated β-bridge	trans	-62.9	135.1	178.2	179.6	172.6	161.5	-159.7	0	111	Y369 D378 N386 G387	K367-Y369 HydrophobicContact CB-CD2 4.4Å; K367-Y369 HydrophobicContact CB-CE2 3.88Å; K367-Y369 HydrophobicContact CD-CE1 4.27Å; K367-Y369 HydrophobicContact CD-CE2 3.93Å; K367-Y369 WeakPolarHBondContact CD-OH 3.46Å; K367-Y369 WeakPolarHBondContact CE-OH 3.47Å; K367-Y369 HydrophobicContact CG-CD2 4.33Å; K367-Y369 HydrophobicContact CG-CE2 3.88Å; K367-Y369 PolarHBondContact NZ-OH 2.86Å; K367-Y369 WeakPolarHBondContact O-CD2 3.31Å; K367-Y369 PolarHBondContact O-N 3.34Å; K367-D378 PolarHBondContact NZ-O 3.49Å; K367-N386 WeakPolarHBondContact CB-O 3.4Å; K367-N386 PolarHBondContact N-O 3.46Å; K367-G387 WeakPolarHBondContact O-CA 3.47Å
368	Y	98	Very high	96.6	Very high	40 Å²	40	57.1 Å²	57.1	16%	0.157	27%	0.268	C	S	.	.			trans	-80	102.9	-178.6	-167.6	-85.1	0	0	0	110.7	R218 W273 I388 K401	R218-Y368 PolarHBondContact O-OH 2.98Å; W273-Y368 AromaticContact CH2-CE1 3.82Å; W273-Y368 HydrophobicContact CH2-CE1 3.82Å; W273-Y368 AromaticContact CH2-CZ 3.9Å; W273-Y368 WeakPolarHBondContact CH2-OH 3.47Å; W273-Y368 AromaticContact CZ2-CE1 3.92Å; W273-Y368 HydrophobicContact CZ2-CE1 3.92Å; W273-Y368 AromaticContact CZ2-CZ 3.87Å; Y368-I388 HydrophobicContact CD2-CD1 3.56Å; Y368-I388 HydrophobicContact CE2-CD1 4.3Å; Y368-I388 HydrophobicContact CG-CD1 4.32Å; Y368-K401 VanDerWaalsContact CE2-O 3.24Å; Y368-K401 WeakPolarHBondContact CE2-O 3.32Å; Y368-K401 PolarHBondContact OH-O 3.14Å
369	Y	97.8	Very high	96.2	Very high	23 Å²	23	52.1 Å²	52.1	9%	0.09	25%	0.251	C	S	.	.			trans	-92.5	106.6	175	-71	-85.8	0	0	0	111.1	W273 K367 G371 G372 Y374 D378 T379 N386	W273-Y369 WeakPolarHBondContact CZ2-O 3.24Å; K367-Y369 HydrophobicContact CB-CD2 4.4Å; K367-Y369 HydrophobicContact CB-CE2 3.88Å; K367-Y369 HydrophobicContact CD-CE1 4.27Å; K367-Y369 HydrophobicContact CD-CE2 3.93Å; K367-Y369 WeakPolarHBondContact CD-OH 3.46Å; K367-Y369 WeakPolarHBondContact CE-OH 3.47Å; K367-Y369 HydrophobicContact CG-CD2 4.33Å; K367-Y369 HydrophobicContact CG-CE2 3.88Å; K367-Y369 PolarHBondContact NZ-OH 2.86Å; K367-Y369 WeakPolarHBondContact O-CD2 3.31Å; K367-Y369 PolarHBondContact O-N 3.34Å; Y369-G371 PolarHBondContact O-N 3.42Å; Y369-G372 WeakPolarHBondContact O-CA 3.49Å; Y369-G372 PolarHBondContact O-N 2.72Å; Y369-Y374 HydrophobicContact CD1-CD1 4.46Å; Y369-Y374 AromaticContact CD1-CG 3.99Å; Y369-Y374 HydrophobicContact CD1-CG 3.99Å; Y369-Y374 AromaticContact CD2-CD1 3.65Å; Y369-Y374 HydrophobicContact CD2-CD1 3.65Å; Y369-Y374 HydrophobicContact CD2-CD2 4.1Å; Y369-Y374 AromaticContact CD2-CE1 3.93Å; Y369-Y374 HydrophobicContact CD2-CE1 3.93Å; Y369-Y374 HydrophobicContact CD2-CE2 4.37Å; Y369-Y374 AromaticContact CD2-CG 3.74Å; Y369-Y374 HydrophobicContact CD2-CG 3.74Å; Y369-Y374 HydrophobicContact CE1-CD2 4.3Å; Y369-Y374 HydrophobicContact CE1-CG 4.18Å; Y369-Y374 HydrophobicContact CE2-CD1 4.2Å; Y369-Y374 AromaticContact CE2-CD2 3.81Å; Y369-Y374 HydrophobicContact CE2-CD2 3.81Å; Y369-Y374 HydrophobicContact CE2-CE1 4.34Å; Y369-Y374 AromaticContact CE2-CE2 3.99Å; Y369-Y374 HydrophobicContact CE2-CE2 3.99Å; Y369-Y374 AromaticContact CE2-CG 3.93Å; Y369-Y374 HydrophobicContact CE2-CG 3.93Å; Y369-Y374 AromaticContact CG-CD1 3.78Å; Y369-Y374 HydrophobicContact CG-CD1 3.78Å; Y369-Y374 HydrophobicContact CG-CD2 4.45Å; Y369-Y374 AromaticContact CG-CG 3.75Å; Y369-Y374 HydrophobicContact CG-CG 3.75Å; Y369-Y374 AromaticContact CZ-CD2 3.91Å; Y369-D378 HydrophobicContact CE1-CB 3.84Å; Y369-D378 PolarHBondContact OH-O 3.15Å; Y369-D378 VanDerWaalsContact OH-O 3.04Å; Y369-T379 WeakPolarHBondContact OH-CA 3.42Å; Y369-N386 WeakPolarHBondContact CE2-OD1 3.31Å; Y369-N386 PolarHBondContact OH-OD1 2.96Å
370	Q	96.4	Very high	95.6	Very high	172 Å²	172	53.7 Å²	53.7	80%	0.804	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	129	179.5	-169	176.3	17.3	0	0	111.5	W273 G372	W273-Q370 HydrophobicContact CH2-CB 4.25Å; W273-Q370 HydrophobicContact CH2-CG 3.84Å; W273-Q370 HydrophobicContact CZ3-CG 4.15Å; Q370-G372 VanDerWaalsContact C-N 3.28Å
371	G	95.8	Very high	95	Very high	46 Å²	46	61.8 Å²	61.8	47%	0.474	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.4	-1.8	-172.7	0	0	0	0	0	114.4	W273 Y369 R373	W273-G371 VanDerWaalsContact CH2-N 3.28Å; W273-G371 VanDerWaalsContact CZ2-N 3.31Å; Y369-G371 PolarHBondContact O-N 3.42Å; G371-R373 VanDerWaalsContact C-N 3.28Å; G371-R373 PolarHBondContact O-N 3.22Å
372	G	95.6	Very high	94.5	Very high	0 Å²	0	66.4 Å²	66.4	0%	0	33%	0.327	C	S	.	.	S	Bend	trans	80.2	-49.3	165.7	0	0	0	0	0	115.9	Y369 Q370 Y374 Y398 S399	Y369-G372 WeakPolarHBondContact O-CA 3.49Å; Y369-G372 PolarHBondContact O-N 2.72Å; Q370-G372 VanDerWaalsContact C-N 3.28Å; G372-Y374 WeakPolarHBondContact O-CD1 3.33Å; G372-Y374 PolarHBondContact O-N 3.23Å; G372-Y398 CarbonylContact O-C 3.56Å; G372-Y398 WeakPolarHBondContact O-CA 3.41Å; G372-S399 WeakPolarHBondContact CA-O 3.42Å; G372-S399 PolarHBondContact O-N 2.81Å
373	R	96.5	Very high	94	Very high	205 Å²	205	67 Å²	67	77%	0.774	33%	0.334	S	S	*	.	B	Isolated β-bridge	trans	-75.8	127.2	178.2	-67.8	-175.7	-177.5	173.4	3.5	110.9	G371 Y398	G371-R373 VanDerWaalsContact C-N 3.28Å; G371-R373 PolarHBondContact O-N 3.22Å; R373-Y398 HydrophobicContact CG-CD2 4.02Å; R373-Y398 HydrophobicContact CG-CE2 4.43Å
374	Y	96.8	Very high	93.7	Very high	16 Å²	16	71.3 Å²	71.3	6%	0.063	35%	0.353	C	S	.	.			trans	-137	174.8	171.6	66.4	-82	0	0	0	109.9	Y369 G372 T379 D385 G387 T389 R396 W397	Y369-Y374 HydrophobicContact CD1-CD1 4.46Å; Y369-Y374 AromaticContact CD1-CG 3.99Å; Y369-Y374 HydrophobicContact CD1-CG 3.99Å; Y369-Y374 AromaticContact CD2-CD1 3.65Å; Y369-Y374 HydrophobicContact CD2-CD1 3.65Å; Y369-Y374 HydrophobicContact CD2-CD2 4.1Å; Y369-Y374 AromaticContact CD2-CE1 3.93Å; Y369-Y374 HydrophobicContact CD2-CE1 3.93Å; Y369-Y374 HydrophobicContact CD2-CE2 4.37Å; Y369-Y374 AromaticContact CD2-CG 3.74Å; Y369-Y374 HydrophobicContact CD2-CG 3.74Å; Y369-Y374 HydrophobicContact CE1-CD2 4.3Å; Y369-Y374 HydrophobicContact CE1-CG 4.18Å; Y369-Y374 HydrophobicContact CE2-CD1 4.2Å; Y369-Y374 AromaticContact CE2-CD2 3.81Å; Y369-Y374 HydrophobicContact CE2-CD2 3.81Å; Y369-Y374 HydrophobicContact CE2-CE1 4.34Å; Y369-Y374 AromaticContact CE2-CE2 3.99Å; Y369-Y374 HydrophobicContact CE2-CE2 3.99Å; Y369-Y374 AromaticContact CE2-CG 3.93Å; Y369-Y374 HydrophobicContact CE2-CG 3.93Å; Y369-Y374 AromaticContact CG-CD1 3.78Å; Y369-Y374 HydrophobicContact CG-CD1 3.78Å; Y369-Y374 HydrophobicContact CG-CD2 4.45Å; Y369-Y374 AromaticContact CG-CG 3.75Å; Y369-Y374 HydrophobicContact CG-CG 3.75Å; Y369-Y374 AromaticContact CZ-CD2 3.91Å; G372-Y374 WeakPolarHBondContact O-CD1 3.33Å; G372-Y374 PolarHBondContact O-N 3.23Å; Y374-T379 HydrophobicContact CD2-CG2 3.98Å; Y374-T379 HydrophobicContact CE2-CG2 4.04Å; Y374-D385 HydrophobicContact CE2-CB 4.29Å; Y374-G387 WeakPolarHBondContact OH-CA 3.33Å; Y374-G387 PolarHBondContact OH-N 3.26Å; Y374-T389 WeakPolarHBondContact OH-CG2 3.47Å; Y374-R396 PolarHBondContact OH-O 3.07Å; Y374-W397 AromaticContact CD2-CE3 3.55Å; Y374-W397 HydrophobicContact CD2-CE3 3.55Å; Y374-W397 AromaticContact CD2-CZ3 3.72Å; Y374-W397 HydrophobicContact CD2-CZ3 3.72Å; Y374-W397 AromaticContact CE2-CE3 3.41Å; Y374-W397 HydrophobicContact CE2-CE3 3.41Å; Y374-W397 VanDerWaalsContact CE2-CE3 3.41Å; Y374-W397 AromaticContact CE2-CZ3 3.52Å; Y374-W397 HydrophobicContact CE2-CZ3 3.52Å; Y374-W397 HydrophobicContact CG-CE3 4.39Å; Y374-W397 PolarHBondContact N-O 3.37Å
375	S	95.5	Very high	93.5	Very high	46 Å²	46	71.8 Å²	71.8	32%	0.322	36%	0.355	S	S	.	.			trans	-140.2	167.4	-178.9	70.3	0	0	0	0	110.9	K377 D378 T379	S375-K377 PolarHBondContact O-N 3.45Å; S375-D378 WeakPolarHBondContact CA-OD2 3.35Å; S375-D378 WeakPolarHBondContact CB-OD2 3.3Å; S375-D378 PolarHBondContact N-OD2 3.11Å; S375-D378 WeakPolarHBondContact O-CB 3.37Å; S375-D378 PolarHBondContact O-N 3.49Å; S375-D378 PolarHBondContact OG-OD2 2.93Å; S375-T379 WeakPolarHBondContact O-CG2 3.35Å
376	E	93.4	Very high	93.4	Very high	130 Å²	130	72.3 Å²	72.3	61%	0.607	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-42.4	-41.6	173.1	172.7	177.3	-163.8	0	0	112.9	D378 T379 G383 W397	E376-D378 PolarHBondContact O-N 3.29Å; E376-D378 VanDerWaalsContact O-N 3.15Å; E376-T379 PolarHBondContact O-N 3.31Å; E376-T379 VanDerWaalsContact O-N 3.1Å; E376-T379 PolarHBondContact O-OG1 3.4Å; E376-G383 WeakPolarHBondContact CG-O 3.43Å; E376-W397 HydrophobicContact CB-CH2 3.95Å; E376-W397 HydrophobicContact CB-CZ2 4.38Å
377	K	91.9	Very high	93.4	Very high	194 Å²	194	72.2 Å²	72.2	84%	0.843	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-62.2	-23.2	-179.9	-61.8	176.6	-177.7	174.3	0	114.2	S375	S375-K377 PolarHBondContact O-N 3.45Å
378	D	91.4	Very high	93.5	Very high	79 Å²	79	67.7 Å²	67.7	42%	0.422	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-92	-8.4	-177.6	-49.1	-66.3	0	0	0	112.3	K367 Y369 S375 E376	K367-D378 PolarHBondContact NZ-O 3.49Å; Y369-D378 HydrophobicContact CE1-CB 3.84Å; Y369-D378 PolarHBondContact OH-O 3.15Å; Y369-D378 VanDerWaalsContact OH-O 3.04Å; S375-D378 WeakPolarHBondContact CA-OD2 3.35Å; S375-D378 WeakPolarHBondContact CB-OD2 3.3Å; S375-D378 PolarHBondContact N-OD2 3.11Å; S375-D378 WeakPolarHBondContact O-CB 3.37Å; S375-D378 PolarHBondContact O-N 3.49Å; S375-D378 PolarHBondContact OG-OD2 2.93Å; E376-D378 PolarHBondContact O-N 3.29Å; E376-D378 VanDerWaalsContact O-N 3.15Å
379	T	88.4	Confident	93.5	Very high	11 Å²	11	65.8 Å²	65.8	7%	0.067	33%	0.33	C	S	.	.	S	Bend	trans	-92.5	-11.6	-171.3	68.6	0	0	0	0	114.6	Y369 Y374 S375 E376 G383 F384 N386 W397	Y369-T379 WeakPolarHBondContact OH-CA 3.42Å; Y374-T379 HydrophobicContact CD2-CG2 3.98Å; Y374-T379 HydrophobicContact CE2-CG2 4.04Å; S375-T379 WeakPolarHBondContact O-CG2 3.35Å; E376-T379 PolarHBondContact O-N 3.31Å; E376-T379 VanDerWaalsContact O-N 3.1Å; E376-T379 PolarHBondContact O-OG1 3.4Å; T379-G383 VanDerWaalsContact OG1-C 3.27Å; T379-G383 WeakPolarHBondContact OG1-CA 3.45Å; T379-G383 PolarHBondContact OG1-N 3.01Å; T379-F384 VanDerWaalsContact CB-O 3.28Å; T379-F384 WeakPolarHBondContact CB-O 3.27Å; T379-F384 WeakPolarHBondContact CG2-O 3.41Å; T379-N386 PolarHBondContact O-ND2 2.99Å; T379-W397 HydrophobicContact CG2-CH2 4.25Å; T379-W397 HydrophobicContact CG2-CZ3 3.73Å
380	G	85.1	Confident	93.5	Very high	58 Å²	58	64.7 Å²	64.7	60%	0.598	33%	0.326	S	S	*	.			trans	96.2	-143.5	176.5	0	0	0	0	0	113.2	Y382	G380-Y382 PolarHBondContact O-N 3.27Å
381	E	84.8	Confident	93.6	Very high	181 Å²	181	57 Å²	57	85%	0.846	29%	0.29	S	S	*	.	S	Bend	trans	-68.9	-31	-171.3	-172.9	174	170	0	0	113.8
382	Y	87.1	Confident	93.7	Very high	96 Å²	96	57 Å²	57	38%	0.376	28%	0.281	S	S	.	.	S	Bend	trans	-89.5	-23.1	-171.3	-59	-63.4	0	0	0	115.1	Q349 G380 F384	Q349-Y382 HydrophobicContact CB-CD2 3.97Å; Q349-Y382 HydrophobicContact CB-CE2 4.45Å; Q349-Y382 HydrophobicContact CB-CG 4.08Å; Q349-Y382 HydrophobicContact CG-CD1 3.86Å; Q349-Y382 HydrophobicContact CG-CD2 3.92Å; Q349-Y382 HydrophobicContact CG-CE1 4.09Å; Q349-Y382 HydrophobicContact CG-CE2 4.13Å; Q349-Y382 HydrophobicContact CG-CG 3.77Å; G380-Y382 PolarHBondContact O-N 3.27Å; Y382-F384 VanDerWaalsContact C-N 3.31Å; Y382-F384 VanDerWaalsContact O-CD2 3.26Å; Y382-F384 WeakPolarHBondContact O-CD2 3.34Å; Y382-F384 VanDerWaalsContact O-CE2 3.27Å; Y382-F384 WeakPolarHBondContact O-CE2 3.47Å; Y382-F384 PolarHBondContact O-N 2.95Å
383	G	89.1	Confident	93.8	Very high	14 Å²	14	59.2 Å²	59.2	14%	0.144	29%	0.29	C	S	.	.			trans	77.6	-1.2	175.5	0	0	0	0	0	117.1	E376 T379	E376-G383 WeakPolarHBondContact CG-O 3.43Å; T379-G383 VanDerWaalsContact OG1-C 3.27Å; T379-G383 WeakPolarHBondContact OG1-CA 3.45Å; T379-G383 PolarHBondContact OG1-N 3.01Å
384	F	92.3	Very high	93.9	Very high	90 Å²	90	51.3 Å²	51.3	40%	0.395	26%	0.261	S	S	.	.	S	Bend	trans	-92.5	157.8	-176	-58.1	-64.5	0	0	0	113.8	T379 Y382 N386	T379-F384 VanDerWaalsContact CB-O 3.28Å; T379-F384 WeakPolarHBondContact CB-O 3.27Å; T379-F384 WeakPolarHBondContact CG2-O 3.41Å; Y382-F384 VanDerWaalsContact C-N 3.31Å; Y382-F384 VanDerWaalsContact O-CD2 3.26Å; Y382-F384 WeakPolarHBondContact O-CD2 3.34Å; Y382-F384 VanDerWaalsContact O-CE2 3.27Å; Y382-F384 WeakPolarHBondContact O-CE2 3.47Å; Y382-F384 PolarHBondContact O-N 2.95Å; F384-N386 PolarHBondContact O-N 2.81Å
385	D	94.4	Very high	93.8	Very high	9 Å²	9	54.1 Å²	54.1	5%	0.048	28%	0.284	C	S	.	.			trans	-69.9	111.2	179.5	59.3	-67.7	0	0	0	112.7	H360 Y374 R396 W397	H360-D385 PolarHBondContact CE1-O 3.33Å; H360-D385 IonicContact CE1-OD2 2.68Å; H360-D385 PolarHBondContact CE1-OD2 2.76Å; H360-D385 VanDerWaalsContact CE1-OD2 3.31Å; H360-D385 PolarHBondContact NE2-O 2.79Å; H360-D385 VanDerWaalsContact NE2-O 3.12Å; Y374-D385 HydrophobicContact CE2-CB 4.29Å; D385-R396 HydrophobicContact CB-CB 4.23Å; D385-R396 HydrophobicContact CB-CG 4.27Å; D385-R396 VanDerWaalsContact CB-O 3.27Å; D385-R396 WeakPolarHBondContact CB-O 3.04Å; D385-R396 IonicContact OD1-CZ 2.79Å; D385-R396 IonicContact OD1-NE 2.74Å; D385-R396 PolarHBondContact OD1-NE 3.12Å; D385-R396 IonicContact OD1-NH2 3.51Å; D385-R396 PolarHBondContact OD1-NH2 2.88Å; D385-R396 WeakPolarHBondContact OD2-CB 3.47Å; D385-R396 IonicContact OD2-NE 3.16Å; D385-W397 HydrophobicContact CB-CE3 4.4Å; D385-W397 HydrophobicContact CB-CH2 4.23Å; D385-W397 HydrophobicContact CB-CZ2 4.5Å; D385-W397 HydrophobicContact CB-CZ3 4.19Å
386	N	96.9	Very high	93.8	Very high	11 Å²	11	54 Å²	54	6%	0.059	28%	0.276	C	S	.	.			trans	-123.5	20.7	-174.4	62.5	8.8	0	0	0	113.7	D350 G366 K367 Y369 T379 F384	D350-N386 HydrophobicContact CB-CB 3.9Å; G366-N386 CarbonylContact C-O 3.16Å; G366-N386 WeakPolarHBondContact CA-O 3.43Å; K367-N386 WeakPolarHBondContact CB-O 3.4Å; K367-N386 PolarHBondContact N-O 3.46Å; Y369-N386 WeakPolarHBondContact CE2-OD1 3.31Å; Y369-N386 PolarHBondContact OH-OD1 2.96Å; T379-N386 PolarHBondContact O-ND2 2.99Å; F384-N386 PolarHBondContact O-N 2.81Å
387	G	97.8	Very high	94	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.261	C	S	.	.	B	Isolated β-bridge	trans	-85.7	-175.4	177.8	0	0	0	0	0	113.5	H363 K367 Y374 T389	H363-G387 PolarHBondContact ND1-O 3.48Å; K367-G387 WeakPolarHBondContact O-CA 3.47Å; Y374-G387 WeakPolarHBondContact OH-CA 3.33Å; Y374-G387 PolarHBondContact OH-N 3.26Å; G387-T389 PolarHBondContact O-N 2.95Å
388	I	98.6	Very high	94.3	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.225	C	C	.	.	S	Bend	trans	-80.9	81.4	178.1	-53.2	179	0	0	0	110	R217 H363 Y368 S399 L400 T403	R217-I388 HydrophobicContact CB-CD1 4.18Å; R217-I388 HydrophobicContact CG-CD1 4.24Å; H363-I388 VanDerWaalsContact O-CA 3.3Å; H363-I388 WeakPolarHBondContact O-CA 3.43Å; Y368-I388 HydrophobicContact CD2-CD1 3.56Å; Y368-I388 HydrophobicContact CE2-CD1 4.3Å; Y368-I388 HydrophobicContact CG-CD1 4.32Å; I388-S399 WeakPolarHBondContact CB-OG 3.44Å; I388-S399 PolarHBondContact N-OG 3.17Å; I388-S399 VanDerWaalsContact N-OG 3.08Å; I388-S399 WeakPolarHBondContact O-CA 3.35Å; I388-L400 HydrophobicContact CB-CB 4.4Å; I388-L400 HydrophobicContact CG2-CB 4.03Å; I388-L400 WeakPolarHBondContact O-CG 3.46Å; I388-L400 PolarHBondContact O-N 3.23Å; I388-T403 HydrophobicContact CG2-CG2 3.51Å
389	T	98.1	Very high	94.6	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	155.5	-168.1	65.4	0	0	0	0	114.6	H363 Y374 G387	H363-T389 WeakPolarHBondContact CB-OG1 3.49Å; H363-T389 PolarHBondContact N-O 3.43Å; H363-T389 PolarHBondContact O-N 2.91Å; Y374-T389 WeakPolarHBondContact OH-CG2 3.47Å; G387-T389 PolarHBondContact O-N 2.95Å
390	W	98.5	Very high	95.1	Very high	1 Å²	1	39 Å²	39	0%	0.004	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	94.3	168.5	-167.9	-90.7	0	0	0	110	I268 L270 A280 Y282 A306 G307 A309 F310 A362 L364 T392 W393 H394 L400	I268-W390 HydrophobicContact CD1-CH2 3.57Å; I268-W390 HydrophobicContact CD1-CZ3 3.68Å; I268-W390 HydrophobicContact CG2-CH2 4.48Å; I268-W390 HydrophobicContact CG2-CZ3 4.31Å; L270-W390 HydrophobicContact CD1-CB 3.89Å; L270-W390 HydrophobicContact CD1-CD2 3.73Å; L270-W390 HydrophobicContact CD1-CE3 4.32Å; L270-W390 HydrophobicContact CD1-CG 3.51Å; A280-W390 HydrophobicContact CB-CH2 4.32Å; A280-W390 HydrophobicContact CB-CZ2 3.71Å; Y282-W390 HydrophobicContact CE2-CH2 4.02Å; Y282-W390 HydrophobicContact CE2-CZ2 4.4Å; Y282-W390 WeakPolarHBondContact OH-CH2 3.49Å; Y282-W390 WeakPolarHBondContact OH-CZ2 3.13Å; A306-W390 PolarHBondContact O-NE1 3.1Å; G307-W390 WeakPolarHBondContact O-CZ2 3.24Å; G307-W390 PolarHBondContact O-NE1 3.47Å; A309-W390 HydrophobicContact CB-CD2 3.74Å; A309-W390 VanDerWaalsContact CB-CE2 3.49Å; A309-W390 HydrophobicContact CB-CE3 4.16Å; A309-W390 HydrophobicContact CB-CG 4.19Å; A309-W390 HydrophobicContact CB-CH2 4.15Å; A309-W390 HydrophobicContact CB-CZ2 3.73Å; A309-W390 HydrophobicContact CB-CZ3 4.36Å; F310-W390 HydrophobicContact CD1-CH2 4.38Å; F310-W390 HydrophobicContact CD1-CZ3 4.45Å; F310-W390 HydrophobicContact CE1-CH2 4.37Å; F310-W390 HydrophobicContact CE1-CZ3 4.13Å; F310-W390 HydrophobicContact CZ-CZ3 4.44Å; A362-W390 HydrophobicContact CB-CD2 4.29Å; A362-W390 HydrophobicContact CB-CE3 3.44Å; A362-W390 VanDerWaalsContact CB-CE3 3.44Å; A362-W390 HydrophobicContact CB-CH2 4.28Å; A362-W390 HydrophobicContact CB-CZ3 3.45Å; A362-W390 VanDerWaalsContact CB-CZ3 3.45Å; L364-W390 HydrophobicContact CD1-CZ3 4.48Å; L364-W390 HydrophobicContact CD2-CE3 3.94Å; L364-W390 HydrophobicContact CD2-CZ3 4.44Å; W390-T392 VanDerWaalsContact C-N 3.32Å; W390-T392 PolarHBondContact NE1-OG1 2.05Å; W390-T392 PolarHBondContact O-N 2.74Å; W390-W393 PolarHBondContact O-N 2.88Å; W390-H394 PolarHBondContact O-N 2.82Å; W390-L400 HydrophobicContact CB-CD1 4.08Å
391	L	97.9	Very high	95.7	Very high	10 Å²	10	39.3 Å²	39.3	5%	0.052	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-24.4	-161.5	-64.5	-170.9	0	0	0	115.2	F313 L315 A361 W393 H394 R396	F313-L391 HydrophobicContact CB-CB 3.79Å; F313-L391 HydrophobicContact CB-CD1 3.92Å; F313-L391 HydrophobicContact CD1-CB 3.91Å; F313-L391 HydrophobicContact CD1-CD1 3.94Å; F313-L391 HydrophobicContact CD2-CB 3.89Å; F313-L391 HydrophobicContact CE1-CB 4.47Å; F313-L391 HydrophobicContact CE2-CB 4.45Å; F313-L391 VanDerWaalsContact CE2-O 3.31Å; F313-L391 WeakPolarHBondContact CE2-O 3.42Å; F313-L391 HydrophobicContact CG-CB 3.59Å; F313-L391 HydrophobicContact CG-CD1 4.13Å; L315-L391 HydrophobicContact CD2-CD1 3.8Å; L315-L391 HydrophobicContact CG-CD1 4.42Å; A361-L391 HydrophobicContact CB-CB 4.34Å; A361-L391 HydrophobicContact CB-CD1 3.85Å; A361-L391 HydrophobicContact CB-CG 4.23Å; A361-L391 WeakPolarHBondContact O-CB 3.4Å; A361-L391 VanDerWaalsContact O-CG 3.3Å; A361-L391 WeakPolarHBondContact O-CG 3.17Å; A361-L391 PolarHBondContact O-N 3.45Å; L391-W393 PolarHBondContact O-N 3.02Å; L391-H394 WeakPolarHBondContact CA-O 3.29Å; L391-R396 VanDerWaalsContact CD2-CA 3.43Å; L391-R396 HydrophobicContact CD2-CB 3.58Å
392	T	97.9	Very high	96.4	Very high	47 Å²	47	32.1 Å²	32.1	29%	0.288	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-2.9	174.3	55.4	0	0	0	0	114	A306 D308 A309 F313 W390	A306-T392 CarbonylContact O-C 3.53Å; A306-T392 WeakPolarHBondContact O-CB 3.38Å; A306-T392 PolarHBondContact O-OG1 2.96Å; D308-T392 WeakPolarHBondContact O-CG2 3.33Å; A309-T392 HydrophobicContact CB-CG2 4.14Å; F313-T392 HydrophobicContact CD2-CG2 4Å; W390-T392 VanDerWaalsContact C-N 3.32Å; W390-T392 PolarHBondContact NE1-OG1 2.05Å; W390-T392 PolarHBondContact O-N 2.74Å
393	W	97.9	Very high	96.9	Very high	45 Å²	45	27.6 Å²	27.6	17%	0.17	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-122.2	-47	174.8	-177.8	20.2	0	0	0	113.2	L270 D272 N276 K278 W390 L391 L400	L270-W393 HydrophobicContact CB-CE3 4.07Å; L270-W393 HydrophobicContact CB-CZ3 3.57Å; L270-W393 HydrophobicContact CD1-CE3 4.05Å; L270-W393 HydrophobicContact CD1-CZ3 4.41Å; D272-W393 HydrophobicContact CB-CH2 3.73Å; D272-W393 HydrophobicContact CB-CZ2 3.98Å; N276-W393 HydrophobicContact CB-CZ2 4.04Å; K278-W393 HydrophobicContact CB-CD2 4.3Å; K278-W393 HydrophobicContact CB-CE3 4.07Å; K278-W393 HydrophobicContact CB-CH2 4.24Å; K278-W393 HydrophobicContact CB-CZ2 4.46Å; K278-W393 HydrophobicContact CB-CZ3 4.05Å; K278-W393 HydrophobicContact CD-CD2 3.58Å; K278-W393 HydrophobicContact CD-CE3 4.2Å; K278-W393 HydrophobicContact CD-CG 3.76Å; K278-W393 HydrophobicContact CD-CZ2 4.1Å; K278-W393 HydrophobicContact CG-CD2 4.05Å; K278-W393 HydrophobicContact CG-CE3 4.29Å; K278-W393 HydrophobicContact CG-CH2 4.08Å; K278-W393 HydrophobicContact CG-CZ2 3.83Å; K278-W393 HydrophobicContact CG-CZ3 4.31Å; W390-W393 PolarHBondContact O-N 2.88Å; L391-W393 PolarHBondContact O-N 3.02Å; W393-L400 HydrophobicContact CE3-CD2 3.86Å; W393-L400 HydrophobicContact CH2-CD2 4.28Å; W393-L400 HydrophobicContact CZ3-CD2 3.52Å
394	H	97.5	Very high	97.4	Very high	39 Å²	39	27.4 Å²	27.4	18%	0.181	13%	0.131	C	C	.	.	S	Bend	trans	-128.1	161.6	-178.4	-72.4	-78.1	0	0	0	112.3	D272 W390 L391 Y398	D272-H394 IonicContact OD2-CE1 3.23Å; D272-H394 IonicContact OD2-NE2 2.66Å; W390-H394 PolarHBondContact O-N 2.82Å; L391-H394 WeakPolarHBondContact CA-O 3.29Å; H394-Y398 HydrophobicContact CB-CD1 3.81Å; H394-Y398 HydrophobicContact CB-CG 4.1Å; H394-Y398 AromaticContact CD2-CD1 3.88Å; H394-Y398 AromaticContact CD2-CE1 3.92Å; H394-Y398 AromaticContact CE1-CE1 3.84Å; H394-Y398 AromaticContact CG-CD1 3.61Å; H394-Y398 AromaticContact CG-CE1 3.99Å; H394-Y398 AromaticContact ND1-CD1 3.81Å; H394-Y398 AromaticContact ND1-CE1 3.94Å; H394-Y398 AromaticContact NE2-CE1 3.83Å
395	S	95.3	Very high	97.7	Very high	76 Å²	76	23.1 Å²	23.1	53%	0.531	11%	0.113	S	C	.	.			trans	-60.1	152.7	174.3	179.8	0	0	0	0	112.2	W397 Y398	S395-W397 PolarHBondContact O-N 3.07Å; S395-W397 PolarHBondContact OG-N 3.31Å; S395-Y398 WeakPolarHBondContact O-CB 3.29Å; S395-Y398 PolarHBondContact O-N 2.8Å
396	R	95.3	Very high	97.9	Very high	42 Å²	42	22.8 Å²	22.8	16%	0.158	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-20.7	171.7	83.9	-170.9	-75.3	-169	0.2	114	E317 Y374 D385 L391	E317-R396 IonicContact OE1-NH1 3.05Å; E317-R396 PolarHBondContact OE1-NH1 3.45Å; E317-R396 IonicContact OE2-NH1 3.3Å; E317-R396 PolarHBondContact OE2-NH1 2.81Å; Y374-R396 PolarHBondContact OH-O 3.07Å; D385-R396 HydrophobicContact CB-CB 4.23Å; D385-R396 HydrophobicContact CB-CG 4.27Å; D385-R396 VanDerWaalsContact CB-O 3.27Å; D385-R396 WeakPolarHBondContact CB-O 3.04Å; D385-R396 IonicContact OD1-CZ 2.79Å; D385-R396 IonicContact OD1-NE 2.74Å; D385-R396 PolarHBondContact OD1-NE 3.12Å; D385-R396 IonicContact OD1-NH2 3.51Å; D385-R396 PolarHBondContact OD1-NH2 2.88Å; D385-R396 WeakPolarHBondContact OD2-CB 3.47Å; D385-R396 IonicContact OD2-NE 3.16Å; L391-R396 VanDerWaalsContact CD2-CA 3.43Å; L391-R396 HydrophobicContact CD2-CB 3.58Å
397	W	97	Very high	97.9	Very high	78 Å²	78	22.4 Å²	22.4	30%	0.295	11%	0.109	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.2	22.4	177.4	-64.1	112.9	0	0	0	114.3	Y374 E376 T379 D385 S395	Y374-W397 AromaticContact CD2-CE3 3.55Å; Y374-W397 HydrophobicContact CD2-CE3 3.55Å; Y374-W397 AromaticContact CD2-CZ3 3.72Å; Y374-W397 HydrophobicContact CD2-CZ3 3.72Å; Y374-W397 AromaticContact CE2-CE3 3.41Å; Y374-W397 HydrophobicContact CE2-CE3 3.41Å; Y374-W397 VanDerWaalsContact CE2-CE3 3.41Å; Y374-W397 AromaticContact CE2-CZ3 3.52Å; Y374-W397 HydrophobicContact CE2-CZ3 3.52Å; Y374-W397 HydrophobicContact CG-CE3 4.39Å; Y374-W397 PolarHBondContact N-O 3.37Å; E376-W397 HydrophobicContact CB-CH2 3.95Å; E376-W397 HydrophobicContact CB-CZ2 4.38Å; T379-W397 HydrophobicContact CG2-CH2 4.25Å; T379-W397 HydrophobicContact CG2-CZ3 3.73Å; D385-W397 HydrophobicContact CB-CE3 4.4Å; D385-W397 HydrophobicContact CB-CH2 4.23Å; D385-W397 HydrophobicContact CB-CZ2 4.5Å; D385-W397 HydrophobicContact CB-CZ3 4.19Å; S395-W397 PolarHBondContact O-N 3.07Å; S395-W397 PolarHBondContact OG-N 3.31Å
398	Y	98.2	Very high	97.9	Very high	22 Å²	22	22.5 Å²	22.5	9%	0.086	11%	0.109	C	C	.	.	B	Isolated β-bridge	trans	-129.7	110.6	177.7	-170	-83.7	0	0	0	111.4	D272 W273 G372 R373 H394 S395 L400	D272-Y398 HydrophobicContact CB-CE1 4.05Å; D272-Y398 WeakPolarHBondContact CB-OH 3.3Å; W273-Y398 AromaticContact CD1-CZ 3.88Å; W273-Y398 PolarHBondContact N-OH 2.99Å; G372-Y398 CarbonylContact O-C 3.56Å; G372-Y398 WeakPolarHBondContact O-CA 3.41Å; R373-Y398 HydrophobicContact CG-CD2 4.02Å; R373-Y398 HydrophobicContact CG-CE2 4.43Å; H394-Y398 HydrophobicContact CB-CD1 3.81Å; H394-Y398 HydrophobicContact CB-CG 4.1Å; H394-Y398 AromaticContact CD2-CD1 3.88Å; H394-Y398 AromaticContact CD2-CE1 3.92Å; H394-Y398 AromaticContact CE1-CE1 3.84Å; H394-Y398 AromaticContact CG-CD1 3.61Å; H394-Y398 AromaticContact CG-CE1 3.99Å; H394-Y398 AromaticContact ND1-CD1 3.81Å; H394-Y398 AromaticContact ND1-CE1 3.94Å; H394-Y398 AromaticContact NE2-CE1 3.83Å; S395-Y398 WeakPolarHBondContact O-CB 3.29Å; S395-Y398 PolarHBondContact O-N 2.8Å; Y398-L400 HydrophobicContact CE1-CD2 4.41Å
399	S	98.3	Very high	97.7	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	11%	0.113	C	C	.	.			trans	-82.7	127.9	172.1	-175.1	0	0	0	0	110.1	W273 G372 I388	W273-S399 PolarHBondContact NE1-O 2.91Å; G372-S399 WeakPolarHBondContact CA-O 3.42Å; G372-S399 PolarHBondContact O-N 2.81Å; I388-S399 WeakPolarHBondContact CB-OG 3.44Å; I388-S399 PolarHBondContact N-OG 3.17Å; I388-S399 VanDerWaalsContact N-OG 3.08Å; I388-S399 WeakPolarHBondContact O-CA 3.35Å
400	L	98.6	Very high	97.5	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	12%	0.124	C	C	.	.			trans	-62.9	158.5	172.1	-65.8	168.4	0	0	0	111.7	L270 D272 I388 W390 W393 Y398 T403	L270-L400 HydrophobicContact CB-CD1 4.05Å; L270-L400 HydrophobicContact CD1-CD1 4.05Å; L270-L400 HydrophobicContact CD2-CD1 3.78Å; L270-L400 HydrophobicContact CG-CD1 4.17Å; D272-L400 HydrophobicContact CB-CD2 4.49Å; I388-L400 HydrophobicContact CB-CB 4.4Å; I388-L400 HydrophobicContact CG2-CB 4.03Å; I388-L400 WeakPolarHBondContact O-CG 3.46Å; I388-L400 PolarHBondContact O-N 3.23Å; W390-L400 HydrophobicContact CB-CD1 4.08Å; W393-L400 HydrophobicContact CE3-CD2 3.86Å; W393-L400 HydrophobicContact CH2-CD2 4.28Å; W393-L400 HydrophobicContact CZ3-CD2 3.52Å; Y398-L400 HydrophobicContact CE1-CD2 4.41Å; L400-T403 HydrophobicContact CB-CG2 4.04Å; L400-T403 HydrophobicContact CD1-CG2 3.96Å
401	K	98.5	Very high	97	Very high	65 Å²	65	29 Å²	29	28%	0.283	15%	0.152	S	C	.	.	S	Bend	trans	-89.9	-47.1	-179.5	-174.5	-163.7	169.4	-136.6	0	111.5	V271 W273 Y368	V271-K401 WeakPolarHBondContact O-CB 3.21Å; V271-K401 PolarHBondContact O-N 2.88Å; W273-K401 HydrophobicContact CD2-CB 3.81Å; W273-K401 HydrophobicContact CD2-CD 4.38Å; W273-K401 HydrophobicContact CD2-CG 3.91Å; W273-K401 HydrophobicContact CE3-CB 4.39Å; W273-K401 HydrophobicContact CE3-CD 4.2Å; W273-K401 HydrophobicContact CE3-CG 3.96Å; W273-K401 HydrophobicContact CG-CB 4.03Å; W273-K401 HydrophobicContact CH2-CG 4Å; W273-K401 HydrophobicContact CZ2-CB 4.06Å; W273-K401 HydrophobicContact CZ2-CG 3.96Å; W273-K401 HydrophobicContact CZ3-CD 4.47Å; W273-K401 HydrophobicContact CZ3-CG 4.02Å; Y368-K401 VanDerWaalsContact CE2-O 3.24Å; Y368-K401 WeakPolarHBondContact CE2-O 3.32Å; Y368-K401 PolarHBondContact OH-O 3.14Å
402	E	98.5	Very high	96.6	Very high	30 Å²	30	32.5 Å²	32.5	14%	0.14	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	139.2	178.2	-41.7	-177.2	-154.5	0	0	109.4	R217 R218 L270 V271	R217-E402 CarbonylContact O-C 3.55Å; R217-E402 WeakPolarHBondContact O-CA 3.45Å; R218-E402 HydrophobicContact CB-CG 4.39Å; R218-E402 IonicContact CZ-OE2 2.74Å; R218-E402 VanDerWaalsContact CZ-OE2 3.25Å; R218-E402 IonicContact NE-OE2 2.75Å; R218-E402 PolarHBondContact NE-OE2 2.96Å; R218-E402 IonicContact NH2-OE1 3.56Å; R218-E402 IonicContact NH2-OE2 2.7Å; R218-E402 PolarHBondContact NH2-OE2 3.24Å; L270-E402 CarbonylContact C-O 3.56Å; V271-E402 HydrophobicContact CB-CB 3.85Å; V271-E402 HydrophobicContact CB-CG 4.19Å; V271-E402 HydrophobicContact CG2-CB 3.93Å; V271-E402 PolarHBondContact N-O 2.8Å; V271-E402 PolarHBondContact O-N 2.95Å; V271-E402 VanDerWaalsContact O-N 3.1Å
403	T	98.4	Very high	95.8	Very high	1 Å²	1	31 Å²	31	1%	0.006	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	147.8	172.9	67.9	0	0	0	0	110.1	Q215 R217 E269 L270 L364 I388 L400	Q215-T403 PolarHBondContact NE2-OG1 3.22Å; Q215-T403 PolarHBondContact OE1-OG1 2.73Å; R217-T403 WeakPolarHBondContact CB-OG1 3.15Å; R217-T403 WeakPolarHBondContact CG-OG1 3.28Å; R217-T403 PolarHBondContact N-O 2.81Å; R217-T403 PolarHBondContact O-N 3.23Å; E269-T403 CarbonylContact O-C 3.43Å; E269-T403 WeakPolarHBondContact O-CA 3.29Å; L270-T403 HydrophobicContact CD2-CG2 3.78Å; L364-T403 HydrophobicContact CD2-CG2 4.04Å; I388-T403 HydrophobicContact CG2-CG2 3.51Å; L400-T403 HydrophobicContact CB-CG2 4.04Å; L400-T403 HydrophobicContact CD1-CG2 3.96Å
404	T	98.8	Very high	94.1	Very high	10 Å²	10	34 Å²	34	6%	0.061	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	120.1	178.4	-60.1	0	0	0	0	108.3	V213 R216 I268 E269 K406	V213-T404 HydrophobicContact CG1-CG2 3.93Å; V213-T404 HydrophobicContact CG2-CG2 4.46Å; R216-T404 WeakPolarHBondContact CD-OG1 3.36Å; R216-T404 PolarHBondContact NE-OG1 3.25Å; R216-T404 PolarHBondContact NH1-OG1 2.94Å; I268-T404 WeakPolarHBondContact CA-O 3.45Å; E269-T404 PolarHBondContact N-O 2.95Å; E269-T404 PolarHBondContact O-N 2.89Å; T404-K406 HydrophobicContact CG2-CB 4.44Å; T404-K406 HydrophobicContact CG2-CD 4.12Å; T404-K406 HydrophobicContact CG2-CG 4.42Å
405	M	98.9	Very high	91.6	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	124.8	167.2	-55.5	-178.9	71.2	0	0	107.9	I214 Q215 W247 L266 I268 W354 W355 L364	I214-M405 HydrophobicContact CD1-CB 4.12Å; I214-M405 HydrophobicContact CD1-CE 4.49Å; I214-M405 HydrophobicContact CG1-CB 3.63Å; I214-M405 WeakPolarHBondContact CG1-O 3.49Å; I214-M405 PolarHBondContact N-O 3.48Å; Q215-M405 HydrophobicContact CB-CB 3.88Å; Q215-M405 HydrophobicContact CB-CG 3.93Å; Q215-M405 HydrophobicContact CB-SD 3.99Å; Q215-M405 HydrophobicContact CG-SD 4.4Å; Q215-M405 PolarHBondContact N-O 2.9Å; Q215-M405 PolarHBondContact O-N 3.43Å; W247-M405 HydrophobicContact CZ3-SD 4.14Å; L266-M405 HydrophobicContact CD1-CB 4.04Å; L266-M405 HydrophobicContact CD1-CE 4.08Å; L266-M405 HydrophobicContact CD2-CE 3.88Å; I268-M405 HydrophobicContact CD1-CE 4.39Å; I268-M405 HydrophobicContact CG1-CE 4.49Å; I268-M405 HydrophobicContact CG1-CG 4.33Å; W354-M405 HydrophobicContact CH2-CE 4.3Å; W354-M405 HydrophobicContact CH2-SD 3.93Å; W354-M405 HydrophobicContact CZ3-SD 4.12Å; W355-M405 HydrophobicContact CH2-CE 4.4Å; W355-M405 HydrophobicContact CZ3-CE 4.1Å; L364-M405 HydrophobicContact CD1-CG 3.72Å; L364-M405 HydrophobicContact CD1-SD 3.96Å
406	K	98.7	Very high	88.9	Confident	1 Å²	1	35.8 Å²	35.8	0%	0.004	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	145.3	179.6	63.3	-172.5	172.8	-167	0	112.3	E203 F211 T212 V213 R267 E269 T404	E203-K406 IonicContact OE1-NZ 3.97Å; E203-K406 PolarHBondContact OE1-NZ 3.12Å; E203-K406 IonicContact OE2-NZ 3.88Å; E203-K406 PolarHBondContact OE2-NZ 2.99Å; F211-K406 HydrophobicContact CB-CB 4.2Å; F211-K406 HydrophobicContact CB-CD 3.89Å; F211-K406 HydrophobicContact CB-CG 4.16Å; F211-K406 HydrophobicContact CD1-CB 4.46Å; F211-K406 HydrophobicContact CD1-CD 4.01Å; F211-K406 HydrophobicContact CD1-CG 3.82Å; F211-K406 HydrophobicContact CG-CD 4Å; F211-K406 HydrophobicContact CG-CG 4.25Å; T212-K406 CarbonylContact O-C 3.44Å; T212-K406 VanDerWaalsContact O-CA 3.29Å; T212-K406 WeakPolarHBondContact O-CA 3.49Å; V213-K406 HydrophobicContact CB-CB 4.37Å; V213-K406 HydrophobicContact CG2-CB 3.94Å; V213-K406 HydrophobicContact CG2-CD 4.38Å; R267-K406 HydrophobicContact CB-CG 4.2Å; R267-K406 PolarHBondContact N-O 2.79Å; R267-K406 PolarHBondContact O-N 2.68Å; E269-K406 WeakPolarHBondContact OE1-CE 3.5Å; E269-K406 IonicContact OE1-NZ 2.75Å; E269-K406 PolarHBondContact OE1-NZ 3.19Å; E269-K406 WeakPolarHBondContact OE2-CE 3.38Å; E269-K406 IonicContact OE2-NZ 3.89Å; E269-K406 PolarHBondContact OE2-NZ 2.69Å; T404-K406 HydrophobicContact CG2-CB 4.44Å; T404-K406 HydrophobicContact CG2-CD 4.12Å; T404-K406 HydrophobicContact CG2-CG 4.42Å
407	I	98.1	Very high	86.1	Confident	4 Å²	4	37.7 Å²	37.7	2%	0.021	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	148.4	-174.5	61.9	175.6	0	0	0	111.9	F211 T212 I214 L256 T257 V265 L266 F285	F211-I407 WeakPolarHBondContact CA-O 3.45Å; T212-I407 PolarHBondContact N-O 2.94Å; T212-I407 PolarHBondContact O-N 3.33Å; I214-I407 HydrophobicContact CD1-CG2 4.08Å; I214-I407 HydrophobicContact CG2-CD1 4.03Å; I214-I407 HydrophobicContact CG2-CG1 4.02Å; I214-I407 HydrophobicContact CG2-CG2 4.47Å; L256-I407 HydrophobicContact CB-CD1 3.78Å; L256-I407 HydrophobicContact CD1-CD1 4.24Å; T257-I407 HydrophobicContact CG2-CD1 4.02Å; V265-I407 WeakPolarHBondContact O-CA 3.49Å; L266-I407 HydrophobicContact CB-CG2 4.38Å; L266-I407 HydrophobicContact CD1-CG2 4.14Å; F285-I407 HydrophobicContact CD1-CG2 3.76Å; F285-I407 HydrophobicContact CE1-CG2 3.74Å
408	I	96.8	Very high	83.2	Confident	2 Å²	2	37.6 Å²	37.6	1%	0.01	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	149.9	176.7	-166.8	170.4	0	0	0	110.1	R209 F211 T264 V265 V410 R412 I413	R209-I408 HydrophobicContact CB-CD1 3.75Å; R209-I408 HydrophobicContact CG-CD1 4.31Å; F211-I408 HydrophobicContact CD1-CB 3.71Å; F211-I408 HydrophobicContact CD1-CD1 4.23Å; F211-I408 HydrophobicContact CD1-CG2 3.88Å; F211-I408 HydrophobicContact CD2-CD1 4.13Å; F211-I408 HydrophobicContact CE1-CB 3.86Å; F211-I408 HydrophobicContact CE1-CD1 4.08Å; F211-I408 HydrophobicContact CE1-CG2 3.51Å; F211-I408 HydrophobicContact CE2-CD1 3.96Å; F211-I408 HydrophobicContact CG-CB 4.32Å; F211-I408 HydrophobicContact CG-CD1 4.26Å; F211-I408 HydrophobicContact CZ-CD1 3.93Å; F211-I408 HydrophobicContact CZ-CG2 4.21Å; T264-I408 CarbonylContact C-O 3.55Å; T264-I408 WeakPolarHBondContact CA-O 3.48Å; V265-I408 PolarHBondContact N-O 3.1Å; V265-I408 PolarHBondContact O-N 2.74Å; V265-I408 VanDerWaalsContact O-N 3.12Å; I408-V410 PolarHBondContact O-N 3.04Å; I408-R412 HydrophobicContact CD1-CB 3.76Å; I408-R412 HydrophobicContact CD1-CG 4.46Å; I408-R412 HydrophobicContact CG1-CB 4.03Å; I408-R412 HydrophobicContact CG1-CG 4.42Å; I408-I413 HydrophobicContact CG2-CD1 3.56Å; I408-I413 HydrophobicContact CG2-CG1 3.76Å
409	P	95.4	Very high	79.9	Confident	12 Å²	12	45.2 Å²	45.2	8%	0.078	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	136.1	171.9	-25.9	36	0	0	0	112.4	Q174 I262 S411 R412	Q174-P409 HydrophobicContact CB-CG 4.04Å; Q174-P409 HydrophobicContact CG-CG 4.24Å; I262-P409 HydrophobicContact CG2-CB 3.96Å; P409-S411 PolarHBondContact O-N 3.04Å; P409-S411 VanDerWaalsContact O-N 3.08Å; P409-R412 WeakPolarHBondContact O-CB 3.17Å; P409-R412 PolarHBondContact O-N 2.96Å
410	V	92	Very high	77.3	Confident	37 Å²	37	54.5 Å²	54.5	22%	0.224	35%	0.352	C	S	.	.	G	3₁₀ helix	trans	-56.2	-30.1	-175.9	68.7	0	0	0	0	113.3	I262 P263 V265 N283 I408 R412 I413	I262-V410 HydrophobicContact CG2-CG1 4.15Å; P263-V410 HydrophobicContact CB-CB 4.5Å; P263-V410 HydrophobicContact CB-CG1 4.02Å; P263-V410 HydrophobicContact CG-CG1 4.25Å; P263-V410 WeakPolarHBondContact O-CB 3.44Å; P263-V410 WeakPolarHBondContact O-CG1 3.27Å; P263-V410 PolarHBondContact O-N 2.85Å; V265-V410 HydrophobicContact CG2-CB 3.92Å; V265-V410 HydrophobicContact CG2-CG2 3.8Å; N283-V410 WeakPolarHBondContact OD1-CG2 3.26Å; I408-V410 PolarHBondContact O-N 3.04Å; V410-R412 PolarHBondContact O-N 2.92Å; V410-I413 PolarHBondContact O-N 2.66Å; V410-I413 VanDerWaalsContact O-N 3.12Å
411	S	88.5	Confident	74.1	Confident	87 Å²	87	60.4 Å²	60.4	61%	0.608	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-62.7	-7.9	176.8	55.9	0	0	0	0	114.7	P409	P409-S411 PolarHBondContact O-N 3.04Å; P409-S411 VanDerWaalsContact O-N 3.08Å
412	R	89.1	Confident	70.9	Confident	84 Å²	84	60.7 Å²	60.7	32%	0.317	41%	0.409	S	S	.	.	G	3₁₀ helix	trans	-107.9	-7.7	179.2	-53.6	-67	-73.5	-175.9	-2.7	113.5	Q174 G208 R209 I408 P409 V410	Q174-R412 HydrophobicContact CG-CG 3.83Å; G208-R412 PolarHBondContact O-NH2 2.77Å; R209-R412 WeakPolarHBondContact CD-O 3.47Å; I408-R412 HydrophobicContact CD1-CB 3.76Å; I408-R412 HydrophobicContact CD1-CG 4.46Å; I408-R412 HydrophobicContact CG1-CB 4.03Å; I408-R412 HydrophobicContact CG1-CG 4.42Å; P409-R412 WeakPolarHBondContact O-CB 3.17Å; P409-R412 PolarHBondContact O-N 2.96Å; V410-R412 PolarHBondContact O-N 2.92Å
413	I	82.9	Confident	67.7	Low	17 Å²	17	66.2 Å²	66.2	9%	0.087	44%	0.444	C	S	.	.			trans	-102.2	102.5	170.9	-63.4	-171.3	0	0	0	108.2	V265 F302 I408 V410	V265-I413 HydrophobicContact CB-CD1 3.8Å; V265-I413 HydrophobicContact CG1-CD1 3.68Å; V265-I413 HydrophobicContact CG2-CD1 4.18Å; F302-I413 HydrophobicContact CD1-CG2 4.36Å; F302-I413 HydrophobicContact CE1-CG2 3.54Å; F302-I413 HydrophobicContact CZ-CG2 4.05Å; I408-I413 HydrophobicContact CG2-CD1 3.56Å; I408-I413 HydrophobicContact CG2-CG1 3.76Å; V410-I413 PolarHBondContact O-N 2.66Å; V410-I413 VanDerWaalsContact O-N 3.12Å
414	S	61	Low	64.5	Low	106 Å²	106	75.1 Å²	75.1	74%	0.741	48%	0.483	S	S	*	.			trans	-66.9	133.2	165.5	-59	0	0	0	0	109.5	G416	S414-G416 PolarHBondContact O-N 2.56Å
415	A	44.6	Very low	61.4	Low	86 Å²	86	83.3 Å²	83.3	71%	0.711	52%	0.521	S	S	*	.	S	Bend	trans	-66.3	121.3	174.3	0	0	0	0	0	110.7	F302	F302-A415 HydrophobicContact CZ-CB 3.95Å
416	G	38.7	Very low	58.2	Low	67 Å²	67	93.1 Å²	93.1	69%	0.691	56%	0.564	S	S	*	*	S	Bend	trans	86.8	131.7	173.2	0	0	0	0	0	114.7	S414	S414-G416 PolarHBondContact O-N 2.56Å
417	G	37.9	Very low	55	Low	82 Å²	82	96.3 Å²	96.3	85%	0.845	60%	0.597	S	S	*	*	S	Bend	trans	-72	142.1	167.4	0	0	0	0	0	111.5
418	G	34.6	Very low	51.8	Low	77 Å²	77	99.9 Å²	99.9	79%	0.794	64%	0.635	S	S	*	*			trans	79.7	69.9	156.7	0	0	0	0	0	117.7
419	Q	29.2	Very low	49	Very low	181 Å²	181	108.6 Å²	108.6	85%	0.846	68%	0.681	S	S	*	*			trans	-156.8	129.5	130.2	-118.2	171.8	12	0	0	113.3	T421	Q419-T421 PolarHBondContact O-N 3.3Å
420	Q	43.8	Very low	46.1	Very low	196 Å²	196	111.2 Å²	111.2	92%	0.916	71%	0.709	S	S	*	*			trans	-63.7	117.6	160	-68.3	174.5	-14.6	0	0	108.6
421	T	32	Very low	43.6	Very low	124 Å²	124	117.8 Å²	117.8	76%	0.761	74%	0.743	S	S	*	*			trans	-134.6	126	154.4	47.2	0	0	0	0	109	Q419	Q419-T421 PolarHBondContact O-N 3.3Å
422	G	30.6	Very low	41.2	Very low	71 Å²	71	122 Å²	122	73%	0.732	78%	0.784	S	S	*	*			trans	-69.8	152.2	-177	0	0	0	0	0	112.1	K424	G422-K424 PolarHBondContact O-N 3.33Å
423	V	31.1	Very low	38.8	Very low	145 Å²	145	124 Å²	124	88%	0.879	81%	0.807	S	S	*	*			trans	-57.8	100.9	173.2	179	0	0	0	0	109.6	Q425	V423-Q425 PolarHBondContact O-N 3.47Å
424	K	32.3	Very low	36.5	Very low	189 Å²	189	129.6 Å²	129.6	82%	0.822	85%	0.845	S	S	*	*			trans	-79.2	97.2	161.8	-93.8	-171.2	174.3	-178.6	0	108.5	G422 F426	G422-K424 PolarHBondContact O-N 3.33Å; K424-F426 PolarHBondContact O-N 3.47Å; K424-F426 VanDerWaalsContact O-N 3.14Å
425	Q	33	Very low	35.2	Very low	182 Å²	182	130.9 Å²	130.9	85%	0.85	85%	0.851	S	S	*	*			trans	-58	108.4	169.9	-168.2	172.7	15.3	0	0	109.3	V423 G427	V423-Q425 PolarHBondContact O-N 3.47Å; Q425-G427 PolarHBondContact O-N 2.66Å
426	F	32	Very low	34.6	Very low	205 Å²	205	133.5 Å²	133.5	90%	0.899	86%	0.859	S	S	*	*	P	Polyproline II helix	trans	-75.3	116.8	170	-95.7	-90.8	0	0	0	108.8	K424	K424-F426 PolarHBondContact O-N 3.47Å; K424-F426 VanDerWaalsContact O-N 3.14Å
427	G	31.5	Very low	34.3	Very low	68 Å²	68	137.7 Å²	137.7	70%	0.701	87%	0.87	S	S	*	*	P	Polyproline II helix	trans	-68.5	152.7	178	0	0	0	0	0	112.2	Q425	Q425-G427 PolarHBondContact O-N 2.66Å
428	G	31.5	Very low	34.1	Very low	80 Å²	80	141.4 Å²	141.4	83%	0.825	87%	0.871	S	S	*	*	P	Polyproline II helix	trans	-66.4	148	176.7	0	0	0	0	0	112.6	G430	G428-G430 PolarHBondContact O-N 3.15Å
429	L	36.7	Very low	34.1	Very low	185 Å²	185	146 Å²	146	97%	0.969	88%	0.877	S	S	*	*	P	Polyproline II helix	trans	-75.2	116.2	163.6	-80.1	144.7	0	0	0	108.2
430	G	35.7	Very low	34.4	Very low	66 Å²	66	143.3 Å²	143.3	68%	0.68	88%	0.879	S	S	*	*	P	Polyproline II helix	trans	-89.6	162	166.5	0	0	0	0	0	111.4	G428	G428-G430 PolarHBondContact O-N 3.15Å
431	D	39.5	Very low	33.7	Very low	175 Å²	175	138.9 Å²	138.9	94%	0.936	88%	0.876	S	S	*	*	P	Polyproline II helix	trans	-65.7	143.5	-173.8	-49.8	-81.1	0	0	0	114.5
432	A	38.4	Very low	33.8	Very low	177 Å²	177	140.3 Å²	140.3	100%	1.463	89%	0.887	S	S	*	*			trans	-157.2	0	155.3	0	0	0	0	0	109.9

Retrieved 432 of 432 residues in 382.3 ms (Link to these results)

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