A0A3Q0KSK7_SCHMA Loading...

Putative mitochondrial translational initiation factor

AlphaFold DB , UniProt , Accession A0A3Q0KSK7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 769 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.8	Very low	38.5	Very low	218 Å²	218	160.9 Å²	160.9	100%	1.074	76%	0.757	S	S	*	*				0	-25.6	0	-85.8	178.6	177.5	0	0	113.9	F3 K4	M1-F3 PolarHBondContact O-N 3.11Å; M1-K4 PolarHBondContact O-N 3.08Å
2	I	43.6	Very low	38.4	Very low	149 Å²	149	156.7 Å²	156.7	76%	0.764	75%	0.749	S	S	*	*	H	α-helix	trans	-66.2	-28.9	-177.6	-69	154.9	0	0	0	114.3	K4	I2-K4 PolarHBondContact O-N 3.33Å
3	F	39.1	Very low	38	Very low	188 Å²	188	152.2 Å²	152.2	83%	0.825	74%	0.743	S	S	*	*	H	α-helix	trans	-75.5	-18	179.6	-100.3	-88.3	0	0	0	115.8	M1	M1-F3 PolarHBondContact O-N 3.11Å
4	K	39.7	Very low	37.6	Very low	179 Å²	179	153.9 Å²	153.9	78%	0.778	74%	0.739	S	S	*	*	H	α-helix	trans	-85.2	-23.5	177.8	-94	-177.1	176	179.2	0	113	M1 I2	M1-K4 PolarHBondContact O-N 3.08Å; I2-K4 PolarHBondContact O-N 3.33Å
5	L	39.3	Very low	37	Very low	126 Å²	126	150.1 Å²	150.1	66%	0.66	74%	0.735	S	S	*	*	H	α-helix	trans	-74.4	-30.9	176.4	-90.7	139.7	0	0	0	112.5	K7 V8 H9	L5-K7 PolarHBondContact O-N 3.19Å; L5-V8 PolarHBondContact O-N 3.18Å; L5-H9 PolarHBondContact O-N 3.36Å
6	W	40.1	Very low	36.6	Very low	200 Å²	200	147.6 Å²	147.6	76%	0.758	73%	0.734	S	S	*	*	H	α-helix	trans	-66.6	-33.5	-179.3	-131.1	53.4	0	0	0	113.6
7	K	39.2	Very low	36.2	Very low	181 Å²	181	145.7 Å²	145.7	79%	0.787	74%	0.738	S	S	*	*	H	α-helix	trans	-74.7	-23	175.1	-99.6	-175.8	175.8	-179	0	114.1	L5	L5-K7 PolarHBondContact O-N 3.19Å
8	V	40.4	Very low	35.7	Very low	92 Å²	92	148.3 Å²	148.3	56%	0.558	74%	0.744	S	S	*	*	H	α-helix	trans	-86.3	-32.8	-179.4	-179.8	0	0	0	0	110.6	L5 A11 V12	L5-V8 PolarHBondContact O-N 3.18Å; V8-A11 PolarHBondContact O-N 3.1Å; V8-V12 VanDerWaalsContact O-CG2 3.3Å; V8-V12 WeakPolarHBondContact O-CG2 3.29Å
9	H	35	Very low	35.5	Very low	144 Å²	144	152.5 Å²	152.5	67%	0.667	75%	0.752	S	S	*	*	H	α-helix	trans	-70.4	-31.4	178	-134.2	66.8	0	0	0	113.1	L5 A11	L5-H9 PolarHBondContact O-N 3.36Å; H9-A11 VanDerWaalsContact C-N 3.34Å; H9-A11 PolarHBondContact O-N 2.95Å
10	W	33.2	Very low	35	Very low	216 Å²	216	154.9 Å²	154.9	82%	0.818	76%	0.758	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	-21.7	176.2	-113.6	51.8	0	0	0	114.3
11	A	34.6	Very low	34.7	Very low	77 Å²	77	153.3 Å²	153.3	64%	0.636	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	-8.3	-179.5	0	0	0	0	0	113.9	V8 H9	V8-A11 PolarHBondContact O-N 3.1Å; H9-A11 VanDerWaalsContact C-N 3.34Å; H9-A11 PolarHBondContact O-N 2.95Å
12	V	37	Very low	34.1	Very low	110 Å²	110	154 Å²	154	67%	0.667	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.3	-16.1	-171.4	174.1	0	0	0	0	113.1	V8	V8-V12 VanDerWaalsContact O-CG2 3.3Å; V8-V12 WeakPolarHBondContact O-CG2 3.29Å
13	C	33.7	Very low	33.4	Very low	99 Å²	99	157.9 Å²	157.9	67%	0.669	75%	0.754	S	S	*	*	S	Bend	trans	-97.9	4.6	-177.9	-64.8	0	0	0	0	115.1
14	Y	31.8	Very low	33.1	Very low	176 Å²	176	154.1 Å²	154.1	69%	0.69	75%	0.751	S	S	*	*			trans	-126.9	91.3	175.7	-85.7	-87.3	0	0	0	110.8
15	S	29.3	Very low	32.5	Very low	96 Å²	96	151.1 Å²	151.1	67%	0.671	75%	0.753	S	S	*	*			trans	-148.4	105.8	157.1	-175	0	0	0	0	109.4	S17	S15-S17 PolarHBondContact O-N 2.84Å
16	P	30.4	Very low	32.2	Very low	111 Å²	111	156.5 Å²	156.5	72%	0.721	76%	0.764	S	S	*	*			trans	-75.1	118.7	164.3	30.5	-25.7	0	0	0	107.6
17	S	29.3	Very low	31.6	Very low	115 Å²	115	152.3 Å²	152.3	80%	0.804	77%	0.765	S	S	*	*			trans	42.8	84.6	150.7	-54.5	0	0	0	0	117.2	S15	S15-S17 PolarHBondContact O-N 2.84Å
18	F	27.5	Very low	31.4	Very low	193 Å²	193	152.6 Å²	152.6	85%	0.846	77%	0.769	S	S	*	*			trans	-125.3	114.5	154.3	-100.7	-86.9	0	0	0	110.9	K20	F18-K20 PolarHBondContact O-N 3.42Å
19	Y	31.3	Very low	30.9	Very low	227 Å²	227	153.3 Å²	153.3	89%	0.89	78%	0.778	S	S	*	*			trans	-54.9	132.3	172.6	-95.5	-99.8	0	0	0	111.2	V21	Y19-V21 PolarHBondContact O-N 3.16Å
20	K	25.9	Very low	30.9	Very low	200 Å²	200	152.4 Å²	152.4	87%	0.87	79%	0.785	S	S	*	*			trans	-76.1	102.3	179.6	-161.8	175.5	-169.3	172.7	0	109.6	F18	F18-K20 PolarHBondContact O-N 3.42Å
21	V	29.5	Very low	30.8	Very low	122 Å²	122	146.3 Å²	146.3	74%	0.739	78%	0.781	S	S	*	*			trans	-96	113.4	165	-179.4	0	0	0	0	108.5	Y19 Y23	Y19-V21 PolarHBondContact O-N 3.16Å; V21-Y23 PolarHBondContact O-N 3.42Å
22	R	26.8	Very low	30.5	Very low	234 Å²	234	153 Å²	153	88%	0.883	80%	0.796	S	S	*	*			trans	-60.2	122.1	173.3	-79	175.4	167.6	161.1	-4.1	109.9
23	Y	29.6	Very low	30.5	Very low	229 Å²	229	153.4 Å²	153.4	90%	0.898	80%	0.799	S	S	*	*			trans	-91	108.3	158.7	-98.4	-88.5	0	0	0	109	V21	V21-Y23 PolarHBondContact O-N 3.42Å
24	S	31.4	Very low	30.7	Very low	110 Å²	110	154.4 Å²	154.4	77%	0.769	81%	0.807	S	S	*	*			trans	-78.5	118	161	58.6	0	0	0	0	108.8	R26	S24-R26 PolarHBondContact O-N 2.95Å
25	S	28	Very low	31.4	Very low	116 Å²	116	155.5 Å²	155.5	81%	0.811	82%	0.815	S	S	*	*			trans	-66.1	112.1	170.1	50.6	0	0	0	0	110.9
26	R	32.7	Very low	32.6	Very low	239 Å²	239	158.1 Å²	158.1	90%	0.902	82%	0.815	S	S	*	*			trans	-137.8	114.9	152.4	-87.3	-171.4	175.4	173.2	-2.2	109.5	S24	S24-R26 PolarHBondContact O-N 2.95Å
27	S	28.1	Very low	34.4	Very low	111 Å²	111	156 Å²	156	78%	0.776	80%	0.802	S	S	*	*			trans	-59.8	119.5	169.7	47.7	0	0	0	0	111.2
28	H	33	Very low	36.7	Very low	187 Å²	187	158.6 Å²	158.6	87%	0.866	80%	0.799	S	S	*	*			trans	-148.8	135.5	147.9	-90.4	-42.5	0	0	0	109.7
29	S	30.7	Very low	39.1	Very low	107 Å²	107	149.9 Å²	149.9	75%	0.748	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-48.9	140	-172.6	42.4	0	0	0	0	115.1	A31	S29-A31 PolarHBondContact O-N 2.78Å
30	P	34.2	Very low	41.2	Very low	125 Å²	125	143.9 Å²	143.9	81%	0.812	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-83.5	117.5	178.3	32.8	-28.6	0	0	0	110.5
31	A	31.3	Very low	43.5	Very low	88 Å²	88	134.4 Å²	134.4	73%	0.727	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-67.8	129.3	157.6	0	0	0	0	0	108.9	S29 T33	S29-A31 PolarHBondContact O-N 2.78Å; A31-T33 PolarHBondContact O-N 2.75Å; A31-T33 VanDerWaalsContact O-N 3.1Å
32	F	30	Very low	45.7	Very low	218 Å²	218	132.1 Å²	132.1	96%	0.956	68%	0.678	S	S	*	*			trans	-60.9	106.2	-178.6	-123.9	-99	0	0	0	110.8
33	T	35.3	Very low	47.8	Very low	118 Å²	118	126.9 Å²	126.9	72%	0.724	66%	0.664	S	S	*	*			trans	-136.7	123.3	162.6	53.7	0	0	0	0	108.1	A31 K35	A31-T33 PolarHBondContact O-N 2.75Å; A31-T33 VanDerWaalsContact O-N 3.1Å; T33-K35 PolarHBondContact O-N 2.82Å
34	S	39.2	Very low	49.9	Very low	120 Å²	120	116.9 Å²	116.9	84%	0.839	63%	0.63	S	S	*	*			trans	-68.2	97.6	-174.1	46.7	0	0	0	0	111.4	K36	S34-K36 PolarHBondContact O-N 2.93Å
35	K	46.8	Very low	52.1	Low	199 Å²	199	111.7 Å²	111.7	87%	0.865	59%	0.594	S	S	*	*			trans	-70.6	113.3	172.6	-82.5	179.2	177.1	173.3	0	110	T33 S37	T33-K35 PolarHBondContact O-N 2.82Å; K35-S37 PolarHBondContact O-N 2.82Å
36	K	54	Low	54.6	Low	152 Å²	152	107.4 Å²	107.4	66%	0.661	56%	0.563	S	S	*	*	P	Polyproline II helix	trans	-57.4	132.1	165.6	-65.2	-176.6	180	-178.2	0	109.3	S34 T97	S34-K36 PolarHBondContact O-N 2.93Å; K36-T97 HydrophobicContact CB-CG2 4.27Å
37	S	67.1	Low	56.7	Low	65 Å²	65	96 Å²	96	46%	0.455	52%	0.52	S	S	.	.	P	Polyproline II helix	trans	-63.7	138.6	177.7	30.1	0	0	0	0	111.3	K35 F96 T97	K35-S37 PolarHBondContact O-N 2.82Å; S37-F96 VanDerWaalsContact O-CA 3.31Å; S37-F96 WeakPolarHBondContact O-CA 3.07Å; S37-F96 WeakPolarHBondContact OG-CD1 3.26Å; S37-F96 WeakPolarHBondContact OG-CE1 3.11Å; S37-T97 PolarHBondContact O-N 3.21Å; S37-T97 PolarHBondContact O-OG1 3.14Å
38	K	78.1	Confident	59	Low	170 Å²	170	97.3 Å²	97.3	74%	0.739	51%	0.512	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.9	139.1	175.5	-66	-180	177.7	-173.1	0	109.6	T97 V99	K38-T97 WeakPolarHBondContact CA-O 3.23Å; K38-T97 WeakPolarHBondContact CA-OG1 3.36Å; K38-T97 WeakPolarHBondContact CG-OG1 3.14Å; K38-V99 HydrophobicContact CB-CG2 4.13Å; K38-V99 HydrophobicContact CD-CG2 4.27Å; K38-V99 HydrophobicContact CG-CG2 4.39Å
39	L	77.5	Confident	61.2	Low	11 Å²	11	92.2 Å²	92.2	6%	0.058	49%	0.488	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	124.8	177.5	-172.6	77.2	0	0	0	109	V41 L50 A53 A54 V91 F96 T97 P98 V99	L39-V41 HydrophobicContact CD2-CG2 4.06Å; L39-V41 HydrophobicContact CG-CG2 4.2Å; L39-L50 HydrophobicContact CD2-CD2 4.34Å; L39-A53 HydrophobicContact CD1-CB 3.81Å; L39-A53 WeakPolarHBondContact CD1-O 3.32Å; L39-A54 HydrophobicContact CD1-CB 4.27Å; L39-A54 HydrophobicContact CD2-CB 4.46Å; L39-V91 HydrophobicContact CB-CG1 4.19Å; L39-V91 HydrophobicContact CD2-CG1 3.96Å; L39-V91 HydrophobicContact CD2-CG2 3.99Å; L39-F96 HydrophobicContact CB-CB 3.84Å; L39-F96 HydrophobicContact CB-CD1 4.27Å; L39-F96 HydrophobicContact CB-CG 4.18Å; L39-T97 PolarHBondContact N-O 2.91Å; L39-P98 CarbonylContact O-C 3.6Å; L39-P98 WeakPolarHBondContact O-CA 3.42Å; L39-V99 PolarHBondContact O-N 2.91Å
40	E	75.5	Confident	63.5	Low	101 Å²	101	87.3 Å²	87.3	47%	0.472	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	128.6	176.1	-65.8	-174.9	-167.3	0	0	110.2	V99 R101	E40-V99 WeakPolarHBondContact CA-O 3.49Å; E40-R101 IonicContact OE1-NH1 2.69Å; E40-R101 WeakPolarHBondContact OE2-CD 3.41Å; E40-R101 IonicContact OE2-CZ 2.78Å; E40-R101 IonicContact OE2-NH1 2.76Å; E40-R101 PolarHBondContact OE2-NH1 2.84Å
41	V	74.8	Confident	65.8	Low	0 Å²	0	82.3 Å²	82.3	0%	0	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	153.9	-178.7	-167.4	0	0	0	0	110.4	L39 I45 L50 I87 V91 V99 F100 R101	L39-V41 HydrophobicContact CD2-CG2 4.06Å; L39-V41 HydrophobicContact CG-CG2 4.2Å; V41-I45 HydrophobicContact CG1-CB 4.24Å; V41-I45 HydrophobicContact CG1-CD1 3.92Å; V41-I45 HydrophobicContact CG1-CG2 3.74Å; V41-L50 HydrophobicContact CG1-CD2 4.19Å; V41-L50 HydrophobicContact CG2-CD2 4.21Å; V41-I87 HydrophobicContact CB-CG2 4.14Å; V41-I87 HydrophobicContact CG1-CD1 4.46Å; V41-I87 HydrophobicContact CG1-CG2 3.39Å; V41-I87 HydrophobicContact CG2-CG2 4.43Å; V41-V91 HydrophobicContact CG2-CG2 4.05Å; V41-V99 PolarHBondContact N-O 2.83Å; V41-F100 CarbonylContact O-C 3.46Å; V41-F100 VanDerWaalsContact O-CA 3.25Å; V41-F100 WeakPolarHBondContact O-CA 3.32Å; V41-R101 PolarHBondContact O-N 2.83Å
42	W	76.6	Confident	68.2	Low	75 Å²	75	82.3 Å²	82.3	28%	0.284	42%	0.416	S	S	.	.			trans	-131.7	164.3	173.7	56.6	91.9	0	0	0	110.5	I45 E49	W42-I45 HydrophobicContact CD2-CB 4.41Å; W42-I45 HydrophobicContact CD2-CD1 4.1Å; W42-I45 HydrophobicContact CD2-CG1 4.28Å; W42-I45 HydrophobicContact CE3-CD1 4.04Å; W42-I45 HydrophobicContact CH2-CD1 3.83Å; W42-I45 HydrophobicContact CH2-CG1 4.23Å; W42-I45 HydrophobicContact CZ2-CD1 3.89Å; W42-I45 HydrophobicContact CZ2-CG1 3.77Å; W42-I45 HydrophobicContact CZ3-CD1 3.9Å; W42-I45 PolarHBondContact O-N 2.88Å; W42-E49 HydrophobicContact CH2-CB 4.25Å; W42-E49 HydrophobicContact CZ2-CB 4.03Å; W42-E49 HydrophobicContact CZ2-CG 4.12Å
43	E	69.7	Low	70.5	Confident	124 Å²	124	74.2 Å²	74.2	58%	0.579	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	131.5	177	-64.9	178.8	175.6	0	0	109.7
44	G	73.2	Confident	72.3	Confident	19 Å²	19	69.1 Å²	69.1	20%	0.196	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.9	16.2	-176.1	0	0	0	0	0	115.1	T46 L81	G44-T46 PolarHBondContact O-N 3.31Å; G44-L81 VanDerWaalsContact CA-O 3.24Å; G44-L81 WeakPolarHBondContact CA-O 3.29Å; G44-L81 PolarHBondContact N-O 3.19Å
45	I	78.4	Confident	74.2	Confident	0 Å²	0	72.8 Å²	72.8	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.3	136.3	176	-163.8	163.5	0	0	0	111.1	V41 W42 E49 L50 L81 I87	V41-I45 HydrophobicContact CG1-CB 4.24Å; V41-I45 HydrophobicContact CG1-CD1 3.92Å; V41-I45 HydrophobicContact CG1-CG2 3.74Å; W42-I45 HydrophobicContact CD2-CB 4.41Å; W42-I45 HydrophobicContact CD2-CD1 4.1Å; W42-I45 HydrophobicContact CD2-CG1 4.28Å; W42-I45 HydrophobicContact CE3-CD1 4.04Å; W42-I45 HydrophobicContact CH2-CD1 3.83Å; W42-I45 HydrophobicContact CH2-CG1 4.23Å; W42-I45 HydrophobicContact CZ2-CD1 3.89Å; W42-I45 HydrophobicContact CZ2-CG1 3.77Å; W42-I45 HydrophobicContact CZ3-CD1 3.9Å; W42-I45 PolarHBondContact O-N 2.88Å; I45-E49 HydrophobicContact CD1-CB 4.17Å; I45-E49 HydrophobicContact CG1-CB 3.67Å; I45-L50 HydrophobicContact CB-CG 4.39Å; I45-L50 HydrophobicContact CD1-CD2 3.76Å; I45-L50 HydrophobicContact CD1-CG 3.72Å; I45-L50 HydrophobicContact CG1-CD2 4.44Å; I45-L50 HydrophobicContact CG1-CG 3.89Å; I45-L50 HydrophobicContact CG2-CD1 3.61Å; I45-L50 HydrophobicContact CG2-CD2 4.1Å; I45-L50 HydrophobicContact CG2-CG 3.63Å; I45-L81 PolarHBondContact O-N 3.48Å; I45-I87 HydrophobicContact CG2-CD1 4.14Å; I45-I87 HydrophobicContact CG2-CG1 4.45Å
46	T	79.9	Confident	75.7	Confident	27 Å²	27	65.4 Å²	65.4	17%	0.166	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	152.1	174.8	61.1	0	0	0	0	111.1	G44 K48 E49 L50 K80	G44-T46 PolarHBondContact O-N 3.31Å; T46-K48 PolarHBondContact O-N 2.99Å; T46-E49 PolarHBondContact N-OE2 2.76Å; T46-E49 PolarHBondContact O-N 3.44Å; T46-E49 WeakPolarHBondContact OG1-CB 3.42Å; T46-E49 WeakPolarHBondContact OG1-CG 3.49Å; T46-E49 PolarHBondContact OG1-N 3.24Å; T46-E49 PolarHBondContact OG1-OE2 2.8Å; T46-L50 PolarHBondContact O-N 2.93Å; T46-K80 HydrophobicContact CG2-CG 4.33Å
47	V	76.5	Confident	76.9	Confident	0 Å²	0	61 Å²	61	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-57.7	-32.1	176.2	-179.8	0	0	0	0	111.4	S51 I61 L62 L65	V47-S51 VanDerWaalsContact O-CB 3.31Å; V47-S51 WeakPolarHBondContact O-CB 3.37Å; V47-S51 PolarHBondContact O-N 2.71Å; V47-I61 HydrophobicContact CG1-CB 4.3Å; V47-I61 HydrophobicContact CG1-CG2 3.87Å; V47-L62 HydrophobicContact CG1-CD2 4.37Å; V47-L62 HydrophobicContact CG1-CG 4.44Å; V47-L65 HydrophobicContact CG2-CD1 4.19Å
48	K	78.4	Confident	77.4	Confident	138 Å²	138	59.9 Å²	59.9	60%	0.6	31%	0.309	S	S	*	.	H	α-helix	trans	-68.3	-41	174.6	-168.9	179.1	-180	-176.6	0	113.2	T46 S51 S52 N77	T46-K48 PolarHBondContact O-N 2.99Å; K48-S51 PolarHBondContact O-N 3.07Å; K48-S52 WeakPolarHBondContact O-CB 3.23Å; K48-S52 PolarHBondContact O-N 2.94Å; K48-S52 PolarHBondContact O-OG 2.88Å; K48-N77 PolarHBondContact N-O 2.95Å
49	E	79	Confident	77.2	Confident	79 Å²	79	59 Å²	59	37%	0.369	31%	0.307	S	S	.	.	H	α-helix	trans	-68	-41.2	174.8	-74.1	161.1	162.2	0	0	111.2	W42 I45 T46 S51 S52 A53	W42-E49 HydrophobicContact CH2-CB 4.25Å; W42-E49 HydrophobicContact CZ2-CB 4.03Å; W42-E49 HydrophobicContact CZ2-CG 4.12Å; I45-E49 HydrophobicContact CD1-CB 4.17Å; I45-E49 HydrophobicContact CG1-CB 3.67Å; T46-E49 PolarHBondContact N-OE2 2.76Å; T46-E49 PolarHBondContact O-N 3.44Å; T46-E49 WeakPolarHBondContact OG1-CB 3.42Å; T46-E49 WeakPolarHBondContact OG1-CG 3.49Å; T46-E49 PolarHBondContact OG1-N 3.24Å; T46-E49 PolarHBondContact OG1-OE2 2.8Å; E49-S51 PolarHBondContact O-N 2.77Å; E49-S52 PolarHBondContact O-N 3.4Å; E49-A53 WeakPolarHBondContact O-CB 3.41Å; E49-A53 PolarHBondContact O-N 2.76Å
50	L	78.9	Confident	77.1	Confident	5 Å²	5	61.4 Å²	61.4	3%	0.026	32%	0.323	C	S	.	.	H	α-helix	trans	-61.3	-41.9	171.7	-83.9	171.3	0	0	0	112.4	L39 V41 I45 T46 S52 A53 A54 L81 L90	L39-L50 HydrophobicContact CD2-CD2 4.34Å; V41-L50 HydrophobicContact CG1-CD2 4.19Å; V41-L50 HydrophobicContact CG2-CD2 4.21Å; I45-L50 HydrophobicContact CB-CG 4.39Å; I45-L50 HydrophobicContact CD1-CD2 3.76Å; I45-L50 HydrophobicContact CD1-CG 3.72Å; I45-L50 HydrophobicContact CG1-CD2 4.44Å; I45-L50 HydrophobicContact CG1-CG 3.89Å; I45-L50 HydrophobicContact CG2-CD1 3.61Å; I45-L50 HydrophobicContact CG2-CD2 4.1Å; I45-L50 HydrophobicContact CG2-CG 3.63Å; T46-L50 PolarHBondContact O-N 2.93Å; L50-S52 VanDerWaalsContact C-N 3.3Å; L50-S52 PolarHBondContact O-N 2.91Å; L50-A53 PolarHBondContact O-N 2.89Å; L50-A54 VanDerWaalsContact O-CB 3.23Å; L50-A54 WeakPolarHBondContact O-CB 3.45Å; L50-A54 PolarHBondContact O-N 3.4Å; L50-L81 HydrophobicContact CD1-CD1 3.72Å; L50-L90 HydrophobicContact CD1-CD2 3.84Å
51	S	82	Confident	77	Confident	19 Å²	19	56.8 Å²	56.8	13%	0.133	30%	0.301	C	S	.	.	H	α-helix	trans	-60.2	-42.1	175.3	177.8	0	0	0	0	111.7	V47 K48 E49 K55 I56 P58 I61	V47-S51 VanDerWaalsContact O-CB 3.31Å; V47-S51 WeakPolarHBondContact O-CB 3.37Å; V47-S51 PolarHBondContact O-N 2.71Å; K48-S51 PolarHBondContact O-N 3.07Å; E49-S51 PolarHBondContact O-N 2.77Å; S51-K55 PolarHBondContact O-N 2.7Å; S51-I56 WeakPolarHBondContact CB-O 3.44Å; S51-I56 PolarHBondContact O-N 3.34Å; S51-I56 PolarHBondContact OG-O 3.35Å; S51-P58 WeakPolarHBondContact OG-CD 3.31Å; S51-I61 VanDerWaalsContact CA-CD1 3.46Å
52	S	80.9	Confident	77	Confident	89 Å²	89	58.1 Å²	58.1	62%	0.622	31%	0.308	S	S	*	.	H	α-helix	trans	-68.2	-40.9	178.5	-55.6	0	0	0	0	111.7	K48 E49 L50	K48-S52 WeakPolarHBondContact O-CB 3.23Å; K48-S52 PolarHBondContact O-N 2.94Å; K48-S52 PolarHBondContact O-OG 2.88Å; E49-S52 PolarHBondContact O-N 3.4Å; L50-S52 VanDerWaalsContact C-N 3.3Å; L50-S52 PolarHBondContact O-N 2.91Å
53	A	78.4	Confident	76.8	Confident	47 Å²	47	64.1 Å²	64.1	39%	0.388	33%	0.33	S	S	.	.	H	α-helix	trans	-69.9	-39.2	177.8	0	0	0	0	0	112.4	L39 E49 L50	L39-A53 HydrophobicContact CD1-CB 3.81Å; L39-A53 WeakPolarHBondContact CD1-O 3.32Å; E49-A53 WeakPolarHBondContact O-CB 3.41Å; E49-A53 PolarHBondContact O-N 2.76Å; L50-A53 PolarHBondContact O-N 2.89Å
54	A	72.7	Confident	76.8	Confident	11 Å²	11	59.6 Å²	59.6	9%	0.091	31%	0.312	C	S	.	.	H	α-helix	trans	-88.1	-10.7	-175	0	0	0	0	0	114.4	L39 L50 I56 F96	L39-A54 HydrophobicContact CD1-CB 4.27Å; L39-A54 HydrophobicContact CD2-CB 4.46Å; L50-A54 VanDerWaalsContact O-CB 3.23Å; L50-A54 WeakPolarHBondContact O-CB 3.45Å; L50-A54 PolarHBondContact O-N 3.4Å; A54-I56 HydrophobicContact CB-CB 4.43Å; A54-I56 HydrophobicContact CB-CD1 4.27Å; A54-I56 HydrophobicContact CB-CG1 4.45Å; A54-I56 WeakPolarHBondContact O-CG1 3.39Å; A54-I56 PolarHBondContact O-N 3.16Å; A54-F96 HydrophobicContact CB-CE2 4.36Å
55	K	79.4	Confident	76.8	Confident	198 Å²	198	59 Å²	59	86%	0.861	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.1	31.4	-171.7	-58.5	-179.4	179.3	178.3	0	113.4	S51	S51-K55 PolarHBondContact O-N 2.7Å
56	I	79.3	Confident	76.3	Confident	44 Å²	44	64 Å²	64	23%	0.226	33%	0.33	C	S	.	.			trans	-118.1	140.8	-179.1	-66.2	165.6	0	0	0	108.3	S51 A54 V60 I61 M94 F96	S51-I56 WeakPolarHBondContact CB-O 3.44Å; S51-I56 PolarHBondContact O-N 3.34Å; S51-I56 PolarHBondContact OG-O 3.35Å; A54-I56 HydrophobicContact CB-CB 4.43Å; A54-I56 HydrophobicContact CB-CD1 4.27Å; A54-I56 HydrophobicContact CB-CG1 4.45Å; A54-I56 WeakPolarHBondContact O-CG1 3.39Å; A54-I56 PolarHBondContact O-N 3.16Å; I56-V60 HydrophobicContact CG2-CB 3.64Å; I56-V60 HydrophobicContact CG2-CG1 3.63Å; I56-V60 HydrophobicContact CG2-CG2 4.38Å; I56-I61 HydrophobicContact CG2-CG1 4.36Å; I56-M94 HydrophobicContact CB-CE 3.98Å; I56-M94 HydrophobicContact CD1-CE 3.32Å; I56-M94 HydrophobicContact CG1-CE 4.19Å; I56-M94 HydrophobicContact CG2-CE 3.55Å; I56-F96 HydrophobicContact CD1-CE2 3.9Å
57	S	79.1	Confident	75.7	Confident	60 Å²	60	67.2 Å²	67.2	42%	0.42	35%	0.354	S	S	.	.			trans	-59.8	142	-177.3	63	0	0	0	0	111.1	H59 V60 I61	S57-H59 PolarHBondContact O-N 3.41Å; S57-H59 VanDerWaalsContact O-N 3.16Å; S57-V60 PolarHBondContact O-N 2.97Å; S57-V60 VanDerWaalsContact OG-CG2 3.26Å; S57-V60 WeakPolarHBondContact OG-CG2 3.11Å; S57-I61 PolarHBondContact O-N 2.93Å
58	P	76.5	Confident	75.1	Confident	41 Å²	41	69.6 Å²	69.6	27%	0.266	37%	0.374	S	S	.	.	H	α-helix	trans	-60	-30.3	-178.2	23.9	-33.2	0	0	0	111.4	S51 V60 I61 L62	S51-P58 WeakPolarHBondContact OG-CD 3.31Å; P58-V60 VanDerWaalsContact C-N 3.33Å; P58-V60 PolarHBondContact O-N 3.4Å; P58-I61 PolarHBondContact O-N 3.49Å; P58-L62 WeakPolarHBondContact O-CB 3.47Å; P58-L62 WeakPolarHBondContact O-CG 3.39Å; P58-L62 PolarHBondContact O-N 3.02Å
59	H	74.8	Confident	74.1	Confident	150 Å²	150	65.6 Å²	65.6	69%	0.694	36%	0.359	S	S	*	.	H	α-helix	trans	-60	-37.3	173.4	-78.7	-66.4	0	0	0	114	S57 R63	S57-H59 PolarHBondContact O-N 3.41Å; S57-H59 VanDerWaalsContact O-N 3.16Å; H59-R63 VanDerWaalsContact O-CB 3.3Å; H59-R63 WeakPolarHBondContact O-CB 3.4Å; H59-R63 PolarHBondContact O-N 3.27Å
60	V	74.7	Confident	72.8	Confident	63 Å²	63	69 Å²	69	38%	0.382	39%	0.385	S	S	.	.	H	α-helix	trans	-72	-38.5	178.3	170.7	0	0	0	0	110.2	I56 S57 P58 R63 T64 M94	I56-V60 HydrophobicContact CG2-CB 3.64Å; I56-V60 HydrophobicContact CG2-CG1 3.63Å; I56-V60 HydrophobicContact CG2-CG2 4.38Å; S57-V60 PolarHBondContact O-N 2.97Å; S57-V60 VanDerWaalsContact OG-CG2 3.26Å; S57-V60 WeakPolarHBondContact OG-CG2 3.11Å; P58-V60 VanDerWaalsContact C-N 3.33Å; P58-V60 PolarHBondContact O-N 3.4Å; V60-R63 PolarHBondContact O-N 2.8Å; V60-T64 WeakPolarHBondContact O-CG2 3.44Å; V60-T64 PolarHBondContact O-N 3.34Å; V60-T64 PolarHBondContact O-OG1 2.81Å; V60-T64 VanDerWaalsContact O-OG1 3.11Å; V60-M94 HydrophobicContact CG1-CE 4.15Å
61	I	74.6	Confident	71.5	Confident	4 Å²	4	73.3 Å²	73.3	2%	0.021	41%	0.411	C	S	.	.	H	α-helix	trans	-67.6	-40.8	177.3	-61.1	169.6	0	0	0	111.1	V47 S51 I56 S57 P58 R63 T64 L65 L90 M94	V47-I61 HydrophobicContact CG1-CB 4.3Å; V47-I61 HydrophobicContact CG1-CG2 3.87Å; S51-I61 VanDerWaalsContact CA-CD1 3.46Å; I56-I61 HydrophobicContact CG2-CG1 4.36Å; S57-I61 PolarHBondContact O-N 2.93Å; P58-I61 PolarHBondContact O-N 3.49Å; I61-R63 VanDerWaalsContact C-N 3.34Å; I61-T64 WeakPolarHBondContact CA-OG1 3.37Å; I61-T64 PolarHBondContact O-N 3.17Å; I61-T64 PolarHBondContact O-OG1 3.39Å; I61-L65 HydrophobicContact CG2-CD1 4.14Å; I61-L65 WeakPolarHBondContact O-CB 3.23Å; I61-L65 VanDerWaalsContact O-CG 3.25Å; I61-L65 WeakPolarHBondContact O-CG 3.25Å; I61-L65 PolarHBondContact O-N 2.83Å; I61-L90 HydrophobicContact CG2-CD2 4.13Å; I61-M94 HydrophobicContact CG1-CE 3.94Å
62	L	74.6	Confident	70.1	Confident	27 Å²	27	82.4 Å²	82.4	14%	0.141	45%	0.448	C	S	.	.	H	α-helix	trans	-65	-38.3	173.3	-72.8	173.1	0	0	0	112.1	V47 P58 L65 N66 A75 N77	V47-L62 HydrophobicContact CG1-CD2 4.37Å; V47-L62 HydrophobicContact CG1-CG 4.44Å; P58-L62 WeakPolarHBondContact O-CB 3.47Å; P58-L62 WeakPolarHBondContact O-CG 3.39Å; P58-L62 PolarHBondContact O-N 3.02Å; L62-L65 HydrophobicContact CD2-CD1 4.48Å; L62-L65 PolarHBondContact O-N 3.47Å; L62-N66 WeakPolarHBondContact O-CB 3.32Å; L62-N66 PolarHBondContact O-N 3.24Å; L62-N66 PolarHBondContact O-ND2 2.75Å; L62-A75 HydrophobicContact CD2-CB 4.02Å; L62-A75 WeakPolarHBondContact CD2-O 3.47Å; L62-N77 WeakPolarHBondContact CD1-OD1 3.47Å
63	R	72.2	Confident	68.8	Low	201 Å²	201	85.7 Å²	85.7	76%	0.758	45%	0.454	S	S	*	.	H	α-helix	trans	-66.5	-40.8	176.5	-170.1	176.4	-174.7	166.7	1.9	111.7	H59 V60 I61 N66 S67	H59-R63 VanDerWaalsContact O-CB 3.3Å; H59-R63 WeakPolarHBondContact O-CB 3.4Å; H59-R63 PolarHBondContact O-N 3.27Å; V60-R63 PolarHBondContact O-N 2.8Å; I61-R63 VanDerWaalsContact C-N 3.34Å; R63-N66 PolarHBondContact O-N 2.84Å; R63-S67 WeakPolarHBondContact O-CB 3.32Å; R63-S67 PolarHBondContact O-N 3.23Å; R63-S67 PolarHBondContact O-OG 3.25Å
64	T	70.1	Confident	67.8	Low	30 Å²	30	93 Å²	93	18%	0.184	48%	0.477	C	S	.	.	H	α-helix	trans	-69.6	-39.8	176.4	50.5	0	0	0	0	111.7	V60 I61 S67 A68 M94	V60-T64 WeakPolarHBondContact O-CG2 3.44Å; V60-T64 PolarHBondContact O-N 3.34Å; V60-T64 PolarHBondContact O-OG1 2.81Å; V60-T64 VanDerWaalsContact O-OG1 3.11Å; I61-T64 WeakPolarHBondContact CA-OG1 3.37Å; I61-T64 PolarHBondContact O-N 3.17Å; I61-T64 PolarHBondContact O-OG1 3.39Å; T64-S67 WeakPolarHBondContact CA-OG 3.49Å; T64-S67 PolarHBondContact O-N 2.82Å; T64-S67 PolarHBondContact O-OG 2.91Å; T64-A68 VanDerWaalsContact O-CB 3.22Å; T64-A68 WeakPolarHBondContact O-CB 3.39Å; T64-A68 PolarHBondContact O-N 2.75Å; T64-M94 HydrophobicContact CG2-SD 3.94Å
65	L	72.1	Confident	67.1	Low	6 Å²	6	94 Å²	94	3%	0.031	48%	0.484	C	S	.	.	H	α-helix	trans	-56.9	-49.1	171.3	-77.7	167.7	0	0	0	111.7	V47 I61 L62 S67 A68 L69 L81 I86 L90	V47-L65 HydrophobicContact CG2-CD1 4.19Å; I61-L65 HydrophobicContact CG2-CD1 4.14Å; I61-L65 WeakPolarHBondContact O-CB 3.23Å; I61-L65 VanDerWaalsContact O-CG 3.25Å; I61-L65 WeakPolarHBondContact O-CG 3.25Å; I61-L65 PolarHBondContact O-N 2.83Å; L62-L65 HydrophobicContact CD2-CD1 4.48Å; L62-L65 PolarHBondContact O-N 3.47Å; L65-S67 VanDerWaalsContact C-N 3.29Å; L65-S67 PolarHBondContact O-N 2.82Å; L65-A68 PolarHBondContact O-N 2.88Å; L65-L69 HydrophobicContact CD2-CD1 3.72Å; L65-L69 WeakPolarHBondContact O-CB 3.07Å; L65-L69 PolarHBondContact O-N 2.9Å; L65-L81 HydrophobicContact CD2-CD1 4.5Å; L65-L81 HydrophobicContact CD2-CD2 4.31Å; L65-I86 HydrophobicContact CD2-CG2 4.32Å; L65-L90 HydrophobicContact CD2-CD1 3.64Å; L65-L90 HydrophobicContact CD2-CD2 4.38Å; L65-L90 HydrophobicContact CG-CD1 3.69Å
66	N	68.8	Low	66.4	Low	104 Å²	104	90.1 Å²	90.1	56%	0.556	47%	0.473	S	S	*	.	H	α-helix	trans	-68.1	-26.5	179.4	-69.3	-20.7	0	0	0	113.4	L62 R63	L62-N66 WeakPolarHBondContact O-CB 3.32Å; L62-N66 PolarHBondContact O-N 3.24Å; L62-N66 PolarHBondContact O-ND2 2.75Å; R63-N66 PolarHBondContact O-N 2.84Å
67	S	67.8	Low	65.6	Low	96 Å²	96	91.6 Å²	91.6	67%	0.671	48%	0.482	S	S	*	.	H	α-helix	trans	-82.3	-25.8	175.8	68.2	0	0	0	0	113.6	R63 T64 L65	R63-S67 WeakPolarHBondContact O-CB 3.32Å; R63-S67 PolarHBondContact O-N 3.23Å; R63-S67 PolarHBondContact O-OG 3.25Å; T64-S67 WeakPolarHBondContact CA-OG 3.49Å; T64-S67 PolarHBondContact O-N 2.82Å; T64-S67 PolarHBondContact O-OG 2.91Å; L65-S67 VanDerWaalsContact C-N 3.29Å; L65-S67 PolarHBondContact O-N 2.82Å
68	A	62.2	Low	65.1	Low	49 Å²	49	94.6 Å²	94.6	41%	0.405	49%	0.493	S	S	.	.	H	α-helix	trans	-97.5	-22.5	-173.7	0	0	0	0	0	113.3	T64 L65 L93	T64-A68 VanDerWaalsContact O-CB 3.22Å; T64-A68 WeakPolarHBondContact O-CB 3.39Å; T64-A68 PolarHBondContact O-N 2.75Å; L65-A68 PolarHBondContact O-N 2.88Å; A68-L93 HydrophobicContact CB-CD1 3.92Å
69	L	58.2	Low	64.8	Low	54 Å²	54	94.6 Å²	94.6	28%	0.283	49%	0.494	S	S	.	.			trans	-115.7	117.5	-173.7	-66.1	162.1	0	0	0	110.7	L65 T71 I86	L65-L69 HydrophobicContact CD2-CD1 3.72Å; L65-L69 WeakPolarHBondContact O-CB 3.07Å; L65-L69 PolarHBondContact O-N 2.9Å; L69-T71 PolarHBondContact O-N 2.93Å; L69-I86 HydrophobicContact CD1-CG2 3.89Å; L69-I86 HydrophobicContact CD2-CD1 4.02Å; L69-I86 HydrophobicContact CD2-CG1 4.16Å; L69-I86 HydrophobicContact CD2-CG2 4.38Å
70	V	50.6	Low	64.6	Low	152 Å²	152	94.3 Å²	94.3	92%	0.921	49%	0.491	S	S	*	.			trans	-73.2	16.7	174.2	177.4	0	0	0	0	111.8
71	T	53.2	Low	64.2	Low	94 Å²	94	92.2 Å²	92.2	58%	0.577	48%	0.477	S	S	*	.			trans	-93.5	130.6	-173.8	48.3	0	0	0	0	111.8	L69 H73	L69-T71 PolarHBondContact O-N 2.93Å; T71-H73 PolarHBondContact O-N 3.37Å
72	K	51.5	Low	63.8	Low	210 Å²	210	99.2 Å²	99.2	91%	0.913	51%	0.51	S	S	*	.	S	Bend	trans	-62.6	15.1	-170.3	-67.3	176.1	175.1	176.1	0	116.5
73	H	53.9	Low	63.6	Low	159 Å²	159	102.8 Å²	102.8	74%	0.736	53%	0.529	S	S	*	.			trans	-116.3	124.1	-172.5	-72.5	-74.7	0	0	0	112.1	T71 A75	T71-H73 PolarHBondContact O-N 3.37Å; H73-A75 PolarHBondContact O-N 3.28Å
74	K	56.8	Low	63.6	Low	200 Å²	200	98.3 Å²	98.3	87%	0.87	52%	0.515	S	S	*	.			trans	-65.3	111.3	168.8	-71	178.4	178	176.6	0	108.1
75	A	59.6	Low	63.7	Low	31 Å²	31	100 Å²	100	26%	0.256	53%	0.532	S	S	.	.			trans	-73.4	133.3	172.8	0	0	0	0	0	110.1	L62 H73	L62-A75 HydrophobicContact CD2-CB 4.02Å; L62-A75 WeakPolarHBondContact CD2-O 3.47Å; H73-A75 PolarHBondContact O-N 3.28Å
76	D	64.1	Low	63.7	Low	117 Å²	117	101.7 Å²	101.7	63%	0.626	54%	0.541	S	S	*	.			trans	-100.1	163.2	173.7	-75.9	-28.9	0	0	0	110.6	N78 S79	D76-N78 PolarHBondContact O-N 2.82Å; D76-S79 PolarHBondContact O-N 3.45Å; D76-S79 PolarHBondContact O-OG 2.79Å
77	N	63.2	Low	63.9	Low	76 Å²	76	96.8 Å²	96.8	41%	0.406	51%	0.514	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-18.4	-179.4	-72.7	-27.4	0	0	0	114.7	K48 L62	K48-N77 PolarHBondContact N-O 2.95Å; L62-N77 WeakPolarHBondContact CD1-OD1 3.47Å
78	N	67.8	Low	64.3	Low	123 Å²	123	95.5 Å²	95.5	66%	0.658	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.1	1.9	-176.4	-64.6	-12.5	0	0	0	113.6	D76 K80	D76-N78 PolarHBondContact O-N 2.82Å; N78-K80 PolarHBondContact O-N 2.87Å
79	S	69.3	Low	64.8	Low	40 Å²	40	96.8 Å²	96.8	28%	0.28	50%	0.501	S	S	.	.			trans	-68	126.7	175.9	59.3	0	0	0	0	109.9	D76	D76-S79 PolarHBondContact O-N 3.45Å; D76-S79 PolarHBondContact O-OG 2.79Å
80	K	71.4	Confident	65.7	Low	144 Å²	144	94.6 Å²	94.6	63%	0.626	49%	0.49	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.8	132.1	175.3	-65	-178.2	179.9	179.9	0	109.4	T46 N78	T46-K80 HydrophobicContact CG2-CG 4.33Å; N78-K80 PolarHBondContact O-N 2.87Å
81	L	66.3	Low	67	Low	20 Å²	20	87.5 Å²	87.5	11%	0.105	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	105.3	170.7	-67.1	170.9	0	0	0	108	G44 I45 L50 L65 I86 I87 L90	G44-L81 VanDerWaalsContact CA-O 3.24Å; G44-L81 WeakPolarHBondContact CA-O 3.29Å; G44-L81 PolarHBondContact N-O 3.19Å; I45-L81 PolarHBondContact O-N 3.48Å; L50-L81 HydrophobicContact CD1-CD1 3.72Å; L65-L81 HydrophobicContact CD2-CD1 4.5Å; L65-L81 HydrophobicContact CD2-CD2 4.31Å; L81-I86 HydrophobicContact CD2-CG2 4.11Å; L81-I87 HydrophobicContact CB-CD1 4.19Å; L81-I87 HydrophobicContact CB-CG1 3.89Å; L81-I87 HydrophobicContact CD1-CG1 4.43Å; L81-L90 HydrophobicContact CD1-CD2 4.16Å
82	E	65.8	Low	68.3	Low	151 Å²	151	88.9 Å²	88.9	71%	0.706	44%	0.444	S	S	*	.			trans	-84.4	-32.4	179.2	-64.9	179.4	175.9	0	0	111.3	K84	E82-K84 PolarHBondContact O-N 3.01Å
83	D	70.2	Confident	69.3	Low	101 Å²	101	83.9 Å²	83.9	54%	0.54	43%	0.427	S	S	.	.			trans	-77.4	113	-175.7	-71.1	-29.7	0	0	0	112.9	A85 I86 I87	D83-A85 PolarHBondContact O-N 3.47Å; D83-I86 HydrophobicContact CB-CB 3.98Å; D83-I86 HydrophobicContact CB-CD1 3.67Å; D83-I86 HydrophobicContact CB-CG1 3.6Å; D83-I86 PolarHBondContact O-N 2.89Å; D83-I86 VanDerWaalsContact OD2-CD1 3.29Å; D83-I86 WeakPolarHBondContact OD2-CD1 3.48Å; D83-I87 PolarHBondContact O-N 3.49Å; D83-I87 VanDerWaalsContact O-N 3.08Å
84	K	71.8	Confident	70.2	Confident	108 Å²	108	77.9 Å²	77.9	47%	0.47	40%	0.4	S	S	.	.	H	α-helix	trans	-51.4	-38.1	172	-173.7	175.5	-178.1	173	0	113.2	E82 E88 F100	E82-K84 PolarHBondContact O-N 3.01Å; K84-E88 WeakPolarHBondContact O-CB 3.23Å; K84-E88 PolarHBondContact O-N 2.96Å; K84-F100 HydrophobicContact CD-CZ 4.46Å; K84-F100 HydrophobicContact CG-CE1 3.96Å; K84-F100 HydrophobicContact CG-CE2 4.23Å; K84-F100 HydrophobicContact CG-CZ 3.61Å
85	A	73	Confident	71	Confident	66 Å²	66	70.1 Å²	70.1	55%	0.545	38%	0.377	S	S	.	.	H	α-helix	trans	-68.6	-37.7	179	0	0	0	0	0	112.4	D83 E88 T89	D83-A85 PolarHBondContact O-N 3.47Å; A85-E88 PolarHBondContact O-N 2.91Å; A85-T89 WeakPolarHBondContact O-CB 3.39Å; A85-T89 PolarHBondContact O-N 3.28Å; A85-T89 PolarHBondContact O-OG1 2.97Å
86	I	72.3	Confident	72	Confident	41 Å²	41	70.4 Å²	70.4	21%	0.21	37%	0.372	C	S	.	.	H	α-helix	trans	-68.8	-44.3	177.8	-62.1	-178	0	0	0	109.7	L65 L69 L81 D83 E88 T89 L90	L65-I86 HydrophobicContact CD2-CG2 4.32Å; L69-I86 HydrophobicContact CD1-CG2 3.89Å; L69-I86 HydrophobicContact CD2-CD1 4.02Å; L69-I86 HydrophobicContact CD2-CG1 4.16Å; L69-I86 HydrophobicContact CD2-CG2 4.38Å; L81-I86 HydrophobicContact CD2-CG2 4.11Å; D83-I86 HydrophobicContact CB-CB 3.98Å; D83-I86 HydrophobicContact CB-CD1 3.67Å; D83-I86 HydrophobicContact CB-CG1 3.6Å; D83-I86 PolarHBondContact O-N 2.89Å; D83-I86 VanDerWaalsContact OD2-CD1 3.29Å; D83-I86 WeakPolarHBondContact OD2-CD1 3.48Å; I86-E88 PolarHBondContact O-N 3.47Å; I86-T89 PolarHBondContact O-N 2.93Å; I86-L90 WeakPolarHBondContact O-CB 3.22Å; I86-L90 PolarHBondContact O-N 3.47Å
87	I	72.4	Confident	72.5	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-59.3	-47.2	175.7	-67.9	169.7	0	0	0	110.8	V41 I45 L81 D83 T89 L90 V91 F100	V41-I87 HydrophobicContact CB-CG2 4.14Å; V41-I87 HydrophobicContact CG1-CD1 4.46Å; V41-I87 HydrophobicContact CG1-CG2 3.39Å; V41-I87 HydrophobicContact CG2-CG2 4.43Å; I45-I87 HydrophobicContact CG2-CD1 4.14Å; I45-I87 HydrophobicContact CG2-CG1 4.45Å; L81-I87 HydrophobicContact CB-CD1 4.19Å; L81-I87 HydrophobicContact CB-CG1 3.89Å; L81-I87 HydrophobicContact CD1-CG1 4.43Å; D83-I87 PolarHBondContact O-N 3.49Å; D83-I87 VanDerWaalsContact O-N 3.08Å; I87-T89 PolarHBondContact O-N 2.84Å; I87-L90 PolarHBondContact O-N 2.82Å; I87-V91 HydrophobicContact CG2-CG2 4.25Å; I87-V91 WeakPolarHBondContact O-CB 3.37Å; I87-V91 WeakPolarHBondContact O-CG2 3.35Å; I87-V91 PolarHBondContact O-N 2.92Å; I87-F100 HydrophobicContact CG2-CE1 4.18Å; I87-F100 HydrophobicContact CG2-CZ 4.29Å
88	E	76.9	Confident	73	Confident	69 Å²	69	65.2 Å²	65.2	32%	0.322	35%	0.348	S	S	.	.	H	α-helix	trans	-64.5	-41.8	-179	-174.5	175.6	175.3	0	0	112	K84 A85 I86 K92 P98	K84-E88 WeakPolarHBondContact O-CB 3.23Å; K84-E88 PolarHBondContact O-N 2.96Å; A85-E88 PolarHBondContact O-N 2.91Å; I86-E88 PolarHBondContact O-N 3.47Å; E88-K92 HydrophobicContact CG-CD 4.16Å; E88-K92 WeakPolarHBondContact O-CB 3.2Å; E88-K92 WeakPolarHBondContact O-CG 3.38Å; E88-K92 PolarHBondContact O-N 3.49Å; E88-K92 WeakPolarHBondContact OE1-CE 3.49Å; E88-K92 IonicContact OE1-NZ 3.54Å; E88-K92 PolarHBondContact OE1-NZ 3.21Å; E88-P98 HydrophobicContact CG-CG 4.02Å
89	T	73.3	Confident	73.5	Confident	77 Å²	77	62.3 Å²	62.3	47%	0.472	33%	0.334	S	S	.	.	H	α-helix	trans	-67.3	-42.2	178.5	-48.1	0	0	0	0	111.1	A85 I86 I87 K92 L93	A85-T89 WeakPolarHBondContact O-CB 3.39Å; A85-T89 PolarHBondContact O-N 3.28Å; A85-T89 PolarHBondContact O-OG1 2.97Å; I86-T89 PolarHBondContact O-N 2.93Å; I87-T89 PolarHBondContact O-N 2.84Å; T89-K92 PolarHBondContact O-N 3.15Å; T89-L93 HydrophobicContact CG2-CD1 4.23Å; T89-L93 WeakPolarHBondContact O-CB 3.33Å; T89-L93 WeakPolarHBondContact O-CG 3.48Å; T89-L93 PolarHBondContact O-N 2.78Å
90	L	75.9	Confident	73.6	Confident	8 Å²	8	63.4 Å²	63.4	4%	0.042	33%	0.334	C	S	.	.	H	α-helix	trans	-61.1	-51.3	175.8	-172	80.6	0	0	0	111	L50 I61 L65 L81 I86 I87 K92 L93 M94	L50-L90 HydrophobicContact CD1-CD2 3.84Å; I61-L90 HydrophobicContact CG2-CD2 4.13Å; L65-L90 HydrophobicContact CD2-CD1 3.64Å; L65-L90 HydrophobicContact CD2-CD2 4.38Å; L65-L90 HydrophobicContact CG-CD1 3.69Å; L81-L90 HydrophobicContact CD1-CD2 4.16Å; I86-L90 WeakPolarHBondContact O-CB 3.22Å; I86-L90 PolarHBondContact O-N 3.47Å; I87-L90 PolarHBondContact O-N 2.82Å; L90-K92 VanDerWaalsContact C-N 3.3Å; L90-K92 PolarHBondContact O-N 3.27Å; L90-L93 PolarHBondContact O-N 3.09Å; L90-M94 WeakPolarHBondContact O-CG 3.38Å; L90-M94 PolarHBondContact O-N 2.98Å
91	V	78.4	Confident	73.3	Confident	3 Å²	3	63.9 Å²	63.9	2%	0.018	33%	0.332	C	S	.	.	H	α-helix	trans	-65	-36.3	-177.4	177.8	0	0	0	0	111.3	L39 V41 I87 M94 G95 F96 P98	L39-V91 HydrophobicContact CB-CG1 4.19Å; L39-V91 HydrophobicContact CD2-CG1 3.96Å; L39-V91 HydrophobicContact CD2-CG2 3.99Å; V41-V91 HydrophobicContact CG2-CG2 4.05Å; I87-V91 HydrophobicContact CG2-CG2 4.25Å; I87-V91 WeakPolarHBondContact O-CB 3.37Å; I87-V91 WeakPolarHBondContact O-CG2 3.35Å; I87-V91 PolarHBondContact O-N 2.92Å; V91-M94 PolarHBondContact O-N 2.58Å; V91-G95 PolarHBondContact O-N 2.83Å; V91-F96 CarbonylContact C-O 3.48Å; V91-F96 HydrophobicContact CG1-CB 3.64Å; V91-F96 PolarHBondContact O-N 3.23Å; V91-F96 VanDerWaalsContact O-O 3.09Å; V91-P98 HydrophobicContact CB-CB 4.11Å; V91-P98 HydrophobicContact CB-CG 4.31Å; V91-P98 HydrophobicContact CG1-CB 3.83Å; V91-P98 HydrophobicContact CG1-CG 4.16Å; V91-P98 HydrophobicContact CG2-CB 4.39Å
92	K	79.6	Confident	72.7	Confident	122 Å²	122	70.7 Å²	70.7	53%	0.53	36%	0.363	S	S	.	.	H	α-helix	trans	-64.6	-43.6	172.7	-76.7	173.7	-176	170.8	0	112.5	E88 T89 L90 M94 G95	E88-K92 HydrophobicContact CG-CD 4.16Å; E88-K92 WeakPolarHBondContact O-CB 3.2Å; E88-K92 WeakPolarHBondContact O-CG 3.38Å; E88-K92 PolarHBondContact O-N 3.49Å; E88-K92 WeakPolarHBondContact OE1-CE 3.49Å; E88-K92 IonicContact OE1-NZ 3.54Å; E88-K92 PolarHBondContact OE1-NZ 3.21Å; T89-K92 PolarHBondContact O-N 3.15Å; L90-K92 VanDerWaalsContact C-N 3.3Å; L90-K92 PolarHBondContact O-N 3.27Å; K92-M94 VanDerWaalsContact C-N 3.26Å; K92-M94 PolarHBondContact O-N 2.81Å; K92-G95 PolarHBondContact O-N 3.44Å; K92-G95 VanDerWaalsContact O-N 3.13Å
93	L	73.7	Confident	71.9	Confident	106 Å²	106	70.2 Å²	70.2	56%	0.555	36%	0.361	S	S	*	.	H	α-helix	trans	-63.6	-32.2	176.2	-79.3	165.5	0	0	0	112.2	A68 T89 L90 G95	A68-L93 HydrophobicContact CB-CD1 3.92Å; T89-L93 HydrophobicContact CG2-CD1 4.23Å; T89-L93 WeakPolarHBondContact O-CB 3.33Å; T89-L93 WeakPolarHBondContact O-CG 3.48Å; T89-L93 PolarHBondContact O-N 2.78Å; L90-L93 PolarHBondContact O-N 3.09Å; L93-G95 PolarHBondContact O-N 2.89Å
94	M	72.5	Confident	70.6	Confident	32 Å²	32	71.6 Å²	71.6	16%	0.158	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	0.3	176.4	-59.5	-61.9	-74.8	0	0	113.5	I56 V60 I61 T64 L90 V91 K92 F96	I56-M94 HydrophobicContact CB-CE 3.98Å; I56-M94 HydrophobicContact CD1-CE 3.32Å; I56-M94 HydrophobicContact CG1-CE 4.19Å; I56-M94 HydrophobicContact CG2-CE 3.55Å; V60-M94 HydrophobicContact CG1-CE 4.15Å; I61-M94 HydrophobicContact CG1-CE 3.94Å; T64-M94 HydrophobicContact CG2-SD 3.94Å; L90-M94 WeakPolarHBondContact O-CG 3.38Å; L90-M94 PolarHBondContact O-N 2.98Å; V91-M94 PolarHBondContact O-N 2.58Å; K92-M94 VanDerWaalsContact C-N 3.26Å; K92-M94 PolarHBondContact O-N 2.81Å; M94-F96 HydrophobicContact CB-CD2 3.88Å; M94-F96 HydrophobicContact CB-CE2 4.33Å; M94-F96 WeakPolarHBondContact O-CD2 3.38Å; M94-F96 WeakPolarHBondContact O-CE2 3.25Å
95	G	72.6	Confident	69.4	Low	37 Å²	37	72.5 Å²	72.5	38%	0.381	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	84	9	177.6	0	0	0	0	0	115.2	V91 K92 L93	V91-G95 PolarHBondContact O-N 2.83Å; K92-G95 PolarHBondContact O-N 3.44Å; K92-G95 VanDerWaalsContact O-N 3.13Å; L93-G95 PolarHBondContact O-N 2.89Å
96	F	80.5	Confident	68.1	Low	38 Å²	38	77.1 Å²	77.1	17%	0.167	39%	0.386	C	S	.	.			trans	-104.4	162.7	-180	-63.6	-86.6	0	0	0	111.9	S37 L39 A54 I56 V91 M94	S37-F96 VanDerWaalsContact O-CA 3.31Å; S37-F96 WeakPolarHBondContact O-CA 3.07Å; S37-F96 WeakPolarHBondContact OG-CD1 3.26Å; S37-F96 WeakPolarHBondContact OG-CE1 3.11Å; L39-F96 HydrophobicContact CB-CB 3.84Å; L39-F96 HydrophobicContact CB-CD1 4.27Å; L39-F96 HydrophobicContact CB-CG 4.18Å; A54-F96 HydrophobicContact CB-CE2 4.36Å; I56-F96 HydrophobicContact CD1-CE2 3.9Å; V91-F96 CarbonylContact C-O 3.48Å; V91-F96 HydrophobicContact CG1-CB 3.64Å; V91-F96 PolarHBondContact O-N 3.23Å; V91-F96 VanDerWaalsContact O-O 3.09Å; M94-F96 HydrophobicContact CB-CD2 3.88Å; M94-F96 HydrophobicContact CB-CE2 4.33Å; M94-F96 WeakPolarHBondContact O-CD2 3.38Å; M94-F96 WeakPolarHBondContact O-CE2 3.25Å
97	T	74.9	Confident	67.1	Low	55 Å²	55	82.6 Å²	82.6	34%	0.337	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	119	171	44	0	0	0	0	109.4	K36 S37 K38 L39	K36-T97 HydrophobicContact CB-CG2 4.27Å; S37-T97 PolarHBondContact O-N 3.21Å; S37-T97 PolarHBondContact O-OG1 3.14Å; K38-T97 WeakPolarHBondContact CA-O 3.23Å; K38-T97 WeakPolarHBondContact CA-OG1 3.36Å; K38-T97 WeakPolarHBondContact CG-OG1 3.14Å; L39-T97 PolarHBondContact N-O 2.91Å
98	P	73.6	Confident	66.6	Low	29 Å²	29	88.7 Å²	88.7	19%	0.188	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	133	-176.8	26.1	-29.7	0	0	0	111.3	L39 E88 V91 F100	L39-P98 CarbonylContact O-C 3.6Å; L39-P98 WeakPolarHBondContact O-CA 3.42Å; E88-P98 HydrophobicContact CG-CG 4.02Å; V91-P98 HydrophobicContact CB-CB 4.11Å; V91-P98 HydrophobicContact CB-CG 4.31Å; V91-P98 HydrophobicContact CG1-CB 3.83Å; V91-P98 HydrophobicContact CG1-CG 4.16Å; V91-P98 HydrophobicContact CG2-CB 4.39Å; P98-F100 HydrophobicContact CB-CE2 4.38Å
99	V	78.3	Confident	66.2	Low	61 Å²	61	91.8 Å²	91.8	37%	0.37	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	109.8	170.7	179.6	0	0	0	0	107.7	K38 L39 E40 V41 R101	K38-V99 HydrophobicContact CB-CG2 4.13Å; K38-V99 HydrophobicContact CD-CG2 4.27Å; K38-V99 HydrophobicContact CG-CG2 4.39Å; L39-V99 PolarHBondContact O-N 2.91Å; E40-V99 WeakPolarHBondContact CA-O 3.49Å; V41-V99 PolarHBondContact N-O 2.83Å; V99-R101 PolarHBondContact O-N 3.29Å
100	F	72.6	Confident	66.5	Low	63 Å²	63	91.6 Å²	91.6	28%	0.276	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	120.4	180	-70.1	-82.2	0	0	0	110.9	V41 K84 I87 P98	V41-F100 CarbonylContact O-C 3.46Å; V41-F100 VanDerWaalsContact O-CA 3.25Å; V41-F100 WeakPolarHBondContact O-CA 3.32Å; K84-F100 HydrophobicContact CD-CZ 4.46Å; K84-F100 HydrophobicContact CG-CE1 3.96Å; K84-F100 HydrophobicContact CG-CE2 4.23Å; K84-F100 HydrophobicContact CG-CZ 3.61Å; I87-F100 HydrophobicContact CG2-CE1 4.18Å; I87-F100 HydrophobicContact CG2-CZ 4.29Å; P98-F100 HydrophobicContact CB-CE2 4.38Å
101	R	64.3	Low	66.7	Low	155 Å²	155	92.9 Å²	92.9	59%	0.585	47%	0.47	S	S	*	.			trans	-110.8	118.3	176.8	-155.3	174.3	-175.4	174.5	-2.6	109.6	E40 V41 V99 Q103	E40-R101 IonicContact OE1-NH1 2.69Å; E40-R101 WeakPolarHBondContact OE2-CD 3.41Å; E40-R101 IonicContact OE2-CZ 2.78Å; E40-R101 IonicContact OE2-NH1 2.76Å; E40-R101 PolarHBondContact OE2-NH1 2.84Å; V41-R101 PolarHBondContact O-N 2.83Å; V99-R101 PolarHBondContact O-N 3.29Å; R101-Q103 PolarHBondContact O-N 3.15Å
102	H	55.1	Low	67	Low	162 Å²	162	94.2 Å²	94.2	75%	0.75	48%	0.477	S	S	*	.			trans	-73.1	121.9	167.6	-65.4	82.5	0	0	0	107.4	I104	H102-I104 PolarHBondContact O-N 3.06Å
103	Q	47.7	Very low	67.3	Low	141 Å²	141	89 Å²	89	66%	0.659	46%	0.457	S	S	*	.			trans	-66.7	104.1	169.2	-71.7	-178.3	-0.2	0	0	107.5	R101 I105	R101-Q103 PolarHBondContact O-N 3.15Å; Q103-I105 VanDerWaalsContact C-N 3.29Å; Q103-I105 PolarHBondContact O-N 3.24Å; Q103-I105 VanDerWaalsContact O-N 3.08Å
104	I	43.7	Very low	68	Low	130 Å²	130	91 Å²	91	67%	0.667	46%	0.458	S	S	*	.			trans	-73.4	96.9	161	-57.6	170.6	0	0	0	104.4	H102 H106	H102-I104 PolarHBondContact O-N 3.06Å; I104-H106 PolarHBondContact O-N 2.77Å
105	I	45.8	Very low	68.7	Low	127 Å²	127	93 Å²	93	65%	0.651	47%	0.474	S	S	*	.			trans	-61.3	108.2	160.4	-58.7	170.9	0	0	0	103.9	Q103 E107	Q103-I105 VanDerWaalsContact C-N 3.29Å; Q103-I105 PolarHBondContact O-N 3.24Å; Q103-I105 VanDerWaalsContact O-N 3.08Å; I105-E107 HydrophobicContact CG2-CG 4.09Å; I105-E107 PolarHBondContact O-N 3.36Å
106	H	45.7	Very low	69.3	Low	164 Å²	164	95 Å²	95	76%	0.759	47%	0.47	S	S	*	.			trans	-69.6	81.4	168.4	-78.2	-67.5	0	0	0	107	I104 T108	I104-H106 PolarHBondContact O-N 2.77Å; H106-T108 PolarHBondContact O-N 3.46Å
107	E	52.3	Low	69.6	Low	155 Å²	155	98.3 Å²	98.3	72%	0.724	50%	0.495	S	S	*	.			trans	-57.9	119.3	159.4	-69.9	-178.7	175.6	0	0	105.8	I105 I109	I105-E107 HydrophobicContact CG2-CG 4.09Å; I105-E107 PolarHBondContact O-N 3.36Å; E107-I109 VanDerWaalsContact C-N 3.25Å; E107-I109 PolarHBondContact O-N 3.32Å
108	T	61.3	Low	70	Confident	129 Å²	129	100.8 Å²	100.8	79%	0.791	51%	0.512	S	S	*	.			trans	-65.3	92.5	174.8	44.8	0	0	0	0	107.3	H106 D110	H106-T108 PolarHBondContact O-N 3.46Å; T108-D110 PolarHBondContact O-N 3.37Å; T108-D110 VanDerWaalsContact O-N 3.15Å
109	I	68.7	Low	70.3	Confident	134 Å²	134	100.8 Å²	100.8	69%	0.687	51%	0.513	S	S	*	.			trans	-58.6	120.6	176.1	-57.7	171.1	0	0	0	106.9	E107 C111	E107-I109 VanDerWaalsContact C-N 3.25Å; E107-I109 PolarHBondContact O-N 3.32Å; I109-C111 PolarHBondContact O-N 3.2Å; I109-C111 VanDerWaalsContact O-N 3.14Å
110	D	79.7	Confident	70.6	Confident	72 Å²	72	101.1 Å²	101.1	39%	0.385	52%	0.516	S	S	.	.			trans	-64.9	112.2	173.9	-177.2	3	0	0	0	108.8	T108 D112 Y114 Y412	T108-D110 PolarHBondContact O-N 3.37Å; T108-D110 VanDerWaalsContact O-N 3.15Å; D110-D112 WeakPolarHBondContact OD1-CB 3.47Å; D110-D112 PolarHBondContact OD1-N 3.14Å; D110-Y114 VanDerWaalsContact OD2-CE2 3.31Å; D110-Y114 WeakPolarHBondContact OD2-CE2 3.37Å; D110-Y114 PolarHBondContact OD2-OH 3.17Å; D110-Y412 WeakPolarHBondContact OD1-CE1 3.43Å
111	C	79.1	Confident	70.9	Confident	35 Å²	35	103.1 Å²	103.1	24%	0.236	54%	0.535	C	S	.	.			trans	-106.1	13	-176.6	-76.2	0	0	0	0	112.1	I109 R405 V409 Y412	I109-C111 PolarHBondContact O-N 3.2Å; I109-C111 VanDerWaalsContact O-N 3.14Å; C111-R405 PolarHBondContact O-NH2 3.42Å; C111-R405 VanDerWaalsContact O-NH2 3.13Å; C111-V409 VanDerWaalsContact O-CG2 3.27Å; C111-V409 WeakPolarHBondContact O-CG2 3.48Å; C111-Y412 HydrophobicContact CB-CD2 4.27Å; C111-Y412 HydrophobicContact CB-CG 4.29Å
112	D	86.5	Confident	71.9	Confident	31 Å²	31	104.8 Å²	104.8	17%	0.166	55%	0.55	C	S	.	.			trans	-72.1	165.8	-178.7	-148.3	-17	0	0	0	112.8	D110 Y114 R405 V409 Y412 R413	D110-D112 WeakPolarHBondContact OD1-CB 3.47Å; D110-D112 PolarHBondContact OD1-N 3.14Å; D112-Y114 HydrophobicContact CB-CE2 4.04Å; D112-R405 PolarHBondContact O-NH2 2.93Å; D112-V409 VanDerWaalsContact OD1-CG1 3.29Å; D112-V409 WeakPolarHBondContact OD1-CG1 3.5Å; D112-Y412 HydrophobicContact CB-CD1 3.92Å; D112-Y412 HydrophobicContact CB-CE1 3.89Å; D112-R413 IonicContact OD1-CZ 3.47Å; D112-R413 VanDerWaalsContact OD1-CZ 3.25Å; D112-R413 IonicContact OD1-NE 3.65Å; D112-R413 PolarHBondContact OD1-NE 3.24Å; D112-R413 IonicContact OD1-NH2 3.79Å; D112-R413 PolarHBondContact OD1-NH2 3.41Å; D112-R413 IonicContact OD2-NE 2.69Å
113	A	85	Confident	73.3	Confident	12 Å²	12	103.3 Å²	103.3	10%	0.099	54%	0.541	C	S	.	.			trans	-103	122.6	168.6	0	0	0	0	0	109.3	L398 L400 V409 R413	A113-L398 HydrophobicContact CB-CD1 3.86Å; A113-L398 WeakPolarHBondContact O-CD1 3.44Å; A113-L400 HydrophobicContact CB-CD2 3.89Å; A113-V409 HydrophobicContact CB-CG1 4.06Å; A113-V409 HydrophobicContact CB-CG2 4.12Å; A113-R413 PolarHBondContact O-NH2 3.37Å; A113-R413 VanDerWaalsContact O-NH2 3.11Å
114	Y	88.1	Confident	74.9	Confident	148 Å²	148	98 Å²	98	58%	0.58	52%	0.519	S	S	*	.			trans	-107.1	152.1	178.6	-66.9	-75.6	0	0	0	110.9	D110 D112	D110-Y114 VanDerWaalsContact OD2-CE2 3.31Å; D110-Y114 WeakPolarHBondContact OD2-CE2 3.37Å; D110-Y114 PolarHBondContact OD2-OH 3.17Å; D112-Y114 HydrophobicContact CB-CE2 4.04Å
115	P	86.8	Confident	76.9	Confident	75 Å²	75	96.7 Å²	96.7	49%	0.487	51%	0.51	S	S	.	.	P	Polyproline II helix	trans	-60.9	145.2	172.4	27.1	-34.3	0	0	0	110.1
116	R	86.6	Confident	78.8	Confident	79 Å²	79	95.2 Å²	95.2	30%	0.298	51%	0.509	S	S	.	.	P	Polyproline II helix	trans	-67.2	151	179.8	-68.1	-178.4	-64.6	147.4	-2.6	110.9	D313 L317 E319	R116-D313 IonicContact CZ-OD2 3.49Å; R116-D313 IonicContact NH1-OD2 3.46Å; R116-D313 PolarHBondContact NH1-OD2 3.48Å; R116-D313 VanDerWaalsContact NH1-OD2 3.08Å; R116-D313 IonicContact NH2-OD2 3.84Å; R116-D313 PolarHBondContact NH2-OD2 2.92Å; R116-L317 PolarHBondContact NH2-O 3.05Å; R116-E319 WeakPolarHBondContact CB-OE1 3.48Å; R116-E319 WeakPolarHBondContact CG-OE1 3.39Å; R116-E319 PolarHBondContact N-OE1 3.48Å; R116-E319 IonicContact NE-OE1 3.86Å; R116-E319 PolarHBondContact NE-OE1 3Å
117	P	86.6	Confident	80.8	Confident	108 Å²	108	89.3 Å²	89.3	70%	0.701	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-56.1	155.6	170.5	25.6	-34.6	0	0	0	110.8	C119	P117-C119 PolarHBondContact O-N 3.49Å
118	P	81.8	Confident	82.5	Confident	106 Å²	106	82.5 Å²	82.5	69%	0.688	45%	0.449	S	S	*	.	P	Polyproline II helix	trans	-54.8	139.6	179.7	23.8	-33.4	0	0	0	111.1
119	C	80.5	Confident	84	Confident	30 Å²	30	76.9 Å²	76.9	20%	0.203	42%	0.415	C	S	.	.	P	Polyproline II helix	trans	-67	139.3	-177.2	-172.7	0	0	0	0	110.2	P117 C124 D313	P117-C119 PolarHBondContact O-N 3.49Å; C119-C124 WeakPolarHBondContact CB-SG 3.46Å; C119-C124 PolarHBondContact SG-SG 2.89Å; C119-D313 HydrophobicContact CB-CB 4.2Å
120	P	84	Confident	85.2	Confident	67 Å²	67	70.6 Å²	70.6	44%	0.435	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-58.9	141.1	170.5	24.9	-34.6	0	0	0	110.3	E122 K123 C124	P120-E122 PolarHBondContact O-N 2.86Å; P120-K123 HydrophobicContact CG-CB 4.44Å; P120-K123 HydrophobicContact CG-CD 4.07Å; P120-K123 HydrophobicContact CG-CG 4.27Å; P120-K123 PolarHBondContact O-N 2.84Å; P120-C124 PolarHBondContact O-SG 2.79Å
121	P	80.6	Confident	85.9	Confident	106 Å²	106	67.1 Å²	67.1	69%	0.688	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-59.2	-28.5	-171.5	23.2	-34	0	0	0	113.3	K123 C124	P121-K123 VanDerWaalsContact C-N 3.27Å; P121-K123 PolarHBondContact O-N 3.43Å; P121-C124 PolarHBondContact O-N 3.3Å
122	E	83.5	Confident	86.6	Confident	189 Å²	189	65.5 Å²	65.5	88%	0.883	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-63.4	-27.4	178.9	-61.7	178	-177.8	0	0	114.2	P120	P120-E122 PolarHBondContact O-N 2.86Å
123	K	84.7	Confident	87	Confident	132 Å²	132	64 Å²	64	57%	0.574	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-98.1	0.4	-179.1	-67.1	-175.6	-177.6	-179.2	0	113	P120 P121	P120-K123 HydrophobicContact CG-CB 4.44Å; P120-K123 HydrophobicContact CG-CD 4.07Å; P120-K123 HydrophobicContact CG-CG 4.27Å; P120-K123 PolarHBondContact O-N 2.84Å; P121-K123 VanDerWaalsContact C-N 3.27Å; P121-K123 PolarHBondContact O-N 3.43Å
124	C	82.9	Confident	87.4	Confident	28 Å²	28	63.4 Å²	63.4	19%	0.189	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	120.4	-174.2	-58	0	0	0	0	110	C119 P120 P121 K311 A312	C119-C124 WeakPolarHBondContact CB-SG 3.46Å; C119-C124 PolarHBondContact SG-SG 2.89Å; P120-C124 PolarHBondContact O-SG 2.79Å; P121-C124 PolarHBondContact O-N 3.3Å; C124-K311 HydrophobicContact CB-CB 3.63Å; C124-K311 HydrophobicContact CB-CD 4.39Å; C124-K311 HydrophobicContact CB-CG 4.45Å; C124-A312 CarbonylContact C-O 3.59Å; C124-A312 WeakPolarHBondContact CA-O 3.25Å
125	E	85.4	Confident	87.5	Confident	103 Å²	103	56.4 Å²	56.4	48%	0.481	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	153.3	173.8	-70.6	179.9	-175.7	0	0	110	K311 A312 H314	E125-K311 CarbonylContact O-C 3.55Å; E125-K311 VanDerWaalsContact O-CA 3.23Å; E125-K311 WeakPolarHBondContact O-CA 3.49Å; E125-A312 PolarHBondContact N-O 3.4Å; E125-A312 PolarHBondContact O-N 2.92Å; E125-H314 IonicContact OE2-CD2 3.42Å; E125-H314 IonicContact OE2-CE1 2.85Å; E125-H314 IonicContact OE2-CG 3.88Å; E125-H314 IonicContact OE2-ND1 2.81Å; E125-H314 PolarHBondContact OE2-ND1 2.88Å
126	P	85.2	Confident	87.6	Confident	97 Å²	97	55 Å²	55	63%	0.63	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.8	137	177	27.8	-34.5	0	0	0	110.8	L310	P126-L310 WeakPolarHBondContact CA-O 3.31Å
127	R	88.2	Confident	87.7	Confident	39 Å²	39	53.1 Å²	53.1	15%	0.147	30%	0.297	C	S	.	.			trans	-119	157.8	178.1	69.5	157.2	175	102	-2.5	111.5	D216 L310 A312	R127-D216 IonicContact CZ-OD1 3.51Å; R127-D216 IonicContact CZ-OD2 3.08Å; R127-D216 VanDerWaalsContact CZ-OD2 3.26Å; R127-D216 IonicContact NH1-OD1 3.87Å; R127-D216 IonicContact NH1-OD2 2.7Å; R127-D216 PolarHBondContact NH1-OD2 3.26Å; R127-D216 IonicContact NH2-OD1 3.22Å; R127-D216 PolarHBondContact NH2-OD1 3.43Å; R127-D216 IonicContact NH2-OD2 3.19Å; R127-D216 PolarHBondContact NH2-OD2 3.41Å; R127-L310 HydrophobicContact CG-CB 4.33Å; R127-L310 PolarHBondContact N-O 3.42Å; R127-L310 VanDerWaalsContact N-O 3.14Å; R127-A312 HydrophobicContact CB-CB 4.06Å; R127-A312 HydrophobicContact CG-CB 4.01Å
128	P	87.6	Confident	87.6	Confident	13 Å²	13	53.9 Å²	53.9	8%	0.084	30%	0.295	C	S	.	.			trans	-67	146.4	176.7	27.4	-34.1	0	0	0	111.8	S192 F380	P128-S192 WeakPolarHBondContact CB-O 3.42Å; P128-F380 HydrophobicContact CG-CD2 4.31Å; P128-F380 HydrophobicContact CG-CE2 3.94Å; P128-F380 HydrophobicContact CG-CZ 4.21Å
129	P	92.7	Very high	88	Confident	10 Å²	10	48.9 Å²	48.9	7%	0.065	26%	0.263	C	S	.	.			trans	-70	144.5	174.2	28.2	-33.9	0	0	0	111.5	I193 T194 I217 A305 L310	P129-I193 HydrophobicContact CG-CG1 4.09Å; P129-I193 HydrophobicContact CG-CG2 4.36Å; P129-T194 PolarHBondContact O-N 2.82Å; P129-I217 HydrophobicContact CB-CD1 4.32Å; P129-A305 HydrophobicContact CB-CB 3.74Å; P129-A305 HydrophobicContact CG-CB 3.86Å; P129-L310 HydrophobicContact CB-CD1 3.72Å
130	I	93.8	Very high	88.3	Confident	2 Å²	2	48.1 Å²	48.1	1%	0.01	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	119.9	175.8	-52.3	156.5	0	0	0	107.7	T194 L196 T215 D216 I217 L338	I130-T194 CarbonylContact C-O 3.51Å; I130-T194 WeakPolarHBondContact CA-O 3.42Å; I130-T194 HydrophobicContact CG2-CG2 4.49Å; I130-L196 HydrophobicContact CG2-CD1 4.35Å; I130-L196 HydrophobicContact CG2-CG 4.23Å; I130-T215 HydrophobicContact CB-CG2 4.47Å; I130-T215 HydrophobicContact CG2-CG2 3.66Å; I130-T215 WeakPolarHBondContact O-CB 3.47Å; I130-D216 PolarHBondContact N-OD2 3.43Å; I130-D216 PolarHBondContact O-N 2.84Å; I130-I217 PolarHBondContact O-N 3.44Å; I130-L338 HydrophobicContact CD1-CD1 3.8Å; I130-L338 HydrophobicContact CD1-CD2 3.99Å; I130-L338 HydrophobicContact CD1-CG 4.14Å; I130-L338 HydrophobicContact CG1-CD1 4.17Å; I130-L338 HydrophobicContact CG2-CD1 4.3Å; I130-L338 HydrophobicContact CG2-CD2 4.09Å
131	V	94.4	Very high	88.5	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	121.4	-170.8	-176.4	0	0	0	0	110.5	I193 T194 F195 L196 I217 L219 I301	V131-I193 HydrophobicContact CB-CG2 4.37Å; V131-I193 HydrophobicContact CG2-CG2 3.67Å; V131-T194 PolarHBondContact N-O 3.42Å; V131-F195 HydrophobicContact CB-CD1 3.89Å; V131-F195 HydrophobicContact CB-CE1 4.02Å; V131-F195 HydrophobicContact CG1-CD1 4.06Å; V131-F195 HydrophobicContact CG1-CE1 3.98Å; V131-F195 HydrophobicContact CG2-CE1 4.49Å; V131-F195 CarbonylContact O-C 3.35Å; V131-F195 WeakPolarHBondContact O-CA 3.34Å; V131-L196 PolarHBondContact O-N 2.85Å; V131-I217 VanDerWaalsContact CA-O 3.3Å; V131-I217 WeakPolarHBondContact CA-O 3.41Å; V131-I217 HydrophobicContact CG2-CB 4.33Å; V131-L219 HydrophobicContact CG1-CB 3.7Å; V131-I301 HydrophobicContact CG2-CG2 3.68Å
132	A	94.1	Very high	88.7	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	129	172.3	0	0	0	0	0	110.5	T215 I217 L219	A132-T215 HydrophobicContact CB-CG2 3.54Å; A132-T215 WeakPolarHBondContact CB-OG1 3.29Å; A132-I217 PolarHBondContact N-O 3.05Å; A132-I217 VanDerWaalsContact N-O 3.09Å; A132-L219 PolarHBondContact O-N 2.67Å
133	V	94	Very high	88.8	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	110.1	177.8	-175.1	0	0	0	0	109.9	K141 L145 F195 L196 T198 L219 V221	V133-K141 HydrophobicContact CG1-CB 4.16Å; V133-K141 HydrophobicContact CG1-CD 4.24Å; V133-K141 HydrophobicContact CG1-CG 4.03Å; V133-L145 HydrophobicContact CB-CD1 4.35Å; V133-L145 HydrophobicContact CB-CD2 4.42Å; V133-L145 HydrophobicContact CG2-CD1 4.4Å; V133-L145 HydrophobicContact CG2-CD2 3.66Å; V133-L145 HydrophobicContact CG2-CG 4.45Å; V133-F195 HydrophobicContact CG2-CD1 3.96Å; V133-L196 PolarHBondContact N-O 3.26Å; V133-T198 PolarHBondContact O-OG1 2.86Å; V133-L219 WeakPolarHBondContact CA-O 3.36Å; V133-L219 HydrophobicContact CG1-CD2 4.33Å; V133-L219 HydrophobicContact CG2-CB 4.26Å; V133-L219 HydrophobicContact CG2-CD2 3.87Å; V133-L219 HydrophobicContact CG2-CG 4.5Å; V133-V221 HydrophobicContact CG1-CG2 3.57Å
134	L	93.2	Very high	89.1	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	154.7	-175.6	-74.1	165.4	0	0	0	111.2	T198 R208 T212 M218 L219 V221 A235	L134-T198 HydrophobicContact CD2-CG2 4.18Å; L134-T198 WeakPolarHBondContact CD2-OG1 3.45Å; L134-R208 HydrophobicContact CD2-CB 3.77Å; L134-R208 HydrophobicContact CD2-CG 3.51Å; L134-T212 WeakPolarHBondContact CD1-OG1 3.4Å; L134-M218 HydrophobicContact CB-CG 4.43Å; L134-M218 HydrophobicContact CB-SD 4.33Å; L134-M218 HydrophobicContact CD1-CG 3.75Å; L134-M218 HydrophobicContact CD1-SD 3.37Å; L134-M218 WeakPolarHBondContact CD1-SD 3.4Å; L134-M218 HydrophobicContact CG-SD 4.43Å; L134-L219 PolarHBondContact N-O 3.39Å; L134-V221 PolarHBondContact O-N 2.98Å; L134-A235 HydrophobicContact CB-CB 3.93Å; L134-A235 HydrophobicContact CD1-CB 4.41Å
135	G	90.2	Very high	89.3	Confident	1 Å²	1	27.1 Å²	27.1	1%	0.01	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	161.7	175.1	-174.2	0	0	0	0	0	113	K141	G135-K141 VanDerWaalsContact C-CE 3.41Å; G135-K141 WeakPolarHBondContact O-CE 3.31Å; G135-K141 PolarHBondContact O-NZ 2.95Å
136	H	90.3	Very high	89.3	Confident	44 Å²	44	22.9 Å²	22.9	20%	0.204	13%	0.132	C	C	.	.			trans	-73.4	166.2	175.7	-167	53.5	0	0	0	111.8	H139 K141 K229 Q231	H136-H139 WeakPolarHBondContact CB-CE1 3.31Å; H136-H139 WeakPolarHBondContact CB-NE2 3.37Å; H136-H139 AromaticContact CD2-NE2 3.88Å; H136-K141 WeakPolarHBondContact O-CE 3.1Å; H136-K229 HydrophobicContact CB-CB 4.09Å; H136-K229 HydrophobicContact CB-CG 4.49Å; H136-Q231 VanDerWaalsContact CA-OE1 3.29Å; H136-Q231 HydrophobicContact CB-CB 4.42Å; H136-Q231 PolarHBondContact ND1-OE1 3.32Å
137	V	87.8	Confident	89.3	Confident	40 Å²	40	19 Å²	19	24%	0.242	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	144.8	167.1	-176	0	0	0	0	109.1	H139 H201	V137-H139 PolarHBondContact O-N 2.91Å; V137-H201 HydrophobicContact CG2-CB 4.27Å
138	D	85.8	Confident	89.1	Confident	125 Å²	125	17.6 Å²	17.6	67%	0.668	10%	0.103	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.6	12.4	179.4	-57.7	-23.5	0	0	0	117.3	G140 K252	D138-G140 PolarHBondContact O-N 3.43Å; D138-K252 WeakPolarHBondContact O-CE 3.48Å; D138-K252 PolarHBondContact O-NZ 2.99Å
139	H	89.8	Confident	88.7	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.116	C	C	.	.	S	Bend	trans	-75.4	-4.7	168.8	-75.6	-163.7	0	0	0	113.6	H136 V137 V221 V222 A223 N251	H136-H139 WeakPolarHBondContact CB-CE1 3.31Å; H136-H139 WeakPolarHBondContact CB-NE2 3.37Å; H136-H139 AromaticContact CD2-NE2 3.88Å; V137-H139 PolarHBondContact O-N 2.91Å; H139-V221 HydrophobicContact CB-CG1 4.25Å; H139-V221 PolarHBondContact ND1-O 3.07Å; H139-V221 WeakPolarHBondContact O-CG1 3.27Å; H139-V222 WeakPolarHBondContact ND1-CA 3.42Å; H139-A223 HydrophobicContact CB-CB 4.2Å; H139-A223 PolarHBondContact ND1-N 2.77Å; H139-N251 PolarHBondContact O-ND2 3.19Å
140	G	85.5	Confident	87.6	Confident	14 Å²	14	25.1 Å²	25.1	14%	0.144	14%	0.142	C	C	.	.			trans	81.9	31.3	176.3	0	0	0	0	0	114.7	D138 T143 L144	D138-G140 PolarHBondContact O-N 3.43Å; G140-T143 PolarHBondContact O-N 3.06Å; G140-L144 WeakPolarHBondContact O-CB 3.41Å; G140-L144 PolarHBondContact O-N 3.3Å
141	K	87.9	Confident	86.5	Confident	11 Å²	11	26.8 Å²	26.8	5%	0.048	15%	0.153	C	C	.	.	H	α-helix	trans	-57.7	-55.3	176.2	-70.3	-172	-97.1	170.7	0	112.2	V133 G135 H136 T143 L144 L145 T198 V221	V133-K141 HydrophobicContact CG1-CB 4.16Å; V133-K141 HydrophobicContact CG1-CD 4.24Å; V133-K141 HydrophobicContact CG1-CG 4.03Å; G135-K141 VanDerWaalsContact C-CE 3.41Å; G135-K141 WeakPolarHBondContact O-CE 3.31Å; G135-K141 PolarHBondContact O-NZ 2.95Å; H136-K141 WeakPolarHBondContact O-CE 3.1Å; K141-T143 VanDerWaalsContact C-N 3.3Å; K141-T143 PolarHBondContact O-N 3.27Å; K141-L144 WeakPolarHBondContact O-CB 3.31Å; K141-L144 PolarHBondContact O-N 3.01Å; K141-L144 VanDerWaalsContact O-N 3.15Å; K141-L145 WeakPolarHBondContact O-CG 3.33Å; K141-L145 PolarHBondContact O-N 2.9Å; K141-T198 PolarHBondContact NZ-O 2.97Å; K141-T198 VanDerWaalsContact NZ-O 3.13Å; K141-V221 HydrophobicContact CG-CB 4.01Å; K141-V221 HydrophobicContact CG-CG1 4.48Å; K141-V221 HydrophobicContact CG-CG2 4.11Å
142	T	85.5	Confident	85.1	Confident	19 Å²	19	35.9 Å²	35.9	12%	0.117	19%	0.188	C	C	.	.	H	α-helix	trans	-64.2	-38.6	179.7	-33.7	0	0	0	0	111	L144 L145 D146 V154 T162	T142-L144 VanDerWaalsContact C-N 3.32Å; T142-L144 PolarHBondContact O-N 3.09Å; T142-L145 PolarHBondContact O-N 3.43Å; T142-L145 VanDerWaalsContact O-N 3.16Å; T142-D146 WeakPolarHBondContact O-CB 3.38Å; T142-D146 PolarHBondContact O-N 3.38Å; T142-V154 HydrophobicContact CG2-CG2 3.41Å; T142-V154 VanDerWaalsContact CG2-CG2 3.41Å; T142-T162 HydrophobicContact CG2-CG2 3.39Å; T142-T162 WeakPolarHBondContact OG1-CG2 3.49Å
143	T	86.9	Confident	84.1	Confident	50 Å²	50	37 Å²	37	31%	0.307	20%	0.195	S	C	.	.	H	α-helix	trans	-61.9	-38.6	175	-41.7	0	0	0	0	112.3	G140 K141 A147 A288 L289	G140-T143 PolarHBondContact O-N 3.06Å; K141-T143 VanDerWaalsContact C-N 3.3Å; K141-T143 PolarHBondContact O-N 3.27Å; T143-A147 WeakPolarHBondContact O-CB 3.39Å; T143-A147 PolarHBondContact O-N 2.82Å; T143-A288 HydrophobicContact CG2-CB 4.14Å; T143-L289 HydrophobicContact CG2-CD2 3.84Å
144	L	89.4	Confident	82.7	Confident	0 Å²	0	39 Å²	39	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-63.6	-45.6	173.4	178	158.4	0	0	0	110.6	G140 K141 T142 A147 L148 L219 V221 I286 A288 L297	G140-L144 WeakPolarHBondContact O-CB 3.41Å; G140-L144 PolarHBondContact O-N 3.3Å; K141-L144 WeakPolarHBondContact O-CB 3.31Å; K141-L144 PolarHBondContact O-N 3.01Å; K141-L144 VanDerWaalsContact O-N 3.15Å; T142-L144 VanDerWaalsContact C-N 3.32Å; T142-L144 PolarHBondContact O-N 3.09Å; L144-A147 WeakPolarHBondContact O-CB 3.46Å; L144-A147 PolarHBondContact O-N 3.28Å; L144-L148 HydrophobicContact CD2-CD1 3.66Å; L144-L148 HydrophobicContact CD2-CG 4.34Å; L144-L148 WeakPolarHBondContact O-CG 3.47Å; L144-L148 PolarHBondContact O-N 3.19Å; L144-L219 HydrophobicContact CD2-CD2 4.36Å; L144-V221 HydrophobicContact CD1-CG2 4.16Å; L144-I286 HydrophobicContact CD1-CD1 3.3Å; L144-I286 HydrophobicContact CG-CD1 4.33Å; L144-A288 HydrophobicContact CB-CB 4.21Å; L144-L297 HydrophobicContact CD1-CD2 4.09Å
145	L	88.2	Confident	81.5	Confident	1 Å²	1	44.8 Å²	44.8	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-67.9	-37.6	-179.9	-63.6	172.6	0	0	0	112.2	V133 K141 T142 L148 R149 F168 F195 D197	V133-L145 HydrophobicContact CB-CD1 4.35Å; V133-L145 HydrophobicContact CB-CD2 4.42Å; V133-L145 HydrophobicContact CG2-CD1 4.4Å; V133-L145 HydrophobicContact CG2-CD2 3.66Å; V133-L145 HydrophobicContact CG2-CG 4.45Å; K141-L145 WeakPolarHBondContact O-CG 3.33Å; K141-L145 PolarHBondContact O-N 2.9Å; T142-L145 PolarHBondContact O-N 3.43Å; T142-L145 VanDerWaalsContact O-N 3.16Å; L145-L148 HydrophobicContact CD2-CD1 4.49Å; L145-L148 PolarHBondContact O-N 3.3Å; L145-R149 WeakPolarHBondContact O-CB 3.19Å; L145-R149 WeakPolarHBondContact O-CG 3.43Å; L145-R149 PolarHBondContact O-N 3.5Å; L145-F168 HydrophobicContact CB-CE1 3.97Å; L145-F168 HydrophobicContact CB-CZ 3.64Å; L145-F168 HydrophobicContact CD1-CE1 4.05Å; L145-F168 HydrophobicContact CD1-CZ 4.3Å; L145-F168 HydrophobicContact CD2-CE1 3.92Å; L145-F168 HydrophobicContact CD2-CE2 4.46Å; L145-F168 HydrophobicContact CD2-CZ 3.38Å; L145-F168 HydrophobicContact CG-CE1 4.16Å; L145-F168 HydrophobicContact CG-CZ 3.9Å; L145-F195 HydrophobicContact CD2-CB 4.09Å; L145-F195 HydrophobicContact CD2-CD1 4.08Å; L145-F195 HydrophobicContact CD2-CG 4.12Å; L145-D197 HydrophobicContact CD1-CB 3.55Å; L145-D197 VanDerWaalsContact CD1-OD1 3.24Å; L145-D197 WeakPolarHBondContact CD1-OD1 3.38Å
146	D	85.3	Confident	80.7	Confident	15 Å²	15	52.2 Å²	52.2	8%	0.08	27%	0.272	C	S	.	.	H	α-helix	trans	-62.8	-41.9	171.9	-89	-10.1	0	0	0	111.9	T142 L148 R149 S150 S151 R152 V153 V154	T142-D146 WeakPolarHBondContact O-CB 3.38Å; T142-D146 PolarHBondContact O-N 3.38Å; D146-L148 VanDerWaalsContact C-N 3.28Å; D146-L148 PolarHBondContact O-N 3.43Å; D146-R149 PolarHBondContact O-N 2.86Å; D146-S150 PolarHBondContact O-N 3.32Å; D146-S151 CarbonylContact C-O 3.58Å; D146-S151 WeakPolarHBondContact CA-O 3.26Å; D146-S151 WeakPolarHBondContact CB-O 3.49Å; D146-S151 VanDerWaalsContact CG-O 3.3Å; D146-S151 PolarHBondContact O-N 3.01Å; D146-S151 VanDerWaalsContact O-O 3.12Å; D146-R152 WeakPolarHBondContact OD2-CA 3.4Å; D146-V153 VanDerWaalsContact CG-N 3.27Å; D146-V153 WeakPolarHBondContact OD1-CB 3.25Å; D146-V153 PolarHBondContact OD1-N 3.26Å; D146-V153 PolarHBondContact OD2-N 2.86Å; D146-V154 VanDerWaalsContact OD2-CG2 3.28Å; D146-V154 WeakPolarHBondContact OD2-CG2 3.1Å; D146-V154 PolarHBondContact OD2-N 2.91Å; D146-V154 VanDerWaalsContact OD2-N 3.09Å
147	A	85.3	Confident	79.6	Confident	16 Å²	16	52.3 Å²	52.3	13%	0.132	27%	0.273	C	S	.	.	H	α-helix	trans	-61	-38.4	174.2	0	0	0	0	0	111.9	T143 L144 R291 L294	T143-A147 WeakPolarHBondContact O-CB 3.39Å; T143-A147 PolarHBondContact O-N 2.82Å; L144-A147 WeakPolarHBondContact O-CB 3.46Å; L144-A147 PolarHBondContact O-N 3.28Å; A147-R291 HydrophobicContact CB-CG 4.29Å; A147-L294 HydrophobicContact CB-CD1 3.84Å
148	L	83.7	Confident	78.5	Confident	9 Å²	9	55.8 Å²	55.8	5%	0.047	29%	0.285	C	S	.	.	H	α-helix	trans	-73.5	-36.2	175.9	-68.1	178.4	0	0	0	113.2	L144 L145 D146 S150 V170 F195 L298	L144-L148 HydrophobicContact CD2-CD1 3.66Å; L144-L148 HydrophobicContact CD2-CG 4.34Å; L144-L148 WeakPolarHBondContact O-CG 3.47Å; L144-L148 PolarHBondContact O-N 3.19Å; L145-L148 HydrophobicContact CD2-CD1 4.49Å; L145-L148 PolarHBondContact O-N 3.3Å; D146-L148 VanDerWaalsContact C-N 3.28Å; D146-L148 PolarHBondContact O-N 3.43Å; L148-S150 VanDerWaalsContact C-N 3.33Å; L148-V170 HydrophobicContact CB-CG2 4.43Å; L148-F195 HydrophobicContact CD1-CE1 4.19Å; L148-F195 HydrophobicContact CD1-CE2 3.91Å; L148-F195 HydrophobicContact CD1-CZ 3.72Å; L148-L298 HydrophobicContact CD2-CD1 3.95Å; L148-L298 HydrophobicContact CD2-CD2 4.08Å; L148-L298 HydrophobicContact CD2-CG 4.2Å
149	R	78.2	Confident	77.6	Confident	93 Å²	93	52.5 Å²	52.5	35%	0.351	28%	0.281	S	S	.	.	H	α-helix	trans	-77.7	-16.5	-178.5	-74.6	170.8	57.4	160.3	0.4	113.7	L145 D146 S151 V153 F168	L145-R149 WeakPolarHBondContact O-CB 3.19Å; L145-R149 WeakPolarHBondContact O-CG 3.43Å; L145-R149 PolarHBondContact O-N 3.5Å; D146-R149 PolarHBondContact O-N 2.86Å; R149-S151 VanDerWaalsContact CB-OG 3.22Å; R149-S151 WeakPolarHBondContact CB-OG 3.44Å; R149-S151 PolarHBondContact NE-OG 3.25Å; R149-S151 PolarHBondContact O-N 3.09Å; R149-V153 VanDerWaalsContact CZ-CG2 3.43Å; R149-V153 VanDerWaalsContact NH2-CG2 3.26Å; R149-F168 HydrophobicContact CG-CD2 3.51Å; R149-F168 HydrophobicContact CG-CE1 4.43Å; R149-F168 HydrophobicContact CG-CE2 3.37Å; R149-F168 HydrophobicContact CG-CG 4.09Å; R149-F168 HydrophobicContact CG-CZ 3.84Å
150	S	70.3	Confident	76.7	Confident	87 Å²	87	54.7 Å²	54.7	61%	0.608	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.8	23.2	-164.8	67.1	0	0	0	0	113.6	D146 L148	D146-S150 PolarHBondContact O-N 3.32Å; L148-S150 VanDerWaalsContact C-N 3.33Å
151	S	70	Confident	76.3	Confident	37 Å²	37	56.2 Å²	56.2	26%	0.259	31%	0.307	S	S	.	.	S	Bend	trans	-117	164.3	174.1	63.6	0	0	0	0	110.5	D146 R149	D146-S151 CarbonylContact C-O 3.58Å; D146-S151 WeakPolarHBondContact CA-O 3.26Å; D146-S151 WeakPolarHBondContact CB-O 3.49Å; D146-S151 VanDerWaalsContact CG-O 3.3Å; D146-S151 PolarHBondContact O-N 3.01Å; D146-S151 VanDerWaalsContact O-O 3.12Å; R149-S151 VanDerWaalsContact CB-OG 3.22Å; R149-S151 WeakPolarHBondContact CB-OG 3.44Å; R149-S151 PolarHBondContact NE-OG 3.25Å; R149-S151 PolarHBondContact O-N 3.09Å
152	R	66	Low	75.9	Confident	192 Å²	192	56.3 Å²	56.3	73%	0.725	31%	0.309	S	S	*	.			trans	-119.3	87.9	172.9	-67.2	-174.8	-176.7	-177.3	0.1	109.2	D146	D146-R152 WeakPolarHBondContact OD2-CA 3.4Å
153	V	72.3	Confident	75.7	Confident	24 Å²	24	55.9 Å²	55.9	15%	0.145	31%	0.306	C	S	.	.			trans	-81.7	-31.4	177.1	179.6	0	0	0	0	111	D146 R149 D155 E156 E157	D146-V153 VanDerWaalsContact CG-N 3.27Å; D146-V153 WeakPolarHBondContact OD1-CB 3.25Å; D146-V153 PolarHBondContact OD1-N 3.26Å; D146-V153 PolarHBondContact OD2-N 2.86Å; R149-V153 VanDerWaalsContact CZ-CG2 3.43Å; R149-V153 VanDerWaalsContact NH2-CG2 3.26Å; V153-D155 PolarHBondContact O-N 3.29Å; V153-D155 VanDerWaalsContact O-N 3.12Å; V153-E156 PolarHBondContact O-N 3.46Å; V153-E157 HydrophobicContact CG1-CG 3.92Å; V153-E157 PolarHBondContact O-N 3.08Å; V153-E157 VanDerWaalsContact O-N 3.14Å
154	V	65.5	Low	75.5	Confident	40 Å²	40	55.8 Å²	55.8	24%	0.242	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-34.7	-177.8	174.8	0	0	0	0	112.9	T142 D146 E156	T142-V154 HydrophobicContact CG2-CG2 3.41Å; T142-V154 VanDerWaalsContact CG2-CG2 3.41Å; D146-V154 VanDerWaalsContact OD2-CG2 3.28Å; D146-V154 WeakPolarHBondContact OD2-CG2 3.1Å; D146-V154 PolarHBondContact OD2-N 2.91Å; D146-V154 VanDerWaalsContact OD2-N 3.09Å; V154-E156 VanDerWaalsContact C-N 3.32Å
155	D	68.6	Low	75.3	Confident	122 Å²	122	56.1 Å²	56.1	65%	0.652	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-23.9	-179.8	-64.8	-26.1	0	0	0	112.5	V153	V153-D155 PolarHBondContact O-N 3.29Å; V153-D155 VanDerWaalsContact O-N 3.12Å
156	E	71.5	Confident	75.1	Confident	158 Å²	158	57.4 Å²	57.4	74%	0.738	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-25	179.7	-64.8	-176	173.7	0	0	112.3	V153 V154	V153-E156 PolarHBondContact O-N 3.46Å; V154-E156 VanDerWaalsContact C-N 3.32Å
157	E	67.3	Low	75.1	Confident	45 Å²	45	57.5 Å²	57.5	21%	0.21	32%	0.32	C	S	.	.	S	Bend	trans	-74.1	129.9	-179.1	-73.3	-175.1	160.4	0	0	112.8	V153 G159 G160 T162	V153-E157 HydrophobicContact CG1-CG 3.92Å; V153-E157 PolarHBondContact O-N 3.08Å; V153-E157 VanDerWaalsContact O-N 3.14Å; E157-G159 PolarHBondContact O-N 3.26Å; E157-G160 PolarHBondContact O-N 3.48Å; E157-T162 WeakPolarHBondContact OE2-CA 3.44Å; E157-T162 WeakPolarHBondContact OE2-CG2 3.45Å; E157-T162 PolarHBondContact OE2-N 2.93Å
158	F	65.4	Low	75.2	Confident	113 Å²	113	57.2 Å²	57.2	50%	0.496	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-62.4	122.9	-179.8	-68	-76	0	0	0	111.8	G160 Q163 N559	F158-G160 VanDerWaalsContact C-N 3.27Å; F158-Q163 PolarHBondContact O-NE2 2.68Å; F158-N559 HydrophobicContact CB-CB 3.83Å; F158-N559 HydrophobicContact CD1-CB 4.23Å; F158-N559 WeakPolarHBondContact CD1-ND2 3.33Å; F158-N559 HydrophobicContact CD2-CB 4.23Å; F158-N559 WeakPolarHBondContact CE1-ND2 3.43Å; F158-N559 HydrophobicContact CG-CB 3.85Å
159	G	66.2	Low	75.2	Confident	57 Å²	57	58.7 Å²	58.7	59%	0.588	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	78.5	6.9	-178.2	0	0	0	0	0	114.3	E157 I161	E157-G159 PolarHBondContact O-N 3.26Å; G159-I161 PolarHBondContact O-N 2.98Å
160	G	71	Confident	75.4	Confident	45 Å²	45	54.8 Å²	54.8	46%	0.464	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	64.9	23.7	-178.1	0	0	0	0	0	113.4	E157 F158	E157-G160 PolarHBondContact O-N 3.48Å; F158-G160 VanDerWaalsContact C-N 3.27Å
161	I	77.1	Confident	75.7	Confident	46 Å²	46	53.1 Å²	53.1	24%	0.236	30%	0.3	C	S	.	.			trans	-123.2	134.1	-178.1	54.2	166.2	0	0	0	111	G159 Q163 I560 Y562	G159-I161 PolarHBondContact O-N 2.98Å; I161-Q163 HydrophobicContact CD1-CG 4Å; I161-Q163 HydrophobicContact CG1-CG 4.03Å; I161-Q163 PolarHBondContact O-N 3.28Å; I161-I560 HydrophobicContact CD1-CG2 4.16Å; I161-Y562 HydrophobicContact CD1-CE2 4.31Å
162	T	81.2	Confident	75.6	Confident	14 Å²	14	51.6 Å²	51.6	9%	0.086	29%	0.289	C	S	.	.			trans	-71.4	117.3	170.5	51.9	0	0	0	0	109.3	T142 E157 P199	T142-T162 HydrophobicContact CG2-CG2 3.39Å; T142-T162 WeakPolarHBondContact OG1-CG2 3.49Å; E157-T162 WeakPolarHBondContact OE2-CA 3.44Å; E157-T162 WeakPolarHBondContact OE2-CG2 3.45Å; E157-T162 PolarHBondContact OE2-N 2.93Å; T162-P199 WeakPolarHBondContact O-CB 3.49Å
163	Q	80.7	Confident	75.3	Confident	10 Å²	10	44.8 Å²	44.8	5%	0.047	27%	0.27	C	S	.	.			trans	-109.7	-18.1	179.4	-60.7	177.3	22	0	0	112.9	F158 I161 F204 N559	F158-Q163 PolarHBondContact O-NE2 2.68Å; I161-Q163 HydrophobicContact CD1-CG 4Å; I161-Q163 HydrophobicContact CG1-CG 4.03Å; I161-Q163 PolarHBondContact O-N 3.28Å; Q163-F204 HydrophobicContact CB-CZ 4.34Å; Q163-F204 WeakPolarHBondContact O-CE1 3.46Å; Q163-N559 PolarHBondContact NE2-O 3.08Å; Q163-N559 PolarHBondContact OE1-O 2.93Å; Q163-N559 VanDerWaalsContact OE1-O 3.12Å
164	H	82.6	Confident	74.5	Confident	48 Å²	48	46.1 Å²	46.1	22%	0.222	28%	0.281	C	S	.	.	S	Bend	trans	-112.2	150.5	-177.6	-55.4	-50.3	0	0	0	111	G166 D486	H164-G166 PolarHBondContact O-N 3.41Å; H164-G166 VanDerWaalsContact O-N 3.15Å; H164-D486 VanDerWaalsContact CE1-CG 3.47Å; H164-D486 IonicContact CE1-OD1 2.67Å; H164-D486 PolarHBondContact CE1-OD1 3.01Å; H164-D486 IonicContact CE1-OD2 3.81Å; H164-D486 PolarHBondContact CE1-OD2 3.23Å; H164-D486 IonicContact ND1-OD2 3.45Å; H164-D486 IonicContact NE2-OD2 3.09Å; H164-D486 PolarHBondContact NE2-OD2 2.69Å
165	L	85.1	Confident	74	Confident	6 Å²	6	45.8 Å²	45.8	3%	0.031	28%	0.279	C	S	.	.			trans	-77.8	97.1	171.6	177.3	64.6	0	0	0	109.4	L196 D197 T198 I207 L323 E324	L165-L196 HydrophobicContact CD1-CB 4.25Å; L165-D197 WeakPolarHBondContact CD1-O 3.46Å; L165-T198 HydrophobicContact CD1-CG2 4.03Å; L165-I207 HydrophobicContact CB-CG2 3.85Å; L165-I207 HydrophobicContact CD1-CG2 4.22Å; L165-I207 HydrophobicContact CD2-CG2 4.2Å; L165-I207 HydrophobicContact CG-CG2 4.31Å; L165-L323 HydrophobicContact CD2-CB 4.02Å; L165-L323 HydrophobicContact CD2-CD2 4.35Å; L165-E324 HydrophobicContact CB-CG 3.87Å; L165-E324 WeakPolarHBondContact CB-OE1 3.22Å; L165-E324 HydrophobicContact CD2-CG 4.42Å; L165-E324 PolarHBondContact N-OE1 3.02Å
166	G	83.1	Confident	73.3	Confident	29 Å²	29	43.4 Å²	43.4	30%	0.299	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	145	172.6	0	0	0	0	0	111.6	H164 L196 D197	H164-G166 PolarHBondContact O-N 3.41Å; H164-G166 VanDerWaalsContact O-N 3.15Å; G166-L196 CarbonylContact O-C 3.42Å; G166-L196 WeakPolarHBondContact O-CA 3.5Å; G166-D197 PolarHBondContact N-O 2.95Å; G166-D197 PolarHBondContact O-N 2.8Å
167	A	86.9	Confident	72.2	Confident	16 Å²	16	44.9 Å²	44.9	13%	0.132	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	133	169.2	0	0	0	0	0	110	F195 L196 L323 V381	A167-F195 WeakPolarHBondContact CA-O 3.42Å; A167-L196 HydrophobicContact CB-CD2 3.4Å; A167-L196 VanDerWaalsContact CB-CD2 3.4Å; A167-L323 HydrophobicContact CB-CD1 3.76Å; A167-V381 HydrophobicContact CB-CB 4.28Å; A167-V381 HydrophobicContact CB-CG1 4.02Å; A167-V381 HydrophobicContact CB-CG2 3.85Å
168	F	86.2	Confident	71.2	Confident	10 Å²	10	48.6 Å²	48.6	4%	0.044	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	153.4	-176.4	62.6	-89.5	0	0	0	111.3	L145 R149 V170 T194 F195 D368	L145-F168 HydrophobicContact CB-CE1 3.97Å; L145-F168 HydrophobicContact CB-CZ 3.64Å; L145-F168 HydrophobicContact CD1-CE1 4.05Å; L145-F168 HydrophobicContact CD1-CZ 4.3Å; L145-F168 HydrophobicContact CD2-CE1 3.92Å; L145-F168 HydrophobicContact CD2-CE2 4.46Å; L145-F168 HydrophobicContact CD2-CZ 3.38Å; L145-F168 HydrophobicContact CG-CE1 4.16Å; L145-F168 HydrophobicContact CG-CZ 3.9Å; R149-F168 HydrophobicContact CG-CD2 3.51Å; R149-F168 HydrophobicContact CG-CE1 4.43Å; R149-F168 HydrophobicContact CG-CE2 3.37Å; R149-F168 HydrophobicContact CG-CG 4.09Å; R149-F168 HydrophobicContact CG-CZ 3.84Å; F168-V170 HydrophobicContact CD2-CG2 3.68Å; F168-V170 HydrophobicContact CE2-CG2 3.47Å; F168-V170 VanDerWaalsContact CE2-CG2 3.47Å; F168-T194 WeakPolarHBondContact O-CA 3.34Å; F168-F195 HydrophobicContact CD1-CB 4.29Å; F168-F195 HydrophobicContact CD2-CB 4.23Å; F168-F195 HydrophobicContact CD2-CD2 4.46Å; F168-F195 HydrophobicContact CE1-CB 3.75Å; F168-F195 HydrophobicContact CE2-CB 3.69Å; F168-F195 AromaticContact CE2-CD2 3.74Å; F168-F195 HydrophobicContact CE2-CD2 3.74Å; F168-F195 HydrophobicContact CE2-CG 4.04Å; F168-F195 HydrophobicContact CZ-CB 3.45Å; F168-F195 VanDerWaalsContact CZ-CB 3.45Å; F168-F195 HydrophobicContact CZ-CD2 4.18Å; F168-F195 HydrophobicContact CZ-CG 4.03Å; F168-F195 PolarHBondContact N-O 3.43Å; F168-F195 PolarHBondContact O-N 2.99Å; F168-D368 WeakPolarHBondContact CA-OD2 3.41Å
169	T	84.8	Confident	70.4	Confident	41 Å²	41	46.4 Å²	46.4	25%	0.252	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	124.1	-179.7	-46.2	0	0	0	0	110.7	D368 F380	T169-D368 PolarHBondContact N-OD2 3.24Å; T169-D368 VanDerWaalsContact N-OD2 3.11Å; T169-F380 HydrophobicContact CG2-CD1 3.91Å; T169-F380 HydrophobicContact CG2-CE1 3.76Å
170	V	82.5	Confident	69.2	Low	11 Å²	11	47 Å²	47	7%	0.067	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	128.5	174.2	-179.1	0	0	0	0	109	L148 F168 V175 S192 I193 F195	L148-V170 HydrophobicContact CB-CG2 4.43Å; F168-V170 HydrophobicContact CD2-CG2 3.68Å; F168-V170 HydrophobicContact CE2-CG2 3.47Å; F168-V170 VanDerWaalsContact CE2-CG2 3.47Å; V170-V175 HydrophobicContact CG1-CG2 3.89Å; V170-S192 CarbonylContact O-C 3.56Å; V170-S192 VanDerWaalsContact O-CA 3.28Å; V170-S192 WeakPolarHBondContact O-CA 3.43Å; V170-I193 PolarHBondContact N-O 2.83Å; V170-I193 PolarHBondContact O-N 3.31Å; V170-F195 HydrophobicContact CB-CD2 4.3Å; V170-F195 HydrophobicContact CB-CE2 4.13Å; V170-F195 HydrophobicContact CG2-CD2 3.79Å; V170-F195 HydrophobicContact CG2-CE2 3.95Å
171	S	76.4	Confident	68	Low	52 Å²	52	48.4 Å²	48.4	36%	0.364	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	122.9	168.4	56	0	0	0	0	109.5	S173 S174	S171-S173 PolarHBondContact O-N 3.37Å; S171-S174 WeakPolarHBondContact O-CB 3.49Å; S171-S174 PolarHBondContact O-N 2.84Å; S171-S174 PolarHBondContact O-OG 2.99Å; S171-S174 PolarHBondContact OG-OG 2.92Å
172	L	67.8	Low	65.8	Low	5 Å²	5	52.8 Å²	52.8	3%	0.026	33%	0.325	C	S	.	.	H	α-helix	trans	-62	-28.8	-174.7	-61.1	168.1	0	0	0	112.6	S174 V175 E176 K191 I193 L298 I302	L172-S174 PolarHBondContact O-N 2.87Å; L172-V175 PolarHBondContact O-N 3.26Å; L172-E176 PolarHBondContact O-N 2.98Å; L172-K191 HydrophobicContact CB-CB 4.1Å; L172-K191 HydrophobicContact CB-CD 4.25Å; L172-K191 HydrophobicContact CD1-CB 3.79Å; L172-K191 HydrophobicContact CD1-CD 4.2Å; L172-K191 HydrophobicContact CD1-CG 3.85Å; L172-K191 HydrophobicContact CG-CB 4.32Å; L172-K191 WeakPolarHBondContact CG-O 3.28Å; L172-K191 PolarHBondContact N-O 2.92Å; L172-I193 HydrophobicContact CD2-CD1 4.11Å; L172-L298 HydrophobicContact CD2-CB 3.96Å; L172-L298 HydrophobicContact CD2-CD1 3.78Å; L172-L298 HydrophobicContact CD2-CD2 4Å; L172-L298 HydrophobicContact CD2-CG 4.13Å; L172-I302 HydrophobicContact CD1-CD1 3.19Å; L172-I302 HydrophobicContact CD1-CG1 4.03Å; L172-I302 HydrophobicContact CD2-CD1 4.23Å; L172-I302 HydrophobicContact CG-CD1 4.34Å
173	S	58.7	Low	63.9	Low	48 Å²	48	59.2 Å²	59.2	34%	0.336	36%	0.359	S	S	.	.	H	α-helix	trans	-58.7	-22	175.7	74.6	0	0	0	0	113.7	S171 R177	S171-S173 PolarHBondContact O-N 3.37Å; S173-R177 WeakPolarHBondContact O-CG 3.34Å; S173-R177 PolarHBondContact O-NE 3.1Å; S173-R177 VanDerWaalsContact O-NE 3.08Å
174	S	55.9	Low	61.9	Low	53 Å²	53	64.3 Å²	64.3	37%	0.371	39%	0.392	S	S	.	.	H	α-helix	trans	-82.5	-33.3	176.9	-51.4	0	0	0	0	111.5	S171 L172 N178	S171-S174 WeakPolarHBondContact O-CB 3.49Å; S171-S174 PolarHBondContact O-N 2.84Å; S171-S174 PolarHBondContact O-OG 2.99Å; S171-S174 PolarHBondContact OG-OG 2.92Å; L172-S174 PolarHBondContact O-N 2.87Å; S174-N178 PolarHBondContact O-ND2 2.98Å
175	V	55.6	Low	59.8	Low	32 Å²	32	69.2 Å²	69.2	19%	0.194	42%	0.42	C	S	.	.	H	α-helix	trans	-79.2	-43.3	179.5	-174.9	0	0	0	0	110.3	V170 L172 R177 N178 A179 L298	V170-V175 HydrophobicContact CG1-CG2 3.89Å; L172-V175 PolarHBondContact O-N 3.26Å; V175-R177 VanDerWaalsContact C-N 3.29Å; V175-R177 PolarHBondContact O-N 3.49Å; V175-N178 PolarHBondContact O-N 3.42Å; V175-A179 PolarHBondContact O-N 3.1Å; V175-L298 HydrophobicContact CB-CD1 4.42Å; V175-L298 HydrophobicContact CG1-CD1 4Å; V175-L298 HydrophobicContact CG2-CD1 4.44Å
176	E	52.9	Low	57.6	Low	73 Å²	73	74.1 Å²	74.1	34%	0.341	45%	0.453	S	S	.	.	H	α-helix	trans	-60.2	-37	177.1	-71.4	173.8	176.7	0	0	112	L172 N178 A179 G180 K191	L172-E176 PolarHBondContact O-N 2.98Å; E176-N178 VanDerWaalsContact C-N 3.3Å; E176-N178 PolarHBondContact O-N 3.26Å; E176-A179 PolarHBondContact O-N 2.99Å; E176-G180 PolarHBondContact O-N 3.27Å; E176-K191 IonicContact OE1-NZ 2.67Å; E176-K191 PolarHBondContact OE1-NZ 3.27Å; E176-K191 IonicContact OE2-NZ 2.72Å; E176-K191 PolarHBondContact OE2-NZ 3.32Å
177	R	47.9	Very low	55.4	Low	188 Å²	188	79.1 Å²	79.1	71%	0.709	48%	0.477	S	S	*	.	H	α-helix	trans	-65	-30.7	174.6	-80.4	-175.9	-118.3	163.2	-1.2	113.7	S173 V175	S173-R177 WeakPolarHBondContact O-CG 3.34Å; S173-R177 PolarHBondContact O-NE 3.1Å; S173-R177 VanDerWaalsContact O-NE 3.08Å; V175-R177 VanDerWaalsContact C-N 3.29Å; V175-R177 PolarHBondContact O-N 3.49Å
178	N	48.1	Very low	53	Low	124 Å²	124	82.5 Å²	82.5	66%	0.663	50%	0.499	S	S	*	.	H	α-helix	trans	-85.5	-17.9	177.8	-68.8	-27.9	0	0	0	112.4	S174 V175 E176	S174-N178 PolarHBondContact O-ND2 2.98Å; V175-N178 PolarHBondContact O-N 3.42Å; E176-N178 VanDerWaalsContact C-N 3.3Å; E176-N178 PolarHBondContact O-N 3.26Å
179	A	48.4	Very low	51	Low	66 Å²	66	90.1 Å²	90.1	55%	0.545	53%	0.533	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-1	179.6	0	0	0	0	0	114.3	V175 E176 S181	V175-A179 PolarHBondContact O-N 3.1Å; E176-A179 PolarHBondContact O-N 2.99Å; A179-S181 VanDerWaalsContact C-N 3.34Å; A179-S181 PolarHBondContact O-N 2.69Å
180	G	39.4	Very low	49.5	Very low	69 Å²	69	91.5 Å²	91.5	71%	0.711	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.9	6	166.3	0	0	0	0	0	116.8	E176	E176-G180 PolarHBondContact O-N 3.27Å
181	S	46.8	Very low	48.7	Very low	76 Å²	76	95.2 Å²	95.2	53%	0.531	56%	0.559	S	S	.	*			trans	-95.4	106.7	175.5	55	0	0	0	0	111.4	A179 D183	A179-S181 VanDerWaalsContact C-N 3.34Å; A179-S181 PolarHBondContact O-N 2.69Å; S181-D183 PolarHBondContact O-N 3.41Å
182	T	30.8	Very low	49	Very low	138 Å²	138	93.6 Å²	93.6	85%	0.847	55%	0.548	S	S	*	.			trans	-83.8	89.1	171	38.3	0	0	0	0	110.9
183	D	41	Very low	50	Low	149 Å²	149	93.4 Å²	93.4	80%	0.797	55%	0.547	S	S	*	.			trans	-99.8	130.5	158.6	-79.9	-25.2	0	0	0	109.9	S181 N185	S181-D183 PolarHBondContact O-N 3.41Å; D183-N185 PolarHBondContact O-N 3.05Å
184	P	39.4	Very low	51.5	Low	116 Å²	116	91.1 Å²	91.1	75%	0.753	53%	0.531	S	S	*	.			trans	-93.7	26.3	-164.3	38.8	-37.8	0	0	0	114.2	P186	P184-P186 VanDerWaalsContact O-CD 3.22Å; P184-P186 WeakPolarHBondContact O-CD 3.38Å
185	N	39.1	Very low	53.3	Low	151 Å²	151	88.6 Å²	88.6	81%	0.807	51%	0.514	S	S	*	.			trans	-91.7	110.5	178.5	-79.8	-16.8	0	0	0	111.7	D183 V187	D183-N185 PolarHBondContact O-N 3.05Å; N185-V187 PolarHBondContact O-N 3.38Å
186	P	37.7	Very low	55	Low	110 Å²	110	87.1 Å²	87.1	71%	0.714	50%	0.504	S	S	*	.			trans	-80.7	117.3	-178.8	31.6	-31.4	0	0	0	112.3	P184	P184-P186 VanDerWaalsContact O-CD 3.22Å; P184-P186 WeakPolarHBondContact O-CD 3.38Å
187	V	37	Very low	56.8	Low	133 Å²	133	84 Å²	84	81%	0.806	49%	0.49	S	S	*	.			trans	60.7	89.1	132.2	-161.6	0	0	0	0	117.4	N185	N185-V187 PolarHBondContact O-N 3.38Å
188	S	37.7	Very low	58.7	Low	87 Å²	87	75.1 Å²	75.1	61%	0.608	46%	0.457	S	S	*	.			trans	-94	152.3	147.1	-65.5	0	0	0	0	109	S190	S188-S190 WeakPolarHBondContact CB-OG 3.1Å; S188-S190 PolarHBondContact O-N 3.37Å
189	F	44.1	Very low	60.5	Low	170 Å²	170	69.2 Å²	69.2	75%	0.746	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	-6.4	176.4	-112.2	-96.1	0	0	0	114.6	K191	F189-K191 VanDerWaalsContact C-N 3.31Å; F189-K191 PolarHBondContact O-N 3.44Å
190	S	53.3	Low	62	Low	70 Å²	70	66.4 Å²	66.4	49%	0.49	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75	2.8	-172.4	56	0	0	0	0	116.5	S188	S188-S190 WeakPolarHBondContact CB-OG 3.1Å; S188-S190 PolarHBondContact O-N 3.37Å
191	K	65.6	Low	64	Low	89 Å²	89	64 Å²	64	39%	0.387	37%	0.372	S	S	.	.			trans	-113.3	30.8	-168.8	-74.9	-154.3	-179.4	-168.4	0	115.8	L172 E176 F189	L172-K191 HydrophobicContact CB-CB 4.1Å; L172-K191 HydrophobicContact CB-CD 4.25Å; L172-K191 HydrophobicContact CD1-CB 3.79Å; L172-K191 HydrophobicContact CD1-CD 4.2Å; L172-K191 HydrophobicContact CD1-CG 3.85Å; L172-K191 HydrophobicContact CG-CB 4.32Å; L172-K191 WeakPolarHBondContact CG-O 3.28Å; L172-K191 PolarHBondContact N-O 2.92Å; E176-K191 IonicContact OE1-NZ 2.67Å; E176-K191 PolarHBondContact OE1-NZ 3.27Å; E176-K191 IonicContact OE2-NZ 2.72Å; E176-K191 PolarHBondContact OE2-NZ 3.32Å; F189-K191 VanDerWaalsContact C-N 3.31Å; F189-K191 PolarHBondContact O-N 3.44Å
192	S	81.2	Confident	65.6	Low	18 Å²	18	61.1 Å²	61.1	13%	0.126	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	140.2	169.1	57.5	0	0	0	0	111.5	P128 V170	P128-S192 WeakPolarHBondContact CB-O 3.42Å; V170-S192 CarbonylContact O-C 3.56Å; V170-S192 VanDerWaalsContact O-CA 3.28Å; V170-S192 WeakPolarHBondContact O-CA 3.43Å
193	I	89.3	Confident	68.1	Low	2 Å²	2	54.7 Å²	54.7	1%	0.01	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	132.6	179.3	-56.4	174.9	0	0	0	107.9	P129 V131 V170 L172 F195 L298 I301 I302	P129-I193 HydrophobicContact CG-CG1 4.09Å; P129-I193 HydrophobicContact CG-CG2 4.36Å; V131-I193 HydrophobicContact CB-CG2 4.37Å; V131-I193 HydrophobicContact CG2-CG2 3.67Å; V170-I193 PolarHBondContact N-O 2.83Å; V170-I193 PolarHBondContact O-N 3.31Å; L172-I193 HydrophobicContact CD2-CD1 4.11Å; I193-F195 HydrophobicContact CB-CD2 4.49Å; I193-F195 HydrophobicContact CB-CE2 3.91Å; I193-F195 HydrophobicContact CB-CZ 4.28Å; I193-F195 HydrophobicContact CG2-CD2 4.06Å; I193-F195 HydrophobicContact CG2-CE1 4.12Å; I193-F195 HydrophobicContact CG2-CE2 3.61Å; I193-F195 HydrophobicContact CG2-CG 4.5Å; I193-F195 HydrophobicContact CG2-CZ 3.64Å; I193-L298 HydrophobicContact CD1-CD2 3.88Å; I193-I301 HydrophobicContact CD1-CG2 4Å; I193-I301 HydrophobicContact CG2-CG2 4.46Å; I193-I302 HydrophobicContact CD1-CG1 4.09Å
194	T	90.8	Very high	70.3	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	117.6	174.9	-58.9	0	0	0	0	108.6	P129 I130 V131 F168 G379 V381	P129-T194 PolarHBondContact O-N 2.82Å; I130-T194 CarbonylContact C-O 3.51Å; I130-T194 WeakPolarHBondContact CA-O 3.42Å; I130-T194 HydrophobicContact CG2-CG2 4.49Å; V131-T194 PolarHBondContact N-O 3.42Å; F168-T194 WeakPolarHBondContact O-CA 3.34Å; T194-G379 WeakPolarHBondContact CB-O 3.32Å; T194-G379 PolarHBondContact OG1-O 3.08Å; T194-V381 HydrophobicContact CG2-CG2 3.87Å
195	F	92.7	Very high	72.5	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	139.2	177.7	-71.1	-80.6	0	0	0	110.9	V131 V133 L145 L148 A167 F168 V170 I193 L298 I301	V131-F195 HydrophobicContact CB-CD1 3.89Å; V131-F195 HydrophobicContact CB-CE1 4.02Å; V131-F195 HydrophobicContact CG1-CD1 4.06Å; V131-F195 HydrophobicContact CG1-CE1 3.98Å; V131-F195 HydrophobicContact CG2-CE1 4.49Å; V131-F195 CarbonylContact O-C 3.35Å; V131-F195 WeakPolarHBondContact O-CA 3.34Å; V133-F195 HydrophobicContact CG2-CD1 3.96Å; L145-F195 HydrophobicContact CD2-CB 4.09Å; L145-F195 HydrophobicContact CD2-CD1 4.08Å; L145-F195 HydrophobicContact CD2-CG 4.12Å; L148-F195 HydrophobicContact CD1-CE1 4.19Å; L148-F195 HydrophobicContact CD1-CE2 3.91Å; L148-F195 HydrophobicContact CD1-CZ 3.72Å; A167-F195 WeakPolarHBondContact CA-O 3.42Å; F168-F195 HydrophobicContact CD1-CB 4.29Å; F168-F195 HydrophobicContact CD2-CB 4.23Å; F168-F195 HydrophobicContact CD2-CD2 4.46Å; F168-F195 HydrophobicContact CE1-CB 3.75Å; F168-F195 HydrophobicContact CE2-CB 3.69Å; F168-F195 AromaticContact CE2-CD2 3.74Å; F168-F195 HydrophobicContact CE2-CD2 3.74Å; F168-F195 HydrophobicContact CE2-CG 4.04Å; F168-F195 HydrophobicContact CZ-CB 3.45Å; F168-F195 VanDerWaalsContact CZ-CB 3.45Å; F168-F195 HydrophobicContact CZ-CD2 4.18Å; F168-F195 HydrophobicContact CZ-CG 4.03Å; F168-F195 PolarHBondContact N-O 3.43Å; F168-F195 PolarHBondContact O-N 2.99Å; V170-F195 HydrophobicContact CB-CD2 4.3Å; V170-F195 HydrophobicContact CB-CE2 4.13Å; V170-F195 HydrophobicContact CG2-CD2 3.79Å; V170-F195 HydrophobicContact CG2-CE2 3.95Å; I193-F195 HydrophobicContact CB-CD2 4.49Å; I193-F195 HydrophobicContact CB-CE2 3.91Å; I193-F195 HydrophobicContact CB-CZ 4.28Å; I193-F195 HydrophobicContact CG2-CD2 4.06Å; I193-F195 HydrophobicContact CG2-CE1 4.12Å; I193-F195 HydrophobicContact CG2-CE2 3.61Å; I193-F195 HydrophobicContact CG2-CG 4.5Å; I193-F195 HydrophobicContact CG2-CZ 3.64Å; F195-L298 HydrophobicContact CE2-CD2 4.39Å; F195-L298 HydrophobicContact CZ-CD2 3.97Å; F195-I301 HydrophobicContact CE1-CD1 4.16Å; F195-I301 HydrophobicContact CZ-CD1 4.32Å
196	L	92.2	Very high	74.8	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	119.2	167.6	-54.2	-171.4	0	0	0	109.3	I130 V131 V133 L165 G166 A167 T215 L323	I130-L196 HydrophobicContact CG2-CD1 4.35Å; I130-L196 HydrophobicContact CG2-CG 4.23Å; V131-L196 PolarHBondContact O-N 2.85Å; V133-L196 PolarHBondContact N-O 3.26Å; L165-L196 HydrophobicContact CD1-CB 4.25Å; G166-L196 CarbonylContact O-C 3.42Å; G166-L196 WeakPolarHBondContact O-CA 3.5Å; A167-L196 HydrophobicContact CB-CD2 3.4Å; A167-L196 VanDerWaalsContact CB-CD2 3.4Å; L196-T215 HydrophobicContact CD1-CG2 3.36Å; L196-T215 HydrophobicContact CG-CG2 3.95Å; L196-L323 HydrophobicContact CD1-CD2 4.17Å; L196-L323 HydrophobicContact CD2-CD1 3.76Å
197	D	89.7	Confident	77.3	Confident	9 Å²	9	33.1 Å²	33.1	5%	0.048	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	121.8	176.6	-165.9	0.2	0	0	0	110.3	L145 L165 G166	L145-D197 HydrophobicContact CD1-CB 3.55Å; L145-D197 VanDerWaalsContact CD1-OD1 3.24Å; L145-D197 WeakPolarHBondContact CD1-OD1 3.38Å; L165-D197 WeakPolarHBondContact CD1-O 3.46Å; G166-D197 PolarHBondContact N-O 2.95Å; G166-D197 PolarHBondContact O-N 2.8Å
198	T	88.4	Confident	79.9	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	16%	0.16	C	C	.	.			trans	-118.7	135	-174.7	74.6	0	0	0	0	112.7	V133 L134 K141 L165 G200 S211	V133-T198 PolarHBondContact O-OG1 2.86Å; L134-T198 HydrophobicContact CD2-CG2 4.18Å; L134-T198 WeakPolarHBondContact CD2-OG1 3.45Å; K141-T198 PolarHBondContact NZ-O 2.97Å; K141-T198 VanDerWaalsContact NZ-O 3.13Å; L165-T198 HydrophobicContact CD1-CG2 4.03Å; T198-G200 PolarHBondContact O-N 3.15Å; T198-S211 VanDerWaalsContact CG2-OG 3.28Å; T198-S211 WeakPolarHBondContact CG2-OG 3.37Å
199	P	87.1	Confident	82.4	Confident	1 Å²	1	26.5 Å²	26.5	1%	0.006	15%	0.147	C	C	.	.			trans	-61.8	137.6	176.2	25.8	-35.8	0	0	0	112	T162 F204 I207 R208	T162-P199 WeakPolarHBondContact O-CB 3.49Å; P199-F204 HydrophobicContact CB-CB 3.86Å; P199-F204 HydrophobicContact CB-CD1 4.39Å; P199-F204 HydrophobicContact CB-CD2 3.61Å; P199-F204 HydrophobicContact CB-CE2 4.2Å; P199-F204 HydrophobicContact CB-CG 3.71Å; P199-F204 HydrophobicContact CG-CB 3.33Å; P199-F204 HydrophobicContact CG-CD1 4.01Å; P199-F204 HydrophobicContact CG-CD2 4Å; P199-F204 HydrophobicContact CG-CG 3.53Å; P199-I207 HydrophobicContact CG-CB 4.33Å; P199-I207 HydrophobicContact CG-CD1 4.24Å; P199-I207 HydrophobicContact CG-CG2 4.18Å; P199-R208 PolarHBondContact O-NH1 3.03Å
200	G	79.8	Confident	84.6	Confident	6 Å²	6	20.4 Å²	20.4	6%	0.062	12%	0.119	C	C	.	.			trans	-76.1	-34.6	178.5	0	0	0	0	0	114.1	T198 R208 Q231	T198-G200 PolarHBondContact O-N 3.15Å; G200-R208 PolarHBondContact O-NH1 3.35Å; G200-R208 VanDerWaalsContact O-NH1 3.13Å; G200-Q231 PolarHBondContact O-NE2 3.16Å; G200-Q231 PolarHBondContact O-OE1 3.26Å
201	H	81.4	Confident	86.4	Confident	18 Å²	18	17 Å²	17	8%	0.083	10%	0.096	C	C	.	.	S	Bend	trans	-65.4	139.7	-170.3	177.9	31.1	0	0	0	113.3	V137 A203 F204 R208 Y562	V137-H201 HydrophobicContact CG2-CB 4.27Å; H201-A203 PolarHBondContact O-N 3.21Å; H201-A203 VanDerWaalsContact O-N 3.09Å; H201-F204 HydrophobicContact CB-CD2 3.99Å; H201-F204 HydrophobicContact CB-CE2 4.23Å; H201-F204 PolarHBondContact O-N 3.48Å; H201-R208 PolarHBondContact O-NH1 3.34Å; H201-Y562 AromaticContact CD2-CE1 3.42Å; H201-Y562 VanDerWaalsContact CD2-CE1 3.42Å; H201-Y562 WeakPolarHBondContact CD2-CE1 3.34Å; H201-Y562 AromaticContact CD2-CZ 3.16Å; H201-Y562 PolarHBondContact CD2-OH 3.14Å; H201-Y562 AromaticContact CE1-CE1 3.49Å; H201-Y562 VanDerWaalsContact CE1-CE1 3.49Å; H201-Y562 WeakPolarHBondContact CE1-CE1 3.45Å; H201-Y562 AromaticContact CE1-CZ 3.82Å; H201-Y562 PolarHBondContact CE1-OH 3.49Å; H201-Y562 AromaticContact CG-CZ 3.71Å; H201-Y562 PolarHBondContact ND1-OH 2.93Å; H201-Y562 AromaticContact NE2-CD1 3.88Å; H201-Y562 AromaticContact NE2-CE1 2.95Å; H201-Y562 WeakPolarHBondContact NE2-CE1 3.45Å; H201-Y562 AromaticContact NE2-CZ 3.28Å; H201-Y562 VanDerWaalsContact NE2-CZ 3.28Å; H201-Y562 PolarHBondContact NE2-OH 3.23Å
202	A	79.7	Confident	87.6	Confident	17 Å²	17	12.8 Å²	12.8	14%	0.14	8%	0.077	C	C	.	.	G	3₁₀ helix	trans	-52.3	-29.2	-178.3	0	0	0	0	0	115	F204 S205 I758	A202-F204 PolarHBondContact O-N 3.38Å; A202-F204 VanDerWaalsContact O-N 3.12Å; A202-S205 PolarHBondContact O-N 2.86Å; A202-I758 HydrophobicContact CB-CB 4.08Å; A202-I758 HydrophobicContact CB-CD1 4.06Å; A202-I758 HydrophobicContact CB-CG2 3.54Å
203	A	82.3	Confident	88	Confident	2 Å²	2	19.4 Å²	19.4	2%	0.017	10%	0.104	C	C	.	.	G	3₁₀ helix	trans	-59.5	-22.4	175.2	0	0	0	0	0	113.7	H201 L497 I561	H201-A203 PolarHBondContact O-N 3.21Å; H201-A203 VanDerWaalsContact O-N 3.09Å; A203-L497 HydrophobicContact CB-CB 4.45Å; A203-L497 HydrophobicContact CB-CD1 4.1Å; A203-I561 HydrophobicContact CB-CD1 4.44Å
204	F	87.3	Confident	88.1	Confident	4 Å²	4	20 Å²	20	2%	0.018	11%	0.109	C	C	.	.	G	3₁₀ helix	trans	-100.9	25.8	-178.1	-56.4	-80.9	0	0	0	113.7	Q163 P199 H201 A202 G206 I207 R208 A493 I561	Q163-F204 HydrophobicContact CB-CZ 4.34Å; Q163-F204 WeakPolarHBondContact O-CE1 3.46Å; P199-F204 HydrophobicContact CB-CB 3.86Å; P199-F204 HydrophobicContact CB-CD1 4.39Å; P199-F204 HydrophobicContact CB-CD2 3.61Å; P199-F204 HydrophobicContact CB-CE2 4.2Å; P199-F204 HydrophobicContact CB-CG 3.71Å; P199-F204 HydrophobicContact CG-CB 3.33Å; P199-F204 HydrophobicContact CG-CD1 4.01Å; P199-F204 HydrophobicContact CG-CD2 4Å; P199-F204 HydrophobicContact CG-CG 3.53Å; H201-F204 HydrophobicContact CB-CD2 3.99Å; H201-F204 HydrophobicContact CB-CE2 4.23Å; H201-F204 PolarHBondContact O-N 3.48Å; A202-F204 PolarHBondContact O-N 3.38Å; A202-F204 VanDerWaalsContact O-N 3.12Å; F204-G206 VanDerWaalsContact C-N 3.26Å; F204-G206 PolarHBondContact O-N 3.38Å; F204-I207 HydrophobicContact CB-CB 4.37Å; F204-I207 HydrophobicContact CB-CD1 4.31Å; F204-I207 HydrophobicContact CB-CG1 4.48Å; F204-I207 HydrophobicContact CD1-CD1 3.61Å; F204-I207 HydrophobicContact CD1-CG1 4.49Å; F204-I207 HydrophobicContact CE1-CD1 4.41Å; F204-I207 HydrophobicContact CG-CD1 4.39Å; F204-I207 WeakPolarHBondContact O-CB 3.22Å; F204-I207 PolarHBondContact O-N 3.25Å; F204-R208 PolarHBondContact O-N 3.43Å; F204-R208 VanDerWaalsContact O-N 3.13Å; F204-A493 HydrophobicContact CD1-CB 3.39Å; F204-A493 HydrophobicContact CE1-CB 3.51Å; F204-A493 HydrophobicContact CG-CB 4.24Å; F204-A493 HydrophobicContact CZ-CB 4.41Å; F204-I561 HydrophobicContact CE2-CG2 4.5Å; F204-I561 HydrophobicContact CZ-CD1 4.2Å; F204-I561 HydrophobicContact CZ-CG2 4.44Å
205	S	86.5	Confident	88.2	Confident	30 Å²	30	20.5 Å²	20.5	21%	0.21	11%	0.112	C	C	.	.	H	α-helix	trans	-52	-43.2	176	58.2	0	0	0	0	112.8	A202 I207 R208 F209 E234	A202-S205 PolarHBondContact O-N 2.86Å; S205-I207 VanDerWaalsContact C-N 3.29Å; S205-I207 PolarHBondContact O-N 3.27Å; S205-R208 PolarHBondContact O-N 2.9Å; S205-F209 PolarHBondContact O-N 3.42Å; S205-E234 VanDerWaalsContact CB-OE1 3.28Å; S205-E234 WeakPolarHBondContact CB-OE1 3.31Å
206	G	86.3	Confident	88.2	Confident	37 Å²	37	21.7 Å²	21.7	38%	0.381	12%	0.119	S	C	.	.	H	α-helix	trans	-60.5	-34.2	176	0	0	0	0	0	113.8	F204 R210	F204-G206 VanDerWaalsContact C-N 3.26Å; F204-G206 PolarHBondContact O-N 3.38Å; G206-R210 WeakPolarHBondContact O-CG 3.41Å; G206-R210 PolarHBondContact O-N 3.17Å; G206-R210 PolarHBondContact O-NE 2.79Å
207	I	90.3	Very high	88.3	Confident	3 Å²	3	21.7 Å²	21.7	2%	0.015	12%	0.119	C	C	.	.	H	α-helix	trans	-70.7	-44.9	175.4	-60.4	-176.9	0	0	0	110.4	L165 P199 F204 S205 F209 R210 S211	L165-I207 HydrophobicContact CB-CG2 3.85Å; L165-I207 HydrophobicContact CD1-CG2 4.22Å; L165-I207 HydrophobicContact CD2-CG2 4.2Å; L165-I207 HydrophobicContact CG-CG2 4.31Å; P199-I207 HydrophobicContact CG-CB 4.33Å; P199-I207 HydrophobicContact CG-CD1 4.24Å; P199-I207 HydrophobicContact CG-CG2 4.18Å; F204-I207 HydrophobicContact CB-CB 4.37Å; F204-I207 HydrophobicContact CB-CD1 4.31Å; F204-I207 HydrophobicContact CB-CG1 4.48Å; F204-I207 HydrophobicContact CD1-CD1 3.61Å; F204-I207 HydrophobicContact CD1-CG1 4.49Å; F204-I207 HydrophobicContact CE1-CD1 4.41Å; F204-I207 HydrophobicContact CG-CD1 4.39Å; F204-I207 WeakPolarHBondContact O-CB 3.22Å; F204-I207 PolarHBondContact O-N 3.25Å; S205-I207 VanDerWaalsContact C-N 3.29Å; S205-I207 PolarHBondContact O-N 3.27Å; I207-F209 PolarHBondContact O-N 3.47Å; I207-R210 PolarHBondContact O-N 3.11Å; I207-S211 PolarHBondContact O-N 3.04Å; I207-S211 PolarHBondContact O-OG 3.4Å
208	R	91.6	Very high	88.5	Confident	1 Å²	1	21.3 Å²	21.3	0%	0.004	12%	0.116	C	C	.	.	H	α-helix	trans	-60.8	-41.6	177.6	-70	-167.3	-69	-84.6	2.4	112.9	L134 P199 G200 H201 F204 S205 S211 T212 E234 Y238	L134-R208 HydrophobicContact CD2-CB 3.77Å; L134-R208 HydrophobicContact CD2-CG 3.51Å; P199-R208 PolarHBondContact O-NH1 3.03Å; G200-R208 PolarHBondContact O-NH1 3.35Å; G200-R208 VanDerWaalsContact O-NH1 3.13Å; H201-R208 PolarHBondContact O-NH1 3.34Å; F204-R208 PolarHBondContact O-N 3.43Å; F204-R208 VanDerWaalsContact O-N 3.13Å; S205-R208 PolarHBondContact O-N 2.9Å; R208-S211 WeakPolarHBondContact CA-OG 3.32Å; R208-S211 PolarHBondContact O-OG 3.49Å; R208-T212 PolarHBondContact O-N 3.41Å; R208-T212 PolarHBondContact O-OG1 2.95Å; R208-E234 IonicContact CZ-OE1 3.23Å; R208-E234 IonicContact CZ-OE2 3.79Å; R208-E234 IonicContact NE-OE1 2.69Å; R208-E234 PolarHBondContact NE-OE1 2.9Å; R208-E234 IonicContact NE-OE2 3.07Å; R208-E234 IonicContact NH2-OE1 2.68Å; R208-E234 PolarHBondContact NH2-OE1 3.13Å; R208-E234 IonicContact NH2-OE2 3.26Å; R208-E234 PolarHBondContact NH2-OE2 3.21Å; R208-Y238 HydrophobicContact CB-CD2 4.13Å; R208-Y238 HydrophobicContact CB-CE2 3.87Å
209	F	90.4	Very high	88.8	Confident	80 Å²	80	21.3 Å²	21.3	35%	0.351	12%	0.116	S	C	.	.	H	α-helix	trans	-64.1	-43.4	177.3	-177.9	-105.5	0	0	0	111.5	S205 I207 T212 K213 Y238	S205-F209 PolarHBondContact O-N 3.42Å; I207-F209 PolarHBondContact O-N 3.47Å; F209-T212 PolarHBondContact O-N 3.1Å; F209-K213 PolarHBondContact O-N 2.97Å; F209-K213 VanDerWaalsContact O-N 3.1Å; F209-Y238 HydrophobicContact CB-CE1 4.37Å; F209-Y238 HydrophobicContact CB-CE2 4.35Å; F209-Y238 AromaticContact CD2-CD1 3.73Å; F209-Y238 HydrophobicContact CD2-CD1 3.73Å; F209-Y238 AromaticContact CD2-CE1 3.94Å; F209-Y238 HydrophobicContact CD2-CE1 3.94Å; F209-Y238 HydrophobicContact CD2-CG 4.24Å; F209-Y238 HydrophobicContact CE2-CD1 4.49Å
210	R	90.2	Very high	89.2	Confident	41 Å²	41	21.2 Å²	21.2	16%	0.155	12%	0.116	C	C	.	.	H	α-helix	trans	-64	-42.9	177.3	-76.1	-173.8	-65.7	-152.3	-6.6	113	G206 I207 K213 A214 A393 E492	G206-R210 WeakPolarHBondContact O-CG 3.41Å; G206-R210 PolarHBondContact O-N 3.17Å; G206-R210 PolarHBondContact O-NE 2.79Å; I207-R210 PolarHBondContact O-N 3.11Å; R210-K213 PolarHBondContact O-N 2.82Å; R210-A214 WeakPolarHBondContact O-CB 3.41Å; R210-A214 PolarHBondContact O-N 2.87Å; R210-A214 VanDerWaalsContact O-N 3.14Å; R210-A393 VanDerWaalsContact CD-O 3.28Å; R210-A393 WeakPolarHBondContact CD-O 3.48Å; R210-A393 PolarHBondContact NH1-O 2.85Å; R210-E492 IonicContact CZ-OE2 3.52Å; R210-E492 IonicContact NH1-OE1 2.97Å; R210-E492 IonicContact NH1-OE2 2.77Å; R210-E492 PolarHBondContact NH1-OE2 3.47Å; R210-E492 IonicContact NH2-OE2 2.79Å; R210-E492 PolarHBondContact NH2-OE2 3.35Å
211	S	90.7	Very high	89.9	Confident	0 Å²	0	21 Å²	21	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-63.8	-44.5	177.7	60.8	0	0	0	0	110.8	T198 I207 R208 K213 A214 T215	T198-S211 VanDerWaalsContact CG2-OG 3.28Å; T198-S211 WeakPolarHBondContact CG2-OG 3.37Å; I207-S211 PolarHBondContact O-N 3.04Å; I207-S211 PolarHBondContact O-OG 3.4Å; R208-S211 WeakPolarHBondContact CA-OG 3.32Å; R208-S211 PolarHBondContact O-OG 3.49Å; S211-K213 VanDerWaalsContact C-N 3.31Å; S211-K213 PolarHBondContact O-N 2.8Å; S211-A214 PolarHBondContact O-N 3.25Å; S211-T215 VanDerWaalsContact O-CG2 3.29Å; S211-T215 WeakPolarHBondContact O-CG2 3.44Å; S211-T215 PolarHBondContact O-N 2.85Å; S211-T215 PolarHBondContact O-OG1 2.92Å; S211-T215 VanDerWaalsContact O-OG1 3.07Å
212	T	90.9	Very high	90.5	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-56.9	-45.2	177.2	-47.2	0	0	0	0	111.1	L134 R208 F209 A214 T215 T242 T244	L134-T212 WeakPolarHBondContact CD1-OG1 3.4Å; R208-T212 PolarHBondContact O-N 3.41Å; R208-T212 PolarHBondContact O-OG1 2.95Å; F209-T212 PolarHBondContact O-N 3.1Å; T212-A214 VanDerWaalsContact C-N 3.28Å; T212-A214 PolarHBondContact O-N 2.79Å; T212-T215 PolarHBondContact O-N 2.77Å; T212-T215 PolarHBondContact O-OG1 3.13Å; T212-T242 HydrophobicContact CG2-CG2 4.09Å; T212-T242 VanDerWaalsContact CG2-OG1 3.24Å; T212-T242 WeakPolarHBondContact CG2-OG1 3.46Å; T212-T244 HydrophobicContact CG2-CG2 4.4Å; T212-T244 WeakPolarHBondContact CG2-OG1 3.37Å
213	K	91.3	Very high	91.1	Very high	157 Å²	157	19.3 Å²	19.3	68%	0.683	10%	0.102	S	C	*	.	H	α-helix	trans	-64	-29.2	177.5	-173.6	178.4	178.4	-176	0	114	F209 R210 S211	F209-K213 PolarHBondContact O-N 2.97Å; F209-K213 VanDerWaalsContact O-N 3.1Å; R210-K213 PolarHBondContact O-N 2.82Å; S211-K213 VanDerWaalsContact C-N 3.31Å; S211-K213 PolarHBondContact O-N 2.8Å
214	A	90.5	Very high	91.5	Very high	15 Å²	15	19.5 Å²	19.5	12%	0.124	10%	0.104	C	C	.	.	H	α-helix	trans	-88.7	-6.6	-176.8	0	0	0	0	0	113.8	R210 S211 T212 L323 L338	R210-A214 WeakPolarHBondContact O-CB 3.41Å; R210-A214 PolarHBondContact O-N 2.87Å; R210-A214 VanDerWaalsContact O-N 3.14Å; S211-A214 PolarHBondContact O-N 3.25Å; T212-A214 VanDerWaalsContact C-N 3.28Å; T212-A214 PolarHBondContact O-N 2.79Å; A214-L323 HydrophobicContact CB-CD2 4.23Å; A214-L338 HydrophobicContact CB-CD2 4.05Å; A214-L338 WeakPolarHBondContact O-CD2 3.29Å
215	T	92.3	Very high	91.7	Very high	9 Å²	9	22.4 Å²	22.4	6%	0.055	12%	0.12	C	C	.	.			trans	-111.5	157.1	-172.1	53.8	0	0	0	0	112.9	I130 A132 L196 S211 T212	I130-T215 HydrophobicContact CB-CG2 4.47Å; I130-T215 HydrophobicContact CG2-CG2 3.66Å; I130-T215 WeakPolarHBondContact O-CB 3.47Å; A132-T215 HydrophobicContact CB-CG2 3.54Å; A132-T215 WeakPolarHBondContact CB-OG1 3.29Å; L196-T215 HydrophobicContact CD1-CG2 3.36Å; L196-T215 HydrophobicContact CG-CG2 3.95Å; S211-T215 VanDerWaalsContact O-CG2 3.29Å; S211-T215 WeakPolarHBondContact O-CG2 3.44Å; S211-T215 PolarHBondContact O-N 2.85Å; S211-T215 PolarHBondContact O-OG1 2.92Å; S211-T215 VanDerWaalsContact O-OG1 3.07Å; T212-T215 PolarHBondContact O-N 2.77Å; T212-T215 PolarHBondContact O-OG1 3.13Å
216	D	92.7	Very high	91.7	Very high	26 Å²	26	24.1 Å²	24.1	14%	0.139	13%	0.127	C	C	.	.	S	Bend	trans	-91.1	-34.9	177.5	-54.5	-55.3	0	0	0	111.2	R127 I130 P245 M308 L310	R127-D216 IonicContact CZ-OD1 3.51Å; R127-D216 IonicContact CZ-OD2 3.08Å; R127-D216 VanDerWaalsContact CZ-OD2 3.26Å; R127-D216 IonicContact NH1-OD1 3.87Å; R127-D216 IonicContact NH1-OD2 2.7Å; R127-D216 PolarHBondContact NH1-OD2 3.26Å; R127-D216 IonicContact NH2-OD1 3.22Å; R127-D216 PolarHBondContact NH2-OD1 3.43Å; R127-D216 IonicContact NH2-OD2 3.19Å; R127-D216 PolarHBondContact NH2-OD2 3.41Å; I130-D216 PolarHBondContact N-OD2 3.43Å; I130-D216 PolarHBondContact O-N 2.84Å; D216-P245 VanDerWaalsContact O-CD 3.22Å; D216-P245 WeakPolarHBondContact O-CD 3.46Å; D216-P245 WeakPolarHBondContact O-CG 3.2Å; D216-M308 HydrophobicContact CB-CE 4.4Å; D216-L310 HydrophobicContact CB-CD1 4.05Å; D216-L310 HydrophobicContact CB-CD2 4.15Å
217	I	94	Very high	91.8	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	133.9	-176.3	-61.7	166.7	0	0	0	108.9	P129 I130 V131 A132 P245 V247 I301 Q304 A305 M308	P129-I217 HydrophobicContact CB-CD1 4.32Å; I130-I217 PolarHBondContact O-N 3.44Å; V131-I217 VanDerWaalsContact CA-O 3.3Å; V131-I217 WeakPolarHBondContact CA-O 3.41Å; V131-I217 HydrophobicContact CG2-CB 4.33Å; A132-I217 PolarHBondContact N-O 3.05Å; A132-I217 VanDerWaalsContact N-O 3.09Å; I217-P245 HydrophobicContact CG1-CG 4.36Å; I217-V247 HydrophobicContact CG2-CG2 3.87Å; I217-I301 HydrophobicContact CD1-CG2 4.4Å; I217-Q304 HydrophobicContact CD1-CB 4.06Å; I217-Q304 HydrophobicContact CD1-CG 3.99Å; I217-Q304 HydrophobicContact CG1-CG 4.2Å; I217-A305 HydrophobicContact CD1-CB 4.02Å; I217-M308 HydrophobicContact CD1-SD 4.46Å; I217-M308 HydrophobicContact CG1-SD 3.96Å
218	M	94.7	Very high	91.9	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	121.3	172.1	-175	176.8	82.5	0	0	110.6	L134 L220 A239 P245 I246 V247	L134-M218 HydrophobicContact CB-CG 4.43Å; L134-M218 HydrophobicContact CB-SD 4.33Å; L134-M218 HydrophobicContact CD1-CG 3.75Å; L134-M218 HydrophobicContact CD1-SD 3.37Å; L134-M218 WeakPolarHBondContact CD1-SD 3.4Å; L134-M218 HydrophobicContact CG-SD 4.43Å; M218-L220 HydrophobicContact CE-CB 4.33Å; M218-L220 HydrophobicContact CE-CD1 4.4Å; M218-A239 HydrophobicContact CE-CB 3.46Å; M218-A239 VanDerWaalsContact CE-CB 3.46Å; M218-A239 HydrophobicContact SD-CB 3.75Å; M218-P245 PolarHBondContact N-O 3.35Å; M218-I246 HydrophobicContact CE-CB 4.28Å; M218-I246 HydrophobicContact CE-CD1 3.68Å; M218-I246 HydrophobicContact CE-CG1 3.75Å; M218-I246 HydrophobicContact CE-CG2 3.72Å; M218-I246 CarbonylContact O-C 3.58Å; M218-I246 WeakPolarHBondContact O-CA 3.43Å; M218-V247 PolarHBondContact O-N 3.43Å
219	L	95.3	Very high	91.8	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	108.9	170.3	179	63.7	0	0	0	110	V131 A132 V133 L134 L144 V221 V247 A249 L297 I301	V131-L219 HydrophobicContact CG1-CB 3.7Å; A132-L219 PolarHBondContact O-N 2.67Å; V133-L219 WeakPolarHBondContact CA-O 3.36Å; V133-L219 HydrophobicContact CG1-CD2 4.33Å; V133-L219 HydrophobicContact CG2-CB 4.26Å; V133-L219 HydrophobicContact CG2-CD2 3.87Å; V133-L219 HydrophobicContact CG2-CG 4.5Å; L134-L219 PolarHBondContact N-O 3.39Å; L144-L219 HydrophobicContact CD2-CD2 4.36Å; L219-V221 HydrophobicContact CG-CG2 4.42Å; L219-V247 CarbonylContact C-O 3.57Å; L219-V247 WeakPolarHBondContact CA-O 3.49Å; L219-V247 HydrophobicContact CD1-CB 4.29Å; L219-V247 HydrophobicContact CD1-CG1 4.12Å; L219-A249 HydrophobicContact CD1-CB 3.87Å; L219-L297 HydrophobicContact CD1-CD1 3.82Å; L219-L297 HydrophobicContact CD1-CD2 4.5Å; L219-L297 HydrophobicContact CD2-CD2 4.24Å; L219-I301 HydrophobicContact CD2-CD1 4.43Å
220	L	94.7	Very high	91.8	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	111.3	178.5	-172.2	66.4	0	0	0	110.8	M218 V222 T232 A235 I236 I246 V247 V248 A249 L267	M218-L220 HydrophobicContact CE-CB 4.33Å; M218-L220 HydrophobicContact CE-CD1 4.4Å; L220-V222 HydrophobicContact CD2-CG2 4.21Å; L220-V222 HydrophobicContact CG-CG2 4.03Å; L220-T232 HydrophobicContact CD1-CG2 3.91Å; L220-T232 HydrophobicContact CD2-CG2 3.96Å; L220-T232 HydrophobicContact CG-CG2 4.18Å; L220-A235 HydrophobicContact CD1-CB 3.9Å; L220-I236 HydrophobicContact CD2-CD1 4.15Å; L220-I236 HydrophobicContact CD2-CG1 3.87Å; L220-I246 HydrophobicContact CB-CG2 3.93Å; L220-V247 PolarHBondContact N-O 3.04Å; L220-V248 HydrophobicContact CB-CG2 4.43Å; L220-V248 HydrophobicContact CD2-CG2 4.43Å; L220-V248 WeakPolarHBondContact O-CA 3.33Å; L220-A249 PolarHBondContact O-N 2.9Å; L220-L267 HydrophobicContact CD2-CD2 4.16Å
221	V	94.3	Very high	91.8	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	116.8	177.4	-172.4	0	0	0	0	110	V133 L134 H139 K141 L144 L219 A249 N251	V133-V221 HydrophobicContact CG1-CG2 3.57Å; L134-V221 PolarHBondContact O-N 2.98Å; H139-V221 HydrophobicContact CB-CG1 4.25Å; H139-V221 PolarHBondContact ND1-O 3.07Å; H139-V221 WeakPolarHBondContact O-CG1 3.27Å; K141-V221 HydrophobicContact CG-CB 4.01Å; K141-V221 HydrophobicContact CG-CG1 4.48Å; K141-V221 HydrophobicContact CG-CG2 4.11Å; L144-V221 HydrophobicContact CD1-CG2 4.16Å; L219-V221 HydrophobicContact CG-CG2 4.42Å; V221-A249 WeakPolarHBondContact CA-O 3.34Å; V221-A249 HydrophobicContact CG2-CB 4.45Å; V221-N251 HydrophobicContact CG1-CB 3.98Å
222	V	93.7	Very high	91.8	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	125.3	177.5	-173	0	0	0	0	108.8	H139 L220 G227 T232 A249 I250 N251 V263 L267	H139-V222 WeakPolarHBondContact ND1-CA 3.42Å; L220-V222 HydrophobicContact CD2-CG2 4.21Å; L220-V222 HydrophobicContact CG-CG2 4.03Å; V222-G227 WeakPolarHBondContact CG1-O 3.15Å; V222-T232 HydrophobicContact CG2-CG2 3.84Å; V222-A249 PolarHBondContact N-O 3.42Å; V222-I250 CarbonylContact O-C 3.6Å; V222-I250 WeakPolarHBondContact O-CA 3.44Å; V222-N251 PolarHBondContact O-N 3.44Å; V222-V263 HydrophobicContact CB-CG1 4.25Å; V222-V263 HydrophobicContact CG1-CG1 3.7Å; V222-L267 HydrophobicContact CG2-CD2 4.47Å
223	A	92.8	Very high	91.8	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	138	176.8	0	0	0	0	0	110.5	H139 D225 D226 G227 K252	H139-A223 HydrophobicContact CB-CB 4.2Å; H139-A223 PolarHBondContact ND1-N 2.77Å; A223-D225 WeakPolarHBondContact CB-OD1 3.24Å; A223-D225 PolarHBondContact O-N 3.25Å; A223-D226 HydrophobicContact CB-CB 4.46Å; A223-D226 PolarHBondContact O-N 3.13Å; A223-G227 PolarHBondContact O-N 3.22Å; A223-K252 HydrophobicContact CB-CD 3.96Å; A223-K252 HydrophobicContact CB-CG 4.35Å
224	A	91.6	Very high	91.7	Very high	7 Å²	7	23.8 Å²	23.8	6%	0.058	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-16.5	-175.4	0	0	0	0	0	113.6	I250 N251 I258	A224-I250 HydrophobicContact CB-CG2 3.77Å; A224-N251 VanDerWaalsContact CB-O 3.31Å; A224-N251 WeakPolarHBondContact CB-O 3.25Å; A224-N251 PolarHBondContact N-O 3.38Å; A224-I258 HydrophobicContact CB-CD1 4.32Å; A224-I258 HydrophobicContact CB-CG1 4.46Å; A224-I258 HydrophobicContact CB-CG2 3.35Å
225	D	90	Very high	91.8	Very high	64 Å²	64	23.1 Å²	23.1	34%	0.342	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-44.1	174	53.5	-11.8	0	0	0	112.7	A223 K252 K255	A223-D225 WeakPolarHBondContact CB-OD1 3.24Å; A223-D225 PolarHBondContact O-N 3.25Å; D225-K252 WeakPolarHBondContact OD1-CD 3.35Å; D225-K252 IonicContact OD1-NZ 3.98Å; D225-K252 PolarHBondContact OD1-NZ 3.07Å; D225-K252 VanDerWaalsContact OD1-NZ 3.09Å; D225-K252 WeakPolarHBondContact OD2-CD 3.48Å; D225-K252 IonicContact OD2-NZ 2.75Å; D225-K252 PolarHBondContact OD2-NZ 3.42Å; D225-K255 HydrophobicContact CB-CD 4.41Å; D225-K255 IonicContact OD2-NZ 3.93Å; D225-K255 PolarHBondContact OD2-NZ 2.96Å
226	D	87.6	Confident	91.8	Very high	66 Å²	66	22.9 Å²	22.9	35%	0.353	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-31.6	-174.5	-75.9	-43.8	0	0	0	114.1	A223 K229 K252	A223-D226 HydrophobicContact CB-CB 4.46Å; A223-D226 PolarHBondContact O-N 3.13Å; D226-K229 HydrophobicContact CB-CG 4.48Å; D226-K229 WeakPolarHBondContact O-CE 3.41Å; D226-K252 IonicContact OD2-NZ 3.15Å
227	G	88.9	Confident	91.8	Very high	13 Å²	13	28.5 Å²	28.5	13%	0.134	15%	0.148	C	C	.	.			trans	69.9	-153	-172.5	0	0	0	0	0	113.5	V222 A223	V222-G227 WeakPolarHBondContact CG1-O 3.15Å; A223-G227 PolarHBondContact O-N 3.22Å
228	V	90.8	Very high	91.7	Very high	35 Å²	35	30 Å²	30	21%	0.212	15%	0.154	C	C	.	.	S	Bend	trans	-79.1	124.6	-177.8	-177.2	0	0	0	0	110.1	T232 V233 L267 Y270	V228-T232 HydrophobicContact CG1-CG2 4.05Å; V228-V233 HydrophobicContact CG1-CG2 3.82Å; V228-L267 HydrophobicContact CG2-CD2 3.78Å; V228-L267 HydrophobicContact CG2-CG 3.97Å; V228-Y270 HydrophobicContact CB-CE2 4.47Å; V228-Y270 HydrophobicContact CG1-CD2 3.89Å; V228-Y270 HydrophobicContact CG1-CE2 3.71Å
229	K	91	Very high	91.6	Very high	73 Å²	73	30.1 Å²	30.1	32%	0.317	15%	0.154	S	C	.	.			trans	-116	166.7	179.6	-65.2	-72.6	-175.4	173.3	0	110.9	H136 D226 Q231 T232 V233	H136-K229 HydrophobicContact CB-CB 4.09Å; H136-K229 HydrophobicContact CB-CG 4.49Å; D226-K229 HydrophobicContact CB-CG 4.48Å; D226-K229 WeakPolarHBondContact O-CE 3.41Å; K229-Q231 VanDerWaalsContact C-N 3.29Å; K229-Q231 PolarHBondContact O-N 2.92Å; K229-T232 WeakPolarHBondContact O-CA 3.39Å; K229-T232 WeakPolarHBondContact O-CB 3.2Å; K229-T232 PolarHBondContact O-N 3.39Å; K229-V233 PolarHBondContact O-N 3.01Å; K229-V233 VanDerWaalsContact O-N 3.09Å
230	P	89.2	Confident	91.4	Very high	90 Å²	90	34.1 Å²	34.1	58%	0.584	17%	0.172	S	C	*	.	H	α-helix	trans	-54.2	-38.5	-176.8	-28.6	35.8	0	0	0	114.8	T232 V233 E234	P230-T232 VanDerWaalsContact C-N 3.32Å; P230-T232 PolarHBondContact O-N 3.37Å; P230-V233 WeakPolarHBondContact O-CB 3.2Å; P230-V233 PolarHBondContact O-N 3.35Å; P230-E234 PolarHBondContact O-N 3.42Å
231	Q	90.1	Very high	91.3	Very high	21 Å²	21	38.6 Å²	38.6	10%	0.098	19%	0.193	C	C	.	.	H	α-helix	trans	-69.2	-29.4	177	-68.2	167.2	3.1	0	0	112.7	H136 G200 K229 A235	H136-Q231 VanDerWaalsContact CA-OE1 3.29Å; H136-Q231 HydrophobicContact CB-CB 4.42Å; H136-Q231 PolarHBondContact ND1-OE1 3.32Å; G200-Q231 PolarHBondContact O-NE2 3.16Å; G200-Q231 PolarHBondContact O-OE1 3.26Å; K229-Q231 VanDerWaalsContact C-N 3.29Å; K229-Q231 PolarHBondContact O-N 2.92Å; Q231-A235 PolarHBondContact O-N 3.24Å
232	T	90.4	Very high	91.1	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-67.1	-42.3	171.1	-50.4	0	0	0	0	110.2	L220 V222 V228 K229 P230 E234 A235 I236	L220-T232 HydrophobicContact CD1-CG2 3.91Å; L220-T232 HydrophobicContact CD2-CG2 3.96Å; L220-T232 HydrophobicContact CG-CG2 4.18Å; V222-T232 HydrophobicContact CG2-CG2 3.84Å; V228-T232 HydrophobicContact CG1-CG2 4.05Å; K229-T232 WeakPolarHBondContact O-CA 3.39Å; K229-T232 WeakPolarHBondContact O-CB 3.2Å; K229-T232 PolarHBondContact O-N 3.39Å; P230-T232 VanDerWaalsContact C-N 3.32Å; P230-T232 PolarHBondContact O-N 3.37Å; T232-E234 VanDerWaalsContact C-N 3.33Å; T232-E234 PolarHBondContact O-N 2.86Å; T232-A235 PolarHBondContact O-N 3.45Å; T232-I236 HydrophobicContact CG2-CD1 4.38Å; T232-I236 WeakPolarHBondContact O-CG1 3.44Å; T232-I236 PolarHBondContact O-N 3.05Å
233	V	91.6	Very high	91	Very high	41 Å²	41	47.4 Å²	47.4	25%	0.248	24%	0.241	C	C	.	.	H	α-helix	trans	-62.7	-41.9	176.1	-178.9	0	0	0	0	111.1	V228 K229 P230 I236 R237 Y270	V228-V233 HydrophobicContact CG1-CG2 3.82Å; K229-V233 PolarHBondContact O-N 3.01Å; K229-V233 VanDerWaalsContact O-N 3.09Å; P230-V233 WeakPolarHBondContact O-CB 3.2Å; P230-V233 PolarHBondContact O-N 3.35Å; V233-I236 PolarHBondContact O-N 3.15Å; V233-R237 PolarHBondContact O-N 3.28Å; V233-Y270 HydrophobicContact CB-CE1 4.41Å; V233-Y270 HydrophobicContact CG1-CD1 3.9Å; V233-Y270 HydrophobicContact CG1-CE1 3.72Å; V233-Y270 HydrophobicContact CG2-CD1 4.18Å; V233-Y270 HydrophobicContact CG2-CD2 4.15Å; V233-Y270 HydrophobicContact CG2-CE1 3.72Å; V233-Y270 HydrophobicContact CG2-CE2 3.69Å; V233-Y270 HydrophobicContact CG2-CG 4.38Å; V233-Y270 VanDerWaalsContact CG2-CZ 3.45Å
234	E	90.4	Very high	90.9	Very high	40 Å²	40	48.2 Å²	48.2	19%	0.187	25%	0.246	C	C	.	.	H	α-helix	trans	-59.8	-44.7	174.3	-170.1	-165.1	156.3	0	0	112	S205 R208 P230 T232 I236 R237 Y238	S205-E234 VanDerWaalsContact CB-OE1 3.28Å; S205-E234 WeakPolarHBondContact CB-OE1 3.31Å; R208-E234 IonicContact CZ-OE1 3.23Å; R208-E234 IonicContact CZ-OE2 3.79Å; R208-E234 IonicContact NE-OE1 2.69Å; R208-E234 PolarHBondContact NE-OE1 2.9Å; R208-E234 IonicContact NE-OE2 3.07Å; R208-E234 IonicContact NH2-OE1 2.68Å; R208-E234 PolarHBondContact NH2-OE1 3.13Å; R208-E234 IonicContact NH2-OE2 3.26Å; R208-E234 PolarHBondContact NH2-OE2 3.21Å; P230-E234 PolarHBondContact O-N 3.42Å; T232-E234 VanDerWaalsContact C-N 3.33Å; T232-E234 PolarHBondContact O-N 2.86Å; E234-I236 PolarHBondContact O-N 2.93Å; E234-R237 WeakPolarHBondContact O-CB 3.45Å; E234-R237 PolarHBondContact O-N 3.48Å; E234-Y238 HydrophobicContact CG-CD2 4.45Å; E234-Y238 HydrophobicContact CG-CE2 3.78Å; E234-Y238 PolarHBondContact O-N 3.42Å; E234-Y238 WeakPolarHBondContact OE1-CE2 3.49Å; E234-Y238 PolarHBondContact OE1-OH 2.89Å
235	A	91.4	Very high	91	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-62	-41.7	176.1	0	0	0	0	0	112.4	L134 L220 Q231 T232 R237 Y238 A239	L134-A235 HydrophobicContact CB-CB 3.93Å; L134-A235 HydrophobicContact CD1-CB 4.41Å; L220-A235 HydrophobicContact CD1-CB 3.9Å; Q231-A235 PolarHBondContact O-N 3.24Å; T232-A235 PolarHBondContact O-N 3.45Å; A235-R237 VanDerWaalsContact C-N 3.28Å; A235-R237 PolarHBondContact O-N 2.97Å; A235-Y238 PolarHBondContact O-N 3.29Å; A235-A239 PolarHBondContact O-N 2.67Å
236	I	92.7	Very high	91.1	Very high	4 Å²	4	47.5 Å²	47.5	2%	0.021	24%	0.243	C	C	.	.	H	α-helix	trans	-60.5	-40.8	175	-66.9	164.8	0	0	0	110.6	L220 T232 V233 E234 A239 K240 L267 V272	L220-I236 HydrophobicContact CD2-CD1 4.15Å; L220-I236 HydrophobicContact CD2-CG1 3.87Å; T232-I236 HydrophobicContact CG2-CD1 4.38Å; T232-I236 WeakPolarHBondContact O-CG1 3.44Å; T232-I236 PolarHBondContact O-N 3.05Å; V233-I236 PolarHBondContact O-N 3.15Å; E234-I236 PolarHBondContact O-N 2.93Å; I236-A239 PolarHBondContact O-N 3.13Å; I236-K240 HydrophobicContact CG2-CD 4.42Å; I236-K240 WeakPolarHBondContact O-CG 3.24Å; I236-K240 PolarHBondContact O-N 3Å; I236-K240 VanDerWaalsContact O-N 3.09Å; I236-L267 HydrophobicContact CD1-CD2 4.21Å; I236-V272 HydrophobicContact CD1-CG2 3.83Å; I236-V272 HydrophobicContact CG1-CG2 3.96Å; I236-V272 HydrophobicContact CG2-CG2 3.71Å
237	R	93.2	Very high	91.4	Very high	144 Å²	144	44.4 Å²	44.4	54%	0.543	23%	0.226	S	C	.	.	H	α-helix	trans	-61.2	-45.5	175.9	-179.8	-178.9	170.6	177.4	-0.4	111.6	V233 E234 A235 A239 K240 E241	V233-R237 PolarHBondContact O-N 3.28Å; E234-R237 WeakPolarHBondContact O-CB 3.45Å; E234-R237 PolarHBondContact O-N 3.48Å; A235-R237 VanDerWaalsContact C-N 3.28Å; A235-R237 PolarHBondContact O-N 2.97Å; R237-A239 VanDerWaalsContact C-N 3.33Å; R237-A239 PolarHBondContact O-N 3.26Å; R237-K240 PolarHBondContact O-N 3.39Å; R237-E241 HydrophobicContact CG-CG 4.45Å; R237-E241 IonicContact CZ-OE1 3.67Å; R237-E241 IonicContact NE-OE1 2.68Å; R237-E241 PolarHBondContact NE-OE1 3.5Å; R237-E241 IonicContact NH2-OE1 3.62Å; R237-E241 PolarHBondContact NH2-OE1 3.3Å; R237-E241 WeakPolarHBondContact O-CG 3.28Å; R237-E241 PolarHBondContact O-N 2.8Å
238	Y	92.2	Very high	91.7	Very high	32 Å²	32	43.8 Å²	43.8	13%	0.125	22%	0.22	C	C	.	.	H	α-helix	trans	-62.9	-38.4	177.6	-64.3	-28.9	0	0	0	113	R208 F209 E234 A235 K240 E241 T242	R208-Y238 HydrophobicContact CB-CD2 4.13Å; R208-Y238 HydrophobicContact CB-CE2 3.87Å; F209-Y238 HydrophobicContact CB-CE1 4.37Å; F209-Y238 HydrophobicContact CB-CE2 4.35Å; F209-Y238 AromaticContact CD2-CD1 3.73Å; F209-Y238 HydrophobicContact CD2-CD1 3.73Å; F209-Y238 AromaticContact CD2-CE1 3.94Å; F209-Y238 HydrophobicContact CD2-CE1 3.94Å; F209-Y238 HydrophobicContact CD2-CG 4.24Å; F209-Y238 HydrophobicContact CE2-CD1 4.49Å; E234-Y238 HydrophobicContact CG-CD2 4.45Å; E234-Y238 HydrophobicContact CG-CE2 3.78Å; E234-Y238 PolarHBondContact O-N 3.42Å; E234-Y238 WeakPolarHBondContact OE1-CE2 3.49Å; E234-Y238 PolarHBondContact OE1-OH 2.89Å; A235-Y238 PolarHBondContact O-N 3.29Å; Y238-K240 VanDerWaalsContact C-N 3.34Å; Y238-K240 PolarHBondContact O-N 3.43Å; Y238-E241 PolarHBondContact O-N 2.9Å; Y238-T242 WeakPolarHBondContact O-CB 3.31Å; Y238-T242 WeakPolarHBondContact O-CG2 3.27Å; Y238-T242 PolarHBondContact O-N 3.36Å; Y238-T242 PolarHBondContact O-OG1 2.9Å
239	A	91.4	Very high	91.9	Very high	2 Å²	2	42.1 Å²	42.1	2%	0.017	21%	0.21	C	C	.	.	H	α-helix	trans	-61.9	-42.7	174.5	0	0	0	0	0	112.5	M218 A235 I236 R237 T242 N243 T244 I246	M218-A239 HydrophobicContact CE-CB 3.46Å; M218-A239 VanDerWaalsContact CE-CB 3.46Å; M218-A239 HydrophobicContact SD-CB 3.75Å; A235-A239 PolarHBondContact O-N 2.67Å; I236-A239 PolarHBondContact O-N 3.13Å; R237-A239 VanDerWaalsContact C-N 3.33Å; R237-A239 PolarHBondContact O-N 3.26Å; A239-T242 PolarHBondContact O-N 3.25Å; A239-T242 PolarHBondContact O-OG1 3.38Å; A239-N243 WeakPolarHBondContact O-CA 3.24Å; A239-N243 PolarHBondContact O-N 2.87Å; A239-T244 WeakPolarHBondContact CA-OG1 3.27Å; A239-T244 PolarHBondContact O-N 3.37Å; A239-I246 HydrophobicContact CB-CD1 3.59Å; A239-I246 HydrophobicContact CB-CG1 3.78Å
240	K	91.5	Very high	92	Very high	84 Å²	84	38.8 Å²	38.8	37%	0.365	20%	0.196	S	C	.	.	H	α-helix	trans	-65.7	-41.8	176.1	-69.2	-179.2	-175.9	-179.2	0	112.6	I236 R237 Y238 T242 N243 Y270 E271	I236-K240 HydrophobicContact CG2-CD 4.42Å; I236-K240 WeakPolarHBondContact O-CG 3.24Å; I236-K240 PolarHBondContact O-N 3Å; I236-K240 VanDerWaalsContact O-N 3.09Å; R237-K240 PolarHBondContact O-N 3.39Å; Y238-K240 VanDerWaalsContact C-N 3.34Å; Y238-K240 PolarHBondContact O-N 3.43Å; K240-T242 VanDerWaalsContact C-N 3.29Å; K240-T242 PolarHBondContact O-N 3.23Å; K240-N243 PolarHBondContact O-N 2.88Å; K240-N243 PolarHBondContact O-OD1 3.28Å; K240-Y270 PolarHBondContact NZ-O 2.94Å; K240-E271 IonicContact NZ-OE2 2.92Å; K240-E271 PolarHBondContact NZ-OE2 3.48Å
241	E	92.7	Very high	92.2	Very high	95 Å²	95	34.7 Å²	34.7	44%	0.444	17%	0.169	S	C	.	.	H	α-helix	trans	-66.1	-32	178.6	-73.4	177.5	-176	0	0	112.6	R237 Y238	R237-E241 HydrophobicContact CG-CG 4.45Å; R237-E241 IonicContact CZ-OE1 3.67Å; R237-E241 IonicContact NE-OE1 2.68Å; R237-E241 PolarHBondContact NE-OE1 3.5Å; R237-E241 IonicContact NH2-OE1 3.62Å; R237-E241 PolarHBondContact NH2-OE1 3.3Å; R237-E241 WeakPolarHBondContact O-CG 3.28Å; R237-E241 PolarHBondContact O-N 2.8Å; Y238-E241 PolarHBondContact O-N 2.9Å
242	T	89.6	Confident	92.3	Very high	40 Å²	40	35.1 Å²	35.1	25%	0.245	17%	0.171	C	C	.	.	H	α-helix	trans	-95.5	-6.9	-179.9	55.9	0	0	0	0	114.1	T212 Y238 A239 K240 T244	T212-T242 HydrophobicContact CG2-CG2 4.09Å; T212-T242 VanDerWaalsContact CG2-OG1 3.24Å; T212-T242 WeakPolarHBondContact CG2-OG1 3.46Å; Y238-T242 WeakPolarHBondContact O-CB 3.31Å; Y238-T242 WeakPolarHBondContact O-CG2 3.27Å; Y238-T242 PolarHBondContact O-N 3.36Å; Y238-T242 PolarHBondContact O-OG1 2.9Å; A239-T242 PolarHBondContact O-N 3.25Å; A239-T242 PolarHBondContact O-OG1 3.38Å; K240-T242 VanDerWaalsContact C-N 3.29Å; K240-T242 PolarHBondContact O-N 3.23Å; T242-T244 PolarHBondContact O-N 3.23Å; T242-T244 WeakPolarHBondContact OG1-CG2 3.35Å; T242-T244 PolarHBondContact OG1-OG1 2.8Å
243	N	91.1	Very high	92.2	Very high	145 Å²	145	37.3 Å²	37.3	78%	0.775	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	53	38.4	-169.9	-59.8	-55.2	0	0	0	113.4	A239 K240	A239-N243 WeakPolarHBondContact O-CA 3.24Å; A239-N243 PolarHBondContact O-N 2.87Å; K240-N243 PolarHBondContact O-N 2.88Å; K240-N243 PolarHBondContact O-OD1 3.28Å
244	T	91.1	Very high	92	Very high	17 Å²	17	37.1 Å²	37.1	10%	0.104	18%	0.179	C	C	.	.			trans	-87.6	129.6	177.1	46	0	0	0	0	110.7	T212 A239 T242	T212-T244 HydrophobicContact CG2-CG2 4.4Å; T212-T244 WeakPolarHBondContact CG2-OG1 3.37Å; A239-T244 WeakPolarHBondContact CA-OG1 3.27Å; A239-T244 PolarHBondContact O-N 3.37Å; T242-T244 PolarHBondContact O-N 3.23Å; T242-T244 WeakPolarHBondContact OG1-CG2 3.35Å; T242-T244 PolarHBondContact OG1-OG1 2.8Å
245	P	93.4	Very high	91.7	Very high	34 Å²	34	40 Å²	40	22%	0.221	19%	0.191	C	C	.	.			trans	-64	141.8	176.7	24.3	-32.7	0	0	0	111.4	D216 I217 M218 M308	D216-P245 VanDerWaalsContact O-CD 3.22Å; D216-P245 WeakPolarHBondContact O-CD 3.46Å; D216-P245 WeakPolarHBondContact O-CG 3.2Å; I217-P245 HydrophobicContact CG1-CG 4.36Å; M218-P245 PolarHBondContact N-O 3.35Å; P245-M308 HydrophobicContact CG-CE 3.9Å; P245-M308 HydrophobicContact CG-SD 3.59Å; P245-M308 VanDerWaalsContact CG-SD 3.59Å
246	I	93.9	Very high	91	Very high	21 Å²	21	48.3 Å²	48.3	11%	0.108	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	134.5	-175	-46.8	-176	0	0	0	109.3	M218 L220 A239 V248 V272	M218-I246 HydrophobicContact CE-CB 4.28Å; M218-I246 HydrophobicContact CE-CD1 3.68Å; M218-I246 HydrophobicContact CE-CG1 3.75Å; M218-I246 HydrophobicContact CE-CG2 3.72Å; M218-I246 CarbonylContact O-C 3.58Å; M218-I246 WeakPolarHBondContact O-CA 3.43Å; L220-I246 HydrophobicContact CB-CG2 3.93Å; A239-I246 HydrophobicContact CB-CD1 3.59Å; A239-I246 HydrophobicContact CB-CG1 3.78Å; I246-V248 HydrophobicContact CG2-CG2 4.16Å; I246-V272 HydrophobicContact CD1-CG2 4.5Å
247	V	93.9	Very high	90.3	Very high	1 Å²	1	56.4 Å²	56.4	1%	0.006	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	131.7	163.9	178.4	0	0	0	0	107.3	I217 M218 L219 L220 L297 Q304	I217-V247 HydrophobicContact CG2-CG2 3.87Å; M218-V247 PolarHBondContact O-N 3.43Å; L219-V247 CarbonylContact C-O 3.57Å; L219-V247 WeakPolarHBondContact CA-O 3.49Å; L219-V247 HydrophobicContact CD1-CB 4.29Å; L219-V247 HydrophobicContact CD1-CG1 4.12Å; L220-V247 PolarHBondContact N-O 3.04Å; V247-L297 HydrophobicContact CG1-CD1 4.28Å; V247-Q304 HydrophobicContact CG2-CB 4.38Å; V247-Q304 HydrophobicContact CG2-CG 4.32Å
248	V	94.4	Very high	89.4	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	126.4	-176.5	178.8	0	0	0	0	110	L220 I246 I250 L267 V272 I281 Q282 A283 V284	L220-V248 HydrophobicContact CB-CG2 4.43Å; L220-V248 HydrophobicContact CD2-CG2 4.43Å; L220-V248 WeakPolarHBondContact O-CA 3.33Å; I246-V248 HydrophobicContact CG2-CG2 4.16Å; V248-I250 HydrophobicContact CG1-CG1 4.16Å; V248-L267 HydrophobicContact CG1-CD1 3.83Å; V248-L267 HydrophobicContact CG2-CD1 4.36Å; V248-V272 HydrophobicContact CG2-CG1 4.19Å; V248-I281 HydrophobicContact CG2-CG2 3.68Å; V248-Q282 PolarHBondContact N-O 3.45Å; V248-A283 HydrophobicContact CB-CB 4.36Å; V248-A283 WeakPolarHBondContact O-CA 3.49Å; V248-V284 PolarHBondContact O-N 3.32Å
249	A	94.4	Very high	88.9	Confident	0 Å²	0	52 Å²	52	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	112.8	170.6	0	0	0	0	0	110.1	L219 L220 V221 V222 N251 V284 I286 L297	L219-A249 HydrophobicContact CD1-CB 3.87Å; L220-A249 PolarHBondContact O-N 2.9Å; V221-A249 WeakPolarHBondContact CA-O 3.34Å; V221-A249 HydrophobicContact CG2-CB 4.45Å; V222-A249 PolarHBondContact N-O 3.42Å; A249-N251 PolarHBondContact O-N 2.98Å; A249-V284 WeakPolarHBondContact CA-O 3.44Å; A249-I286 HydrophobicContact CB-CD1 3.76Å; A249-I286 HydrophobicContact CB-CG1 4.27Å; A249-L297 HydrophobicContact CB-CD1 4.08Å; A249-L297 HydrophobicContact CB-CD2 4.24Å
250	I	94.1	Very high	88.4	Confident	3 Å²	3	55 Å²	55	2%	0.015	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	102.6	176.8	-57.4	175.5	0	0	0	108.1	V222 A224 V248 V263 V284 I286	V222-I250 CarbonylContact O-C 3.6Å; V222-I250 WeakPolarHBondContact O-CA 3.44Å; A224-I250 HydrophobicContact CB-CG2 3.77Å; V248-I250 HydrophobicContact CG1-CG1 4.16Å; I250-V263 HydrophobicContact CD1-CG1 4.37Å; I250-V263 HydrophobicContact CG1-CG1 4.37Å; I250-V284 PolarHBondContact N-O 2.83Å; I250-I286 PolarHBondContact O-N 3.49Å
251	N	93.5	Very high	88.2	Confident	5 Å²	5	56.1 Å²	56.1	3%	0.027	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	167.1	-174.3	-162.9	17.9	0	0	0	113.2	H139 V221 V222 A224 A249 I286 A288	H139-N251 PolarHBondContact O-ND2 3.19Å; V221-N251 HydrophobicContact CG1-CB 3.98Å; V222-N251 PolarHBondContact O-N 3.44Å; A224-N251 VanDerWaalsContact CB-O 3.31Å; A224-N251 WeakPolarHBondContact CB-O 3.25Å; A224-N251 PolarHBondContact N-O 3.38Å; A249-N251 PolarHBondContact O-N 2.98Å; N251-I286 CarbonylContact C-O 3.53Å; N251-I286 WeakPolarHBondContact CA-O 3.28Å; N251-I286 HydrophobicContact CB-CD1 4.39Å; N251-I286 HydrophobicContact CB-CG1 4.21Å; N251-A288 PolarHBondContact OD1-N 2.69Å
252	K	90.6	Very high	87.9	Confident	30 Å²	30	58.8 Å²	58.8	13%	0.13	30%	0.299	C	S	.	.			trans	68.2	33.4	176.5	-50.2	-176.2	-166.5	156.1	0	115.2	D138 A223 D225 D226 D254 K255 I258 I286	D138-K252 WeakPolarHBondContact O-CE 3.48Å; D138-K252 PolarHBondContact O-NZ 2.99Å; A223-K252 HydrophobicContact CB-CD 3.96Å; A223-K252 HydrophobicContact CB-CG 4.35Å; D225-K252 WeakPolarHBondContact OD1-CD 3.35Å; D225-K252 IonicContact OD1-NZ 3.98Å; D225-K252 PolarHBondContact OD1-NZ 3.07Å; D225-K252 VanDerWaalsContact OD1-NZ 3.09Å; D225-K252 WeakPolarHBondContact OD2-CD 3.48Å; D225-K252 IonicContact OD2-NZ 2.75Å; D225-K252 PolarHBondContact OD2-NZ 3.42Å; D226-K252 IonicContact OD2-NZ 3.15Å; K252-D254 WeakPolarHBondContact CA-OD1 3.3Å; K252-D254 PolarHBondContact O-N 2.89Å; K252-K255 PolarHBondContact O-N 3.4Å; K252-I258 WeakPolarHBondContact O-CD1 3.39Å; K252-I286 PolarHBondContact N-O 2.93Å
253	I	88.7	Confident	87.9	Confident	45 Å²	45	57 Å²	57	23%	0.231	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-6	175.1	66.1	175.8	0	0	0	114.5	M260 P285 I286 I292	I253-M260 HydrophobicContact CG2-CE 4.02Å; I253-P285 HydrophobicContact CG2-CB 4.01Å; I253-I286 WeakPolarHBondContact CG1-O 3.49Å; I253-I286 PolarHBondContact N-O 3.3Å; I253-I292 HydrophobicContact CD1-CG2 4.16Å
254	D	88.3	Confident	87.8	Confident	37 Å²	37	50.3 Å²	50.3	20%	0.198	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-17	178.9	53.5	-68.3	0	0	0	114.7	K252 S287 K290	K252-D254 WeakPolarHBondContact CA-OD1 3.3Å; K252-D254 PolarHBondContact O-N 2.89Å; D254-S287 PolarHBondContact OD1-OG 3.26Å; D254-K290 HydrophobicContact CB-CD 3.8Å; D254-K290 HydrophobicContact CB-CG 4.29Å
255	K	84.4	Confident	87.8	Confident	101 Å²	101	55.6 Å²	55.6	44%	0.439	28%	0.276	S	S	.	.	S	Bend	trans	-75.3	149.2	176	-64.7	-176.2	175.1	-176	0	111.2	D225 K252 I258	D225-K255 HydrophobicContact CB-CD 4.41Å; D225-K255 IonicContact OD2-NZ 3.93Å; D225-K255 PolarHBondContact OD2-NZ 2.96Å; K252-K255 PolarHBondContact O-N 3.4Å; K255-I258 HydrophobicContact CB-CD1 3.95Å; K255-I258 HydrophobicContact CB-CG1 4.21Å; K255-I258 WeakPolarHBondContact O-CD1 3.09Å; K255-I258 WeakPolarHBondContact O-CG1 3.26Å
256	H	75.9	Confident	87.6	Confident	175 Å²	175	55 Å²	55	81%	0.81	28%	0.276	S	S	*	.	S	Bend	trans	-79.5	154.1	168.7	-56.1	-68.4	0	0	0	108.9
257	D	78.4	Confident	87.5	Confident	173 Å²	173	54 Å²	54	93%	0.925	27%	0.271	S	S	*	.	S	Bend	trans	76.8	26.5	-175.4	-54.1	-25.7	0	0	0	117.7
258	I	74.7	Confident	87.4	Confident	47 Å²	47	55.4 Å²	55.4	24%	0.241	28%	0.283	C	S	.	.			trans	-90.1	129.4	-179.6	-59.6	170.9	0	0	0	112.1	A224 K252 K255	A224-I258 HydrophobicContact CB-CD1 4.32Å; A224-I258 HydrophobicContact CB-CG1 4.46Å; A224-I258 HydrophobicContact CB-CG2 3.35Å; K252-I258 WeakPolarHBondContact O-CD1 3.39Å; K255-I258 HydrophobicContact CB-CD1 3.95Å; K255-I258 HydrophobicContact CB-CG1 4.21Å; K255-I258 WeakPolarHBondContact O-CD1 3.09Å; K255-I258 WeakPolarHBondContact O-CG1 3.26Å
259	S	80.3	Confident	87.3	Confident	37 Å²	37	60.6 Å²	60.6	26%	0.259	32%	0.315	S	S	.	.			trans	-115.8	103.9	170.5	54.9	0	0	0	0	110.6	D261 K262	S259-D261 PolarHBondContact O-N 2.81Å; S259-K262 PolarHBondContact O-N 3.25Å; S259-K262 WeakPolarHBondContact OG-CD 3.49Å; S259-K262 WeakPolarHBondContact OG-CE 3.37Å; S259-K262 VanDerWaalsContact OG-CG 3.25Å; S259-K262 WeakPolarHBondContact OG-CG 3.25Å
260	M	82.2	Confident	87	Confident	65 Å²	65	65.2 Å²	65.2	32%	0.32	33%	0.333	S	S	.	.	H	α-helix	trans	-59	-36.8	177.5	-66	-174.9	174.3	0	0	112	I253 K262 V263 V264 P285	I253-M260 HydrophobicContact CG2-CE 4.02Å; M260-K262 PolarHBondContact O-N 3.31Å; M260-V263 WeakPolarHBondContact O-CB 3.47Å; M260-V263 PolarHBondContact O-N 3.16Å; M260-V264 WeakPolarHBondContact O-CG2 3.41Å; M260-V264 PolarHBondContact O-N 3.38Å; M260-P285 HydrophobicContact CE-CB 3.71Å; M260-P285 HydrophobicContact CE-CG 4.42Å
261	D	86.8	Confident	86.6	Confident	108 Å²	108	72.1 Å²	72.1	58%	0.578	37%	0.365	S	S	*	.	H	α-helix	trans	-57.3	-36.2	-178.8	-57.7	-18.2	0	0	0	112.9	S259 V263 V264 Q265	S259-D261 PolarHBondContact O-N 2.81Å; D261-V263 VanDerWaalsContact C-N 3.34Å; D261-V263 PolarHBondContact O-N 3.49Å; D261-V264 PolarHBondContact O-N 3.2Å; D261-Q265 VanDerWaalsContact O-CB 3.31Å; D261-Q265 WeakPolarHBondContact O-CB 3.21Å; D261-Q265 WeakPolarHBondContact O-CG 3.41Å; D261-Q265 PolarHBondContact O-N 3.32Å
262	K	87.1	Confident	86.4	Confident	150 Å²	150	71.9 Å²	71.9	65%	0.652	36%	0.364	S	S	*	.	H	α-helix	trans	-65.5	-39.2	178.2	-69	-174.1	-164.6	159.4	0	111.8	S259 M260 G266	S259-K262 PolarHBondContact O-N 3.25Å; S259-K262 WeakPolarHBondContact OG-CD 3.49Å; S259-K262 WeakPolarHBondContact OG-CE 3.37Å; S259-K262 VanDerWaalsContact OG-CG 3.25Å; S259-K262 WeakPolarHBondContact OG-CG 3.25Å; M260-K262 PolarHBondContact O-N 3.31Å; K262-G266 PolarHBondContact O-N 3.05Å
263	V	89.2	Confident	86.3	Confident	2 Å²	2	74.9 Å²	74.9	1%	0.012	38%	0.381	C	S	.	.	H	α-helix	trans	-67.5	-46	177.8	-177.1	0	0	0	0	109.6	V222 I250 M260 D261 G266 L267	V222-V263 HydrophobicContact CB-CG1 4.25Å; V222-V263 HydrophobicContact CG1-CG1 3.7Å; I250-V263 HydrophobicContact CD1-CG1 4.37Å; I250-V263 HydrophobicContact CG1-CG1 4.37Å; M260-V263 WeakPolarHBondContact O-CB 3.47Å; M260-V263 PolarHBondContact O-N 3.16Å; D261-V263 VanDerWaalsContact C-N 3.34Å; D261-V263 PolarHBondContact O-N 3.49Å; V263-G266 PolarHBondContact O-N 3.03Å; V263-L267 HydrophobicContact CG1-CD1 4.21Å; V263-L267 WeakPolarHBondContact O-CG 3.34Å; V263-L267 PolarHBondContact O-N 2.95Å
264	V	89.3	Confident	86.3	Confident	6 Å²	6	72.8 Å²	72.8	4%	0.036	37%	0.37	C	S	.	.	H	α-helix	trans	-62.4	-45	179.4	172.3	0	0	0	0	111.6	M260 D261 L267 A268 T274 L277	M260-V264 WeakPolarHBondContact O-CG2 3.41Å; M260-V264 PolarHBondContact O-N 3.38Å; D261-V264 PolarHBondContact O-N 3.2Å; V264-L267 PolarHBondContact O-N 3.48Å; V264-A268 WeakPolarHBondContact O-CB 3.39Å; V264-A268 PolarHBondContact O-N 2.9Å; V264-T274 WeakPolarHBondContact CG1-OG1 3.43Å; V264-L277 HydrophobicContact CG1-CD1 3.61Å; V264-L277 HydrophobicContact CG1-CD2 4.37Å; V264-L277 HydrophobicContact CG1-CG 3.74Å
265	Q	89.9	Confident	86.3	Confident	128 Å²	128	77.3 Å²	77.3	60%	0.598	39%	0.39	S	S	*	.	H	α-helix	trans	-64.6	-39.1	174.3	-71.9	173.4	8.1	0	0	112.2	D261 A268 T269	D261-Q265 VanDerWaalsContact O-CB 3.31Å; D261-Q265 WeakPolarHBondContact O-CB 3.21Å; D261-Q265 WeakPolarHBondContact O-CG 3.41Å; D261-Q265 PolarHBondContact O-N 3.32Å; Q265-A268 PolarHBondContact O-N 3.34Å; Q265-T269 PolarHBondContact O-N 3.48Å; Q265-T269 VanDerWaalsContact O-N 3.16Å; Q265-T269 PolarHBondContact O-OG1 3.41Å
266	G	90.3	Very high	86.3	Confident	21 Å²	21	78 Å²	78	22%	0.216	40%	0.395	C	S	.	.	H	α-helix	trans	-60.9	-44.3	175.1	0	0	0	0	0	112.3	K262 V263 T269 Y270	K262-G266 PolarHBondContact O-N 3.05Å; V263-G266 PolarHBondContact O-N 3.03Å; G266-T269 WeakPolarHBondContact O-CB 3.5Å; G266-T269 PolarHBondContact O-N 3Å; G266-Y270 VanDerWaalsContact O-CD2 3.28Å; G266-Y270 WeakPolarHBondContact O-CD2 3.47Å
267	L	91.8	Very high	86.8	Confident	0 Å²	0	74.5 Å²	74.5	0%	0	38%	0.381	C	S	.	.	H	α-helix	trans	-66.8	-40.2	176.4	-71.2	173.2	0	0	0	112.3	L220 V222 V228 I236 V248 V263 V264 T269 Y270 V272 T274	L220-L267 HydrophobicContact CD2-CD2 4.16Å; V222-L267 HydrophobicContact CG2-CD2 4.47Å; V228-L267 HydrophobicContact CG2-CD2 3.78Å; V228-L267 HydrophobicContact CG2-CG 3.97Å; I236-L267 HydrophobicContact CD1-CD2 4.21Å; V248-L267 HydrophobicContact CG1-CD1 3.83Å; V248-L267 HydrophobicContact CG2-CD1 4.36Å; V263-L267 HydrophobicContact CG1-CD1 4.21Å; V263-L267 WeakPolarHBondContact O-CG 3.34Å; V263-L267 PolarHBondContact O-N 2.95Å; V264-L267 PolarHBondContact O-N 3.48Å; L267-T269 PolarHBondContact O-N 2.95Å; L267-Y270 CarbonylContact O-C 3.55Å; L267-Y270 PolarHBondContact O-N 2.85Å; L267-V272 CarbonylContact C-O 3.47Å; L267-V272 HydrophobicContact CB-CB 4.1Å; L267-V272 HydrophobicContact CB-CG1 4.22Å; L267-V272 HydrophobicContact CD2-CB 4.43Å; L267-V272 HydrophobicContact CD2-CG1 4.29Å; L267-V272 PolarHBondContact O-N 3.39Å; L267-T274 HydrophobicContact CD1-CG2 4.17Å
268	A	91.1	Very high	87.1	Confident	31 Å²	31	69.6 Å²	69.6	26%	0.256	37%	0.372	S	S	.	.	H	α-helix	trans	-59.7	-33.7	177.1	0	0	0	0	0	112.5	V264 Q265 Y270 E271 V272 L273 L277	V264-A268 WeakPolarHBondContact O-CB 3.39Å; V264-A268 PolarHBondContact O-N 2.9Å; Q265-A268 PolarHBondContact O-N 3.34Å; A268-Y270 PolarHBondContact O-N 3.27Å; A268-E271 PolarHBondContact O-N 3.44Å; A268-E271 VanDerWaalsContact O-N 3.15Å; A268-V272 PolarHBondContact N-O 3.06Å; A268-L273 HydrophobicContact CB-CD2 4.36Å; A268-L277 HydrophobicContact CB-CD1 3.8Å
269	T	91.7	Very high	87.7	Confident	108 Å²	108	68 Å²	68	66%	0.663	37%	0.368	S	S	*	.	H	α-helix	trans	-62.1	-29.1	176.4	-55.3	0	0	0	0	112.4	Q265 G266 L267	Q265-T269 PolarHBondContact O-N 3.48Å; Q265-T269 VanDerWaalsContact O-N 3.16Å; Q265-T269 PolarHBondContact O-OG1 3.41Å; G266-T269 WeakPolarHBondContact O-CB 3.5Å; G266-T269 PolarHBondContact O-N 3Å; L267-T269 PolarHBondContact O-N 2.95Å
270	Y	88.3	Confident	88.1	Confident	97 Å²	97	73.9 Å²	73.9	38%	0.38	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	22.4	178.6	-63	-73.9	0	0	0	113.2	V228 V233 K240 G266 L267 A268 V272	V228-Y270 HydrophobicContact CB-CE2 4.47Å; V228-Y270 HydrophobicContact CG1-CD2 3.89Å; V228-Y270 HydrophobicContact CG1-CE2 3.71Å; V233-Y270 HydrophobicContact CB-CE1 4.41Å; V233-Y270 HydrophobicContact CG1-CD1 3.9Å; V233-Y270 HydrophobicContact CG1-CE1 3.72Å; V233-Y270 HydrophobicContact CG2-CD1 4.18Å; V233-Y270 HydrophobicContact CG2-CD2 4.15Å; V233-Y270 HydrophobicContact CG2-CE1 3.72Å; V233-Y270 HydrophobicContact CG2-CE2 3.69Å; V233-Y270 HydrophobicContact CG2-CG 4.38Å; V233-Y270 VanDerWaalsContact CG2-CZ 3.45Å; K240-Y270 PolarHBondContact NZ-O 2.94Å; G266-Y270 VanDerWaalsContact O-CD2 3.28Å; G266-Y270 WeakPolarHBondContact O-CD2 3.47Å; L267-Y270 CarbonylContact O-C 3.55Å; L267-Y270 PolarHBondContact O-N 2.85Å; A268-Y270 PolarHBondContact O-N 3.27Å; Y270-V272 PolarHBondContact O-N 2.98Å
271	E	86.6	Confident	88.5	Confident	148 Å²	148	72.3 Å²	72.3	69%	0.692	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.9	21.2	179.9	-43.9	169.6	154.2	0	0	114.1	K240 A268 L273	K240-E271 IonicContact NZ-OE2 2.92Å; K240-E271 PolarHBondContact NZ-OE2 3.48Å; A268-E271 PolarHBondContact O-N 3.44Å; A268-E271 VanDerWaalsContact O-N 3.15Å; E271-L273 PolarHBondContact O-N 3.01Å
272	V	88.3	Confident	88.6	Confident	1 Å²	1	68.6 Å²	68.6	1%	0.006	37%	0.367	C	S	.	.			trans	-95.5	88	171.5	178.6	0	0	0	0	107.4	I236 I246 V248 L267 A268 Y270 T274 I281	I236-V272 HydrophobicContact CD1-CG2 3.83Å; I236-V272 HydrophobicContact CG1-CG2 3.96Å; I236-V272 HydrophobicContact CG2-CG2 3.71Å; I246-V272 HydrophobicContact CD1-CG2 4.5Å; V248-V272 HydrophobicContact CG2-CG1 4.19Å; L267-V272 CarbonylContact C-O 3.47Å; L267-V272 HydrophobicContact CB-CB 4.1Å; L267-V272 HydrophobicContact CB-CG1 4.22Å; L267-V272 HydrophobicContact CD2-CB 4.43Å; L267-V272 HydrophobicContact CD2-CG1 4.29Å; L267-V272 PolarHBondContact O-N 3.39Å; A268-V272 PolarHBondContact N-O 3.06Å; Y270-V272 PolarHBondContact O-N 2.98Å; V272-T274 PolarHBondContact O-N 3.38Å; V272-I281 HydrophobicContact CB-CD1 4.19Å; V272-I281 HydrophobicContact CG1-CD1 3.54Å; V272-I281 HydrophobicContact CG1-CG2 4.23Å
273	L	89.9	Confident	88.9	Confident	93 Å²	93	62.2 Å²	62.2	49%	0.487	34%	0.343	S	S	.	.			trans	-82.6	110.8	-179.8	-63.4	175.7	0	0	0	110.2	A268 E271 G279 I281	A268-L273 HydrophobicContact CB-CD2 4.36Å; E271-L273 PolarHBondContact O-N 3.01Å; L273-G279 WeakPolarHBondContact O-CA 3.33Å; L273-I281 WeakPolarHBondContact O-CB 3.42Å; L273-I281 PolarHBondContact O-N 3.11Å
274	T	88.7	Confident	89	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	35%	0.346	C	S	.	.	B	Isolated β-bridge	trans	-76.9	158.3	177.9	65.8	0	0	0	0	112.2	V264 L267 V272 Q276 L277 G278 G279 I281 A283	V264-T274 WeakPolarHBondContact CG1-OG1 3.43Å; L267-T274 HydrophobicContact CD1-CG2 4.17Å; V272-T274 PolarHBondContact O-N 3.38Å; T274-Q276 PolarHBondContact O-N 3.45Å; T274-Q276 VanDerWaalsContact O-N 3.15Å; T274-L277 PolarHBondContact O-N 3.09Å; T274-G278 PolarHBondContact O-N 2.77Å; T274-G279 PolarHBondContact O-N 2.91Å; T274-I281 CarbonylContact C-O 3.56Å; T274-I281 VanDerWaalsContact CA-O 3.31Å; T274-I281 WeakPolarHBondContact CA-O 3.34Å; T274-A283 HydrophobicContact CG2-CB 3.9Å
275	E	87.7	Confident	89.2	Confident	132 Å²	132	64 Å²	64	62%	0.617	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-53.9	-33	177.5	-167.8	176.8	178.2	0	0	113.3	L277 G278 G279 I281	E275-L277 PolarHBondContact O-N 3.17Å; E275-G278 PolarHBondContact O-N 2.96Å; E275-G279 WeakPolarHBondContact CA-O 3.33Å; E275-I281 PolarHBondContact N-O 3.5Å
276	Q	83.7	Confident	89.3	Confident	117 Å²	117	57.9 Å²	57.9	55%	0.547	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-63.8	-27.8	176.5	-65.1	-176.4	-5.1	0	0	113.4	T274	T274-Q276 PolarHBondContact O-N 3.45Å; T274-Q276 VanDerWaalsContact O-N 3.15Å
277	L	87.3	Confident	89.4	Confident	100 Å²	100	56.9 Å²	56.9	52%	0.524	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-95	6.8	174.7	-64.7	177.4	0	0	0	112.4	V264 A268 T274 E275	V264-L277 HydrophobicContact CG1-CD1 3.61Å; V264-L277 HydrophobicContact CG1-CD2 4.37Å; V264-L277 HydrophobicContact CG1-CG 3.74Å; A268-L277 HydrophobicContact CB-CD1 3.8Å; T274-L277 PolarHBondContact O-N 3.09Å; E275-L277 PolarHBondContact O-N 3.17Å
278	G	84.6	Confident	89.2	Confident	70 Å²	70	57 Å²	57	72%	0.722	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.7	21.5	-176.4	0	0	0	0	0	114.5	T274 E275	T274-G278 PolarHBondContact O-N 2.77Å; E275-G278 PolarHBondContact O-N 2.96Å
279	G	87.3	Confident	88.9	Confident	15 Å²	15	61.7 Å²	61.7	16%	0.155	34%	0.337	C	S	.	.			trans	-90.5	174.8	172.9	0	0	0	0	0	113.7	L273 T274 E275	L273-G279 WeakPolarHBondContact O-CA 3.33Å; T274-G279 PolarHBondContact O-N 2.91Å; E275-G279 WeakPolarHBondContact CA-O 3.33Å
280	D	87.4	Confident	88.6	Confident	159 Å²	159	62.9 Å²	62.9	85%	0.85	33%	0.332	S	S	*	.	S	Bend	trans	-84.4	-9.1	-176.4	-57	-30.2	0	0	0	113.5
281	I	90.8	Very high	88.4	Confident	32 Å²	32	65.3 Å²	65.3	16%	0.164	34%	0.341	C	S	.	.	B	Isolated β-bridge	trans	-90.3	117.5	-172	-59.6	176.1	0	0	0	110.3	V248 V272 L273 T274 E275 A283	V248-I281 HydrophobicContact CG2-CG2 3.68Å; V272-I281 HydrophobicContact CB-CD1 4.19Å; V272-I281 HydrophobicContact CG1-CD1 3.54Å; V272-I281 HydrophobicContact CG1-CG2 4.23Å; L273-I281 WeakPolarHBondContact O-CB 3.42Å; L273-I281 PolarHBondContact O-N 3.11Å; T274-I281 CarbonylContact C-O 3.56Å; T274-I281 VanDerWaalsContact CA-O 3.31Å; T274-I281 WeakPolarHBondContact CA-O 3.34Å; E275-I281 PolarHBondContact N-O 3.5Å; I281-A283 PolarHBondContact O-N 3.23Å
282	Q	90.2	Very high	88.5	Confident	30 Å²	30	61.6 Å²	61.6	14%	0.14	33%	0.325	C	S	.	.			trans	-70.4	126.8	177.1	-64.2	175.6	38	0	0	110.5	V248 A300	V248-Q282 PolarHBondContact N-O 3.45Å; Q282-A300 VanDerWaalsContact OE1-CA 3.3Å
283	A	91.8	Very high	88.4	Confident	16 Å²	16	63.9 Å²	63.9	13%	0.132	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	106.5	178.8	0	0	0	0	0	110.2	V248 T274 I281	V248-A283 HydrophobicContact CB-CB 4.36Å; V248-A283 WeakPolarHBondContact O-CA 3.49Å; T274-A283 HydrophobicContact CG2-CB 3.9Å; I281-A283 PolarHBondContact O-N 3.23Å
284	V	92.8	Very high	88.2	Confident	15 Å²	15	60.1 Å²	60.1	9%	0.091	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	118.9	-176.8	-174	0	0	0	0	110.1	V248 A249 I250 I286 E296 L297 A300	V248-V284 PolarHBondContact O-N 3.32Å; A249-V284 WeakPolarHBondContact CA-O 3.44Å; I250-V284 PolarHBondContact N-O 2.83Å; V284-I286 HydrophobicContact CG1-CG2 3.88Å; V284-E296 HydrophobicContact CG1-CB 4.08Å; V284-L297 HydrophobicContact CB-CD1 4.15Å; V284-L297 HydrophobicContact CG1-CB 4.27Å; V284-L297 HydrophobicContact CG2-CD1 4.32Å; V284-A300 HydrophobicContact CG2-CB 3.97Å
285	P	93	Very high	88	Confident	31 Å²	31	63.2 Å²	63.2	20%	0.201	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	124.2	172.9	29.9	-31.3	0	0	0	110.6	I253 M260 N293	I253-P285 HydrophobicContact CG2-CB 4.01Å; M260-P285 HydrophobicContact CE-CB 3.71Å; M260-P285 HydrophobicContact CE-CG 4.42Å; P285-N293 VanDerWaalsContact O-CB 3.23Å; P285-N293 WeakPolarHBondContact O-CB 3.43Å; P285-N293 PolarHBondContact O-ND2 3.32Å
286	I	92.8	Very high	88.1	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	33%	0.331	C	S	.	.			trans	-131.9	155.6	-175.6	62.6	164.8	0	0	0	112.4	L144 A249 I250 N251 K252 I253 V284 N293 L297	L144-I286 HydrophobicContact CD1-CD1 3.3Å; L144-I286 HydrophobicContact CG-CD1 4.33Å; A249-I286 HydrophobicContact CB-CD1 3.76Å; A249-I286 HydrophobicContact CB-CG1 4.27Å; I250-I286 PolarHBondContact O-N 3.49Å; N251-I286 CarbonylContact C-O 3.53Å; N251-I286 WeakPolarHBondContact CA-O 3.28Å; N251-I286 HydrophobicContact CB-CD1 4.39Å; N251-I286 HydrophobicContact CB-CG1 4.21Å; K252-I286 PolarHBondContact N-O 2.93Å; I253-I286 WeakPolarHBondContact CG1-O 3.49Å; I253-I286 PolarHBondContact N-O 3.3Å; V284-I286 HydrophobicContact CG1-CG2 3.88Å; I286-N293 HydrophobicContact CG2-CB 4.16Å; I286-L297 HydrophobicContact CD1-CD2 4.19Å; I286-L297 HydrophobicContact CG2-CB 4.22Å; I286-L297 HydrophobicContact CG2-CD2 4.43Å
287	S	91.5	Very high	88.4	Confident	0 Å²	0	56 Å²	56	0%	0	31%	0.306	C	S	.	.	B	Isolated β-bridge	trans	-122.1	107.4	162.3	180	0	0	0	0	109	D254 L289 K290 R291 I292	D254-S287 PolarHBondContact OD1-OG 3.26Å; S287-L289 VanDerWaalsContact C-N 3.29Å; S287-L289 PolarHBondContact O-N 2.98Å; S287-K290 PolarHBondContact OG-N 3.26Å; S287-R291 WeakPolarHBondContact O-CA 3.36Å; S287-R291 PolarHBondContact O-N 3.19Å; S287-I292 PolarHBondContact N-O 3.33Å; S287-I292 PolarHBondContact O-N 3.02Å; S287-I292 VanDerWaalsContact O-N 3.13Å
288	A	87.5	Confident	88.5	Confident	3 Å²	3	51.5 Å²	51.5	3%	0.025	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-36.8	177.7	0	0	0	0	0	112.4	T143 L144 N251	T143-A288 HydrophobicContact CG2-CB 4.14Å; L144-A288 HydrophobicContact CB-CB 4.21Å; N251-A288 PolarHBondContact OD1-N 2.69Å
289	L	85.1	Confident	88.7	Confident	129 Å²	129	52.6 Å²	52.6	68%	0.675	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-48.6	-179.2	-69.5	175.7	0	0	0	112.4	T143 S287 R291	T143-L289 HydrophobicContact CG2-CD2 3.84Å; S287-L289 VanDerWaalsContact C-N 3.29Å; S287-L289 PolarHBondContact O-N 2.98Å; L289-R291 VanDerWaalsContact C-N 3.28Å; L289-R291 PolarHBondContact O-N 3.27Å
290	K	85.5	Confident	88.8	Confident	132 Å²	132	52.2 Å²	52.2	57%	0.574	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-5.4	179.7	-65.7	-174.8	-179.5	168	0	113.4	D254 S287 I292	D254-K290 HydrophobicContact CB-CD 3.8Å; D254-K290 HydrophobicContact CB-CG 4.29Å; S287-K290 PolarHBondContact OG-N 3.26Å; K290-I292 VanDerWaalsContact C-N 3.28Å; K290-I292 HydrophobicContact CB-CD1 3.64Å; K290-I292 HydrophobicContact CB-CG1 3.77Å; K290-I292 HydrophobicContact CD-CD1 3.92Å; K290-I292 HydrophobicContact CG-CD1 4.43Å; K290-I292 PolarHBondContact O-N 2.97Å
291	R	84.5	Confident	89	Confident	149 Å²	149	44.7 Å²	44.7	56%	0.562	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.8	40.5	-175.1	-57	-176.9	176.5	-179	-4.3	113	A147 S287 L289 L294	A147-R291 HydrophobicContact CB-CG 4.29Å; S287-R291 WeakPolarHBondContact O-CA 3.36Å; S287-R291 PolarHBondContact O-N 3.19Å; L289-R291 VanDerWaalsContact C-N 3.28Å; L289-R291 PolarHBondContact O-N 3.27Å; R291-L294 HydrophobicContact CB-CD1 3.85Å; R291-L294 HydrophobicContact CG-CD1 4.1Å
292	I	87.8	Confident	88.9	Confident	70 Å²	70	44.4 Å²	44.4	36%	0.359	23%	0.225	S	C	.	.	B	Isolated β-bridge	trans	-91	137.2	177.7	-60.6	170	0	0	0	108.7	I253 S287 K290 L294	I253-I292 HydrophobicContact CD1-CG2 4.16Å; S287-I292 PolarHBondContact N-O 3.33Å; S287-I292 PolarHBondContact O-N 3.02Å; S287-I292 VanDerWaalsContact O-N 3.13Å; K290-I292 VanDerWaalsContact C-N 3.28Å; K290-I292 HydrophobicContact CB-CD1 3.64Å; K290-I292 HydrophobicContact CB-CG1 3.77Å; K290-I292 HydrophobicContact CD-CD1 3.92Å; K290-I292 HydrophobicContact CG-CD1 4.43Å; K290-I292 PolarHBondContact O-N 2.97Å; I292-L294 VanDerWaalsContact C-N 3.25Å; I292-L294 PolarHBondContact O-N 2.93Å
293	N	86.6	Confident	88.9	Confident	48 Å²	48	47 Å²	47	26%	0.257	24%	0.239	S	C	.	.	S	Bend	trans	60.1	22.9	176.2	-63.6	2.7	0	0	0	116	P285 I286 S295 E296 L297	P285-N293 VanDerWaalsContact O-CB 3.23Å; P285-N293 WeakPolarHBondContact O-CB 3.43Å; P285-N293 PolarHBondContact O-ND2 3.32Å; I286-N293 HydrophobicContact CG2-CB 4.16Å; N293-S295 VanDerWaalsContact C-N 3.34Å; N293-E296 HydrophobicContact CB-CB 4.47Å; N293-E296 VanDerWaalsContact CG-OE2 3.24Å; N293-E296 PolarHBondContact ND2-OE2 2.89Å; N293-L297 PolarHBondContact O-N 3.36Å
294	L	85.4	Confident	88.8	Confident	15 Å²	15	47.8 Å²	47.8	8%	0.079	24%	0.24	C	C	.	.	H	α-helix	trans	-69.3	-32.4	174.4	-63.2	-179.4	0	0	0	112.4	A147 R291 I292 L297 L298	A147-L294 HydrophobicContact CB-CD1 3.84Å; R291-L294 HydrophobicContact CB-CD1 3.85Å; R291-L294 HydrophobicContact CG-CD1 4.1Å; I292-L294 VanDerWaalsContact C-N 3.25Å; I292-L294 PolarHBondContact O-N 2.93Å; L294-L297 PolarHBondContact O-N 3.04Å; L294-L298 VanDerWaalsContact O-CG 3.3Å; L294-L298 WeakPolarHBondContact O-CG 3.38Å; L294-L298 PolarHBondContact O-N 3.35Å; L294-L298 VanDerWaalsContact O-N 3.1Å
295	S	85	Confident	88.7	Confident	65 Å²	65	47.7 Å²	47.7	46%	0.455	24%	0.241	S	C	.	.	H	α-helix	trans	-65	-47.5	174.7	50.3	0	0	0	0	111.4	N293 L297 L298 D299	N293-S295 VanDerWaalsContact C-N 3.34Å; S295-L297 VanDerWaalsContact C-N 3.26Å; S295-L297 PolarHBondContact O-N 3.13Å; S295-L298 PolarHBondContact O-N 3.09Å; S295-D299 VanDerWaalsContact O-CG 3.25Å; S295-D299 PolarHBondContact O-N 3.35Å
296	E	88.5	Confident	88.5	Confident	96 Å²	96	52.3 Å²	52.3	45%	0.449	26%	0.26	S	S	.	.	H	α-helix	trans	-58.5	-38.8	177.2	-64.3	179.5	173.9	0	0	111.8	V284 N293 D299 A300	V284-E296 HydrophobicContact CG1-CB 4.08Å; N293-E296 HydrophobicContact CB-CB 4.47Å; N293-E296 VanDerWaalsContact CG-OE2 3.24Å; N293-E296 PolarHBondContact ND2-OE2 2.89Å; E296-D299 PolarHBondContact O-N 3.18Å; E296-A300 WeakPolarHBondContact O-CB 3.29Å; E296-A300 PolarHBondContact O-N 3.41Å
297	L	90.9	Very high	88.3	Confident	1 Å²	1	58.1 Å²	58.1	1%	0.005	29%	0.29	C	S	.	.	H	α-helix	trans	-65.7	-41.6	175.2	-179	66	0	0	0	112.4	L144 L219 V247 A249 V284 I286 N293 L294 S295 A300 I301	L144-L297 HydrophobicContact CD1-CD2 4.09Å; L219-L297 HydrophobicContact CD1-CD1 3.82Å; L219-L297 HydrophobicContact CD1-CD2 4.5Å; L219-L297 HydrophobicContact CD2-CD2 4.24Å; V247-L297 HydrophobicContact CG1-CD1 4.28Å; A249-L297 HydrophobicContact CB-CD1 4.08Å; A249-L297 HydrophobicContact CB-CD2 4.24Å; V284-L297 HydrophobicContact CB-CD1 4.15Å; V284-L297 HydrophobicContact CG1-CB 4.27Å; V284-L297 HydrophobicContact CG2-CD1 4.32Å; I286-L297 HydrophobicContact CD1-CD2 4.19Å; I286-L297 HydrophobicContact CG2-CB 4.22Å; I286-L297 HydrophobicContact CG2-CD2 4.43Å; N293-L297 PolarHBondContact O-N 3.36Å; L294-L297 PolarHBondContact O-N 3.04Å; S295-L297 VanDerWaalsContact C-N 3.26Å; S295-L297 PolarHBondContact O-N 3.13Å; L297-A300 PolarHBondContact O-N 3.39Å; L297-I301 HydrophobicContact CG-CD1 4.27Å; L297-I301 VanDerWaalsContact O-CG1 3.3Å; L297-I301 WeakPolarHBondContact O-CG1 3.11Å; L297-I301 PolarHBondContact O-N 2.68Å; L297-I301 VanDerWaalsContact O-N 3.1Å
298	L	89.1	Confident	88.1	Confident	5 Å²	5	61.5 Å²	61.5	3%	0.026	31%	0.307	C	S	.	.	H	α-helix	trans	-66.4	-41.7	177	-69.3	167.8	0	0	0	110.8	L148 L172 V175 I193 F195 L294 S295 A300 I301 I302	L148-L298 HydrophobicContact CD2-CD1 3.95Å; L148-L298 HydrophobicContact CD2-CD2 4.08Å; L148-L298 HydrophobicContact CD2-CG 4.2Å; L172-L298 HydrophobicContact CD2-CB 3.96Å; L172-L298 HydrophobicContact CD2-CD1 3.78Å; L172-L298 HydrophobicContact CD2-CD2 4Å; L172-L298 HydrophobicContact CD2-CG 4.13Å; V175-L298 HydrophobicContact CB-CD1 4.42Å; V175-L298 HydrophobicContact CG1-CD1 4Å; V175-L298 HydrophobicContact CG2-CD1 4.44Å; I193-L298 HydrophobicContact CD1-CD2 3.88Å; F195-L298 HydrophobicContact CE2-CD2 4.39Å; F195-L298 HydrophobicContact CZ-CD2 3.97Å; L294-L298 VanDerWaalsContact O-CG 3.3Å; L294-L298 WeakPolarHBondContact O-CG 3.38Å; L294-L298 PolarHBondContact O-N 3.35Å; L294-L298 VanDerWaalsContact O-N 3.1Å; S295-L298 PolarHBondContact O-N 3.09Å; L298-A300 VanDerWaalsContact C-N 3.35Å; L298-A300 PolarHBondContact O-N 3.45Å; L298-I301 PolarHBondContact O-N 3.37Å; L298-I302 VanDerWaalsContact O-CD1 3.24Å; L298-I302 WeakPolarHBondContact O-CD1 3.44Å; L298-I302 WeakPolarHBondContact O-CG1 3.4Å; L298-I302 PolarHBondContact O-N 3.3Å
299	D	88.5	Confident	88.1	Confident	93 Å²	93	67.5 Å²	67.5	50%	0.497	33%	0.334	S	S	.	.	H	α-helix	trans	-61.8	-42.1	176.2	-66.1	-23.5	0	0	0	111.3	S295 E296 I301 I302 L303	S295-D299 VanDerWaalsContact O-CG 3.25Å; S295-D299 PolarHBondContact O-N 3.35Å; E296-D299 PolarHBondContact O-N 3.18Å; D299-I301 PolarHBondContact O-N 3.27Å; D299-I302 PolarHBondContact O-N 2.89Å; D299-L303 WeakPolarHBondContact O-CB 3.26Å; D299-L303 PolarHBondContact O-N 3.43Å
300	A	89.9	Confident	88.2	Confident	7 Å²	7	62.5 Å²	62.5	6%	0.058	31%	0.308	C	S	.	.	H	α-helix	trans	-58.6	-44.9	173.3	0	0	0	0	0	112.6	Q282 V284 E296 L297 L298 L303 Q304	Q282-A300 VanDerWaalsContact OE1-CA 3.3Å; V284-A300 HydrophobicContact CG2-CB 3.97Å; E296-A300 WeakPolarHBondContact O-CB 3.29Å; E296-A300 PolarHBondContact O-N 3.41Å; L297-A300 PolarHBondContact O-N 3.39Å; L298-A300 VanDerWaalsContact C-N 3.35Å; L298-A300 PolarHBondContact O-N 3.45Å; A300-L303 PolarHBondContact O-N 3.02Å; A300-Q304 WeakPolarHBondContact O-CB 3.12Å; A300-Q304 PolarHBondContact O-N 3.41Å
301	I	91.2	Very high	88.3	Confident	1 Å²	1	61 Å²	61	1%	0.005	30%	0.302	C	S	.	.	H	α-helix	trans	-64.8	-41.9	177.3	-69.2	166.8	0	0	0	111.1	V131 I193 F195 I217 L219 L297 L298 D299 Q304 A305	V131-I301 HydrophobicContact CG2-CG2 3.68Å; I193-I301 HydrophobicContact CD1-CG2 4Å; I193-I301 HydrophobicContact CG2-CG2 4.46Å; F195-I301 HydrophobicContact CE1-CD1 4.16Å; F195-I301 HydrophobicContact CZ-CD1 4.32Å; I217-I301 HydrophobicContact CD1-CG2 4.4Å; L219-I301 HydrophobicContact CD2-CD1 4.43Å; L297-I301 HydrophobicContact CG-CD1 4.27Å; L297-I301 VanDerWaalsContact O-CG1 3.3Å; L297-I301 WeakPolarHBondContact O-CG1 3.11Å; L297-I301 PolarHBondContact O-N 2.68Å; L297-I301 VanDerWaalsContact O-N 3.1Å; L298-I301 PolarHBondContact O-N 3.37Å; D299-I301 PolarHBondContact O-N 3.27Å; I301-Q304 PolarHBondContact O-N 3.45Å; I301-A305 WeakPolarHBondContact O-CB 3.37Å; I301-A305 PolarHBondContact O-N 2.92Å
302	I	89.6	Confident	88.4	Confident	27 Å²	27	54.1 Å²	54.1	14%	0.138	28%	0.277	C	S	.	.	H	α-helix	trans	-66.3	-45.9	179.1	-65.1	155.4	0	0	0	110.2	L172 I193 L298 D299 Q304 A305 E306	L172-I302 HydrophobicContact CD1-CD1 3.19Å; L172-I302 HydrophobicContact CD1-CG1 4.03Å; L172-I302 HydrophobicContact CD2-CD1 4.23Å; L172-I302 HydrophobicContact CG-CD1 4.34Å; I193-I302 HydrophobicContact CD1-CG1 4.09Å; L298-I302 VanDerWaalsContact O-CD1 3.24Å; L298-I302 WeakPolarHBondContact O-CD1 3.44Å; L298-I302 WeakPolarHBondContact O-CG1 3.4Å; L298-I302 PolarHBondContact O-N 3.3Å; D299-I302 PolarHBondContact O-N 2.89Å; I302-Q304 VanDerWaalsContact C-N 3.28Å; I302-Q304 PolarHBondContact O-N 2.94Å; I302-A305 CarbonylContact O-C 3.49Å; I302-A305 WeakPolarHBondContact O-CA 3.5Å; I302-A305 WeakPolarHBondContact O-CB 3.41Å; I302-A305 PolarHBondContact O-N 2.94Å; I302-E306 HydrophobicContact CG2-CG 4.38Å; I302-E306 WeakPolarHBondContact O-CG 3.34Å; I302-E306 PolarHBondContact O-N 3.38Å
303	L	90.2	Very high	88.5	Confident	83 Å²	83	51.2 Å²	51.2	44%	0.435	26%	0.262	S	S	.	.	H	α-helix	trans	-56.7	-46.4	176.2	-170.1	165.4	0	0	0	110.1	D299 A300 A305 E306 L307	D299-L303 WeakPolarHBondContact O-CB 3.26Å; D299-L303 PolarHBondContact O-N 3.43Å; A300-L303 PolarHBondContact O-N 3.02Å; L303-A305 VanDerWaalsContact C-N 3.31Å; L303-A305 PolarHBondContact O-N 3.42Å; L303-E306 PolarHBondContact O-N 3.43Å; L303-L307 HydrophobicContact CD2-CD1 3.55Å; L303-L307 HydrophobicContact CD2-CG 3.98Å; L303-L307 WeakPolarHBondContact O-CG 3.42Å; L303-L307 PolarHBondContact O-N 2.78Å
304	Q	90.3	Very high	88.6	Confident	34 Å²	34	50.6 Å²	50.6	16%	0.159	26%	0.257	C	S	.	.	H	α-helix	trans	-61.1	-39.5	176.1	-170.3	64.2	17.8	0	0	112.2	I217 V247 A300 I301 I302 L307 M308	I217-Q304 HydrophobicContact CD1-CB 4.06Å; I217-Q304 HydrophobicContact CD1-CG 3.99Å; I217-Q304 HydrophobicContact CG1-CG 4.2Å; V247-Q304 HydrophobicContact CG2-CB 4.38Å; V247-Q304 HydrophobicContact CG2-CG 4.32Å; A300-Q304 WeakPolarHBondContact O-CB 3.12Å; A300-Q304 PolarHBondContact O-N 3.41Å; I301-Q304 PolarHBondContact O-N 3.45Å; I302-Q304 VanDerWaalsContact C-N 3.28Å; I302-Q304 PolarHBondContact O-N 2.94Å; Q304-L307 PolarHBondContact O-N 2.91Å; Q304-M308 WeakPolarHBondContact O-CG 3.36Å; Q304-M308 PolarHBondContact O-N 3.49Å
305	A	89.4	Confident	88.6	Confident	12 Å²	12	55.2 Å²	55.2	10%	0.099	29%	0.286	C	S	.	.	H	α-helix	trans	-67.8	-36.1	176.5	0	0	0	0	0	112.9	P129 I217 I301 I302 L303 M308 E309 L310	P129-A305 HydrophobicContact CB-CB 3.74Å; P129-A305 HydrophobicContact CG-CB 3.86Å; I217-A305 HydrophobicContact CD1-CB 4.02Å; I301-A305 WeakPolarHBondContact O-CB 3.37Å; I301-A305 PolarHBondContact O-N 2.92Å; I302-A305 CarbonylContact O-C 3.49Å; I302-A305 WeakPolarHBondContact O-CA 3.5Å; I302-A305 WeakPolarHBondContact O-CB 3.41Å; I302-A305 PolarHBondContact O-N 2.94Å; L303-A305 VanDerWaalsContact C-N 3.31Å; L303-A305 PolarHBondContact O-N 3.42Å; A305-M308 PolarHBondContact O-N 3.18Å; A305-E309 PolarHBondContact O-N 2.94Å; A305-L310 HydrophobicContact CB-CD1 4.15Å
306	E	88.2	Confident	88.5	Confident	129 Å²	129	53 Å²	53	60%	0.603	27%	0.274	S	S	*	.	H	α-helix	trans	-66.5	-42.2	175.5	-73.8	-177.6	173.7	0	0	111.4	I302 L303 M308 E309	I302-E306 HydrophobicContact CG2-CG 4.38Å; I302-E306 WeakPolarHBondContact O-CG 3.34Å; I302-E306 PolarHBondContact O-N 3.38Å; L303-E306 PolarHBondContact O-N 3.43Å; E306-M308 PolarHBondContact O-N 3.47Å; E306-E309 PolarHBondContact O-N 2.86Å; E306-E309 VanDerWaalsContact O-N 3.11Å
307	L	89.7	Confident	88.5	Confident	122 Å²	122	51.6 Å²	51.6	64%	0.639	27%	0.269	S	S	*	.	H	α-helix	trans	-60.2	-31.1	174.4	-72.4	175.4	0	0	0	112.9	L303 Q304	L303-L307 HydrophobicContact CD2-CD1 3.55Å; L303-L307 HydrophobicContact CD2-CG 3.98Å; L303-L307 WeakPolarHBondContact O-CG 3.42Å; L303-L307 PolarHBondContact O-N 2.78Å; Q304-L307 PolarHBondContact O-N 2.91Å
308	M	86.8	Confident	88.5	Confident	71 Å²	71	51.8 Å²	51.8	35%	0.35	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-9.2	178.8	-68	178.1	76.4	0	0	114.1	D216 I217 P245 Q304 A305 E306 L310	D216-M308 HydrophobicContact CB-CE 4.4Å; I217-M308 HydrophobicContact CD1-SD 4.46Å; I217-M308 HydrophobicContact CG1-SD 3.96Å; P245-M308 HydrophobicContact CG-CE 3.9Å; P245-M308 HydrophobicContact CG-SD 3.59Å; P245-M308 VanDerWaalsContact CG-SD 3.59Å; Q304-M308 WeakPolarHBondContact O-CG 3.36Å; Q304-M308 PolarHBondContact O-N 3.49Å; A305-M308 PolarHBondContact O-N 3.18Å; E306-M308 PolarHBondContact O-N 3.47Å; M308-L310 HydrophobicContact CB-CD2 3.93Å; M308-L310 HydrophobicContact CB-CG 4.13Å; M308-L310 HydrophobicContact CE-CD2 4.16Å; M308-L310 PolarHBondContact O-N 3.35Å
309	E	87.2	Confident	88.7	Confident	128 Å²	128	52.3 Å²	52.3	60%	0.598	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	44.5	54.3	-174.4	-62.6	-168.2	-175.3	0	0	113.7	A305 E306 K311	A305-E309 PolarHBondContact O-N 2.94Å; E306-E309 PolarHBondContact O-N 2.86Å; E306-E309 VanDerWaalsContact O-N 3.11Å; E309-K311 WeakPolarHBondContact O-CG 3.47Å; E309-K311 PolarHBondContact O-N 2.95Å; E309-K311 IonicContact OE2-NZ 3.7Å; E309-K311 PolarHBondContact OE2-NZ 3.08Å
310	L	87.3	Confident	88.9	Confident	24 Å²	24	48 Å²	48	13%	0.126	25%	0.251	C	S	.	.			trans	-62.1	111.4	-176.4	-61.4	179	0	0	0	112.1	P126 R127 P129 D216 A305 M308	P126-L310 WeakPolarHBondContact CA-O 3.31Å; R127-L310 HydrophobicContact CG-CB 4.33Å; R127-L310 PolarHBondContact N-O 3.42Å; R127-L310 VanDerWaalsContact N-O 3.14Å; P129-L310 HydrophobicContact CB-CD1 3.72Å; D216-L310 HydrophobicContact CB-CD1 4.05Å; D216-L310 HydrophobicContact CB-CD2 4.15Å; A305-L310 HydrophobicContact CB-CD1 4.15Å; M308-L310 HydrophobicContact CB-CD2 3.93Å; M308-L310 HydrophobicContact CB-CG 4.13Å; M308-L310 HydrophobicContact CE-CD2 4.16Å; M308-L310 PolarHBondContact O-N 3.35Å
311	K	87.5	Confident	89.1	Confident	102 Å²	102	48.8 Å²	48.8	44%	0.443	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	151.5	178.9	-59.8	160.5	178.5	155.5	0	111.8	C124 E125 E309	C124-K311 HydrophobicContact CB-CB 3.63Å; C124-K311 HydrophobicContact CB-CD 4.39Å; C124-K311 HydrophobicContact CB-CG 4.45Å; E125-K311 CarbonylContact O-C 3.55Å; E125-K311 VanDerWaalsContact O-CA 3.23Å; E125-K311 WeakPolarHBondContact O-CA 3.49Å; E309-K311 WeakPolarHBondContact O-CG 3.47Å; E309-K311 PolarHBondContact O-N 2.95Å; E309-K311 IonicContact OE2-NZ 3.7Å; E309-K311 PolarHBondContact OE2-NZ 3.08Å
312	A	87.4	Confident	89.2	Confident	4 Å²	4	48.8 Å²	48.8	3%	0.033	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	162.8	175.7	0	0	0	0	0	112.8	C124 E125 R127 H314 P378	C124-A312 CarbonylContact C-O 3.59Å; C124-A312 WeakPolarHBondContact CA-O 3.25Å; E125-A312 PolarHBondContact N-O 3.4Å; E125-A312 PolarHBondContact O-N 2.92Å; R127-A312 HydrophobicContact CB-CB 4.06Å; R127-A312 HydrophobicContact CG-CB 4.01Å; A312-H314 PolarHBondContact O-CD2 2.81Å; A312-P378 HydrophobicContact CB-CB 3.85Å; A312-P378 HydrophobicContact CB-CG 3.91Å
313	D	90.5	Very high	89.3	Confident	9 Å²	9	47.8 Å²	47.8	5%	0.048	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	124.7	173.9	175.3	17.2	0	0	0	109.7	R116 C119 T315 G316 G342	R116-D313 IonicContact CZ-OD2 3.49Å; R116-D313 IonicContact NH1-OD2 3.46Å; R116-D313 PolarHBondContact NH1-OD2 3.48Å; R116-D313 VanDerWaalsContact NH1-OD2 3.08Å; R116-D313 IonicContact NH2-OD2 3.84Å; R116-D313 PolarHBondContact NH2-OD2 2.92Å; C119-D313 HydrophobicContact CB-CB 4.2Å; D313-T315 PolarHBondContact OD1-N 3.49Å; D313-T315 PolarHBondContact OD1-OG1 2.93Å; D313-G316 PolarHBondContact OD1-N 3.21Å; D313-G316 VanDerWaalsContact OD1-N 3.15Å; D313-G316 WeakPolarHBondContact OD2-CA 3.37Å; D313-G316 PolarHBondContact OD2-N 3.25Å; D313-G342 WeakPolarHBondContact O-CA 3.39Å; D313-G342 PolarHBondContact O-N 3.34Å
314	H	87.3	Confident	89.4	Confident	34 Å²	34	44.6 Å²	44.6	16%	0.157	23%	0.232	C	C	.	.	S	Bend	trans	-100.8	-5.9	176.4	-72.7	-128.4	0	0	0	112.9	E125 A312 V343 P378	E125-H314 IonicContact OE2-CD2 3.42Å; E125-H314 IonicContact OE2-CE1 2.85Å; E125-H314 IonicContact OE2-CG 3.88Å; E125-H314 IonicContact OE2-ND1 2.81Å; E125-H314 PolarHBondContact OE2-ND1 2.88Å; A312-H314 PolarHBondContact O-CD2 2.81Å; H314-V343 WeakPolarHBondContact O-CG2 3.31Å; H314-P378 WeakPolarHBondContact NE2-CG 3.34Å
315	T	85.8	Confident	89.5	Confident	112 Å²	112	43 Å²	43	69%	0.687	23%	0.225	S	C	*	.	S	Bend	trans	-101.4	-25.9	-173.3	63.5	0	0	0	0	113.4	D313	D313-T315 PolarHBondContact OD1-N 3.49Å; D313-T315 PolarHBondContact OD1-OG1 2.93Å
316	G	83.6	Confident	89.7	Confident	19 Å²	19	43.8 Å²	43.8	20%	0.196	23%	0.227	C	C	.	.	S	Bend	trans	-83	179.5	-174.8	0	0	0	0	0	116.2	D313 G342	D313-G316 PolarHBondContact OD1-N 3.21Å; D313-G316 VanDerWaalsContact OD1-N 3.15Å; D313-G316 WeakPolarHBondContact OD2-CA 3.37Å; D313-G316 PolarHBondContact OD2-N 3.25Å; G316-G342 WeakPolarHBondContact O-CA 3.36Å
317	L	88.9	Confident	89.8	Confident	67 Å²	67	39.4 Å²	39.4	35%	0.351	21%	0.209	S	C	.	.			trans	-59.1	141.9	172.4	-64.9	174.9	0	0	0	111	R116 E319 E399	R116-L317 PolarHBondContact NH2-O 3.05Å; L317-E319 PolarHBondContact O-N 2.78Å; L317-E399 HydrophobicContact CB-CB 4.21Å; L317-E399 HydrophobicContact CD2-CG 4.16Å
318	A	91.1	Very high	89.7	Confident	4 Å²	4	36.2 Å²	36.2	3%	0.033	19%	0.192	C	C	.	.			trans	-66.4	128.2	-178.6	0	0	0	0	0	111.4	R341 L344 E399	A318-R341 CarbonylContact C-O 3.57Å; A318-R341 WeakPolarHBondContact CA-O 3.43Å; A318-L344 HydrophobicContact CB-CB 3.94Å; A318-L344 HydrophobicContact CB-CD1 4.09Å; A318-E399 HydrophobicContact CB-CB 4.16Å; A318-E399 VanDerWaalsContact CB-OE2 3.32Å; A318-E399 WeakPolarHBondContact CB-OE2 3.49Å; A318-E399 PolarHBondContact N-OE2 3.29Å; A318-E399 WeakPolarHBondContact O-CB 3.39Å; A318-E399 PolarHBondContact O-N 3.42Å
319	E	92.7	Very high	89.7	Confident	17 Å²	17	41.7 Å²	41.7	8%	0.079	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	134.8	170.6	-61.2	179.9	175.2	0	0	108.4	R116 L317 T340 R341 I397 L398	R116-E319 WeakPolarHBondContact CB-OE1 3.48Å; R116-E319 WeakPolarHBondContact CG-OE1 3.39Å; R116-E319 PolarHBondContact N-OE1 3.48Å; R116-E319 IonicContact NE-OE1 3.86Å; R116-E319 PolarHBondContact NE-OE1 3Å; L317-E319 PolarHBondContact O-N 2.78Å; E319-T340 PolarHBondContact O-N 2.69Å; E319-T340 PolarHBondContact O-OG1 2.87Å; E319-R341 HydrophobicContact CB-CB 4.27Å; E319-R341 PolarHBondContact N-O 3.09Å; E319-R341 PolarHBondContact O-N 3.03Å; E319-R341 VanDerWaalsContact O-N 3.12Å; E319-R341 IonicContact OE2-NH1 2.76Å; E319-I397 VanDerWaalsContact CA-O 3.32Å; E319-I397 WeakPolarHBondContact CA-O 3.19Å; E319-L398 HydrophobicContact CB-CD2 4.49Å; E319-L398 HydrophobicContact CG-CD2 3.93Å
320	G	92.2	Very high	89.6	Confident	3 Å²	3	39.3 Å²	39.3	3%	0.031	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	-177.1	-176.3	0	0	0	0	0	113.5	L338 L396 I397	G320-L338 CarbonylContact C-O 3.52Å; G320-L338 WeakPolarHBondContact CA-O 3.01Å; G320-L396 WeakPolarHBondContact O-CA 3.45Å; G320-I397 PolarHBondContact N-O 3.17Å; G320-I397 PolarHBondContact O-N 2.93Å
321	V	93.7	Very high	89.6	Confident	22 Å²	22	41.5 Å²	41.5	13%	0.133	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	135.3	176.6	-176.9	0	0	0	0	108.2	L323 L338 T340 L396	V321-L323 PolarHBondContact O-N 2.88Å; V321-L338 PolarHBondContact N-O 3.01Å; V321-L338 PolarHBondContact O-N 3.3Å; V321-T340 HydrophobicContact CG2-CG2 4.29Å; V321-L396 HydrophobicContact CG2-CD2 4.07Å
322	V	94.2	Very high	89.8	Confident	1 Å²	1	38.3 Å²	38.3	1%	0.006	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	119.7	169.8	-179.2	0	0	0	0	108.5	A335 A355 P391 G394 D395 I397	V322-A335 HydrophobicContact CG1-CB 4.2Å; V322-A355 HydrophobicContact CG2-CB 4.07Å; V322-P391 HydrophobicContact CG1-CG 4.21Å; V322-P391 HydrophobicContact CG2-CB 4.09Å; V322-P391 HydrophobicContact CG2-CG 4.19Å; V322-G394 WeakPolarHBondContact O-CA 3.36Å; V322-G394 PolarHBondContact O-N 3.45Å; V322-D395 HydrophobicContact CG2-CB 4.48Å; V322-D395 PolarHBondContact N-O 3.23Å; V322-I397 HydrophobicContact CG2-CD1 3.67Å; V322-I397 HydrophobicContact CG2-CG1 3.55Å
323	L	91.9	Very high	90	Very high	6 Å²	6	41.7 Å²	41.7	3%	0.031	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	-56	173.4	-63	179.4	0	0	0	110.1	L165 A167 L196 A214 V321 T336 L338 V381 A393	L165-L323 HydrophobicContact CD2-CB 4.02Å; L165-L323 HydrophobicContact CD2-CD2 4.35Å; A167-L323 HydrophobicContact CB-CD1 3.76Å; L196-L323 HydrophobicContact CD1-CD2 4.17Å; L196-L323 HydrophobicContact CD2-CD1 3.76Å; A214-L323 HydrophobicContact CB-CD2 4.23Å; V321-L323 PolarHBondContact O-N 2.88Å; L323-T336 HydrophobicContact CB-CG2 4.48Å; L323-T336 HydrophobicContact CD1-CG2 4.37Å; L323-T336 PolarHBondContact N-O 2.66Å; L323-L338 HydrophobicContact CD1-CB 4.06Å; L323-L338 HydrophobicContact CD2-CB 4.21Å; L323-L338 HydrophobicContact CD2-CD2 4.27Å; L323-L338 HydrophobicContact CG-CB 4.02Å; L323-V381 HydrophobicContact CD1-CG1 4.38Å; L323-V381 HydrophobicContact CD1-CG2 4.2Å; L323-A393 VanDerWaalsContact O-CB 3.27Å; L323-A393 WeakPolarHBondContact O-CB 3.24Å
324	E	91.5	Very high	90.2	Very high	16 Å²	16	41.2 Å²	41.2	8%	0.075	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	154.8	179.9	-75.5	-164.2	150.9	0	0	111.7	L165 A335 T336 V487	L165-E324 HydrophobicContact CB-CG 3.87Å; L165-E324 WeakPolarHBondContact CB-OE1 3.22Å; L165-E324 HydrophobicContact CD2-CG 4.42Å; L165-E324 PolarHBondContact N-OE1 3.02Å; E324-A335 CarbonylContact O-C 3.57Å; E324-A335 VanDerWaalsContact O-CA 3.3Å; E324-A335 WeakPolarHBondContact O-CA 3.45Å; E324-T336 PolarHBondContact N-O 3.24Å; E324-T336 PolarHBondContact O-N 3.43Å; E324-V487 HydrophobicContact CB-CG1 3.82Å; E324-V487 VanDerWaalsContact CD-CG1 3.5Å; E324-V487 HydrophobicContact CG-CG1 3.95Å
325	S	93.3	Very high	90.5	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	135.6	174.4	55.7	0	0	0	0	110.5	P391 V487 Q488	S325-P391 WeakPolarHBondContact CB-O 3.42Å; S325-P391 PolarHBondContact OG-O 3.49Å; S325-V487 WeakPolarHBondContact O-CA 3.37Å; S325-V487 WeakPolarHBondContact O-CG1 3.39Å; S325-Q488 PolarHBondContact O-N 3.22Å; S325-Q488 VanDerWaalsContact O-N 3.07Å; S325-Q488 WeakPolarHBondContact OG-CB 3.44Å
326	E	92	Very high	90.8	Very high	30 Å²	30	35.1 Å²	35.1	14%	0.14	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	164.2	-173.2	72.3	-175.6	172	0	0	109.4	L328 T334 R383 L390 V487	E326-L328 HydrophobicContact CG-CD2 4.49Å; E326-L328 HydrophobicContact CG-CG 4.13Å; E326-L328 WeakPolarHBondContact OE1-CD1 3.43Å; E326-T334 WeakPolarHBondContact CG-OG1 3.39Å; E326-T334 PolarHBondContact N-O 3.28Å; E326-T334 PolarHBondContact O-N 3.02Å; E326-T334 PolarHBondContact O-OG1 3.37Å; E326-T334 PolarHBondContact OE1-OG1 2.91Å; E326-R383 WeakPolarHBondContact OE1-CD 3.47Å; E326-R383 IonicContact OE1-CZ 3.25Å; E326-R383 VanDerWaalsContact OE1-CZ 3.22Å; E326-R383 IonicContact OE1-NE 2.78Å; E326-R383 PolarHBondContact OE1-NE 2.76Å; E326-R383 IonicContact OE1-NH1 3.65Å; E326-R383 IonicContact OE1-NH2 3.12Å; E326-L390 WeakPolarHBondContact O-CD2 3.37Å; E326-V487 HydrophobicContact CB-CG2 4.33Å
327	T	91.6	Very high	91.2	Very high	37 Å²	37	34.3 Å²	34.3	23%	0.227	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	111.3	171.2	57.1	0	0	0	0	110.3	K333 L390 V515 G516	T327-K333 HydrophobicContact CG2-CG 4.2Å; T327-L390 HydrophobicContact CG2-CD1 3.71Å; T327-L390 HydrophobicContact CG2-CD2 3.96Å; T327-L390 HydrophobicContact CG2-CG 4.29Å; T327-V515 HydrophobicContact CG2-CG1 4.47Å; T327-G516 WeakPolarHBondContact OG1-CA 3.04Å
328	L	87.9	Confident	91.5	Very high	55 Å²	55	31.1 Å²	31.1	29%	0.288	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	137.6	178.4	-65.5	178.3	0	0	0	111.1	E326 G330 I331 G332 T334	E326-L328 HydrophobicContact CG-CD2 4.49Å; E326-L328 HydrophobicContact CG-CG 4.13Å; E326-L328 WeakPolarHBondContact OE1-CD1 3.43Å; L328-G330 PolarHBondContact O-N 2.94Å; L328-I331 HydrophobicContact CB-CB 4.28Å; L328-I331 HydrophobicContact CD1-CD1 4.06Å; L328-G332 PolarHBondContact N-O 3.49Å; L328-G332 WeakPolarHBondContact O-CA 2.92Å; L328-G332 PolarHBondContact O-N 3.06Å; L328-T334 HydrophobicContact CD1-CG2 4.36Å
329	H	85.9	Confident	91.6	Very high	185 Å²	185	31.2 Å²	31.2	86%	0.856	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.8	135.2	172.2	-165.2	82.1	0	0	0	110.2	I331	H329-I331 VanDerWaalsContact C-N 3.28Å; H329-I331 PolarHBondContact O-N 3.41Å; H329-I331 VanDerWaalsContact O-N 3.14Å
330	G	85.6	Confident	91.4	Very high	79 Å²	79	32.3 Å²	32.3	81%	0.814	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.5	-41.7	-177.9	0	0	0	0	0	115.5	L328	L328-G330 PolarHBondContact O-N 2.94Å
331	I	87.7	Confident	91.3	Very high	70 Å²	70	35.9 Å²	35.9	36%	0.359	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-31.5	179.2	-54.8	174	0	0	0	111.3	L328 H329 T334 L366 A385	L328-I331 HydrophobicContact CB-CB 4.28Å; L328-I331 HydrophobicContact CD1-CD1 4.06Å; H329-I331 VanDerWaalsContact C-N 3.28Å; H329-I331 PolarHBondContact O-N 3.41Å; H329-I331 VanDerWaalsContact O-N 3.14Å; I331-T334 HydrophobicContact CB-CG2 4.37Å; I331-T334 HydrophobicContact CG2-CG2 3.58Å; I331-L366 HydrophobicContact CD1-CD1 4.09Å; I331-A385 HydrophobicContact CG2-CB 3.47Å; I331-A385 VanDerWaalsContact CG2-CB 3.47Å
332	G	90.6	Very high	91.1	Very high	35 Å²	35	34.8 Å²	34.8	36%	0.361	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	91.9	-146.4	-177.2	0	0	0	0	0	112.6	L328 T334	L328-G332 PolarHBondContact N-O 3.49Å; L328-G332 WeakPolarHBondContact O-CA 2.92Å; L328-G332 PolarHBondContact O-N 3.06Å; G332-T334 PolarHBondContact O-N 3.28Å
333	K	93.2	Very high	90.9	Very high	74 Å²	74	35.6 Å²	35.6	32%	0.322	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	119.5	-179.6	-61.2	173.4	179.8	-176.5	0	110	T327 W387 K388 L390	T327-K333 HydrophobicContact CG2-CG 4.2Å; K333-W387 HydrophobicContact CB-CB 4Å; K333-K388 WeakPolarHBondContact CD-O 3.35Å; K333-K388 PolarHBondContact NZ-O 3Å; K333-L390 HydrophobicContact CB-CD2 4.17Å; K333-L390 HydrophobicContact CB-CG 4.32Å; K333-L390 HydrophobicContact CD-CG 4.09Å; K333-L390 HydrophobicContact CG-CD2 4.35Å; K333-L390 HydrophobicContact CG-CG 4.08Å
334	T	93.5	Very high	90.9	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	151	179.9	44.4	0	0	0	0	110.6	E326 L328 I331 G332 R383 V384 A385	E326-T334 WeakPolarHBondContact CG-OG1 3.39Å; E326-T334 PolarHBondContact N-O 3.28Å; E326-T334 PolarHBondContact O-N 3.02Å; E326-T334 PolarHBondContact O-OG1 3.37Å; E326-T334 PolarHBondContact OE1-OG1 2.91Å; L328-T334 HydrophobicContact CD1-CG2 4.36Å; I331-T334 HydrophobicContact CB-CG2 4.37Å; I331-T334 HydrophobicContact CG2-CG2 3.58Å; G332-T334 PolarHBondContact O-N 3.28Å; T334-R383 HydrophobicContact CG2-CG 4.36Å; T334-V384 WeakPolarHBondContact CA-O 3.31Å; T334-A385 HydrophobicContact CG2-CB 3.83Å
335	A	93.5	Very high	90.9	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	132.7	172.4	0	0	0	0	0	110	V322 E324 C337 R383 V384 W387 P391	V322-A335 HydrophobicContact CG1-CB 4.2Å; E324-A335 CarbonylContact O-C 3.57Å; E324-A335 VanDerWaalsContact O-CA 3.3Å; E324-A335 WeakPolarHBondContact O-CA 3.45Å; A335-C337 PolarHBondContact O-N 2.92Å; A335-C337 PolarHBondContact O-SG 2.83Å; A335-R383 WeakPolarHBondContact O-CA 3.45Å; A335-V384 PolarHBondContact N-O 3.11Å; A335-V384 PolarHBondContact O-N 2.96Å; A335-W387 HydrophobicContact CB-CZ2 4.29Å; A335-P391 HydrophobicContact CB-CG 3.73Å
336	T	92.3	Very high	90.8	Very high	18 Å²	18	44.4 Å²	44.4	11%	0.11	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	114.7	172.6	-56.5	0	0	0	0	108	L323 E324 V381	L323-T336 HydrophobicContact CB-CG2 4.48Å; L323-T336 HydrophobicContact CD1-CG2 4.37Å; L323-T336 PolarHBondContact N-O 2.66Å; E324-T336 PolarHBondContact N-O 3.24Å; E324-T336 PolarHBondContact O-N 3.43Å; T336-V381 HydrophobicContact CG2-CG1 3.47Å; T336-V381 VanDerWaalsContact CG2-CG1 3.47Å
337	C	93	Very high	90.5	Very high	1 Å²	1	45.7 Å²	45.7	1%	0.007	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	131	-169.9	-56.9	0	0	0	0	110.1	A335 V381 A382 V384 I397	A335-C337 PolarHBondContact O-N 2.92Å; A335-C337 PolarHBondContact O-SG 2.83Å; C337-V381 WeakPolarHBondContact O-CA 3.42Å; C337-A382 PolarHBondContact N-O 2.66Å; C337-A382 PolarHBondContact O-N 3.05Å; C337-V384 HydrophobicContact CB-CG2 4Å; C337-I397 HydrophobicContact CB-CD1 3.45Å; C337-I397 VanDerWaalsContact CB-CD1 3.45Å; C337-I397 WeakPolarHBondContact SG-CD1 3.21Å
338	L	93.6	Very high	89.9	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	121.2	172.1	175.3	67	0	0	0	109	I130 A214 G320 V321 L323 V381	I130-L338 HydrophobicContact CD1-CD1 3.8Å; I130-L338 HydrophobicContact CD1-CD2 3.99Å; I130-L338 HydrophobicContact CD1-CG 4.14Å; I130-L338 HydrophobicContact CG1-CD1 4.17Å; I130-L338 HydrophobicContact CG2-CD1 4.3Å; I130-L338 HydrophobicContact CG2-CD2 4.09Å; A214-L338 HydrophobicContact CB-CD2 4.05Å; A214-L338 WeakPolarHBondContact O-CD2 3.29Å; G320-L338 CarbonylContact C-O 3.52Å; G320-L338 WeakPolarHBondContact CA-O 3.01Å; V321-L338 PolarHBondContact N-O 3.01Å; V321-L338 PolarHBondContact O-N 3.3Å; L323-L338 HydrophobicContact CD1-CB 4.06Å; L323-L338 HydrophobicContact CD2-CB 4.21Å; L323-L338 HydrophobicContact CD2-CD2 4.27Å; L323-L338 HydrophobicContact CG-CB 4.02Å; L338-V381 HydrophobicContact CB-CG2 4.27Å; L338-V381 HydrophobicContact CD1-CG2 3.56Å
339	I	93.2	Very high	89.5	Confident	6 Å²	6	52.3 Å²	52.3	3%	0.031	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	125.9	-178.3	-56.9	175.8	0	0	0	108.8	R341 G342 L344 V376 P378 G379 F380	I339-R341 WeakPolarHBondContact CG2-O 3.32Å; I339-G342 WeakPolarHBondContact CG2-O 3.5Å; I339-L344 HydrophobicContact CD1-CB 3.34Å; I339-L344 HydrophobicContact CD1-CD2 4.08Å; I339-L344 HydrophobicContact CD1-CG 4.36Å; I339-L344 HydrophobicContact CG1-CB 4.39Å; I339-V376 HydrophobicContact CD1-CB 3.48Å; I339-V376 VanDerWaalsContact CD1-CB 3.48Å; I339-V376 HydrophobicContact CD1-CG1 3.45Å; I339-V376 VanDerWaalsContact CD1-CG1 3.45Å; I339-V376 WeakPolarHBondContact CD1-O 3.47Å; I339-V376 HydrophobicContact CG1-CG1 4.43Å; I339-P378 HydrophobicContact CG2-CB 4.4Å; I339-G379 PolarHBondContact O-N 2.54Å; I339-F380 PolarHBondContact N-O 3.47Å
340	T	89.6	Confident	89.3	Confident	40 Å²	40	44.1 Å²	44.1	25%	0.245	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	-37.9	179.7	60.4	0	0	0	0	111.6	E319 V321 P378	E319-T340 PolarHBondContact O-N 2.69Å; E319-T340 PolarHBondContact O-OG1 2.87Å; V321-T340 HydrophobicContact CG2-CG2 4.29Å; T340-P378 WeakPolarHBondContact O-CB 3.46Å
341	R	90.1	Very high	89.3	Confident	78 Å²	78	41 Å²	41	29%	0.294	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	156.8	-178.5	-58.5	177.7	176.9	171.1	-0.6	110	A318 E319 I339	A318-R341 CarbonylContact C-O 3.57Å; A318-R341 WeakPolarHBondContact CA-O 3.43Å; E319-R341 HydrophobicContact CB-CB 4.27Å; E319-R341 PolarHBondContact N-O 3.09Å; E319-R341 PolarHBondContact O-N 3.03Å; E319-R341 VanDerWaalsContact O-N 3.12Å; E319-R341 IonicContact OE2-NH1 2.76Å; I339-R341 WeakPolarHBondContact CG2-O 3.32Å
342	G	88.6	Confident	89.5	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.208	C	C	.	.	S	Bend	trans	70.4	173.2	-178.3	0	0	0	0	0	112.9	D313 G316 I339 P378	D313-G342 WeakPolarHBondContact O-CA 3.39Å; D313-G342 PolarHBondContact O-N 3.34Å; G316-G342 WeakPolarHBondContact O-CA 3.36Å; I339-G342 WeakPolarHBondContact CG2-O 3.5Å; G342-P378 WeakPolarHBondContact O-CD 3.36Å
343	V	90.8	Very high	89.6	Confident	18 Å²	18	36.5 Å²	36.5	11%	0.109	19%	0.191	C	C	.	.			trans	-112.9	113.6	179.6	174.6	0	0	0	0	108.8	H314 R345 V376	H314-V343 WeakPolarHBondContact O-CG2 3.31Å; V343-R345 HydrophobicContact CG1-CG 4.21Å; V343-R345 PolarHBondContact O-N 2.91Å; V343-V376 WeakPolarHBondContact CA-O 3.48Å
344	L	91.8	Very high	89.7	Confident	5 Å²	5	33 Å²	33	3%	0.026	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	121.6	176.2	-179.7	65.5	0	0	0	109.4	A318 I339 L353 L365 S375 V376 V384	A318-L344 HydrophobicContact CB-CB 3.94Å; A318-L344 HydrophobicContact CB-CD1 4.09Å; I339-L344 HydrophobicContact CD1-CB 3.34Å; I339-L344 HydrophobicContact CD1-CD2 4.08Å; I339-L344 HydrophobicContact CD1-CG 4.36Å; I339-L344 HydrophobicContact CG1-CB 4.39Å; L344-L353 HydrophobicContact CD1-CD1 3.81Å; L344-L353 HydrophobicContact CD1-CD2 3.74Å; L344-L353 HydrophobicContact CD1-CG 4.23Å; L344-L365 HydrophobicContact CD2-CD1 4.44Å; L344-L365 HydrophobicContact CD2-CD2 3.67Å; L344-L365 HydrophobicContact CG-CD1 4.2Å; L344-L365 HydrophobicContact CG-CD2 4.16Å; L344-S375 CarbonylContact O-C 3.48Å; L344-S375 VanDerWaalsContact O-CA 3.22Å; L344-S375 WeakPolarHBondContact O-CA 3.29Å; L344-V376 PolarHBondContact N-O 2.76Å; L344-V376 PolarHBondContact O-N 3.09Å; L344-V384 HydrophobicContact CD2-CG2 3.69Å
345	R	91.6	Very high	89.6	Confident	127 Å²	127	33 Å²	33	48%	0.479	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	162.5	177.4	-60.8	179	-176.3	-175.2	0.1	110.9	V343 N349 S350 D374	V343-R345 HydrophobicContact CG1-CG 4.21Å; V343-R345 PolarHBondContact O-N 2.91Å; R345-N349 HydrophobicContact CB-CB 4.22Å; R345-S350 WeakPolarHBondContact O-CB 3.41Å; R345-S350 PolarHBondContact O-OG 3.37Å; R345-D374 WeakPolarHBondContact CA-O 3.33Å
346	K	90.9	Very high	89.4	Confident	74 Å²	74	33.9 Å²	33.9	32%	0.322	19%	0.185	S	C	.	.			trans	-72	146	167.2	66.5	179.6	178.5	-169.5	0	111.4	N349 D374	K346-N349 PolarHBondContact O-N 2.81Å; K346-D374 HydrophobicContact CD-CB 4.31Å; K346-D374 WeakPolarHBondContact CD-OD1 3.28Å; K346-D374 VanDerWaalsContact CE-OD1 3.23Å; K346-D374 WeakPolarHBondContact CE-OD1 3.42Å; K346-D374 WeakPolarHBondContact CE-OD2 3.37Å; K346-D374 PolarHBondContact N-O 3.39Å; K346-D374 IonicContact NZ-OD1 2.65Å; K346-D374 PolarHBondContact NZ-OD1 3.39Å; K346-D374 IonicContact NZ-OD2 2.85Å; K346-D374 PolarHBondContact NZ-OD2 3.29Å
347	S	85.7	Confident	89.3	Confident	58 Å²	58	35.8 Å²	35.8	41%	0.406	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	136.2	170	174.6	0	0	0	0	110	S350 P362	S347-S350 PolarHBondContact N-OG 2.99Å; S347-P362 WeakPolarHBondContact CB-O 3.34Å; S347-P362 PolarHBondContact N-O 2.78Å
348	P	79.1	Confident	89.3	Confident	115 Å²	115	35.8 Å²	35.8	75%	0.747	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	cis	-92.9	0.9	18	37	-37.1	0	0	0	115.5	S350	P348-S350 VanDerWaalsContact C-N 3.3Å; P348-S350 PolarHBondContact O-N 2.95Å
349	N	79.8	Confident	89.3	Confident	116 Å²	116	36 Å²	36	62%	0.62	19%	0.194	S	C	*	.	S	Bend	trans	-79.3	-15.7	-173	-67.3	-14.3	0	0	0	113.3	R345 K346	R345-N349 HydrophobicContact CB-CB 4.22Å; K346-N349 PolarHBondContact O-N 2.81Å
350	S	81	Confident	89.3	Confident	12 Å²	12	35.7 Å²	35.7	8%	0.084	19%	0.193	C	C	.	.	S	Bend	trans	-104.6	150.6	172.4	64.4	0	0	0	0	111.1	R345 S347 P348 P362 E399	R345-S350 WeakPolarHBondContact O-CB 3.41Å; R345-S350 PolarHBondContact O-OG 3.37Å; S347-S350 PolarHBondContact N-OG 2.99Å; P348-S350 VanDerWaalsContact C-N 3.3Å; P348-S350 PolarHBondContact O-N 2.95Å; S350-P362 WeakPolarHBondContact OG-CG 3.42Å; S350-E399 VanDerWaalsContact CA-OE1 3.24Å; S350-E399 WeakPolarHBondContact CA-OE1 3.33Å; S350-E399 WeakPolarHBondContact CB-OE1 3.1Å
351	G	85.1	Confident	89.4	Confident	15 Å²	15	35.9 Å²	35.9	16%	0.155	19%	0.194	C	C	.	.	P	Polyproline II helix	trans	-66.7	169.8	165	0	0	0	0	0	113.3	E399 L400	G351-E399 PolarHBondContact N-OE1 3.31Å; G351-L400 WeakPolarHBondContact CA-O 3.37Å
352	P	92.2	Very high	89.5	Confident	9 Å²	9	32.2 Å²	32.2	6%	0.058	18%	0.18	C	C	.	.	P	Polyproline II helix	trans	-62.4	142.7	165.2	29.1	-38.5	0	0	0	111.2	C360 L400 T403 A406	P352-C360 CarbonylContact C-O 3.56Å; P352-C360 WeakPolarHBondContact CA-O 3.45Å; P352-L400 VanDerWaalsContact CD-O 3.24Å; P352-L400 WeakPolarHBondContact CD-O 3.08Å; P352-L400 HydrophobicContact CG-CB 4.4Å; P352-L400 PolarHBondContact O-N 3.25Å; P352-T403 HydrophobicContact CB-CG2 4.28Å; P352-T403 HydrophobicContact CG-CG2 4.12Å; P352-A406 HydrophobicContact CB-CB 4.06Å; P352-A406 HydrophobicContact CG-CB 3.92Å
353	L	93.8	Very high	89.6	Confident	1 Å²	1	41.2 Å²	41.2	1%	0.005	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	144.8	171.9	-53.5	174.8	0	0	0	109.9	L344 V359 C360 P362 V384 W387 I397 L398 E399	L344-L353 HydrophobicContact CD1-CD1 3.81Å; L344-L353 HydrophobicContact CD1-CD2 3.74Å; L344-L353 HydrophobicContact CD1-CG 4.23Å; L353-V359 WeakPolarHBondContact O-CA 2.95Å; L353-C360 HydrophobicContact CB-CB 4.2Å; L353-C360 PolarHBondContact N-O 3.01Å; L353-C360 PolarHBondContact O-N 3.46Å; L353-P362 HydrophobicContact CD1-CB 4.47Å; L353-P362 HydrophobicContact CD1-CG 4.49Å; L353-V384 HydrophobicContact CD1-CG1 4.14Å; L353-W387 HydrophobicContact CB-CH2 4.44Å; L353-I397 HydrophobicContact CB-CG2 4.03Å; L353-I397 HydrophobicContact CD1-CG2 4.12Å; L353-I397 HydrophobicContact CD2-CG2 4.13Å; L353-I397 HydrophobicContact CG-CG2 4.32Å; L353-L398 WeakPolarHBondContact CA-O 3.37Å; L353-E399 HydrophobicContact CD2-CB 3.7Å; L353-E399 HydrophobicContact CD2-CG 4.04Å
354	I	93.9	Very high	89.6	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	131	167.7	-168.2	156.7	0	0	0	109.7	A358 V359 I397 L398 L400 V409 Q410	I354-A358 WeakPolarHBondContact CA-O 3.44Å; I354-V359 HydrophobicContact CD1-CG2 4.39Å; I354-I397 WeakPolarHBondContact O-CA 3.19Å; I354-L398 HydrophobicContact CG2-CB 4.01Å; I354-L398 PolarHBondContact N-O 3.19Å; I354-L398 PolarHBondContact O-N 2.95Å; I354-L400 HydrophobicContact CB-CD1 4.31Å; I354-L400 HydrophobicContact CG2-CD1 3.8Å; I354-L400 HydrophobicContact CG2-CG 4.19Å; I354-V409 HydrophobicContact CD1-CB 3.67Å; I354-V409 HydrophobicContact CD1-CG1 3.44Å; I354-V409 VanDerWaalsContact CD1-CG1 3.44Å; I354-Q410 HydrophobicContact CD1-CB 4.4Å
355	A	93	Very high	89.6	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	114.5	172.2	0	0	0	0	0	108.3	V322 E357 A358 W387 P391 D395 L396 I397	V322-A355 HydrophobicContact CG2-CB 4.07Å; A355-E357 PolarHBondContact O-N 3.15Å; A355-E357 VanDerWaalsContact O-N 3.09Å; A355-A358 PolarHBondContact N-O 3.04Å; A355-A358 WeakPolarHBondContact O-CA 3.49Å; A355-A358 WeakPolarHBondContact O-CB 3.42Å; A355-A358 PolarHBondContact O-N 2.9Å; A355-W387 HydrophobicContact CB-CH2 3.52Å; A355-W387 HydrophobicContact CB-CZ3 3.64Å; A355-P391 HydrophobicContact CB-CB 3.88Å; A355-D395 HydrophobicContact CB-CB 4.26Å; A355-L396 WeakPolarHBondContact CA-O 3.29Å; A355-I397 HydrophobicContact CB-CG1 4.1Å
356	G	89.4	Confident	89.6	Confident	18 Å²	18	38.8 Å²	38.8	19%	0.186	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.7	-116.9	-170.6	0	0	0	0	0	111.4	D395 R413	G356-D395 WeakPolarHBondContact CA-OD2 3.23Å; G356-R413 WeakPolarHBondContact O-CD 3.49Å; G356-R413 PolarHBondContact O-NH1 2.95Å
357	E	89.6	Confident	89.4	Confident	58 Å²	58	36.9 Å²	36.9	27%	0.271	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-12.3	174.6	-64.9	178.7	-140.7	0	0	114.1	A355 Q410 R414 K417	A355-E357 PolarHBondContact O-N 3.15Å; A355-E357 VanDerWaalsContact O-N 3.09Å; E357-Q410 WeakPolarHBondContact O-CG 3.43Å; E357-Q410 PolarHBondContact O-NE2 2.84Å; E357-R414 HydrophobicContact CG-CG 4.25Å; E357-R414 IonicContact OE2-NE 2.98Å; E357-K417 WeakPolarHBondContact OE1-CD 3.39Å; E357-K417 WeakPolarHBondContact OE1-CE 3.22Å; E357-K417 IonicContact OE1-NZ 2.95Å; E357-K417 PolarHBondContact OE1-NZ 3.34Å
358	A	92.5	Very high	89	Confident	2 Å²	2	37.4 Å²	37.4	2%	0.017	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	131.8	-173.6	0	0	0	0	0	110.6	I354 A355 W387 D389 P391	I354-A358 WeakPolarHBondContact CA-O 3.44Å; A355-A358 PolarHBondContact N-O 3.04Å; A355-A358 WeakPolarHBondContact O-CA 3.49Å; A355-A358 WeakPolarHBondContact O-CB 3.42Å; A355-A358 PolarHBondContact O-N 2.9Å; A358-W387 HydrophobicContact CB-CE3 3.73Å; A358-W387 HydrophobicContact CB-CZ3 3.97Å; A358-D389 HydrophobicContact CB-CB 4.24Å; A358-D389 VanDerWaalsContact CB-O 3.26Å; A358-D389 WeakPolarHBondContact CB-O 3.48Å; A358-P391 HydrophobicContact CB-CB 4.04Å
359	V	93.3	Very high	88.9	Confident	4 Å²	4	36.8 Å²	36.8	2%	0.024	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	133.8	174.2	179.4	0	0	0	0	108.6	L353 I354 K388 A406 Q410	L353-V359 WeakPolarHBondContact O-CA 2.95Å; I354-V359 HydrophobicContact CD1-CG2 4.39Å; V359-K388 PolarHBondContact O-N 3.04Å; V359-A406 HydrophobicContact CG1-CB 4.02Å; V359-A406 HydrophobicContact CG2-CB 4.49Å; V359-Q410 HydrophobicContact CG2-CB 3.88Å; V359-Q410 HydrophobicContact CG2-CG 4.21Å
360	C	92.9	Very high	88.9	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	142.8	178.1	-175.3	0	0	0	0	111.1	P352 L353 G386 W387	P352-C360 CarbonylContact C-O 3.56Å; P352-C360 WeakPolarHBondContact CA-O 3.45Å; L353-C360 HydrophobicContact CB-CB 4.2Å; L353-C360 PolarHBondContact N-O 3.01Å; L353-C360 PolarHBondContact O-N 3.46Å; C360-G386 WeakPolarHBondContact CA-O 3.42Å; C360-G386 PolarHBondContact SG-O 2.78Å; C360-G386 VanDerWaalsContact SG-O 3.36Å; C360-W387 HydrophobicContact CB-CD2 3.45Å; C360-W387 VanDerWaalsContact CB-CD2 3.45Å; C360-W387 HydrophobicContact CB-CE3 3.43Å; C360-W387 VanDerWaalsContact CB-CE3 3.43Å; C360-W387 HydrophobicContact CB-CG 3.99Å; C360-W387 HydrophobicContact CB-CH2 3.94Å; C360-W387 HydrophobicContact CB-CZ2 4.01Å; C360-W387 HydrophobicContact CB-CZ3 3.67Å
361	T	92.9	Very high	89.2	Confident	43 Å²	43	39.7 Å²	39.7	26%	0.264	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	109.8	159.8	52.7	0	0	0	0	105.9	R363 G386	T361-R363 PolarHBondContact O-N 3.39Å; T361-G386 PolarHBondContact N-O 3.09Å
362	P	91.9	Very high	89.4	Confident	1 Å²	1	43.8 Å²	43.8	1%	0.006	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	102.7	-173.4	28	-35.4	0	0	0	109.8	S347 S350 L353 L365 V384	S347-P362 WeakPolarHBondContact CB-O 3.34Å; S347-P362 PolarHBondContact N-O 2.78Å; S350-P362 WeakPolarHBondContact OG-CG 3.42Å; L353-P362 HydrophobicContact CD1-CB 4.47Å; L353-P362 HydrophobicContact CD1-CG 4.49Å; P362-L365 HydrophobicContact CB-CD2 4.14Å; P362-V384 HydrophobicContact CB-CG1 3.85Å
363	R	89.7	Confident	89.3	Confident	189 Å²	189	45.7 Å²	45.7	71%	0.713	25%	0.25	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-88.2	-40.2	-178.8	-66.9	-177	-175.8	177.2	-0.6	111.7	T361 A385	T361-R363 PolarHBondContact O-N 3.39Å; R363-A385 PolarHBondContact N-O 3.38Å
364	I	91.4	Very high	89	Confident	74 Å²	74	50 Å²	50	38%	0.379	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	130.2	-178.3	-52	174.3	0	0	0	106.7	L366 A385	I364-L366 HydrophobicContact CG2-CD2 3.74Å; I364-L366 HydrophobicContact CG2-CG 3.96Å; I364-A385 HydrophobicContact CB-CB 4.07Å; I364-A385 PolarHBondContact O-N 3.13Å
365	L	92.8	Very high	88.9	Confident	3 Å²	3	52.9 Å²	52.9	2%	0.016	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	125.1	168.9	-55.7	173.3	0	0	0	106.8	L344 P362 P372 V373 V376 V384	L344-L365 HydrophobicContact CD2-CD1 4.44Å; L344-L365 HydrophobicContact CD2-CD2 3.67Å; L344-L365 HydrophobicContact CG-CD1 4.2Å; L344-L365 HydrophobicContact CG-CD2 4.16Å; P362-L365 HydrophobicContact CB-CD2 4.14Å; L365-P372 CarbonylContact O-C 3.58Å; L365-P372 VanDerWaalsContact O-CA 3.29Å; L365-P372 WeakPolarHBondContact O-CA 3.39Å; L365-V373 WeakPolarHBondContact CB-O 3.36Å; L365-V373 PolarHBondContact O-N 2.87Å; L365-V376 HydrophobicContact CD1-CG2 4.17Å; L365-V384 HydrophobicContact CD2-CB 4.21Å; L365-V384 HydrophobicContact CD2-CG1 3.99Å; L365-V384 HydrophobicContact CD2-CG2 3.75Å
366	L	90.6	Very high	88.7	Confident	23 Å²	23	53.4 Å²	53.4	12%	0.12	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	141.9	176.8	-57.2	171	0	0	0	109.3	I331 I364 K371 P372 A382 R383	I331-L366 HydrophobicContact CD1-CD1 4.09Å; I364-L366 HydrophobicContact CG2-CD2 3.74Å; I364-L366 HydrophobicContact CG2-CG 3.96Å; L366-K371 WeakPolarHBondContact CA-O 3.39Å; L366-P372 HydrophobicContact CD2-CB 4.17Å; L366-A382 CarbonylContact O-C 3.48Å; L366-A382 WeakPolarHBondContact O-CA 3.27Å; L366-R383 HydrophobicContact CB-CB 4.23Å; L366-R383 PolarHBondContact N-O 3.25Å; L366-R383 PolarHBondContact O-N 3.24Å
367	T	86.6	Confident	88.8	Confident	34 Å²	34	55 Å²	55	21%	0.209	30%	0.3	C	S	.	.			trans	-69.9	169.8	167.2	54.9	0	0	0	0	111	T369 G370 K371 V373	T367-T369 PolarHBondContact O-N 2.9Å; T367-T369 PolarHBondContact OG1-OG1 3.3Å; T367-G370 PolarHBondContact O-N 3.04Å; T367-K371 PolarHBondContact N-O 3.26Å; T367-K371 PolarHBondContact OG1-N 3.44Å; T367-K371 PolarHBondContact OG1-O 3.49Å; T367-V373 HydrophobicContact CG2-CB 4.32Å; T367-V373 HydrophobicContact CG2-CG2 3.37Å
368	D	77.4	Confident	88.8	Confident	69 Å²	69	52.2 Å²	52.2	37%	0.369	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.1	-37.2	166.1	58.6	-12.7	0	0	0	113.2	F168 T169 G370	F168-D368 WeakPolarHBondContact CA-OD2 3.41Å; T169-D368 PolarHBondContact N-OD2 3.24Å; T169-D368 VanDerWaalsContact N-OD2 3.11Å; D368-G370 VanDerWaalsContact C-N 3.28Å; D368-G370 PolarHBondContact O-N 3.41Å
369	T	78.2	Confident	88.5	Confident	101 Å²	101	52.1 Å²	52.1	62%	0.62	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	3.2	176.7	45.3	0	0	0	0	114.6	T367 K371	T367-T369 PolarHBondContact O-N 2.9Å; T367-T369 PolarHBondContact OG1-OG1 3.3Å; T369-K371 VanDerWaalsContact C-N 3.34Å; T369-K371 PolarHBondContact O-N 3.26Å
370	G	79.3	Confident	88.3	Confident	45 Å²	45	54.6 Å²	54.6	46%	0.464	30%	0.297	S	S	.	.	S	Bend	trans	78.1	10.1	178.3	0	0	0	0	0	115.4	T367 D368	T367-G370 PolarHBondContact O-N 3.04Å; D368-G370 VanDerWaalsContact C-N 3.28Å; D368-G370 PolarHBondContact O-N 3.41Å
371	K	86	Confident	88.2	Confident	144 Å²	144	55.1 Å²	55.1	63%	0.626	30%	0.3	S	S	*	.			trans	-83.6	134.5	177	-65.8	180	-179	174	0	110.2	L366 T367 T369	L366-K371 WeakPolarHBondContact CA-O 3.39Å; T367-K371 PolarHBondContact N-O 3.26Å; T367-K371 PolarHBondContact OG1-N 3.44Å; T367-K371 PolarHBondContact OG1-O 3.49Å; T369-K371 VanDerWaalsContact C-N 3.34Å; T369-K371 PolarHBondContact O-N 3.26Å
372	P	89.7	Confident	88.1	Confident	101 Å²	101	53.1 Å²	53.1	66%	0.656	29%	0.288	S	S	*	.	B	Isolated β-bridge	trans	-69.8	133.9	175.5	29	-33.5	0	0	0	110.8	L365 L366	L365-P372 CarbonylContact O-C 3.58Å; L365-P372 VanDerWaalsContact O-CA 3.29Å; L365-P372 WeakPolarHBondContact O-CA 3.39Å; L366-P372 HydrophobicContact CD2-CB 4.17Å
373	V	89.7	Confident	88.1	Confident	49 Å²	49	56.9 Å²	56.9	30%	0.297	30%	0.302	S	S	.	.			trans	-128	148.3	-179.7	172.1	0	0	0	0	110.5	L365 T367 S375 V376	L365-V373 WeakPolarHBondContact CB-O 3.36Å; L365-V373 PolarHBondContact O-N 2.87Å; T367-V373 HydrophobicContact CG2-CB 4.32Å; T367-V373 HydrophobicContact CG2-CG2 3.37Å; V373-S375 WeakPolarHBondContact CG1-O 3.36Å; V373-V376 HydrophobicContact CG1-CG2 4.45Å
374	D	88.9	Confident	88.3	Confident	93 Å²	93	47.9 Å²	47.9	50%	0.497	27%	0.268	S	S	.	.	S	Bend	trans	-87.5	-29.9	-175.5	-75.2	0.8	0	0	0	113.5	R345 K346	R345-D374 WeakPolarHBondContact CA-O 3.33Å; K346-D374 HydrophobicContact CD-CB 4.31Å; K346-D374 WeakPolarHBondContact CD-OD1 3.28Å; K346-D374 VanDerWaalsContact CE-OD1 3.23Å; K346-D374 WeakPolarHBondContact CE-OD1 3.42Å; K346-D374 WeakPolarHBondContact CE-OD2 3.37Å; K346-D374 PolarHBondContact N-O 3.39Å; K346-D374 IonicContact NZ-OD1 2.65Å; K346-D374 PolarHBondContact NZ-OD1 3.39Å; K346-D374 IonicContact NZ-OD2 2.85Å; K346-D374 PolarHBondContact NZ-OD2 3.29Å
375	S	90.5	Very high	88.4	Confident	59 Å²	59	44.5 Å²	44.5	41%	0.413	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	141	-179.2	58.7	0	0	0	0	111.9	L344 V373	L344-S375 CarbonylContact O-C 3.48Å; L344-S375 VanDerWaalsContact O-CA 3.22Å; L344-S375 WeakPolarHBondContact O-CA 3.29Å; V373-S375 WeakPolarHBondContact CG1-O 3.36Å
376	V	90.4	Very high	88.3	Confident	12 Å²	12	45.3 Å²	45.3	7%	0.073	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	127.3	-178.2	-172.8	0	0	0	0	108.8	I339 V343 L344 L365 V373 F380 A382	I339-V376 HydrophobicContact CD1-CB 3.48Å; I339-V376 VanDerWaalsContact CD1-CB 3.48Å; I339-V376 HydrophobicContact CD1-CG1 3.45Å; I339-V376 VanDerWaalsContact CD1-CG1 3.45Å; I339-V376 WeakPolarHBondContact CD1-O 3.47Å; I339-V376 HydrophobicContact CG1-CG1 4.43Å; V343-V376 WeakPolarHBondContact CA-O 3.48Å; L344-V376 PolarHBondContact N-O 2.76Å; L344-V376 PolarHBondContact O-N 3.09Å; L365-V376 HydrophobicContact CD1-CG2 4.17Å; V373-V376 HydrophobicContact CG1-CG2 4.45Å; V376-F380 HydrophobicContact CG1-CB 3.91Å; V376-A382 HydrophobicContact CB-CB 4.21Å; V376-A382 HydrophobicContact CG1-CB 3.88Å; V376-A382 HydrophobicContact CG2-CB 3.53Å
377	N	90.4	Very high	88.5	Confident	50 Å²	50	44.7 Å²	44.7	27%	0.267	26%	0.256	S	S	.	.			trans	-84.3	160.8	-176.6	-73.4	-8.3	0	0	0	111.8	F380	N377-F380 HydrophobicContact CB-CD2 3.78Å; N377-F380 HydrophobicContact CB-CE2 4.08Å; N377-F380 PolarHBondContact O-N 3.36Å
378	P	90	Very high	88.8	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	143.5	174.3	27.7	-34.6	0	0	0	111.1	A312 H314 I339 T340 G342 F380	A312-P378 HydrophobicContact CB-CB 3.85Å; A312-P378 HydrophobicContact CB-CG 3.91Å; H314-P378 WeakPolarHBondContact NE2-CG 3.34Å; I339-P378 HydrophobicContact CG2-CB 4.4Å; T340-P378 WeakPolarHBondContact O-CB 3.46Å; G342-P378 WeakPolarHBondContact O-CD 3.36Å; P378-F380 VanDerWaalsContact C-N 3.31Å
379	G	86.2	Confident	89.5	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.4	-11.6	-174.5	0	0	0	0	0	114.8	T194 I339	T194-G379 WeakPolarHBondContact CB-O 3.32Å; T194-G379 PolarHBondContact OG1-O 3.08Å; I339-G379 PolarHBondContact O-N 2.54Å
380	F	88.5	Confident	90.1	Very high	56 Å²	56	45.8 Å²	45.8	25%	0.246	25%	0.251	C	S	.	.			trans	-97.8	159.2	175	-64.8	-90	0	0	0	111.8	P128 T169 I339 V376 N377 P378	P128-F380 HydrophobicContact CG-CD2 4.31Å; P128-F380 HydrophobicContact CG-CE2 3.94Å; P128-F380 HydrophobicContact CG-CZ 4.21Å; T169-F380 HydrophobicContact CG2-CD1 3.91Å; T169-F380 HydrophobicContact CG2-CE1 3.76Å; I339-F380 PolarHBondContact N-O 3.47Å; V376-F380 HydrophobicContact CG1-CB 3.91Å; N377-F380 HydrophobicContact CB-CD2 3.78Å; N377-F380 HydrophobicContact CB-CE2 4.08Å; N377-F380 PolarHBondContact O-N 3.36Å; P378-F380 VanDerWaalsContact C-N 3.31Å
381	V	91.2	Very high	90.8	Very high	12 Å²	12	43.8 Å²	43.8	7%	0.073	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	140.6	177	177.8	0	0	0	0	110.3	A167 T194 L323 T336 C337 L338	A167-V381 HydrophobicContact CB-CB 4.28Å; A167-V381 HydrophobicContact CB-CG1 4.02Å; A167-V381 HydrophobicContact CB-CG2 3.85Å; T194-V381 HydrophobicContact CG2-CG2 3.87Å; L323-V381 HydrophobicContact CD1-CG1 4.38Å; L323-V381 HydrophobicContact CD1-CG2 4.2Å; T336-V381 HydrophobicContact CG2-CG1 3.47Å; T336-V381 VanDerWaalsContact CG2-CG1 3.47Å; C337-V381 WeakPolarHBondContact O-CA 3.42Å; L338-V381 HydrophobicContact CB-CG2 4.27Å; L338-V381 HydrophobicContact CD1-CG2 3.56Å
382	A	91.2	Very high	91	Very high	1 Å²	1	40 Å²	40	1%	0.008	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	142.9	172	0	0	0	0	0	111.7	C337 L366 V376	C337-A382 PolarHBondContact N-O 2.66Å; C337-A382 PolarHBondContact O-N 3.05Å; L366-A382 CarbonylContact O-C 3.48Å; L366-A382 WeakPolarHBondContact O-CA 3.27Å; V376-A382 HydrophobicContact CB-CB 4.21Å; V376-A382 HydrophobicContact CG1-CB 3.88Å; V376-A382 HydrophobicContact CG2-CB 3.53Å
383	R	92.4	Very high	91	Very high	79 Å²	79	35.7 Å²	35.7	30%	0.298	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	114.9	170.7	-177.3	179.6	-65.7	170.7	-0.7	109	E326 T334 A335 L366	E326-R383 WeakPolarHBondContact OE1-CD 3.47Å; E326-R383 IonicContact OE1-CZ 3.25Å; E326-R383 VanDerWaalsContact OE1-CZ 3.22Å; E326-R383 IonicContact OE1-NE 2.78Å; E326-R383 PolarHBondContact OE1-NE 2.76Å; E326-R383 IonicContact OE1-NH1 3.65Å; E326-R383 IonicContact OE1-NH2 3.12Å; T334-R383 HydrophobicContact CG2-CG 4.36Å; A335-R383 WeakPolarHBondContact O-CA 3.45Å; L366-R383 HydrophobicContact CB-CB 4.23Å; L366-R383 PolarHBondContact N-O 3.25Å; L366-R383 PolarHBondContact O-N 3.24Å
384	V	93.9	Very high	90.9	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	122.6	-175.4	-175.1	0	0	0	0	109.6	T334 A335 C337 L344 L353 P362 L365 W387	T334-V384 WeakPolarHBondContact CA-O 3.31Å; A335-V384 PolarHBondContact N-O 3.11Å; A335-V384 PolarHBondContact O-N 2.96Å; C337-V384 HydrophobicContact CB-CG2 4Å; L344-V384 HydrophobicContact CD2-CG2 3.69Å; L353-V384 HydrophobicContact CD1-CG1 4.14Å; P362-V384 HydrophobicContact CB-CG1 3.85Å; L365-V384 HydrophobicContact CD2-CB 4.21Å; L365-V384 HydrophobicContact CD2-CG1 3.99Å; L365-V384 HydrophobicContact CD2-CG2 3.75Å; V384-W387 VanDerWaalsContact O-CD1 3.3Å; V384-W387 PolarHBondContact O-NE1 2.97Å
385	A	93.3	Very high	91	Very high	4 Å²	4	32.5 Å²	32.5	3%	0.033	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	147.2	173.5	0	0	0	0	0	112	I331 T334 R363 I364	I331-A385 HydrophobicContact CG2-CB 3.47Å; I331-A385 VanDerWaalsContact CG2-CB 3.47Å; T334-A385 HydrophobicContact CG2-CB 3.83Å; R363-A385 PolarHBondContact N-O 3.38Å; I364-A385 HydrophobicContact CB-CB 4.07Å; I364-A385 PolarHBondContact O-N 3.13Å
386	G	90.9	Very high	91.1	Very high	19 Å²	19	34.5 Å²	34.5	20%	0.196	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	117.3	20.7	176.3	0	0	0	0	0	114.8	C360 T361	C360-G386 WeakPolarHBondContact CA-O 3.42Å; C360-G386 PolarHBondContact SG-O 2.78Å; C360-G386 VanDerWaalsContact SG-O 3.36Å; T361-G386 PolarHBondContact N-O 3.09Å
387	W	94.3	Very high	91.3	Very high	11 Å²	11	34.4 Å²	34.4	4%	0.042	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	130.7	174.9	-66.7	95.1	0	0	0	110.9	K333 A335 L353 A355 A358 C360 V384 D389 P391	K333-W387 HydrophobicContact CB-CB 4Å; A335-W387 HydrophobicContact CB-CZ2 4.29Å; L353-W387 HydrophobicContact CB-CH2 4.44Å; A355-W387 HydrophobicContact CB-CH2 3.52Å; A355-W387 HydrophobicContact CB-CZ3 3.64Å; A358-W387 HydrophobicContact CB-CE3 3.73Å; A358-W387 HydrophobicContact CB-CZ3 3.97Å; C360-W387 HydrophobicContact CB-CD2 3.45Å; C360-W387 VanDerWaalsContact CB-CD2 3.45Å; C360-W387 HydrophobicContact CB-CE3 3.43Å; C360-W387 VanDerWaalsContact CB-CE3 3.43Å; C360-W387 HydrophobicContact CB-CG 3.99Å; C360-W387 HydrophobicContact CB-CH2 3.94Å; C360-W387 HydrophobicContact CB-CZ2 4.01Å; C360-W387 HydrophobicContact CB-CZ3 3.67Å; V384-W387 VanDerWaalsContact O-CD1 3.3Å; V384-W387 PolarHBondContact O-NE1 2.97Å; W387-D389 WeakPolarHBondContact CB-O 3.35Å; W387-P391 HydrophobicContact CD2-CG 3.94Å; W387-P391 HydrophobicContact CE3-CB 4.27Å; W387-P391 HydrophobicContact CE3-CG 3.95Å; W387-P391 HydrophobicContact CH2-CB 4.48Å; W387-P391 HydrophobicContact CH2-CG 4.3Å; W387-P391 HydrophobicContact CZ2-CG 4.25Å; W387-P391 HydrophobicContact CZ3-CB 4.16Å; W387-P391 HydrophobicContact CZ3-CG 4.16Å
388	K	92	Very high	91.4	Very high	114 Å²	114	32.7 Å²	32.7	50%	0.496	18%	0.178	S	C	.	.	S	Bend	trans	-71.5	-46.2	172.8	-68.2	-179.2	-177.8	174.3	0	111.2	K333 V359	K333-K388 WeakPolarHBondContact CD-O 3.35Å; K333-K388 PolarHBondContact NZ-O 3Å; V359-K388 PolarHBondContact O-N 3.04Å
389	D	91.9	Very high	91.6	Very high	61 Å²	61	33.6 Å²	33.6	33%	0.326	18%	0.182	S	C	.	.	S	Bend	trans	-120.2	151.2	175.5	-63.7	-40.6	0	0	0	108.2	A358 W387 R414	A358-D389 HydrophobicContact CB-CB 4.24Å; A358-D389 VanDerWaalsContact CB-O 3.26Å; A358-D389 WeakPolarHBondContact CB-O 3.48Å; W387-D389 WeakPolarHBondContact CB-O 3.35Å; D389-R414 IonicContact OD2-CZ 2.54Å; D389-R414 IonicContact OD2-NH2 3.36Å; D389-R414 PolarHBondContact OD2-NH2 3.05Å
390	L	91.7	Very high	91.9	Very high	51 Å²	51	34.7 Å²	34.7	27%	0.267	19%	0.188	S	C	.	.	P	Polyproline II helix	trans	-72.1	128	178.3	-78.4	146.5	0	0	0	109.2	E326 T327 K333 V515	E326-L390 WeakPolarHBondContact O-CD2 3.37Å; T327-L390 HydrophobicContact CG2-CD1 3.71Å; T327-L390 HydrophobicContact CG2-CD2 3.96Å; T327-L390 HydrophobicContact CG2-CG 4.29Å; K333-L390 HydrophobicContact CB-CD2 4.17Å; K333-L390 HydrophobicContact CB-CG 4.32Å; K333-L390 HydrophobicContact CD-CG 4.09Å; K333-L390 HydrophobicContact CG-CD2 4.35Å; K333-L390 HydrophobicContact CG-CG 4.08Å; L390-V515 HydrophobicContact CD1-CB 4.28Å
391	P	93.6	Very high	91.8	Very high	3 Å²	3	40.6 Å²	40.6	2%	0.019	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-72.4	152.5	173	30.8	-33.9	0	0	0	110.8	V322 S325 A335 A355 A358 W387	V322-P391 HydrophobicContact CG1-CG 4.21Å; V322-P391 HydrophobicContact CG2-CB 4.09Å; V322-P391 HydrophobicContact CG2-CG 4.19Å; S325-P391 WeakPolarHBondContact CB-O 3.42Å; S325-P391 PolarHBondContact OG-O 3.49Å; A335-P391 HydrophobicContact CB-CG 3.73Å; A355-P391 HydrophobicContact CB-CB 3.88Å; A358-P391 HydrophobicContact CB-CB 4.04Å; W387-P391 HydrophobicContact CD2-CG 3.94Å; W387-P391 HydrophobicContact CE3-CB 4.27Å; W387-P391 HydrophobicContact CE3-CG 3.95Å; W387-P391 HydrophobicContact CH2-CB 4.48Å; W387-P391 HydrophobicContact CH2-CG 4.3Å; W387-P391 HydrophobicContact CZ2-CG 4.25Å; W387-P391 HydrophobicContact CZ3-CB 4.16Å; W387-P391 HydrophobicContact CZ3-CG 4.16Å
392	C	90.7	Very high	91.7	Very high	66 Å²	66	42.5 Å²	42.5	45%	0.446	23%	0.23	S	C	.	.	P	Polyproline II helix	trans	-75.1	141.9	172.2	-64.9	0	0	0	0	109.5	G394 D395	C392-G394 PolarHBondContact O-N 3.44Å; C392-D395 WeakPolarHBondContact CB-OD2 3.19Å; C392-D395 PolarHBondContact N-OD2 3.23Å; C392-D395 WeakPolarHBondContact O-CB 3.41Å; C392-D395 PolarHBondContact O-N 3.03Å
393	A	88.5	Confident	91.5	Very high	9 Å²	9	46.1 Å²	46.1	7%	0.074	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	127.2	177	0	0	0	0	0	110.1	R210 L323	R210-A393 VanDerWaalsContact CD-O 3.28Å; R210-A393 WeakPolarHBondContact CD-O 3.48Å; R210-A393 PolarHBondContact NH1-O 2.85Å; L323-A393 VanDerWaalsContact O-CB 3.27Å; L323-A393 WeakPolarHBondContact O-CB 3.24Å
394	G	87.9	Confident	91.5	Very high	31 Å²	31	49.8 Å²	49.8	32%	0.32	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	101.5	-7.6	-171.3	0	0	0	0	0	115	V322 C392	V322-G394 WeakPolarHBondContact O-CA 3.36Å; V322-G394 PolarHBondContact O-N 3.45Å; C392-G394 PolarHBondContact O-N 3.44Å
395	D	91.4	Very high	91.3	Very high	45 Å²	45	53.9 Å²	53.9	24%	0.241	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-68.5	143.6	178.1	-77.7	-13.1	0	0	0	111.9	V322 A355 G356 C392	V322-D395 HydrophobicContact CG2-CB 4.48Å; V322-D395 PolarHBondContact N-O 3.23Å; A355-D395 HydrophobicContact CB-CB 4.26Å; G356-D395 WeakPolarHBondContact CA-OD2 3.23Å; C392-D395 WeakPolarHBondContact CB-OD2 3.19Å; C392-D395 PolarHBondContact N-OD2 3.23Å; C392-D395 WeakPolarHBondContact O-CB 3.41Å; C392-D395 PolarHBondContact O-N 3.03Å
396	L	92.8	Very high	91.1	Very high	101 Å²	101	53.7 Å²	53.7	53%	0.529	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	128.6	171.5	-68.1	169.9	0	0	0	110.1	G320 V321 A355	G320-L396 WeakPolarHBondContact O-CA 3.45Å; V321-L396 HydrophobicContact CG2-CD2 4.07Å; A355-L396 WeakPolarHBondContact CA-O 3.29Å
397	I	94.4	Very high	91.1	Very high	9 Å²	9	55.1 Å²	55.1	5%	0.046	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	125.6	175.1	-52.3	171	0	0	0	107.7	E319 G320 V322 C337 L353 I354 A355	E319-I397 VanDerWaalsContact CA-O 3.32Å; E319-I397 WeakPolarHBondContact CA-O 3.19Å; G320-I397 PolarHBondContact N-O 3.17Å; G320-I397 PolarHBondContact O-N 2.93Å; V322-I397 HydrophobicContact CG2-CD1 3.67Å; V322-I397 HydrophobicContact CG2-CG1 3.55Å; C337-I397 HydrophobicContact CB-CD1 3.45Å; C337-I397 VanDerWaalsContact CB-CD1 3.45Å; C337-I397 WeakPolarHBondContact SG-CD1 3.21Å; L353-I397 HydrophobicContact CB-CG2 4.03Å; L353-I397 HydrophobicContact CD1-CG2 4.12Å; L353-I397 HydrophobicContact CD2-CG2 4.13Å; L353-I397 HydrophobicContact CG-CG2 4.32Å; I354-I397 WeakPolarHBondContact O-CA 3.19Å; A355-I397 HydrophobicContact CB-CG1 4.1Å
398	L	93.4	Very high	90.9	Very high	14 Å²	14	59.1 Å²	59.1	7%	0.073	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	128.8	173.5	-58.7	175	0	0	0	109.4	A113 E319 L353 I354	A113-L398 HydrophobicContact CB-CD1 3.86Å; A113-L398 WeakPolarHBondContact O-CD1 3.44Å; E319-L398 HydrophobicContact CB-CD2 4.49Å; E319-L398 HydrophobicContact CG-CD2 3.93Å; L353-L398 WeakPolarHBondContact CA-O 3.37Å; I354-L398 HydrophobicContact CG2-CB 4.01Å; I354-L398 PolarHBondContact N-O 3.19Å; I354-L398 PolarHBondContact O-N 2.95Å
399	E	93.6	Very high	90.8	Very high	20 Å²	20	53.7 Å²	53.7	9%	0.093	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	134.9	168.3	-174.1	179.6	-173.4	0	0	110.7	L317 A318 S350 G351 L353	L317-E399 HydrophobicContact CB-CB 4.21Å; L317-E399 HydrophobicContact CD2-CG 4.16Å; A318-E399 HydrophobicContact CB-CB 4.16Å; A318-E399 VanDerWaalsContact CB-OE2 3.32Å; A318-E399 WeakPolarHBondContact CB-OE2 3.49Å; A318-E399 PolarHBondContact N-OE2 3.29Å; A318-E399 WeakPolarHBondContact O-CB 3.39Å; A318-E399 PolarHBondContact O-N 3.42Å; S350-E399 VanDerWaalsContact CA-OE1 3.24Å; S350-E399 WeakPolarHBondContact CA-OE1 3.33Å; S350-E399 WeakPolarHBondContact CB-OE1 3.1Å; G351-E399 PolarHBondContact N-OE1 3.31Å; L353-E399 HydrophobicContact CD2-CB 3.7Å; L353-E399 HydrophobicContact CD2-CG 4.04Å
400	L	91.2	Very high	90.8	Very high	22 Å²	22	51.6 Å²	51.6	12%	0.115	27%	0.271	C	S	.	.			trans	-119.1	155.3	-179.7	-65.5	174.8	0	0	0	111.3	A113 G351 P352 I354 S402 R405 A406 V409	A113-L400 HydrophobicContact CB-CD2 3.89Å; G351-L400 WeakPolarHBondContact CA-O 3.37Å; P352-L400 VanDerWaalsContact CD-O 3.24Å; P352-L400 WeakPolarHBondContact CD-O 3.08Å; P352-L400 HydrophobicContact CG-CB 4.4Å; P352-L400 PolarHBondContact O-N 3.25Å; I354-L400 HydrophobicContact CB-CD1 4.31Å; I354-L400 HydrophobicContact CG2-CD1 3.8Å; I354-L400 HydrophobicContact CG2-CG 4.19Å; L400-S402 PolarHBondContact O-N 3.12Å; L400-R405 HydrophobicContact CD1-CG 4.41Å; L400-A406 HydrophobicContact CD1-CB 3.89Å; L400-V409 HydrophobicContact CD1-CG2 4.24Å
401	E	87.6	Confident	90.8	Very high	180 Å²	180	57.5 Å²	57.5	84%	0.841	29%	0.29	S	S	*	.	S	Bend	trans	-67	-31.9	-177.7	-60.1	171.6	-177.1	0	0	113.9
402	S	88.7	Confident	90.7	Very high	52 Å²	52	60.4 Å²	60.4	36%	0.364	30%	0.301	S	S	.	.			trans	-143.5	145.2	-170.5	-170.9	0	0	0	0	113.5	L400 K404 R405 A406	L400-S402 PolarHBondContact O-N 3.12Å; S402-K404 PolarHBondContact O-N 2.88Å; S402-K404 PolarHBondContact OG-N 3.5Å; S402-R405 PolarHBondContact O-N 3.28Å; S402-R405 VanDerWaalsContact O-N 3.16Å; S402-A406 PolarHBondContact O-N 3.49Å
403	T	88.2	Confident	90.7	Very high	77 Å²	77	59.4 Å²	59.4	47%	0.472	29%	0.288	S	S	.	.	H	α-helix	trans	-62.7	-28.8	174.5	57.4	0	0	0	0	112.7	P352 N407	P352-T403 HydrophobicContact CB-CG2 4.28Å; P352-T403 HydrophobicContact CG-CG2 4.12Å; T403-N407 VanDerWaalsContact O-CG 3.24Å; T403-N407 PolarHBondContact O-N 2.9Å; T403-N407 VanDerWaalsContact O-N 3.11Å; T403-N407 PolarHBondContact O-ND2 2.73Å
404	K	90.7	Very high	90.8	Very high	157 Å²	157	63.1 Å²	63.1	68%	0.683	30%	0.3	S	S	*	.	H	α-helix	trans	-63.1	-49.6	173.4	-69.3	-176.6	179.7	178.1	0	110.7	S402 A406 N407 E408	S402-K404 PolarHBondContact O-N 2.88Å; S402-K404 PolarHBondContact OG-N 3.5Å; K404-A406 VanDerWaalsContact C-N 3.35Å; K404-A406 PolarHBondContact O-N 3.22Å; K404-N407 PolarHBondContact O-N 3.31Å; K404-E408 PolarHBondContact O-N 3.34Å
405	R	89.7	Confident	91	Very high	86 Å²	86	65 Å²	65	33%	0.325	31%	0.307	S	S	.	.	H	α-helix	trans	-61.4	-43.5	178.2	-174.2	61	-179.2	170.6	1	111.4	C111 D112 L400 S402 N407 E408 V409	C111-R405 PolarHBondContact O-NH2 3.42Å; C111-R405 VanDerWaalsContact O-NH2 3.13Å; D112-R405 PolarHBondContact O-NH2 2.93Å; L400-R405 HydrophobicContact CD1-CG 4.41Å; S402-R405 PolarHBondContact O-N 3.28Å; S402-R405 VanDerWaalsContact O-N 3.16Å; R405-N407 VanDerWaalsContact C-N 3.31Å; R405-N407 PolarHBondContact O-N 3.02Å; R405-E408 IonicContact NH1-OE2 2.66Å; R405-E408 WeakPolarHBondContact O-CB 3.48Å; R405-E408 PolarHBondContact O-N 3.35Å; R405-E408 VanDerWaalsContact O-N 3.14Å; R405-V409 HydrophobicContact CG-CG2 4.42Å; R405-V409 VanDerWaalsContact O-CG2 3.3Å; R405-V409 WeakPolarHBondContact O-CG2 3.39Å; R405-V409 PolarHBondContact O-N 3.43Å
406	A	89.3	Confident	90.9	Very high	0 Å²	0	65.6 Å²	65.6	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-58.3	-41.3	176.1	0	0	0	0	0	112.9	P352 V359 L400 S402 K404 Q410	P352-A406 HydrophobicContact CB-CB 4.06Å; P352-A406 HydrophobicContact CG-CB 3.92Å; V359-A406 HydrophobicContact CG1-CB 4.02Å; V359-A406 HydrophobicContact CG2-CB 4.49Å; L400-A406 HydrophobicContact CD1-CB 3.89Å; S402-A406 PolarHBondContact O-N 3.49Å; K404-A406 VanDerWaalsContact C-N 3.35Å; K404-A406 PolarHBondContact O-N 3.22Å; A406-Q410 VanDerWaalsContact O-CB 3.31Å; A406-Q410 WeakPolarHBondContact O-CB 3.41Å; A406-Q410 PolarHBondContact O-N 2.76Å
407	N	91.1	Very high	90.7	Very high	48 Å²	48	66.7 Å²	66.7	26%	0.257	31%	0.31	S	S	.	.	H	α-helix	trans	-71.1	-32.6	177	-65.4	-38.3	0	0	0	112.8	T403 K404 R405 R411	T403-N407 VanDerWaalsContact O-CG 3.24Å; T403-N407 PolarHBondContact O-N 2.9Å; T403-N407 VanDerWaalsContact O-N 3.11Å; T403-N407 PolarHBondContact O-ND2 2.73Å; K404-N407 PolarHBondContact O-N 3.31Å; R405-N407 VanDerWaalsContact C-N 3.31Å; R405-N407 PolarHBondContact O-N 3.02Å; N407-R411 WeakPolarHBondContact O-CB 3.43Å; N407-R411 VanDerWaalsContact O-CG 3.25Å; N407-R411 WeakPolarHBondContact O-CG 3.49Å; N407-R411 PolarHBondContact O-N 3.46Å
408	E	90.5	Very high	90.6	Very high	95 Å²	95	71.4 Å²	71.4	44%	0.444	33%	0.334	S	S	.	.	H	α-helix	trans	-64.6	-48.7	173.7	-73.8	170.2	-174.1	0	0	111.1	K404 R405 Q410 R411 Y412	K404-E408 PolarHBondContact O-N 3.34Å; R405-E408 IonicContact NH1-OE2 2.66Å; R405-E408 WeakPolarHBondContact O-CB 3.48Å; R405-E408 PolarHBondContact O-N 3.35Å; R405-E408 VanDerWaalsContact O-N 3.14Å; E408-Q410 PolarHBondContact O-N 2.9Å; E408-R411 PolarHBondContact O-N 2.99Å; E408-Y412 WeakPolarHBondContact O-CB 3.46Å; E408-Y412 PolarHBondContact O-N 2.89Å
409	V	90.8	Very high	90.5	Very high	0 Å²	0	77 Å²	77	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-61.1	-45.3	176.6	179.5	0	0	0	0	110.4	C111 D112 A113 I354 L400 R405 R411 Y412 R413	C111-V409 VanDerWaalsContact O-CG2 3.27Å; C111-V409 WeakPolarHBondContact O-CG2 3.48Å; D112-V409 VanDerWaalsContact OD1-CG1 3.29Å; D112-V409 WeakPolarHBondContact OD1-CG1 3.5Å; A113-V409 HydrophobicContact CB-CG1 4.06Å; A113-V409 HydrophobicContact CB-CG2 4.12Å; I354-V409 HydrophobicContact CD1-CB 3.67Å; I354-V409 HydrophobicContact CD1-CG1 3.44Å; I354-V409 VanDerWaalsContact CD1-CG1 3.44Å; L400-V409 HydrophobicContact CD1-CG2 4.24Å; R405-V409 HydrophobicContact CG-CG2 4.42Å; R405-V409 VanDerWaalsContact O-CG2 3.3Å; R405-V409 WeakPolarHBondContact O-CG2 3.39Å; R405-V409 PolarHBondContact O-N 3.43Å; V409-R411 VanDerWaalsContact C-N 3.34Å; V409-R411 PolarHBondContact O-N 3.03Å; V409-Y412 WeakPolarHBondContact O-CB 3.41Å; V409-Y412 PolarHBondContact O-N 3.02Å; V409-R413 HydrophobicContact CG1-CG 4.42Å; V409-R413 WeakPolarHBondContact O-CG 3.19Å; V409-R413 PolarHBondContact O-N 3.39Å
410	Q	91.4	Very high	90.4	Very high	17 Å²	17	80 Å²	80	8%	0.079	38%	0.377	C	S	.	.	H	α-helix	trans	-57.3	-45.8	175.9	177.6	-179.2	49.8	0	0	112	I354 E357 V359 A406 E408 Y412 R414	I354-Q410 HydrophobicContact CD1-CB 4.4Å; E357-Q410 WeakPolarHBondContact O-CG 3.43Å; E357-Q410 PolarHBondContact O-NE2 2.84Å; V359-Q410 HydrophobicContact CG2-CB 3.88Å; V359-Q410 HydrophobicContact CG2-CG 4.21Å; A406-Q410 VanDerWaalsContact O-CB 3.31Å; A406-Q410 WeakPolarHBondContact O-CB 3.41Å; A406-Q410 PolarHBondContact O-N 2.76Å; E408-Q410 PolarHBondContact O-N 2.9Å; Q410-Y412 VanDerWaalsContact C-N 3.34Å; Q410-R414 WeakPolarHBondContact O-CB 3.34Å; Q410-R414 WeakPolarHBondContact O-CG 3.24Å; Q410-R414 PolarHBondContact O-N 2.86Å
411	R	91.4	Very high	90.6	Very high	176 Å²	176	85 Å²	85	66%	0.664	40%	0.398	S	S	*	.	H	α-helix	trans	-64.4	-41.9	177.8	-76.8	172.7	-180	173.1	0.8	111.3	N407 E408 V409 R414 C415	N407-R411 WeakPolarHBondContact O-CB 3.43Å; N407-R411 VanDerWaalsContact O-CG 3.25Å; N407-R411 WeakPolarHBondContact O-CG 3.49Å; N407-R411 PolarHBondContact O-N 3.46Å; E408-R411 PolarHBondContact O-N 2.99Å; V409-R411 VanDerWaalsContact C-N 3.34Å; V409-R411 PolarHBondContact O-N 3.03Å; R411-R414 PolarHBondContact O-N 2.91Å; R411-C415 WeakPolarHBondContact O-CB 3.49Å; R411-C415 PolarHBondContact O-N 3.45Å; R411-C415 PolarHBondContact O-SG 3.21Å
412	Y	91.2	Very high	90.8	Very high	63 Å²	63	79.2 Å²	79.2	25%	0.247	37%	0.374	C	S	.	.	H	α-helix	trans	-60.2	-51.6	178.1	-176.1	-103.4	0	0	0	111.3	D110 C111 D112 E408 V409 Q410 R414 C415 I416	D110-Y412 WeakPolarHBondContact OD1-CE1 3.43Å; C111-Y412 HydrophobicContact CB-CD2 4.27Å; C111-Y412 HydrophobicContact CB-CG 4.29Å; D112-Y412 HydrophobicContact CB-CD1 3.92Å; D112-Y412 HydrophobicContact CB-CE1 3.89Å; E408-Y412 WeakPolarHBondContact O-CB 3.46Å; E408-Y412 PolarHBondContact O-N 2.89Å; V409-Y412 WeakPolarHBondContact O-CB 3.41Å; V409-Y412 PolarHBondContact O-N 3.02Å; Q410-Y412 VanDerWaalsContact C-N 3.34Å; Y412-R414 PolarHBondContact O-N 3.26Å; Y412-C415 WeakPolarHBondContact O-CB 3.48Å; Y412-C415 PolarHBondContact O-N 3.42Å; Y412-C415 VanDerWaalsContact O-N 3.13Å; Y412-I416 HydrophobicContact CD1-CD1 3.8Å; Y412-I416 HydrophobicContact CE1-CD1 3.27Å; Y412-I416 HydrophobicContact CE1-CG1 4.38Å; Y412-I416 HydrophobicContact CE2-CD1 4.38Å; Y412-I416 PolarHBondContact O-N 3.18Å
413	R	91.7	Very high	91	Very high	46 Å²	46	83.2 Å²	83.2	17%	0.174	39%	0.385	C	S	.	.	H	α-helix	trans	-59.9	-41.7	176.7	-69.6	-179.3	179.8	-175.7	-2.6	112.9	D112 A113 G356 V409 I416 K417	D112-R413 IonicContact OD1-CZ 3.47Å; D112-R413 VanDerWaalsContact OD1-CZ 3.25Å; D112-R413 IonicContact OD1-NE 3.65Å; D112-R413 PolarHBondContact OD1-NE 3.24Å; D112-R413 IonicContact OD1-NH2 3.79Å; D112-R413 PolarHBondContact OD1-NH2 3.41Å; D112-R413 IonicContact OD2-NE 2.69Å; A113-R413 PolarHBondContact O-NH2 3.37Å; A113-R413 VanDerWaalsContact O-NH2 3.11Å; G356-R413 WeakPolarHBondContact O-CD 3.49Å; G356-R413 PolarHBondContact O-NH1 2.95Å; V409-R413 HydrophobicContact CG1-CG 4.42Å; V409-R413 WeakPolarHBondContact O-CG 3.19Å; V409-R413 PolarHBondContact O-N 3.39Å; R413-I416 PolarHBondContact O-N 3.46Å; R413-K417 PolarHBondContact O-N 3.2Å
414	R	90.4	Very high	91.1	Very high	87 Å²	87	85.8 Å²	85.8	33%	0.328	39%	0.392	S	S	.	.	H	α-helix	trans	-62.5	-42.4	174.1	-78.2	179.6	175.1	170	3.4	112.3	E357 D389 Q410 R411 Y412 K417 I418	E357-R414 HydrophobicContact CG-CG 4.25Å; E357-R414 IonicContact OE2-NE 2.98Å; D389-R414 IonicContact OD2-CZ 2.54Å; D389-R414 IonicContact OD2-NH2 3.36Å; D389-R414 PolarHBondContact OD2-NH2 3.05Å; Q410-R414 WeakPolarHBondContact O-CB 3.34Å; Q410-R414 WeakPolarHBondContact O-CG 3.24Å; Q410-R414 PolarHBondContact O-N 2.86Å; R411-R414 PolarHBondContact O-N 2.91Å; Y412-R414 PolarHBondContact O-N 3.26Å; R414-K417 PolarHBondContact O-N 3.43Å; R414-I418 WeakPolarHBondContact O-CB 3.45Å; R414-I418 WeakPolarHBondContact O-CD1 3.45Å; R414-I418 WeakPolarHBondContact O-CG1 3.37Å; R414-I418 PolarHBondContact O-N 3.47Å
415	C	90.8	Very high	91.2	Very high	71 Å²	71	82.8 Å²	82.8	48%	0.48	38%	0.383	S	S	.	.	H	α-helix	trans	-61.4	-44.6	177.1	-74.9	0	0	0	0	111.6	R411 Y412 I418 Q419	R411-C415 WeakPolarHBondContact O-CB 3.49Å; R411-C415 PolarHBondContact O-N 3.45Å; R411-C415 PolarHBondContact O-SG 3.21Å; Y412-C415 WeakPolarHBondContact O-CB 3.48Å; Y412-C415 PolarHBondContact O-N 3.42Å; Y412-C415 VanDerWaalsContact O-N 3.13Å; C415-I418 PolarHBondContact O-N 2.87Å; C415-Q419 VanDerWaalsContact O-CG 3.29Å; C415-Q419 WeakPolarHBondContact O-CG 3.28Å; C415-Q419 PolarHBondContact O-N 3.37Å
416	I	90.7	Very high	91.3	Very high	57 Å²	57	86.7 Å²	86.7	29%	0.292	40%	0.398	S	S	.	.	H	α-helix	trans	-60.1	-52.4	176.8	-69.9	171.9	0	0	0	110.3	Y412 R413 I418 Q419 D420	Y412-I416 HydrophobicContact CD1-CD1 3.8Å; Y412-I416 HydrophobicContact CE1-CD1 3.27Å; Y412-I416 HydrophobicContact CE1-CG1 4.38Å; Y412-I416 HydrophobicContact CE2-CD1 4.38Å; Y412-I416 PolarHBondContact O-N 3.18Å; R413-I416 PolarHBondContact O-N 3.46Å; I416-I418 VanDerWaalsContact C-N 3.26Å; I416-I418 PolarHBondContact O-N 3.39Å; I416-Q419 WeakPolarHBondContact O-CA 3.27Å; I416-Q419 WeakPolarHBondContact O-CB 3.49Å; I416-Q419 PolarHBondContact O-N 3Å; I416-D420 WeakPolarHBondContact CG2-OD2 3.43Å; I416-D420 PolarHBondContact O-N 3.17Å
417	K	88.9	Confident	91.4	Very high	124 Å²	124	91 Å²	91	54%	0.539	42%	0.421	S	S	.	.	H	α-helix	trans	-58.6	-38.3	-179.9	-173.5	177.3	180	172.2	0	113	E357 R413 R414 K421	E357-K417 WeakPolarHBondContact OE1-CD 3.39Å; E357-K417 WeakPolarHBondContact OE1-CE 3.22Å; E357-K417 IonicContact OE1-NZ 2.95Å; E357-K417 PolarHBondContact OE1-NZ 3.34Å; R413-K417 PolarHBondContact O-N 3.2Å; R414-K417 PolarHBondContact O-N 3.43Å; K417-K421 WeakPolarHBondContact O-CB 3.35Å; K417-K421 PolarHBondContact O-N 3.42Å
418	I	91.5	Very high	91.4	Very high	107 Å²	107	90.6 Å²	90.6	55%	0.549	43%	0.425	S	S	.	.	H	α-helix	trans	-66.6	-41.7	174.7	-68.9	165.5	0	0	0	110.6	R414 C415 I416 K421 V422	R414-I418 WeakPolarHBondContact O-CB 3.45Å; R414-I418 WeakPolarHBondContact O-CD1 3.45Å; R414-I418 WeakPolarHBondContact O-CG1 3.37Å; R414-I418 PolarHBondContact O-N 3.47Å; C415-I418 PolarHBondContact O-N 2.87Å; I416-I418 VanDerWaalsContact C-N 3.26Å; I416-I418 PolarHBondContact O-N 3.39Å; I418-K421 PolarHBondContact O-N 3.29Å; I418-V422 HydrophobicContact CG2-CG2 4.35Å; I418-V422 WeakPolarHBondContact O-CB 3.33Å; I418-V422 WeakPolarHBondContact O-CG2 3.49Å; I418-V422 PolarHBondContact O-N 2.96Å
419	Q	91.2	Very high	91.3	Very high	131 Å²	131	93.3 Å²	93.3	61%	0.612	43%	0.432	S	S	*	.	H	α-helix	trans	-63.7	-42.9	177.2	-74.6	175.5	0.2	0	0	112.2	C415 I416 V422 K423	C415-Q419 VanDerWaalsContact O-CG 3.29Å; C415-Q419 WeakPolarHBondContact O-CG 3.28Å; C415-Q419 PolarHBondContact O-N 3.37Å; I416-Q419 WeakPolarHBondContact O-CA 3.27Å; I416-Q419 WeakPolarHBondContact O-CB 3.49Å; I416-Q419 PolarHBondContact O-N 3Å; Q419-V422 PolarHBondContact O-N 2.79Å; Q419-K423 PolarHBondContact O-N 2.8Å
420	D	92.5	Very high	91.3	Very high	84 Å²	84	96.5 Å²	96.5	45%	0.449	45%	0.449	S	S	.	.	H	α-helix	trans	-62.1	-47.5	176.8	-68.1	-25.5	0	0	0	110.8	I416 V422 K423 E424	I416-D420 WeakPolarHBondContact CG2-OD2 3.43Å; I416-D420 PolarHBondContact O-N 3.17Å; D420-V422 VanDerWaalsContact C-N 3.32Å; D420-V422 PolarHBondContact O-N 2.99Å; D420-K423 WeakPolarHBondContact O-CB 3.49Å; D420-K423 PolarHBondContact O-N 3.46Å; D420-K423 VanDerWaalsContact O-N 3.08Å; D420-E424 WeakPolarHBondContact O-CG 3.44Å; D420-E424 PolarHBondContact O-N 2.91Å
421	K	93.7	Very high	91.1	Very high	128 Å²	128	101.9 Å²	101.9	56%	0.557	48%	0.477	S	S	*	.	H	α-helix	trans	-59.4	-41.9	174.4	-176.1	176.3	178.5	175.4	0	112.4	K417 I418 K423 E424 D425	K417-K421 WeakPolarHBondContact O-CB 3.35Å; K417-K421 PolarHBondContact O-N 3.42Å; I418-K421 PolarHBondContact O-N 3.29Å; K421-K423 VanDerWaalsContact C-N 3.27Å; K421-K423 PolarHBondContact O-N 3.28Å; K421-E424 PolarHBondContact O-N 2.88Å; K421-D425 WeakPolarHBondContact O-CB 3.42Å; K421-D425 VanDerWaalsContact O-CG 3.28Å; K421-D425 PolarHBondContact O-N 2.81Å
422	V	92.2	Very high	90.7	Very high	57 Å²	57	102.3 Å²	102.3	35%	0.345	48%	0.479	S	S	.	.	H	α-helix	trans	-63.7	-35.4	176.8	165.9	0	0	0	0	111.3	I418 Q419 D420 R426	I418-V422 HydrophobicContact CG2-CG2 4.35Å; I418-V422 WeakPolarHBondContact O-CB 3.33Å; I418-V422 WeakPolarHBondContact O-CG2 3.49Å; I418-V422 PolarHBondContact O-N 2.96Å; Q419-V422 PolarHBondContact O-N 2.79Å; D420-V422 VanDerWaalsContact C-N 3.32Å; D420-V422 PolarHBondContact O-N 2.99Å; V422-R426 VanDerWaalsContact O-CB 3.26Å; V422-R426 WeakPolarHBondContact O-CB 3.47Å; V422-R426 PolarHBondContact O-N 3.33Å
423	K	93	Very high	90.5	Very high	136 Å²	136	100.4 Å²	100.4	59%	0.591	48%	0.476	S	S	*	.	H	α-helix	trans	-67.1	-47.7	175.6	-174.3	-174.6	173.6	-169.6	0	111	Q419 D420 K421 D425 R426 D427	Q419-K423 PolarHBondContact O-N 2.8Å; D420-K423 WeakPolarHBondContact O-CB 3.49Å; D420-K423 PolarHBondContact O-N 3.46Å; D420-K423 VanDerWaalsContact O-N 3.08Å; K421-K423 VanDerWaalsContact C-N 3.27Å; K421-K423 PolarHBondContact O-N 3.28Å; K423-D425 PolarHBondContact O-N 3.34Å; K423-R426 WeakPolarHBondContact O-CB 3.38Å; K423-R426 PolarHBondContact O-N 2.91Å; K423-D427 VanDerWaalsContact O-CG 3.3Å; K423-D427 PolarHBondContact O-N 2.81Å
424	E	90.9	Very high	90.2	Very high	132 Å²	132	100.2 Å²	100.2	62%	0.617	48%	0.482	S	S	*	.	H	α-helix	trans	-58.8	-46.5	174.9	-68.7	173.4	-179.1	0	0	111.9	D420 K421 R426 D427 A428	D420-E424 WeakPolarHBondContact O-CG 3.44Å; D420-E424 PolarHBondContact O-N 2.91Å; K421-E424 PolarHBondContact O-N 2.88Å; E424-R426 VanDerWaalsContact C-N 3.27Å; E424-R426 PolarHBondContact O-N 3.42Å; E424-D427 PolarHBondContact O-N 3.13Å; E424-A428 WeakPolarHBondContact O-CB 3.36Å; E424-A428 PolarHBondContact O-N 2.83Å
425	D	92.9	Very high	89.7	Confident	93 Å²	93	102.2 Å²	102.2	50%	0.497	50%	0.495	S	S	.	.	H	α-helix	trans	-61.2	-38	177.1	-76.9	-23.7	0	0	0	111.3	K421 K423 Y429	K421-D425 WeakPolarHBondContact O-CB 3.42Å; K421-D425 VanDerWaalsContact O-CG 3.28Å; K421-D425 PolarHBondContact O-N 2.81Å; K423-D425 PolarHBondContact O-N 3.34Å; D425-Y429 WeakPolarHBondContact O-CB 2.91Å; D425-Y429 PolarHBondContact O-N 2.86Å
426	R	90.7	Very high	89.1	Confident	168 Å²	168	104.4 Å²	104.4	63%	0.634	50%	0.498	S	S	*	.	H	α-helix	trans	-66	-46.8	175.3	178.5	-178.9	178.2	173.7	-0.5	111.4	V422 K423 E424 A428 Y429 D430	V422-R426 VanDerWaalsContact O-CB 3.26Å; V422-R426 WeakPolarHBondContact O-CB 3.47Å; V422-R426 PolarHBondContact O-N 3.33Å; K423-R426 WeakPolarHBondContact O-CB 3.38Å; K423-R426 PolarHBondContact O-N 2.91Å; E424-R426 VanDerWaalsContact C-N 3.27Å; E424-R426 PolarHBondContact O-N 3.42Å; R426-A428 VanDerWaalsContact C-N 3.34Å; R426-A428 PolarHBondContact O-N 2.81Å; R426-Y429 WeakPolarHBondContact O-CB 3.4Å; R426-Y429 PolarHBondContact O-N 2.8Å; R426-D430 IonicContact NE-OD2 2.93Å; R426-D430 WeakPolarHBondContact O-CB 3.44Å; R426-D430 PolarHBondContact O-N 2.85Å
427	D	92.1	Very high	88.7	Confident	90 Å²	90	108.9 Å²	108.9	48%	0.481	51%	0.511	S	S	.	.	H	α-helix	trans	-64.1	-42.3	-179.9	-66.4	-19.9	0	0	0	110.6	K423 E424 D430 L431	K423-D427 VanDerWaalsContact O-CG 3.3Å; K423-D427 PolarHBondContact O-N 2.81Å; E424-D427 PolarHBondContact O-N 3.13Å; D427-D430 PolarHBondContact O-N 3.49Å; D427-L431 WeakPolarHBondContact O-CB 3.21Å; D427-L431 PolarHBondContact O-N 2.62Å
428	A	90.3	Very high	88.4	Confident	41 Å²	41	107.8 Å²	107.8	34%	0.339	51%	0.508	S	S	.	.	H	α-helix	trans	-64.4	-39.4	173.9	0	0	0	0	0	112.5	E424 R426 R432	E424-A428 WeakPolarHBondContact O-CB 3.36Å; E424-A428 PolarHBondContact O-N 2.83Å; R426-A428 VanDerWaalsContact C-N 3.34Å; R426-A428 PolarHBondContact O-N 2.81Å; A428-R432 WeakPolarHBondContact O-CG 3.45Å; A428-R432 PolarHBondContact O-N 2.89Å; A428-R432 VanDerWaalsContact O-N 3.07Å
429	Y	89.7	Confident	87.8	Confident	151 Å²	151	108 Å²	108	59%	0.592	51%	0.506	S	S	*	.	H	α-helix	trans	-63.7	-47.4	173.9	176.2	-91.8	0	0	0	111.3	D425 R426 L431 R432 A433	D425-Y429 WeakPolarHBondContact O-CB 2.91Å; D425-Y429 PolarHBondContact O-N 2.86Å; R426-Y429 WeakPolarHBondContact O-CB 3.4Å; R426-Y429 PolarHBondContact O-N 2.8Å; Y429-L431 VanDerWaalsContact C-N 3.31Å; Y429-L431 PolarHBondContact O-N 2.98Å; Y429-R432 PolarHBondContact O-N 2.93Å; Y429-A433 HydrophobicContact CD1-CB 4.41Å; Y429-A433 HydrophobicContact CE1-CB 4.13Å; Y429-A433 WeakPolarHBondContact O-CB 3.45Å; Y429-A433 PolarHBondContact O-N 2.71Å
430	D	89.7	Confident	87.1	Confident	68 Å²	68	109.8 Å²	109.8	36%	0.364	51%	0.507	S	S	.	.	H	α-helix	trans	-63.3	-38.2	-178.4	-76.9	-20.3	0	0	0	111	R426 D427 A433 S434	R426-D430 IonicContact NE-OD2 2.93Å; R426-D430 WeakPolarHBondContact O-CB 3.44Å; R426-D430 PolarHBondContact O-N 2.85Å; D427-D430 PolarHBondContact O-N 3.49Å; D430-A433 PolarHBondContact O-N 2.87Å; D430-S434 WeakPolarHBondContact O-CB 3.29Å; D430-S434 PolarHBondContact O-N 3.05Å
431	L	87.4	Confident	86.6	Confident	129 Å²	129	110.8 Å²	110.8	68%	0.675	51%	0.509	S	S	*	.	H	α-helix	trans	-65.4	-46	173.1	-175.8	67.2	0	0	0	112.8	D427 Y429 A433 S434	D427-L431 WeakPolarHBondContact O-CB 3.21Å; D427-L431 PolarHBondContact O-N 2.62Å; Y429-L431 VanDerWaalsContact C-N 3.31Å; Y429-L431 PolarHBondContact O-N 2.98Å; L431-A433 VanDerWaalsContact C-N 3.28Å; L431-A433 PolarHBondContact O-N 3.36Å; L431-S434 PolarHBondContact O-N 3.32Å; L431-S434 PolarHBondContact O-OG 2.94Å
432	R	84.1	Confident	86.2	Confident	186 Å²	186	110.4 Å²	110.4	70%	0.702	51%	0.508	S	S	*	.	H	α-helix	trans	-63.7	-38.5	174.7	-72.1	178.1	-175.1	156	3.1	111	A428 Y429 H436	A428-R432 WeakPolarHBondContact O-CG 3.45Å; A428-R432 PolarHBondContact O-N 2.89Å; A428-R432 VanDerWaalsContact O-N 3.07Å; Y429-R432 PolarHBondContact O-N 2.93Å; R432-H436 PolarHBondContact O-CD2 3.42Å; R432-H436 PolarHBondContact O-N 3.06Å
433	A	85.8	Confident	85.6	Confident	22 Å²	22	110.7 Å²	110.7	18%	0.182	50%	0.503	C	S	.	.	H	α-helix	trans	-71.3	-31.6	-179.8	0	0	0	0	0	112.7	Y429 D430 L431 H436 R437	Y429-A433 HydrophobicContact CD1-CB 4.41Å; Y429-A433 HydrophobicContact CE1-CB 4.13Å; Y429-A433 WeakPolarHBondContact O-CB 3.45Å; Y429-A433 PolarHBondContact O-N 2.71Å; D430-A433 PolarHBondContact O-N 2.87Å; L431-A433 VanDerWaalsContact C-N 3.28Å; L431-A433 PolarHBondContact O-N 3.36Å; A433-H436 PolarHBondContact O-N 3.28Å; A433-R437 VanDerWaalsContact O-CB 3.27Å; A433-R437 WeakPolarHBondContact O-CB 3.25Å; A433-R437 PolarHBondContact O-N 3.45Å
434	S	84.9	Confident	85.2	Confident	42 Å²	42	106.5 Å²	106.5	29%	0.294	49%	0.493	S	S	.	.	H	α-helix	trans	-65.3	-45.3	178	68.5	0	0	0	0	111.6	D430 L431 H436 R437 E438	D430-S434 WeakPolarHBondContact O-CB 3.29Å; D430-S434 PolarHBondContact O-N 3.05Å; L431-S434 PolarHBondContact O-N 3.32Å; L431-S434 PolarHBondContact O-OG 2.94Å; S434-H436 VanDerWaalsContact C-N 3.3Å; S434-H436 PolarHBondContact O-N 3.4Å; S434-R437 CarbonylContact O-C 3.52Å; S434-R437 WeakPolarHBondContact O-CA 3.3Å; S434-R437 WeakPolarHBondContact O-CB 3.39Å; S434-R437 PolarHBondContact O-N 3.13Å; S434-E438 PolarHBondContact O-N 3.42Å
435	H	80.9	Confident	84.9	Confident	129 Å²	129	106.4 Å²	106.4	60%	0.597	49%	0.493	S	S	*	.	H	α-helix	trans	-58.9	-43.1	175.2	-175.4	-101.4	0	0	0	111.6	R437 H439	H435-R437 VanDerWaalsContact C-N 3.34Å; H435-R437 PolarHBondContact O-N 3.26Å; H435-H439 WeakPolarHBondContact O-CB 3.13Å; H435-H439 PolarHBondContact O-N 3Å; H435-H439 VanDerWaalsContact O-N 3.1Å
436	H	78.9	Confident	84.4	Confident	118 Å²	118	108.1 Å²	108.1	55%	0.546	50%	0.496	S	S	.	.	H	α-helix	trans	-65.7	-34.7	173.1	-72.7	-55.8	0	0	0	113	R432 A433 S434 R440	R432-H436 PolarHBondContact O-CD2 3.42Å; R432-H436 PolarHBondContact O-N 3.06Å; A433-H436 PolarHBondContact O-N 3.28Å; S434-H436 VanDerWaalsContact C-N 3.3Å; S434-H436 PolarHBondContact O-N 3.4Å; H436-R440 WeakPolarHBondContact O-CB 3.39Å; H436-R440 VanDerWaalsContact O-CG 3.25Å; H436-R440 WeakPolarHBondContact O-CG 3.45Å; H436-R440 PolarHBondContact O-N 2.92Å
437	R	80.8	Confident	83.7	Confident	151 Å²	151	100.4 Å²	100.4	57%	0.57	47%	0.468	S	S	*	.	H	α-helix	trans	-68.4	-48.7	178.5	-171.1	-176.3	-62.2	-179.6	3.2	111	A433 S434 H435 H439 R440 E441	A433-R437 VanDerWaalsContact O-CB 3.27Å; A433-R437 WeakPolarHBondContact O-CB 3.25Å; A433-R437 PolarHBondContact O-N 3.45Å; S434-R437 CarbonylContact O-C 3.52Å; S434-R437 WeakPolarHBondContact O-CA 3.3Å; S434-R437 WeakPolarHBondContact O-CB 3.39Å; S434-R437 PolarHBondContact O-N 3.13Å; H435-R437 VanDerWaalsContact C-N 3.34Å; H435-R437 PolarHBondContact O-N 3.26Å; R437-H439 VanDerWaalsContact C-N 3.34Å; R437-H439 PolarHBondContact O-N 2.84Å; R437-R440 CarbonylContact O-C 3.57Å; R437-R440 WeakPolarHBondContact O-CA 3.14Å; R437-R440 WeakPolarHBondContact O-CB 3.38Å; R437-R440 PolarHBondContact O-N 3.11Å; R437-R440 VanDerWaalsContact O-N 3.08Å; R437-E441 WeakPolarHBondContact CG-OE1 3.34Å; R437-E441 WeakPolarHBondContact O-CG 3.46Å; R437-E441 PolarHBondContact O-N 3.29Å
438	E	82.3	Confident	83.2	Confident	100 Å²	100	103.1 Å²	103.1	47%	0.467	48%	0.482	S	S	.	.	H	α-helix	trans	-59.9	-43.8	176	-71	-179.9	-165.6	0	0	111.7	S434 R440 E441 K442	S434-E438 PolarHBondContact O-N 3.42Å; E438-R440 VanDerWaalsContact C-N 3.29Å; E438-R440 PolarHBondContact O-N 2.97Å; E438-E441 PolarHBondContact O-N 2.96Å; E438-K442 WeakPolarHBondContact O-CB 3.23Å; E438-K442 WeakPolarHBondContact O-CG 3.32Å; E438-K442 PolarHBondContact O-N 3.41Å
439	H	79.2	Confident	82.8	Confident	112 Å²	112	105.6 Å²	105.6	52%	0.519	50%	0.496	S	S	.	.	H	α-helix	trans	-62.5	-38.7	175.7	-171.1	-82.9	0	0	0	111.4	H435 R437 Y443	H435-H439 WeakPolarHBondContact O-CB 3.13Å; H435-H439 PolarHBondContact O-N 3Å; H435-H439 VanDerWaalsContact O-N 3.1Å; R437-H439 VanDerWaalsContact C-N 3.34Å; R437-H439 PolarHBondContact O-N 2.84Å; H439-Y443 VanDerWaalsContact O-CB 3.22Å; H439-Y443 WeakPolarHBondContact O-CB 3.1Å; H439-Y443 PolarHBondContact O-N 3.38Å
440	R	76.2	Confident	82.2	Confident	168 Å²	168	101.2 Å²	101.2	63%	0.634	48%	0.483	S	S	*	.	H	α-helix	trans	-67.1	-38.7	174.3	-80	177.8	-179.7	-177.9	3.1	112.7	H436 R437 E438 Y443 A444	H436-R440 WeakPolarHBondContact O-CB 3.39Å; H436-R440 VanDerWaalsContact O-CG 3.25Å; H436-R440 WeakPolarHBondContact O-CG 3.45Å; H436-R440 PolarHBondContact O-N 2.92Å; R437-R440 CarbonylContact O-C 3.57Å; R437-R440 WeakPolarHBondContact O-CA 3.14Å; R437-R440 WeakPolarHBondContact O-CB 3.38Å; R437-R440 PolarHBondContact O-N 3.11Å; R437-R440 VanDerWaalsContact O-N 3.08Å; E438-R440 VanDerWaalsContact C-N 3.29Å; E438-R440 PolarHBondContact O-N 2.97Å; R440-Y443 PolarHBondContact O-N 3.1Å; R440-A444 VanDerWaalsContact O-CB 3.32Å; R440-A444 WeakPolarHBondContact O-CB 3.39Å; R440-A444 PolarHBondContact O-N 3.43Å
441	E	83.7	Confident	81.6	Confident	105 Å²	105	104.5 Å²	104.5	49%	0.491	50%	0.496	S	S	.	.	H	α-helix	trans	-66.2	-50.9	177.1	-75.4	170.8	-173.8	0	0	110.8	R437 E438 Y443 A444 E445	R437-E441 WeakPolarHBondContact CG-OE1 3.34Å; R437-E441 WeakPolarHBondContact O-CG 3.46Å; R437-E441 PolarHBondContact O-N 3.29Å; E438-E441 PolarHBondContact O-N 2.96Å; E441-Y443 VanDerWaalsContact C-N 3.25Å; E441-Y443 PolarHBondContact O-N 3.34Å; E441-A444 WeakPolarHBondContact O-CA 3.2Å; E441-A444 WeakPolarHBondContact O-CB 3.33Å; E441-A444 PolarHBondContact O-N 3.34Å; E441-E445 WeakPolarHBondContact O-CG 3.35Å; E441-E445 PolarHBondContact O-N 3.24Å
442	K	85.3	Confident	80.9	Confident	121 Å²	121	108.4 Å²	108.4	53%	0.526	50%	0.502	S	S	.	.	H	α-helix	trans	-56.5	-39.8	173.1	-71.6	172.4	-179.3	166.3	0	112.1	E438 K446	E438-K442 WeakPolarHBondContact O-CB 3.23Å; E438-K442 WeakPolarHBondContact O-CG 3.32Å; E438-K442 PolarHBondContact O-N 3.41Å; K442-K446 WeakPolarHBondContact O-CB 3.34Å; K442-K446 WeakPolarHBondContact O-CG 3.24Å; K442-K446 PolarHBondContact O-N 3.32Å
443	Y	79.8	Confident	80.2	Confident	63 Å²	63	109.5 Å²	109.5	25%	0.247	51%	0.506	C	S	.	.	H	α-helix	trans	-65.7	-44	174.3	177.3	-92.6	0	0	0	111.7	H439 R440 E441 K446 C447 L458	H439-Y443 VanDerWaalsContact O-CB 3.22Å; H439-Y443 WeakPolarHBondContact O-CB 3.1Å; H439-Y443 PolarHBondContact O-N 3.38Å; R440-Y443 PolarHBondContact O-N 3.1Å; E441-Y443 VanDerWaalsContact C-N 3.25Å; E441-Y443 PolarHBondContact O-N 3.34Å; Y443-K446 PolarHBondContact O-N 3.36Å; Y443-C447 WeakPolarHBondContact CE1-SG 3.2Å; Y443-C447 WeakPolarHBondContact O-CB 3.05Å; Y443-C447 PolarHBondContact O-N 3.03Å; Y443-C447 PolarHBondContact O-SG 3.31Å; Y443-L458 HydrophobicContact CE2-CB 4.35Å
444	A	82.9	Confident	79.6	Confident	47 Å²	47	113.1 Å²	113.1	39%	0.388	52%	0.519	S	S	.	.	H	α-helix	trans	-63	-41.6	178.1	0	0	0	0	0	112	R440 E441 C447 L448	R440-A444 VanDerWaalsContact O-CB 3.32Å; R440-A444 WeakPolarHBondContact O-CB 3.39Å; R440-A444 PolarHBondContact O-N 3.43Å; E441-A444 WeakPolarHBondContact O-CA 3.2Å; E441-A444 WeakPolarHBondContact O-CB 3.33Å; E441-A444 PolarHBondContact O-N 3.34Å; A444-C447 WeakPolarHBondContact O-CB 3.16Å; A444-C447 PolarHBondContact O-N 2.88Å; A444-L448 WeakPolarHBondContact O-CG 3.38Å; A444-L448 PolarHBondContact O-N 3.14Å
445	E	85.7	Confident	79	Confident	130 Å²	130	116.2 Å²	116.2	61%	0.607	52%	0.524	S	S	*	.	H	α-helix	trans	-60.8	-48.2	173.2	-71.4	176.5	170.8	0	0	111.8	E441 C447 L448 S449	E441-E445 WeakPolarHBondContact O-CG 3.35Å; E441-E445 PolarHBondContact O-N 3.24Å; E445-C447 VanDerWaalsContact C-N 3.29Å; E445-C447 PolarHBondContact O-N 2.78Å; E445-L448 PolarHBondContact O-N 2.93Å; E445-S449 PolarHBondContact O-N 2.72Å; E445-S449 VanDerWaalsContact O-N 3.14Å
446	K	81.2	Confident	78.4	Confident	129 Å²	129	119.6 Å²	119.6	56%	0.561	53%	0.532	S	S	*	.	H	α-helix	trans	-58	-42.3	173.9	-75.9	177.8	-178.6	-178.9	0	111.3	K442 Y443 S449 L450	K442-K446 WeakPolarHBondContact O-CB 3.34Å; K442-K446 WeakPolarHBondContact O-CG 3.24Å; K442-K446 PolarHBondContact O-N 3.32Å; Y443-K446 PolarHBondContact O-N 3.36Å; K446-S449 PolarHBondContact O-N 3.15Å; K446-S449 PolarHBondContact O-OG 3.27Å; K446-L450 WeakPolarHBondContact O-CD1 3.35Å; K446-L450 VanDerWaalsContact O-CG 3.31Å; K446-L450 WeakPolarHBondContact O-CG 3.3Å; K446-L450 PolarHBondContact O-N 3.2Å
447	C	77.1	Confident	78.1	Confident	7 Å²	7	121.2 Å²	121.2	5%	0.047	54%	0.537	C	S	.	.	H	α-helix	trans	-61.9	-45.3	175.9	-72.7	0	0	0	0	112.3	Y443 A444 E445 S449 L450 W455	Y443-C447 WeakPolarHBondContact CE1-SG 3.2Å; Y443-C447 WeakPolarHBondContact O-CB 3.05Å; Y443-C447 PolarHBondContact O-N 3.03Å; Y443-C447 PolarHBondContact O-SG 3.31Å; A444-C447 WeakPolarHBondContact O-CB 3.16Å; A444-C447 PolarHBondContact O-N 2.88Å; E445-C447 VanDerWaalsContact C-N 3.29Å; E445-C447 PolarHBondContact O-N 2.78Å; C447-S449 PolarHBondContact O-N 3.19Å; C447-L450 PolarHBondContact O-N 2.85Å; C447-W455 HydrophobicContact CB-CD2 4.29Å; C447-W455 HydrophobicContact CB-CH2 4.1Å; C447-W455 HydrophobicContact CB-CZ2 3.78Å; C447-W455 HydrophobicContact CB-CZ3 4.48Å; C447-W455 WeakPolarHBondContact O-CZ2 3.32Å; C447-W455 PolarHBondContact O-NE1 3.45Å
448	L	81.2	Confident	77.5	Confident	146 Å²	146	115.7 Å²	115.7	76%	0.764	52%	0.519	S	S	*	.	H	α-helix	trans	-60.5	-34.1	179	-75.2	165.4	0	0	0	112.7	A444 E445 L450	A444-L448 WeakPolarHBondContact O-CG 3.38Å; A444-L448 PolarHBondContact O-N 3.14Å; E445-L448 PolarHBondContact O-N 2.93Å; L448-L450 VanDerWaalsContact C-N 3.33Å; L448-L450 PolarHBondContact O-N 3.35Å
449	S	81.6	Confident	76.9	Confident	93 Å²	93	117 Å²	117	65%	0.65	52%	0.523	S	S	*	.	H	α-helix	trans	-73.7	-19.1	178.7	72.5	0	0	0	0	114.8	E445 K446 C447	E445-S449 PolarHBondContact O-N 2.72Å; E445-S449 VanDerWaalsContact O-N 3.14Å; K446-S449 PolarHBondContact O-N 3.15Å; K446-S449 PolarHBondContact O-OG 3.27Å; C447-S449 PolarHBondContact O-N 3.19Å
450	L	78.2	Confident	76.5	Confident	59 Å²	59	117.4 Å²	117.4	31%	0.309	53%	0.528	S	S	.	.	S	Bend	trans	-108.5	150.2	-168.2	-67.1	169.8	0	0	0	113	K446 C447 L448 Q454 W455 L458	K446-L450 WeakPolarHBondContact O-CD1 3.35Å; K446-L450 VanDerWaalsContact O-CG 3.31Å; K446-L450 WeakPolarHBondContact O-CG 3.3Å; K446-L450 PolarHBondContact O-N 3.2Å; C447-L450 PolarHBondContact O-N 2.85Å; L448-L450 VanDerWaalsContact C-N 3.33Å; L448-L450 PolarHBondContact O-N 3.35Å; L450-Q454 HydrophobicContact CB-CB 4.16Å; L450-W455 PolarHBondContact O-NE1 3.04Å; L450-L458 HydrophobicContact CD1-CD1 3.23Å
451	H	77	Confident	76.2	Confident	138 Å²	138	114.9 Å²	114.9	64%	0.639	52%	0.523	S	S	*	.			trans	-71.2	148.5	176.6	-168.2	74.8	0	0	0	111.3	R453 Q454	H451-R453 PolarHBondContact O-N 3.45Å; H451-Q454 WeakPolarHBondContact O-CB 3.44Å; H451-Q454 PolarHBondContact O-N 2.99Å
452	R	71.9	Confident	75.4	Confident	210 Å²	210	113.4 Å²	113.4	79%	0.792	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.1	-23.2	-171.3	-152.5	177.3	-169.7	-172.8	3.7	115.6
453	R	68.9	Low	74.5	Confident	210 Å²	210	111.7 Å²	111.7	79%	0.792	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-36.3	174.5	-72.7	-175.7	176.5	179.9	-0.5	113.2	H451 W455 R456	H451-R453 PolarHBondContact O-N 3.45Å; R453-W455 VanDerWaalsContact C-N 3.29Å; R453-W455 PolarHBondContact O-N 2.67Å; R453-R456 PolarHBondContact O-N 3.25Å
454	Q	73.2	Confident	73.9	Confident	97 Å²	97	111.4 Å²	111.4	45%	0.453	52%	0.517	S	S	.	.	H	α-helix	trans	-71.5	-26.3	178.6	-71.5	164.1	-28.4	0	0	111.8	L450 H451 R456 K457 L458	L450-Q454 HydrophobicContact CB-CB 4.16Å; H451-Q454 WeakPolarHBondContact O-CB 3.44Å; H451-Q454 PolarHBondContact O-N 2.99Å; Q454-R456 PolarHBondContact O-N 2.89Å; Q454-K457 PolarHBondContact O-N 3.41Å; Q454-L458 PolarHBondContact O-N 3.01Å; Q454-L458 VanDerWaalsContact O-N 3.15Å
455	W	72	Confident	73.1	Confident	108 Å²	108	111.5 Å²	111.5	41%	0.409	52%	0.518	S	S	.	.	H	α-helix	trans	-56.9	-36.2	174.5	-70.4	36.1	0	0	0	112.7	C447 L450 R453 K457 K459	C447-W455 HydrophobicContact CB-CD2 4.29Å; C447-W455 HydrophobicContact CB-CH2 4.1Å; C447-W455 HydrophobicContact CB-CZ2 3.78Å; C447-W455 HydrophobicContact CB-CZ3 4.48Å; C447-W455 WeakPolarHBondContact O-CZ2 3.32Å; C447-W455 PolarHBondContact O-NE1 3.45Å; L450-W455 PolarHBondContact O-NE1 3.04Å; R453-W455 VanDerWaalsContact C-N 3.29Å; R453-W455 PolarHBondContact O-N 2.67Å; W455-K457 VanDerWaalsContact C-N 3.34Å; W455-K457 PolarHBondContact O-N 3.23Å; W455-K459 WeakPolarHBondContact O-CB 3.19Å; W455-K459 PolarHBondContact O-N 3.02Å
456	R	68.4	Low	72.1	Confident	199 Å²	199	109.1 Å²	109.1	75%	0.751	51%	0.507	S	S	*	.	H	α-helix	trans	-66	-36.1	177.9	-72.2	-174	179	177.6	-1	112.1	R453 Q454 I460	R453-R456 PolarHBondContact O-N 3.25Å; Q454-R456 PolarHBondContact O-N 2.89Å; R456-I460 WeakPolarHBondContact O-CD1 3.28Å; R456-I460 WeakPolarHBondContact O-CG1 3.36Å; R456-I460 PolarHBondContact O-N 2.96Å
457	K	72.7	Confident	71.3	Confident	153 Å²	153	105.3 Å²	105.3	67%	0.665	50%	0.496	S	S	*	.	H	α-helix	trans	-69.4	-48.4	177	-69.1	-171.6	175.9	-172.3	0	111.2	Q454 W455 K459 I460 E461	Q454-K457 PolarHBondContact O-N 3.41Å; W455-K457 VanDerWaalsContact C-N 3.34Å; W455-K457 PolarHBondContact O-N 3.23Å; K457-K459 VanDerWaalsContact C-N 3.27Å; K457-K459 PolarHBondContact O-N 2.99Å; K457-I460 PolarHBondContact O-N 3.39Å; K457-I460 VanDerWaalsContact O-N 3.09Å; K457-E461 PolarHBondContact O-N 3.38Å; K457-E461 VanDerWaalsContact O-N 3.07Å
458	L	69.8	Low	70.6	Confident	34 Å²	34	109 Å²	109	18%	0.178	52%	0.515	C	S	.	.	H	α-helix	trans	-59.4	-36	176.8	-88.7	165.2	0	0	0	113.3	Y443 L450 Q454 E461 R462	Y443-L458 HydrophobicContact CE2-CB 4.35Å; L450-L458 HydrophobicContact CD1-CD1 3.23Å; Q454-L458 PolarHBondContact O-N 3.01Å; Q454-L458 VanDerWaalsContact O-N 3.15Å; L458-E461 PolarHBondContact O-N 2.94Å; L458-R462 PolarHBondContact O-N 3.17Å
459	K	70	Confident	69.7	Low	127 Å²	127	106.8 Å²	106.8	55%	0.552	50%	0.504	S	S	*	.	H	α-helix	trans	-64.6	-40.6	176.2	-170.6	179.6	178.5	-175.1	0	112	W455 K457 R462 D463	W455-K459 WeakPolarHBondContact O-CB 3.19Å; W455-K459 PolarHBondContact O-N 3.02Å; K457-K459 VanDerWaalsContact C-N 3.27Å; K457-K459 PolarHBondContact O-N 2.99Å; K459-R462 WeakPolarHBondContact O-CB 3.37Å; K459-R462 PolarHBondContact O-N 2.83Å; K459-D463 PolarHBondContact O-N 3.45Å
460	I	70.4	Confident	68.7	Low	121 Å²	121	108.6 Å²	108.6	62%	0.621	51%	0.505	S	S	*	.	H	α-helix	trans	-65.8	-43	177.5	-65.6	164.1	0	0	0	110.2	R456 K457 R462 D463 S464	R456-I460 WeakPolarHBondContact O-CD1 3.28Å; R456-I460 WeakPolarHBondContact O-CG1 3.36Å; R456-I460 PolarHBondContact O-N 2.96Å; K457-I460 PolarHBondContact O-N 3.39Å; K457-I460 VanDerWaalsContact O-N 3.09Å; I460-R462 VanDerWaalsContact C-N 3.29Å; I460-R462 PolarHBondContact O-N 3.04Å; I460-D463 PolarHBondContact O-N 2.85Å; I460-S464 PolarHBondContact O-N 3Å; I460-S464 PolarHBondContact O-OG 3.25Å
461	E	68.8	Low	67.8	Low	116 Å²	116	112 Å²	112	54%	0.542	52%	0.518	S	S	.	.	H	α-helix	trans	-61	-36.4	176.6	-73.4	173.3	177.2	0	0	112.6	K457 L458 S464 A465	K457-E461 PolarHBondContact O-N 3.38Å; K457-E461 VanDerWaalsContact O-N 3.07Å; L458-E461 PolarHBondContact O-N 2.94Å; E461-S464 VanDerWaalsContact C-OG 3.26Å; E461-S464 VanDerWaalsContact CA-OG 3.32Å; E461-S464 WeakPolarHBondContact CA-OG 3.34Å; E461-S464 PolarHBondContact O-N 3.48Å; E461-S464 PolarHBondContact O-OG 3.2Å; E461-A465 PolarHBondContact O-N 3.08Å
462	R	68.2	Low	66.8	Low	73 Å²	73	111.6 Å²	111.6	28%	0.275	52%	0.516	S	S	.	.	H	α-helix	trans	-63.3	-46	176.6	-169.6	-168.8	108.9	100.9	13.2	112.6	L458 K459 I460 S464 A465 E466	L458-R462 PolarHBondContact O-N 3.17Å; K459-R462 WeakPolarHBondContact O-CB 3.37Å; K459-R462 PolarHBondContact O-N 2.83Å; I460-R462 VanDerWaalsContact C-N 3.29Å; I460-R462 PolarHBondContact O-N 3.04Å; R462-S464 VanDerWaalsContact C-N 3.26Å; R462-S464 PolarHBondContact O-N 3.08Å; R462-A465 PolarHBondContact O-N 3.04Å; R462-A465 VanDerWaalsContact O-N 3.1Å; R462-E466 IonicContact CZ-OE1 3.83Å; R462-E466 IonicContact CZ-OE2 2.77Å; R462-E466 IonicContact NE-OE1 3.63Å; R462-E466 IonicContact NH1-OE1 2.63Å; R462-E466 PolarHBondContact NH1-OE1 3.48Å; R462-E466 IonicContact NH2-OE1 3.75Å; R462-E466 PolarHBondContact NH2-OE1 3.49Å; R462-E466 IonicContact NH2-OE2 3.56Å; R462-E466 PolarHBondContact NH2-OE2 2.97Å; R462-E466 PolarHBondContact O-N 3.47Å
463	D	66.4	Low	65.9	Low	85 Å²	85	107.9 Å²	107.9	46%	0.455	51%	0.512	S	S	.	.	H	α-helix	trans	-65.9	-33.7	-178.4	-66.7	-15	0	0	0	110.6	K459 I460 S467	K459-D463 PolarHBondContact O-N 3.45Å; I460-D463 PolarHBondContact O-N 2.85Å; D463-S467 WeakPolarHBondContact O-CB 3.49Å; D463-S467 PolarHBondContact O-N 2.86Å; D463-S467 PolarHBondContact O-OG 2.65Å
464	S	67	Low	65.4	Low	57 Å²	57	101.9 Å²	101.9	40%	0.399	50%	0.502	S	S	.	.	H	α-helix	trans	-67.7	-38.4	169.2	44.3	0	0	0	0	113.4	I460 E461 R462 S467 N468	I460-S464 PolarHBondContact O-N 3Å; I460-S464 PolarHBondContact O-OG 3.25Å; E461-S464 VanDerWaalsContact C-OG 3.26Å; E461-S464 VanDerWaalsContact CA-OG 3.32Å; E461-S464 WeakPolarHBondContact CA-OG 3.34Å; E461-S464 PolarHBondContact O-N 3.48Å; E461-S464 PolarHBondContact O-OG 3.2Å; R462-S464 VanDerWaalsContact C-N 3.26Å; R462-S464 PolarHBondContact O-N 3.08Å; S464-S467 WeakPolarHBondContact CA-OG 3.44Å; S464-S467 PolarHBondContact O-OG 2.92Å; S464-N468 PolarHBondContact O-N 2.82Å; S464-N468 VanDerWaalsContact O-N 3.1Å; S464-N468 PolarHBondContact O-ND2 3.48Å
465	A	65.5	Low	64.9	Low	49 Å²	49	103.7 Å²	103.7	41%	0.405	52%	0.515	S	S	.	.	H	α-helix	trans	-70.7	-42.7	178.7	0	0	0	0	0	112.6	E461 R462 S467 N468 L469	E461-A465 PolarHBondContact O-N 3.08Å; R462-A465 PolarHBondContact O-N 3.04Å; R462-A465 VanDerWaalsContact O-N 3.1Å; A465-S467 VanDerWaalsContact C-N 3.34Å; A465-S467 PolarHBondContact O-N 2.9Å; A465-N468 PolarHBondContact O-N 3.38Å; A465-L469 WeakPolarHBondContact O-CG 3.3Å; A465-L469 PolarHBondContact O-N 3Å
466	E	65.6	Low	64.9	Low	81 Å²	81	103.8 Å²	103.8	38%	0.379	52%	0.52	S	S	.	.	H	α-helix	trans	-64.4	-39	176.6	-77.2	-175.3	167.6	0	0	111.7	R462 N468 L469 L470	R462-E466 IonicContact CZ-OE1 3.83Å; R462-E466 IonicContact CZ-OE2 2.77Å; R462-E466 IonicContact NE-OE1 3.63Å; R462-E466 IonicContact NH1-OE1 2.63Å; R462-E466 PolarHBondContact NH1-OE1 3.48Å; R462-E466 IonicContact NH2-OE1 3.75Å; R462-E466 PolarHBondContact NH2-OE1 3.49Å; R462-E466 IonicContact NH2-OE2 3.56Å; R462-E466 PolarHBondContact NH2-OE2 2.97Å; R462-E466 PolarHBondContact O-N 3.47Å; E466-N468 VanDerWaalsContact C-N 3.33Å; E466-L469 PolarHBondContact O-N 2.91Å; E466-L470 WeakPolarHBondContact O-CG 3.43Å; E466-L470 PolarHBondContact O-N 3.4Å; E466-L470 VanDerWaalsContact O-N 3.13Å
467	S	63.8	Low	65.5	Low	49 Å²	49	96.7 Å²	96.7	34%	0.343	50%	0.497	S	S	.	.	H	α-helix	trans	-68.9	-30.3	175.7	53.9	0	0	0	0	113.1	D463 S464 A465 K471	D463-S467 WeakPolarHBondContact O-CB 3.49Å; D463-S467 PolarHBondContact O-N 2.86Å; D463-S467 PolarHBondContact O-OG 2.65Å; S464-S467 WeakPolarHBondContact CA-OG 3.44Å; S464-S467 PolarHBondContact O-OG 2.92Å; A465-S467 VanDerWaalsContact C-N 3.34Å; A465-S467 PolarHBondContact O-N 2.9Å; S467-K471 VanDerWaalsContact O-CG 3.29Å; S467-K471 WeakPolarHBondContact O-CG 3.34Å; S467-K471 PolarHBondContact O-N 3.13Å
468	N	63	Low	66.2	Low	83 Å²	83	91.6 Å²	91.6	44%	0.444	48%	0.48	S	S	.	.	H	α-helix	trans	-72.6	-42.9	173	-71.8	-12.1	0	0	0	112.1	S464 A465 E466 L470 K471 E472	S464-N468 PolarHBondContact O-N 2.82Å; S464-N468 VanDerWaalsContact O-N 3.1Å; S464-N468 PolarHBondContact O-ND2 3.48Å; A465-N468 PolarHBondContact O-N 3.38Å; E466-N468 VanDerWaalsContact C-N 3.33Å; N468-L470 VanDerWaalsContact C-N 3.3Å; N468-L470 PolarHBondContact O-N 3.02Å; N468-K471 WeakPolarHBondContact O-CB 3.29Å; N468-K471 PolarHBondContact O-N 3.37Å; N468-E472 WeakPolarHBondContact O-CG 3.43Å; N468-E472 PolarHBondContact O-N 2.96Å
469	L	60.4	Low	67.1	Low	100 Å²	100	90 Å²	90	52%	0.524	47%	0.472	S	S	.	.	H	α-helix	trans	-60	-38.3	176	-75.3	163.5	0	0	0	112.8	A465 E466 K471 N473	A465-L469 WeakPolarHBondContact O-CG 3.3Å; A465-L469 PolarHBondContact O-N 3Å; E466-L469 PolarHBondContact O-N 2.91Å; L469-K471 VanDerWaalsContact C-N 3.3Å; L469-N473 PolarHBondContact O-N 3.4Å; L469-N473 PolarHBondContact O-ND2 3.02Å
470	L	61.2	Low	68.1	Low	131 Å²	131	84.5 Å²	84.5	69%	0.686	45%	0.449	S	S	*	.	H	α-helix	trans	-68.3	-30.3	175.2	-72.1	170.9	0	0	0	112.6	E466 N468	E466-L470 WeakPolarHBondContact O-CG 3.43Å; E466-L470 PolarHBondContact O-N 3.4Å; E466-L470 VanDerWaalsContact O-N 3.13Å; N468-L470 VanDerWaalsContact C-N 3.3Å; N468-L470 PolarHBondContact O-N 3.02Å
471	K	59.7	Low	69.2	Low	131 Å²	131	78.7 Å²	78.7	57%	0.57	42%	0.419	S	S	*	.	H	α-helix	trans	-76.6	-38.3	175.8	-72.9	171.8	-178.3	178.9	0	112.1	S467 N468 L469 N473 S474	S467-K471 VanDerWaalsContact O-CG 3.29Å; S467-K471 WeakPolarHBondContact O-CG 3.34Å; S467-K471 PolarHBondContact O-N 3.13Å; N468-K471 WeakPolarHBondContact O-CB 3.29Å; N468-K471 PolarHBondContact O-N 3.37Å; L469-K471 VanDerWaalsContact C-N 3.3Å; K471-N473 VanDerWaalsContact C-N 3.31Å; K471-N473 PolarHBondContact O-N 3.37Å; K471-S474 PolarHBondContact O-N 3.24Å; K471-S474 PolarHBondContact O-OG 3.26Å
472	E	55.1	Low	70.4	Confident	130 Å²	130	73.2 Å²	73.2	61%	0.607	39%	0.394	S	S	*	.	H	α-helix	trans	-59.9	-41.4	178.4	-75.3	172.7	-179	0	0	111.8	N468 S474 N475	N468-E472 WeakPolarHBondContact O-CG 3.43Å; N468-E472 PolarHBondContact O-N 2.96Å; E472-S474 PolarHBondContact O-N 3.34Å; E472-N475 PolarHBondContact O-N 2.98Å
473	N	54	Low	71.6	Confident	131 Å²	131	69.7 Å²	69.7	70%	0.701	38%	0.38	S	S	*	.	G	3₁₀ helix	trans	-67.8	-18.4	176.6	-70	-28.9	0	0	0	114	L469 K471	L469-N473 PolarHBondContact O-N 3.4Å; L469-N473 PolarHBondContact O-ND2 3.02Å; K471-N473 VanDerWaalsContact C-N 3.31Å; K471-N473 PolarHBondContact O-N 3.37Å
474	S	58.7	Low	73	Confident	85 Å²	85	66.2 Å²	66.2	59%	0.594	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-84.7	-10.8	-179	68.3	0	0	0	0	114.3	K471 E472 Q476	K471-S474 PolarHBondContact O-N 3.24Å; K471-S474 PolarHBondContact O-OG 3.26Å; E472-S474 PolarHBondContact O-N 3.34Å; S474-Q476 VanDerWaalsContact C-N 3.29Å; S474-Q476 PolarHBondContact O-N 3.21Å
475	N	62.9	Low	74.2	Confident	135 Å²	135	63.5 Å²	63.5	72%	0.722	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-82.9	-2	-178.3	-79.1	-2.3	0	0	0	113.9	E472 I477	E472-N475 PolarHBondContact O-N 2.98Å; N475-I477 PolarHBondContact O-N 3.04Å
476	Q	71.7	Confident	75.4	Confident	110 Å²	110	62.3 Å²	62.3	51%	0.514	33%	0.329	S	S	.	.	S	Bend	trans	-80.2	117.3	176.6	-164.3	170.8	20.9	0	0	109.9	S474 S478 K507	S474-Q476 VanDerWaalsContact C-N 3.29Å; S474-Q476 PolarHBondContact O-N 3.21Å; Q476-S478 PolarHBondContact O-N 3.13Å; Q476-K507 HydrophobicContact CG-CB 4.39Å
477	I	81.5	Confident	76.7	Confident	50 Å²	50	58.7 Å²	58.7	26%	0.256	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	116.1	-179.8	-60.8	169.2	0	0	0	108	N475 C506 K507 K575 P577	N475-I477 PolarHBondContact O-N 3.04Å; I477-C506 CarbonylContact O-C 3.57Å; I477-C506 WeakPolarHBondContact O-CA 3.46Å; I477-C506 PolarHBondContact O-SG 3.28Å; I477-K507 PolarHBondContact O-N 2.74Å; I477-K575 HydrophobicContact CG2-CB 4.23Å; I477-P577 VanDerWaalsContact CD1-CD 3.49Å; I477-P577 HydrophobicContact CD1-CG 4.14Å
478	S	86.4	Confident	78	Confident	45 Å²	45	58.1 Å²	58.1	32%	0.315	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	141.6	173.8	63.7	0	0	0	0	112.1	Q476 P480 K507	Q476-S478 PolarHBondContact O-N 3.13Å; S478-P480 WeakPolarHBondContact O-CD 3.26Å; S478-K507 CarbonylContact C-O 3.55Å; S478-K507 VanDerWaalsContact CA-O 3.24Å; S478-K507 WeakPolarHBondContact CA-O 3.36Å
479	L	89.1	Confident	79.1	Confident	1 Å²	1	54.2 Å²	54.2	1%	0.005	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	97.3	170.4	-179.1	64	0	0	0	108.4	L481 K507 E509 V568 L571 V572 K575	L479-L481 HydrophobicContact CD1-CD2 4.37Å; L479-L481 HydrophobicContact CD2-CD1 4.43Å; L479-L481 HydrophobicContact CD2-CD2 4.08Å; L479-L481 HydrophobicContact CD2-CG 4.39Å; L479-L481 HydrophobicContact CG-CD2 3.9Å; L479-L481 HydrophobicContact CG-CG 4.13Å; L479-L481 PolarHBondContact O-N 2.91Å; L479-K507 PolarHBondContact N-O 2.92Å; L479-E509 PolarHBondContact O-N 3.01Å; L479-V568 HydrophobicContact CD2-CG1 4.47Å; L479-L571 HydrophobicContact CD2-CB 4.07Å; L479-V572 HydrophobicContact CD2-CG2 3.62Å; L479-K575 HydrophobicContact CD1-CG 4.26Å
480	P	91.5	Very high	80.5	Confident	11 Å²	11	49.4 Å²	49.4	7%	0.071	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	126.6	175.1	27.4	-31.2	0	0	0	110.4	S478 E509 C511 V529 A531 N532	S478-P480 WeakPolarHBondContact O-CD 3.26Å; P480-E509 CarbonylContact C-O 3.54Å; P480-E509 WeakPolarHBondContact CA-O 3.46Å; P480-C511 VanDerWaalsContact CB-SG 3.55Å; P480-V529 HydrophobicContact CB-CG1 3.72Å; P480-V529 HydrophobicContact CG-CG1 4.08Å; P480-A531 HydrophobicContact CB-CB 3.9Å; P480-A531 HydrophobicContact CG-CB 4.28Å; P480-A531 VanDerWaalsContact O-CA 3.27Å; P480-A531 WeakPolarHBondContact O-CA 3.45Å; P480-A531 WeakPolarHBondContact O-CB 3.39Å; P480-N532 PolarHBondContact O-N 2.77Å
481	L	92.7	Very high	82	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	140.4	179.9	-62.6	-179.8	0	0	0	111.1	L479 I483 L498 I508 E509 C511 N532 L534 V568	L479-L481 HydrophobicContact CD1-CD2 4.37Å; L479-L481 HydrophobicContact CD2-CD1 4.43Å; L479-L481 HydrophobicContact CD2-CD2 4.08Å; L479-L481 HydrophobicContact CD2-CG 4.39Å; L479-L481 HydrophobicContact CG-CD2 3.9Å; L479-L481 HydrophobicContact CG-CG 4.13Å; L479-L481 PolarHBondContact O-N 2.91Å; L481-I483 HydrophobicContact CB-CG1 4.38Å; L481-L498 HydrophobicContact CD1-CD1 4.47Å; L481-I508 HydrophobicContact CD1-CG2 3.63Å; L481-I508 HydrophobicContact CG-CG2 4.32Å; L481-E509 PolarHBondContact N-O 2.91Å; L481-C511 PolarHBondContact O-N 3.41Å; L481-N532 HydrophobicContact CD2-CB 4.04Å; L481-L534 HydrophobicContact CD1-CD1 4.12Å; L481-L534 HydrophobicContact CD2-CD1 4.22Å; L481-V568 HydrophobicContact CD1-CG1 4.2Å; L481-V568 HydrophobicContact CD1-CG2 4.23Å
482	V	94	Very high	83.4	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	122.3	166.2	173.5	0	0	0	0	107.9	C511 I512 A526 A531 N532 V533 L534	V482-C511 HydrophobicContact CG2-CB 4.3Å; V482-I512 WeakPolarHBondContact CA-O 3.37Å; V482-I512 HydrophobicContact CG1-CB 4.17Å; V482-I512 HydrophobicContact CG2-CB 4.3Å; V482-A526 HydrophobicContact CG2-CB 4.02Å; V482-A531 HydrophobicContact CG2-CB 4.06Å; V482-N532 PolarHBondContact N-O 2.91Å; V482-V533 HydrophobicContact CB-CG2 4.21Å; V482-V533 HydrophobicContact CG1-CG1 4.46Å; V482-L534 PolarHBondContact O-N 3.13Å
483	I	94.3	Very high	85	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	125.7	-175.1	-54.8	178.8	0	0	0	109.6	L481 L491 I494 L498 Y510 I512 T513 G514 L534	L481-I483 HydrophobicContact CB-CG1 4.38Å; I483-L491 HydrophobicContact CB-CD1 4.26Å; I483-L491 HydrophobicContact CG2-CD1 3.7Å; I483-I494 HydrophobicContact CD1-CG2 4.03Å; I483-I494 HydrophobicContact CG2-CD1 4.44Å; I483-I494 HydrophobicContact CG2-CG2 4.25Å; I483-L498 HydrophobicContact CD1-CD1 3.71Å; I483-Y510 HydrophobicContact CD1-CD1 3.8Å; I483-Y510 HydrophobicContact CD1-CE1 3.75Å; I483-I512 PolarHBondContact N-O 3.41Å; I483-T513 HydrophobicContact CB-CG2 4.49Å; I483-T513 WeakPolarHBondContact O-CA 3.05Å; I483-G514 PolarHBondContact O-N 3.2Å; I483-L534 WeakPolarHBondContact CA-O 3.39Å; I483-L534 HydrophobicContact CG1-CD1 4.4Å
484	K	93.9	Very high	86.8	Confident	12 Å²	12	27.4 Å²	27.4	5%	0.052	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	133.8	173.2	-71.7	-68.3	-175.3	127.4	0	110.5	G514 L518 E522 L534 L535 F536	K484-G514 WeakPolarHBondContact CA-O 3.43Å; K484-G514 WeakPolarHBondContact CD-O 3.47Å; K484-L518 HydrophobicContact CG-CD1 4.39Å; K484-E522 WeakPolarHBondContact CE-OE1 3.48Å; K484-E522 WeakPolarHBondContact CE-OE2 3.43Å; K484-E522 IonicContact NZ-OE1 3.23Å; K484-E522 PolarHBondContact NZ-OE1 2.92Å; K484-E522 IonicContact NZ-OE2 2.8Å; K484-E522 PolarHBondContact NZ-OE2 3.15Å; K484-L534 PolarHBondContact N-O 2.9Å; K484-L535 HydrophobicContact CB-CD2 3.7Å; K484-L535 HydrophobicContact CG-CD2 4.26Å; K484-L535 CarbonylContact O-C 3.56Å; K484-L535 WeakPolarHBondContact O-CA 3.5Å; K484-F536 PolarHBondContact O-N 3.01Å
485	S	92.9	Very high	88.4	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	160.9	176.3	66.4	0	0	0	0	111.3	V487 S490 L491 G514 V515 G516 F536 I538	S485-V487 PolarHBondContact OG-O 3.4Å; S485-S490 WeakPolarHBondContact CB-OG 2.96Å; S485-L491 WeakPolarHBondContact OG-CB 3.46Å; S485-G514 PolarHBondContact N-O 3.4Å; S485-V515 CarbonylContact O-C 3.57Å; S485-V515 VanDerWaalsContact O-CA 3.26Å; S485-V515 WeakPolarHBondContact O-CA 3.34Å; S485-G516 PolarHBondContact O-N 3.45Å; S485-F536 WeakPolarHBondContact CA-O 3.48Å; S485-I538 WeakPolarHBondContact O-CD1 3.35Å
486	D	91.2	Very high	89.6	Confident	23 Å²	23	23 Å²	23	12%	0.123	12%	0.119	C	C	.	.	S	Bend	trans	-66	-40.8	175	59.3	-19.6	0	0	0	113.8	H164 S490 V515 F536 N537 I538	H164-D486 VanDerWaalsContact CE1-CG 3.47Å; H164-D486 IonicContact CE1-OD1 2.67Å; H164-D486 PolarHBondContact CE1-OD1 3.01Å; H164-D486 IonicContact CE1-OD2 3.81Å; H164-D486 PolarHBondContact CE1-OD2 3.23Å; H164-D486 IonicContact ND1-OD2 3.45Å; H164-D486 IonicContact NE2-OD2 3.09Å; H164-D486 PolarHBondContact NE2-OD2 2.69Å; D486-S490 PolarHBondContact OD1-OG 3.47Å; D486-V515 WeakPolarHBondContact O-CG1 3.27Å; D486-F536 PolarHBondContact N-O 3.02Å; D486-N537 HydrophobicContact CB-CB 4.21Å; D486-N537 WeakPolarHBondContact OD2-CB 3.28Å; D486-N537 PolarHBondContact OD2-ND2 3.39Å; D486-I538 HydrophobicContact CB-CD1 4.41Å; D486-I538 HydrophobicContact CB-CG1 3.97Å
487	V	92	Very high	90.3	Very high	6 Å²	6	17.9 Å²	17.9	4%	0.036	10%	0.096	C	C	.	.	B	Isolated β-bridge	trans	-127	152.3	-175.3	-171.4	0	0	0	0	110.2	E324 S325 E326 S485 G489 S490 L491	E324-V487 HydrophobicContact CB-CG1 3.82Å; E324-V487 VanDerWaalsContact CD-CG1 3.5Å; E324-V487 HydrophobicContact CG-CG1 3.95Å; S325-V487 WeakPolarHBondContact O-CA 3.37Å; S325-V487 WeakPolarHBondContact O-CG1 3.39Å; E326-V487 HydrophobicContact CB-CG2 4.33Å; S485-V487 PolarHBondContact OG-O 3.4Å; V487-G489 VanDerWaalsContact C-N 3.34Å; V487-G489 PolarHBondContact O-N 2.92Å; V487-S490 PolarHBondContact O-OG 3.01Å; V487-L491 PolarHBondContact O-N 3.2Å
488	Q	91.2	Very high	90.6	Very high	37 Å²	37	15.7 Å²	15.7	17%	0.173	8%	0.084	C	C	.	.	H	α-helix	trans	-64.3	-35.6	176.1	179.2	62	21.3	0	0	113.2	S325 L491 E492 V515	S325-Q488 PolarHBondContact O-N 3.22Å; S325-Q488 VanDerWaalsContact O-N 3.07Å; S325-Q488 WeakPolarHBondContact OG-CB 3.44Å; Q488-L491 WeakPolarHBondContact O-CB 3.15Å; Q488-L491 PolarHBondContact O-N 3.47Å; Q488-E492 PolarHBondContact NE2-OE1 3.12Å; Q488-E492 PolarHBondContact O-N 2.84Å; Q488-E492 VanDerWaalsContact O-N 3.15Å; Q488-V515 HydrophobicContact CB-CG2 4.07Å
489	G	87.7	Confident	90.5	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-63	-41.3	-179.7	0	0	0	0	0	113	V487 E492 A493	V487-G489 VanDerWaalsContact C-N 3.34Å; V487-G489 PolarHBondContact O-N 2.92Å; G489-E492 PolarHBondContact O-N 3.46Å; G489-A493 PolarHBondContact O-N 2.99Å
490	S	89.8	Confident	90.2	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-67	-37.8	175.4	53.6	0	0	0	0	111.9	S485 D486 V487 E492 A493 I494 F536	S485-S490 WeakPolarHBondContact CB-OG 2.96Å; D486-S490 PolarHBondContact OD1-OG 3.47Å; V487-S490 PolarHBondContact O-OG 3.01Å; S490-E492 VanDerWaalsContact C-N 3.34Å; S490-E492 PolarHBondContact O-N 3.1Å; S490-A493 PolarHBondContact O-N 3.38Å; S490-I494 VanDerWaalsContact O-CG1 3.27Å; S490-I494 WeakPolarHBondContact O-CG1 3.43Å; S490-I494 PolarHBondContact O-N 3.05Å; S490-F536 VanDerWaalsContact CB-CE1 3.45Å
491	L	92	Very high	89.7	Confident	3 Å²	3	20 Å²	20	2%	0.016	11%	0.11	C	C	.	.	H	α-helix	trans	-59.9	-43.2	174.7	-169.2	59	0	0	0	112.5	I483 S485 V487 Q488 I494 K495 V515	I483-L491 HydrophobicContact CB-CD1 4.26Å; I483-L491 HydrophobicContact CG2-CD1 3.7Å; S485-L491 WeakPolarHBondContact OG-CB 3.46Å; V487-L491 PolarHBondContact O-N 3.2Å; Q488-L491 WeakPolarHBondContact O-CB 3.15Å; Q488-L491 PolarHBondContact O-N 3.47Å; L491-I494 PolarHBondContact O-N 2.83Å; L491-K495 WeakPolarHBondContact O-CG 3.4Å; L491-K495 PolarHBondContact O-N 2.81Å; L491-V515 HydrophobicContact CD2-CG2 4.42Å
492	E	89.5	Confident	88.9	Confident	55 Å²	55	22.9 Å²	22.9	26%	0.257	13%	0.129	S	C	.	.	H	α-helix	trans	-67.1	-40.7	178.2	-73.1	168.2	-173.4	0	0	111.6	R210 Q488 G489 S490 K495 T496	R210-E492 IonicContact CZ-OE2 3.52Å; R210-E492 IonicContact NH1-OE1 2.97Å; R210-E492 IonicContact NH1-OE2 2.77Å; R210-E492 PolarHBondContact NH1-OE2 3.47Å; R210-E492 IonicContact NH2-OE2 2.79Å; R210-E492 PolarHBondContact NH2-OE2 3.35Å; Q488-E492 PolarHBondContact NE2-OE1 3.12Å; Q488-E492 PolarHBondContact O-N 2.84Å; Q488-E492 VanDerWaalsContact O-N 3.15Å; G489-E492 PolarHBondContact O-N 3.46Å; S490-E492 VanDerWaalsContact C-N 3.34Å; S490-E492 PolarHBondContact O-N 3.1Å; E492-K495 PolarHBondContact O-N 3.15Å; E492-T496 WeakPolarHBondContact O-CB 3.28Å; E492-T496 PolarHBondContact O-N 3.34Å; E492-T496 PolarHBondContact O-OG1 2.82Å
493	A	89.3	Confident	87.8	Confident	3 Å²	3	26.4 Å²	26.4	3%	0.025	15%	0.154	C	C	.	.	H	α-helix	trans	-61.9	-44.4	175.2	0	0	0	0	0	111.5	F204 G489 S490 K495 T496 L497 I561	F204-A493 HydrophobicContact CD1-CB 3.39Å; F204-A493 HydrophobicContact CE1-CB 3.51Å; F204-A493 HydrophobicContact CG-CB 4.24Å; F204-A493 HydrophobicContact CZ-CB 4.41Å; G489-A493 PolarHBondContact O-N 2.99Å; S490-A493 PolarHBondContact O-N 3.38Å; A493-K495 PolarHBondContact O-N 3.42Å; A493-T496 PolarHBondContact O-N 3.49Å; A493-L497 WeakPolarHBondContact O-CB 3.43Å; A493-L497 PolarHBondContact O-N 3.47Å; A493-I561 HydrophobicContact CB-CD1 4.03Å
494	I	91.8	Very high	86.9	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-61.5	-46	176.2	-66.9	163	0	0	0	110.6	I483 S490 L491 T496 L497 L498 F536 I561 L564	I483-I494 HydrophobicContact CD1-CG2 4.03Å; I483-I494 HydrophobicContact CG2-CD1 4.44Å; I483-I494 HydrophobicContact CG2-CG2 4.25Å; S490-I494 VanDerWaalsContact O-CG1 3.27Å; S490-I494 WeakPolarHBondContact O-CG1 3.43Å; S490-I494 PolarHBondContact O-N 3.05Å; L491-I494 PolarHBondContact O-N 2.83Å; I494-T496 VanDerWaalsContact C-N 3.32Å; I494-T496 PolarHBondContact O-N 3.46Å; I494-L497 PolarHBondContact O-N 2.87Å; I494-L498 HydrophobicContact CG2-CD1 3.79Å; I494-L498 HydrophobicContact CG2-CG 4.21Å; I494-L498 WeakPolarHBondContact O-CB 3.44Å; I494-L498 VanDerWaalsContact O-CG 3.29Å; I494-L498 WeakPolarHBondContact O-CG 3.46Å; I494-L498 PolarHBondContact O-N 3.28Å; I494-F536 HydrophobicContact CD1-CB 3.92Å; I494-F536 HydrophobicContact CD1-CD1 4.34Å; I494-F536 HydrophobicContact CD1-CD2 4.09Å; I494-F536 HydrophobicContact CD1-CG 3.86Å; I494-I561 HydrophobicContact CG1-CD1 3.79Å; I494-I561 HydrophobicContact CG1-CG1 3.93Å; I494-L564 HydrophobicContact CD1-CD1 4.12Å; I494-L564 HydrophobicContact CG2-CD2 4.01Å
495	K	90.5	Very high	85.9	Confident	65 Å²	65	38.1 Å²	38.1	28%	0.283	21%	0.213	S	C	.	.	H	α-helix	trans	-60.4	-42	176.8	-75.8	173.4	176.6	179.2	0	112.3	L491 E492 A493 S499 T513	L491-K495 WeakPolarHBondContact O-CG 3.4Å; L491-K495 PolarHBondContact O-N 2.81Å; E492-K495 PolarHBondContact O-N 3.15Å; A493-K495 PolarHBondContact O-N 3.42Å; K495-S499 VanDerWaalsContact O-CB 3.29Å; K495-S499 WeakPolarHBondContact O-CB 3.11Å; K495-S499 PolarHBondContact O-N 3.49Å; K495-S499 PolarHBondContact O-OG 3.39Å; K495-T513 WeakPolarHBondContact CE-OG1 3.44Å; K495-T513 PolarHBondContact NZ-OG1 2.81Å
496	T	87.9	Confident	85.4	Confident	61 Å²	61	38.1 Å²	38.1	37%	0.374	21%	0.213	S	C	.	.	H	α-helix	trans	-65	-45.7	178.9	-54.9	0	0	0	0	110.5	E492 A493 I494 S499 T500	E492-T496 WeakPolarHBondContact O-CB 3.28Å; E492-T496 PolarHBondContact O-N 3.34Å; E492-T496 PolarHBondContact O-OG1 2.82Å; A493-T496 PolarHBondContact O-N 3.49Å; I494-T496 VanDerWaalsContact C-N 3.32Å; I494-T496 PolarHBondContact O-N 3.46Å; T496-S499 PolarHBondContact O-N 3.42Å; T496-S499 PolarHBondContact O-OG 2.85Å; T496-T500 PolarHBondContact O-N 2.85Å; T496-T500 PolarHBondContact O-OG1 3.27Å; T496-T500 VanDerWaalsContact O-OG1 3.13Å
497	L	87.2	Confident	85.2	Confident	4 Å²	4	41 Å²	41	2%	0.021	23%	0.225	C	C	.	.	H	α-helix	trans	-60.4	-52.5	176.8	-172.5	153.9	0	0	0	110.9	A203 A493 I494 S499 T500 I561 A565 W752 F754	A203-L497 HydrophobicContact CB-CB 4.45Å; A203-L497 HydrophobicContact CB-CD1 4.1Å; A493-L497 WeakPolarHBondContact O-CB 3.43Å; A493-L497 PolarHBondContact O-N 3.47Å; I494-L497 PolarHBondContact O-N 2.87Å; L497-S499 PolarHBondContact O-N 3.22Å; L497-T500 VanDerWaalsContact O-CB 3.24Å; L497-T500 WeakPolarHBondContact O-CB 3.31Å; L497-T500 PolarHBondContact O-N 2.99Å; L497-T500 PolarHBondContact O-OG1 2.96Å; L497-I561 HydrophobicContact CD1-CD1 4.35Å; L497-I561 HydrophobicContact CD1-CG1 4.28Å; L497-A565 HydrophobicContact CD1-CB 4.32Å; L497-A565 HydrophobicContact CD2-CB 3.47Å; L497-A565 VanDerWaalsContact CD2-CB 3.47Å; L497-W752 HydrophobicContact CD2-CH2 3.72Å; L497-W752 HydrophobicContact CD2-CZ2 3.95Å; L497-W752 WeakPolarHBondContact O-CZ2 3.21Å; L497-F754 HydrophobicContact CD2-CD1 4.17Å; L497-F754 HydrophobicContact CD2-CE1 4.12Å
498	L	87.5	Confident	85	Confident	4 Å²	4	41.8 Å²	41.8	2%	0.021	23%	0.229	C	C	.	.	H	α-helix	trans	-65.8	-25.1	-179.5	-66.7	-179.2	0	0	0	113	L481 I483 I494 T500 Y501 Y510 V568 W752	L481-L498 HydrophobicContact CD1-CD1 4.47Å; I483-L498 HydrophobicContact CD1-CD1 3.71Å; I494-L498 HydrophobicContact CG2-CD1 3.79Å; I494-L498 HydrophobicContact CG2-CG 4.21Å; I494-L498 WeakPolarHBondContact O-CB 3.44Å; I494-L498 VanDerWaalsContact O-CG 3.29Å; I494-L498 WeakPolarHBondContact O-CG 3.46Å; I494-L498 PolarHBondContact O-N 3.28Å; L498-T500 VanDerWaalsContact C-N 3.25Å; L498-T500 PolarHBondContact O-N 3.09Å; L498-Y501 VanDerWaalsContact O-CB 3.31Å; L498-Y501 WeakPolarHBondContact O-CB 3.29Å; L498-Y501 PolarHBondContact O-N 3.07Å; L498-Y510 HydrophobicContact CB-CE1 4.49Å; L498-Y510 WeakPolarHBondContact CB-OH 3.48Å; L498-Y510 HydrophobicContact CD1-CE1 3.92Å; L498-V568 HydrophobicContact CD2-CB 4.05Å; L498-V568 HydrophobicContact CD2-CG1 3.81Å; L498-V568 HydrophobicContact CD2-CG2 4.12Å; L498-W752 HydrophobicContact CD2-CH2 4Å
499	S	85.3	Confident	84.9	Confident	86 Å²	86	43.3 Å²	43.3	60%	0.601	24%	0.236	S	C	*	.	H	α-helix	trans	-71.9	-18.4	173.3	73.9	0	0	0	0	114	K495 T496 L497 Y501	K495-S499 VanDerWaalsContact O-CB 3.29Å; K495-S499 WeakPolarHBondContact O-CB 3.11Å; K495-S499 PolarHBondContact O-N 3.49Å; K495-S499 PolarHBondContact O-OG 3.39Å; T496-S499 PolarHBondContact O-N 3.42Å; T496-S499 PolarHBondContact O-OG 2.85Å; L497-S499 PolarHBondContact O-N 3.22Å; S499-Y501 PolarHBondContact O-N 3.16Å
500	T	82.8	Confident	85.1	Confident	44 Å²	44	47.3 Å²	47.3	27%	0.27	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-13.1	176.1	-51.9	0	0	0	0	111.6	T496 L497 L498 C757 I758	T496-T500 PolarHBondContact O-N 2.85Å; T496-T500 PolarHBondContact O-OG1 3.27Å; T496-T500 VanDerWaalsContact O-OG1 3.13Å; L497-T500 VanDerWaalsContact O-CB 3.24Å; L497-T500 WeakPolarHBondContact O-CB 3.31Å; L497-T500 PolarHBondContact O-N 2.99Å; L497-T500 PolarHBondContact O-OG1 2.96Å; L498-T500 VanDerWaalsContact C-N 3.25Å; L498-T500 PolarHBondContact O-N 3.09Å; T500-C757 HydrophobicContact CG2-CB 3.42Å; T500-C757 VanDerWaalsContact CG2-CB 3.42Å; T500-I758 HydrophobicContact CG2-CG1 4.35Å
501	Y	80.7	Confident	85	Confident	17 Å²	17	50 Å²	50	7%	0.067	27%	0.269	C	S	.	.	S	Bend	trans	-67	130.8	178.6	-178.6	-97.6	0	0	0	112	L498 S499 S503 I508 V572 V750 W752	L498-Y501 VanDerWaalsContact O-CB 3.31Å; L498-Y501 WeakPolarHBondContact O-CB 3.29Å; L498-Y501 PolarHBondContact O-N 3.07Å; S499-Y501 PolarHBondContact O-N 3.16Å; Y501-S503 PolarHBondContact O-N 2.87Å; Y501-I508 HydrophobicContact CD1-CD1 3.94Å; Y501-I508 HydrophobicContact CD1-CG1 4.4Å; Y501-I508 HydrophobicContact CG-CD1 4.04Å; Y501-V572 HydrophobicContact CE1-CG1 4.47Å; Y501-V572 VanDerWaalsContact OH-CG1 3.27Å; Y501-V572 WeakPolarHBondContact OH-CG1 3.3Å; Y501-V750 HydrophobicContact CE2-CB 4.47Å; Y501-V750 HydrophobicContact CE2-CG1 3.93Å; Y501-W752 AromaticContact CD2-CD2 3.69Å; Y501-W752 HydrophobicContact CD2-CD2 3.69Å; Y501-W752 AromaticContact CD2-CE3 3.6Å; Y501-W752 HydrophobicContact CD2-CE3 3.6Å; Y501-W752 HydrophobicContact CD2-CG 4.11Å; Y501-W752 HydrophobicContact CD2-CH2 4.42Å; Y501-W752 AromaticContact CD2-CZ3 3.98Å; Y501-W752 HydrophobicContact CD2-CZ3 3.98Å; Y501-W752 HydrophobicContact CE2-CD2 4.5Å; Y501-W752 HydrophobicContact CE2-CE3 4.28Å
502	P	75.8	Confident	84.9	Confident	61 Å²	61	52.3 Å²	52.3	40%	0.396	28%	0.281	S	S	.	.			trans	-67.4	117.3	178.1	25.7	-32.7	0	0	0	111.8	D504 V750	P502-D504 PolarHBondContact O-N 2.96Å; P502-D504 VanDerWaalsContact O-N 3.13Å; P502-V750 HydrophobicContact CG-CG1 4.48Å
503	S	71.8	Confident	85.1	Confident	73 Å²	73	52 Å²	52	51%	0.51	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	10.1	-170.6	59.4	0	0	0	0	116.1	Y501 Q505	Y501-S503 PolarHBondContact O-N 2.87Å; S503-Q505 PolarHBondContact O-N 2.85Å
504	D	73.8	Confident	85.2	Confident	147 Å²	147	52.7 Å²	52.7	79%	0.786	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-37.8	-166.1	-67.9	-10.7	0	0	0	113	P502	P502-D504 PolarHBondContact O-N 2.96Å; P502-D504 VanDerWaalsContact O-N 3.13Å
505	Q	74.3	Confident	85.2	Confident	111 Å²	111	53.6 Å²	53.6	52%	0.519	30%	0.296	S	S	.	.	S	Bend	trans	-108	-37.1	-175.2	-58.8	-174	6.1	0	0	113.6	S503 L576	S503-Q505 PolarHBondContact O-N 2.85Å; Q505-L576 HydrophobicContact CB-CD2 3.56Å
506	C	81.7	Confident	85.1	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	129.2	-179.6	-171.1	0	0	0	0	110.6	I477 V572 L576	I477-C506 CarbonylContact O-C 3.57Å; I477-C506 WeakPolarHBondContact O-CA 3.46Å; I477-C506 PolarHBondContact O-SG 3.28Å; C506-V572 HydrophobicContact CB-CG1 3.72Å; C506-L576 HydrophobicContact CB-CD2 4.16Å
507	K	86.5	Confident	85.3	Confident	84 Å²	84	50.2 Å²	50.2	37%	0.365	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	117.4	176.9	-173.1	-175.8	171.7	-149.1	0	109.9	Q476 I477 S478 L479 E509	Q476-K507 HydrophobicContact CG-CB 4.39Å; I477-K507 PolarHBondContact O-N 2.74Å; S478-K507 CarbonylContact C-O 3.55Å; S478-K507 VanDerWaalsContact CA-O 3.24Å; S478-K507 WeakPolarHBondContact CA-O 3.36Å; L479-K507 PolarHBondContact N-O 2.92Å; K507-E509 HydrophobicContact CD-CG 4.29Å; K507-E509 HydrophobicContact CG-CG 4.24Å; K507-E509 IonicContact NZ-OE1 2.71Å; K507-E509 PolarHBondContact NZ-OE1 3.28Å; K507-E509 PolarHBondContact O-N 3.36Å
508	I	88.9	Confident	85.6	Confident	23 Å²	23	50 Å²	50	12%	0.118	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	121.8	173.2	-57.8	172.9	0	0	0	108.3	L481 Y501 Y510 V568	L481-I508 HydrophobicContact CD1-CG2 3.63Å; L481-I508 HydrophobicContact CG-CG2 4.32Å; Y501-I508 HydrophobicContact CD1-CD1 3.94Å; Y501-I508 HydrophobicContact CD1-CG1 4.4Å; Y501-I508 HydrophobicContact CG-CD1 4.04Å; I508-Y510 HydrophobicContact CG2-CE1 4.22Å; I508-V568 HydrophobicContact CD1-CG1 4.17Å
509	E	89.2	Confident	85.8	Confident	69 Å²	69	52.2 Å²	52.2	32%	0.322	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	122.5	179.8	-66.1	-166.1	150.6	0	0	110.9	L479 P480 L481 K507 C511	L479-E509 PolarHBondContact O-N 3.01Å; P480-E509 CarbonylContact C-O 3.54Å; P480-E509 WeakPolarHBondContact CA-O 3.46Å; L481-E509 PolarHBondContact N-O 2.91Å; K507-E509 HydrophobicContact CD-CG 4.29Å; K507-E509 HydrophobicContact CG-CG 4.24Å; K507-E509 IonicContact NZ-OE1 2.71Å; K507-E509 PolarHBondContact NZ-OE1 3.28Å; K507-E509 PolarHBondContact O-N 3.36Å; E509-C511 PolarHBondContact O-N 3.49Å
510	Y	90.1	Very high	86.1	Confident	83 Å²	83	53 Å²	53	33%	0.325	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	108.2	177	-52.1	-76.5	0	0	0	109.9	I483 L498 I508 T513	I483-Y510 HydrophobicContact CD1-CD1 3.8Å; I483-Y510 HydrophobicContact CD1-CE1 3.75Å; L498-Y510 HydrophobicContact CB-CE1 4.49Å; L498-Y510 WeakPolarHBondContact CB-OH 3.48Å; L498-Y510 HydrophobicContact CD1-CE1 3.92Å; I508-Y510 HydrophobicContact CG2-CE1 4.22Å; Y510-T513 HydrophobicContact CD1-CG2 4.34Å; Y510-T513 HydrophobicContact CG-CG2 4.42Å
511	C	87.7	Confident	86.5	Confident	56 Å²	56	54.7 Å²	54.7	38%	0.378	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	-56.2	178.5	-61	0	0	0	0	111	P480 L481 V482 E509	P480-C511 VanDerWaalsContact CB-SG 3.55Å; L481-C511 PolarHBondContact O-N 3.41Å; V482-C511 HydrophobicContact CG2-CB 4.3Å; E509-C511 PolarHBondContact O-N 3.49Å
512	I	91.5	Very high	87	Confident	52 Å²	52	55.4 Å²	55.4	27%	0.267	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	128.8	-179.8	-61.3	173.9	0	0	0	107.6	V482 I483 A525	V482-I512 WeakPolarHBondContact CA-O 3.37Å; V482-I512 HydrophobicContact CG1-CB 4.17Å; V482-I512 HydrophobicContact CG2-CB 4.3Å; I483-I512 PolarHBondContact N-O 3.41Å; I512-A525 HydrophobicContact CD1-CB 3.63Å
513	T	92.4	Very high	87.9	Confident	50 Å²	50	52.5 Å²	52.5	31%	0.307	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	132.2	172.5	66.2	0	0	0	0	108.6	I483 K495 Y510	I483-T513 HydrophobicContact CB-CG2 4.49Å; I483-T513 WeakPolarHBondContact O-CA 3.05Å; K495-T513 WeakPolarHBondContact CE-OG1 3.44Å; K495-T513 PolarHBondContact NZ-OG1 2.81Å; Y510-T513 HydrophobicContact CD1-CG2 4.34Å; Y510-T513 HydrophobicContact CG-CG2 4.42Å
514	G	90.9	Very high	88.9	Confident	17 Å²	17	52.5 Å²	52.5	18%	0.175	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.8	172.4	179.2	0	0	0	0	0	112.9	I483 K484 S485	I483-G514 PolarHBondContact O-N 3.2Å; K484-G514 WeakPolarHBondContact CA-O 3.43Å; K484-G514 WeakPolarHBondContact CD-O 3.47Å; S485-G514 PolarHBondContact N-O 3.4Å
515	V	91.9	Very high	89.8	Confident	18 Å²	18	47.1 Å²	47.1	11%	0.109	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	136.3	175.3	-179.2	0	0	0	0	108.6	T327 L390 S485 D486 Q488 L491	T327-V515 HydrophobicContact CG2-CG1 4.47Å; L390-V515 HydrophobicContact CD1-CB 4.28Å; S485-V515 CarbonylContact O-C 3.57Å; S485-V515 VanDerWaalsContact O-CA 3.26Å; S485-V515 WeakPolarHBondContact O-CA 3.34Å; D486-V515 WeakPolarHBondContact O-CG1 3.27Å; Q488-V515 HydrophobicContact CB-CG2 4.07Å; L491-V515 HydrophobicContact CD2-CG2 4.42Å
516	G	90.2	Very high	90.6	Very high	3 Å²	3	41.9 Å²	41.9	3%	0.031	23%	0.234	C	C	.	.	S	Bend	trans	108.4	176.4	176.4	0	0	0	0	0	115.8	T327 S485 I538	T327-G516 WeakPolarHBondContact OG1-CA 3.04Å; S485-G516 PolarHBondContact O-N 3.45Å; G516-I538 WeakPolarHBondContact O-CD1 3.4Å
517	P	91.5	Very high	91.2	Very high	53 Å²	53	43.1 Å²	43.1	34%	0.344	24%	0.244	S	C	.	.	P	Polyproline II helix	trans	-62.6	152.3	-169.8	26.8	-35.2	0	0	0	112.2	T519 I538 L541	P517-T519 PolarHBondContact O-N 2.95Å; P517-I538 HydrophobicContact CB-CG2 4.48Å; P517-L541 HydrophobicContact CB-CD1 4.39Å; P517-L541 HydrophobicContact CB-CD2 4.39Å; P517-L541 HydrophobicContact CB-CG 4.1Å
518	L	92.2	Very high	91.4	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	26%	0.26	C	S	.	.	B	Isolated β-bridge	trans	-70.8	126.7	178.8	-174.4	69.1	0	0	0	110.7	K484 E522 V523 V533 L535 A540 A544 I555	K484-L518 HydrophobicContact CG-CD1 4.39Å; L518-E522 HydrophobicContact CD1-CB 4Å; L518-V523 HydrophobicContact CD1-CG2 4.39Å; L518-V523 HydrophobicContact CD2-CG2 3.72Å; L518-V523 HydrophobicContact CG-CG2 3.96Å; L518-V533 HydrophobicContact CD1-CG1 3.8Å; L518-V533 HydrophobicContact CD2-CG1 3.85Å; L518-V533 HydrophobicContact CG-CG1 4.48Å; L518-L535 HydrophobicContact CB-CD1 4.46Å; L518-L535 HydrophobicContact CB-CD2 4.03Å; L518-L535 HydrophobicContact CD1-CD2 4.34Å; L518-L535 HydrophobicContact CD2-CD1 4.4Å; L518-L535 HydrophobicContact CD2-CD2 4.31Å; L518-L535 HydrophobicContact CG-CD2 4.47Å; L518-A540 HydrophobicContact CB-CB 4.45Å; L518-A540 HydrophobicContact CD2-CB 4.21Å; L518-A544 HydrophobicContact CD2-CB 4.29Å; L518-A544 HydrophobicContact CG-CB 4.23Å; L518-A544 WeakPolarHBondContact O-CB 3.22Å; L518-I555 HydrophobicContact CD2-CD1 3.78Å; L518-I555 HydrophobicContact CD2-CG1 4.32Å
519	T	91.6	Very high	91.5	Very high	49 Å²	49	45.6 Å²	45.6	30%	0.301	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-100.1	157.3	178.2	63.4	0	0	0	0	112.3	P517 S521 E522 V523	P517-T519 PolarHBondContact O-N 2.95Å; T519-S521 VanDerWaalsContact C-N 3.31Å; T519-S521 PolarHBondContact O-N 3.39Å; T519-S521 PolarHBondContact OG1-OG 3.07Å; T519-S521 VanDerWaalsContact OG1-OG 3.04Å; T519-E522 PolarHBondContact N-OE2 3.22Å; T519-E522 WeakPolarHBondContact O-CB 3.41Å; T519-E522 PolarHBondContact O-N 3.49Å; T519-E522 VanDerWaalsContact O-N 3.08Å; T519-E522 VanDerWaalsContact OG1-CD 3.24Å; T519-E522 VanDerWaalsContact OG1-CG 3.28Å; T519-E522 WeakPolarHBondContact OG1-CG 3.42Å; T519-E522 PolarHBondContact OG1-OE2 3.04Å; T519-V523 PolarHBondContact O-N 3.49Å
520	E	92.3	Very high	91.5	Very high	103 Å²	103	48.5 Å²	48.5	48%	0.481	29%	0.294	S	S	.	.	H	α-helix	trans	-53.2	-46.2	176.5	-178.6	-176.4	-173.5	0	0	112.3	E522 V523 D524 A547	E520-E522 PolarHBondContact O-N 3.33Å; E520-E522 VanDerWaalsContact O-N 3.13Å; E520-V523 WeakPolarHBondContact O-CB 3.4Å; E520-V523 PolarHBondContact O-N 3.07Å; E520-D524 PolarHBondContact O-N 2.83Å; E520-A547 HydrophobicContact CG-CB 4.05Å
521	S	91.4	Very high	91.5	Very high	80 Å²	80	44.7 Å²	44.7	56%	0.559	28%	0.28	S	S	*	.	H	α-helix	trans	-59.4	-27.2	178.9	55.1	0	0	0	0	114.3	T519 A525	T519-S521 VanDerWaalsContact C-N 3.31Å; T519-S521 PolarHBondContact O-N 3.39Å; T519-S521 PolarHBondContact OG1-OG 3.07Å; T519-S521 VanDerWaalsContact OG1-OG 3.04Å; S521-A525 WeakPolarHBondContact O-CB 3.48Å; S521-A525 PolarHBondContact O-N 3.3Å; S521-A525 VanDerWaalsContact O-N 3.16Å
522	E	92.1	Very high	91.8	Very high	31 Å²	31	43.3 Å²	43.3	15%	0.145	27%	0.268	C	S	.	.	H	α-helix	trans	-81.1	-33.7	178.8	-69.1	170.7	165.5	0	0	111.2	K484 L518 T519 E520 A525 A526	K484-E522 WeakPolarHBondContact CE-OE1 3.48Å; K484-E522 WeakPolarHBondContact CE-OE2 3.43Å; K484-E522 IonicContact NZ-OE1 3.23Å; K484-E522 PolarHBondContact NZ-OE1 2.92Å; K484-E522 IonicContact NZ-OE2 2.8Å; K484-E522 PolarHBondContact NZ-OE2 3.15Å; L518-E522 HydrophobicContact CD1-CB 4Å; T519-E522 PolarHBondContact N-OE2 3.22Å; T519-E522 WeakPolarHBondContact O-CB 3.41Å; T519-E522 PolarHBondContact O-N 3.49Å; T519-E522 VanDerWaalsContact O-N 3.08Å; T519-E522 VanDerWaalsContact OG1-CD 3.24Å; T519-E522 VanDerWaalsContact OG1-CG 3.28Å; T519-E522 WeakPolarHBondContact OG1-CG 3.42Å; T519-E522 PolarHBondContact OG1-OE2 3.04Å; E520-E522 PolarHBondContact O-N 3.33Å; E520-E522 VanDerWaalsContact O-N 3.13Å; E522-A525 PolarHBondContact O-N 2.69Å; E522-A526 WeakPolarHBondContact O-CB 3.44Å; E522-A526 PolarHBondContact O-N 3.05Å
523	V	93.4	Very high	91.9	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-65.8	-43.1	171.7	178.9	0	0	0	0	110.4	L518 T519 E520 A525 A526 A527 A544 A547 A548 V553	L518-V523 HydrophobicContact CD1-CG2 4.39Å; L518-V523 HydrophobicContact CD2-CG2 3.72Å; L518-V523 HydrophobicContact CG-CG2 3.96Å; T519-V523 PolarHBondContact O-N 3.49Å; E520-V523 WeakPolarHBondContact O-CB 3.4Å; E520-V523 PolarHBondContact O-N 3.07Å; V523-A525 VanDerWaalsContact C-N 3.33Å; V523-A525 PolarHBondContact O-N 2.62Å; V523-A526 WeakPolarHBondContact O-CB 3.31Å; V523-A526 PolarHBondContact O-N 3.3Å; V523-A527 WeakPolarHBondContact O-CB 3.2Å; V523-A527 PolarHBondContact O-N 3.01Å; V523-A544 HydrophobicContact CG2-CB 4.01Å; V523-A547 HydrophobicContact CB-CB 4.44Å; V523-A547 HydrophobicContact CG1-CB 4.16Å; V523-A548 HydrophobicContact CG1-CB 3.89Å; V523-V553 HydrophobicContact CG1-CB 4.38Å; V523-V553 HydrophobicContact CG1-CG2 4.23Å
524	D	93.3	Very high	92	Very high	73 Å²	73	38.4 Å²	38.4	39%	0.39	24%	0.241	S	C	.	.	H	α-helix	trans	-62.3	-41.2	175.3	-71.7	-22	0	0	0	112.1	E520 A526 A527 A528 N551	E520-D524 PolarHBondContact O-N 2.83Å; D524-A526 VanDerWaalsContact C-N 3.34Å; D524-A527 PolarHBondContact O-N 3.46Å; D524-A528 PolarHBondContact O-N 3.22Å; D524-N551 PolarHBondContact OD1-ND2 3.49Å; D524-N551 VanDerWaalsContact OD1-ND2 3.08Å
525	A	91.8	Very high	92.1	Very high	35 Å²	35	37.6 Å²	37.6	29%	0.289	23%	0.233	S	C	.	.	H	α-helix	trans	-65.3	-38.6	174.9	0	0	0	0	0	111.9	I512 S521 E522 V523 A528 V529	I512-A525 HydrophobicContact CD1-CB 3.63Å; S521-A525 WeakPolarHBondContact O-CB 3.48Å; S521-A525 PolarHBondContact O-N 3.3Å; S521-A525 VanDerWaalsContact O-N 3.16Å; E522-A525 PolarHBondContact O-N 2.69Å; V523-A525 VanDerWaalsContact C-N 3.33Å; V523-A525 PolarHBondContact O-N 2.62Å; A525-A528 PolarHBondContact O-N 3.5Å; A525-V529 PolarHBondContact O-N 3.4Å
526	A	92.6	Very high	92.2	Very high	1 Å²	1	36.8 Å²	36.8	1%	0.008	23%	0.227	C	C	.	.	H	α-helix	trans	-63.8	-43.1	174.4	0	0	0	0	0	111.3	V482 E522 V523 D524 A528 V529 N530 A531 V533 V553	V482-A526 HydrophobicContact CG2-CB 4.02Å; E522-A526 WeakPolarHBondContact O-CB 3.44Å; E522-A526 PolarHBondContact O-N 3.05Å; V523-A526 WeakPolarHBondContact O-CB 3.31Å; V523-A526 PolarHBondContact O-N 3.3Å; D524-A526 VanDerWaalsContact C-N 3.34Å; A526-A528 VanDerWaalsContact C-N 3.34Å; A526-A528 PolarHBondContact O-N 3.44Å; A526-V529 PolarHBondContact O-N 3.08Å; A526-N530 WeakPolarHBondContact O-CA 3.3Å; A526-N530 PolarHBondContact O-N 3.35Å; A526-A531 HydrophobicContact CB-CB 4.29Å; A526-A531 PolarHBondContact O-N 2.88Å; A526-V533 HydrophobicContact CB-CG2 3.8Å; A526-V553 HydrophobicContact CB-CG1 4.29Å
527	A	93.1	Very high	92.1	Very high	26 Å²	26	39.2 Å²	39.2	22%	0.215	24%	0.24	C	C	.	.	H	α-helix	trans	-61.2	-41.1	176.5	0	0	0	0	0	112	V523 D524 V529 N530 N551 V553	V523-A527 WeakPolarHBondContact O-CB 3.2Å; V523-A527 PolarHBondContact O-N 3.01Å; D524-A527 PolarHBondContact O-N 3.46Å; A527-V529 PolarHBondContact O-N 2.78Å; A527-N530 PolarHBondContact O-N 3.16Å; A527-N530 PolarHBondContact O-OD1 3.11Å; A527-N551 HydrophobicContact CB-CB 3.87Å; A527-V553 HydrophobicContact CB-CG2 3.83Å
528	A	92.4	Very high	92.1	Very high	84 Å²	84	37.5 Å²	37.5	69%	0.694	23%	0.228	S	C	*	.	H	α-helix	trans	-62.9	-29.3	179	0	0	0	0	0	113.7	D524 A525 A526	D524-A528 PolarHBondContact O-N 3.22Å; A525-A528 PolarHBondContact O-N 3.5Å; A526-A528 VanDerWaalsContact C-N 3.34Å; A526-A528 PolarHBondContact O-N 3.44Å
529	V	89.1	Confident	91.8	Very high	74 Å²	74	43.7 Å²	43.7	45%	0.448	26%	0.256	S	S	.	.	H	α-helix	trans	-100.8	-6.6	-179.4	-171.8	0	0	0	0	112.1	P480 A525 A526 A527 A531	P480-V529 HydrophobicContact CB-CG1 3.72Å; P480-V529 HydrophobicContact CG-CG1 4.08Å; A525-V529 PolarHBondContact O-N 3.4Å; A526-V529 PolarHBondContact O-N 3.08Å; A527-V529 PolarHBondContact O-N 2.78Å; V529-A531 VanDerWaalsContact C-N 3.29Å; V529-A531 HydrophobicContact CB-CB 4.49Å
530	N	89.8	Confident	91.7	Very high	130 Å²	130	42.2 Å²	42.2	70%	0.695	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.6	44	-166.6	-59.9	-45.9	0	0	0	112.4	A526 A527	A526-N530 WeakPolarHBondContact O-CA 3.3Å; A526-N530 PolarHBondContact O-N 3.35Å; A527-N530 PolarHBondContact O-N 3.16Å; A527-N530 PolarHBondContact O-OD1 3.11Å
531	A	91.3	Very high	91.6	Very high	4 Å²	4	40 Å²	40	3%	0.033	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-86.8	147.2	179.1	0	0	0	0	0	112.1	P480 V482 A526 V529	P480-A531 HydrophobicContact CB-CB 3.9Å; P480-A531 HydrophobicContact CG-CB 4.28Å; P480-A531 VanDerWaalsContact O-CA 3.27Å; P480-A531 WeakPolarHBondContact O-CA 3.45Å; P480-A531 WeakPolarHBondContact O-CB 3.39Å; V482-A531 HydrophobicContact CG2-CB 4.06Å; A526-A531 HydrophobicContact CB-CB 4.29Å; A526-A531 PolarHBondContact O-N 2.88Å; V529-A531 VanDerWaalsContact C-N 3.29Å; V529-A531 HydrophobicContact CB-CB 4.49Å
532	N	92.1	Very high	91.5	Very high	26 Å²	26	40.7 Å²	40.7	14%	0.139	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	139.4	170.9	-65.8	-40.5	0	0	0	110.1	P480 L481 V482 L571	P480-N532 PolarHBondContact O-N 2.77Å; L481-N532 HydrophobicContact CD2-CB 4.04Å; V482-N532 PolarHBondContact N-O 2.91Å; N532-L571 HydrophobicContact CB-CD1 4.32Å
533	V	94.2	Very high	91.5	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	120.5	-179.3	-178.3	0	0	0	0	109.9	V482 L518 A526 L535 V553 K554 I555 K556	V482-V533 HydrophobicContact CB-CG2 4.21Å; V482-V533 HydrophobicContact CG1-CG1 4.46Å; L518-V533 HydrophobicContact CD1-CG1 3.8Å; L518-V533 HydrophobicContact CD2-CG1 3.85Å; L518-V533 HydrophobicContact CG-CG1 4.48Å; A526-V533 HydrophobicContact CB-CG2 3.8Å; V533-L535 HydrophobicContact CG1-CD2 3.84Å; V533-L535 HydrophobicContact CG1-CG 4.33Å; V533-V553 HydrophobicContact CG2-CG1 3.76Å; V533-K554 PolarHBondContact N-O 3.02Å; V533-K554 VanDerWaalsContact N-O 3.11Å; V533-I555 HydrophobicContact CB-CG1 4.27Å; V533-K556 PolarHBondContact O-N 3.22Å
534	L	94.2	Very high	91.4	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	118.8	178.2	-54.5	175.4	0	0	0	109.1	L481 V482 I483 K484 K556 F558 L564 V568	L481-L534 HydrophobicContact CD1-CD1 4.12Å; L481-L534 HydrophobicContact CD2-CD1 4.22Å; V482-L534 PolarHBondContact O-N 3.13Å; I483-L534 WeakPolarHBondContact CA-O 3.39Å; I483-L534 HydrophobicContact CG1-CD1 4.4Å; K484-L534 PolarHBondContact N-O 2.9Å; L534-K556 HydrophobicContact CD2-CB 4.34Å; L534-F558 HydrophobicContact CD2-CE2 3.93Å; L534-L564 HydrophobicContact CB-CD1 4.47Å; L534-L564 HydrophobicContact CD1-CD2 4.41Å; L534-V568 HydrophobicContact CD1-CG2 3.57Å
535	L	94.2	Very high	91.3	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	130.9	176.8	-53.5	-175.9	0	0	0	109.6	K484 L518 V533 A540 I555 K556 E557 F558	K484-L535 HydrophobicContact CB-CD2 3.7Å; K484-L535 HydrophobicContact CG-CD2 4.26Å; K484-L535 CarbonylContact O-C 3.56Å; K484-L535 WeakPolarHBondContact O-CA 3.5Å; L518-L535 HydrophobicContact CB-CD1 4.46Å; L518-L535 HydrophobicContact CB-CD2 4.03Å; L518-L535 HydrophobicContact CD1-CD2 4.34Å; L518-L535 HydrophobicContact CD2-CD1 4.4Å; L518-L535 HydrophobicContact CD2-CD2 4.31Å; L518-L535 HydrophobicContact CG-CD2 4.47Å; V533-L535 HydrophobicContact CG1-CD2 3.84Å; V533-L535 HydrophobicContact CG1-CG 4.33Å; L535-A540 HydrophobicContact CD1-CB 4.03Å; L535-I555 HydrophobicContact CD1-CG2 3.7Å; L535-I555 HydrophobicContact CG-CG2 4.09Å; L535-K556 PolarHBondContact N-O 3.27Å; L535-E557 HydrophobicContact CB-CG 4.3Å; L535-E557 HydrophobicContact CD1-CG 4.14Å; L535-F558 PolarHBondContact O-N 2.96Å
536	F	93.2	Very high	91.4	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	116.2	178.3	-175.7	-96.5	0	0	0	110.6	K484 S485 D486 S490 I494 I538 F558 I561 L564	K484-F536 PolarHBondContact O-N 3.01Å; S485-F536 WeakPolarHBondContact CA-O 3.48Å; D486-F536 PolarHBondContact N-O 3.02Å; S490-F536 VanDerWaalsContact CB-CE1 3.45Å; I494-F536 HydrophobicContact CD1-CB 3.92Å; I494-F536 HydrophobicContact CD1-CD1 4.34Å; I494-F536 HydrophobicContact CD1-CD2 4.09Å; I494-F536 HydrophobicContact CD1-CG 3.86Å; F536-I538 PolarHBondContact O-N 3.41Å; F536-I538 VanDerWaalsContact O-N 3.09Å; F536-F558 CarbonylContact C-O 3.59Å; F536-F558 WeakPolarHBondContact CA-O 3.48Å; F536-I561 HydrophobicContact CE2-CB 4.08Å; F536-I561 HydrophobicContact CZ-CB 4.45Å; F536-L564 HydrophobicContact CB-CD1 4.43Å; F536-L564 HydrophobicContact CD2-CD1 4.23Å
537	N	88.8	Confident	91.4	Very high	54 Å²	54	47.4 Å²	47.4	29%	0.289	27%	0.272	S	S	.	.	S	Bend	trans	50.4	31.1	-177.1	-159.4	38.1	0	0	0	113.7	D486 F558	D486-N537 HydrophobicContact CB-CB 4.21Å; D486-N537 WeakPolarHBondContact OD2-CB 3.28Å; D486-N537 PolarHBondContact OD2-ND2 3.39Å; N537-F558 PolarHBondContact N-O 3.09Å
538	I	90.5	Very high	91.3	Very high	18 Å²	18	46.5 Å²	46.5	9%	0.092	26%	0.264	C	S	.	.			trans	-136.7	145	-178.9	-73.4	-168.3	0	0	0	108.7	S485 D486 G516 P517 F536	S485-I538 WeakPolarHBondContact O-CD1 3.35Å; D486-I538 HydrophobicContact CB-CD1 4.41Å; D486-I538 HydrophobicContact CB-CG1 3.97Å; G516-I538 WeakPolarHBondContact O-CD1 3.4Å; P517-I538 HydrophobicContact CB-CG2 4.48Å; F536-I538 PolarHBondContact O-N 3.41Å; F536-I538 VanDerWaalsContact O-N 3.09Å
539	H	87	Confident	91.3	Very high	130 Å²	130	49.8 Å²	49.8	60%	0.602	27%	0.265	S	S	*	.	P	Polyproline II helix	trans	-102	149.9	169.1	-56.7	-61.4	0	0	0	111.6	E557	H539-E557 IonicContact CE1-OE2 3.03Å; H539-E557 IonicContact ND1-OE1 3.34Å; H539-E557 IonicContact ND1-OE2 3.68Å; H539-E557 PolarHBondContact ND1-OE2 2.99Å
540	A	88.1	Confident	91.4	Very high	18 Å²	18	53.3 Å²	53.3	15%	0.149	28%	0.277	C	S	.	.	B	Isolated β-bridge	trans	-69	144.3	173.1	0	0	0	0	0	111.6	L518 L535 T545 I555	L518-A540 HydrophobicContact CB-CB 4.45Å; L518-A540 HydrophobicContact CD2-CB 4.21Å; L535-A540 HydrophobicContact CD1-CB 4.03Å; A540-T545 HydrophobicContact CB-CG2 3.6Å; A540-I555 HydrophobicContact CB-CD1 4.49Å
541	L	90.1	Very high	91.4	Very high	56 Å²	56	50.4 Å²	50.4	29%	0.293	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-67.2	149.6	170	-69.2	170.8	0	0	0	110.1	P517 E543 A544 T545	P517-L541 HydrophobicContact CB-CD1 4.39Å; P517-L541 HydrophobicContact CB-CD2 4.39Å; P517-L541 HydrophobicContact CB-CG 4.1Å; L541-E543 PolarHBondContact O-N 2.57Å; L541-E543 VanDerWaalsContact O-N 3.16Å; L541-A544 HydrophobicContact CB-CB 4.39Å; L541-A544 WeakPolarHBondContact O-CA 3.38Å; L541-A544 WeakPolarHBondContact O-CB 3.4Å; L541-A544 PolarHBondContact O-N 3.03Å; L541-T545 PolarHBondContact O-N 3.14Å
542	P	91	Very high	91.3	Very high	94 Å²	94	55.7 Å²	55.7	61%	0.61	30%	0.297	S	S	*	.	H	α-helix	trans	-56.6	-33.8	179.3	-25.6	34	0	0	0	113.9	T545 I546	P542-T545 WeakPolarHBondContact CA-OG1 3.41Å; P542-T545 PolarHBondContact O-OG1 3.22Å; P542-I546 WeakPolarHBondContact O-CD1 3.17Å; P542-I546 VanDerWaalsContact O-CG1 3.29Å; P542-I546 WeakPolarHBondContact O-CG1 3.41Å; P542-I546 PolarHBondContact O-N 2.89Å
543	E	92	Very high	91.2	Very high	133 Å²	133	55.5 Å²	55.5	62%	0.621	30%	0.297	S	S	*	.	H	α-helix	trans	-66.4	-40.4	175.6	-64	174	173.7	0	0	111.3	L541 I546 A547	L541-E543 PolarHBondContact O-N 2.57Å; L541-E543 VanDerWaalsContact O-N 3.16Å; E543-I546 PolarHBondContact O-N 3.15Å; E543-A547 PolarHBondContact O-N 2.82Å; E543-A547 VanDerWaalsContact O-N 3.12Å
544	A	90.3	Very high	91	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-70.9	-35	179.3	0	0	0	0	0	112.3	L518 V523 L541 A547 A548	L518-A544 HydrophobicContact CD2-CB 4.29Å; L518-A544 HydrophobicContact CG-CB 4.23Å; L518-A544 WeakPolarHBondContact O-CB 3.22Å; V523-A544 HydrophobicContact CG2-CB 4.01Å; L541-A544 HydrophobicContact CB-CB 4.39Å; L541-A544 WeakPolarHBondContact O-CA 3.38Å; L541-A544 WeakPolarHBondContact O-CB 3.4Å; L541-A544 PolarHBondContact O-N 3.03Å; A544-A547 PolarHBondContact O-N 3.43Å; A544-A548 WeakPolarHBondContact O-CB 3.22Å; A544-A548 PolarHBondContact O-N 2.97Å
545	T	91.7	Very high	90.9	Very high	54 Å²	54	63.1 Å²	63.1	33%	0.331	33%	0.331	S	S	.	.	H	α-helix	trans	-65.3	-41.8	175.5	52.6	0	0	0	0	111.5	A540 L541 P542 A548 E549	A540-T545 HydrophobicContact CB-CG2 3.6Å; L541-T545 PolarHBondContact O-N 3.14Å; P542-T545 WeakPolarHBondContact CA-OG1 3.41Å; P542-T545 PolarHBondContact O-OG1 3.22Å; T545-A548 PolarHBondContact O-N 2.63Å; T545-E549 WeakPolarHBondContact O-CG 3.34Å; T545-E549 PolarHBondContact O-N 3.43Å
546	I	94.2	Very high	90.8	Very high	90 Å²	90	65.8 Å²	65.8	46%	0.462	34%	0.343	S	S	.	.	H	α-helix	trans	-63.1	-44.9	176.7	-65.2	164.3	0	0	0	110.5	P542 E543 A548 E549 Q550	P542-I546 WeakPolarHBondContact O-CD1 3.17Å; P542-I546 VanDerWaalsContact O-CG1 3.29Å; P542-I546 WeakPolarHBondContact O-CG1 3.41Å; P542-I546 PolarHBondContact O-N 2.89Å; E543-I546 PolarHBondContact O-N 3.15Å; I546-A548 VanDerWaalsContact C-N 3.29Å; I546-A548 PolarHBondContact O-N 3.46Å; I546-E549 PolarHBondContact O-N 3.5Å; I546-Q550 WeakPolarHBondContact O-CG 3.33Å; I546-Q550 PolarHBondContact O-N 3.29Å; I546-Q550 VanDerWaalsContact O-N 3.07Å
547	A	92	Very high	90.8	Very high	5 Å²	5	70.2 Å²	70.2	4%	0.041	36%	0.364	C	S	.	.	H	α-helix	trans	-63	-36.5	177	0	0	0	0	0	112.2	E520 V523 E543 A544 Q550 N551	E520-A547 HydrophobicContact CG-CB 4.05Å; V523-A547 HydrophobicContact CB-CB 4.44Å; V523-A547 HydrophobicContact CG1-CB 4.16Å; E543-A547 PolarHBondContact O-N 2.82Å; E543-A547 VanDerWaalsContact O-N 3.12Å; A544-A547 PolarHBondContact O-N 3.43Å; A547-Q550 PolarHBondContact O-N 3.02Å; A547-N551 WeakPolarHBondContact O-CB 3.24Å; A547-N551 PolarHBondContact O-N 3.46Å; A547-N551 PolarHBondContact O-ND2 3.32Å
548	A	90.9	Very high	91	Very high	6 Å²	6	69 Å²	69	5%	0.05	36%	0.356	C	S	.	.	H	α-helix	trans	-69.3	-38.5	178.6	0	0	0	0	0	112.5	V523 A544 T545 I546 N551 C552 V553 I555	V523-A548 HydrophobicContact CG1-CB 3.89Å; A544-A548 WeakPolarHBondContact O-CB 3.22Å; A544-A548 PolarHBondContact O-N 2.97Å; T545-A548 PolarHBondContact O-N 2.63Å; I546-A548 VanDerWaalsContact C-N 3.29Å; I546-A548 PolarHBondContact O-N 3.46Å; A548-N551 PolarHBondContact O-N 3.27Å; A548-C552 WeakPolarHBondContact O-CA 3.44Å; A548-C552 PolarHBondContact O-N 3.01Å; A548-V553 HydrophobicContact CB-CB 4.39Å; A548-V553 PolarHBondContact O-N 2.85Å; A548-I555 HydrophobicContact CB-CD1 3.37Å; A548-I555 HydrophobicContact CB-CG1 4.02Å
549	E	92.1	Very high	90.9	Very high	153 Å²	153	70.7 Å²	70.7	72%	0.715	37%	0.365	S	S	*	.	H	α-helix	trans	-63.2	-42.7	172.9	-72.7	176.7	-176.1	0	0	111.6	T545 I546 C552	T545-E549 WeakPolarHBondContact O-CG 3.34Å; T545-E549 PolarHBondContact O-N 3.43Å; I546-E549 PolarHBondContact O-N 3.5Å; E549-C552 PolarHBondContact O-N 3.05Å
550	Q	92.2	Very high	91	Very high	148 Å²	148	65.5 Å²	65.5	69%	0.692	34%	0.342	S	S	*	.	H	α-helix	trans	-65.6	-41.3	177.9	-70.6	175.9	7.9	0	0	112.5	I546 A547	I546-Q550 WeakPolarHBondContact O-CG 3.33Å; I546-Q550 PolarHBondContact O-N 3.29Å; I546-Q550 VanDerWaalsContact O-N 3.07Å; A547-Q550 PolarHBondContact O-N 3.02Å
551	N	89.8	Confident	90.9	Very high	69 Å²	69	64.7 Å²	64.7	37%	0.369	34%	0.335	S	S	.	.	H	α-helix	trans	-90.6	1.1	-177.6	-68.5	-30.6	0	0	0	113.7	D524 A527 A547 A548 V553	D524-N551 PolarHBondContact OD1-ND2 3.49Å; D524-N551 VanDerWaalsContact OD1-ND2 3.08Å; A527-N551 HydrophobicContact CB-CB 3.87Å; A547-N551 WeakPolarHBondContact O-CB 3.24Å; A547-N551 PolarHBondContact O-N 3.46Å; A547-N551 PolarHBondContact O-ND2 3.32Å; A548-N551 PolarHBondContact O-N 3.27Å; N551-V553 VanDerWaalsContact C-N 3.28Å; N551-V553 HydrophobicContact CB-CG2 3.93Å; N551-V553 PolarHBondContact O-N 3.1Å
552	C	88.5	Confident	90.7	Very high	116 Å²	116	65.1 Å²	65.1	78%	0.784	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.4	38	-176.3	-62.4	0	0	0	0	114	A548 E549	A548-C552 WeakPolarHBondContact O-CA 3.44Å; A548-C552 PolarHBondContact O-N 3.01Å; E549-C552 PolarHBondContact O-N 3.05Å
553	V	90	Very high	90.6	Very high	21 Å²	21	68 Å²	68	13%	0.127	33%	0.332	C	S	.	.			trans	-86.5	130.3	179.5	178.9	0	0	0	0	110.3	V523 A526 A527 V533 A548 N551 I555	V523-V553 HydrophobicContact CG1-CB 4.38Å; V523-V553 HydrophobicContact CG1-CG2 4.23Å; A526-V553 HydrophobicContact CB-CG1 4.29Å; A527-V553 HydrophobicContact CB-CG2 3.83Å; V533-V553 HydrophobicContact CG2-CG1 3.76Å; A548-V553 HydrophobicContact CB-CB 4.39Å; A548-V553 PolarHBondContact O-N 2.85Å; N551-V553 VanDerWaalsContact C-N 3.28Å; N551-V553 HydrophobicContact CB-CG2 3.93Å; N551-V553 PolarHBondContact O-N 3.1Å; V553-I555 PolarHBondContact O-N 3.4Å
554	K	89.7	Confident	90.5	Very high	113 Å²	113	61.7 Å²	61.7	49%	0.491	30%	0.303	S	S	.	.			trans	-76.7	110.8	176.2	-63.2	-179	-178.4	-178.7	0	110	V533	V533-K554 PolarHBondContact N-O 3.02Å; V533-K554 VanDerWaalsContact N-O 3.11Å
555	I	92.3	Very high	90.4	Very high	47 Å²	47	61.7 Å²	61.7	24%	0.241	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	131	169.6	-59.6	175.3	0	0	0	108.6	L518 V533 L535 A540 A548 V553	L518-I555 HydrophobicContact CD2-CD1 3.78Å; L518-I555 HydrophobicContact CD2-CG1 4.32Å; V533-I555 HydrophobicContact CB-CG1 4.27Å; L535-I555 HydrophobicContact CD1-CG2 3.7Å; L535-I555 HydrophobicContact CG-CG2 4.09Å; A540-I555 HydrophobicContact CB-CD1 4.49Å; A548-I555 HydrophobicContact CB-CD1 3.37Å; A548-I555 HydrophobicContact CB-CG1 4.02Å; V553-I555 PolarHBondContact O-N 3.4Å
556	K	92.1	Very high	90.2	Very high	56 Å²	56	63.4 Å²	63.4	24%	0.243	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	130.3	174.6	-60.4	-168.6	173.5	-160.9	0	110.5	V533 L534 L535 F558 E567	V533-K556 PolarHBondContact O-N 3.22Å; L534-K556 HydrophobicContact CD2-CB 4.34Å; L535-K556 PolarHBondContact N-O 3.27Å; K556-F558 HydrophobicContact CB-CD2 4.46Å; K556-F558 HydrophobicContact CB-CE2 3.45Å; K556-F558 VanDerWaalsContact CB-CE2 3.45Å; K556-F558 HydrophobicContact CB-CZ 3.7Å; K556-F558 HydrophobicContact CD-CZ 4.23Å; K556-E567 HydrophobicContact CD-CG 3.69Å; K556-E567 WeakPolarHBondContact CD-OE2 3.1Å; K556-E567 IonicContact NZ-OE1 3.99Å; K556-E567 PolarHBondContact NZ-OE1 2.93Å; K556-E567 IonicContact NZ-OE2 3.06Å; K556-E567 PolarHBondContact NZ-OE2 3.11Å
557	E	93.5	Very high	90	Very high	94 Å²	94	60.4 Å²	60.4	44%	0.439	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	134	-179.6	-60.4	-171.7	174.2	0	0	110.6	L535 H539	L535-E557 HydrophobicContact CB-CG 4.3Å; L535-E557 HydrophobicContact CD1-CG 4.14Å; H539-E557 IonicContact CE1-OE2 3.03Å; H539-E557 IonicContact ND1-OE1 3.34Å; H539-E557 IonicContact ND1-OE2 3.68Å; H539-E557 PolarHBondContact ND1-OE2 2.99Å
558	F	92.7	Very high	89.9	Confident	27 Å²	27	60.1 Å²	60.1	12%	0.118	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	140.8	-179	-60.5	-78.7	0	0	0	111.7	L534 L535 F536 N537 K556 R563 L564 E567	L534-F558 HydrophobicContact CD2-CE2 3.93Å; L535-F558 PolarHBondContact O-N 2.96Å; F536-F558 CarbonylContact C-O 3.59Å; F536-F558 WeakPolarHBondContact CA-O 3.48Å; N537-F558 PolarHBondContact N-O 3.09Å; K556-F558 HydrophobicContact CB-CD2 4.46Å; K556-F558 HydrophobicContact CB-CE2 3.45Å; K556-F558 VanDerWaalsContact CB-CE2 3.45Å; K556-F558 HydrophobicContact CB-CZ 3.7Å; K556-F558 HydrophobicContact CD-CZ 4.23Å; F558-R563 HydrophobicContact CD1-CB 4.05Å; F558-L564 HydrophobicContact CB-CB 4.06Å; F558-L564 HydrophobicContact CB-CD1 4.36Å; F558-L564 HydrophobicContact CD1-CB 4.22Å; F558-L564 HydrophobicContact CD2-CB 3.94Å; F558-L564 HydrophobicContact CD2-CD1 3.95Å; F558-L564 HydrophobicContact CD2-CG 3.94Å; F558-L564 HydrophobicContact CE2-CG 4.39Å; F558-L564 HydrophobicContact CG-CB 3.79Å; F558-L564 HydrophobicContact CG-CD1 4.38Å; F558-L564 HydrophobicContact CG-CG 4.31Å; F558-E567 HydrophobicContact CE1-CB 4.03Å; F558-E567 HydrophobicContact CE1-CG 4.45Å; F558-E567 HydrophobicContact CE2-CG 4.43Å; F558-E567 HydrophobicContact CZ-CB 3.66Å; F558-E567 HydrophobicContact CZ-CG 3.67Å
559	N	88.9	Confident	89.7	Confident	54 Å²	54	63.5 Å²	63.5	29%	0.289	30%	0.3	S	S	.	.	S	Bend	trans	-110.7	-6.6	173.7	-59.1	-1.9	0	0	0	112.3	F158 Q163	F158-N559 HydrophobicContact CB-CB 3.83Å; F158-N559 HydrophobicContact CD1-CB 4.23Å; F158-N559 WeakPolarHBondContact CD1-ND2 3.33Å; F158-N559 HydrophobicContact CD2-CB 4.23Å; F158-N559 WeakPolarHBondContact CE1-ND2 3.43Å; F158-N559 HydrophobicContact CG-CB 3.85Å; Q163-N559 PolarHBondContact NE2-O 3.08Å; Q163-N559 PolarHBondContact OE1-O 2.93Å; Q163-N559 VanDerWaalsContact OE1-O 3.12Å
560	I	88.1	Confident	89.5	Confident	21 Å²	21	60.8 Å²	60.8	11%	0.108	29%	0.287	C	S	.	.	S	Bend	trans	-134.1	127.7	-176.9	-62.7	174.8	0	0	0	108	I161 Y562 R563 L564	I161-I560 HydrophobicContact CD1-CG2 4.16Å; I560-Y562 VanDerWaalsContact C-N 3.3Å; I560-Y562 HydrophobicContact CG2-CD2 3.76Å; I560-Y562 HydrophobicContact CG2-CG 4.47Å; I560-Y562 PolarHBondContact O-N 3.16Å; I560-R563 HydrophobicContact CB-CG 4.34Å; I560-R563 PolarHBondContact O-N 2.94Å; I560-L564 PolarHBondContact O-N 2.81Å
561	I	86.6	Confident	89.3	Confident	2 Å²	2	53.9 Å²	53.9	1%	0.01	26%	0.255	C	S	.	.	H	α-helix	trans	-62.6	-34.2	-172.9	-161.8	170.8	0	0	0	113	A203 F204 A493 I494 L497 F536 L564 A565	A203-I561 HydrophobicContact CB-CD1 4.44Å; F204-I561 HydrophobicContact CE2-CG2 4.5Å; F204-I561 HydrophobicContact CZ-CD1 4.2Å; F204-I561 HydrophobicContact CZ-CG2 4.44Å; A493-I561 HydrophobicContact CB-CD1 4.03Å; I494-I561 HydrophobicContact CG1-CD1 3.79Å; I494-I561 HydrophobicContact CG1-CG1 3.93Å; L497-I561 HydrophobicContact CD1-CD1 4.35Å; L497-I561 HydrophobicContact CD1-CG1 4.28Å; F536-I561 HydrophobicContact CE2-CB 4.08Å; F536-I561 HydrophobicContact CZ-CB 4.45Å; I561-L564 WeakPolarHBondContact O-CB 3.41Å; I561-L564 PolarHBondContact O-N 2.85Å; I561-A565 PolarHBondContact O-N 2.78Å
562	Y	85.8	Confident	89.2	Confident	64 Å²	64	50.7 Å²	50.7	25%	0.251	24%	0.238	S	C	.	.	H	α-helix	trans	-64	-42.3	178.2	-57	-75.3	0	0	0	112.9	I161 H201 I560 L564 A565 E566	I161-Y562 HydrophobicContact CD1-CE2 4.31Å; H201-Y562 AromaticContact CD2-CE1 3.42Å; H201-Y562 VanDerWaalsContact CD2-CE1 3.42Å; H201-Y562 WeakPolarHBondContact CD2-CE1 3.34Å; H201-Y562 AromaticContact CD2-CZ 3.16Å; H201-Y562 PolarHBondContact CD2-OH 3.14Å; H201-Y562 AromaticContact CE1-CE1 3.49Å; H201-Y562 VanDerWaalsContact CE1-CE1 3.49Å; H201-Y562 WeakPolarHBondContact CE1-CE1 3.45Å; H201-Y562 AromaticContact CE1-CZ 3.82Å; H201-Y562 PolarHBondContact CE1-OH 3.49Å; H201-Y562 AromaticContact CG-CZ 3.71Å; H201-Y562 PolarHBondContact ND1-OH 2.93Å; H201-Y562 AromaticContact NE2-CD1 3.88Å; H201-Y562 AromaticContact NE2-CE1 2.95Å; H201-Y562 WeakPolarHBondContact NE2-CE1 3.45Å; H201-Y562 AromaticContact NE2-CZ 3.28Å; H201-Y562 VanDerWaalsContact NE2-CZ 3.28Å; H201-Y562 PolarHBondContact NE2-OH 3.23Å; I560-Y562 VanDerWaalsContact C-N 3.3Å; I560-Y562 HydrophobicContact CG2-CD2 3.76Å; I560-Y562 HydrophobicContact CG2-CG 4.47Å; I560-Y562 PolarHBondContact O-N 3.16Å; Y562-L564 VanDerWaalsContact C-N 3.27Å; Y562-L564 PolarHBondContact O-N 2.83Å; Y562-A565 WeakPolarHBondContact O-CB 3.45Å; Y562-A565 PolarHBondContact O-N 3.12Å; Y562-A565 VanDerWaalsContact O-N 3.09Å; Y562-E566 WeakPolarHBondContact O-CG 3.43Å; Y562-E566 PolarHBondContact O-N 3.01Å
563	R	89.4	Confident	89.1	Confident	154 Å²	154	47 Å²	47	58%	0.581	21%	0.211	S	C	*	.	H	α-helix	trans	-64.4	-36	177.6	-65.8	-175.3	-178.2	171.3	1.7	111.5	F558 I560 A565 E567	F558-R563 HydrophobicContact CD1-CB 4.05Å; I560-R563 HydrophobicContact CB-CG 4.34Å; I560-R563 PolarHBondContact O-N 2.94Å; R563-A565 VanDerWaalsContact C-N 3.34Å; R563-E567 WeakPolarHBondContact O-CB 3.45Å; R563-E567 PolarHBondContact O-N 2.92Å
564	L	89.7	Confident	88.8	Confident	2 Å²	2	52.4 Å²	52.4	1%	0.01	24%	0.235	C	C	.	.	H	α-helix	trans	-63.8	-42.7	173.4	-177.3	155.7	0	0	0	110.6	I494 L534 F536 F558 I560 I561 Y562 E567 V568	I494-L564 HydrophobicContact CD1-CD1 4.12Å; I494-L564 HydrophobicContact CG2-CD2 4.01Å; L534-L564 HydrophobicContact CB-CD1 4.47Å; L534-L564 HydrophobicContact CD1-CD2 4.41Å; F536-L564 HydrophobicContact CB-CD1 4.43Å; F536-L564 HydrophobicContact CD2-CD1 4.23Å; F558-L564 HydrophobicContact CB-CB 4.06Å; F558-L564 HydrophobicContact CB-CD1 4.36Å; F558-L564 HydrophobicContact CD1-CB 4.22Å; F558-L564 HydrophobicContact CD2-CB 3.94Å; F558-L564 HydrophobicContact CD2-CD1 3.95Å; F558-L564 HydrophobicContact CD2-CG 3.94Å; F558-L564 HydrophobicContact CE2-CG 4.39Å; F558-L564 HydrophobicContact CG-CB 3.79Å; F558-L564 HydrophobicContact CG-CD1 4.38Å; F558-L564 HydrophobicContact CG-CG 4.31Å; I560-L564 PolarHBondContact O-N 2.81Å; I561-L564 WeakPolarHBondContact O-CB 3.41Å; I561-L564 PolarHBondContact O-N 2.85Å; Y562-L564 VanDerWaalsContact C-N 3.27Å; Y562-L564 PolarHBondContact O-N 2.83Å; L564-E567 PolarHBondContact O-N 2.73Å; L564-V568 HydrophobicContact CD2-CG2 4.23Å; L564-V568 WeakPolarHBondContact O-CG2 3.42Å; L564-V568 PolarHBondContact O-N 3.04Å
565	A	87.6	Confident	88.6	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-67.8	-41.4	179.6	0	0	0	0	0	112.9	L497 I561 Y562 R563 E567 V568 R569 F754	L497-A565 HydrophobicContact CD1-CB 4.32Å; L497-A565 HydrophobicContact CD2-CB 3.47Å; L497-A565 VanDerWaalsContact CD2-CB 3.47Å; I561-A565 PolarHBondContact O-N 2.78Å; Y562-A565 WeakPolarHBondContact O-CB 3.45Å; Y562-A565 PolarHBondContact O-N 3.12Å; Y562-A565 VanDerWaalsContact O-N 3.09Å; R563-A565 VanDerWaalsContact C-N 3.34Å; A565-E567 VanDerWaalsContact C-N 3.32Å; A565-E567 PolarHBondContact O-N 3.09Å; A565-V568 PolarHBondContact O-N 3.28Å; A565-R569 PolarHBondContact O-N 2.95Å; A565-F754 HydrophobicContact CB-CD1 4.14Å; A565-F754 HydrophobicContact CB-CE1 3.39Å; A565-F754 HydrophobicContact CB-CE2 4.47Å; A565-F754 HydrophobicContact CB-CZ 3.59Å
566	E	87.6	Confident	88.1	Confident	89 Å²	89	50 Å²	50	42%	0.416	22%	0.223	S	C	.	.	H	α-helix	trans	-58.4	-44.5	172.6	-73.6	171.7	170.3	0	0	111.4	Y562 R569 E570 F754	Y562-E566 WeakPolarHBondContact O-CG 3.43Å; Y562-E566 PolarHBondContact O-N 3.01Å; E566-R569 WeakPolarHBondContact O-CB 3.41Å; E566-R569 PolarHBondContact O-N 2.86Å; E566-E570 WeakPolarHBondContact O-CG 3.47Å; E566-E570 PolarHBondContact O-N 3.35Å; E566-F754 HydrophobicContact CG-CE2 4.23Å
567	E	90.5	Very high	87.5	Confident	27 Å²	27	51.2 Å²	51.2	13%	0.126	24%	0.236	C	C	.	.	H	α-helix	trans	-62.3	-44.8	175.6	178	66.8	-126.2	0	0	112.1	K556 F558 R563 L564 A565 R569 E570 L571	K556-E567 HydrophobicContact CD-CG 3.69Å; K556-E567 WeakPolarHBondContact CD-OE2 3.1Å; K556-E567 IonicContact NZ-OE1 3.99Å; K556-E567 PolarHBondContact NZ-OE1 2.93Å; K556-E567 IonicContact NZ-OE2 3.06Å; K556-E567 PolarHBondContact NZ-OE2 3.11Å; F558-E567 HydrophobicContact CE1-CB 4.03Å; F558-E567 HydrophobicContact CE1-CG 4.45Å; F558-E567 HydrophobicContact CE2-CG 4.43Å; F558-E567 HydrophobicContact CZ-CB 3.66Å; F558-E567 HydrophobicContact CZ-CG 3.67Å; R563-E567 WeakPolarHBondContact O-CB 3.45Å; R563-E567 PolarHBondContact O-N 2.92Å; L564-E567 PolarHBondContact O-N 2.73Å; A565-E567 VanDerWaalsContact C-N 3.32Å; A565-E567 PolarHBondContact O-N 3.09Å; E567-R569 PolarHBondContact O-N 3.27Å; E567-E570 WeakPolarHBondContact O-CB 3.43Å; E567-E570 PolarHBondContact O-N 3.34Å; E567-E570 VanDerWaalsContact O-N 3.11Å; E567-L571 HydrophobicContact CG-CD1 4.26Å; E567-L571 HydrophobicContact CG-CG 4.47Å; E567-L571 WeakPolarHBondContact O-CG 3.49Å; E567-L571 PolarHBondContact O-N 3.26Å
568	V	89.4	Confident	86.7	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-61.2	-38.8	177.4	173.1	0	0	0	0	110.5	L479 L481 L498 I508 L534 L564 A565 E570 L571 V572	L479-V568 HydrophobicContact CD2-CG1 4.47Å; L481-V568 HydrophobicContact CD1-CG1 4.2Å; L481-V568 HydrophobicContact CD1-CG2 4.23Å; L498-V568 HydrophobicContact CD2-CB 4.05Å; L498-V568 HydrophobicContact CD2-CG1 3.81Å; L498-V568 HydrophobicContact CD2-CG2 4.12Å; I508-V568 HydrophobicContact CD1-CG1 4.17Å; L534-V568 HydrophobicContact CD1-CG2 3.57Å; L564-V568 HydrophobicContact CD2-CG2 4.23Å; L564-V568 WeakPolarHBondContact O-CG2 3.42Å; L564-V568 PolarHBondContact O-N 3.04Å; A565-V568 PolarHBondContact O-N 3.28Å; V568-E570 VanDerWaalsContact C-N 3.35Å; V568-E570 PolarHBondContact O-N 2.82Å; V568-L571 PolarHBondContact O-N 3.04Å; V568-V572 HydrophobicContact CG1-CG2 4.45Å; V568-V572 VanDerWaalsContact O-CG2 3.28Å; V568-V572 WeakPolarHBondContact O-CG2 3.2Å; V568-V572 PolarHBondContact O-N 3.02Å
569	R	87.6	Confident	86	Confident	76 Å²	76	52.2 Å²	52.2	29%	0.287	25%	0.254	S	S	.	.	H	α-helix	trans	-60.4	-43.7	173.5	-174.1	-174.9	65.1	127.6	-0.8	111.6	A565 E566 E567 V572 N573 W752	A565-R569 PolarHBondContact O-N 2.95Å; E566-R569 WeakPolarHBondContact O-CB 3.41Å; E566-R569 PolarHBondContact O-N 2.86Å; E567-R569 PolarHBondContact O-N 3.27Å; R569-V572 PolarHBondContact O-N 3.25Å; R569-N573 PolarHBondContact O-N 3.42Å; R569-N573 PolarHBondContact O-ND2 3.12Å; R569-W752 HydrophobicContact CB-CE3 4.16Å; R569-W752 HydrophobicContact CG-CE3 4.44Å
570	E	88	Confident	85.6	Confident	97 Å²	97	54.7 Å²	54.7	45%	0.453	27%	0.266	S	S	.	.	H	α-helix	trans	-62.1	-45.2	175.3	-71.9	178.8	-172.5	0	0	112.2	E566 E567 V568 V572 N573 E574	E566-E570 WeakPolarHBondContact O-CG 3.47Å; E566-E570 PolarHBondContact O-N 3.35Å; E567-E570 WeakPolarHBondContact O-CB 3.43Å; E567-E570 PolarHBondContact O-N 3.34Å; E567-E570 VanDerWaalsContact O-N 3.11Å; V568-E570 VanDerWaalsContact C-N 3.35Å; V568-E570 PolarHBondContact O-N 2.82Å; E570-V572 VanDerWaalsContact C-N 3.28Å; E570-V572 PolarHBondContact O-N 2.93Å; E570-N573 WeakPolarHBondContact O-CB 2.95Å; E570-N573 PolarHBondContact O-N 3.43Å; E570-N573 VanDerWaalsContact O-N 3.13Å; E570-E574 WeakPolarHBondContact O-CG 3.41Å; E570-E574 PolarHBondContact O-N 3.47Å
571	L	88.3	Confident	85.4	Confident	3 Å²	3	55.8 Å²	55.8	2%	0.016	27%	0.274	C	S	.	.	H	α-helix	trans	-62.3	-35.1	176.4	-69.3	172.9	0	0	0	112.9	L479 N532 E567 V568 K575	L479-L571 HydrophobicContact CD2-CB 4.07Å; N532-L571 HydrophobicContact CB-CD1 4.32Å; E567-L571 HydrophobicContact CG-CD1 4.26Å; E567-L571 HydrophobicContact CG-CG 4.47Å; E567-L571 WeakPolarHBondContact O-CG 3.49Å; E567-L571 PolarHBondContact O-N 3.26Å; V568-L571 PolarHBondContact O-N 3.04Å; L571-K575 WeakPolarHBondContact O-CG 3.34Å; L571-K575 PolarHBondContact O-N 3.07Å
572	V	87.1	Confident	85.3	Confident	1 Å²	1	59.2 Å²	59.2	1%	0.006	29%	0.29	C	S	.	.	H	α-helix	trans	-67.5	-47.1	173	173.5	0	0	0	0	109.9	L479 Y501 C506 V568 R569 E570 E574 K575 L576	L479-V572 HydrophobicContact CD2-CG2 3.62Å; Y501-V572 HydrophobicContact CE1-CG1 4.47Å; Y501-V572 VanDerWaalsContact OH-CG1 3.27Å; Y501-V572 WeakPolarHBondContact OH-CG1 3.3Å; C506-V572 HydrophobicContact CB-CG1 3.72Å; V568-V572 HydrophobicContact CG1-CG2 4.45Å; V568-V572 VanDerWaalsContact O-CG2 3.28Å; V568-V572 WeakPolarHBondContact O-CG2 3.2Å; V568-V572 PolarHBondContact O-N 3.02Å; R569-V572 PolarHBondContact O-N 3.25Å; E570-V572 VanDerWaalsContact C-N 3.28Å; E570-V572 PolarHBondContact O-N 2.93Å; V572-E574 VanDerWaalsContact C-N 3.26Å; V572-E574 PolarHBondContact O-N 3.29Å; V572-K575 PolarHBondContact O-N 2.68Å; V572-L576 HydrophobicContact CG1-CD1 4.08Å; V572-L576 HydrophobicContact CG1-CG 4.17Å; V572-L576 WeakPolarHBondContact O-CG 3.02Å; V572-L576 PolarHBondContact O-N 3.44Å
573	N	85.8	Confident	85.3	Confident	39 Å²	39	59 Å²	59	21%	0.209	29%	0.29	C	S	.	.	H	α-helix	trans	-59.5	-35.3	177.4	-67.9	-22.2	0	0	0	112.5	R569 E570 K575 V750	R569-N573 PolarHBondContact O-N 3.42Å; R569-N573 PolarHBondContact O-ND2 3.12Å; E570-N573 WeakPolarHBondContact O-CB 2.95Å; E570-N573 PolarHBondContact O-N 3.43Å; E570-N573 VanDerWaalsContact O-N 3.13Å; N573-K575 VanDerWaalsContact C-N 3.31Å; N573-K575 PolarHBondContact O-N 2.88Å; N573-V750 PolarHBondContact OD1-N 3.02Å
574	E	85	Confident	85.1	Confident	135 Å²	135	55.5 Å²	55.5	63%	0.631	28%	0.282	S	S	*	.	H	α-helix	trans	-66	-31.7	173.3	-73.4	-174.3	170.1	0	0	113.4	E570 V572	E570-E574 WeakPolarHBondContact O-CG 3.41Å; E570-E574 PolarHBondContact O-N 3.47Å; V572-E574 VanDerWaalsContact C-N 3.26Å; V572-E574 PolarHBondContact O-N 3.29Å
575	K	84	Confident	84.9	Confident	97 Å²	97	56 Å²	56	42%	0.422	29%	0.285	S	S	.	.	H	α-helix	trans	-86.3	-21.4	-177.8	-77.1	-97.6	-176.1	167.3	0	113.2	I477 L479 L571 V572 N573	I477-K575 HydrophobicContact CG2-CB 4.23Å; L479-K575 HydrophobicContact CD1-CG 4.26Å; L571-K575 WeakPolarHBondContact O-CG 3.34Å; L571-K575 PolarHBondContact O-N 3.07Å; V572-K575 PolarHBondContact O-N 2.68Å; N573-K575 VanDerWaalsContact C-N 3.31Å; N573-K575 PolarHBondContact O-N 2.88Å
576	L	82.5	Confident	84.9	Confident	13 Å²	13	56.1 Å²	56.1	7%	0.068	29%	0.286	C	S	.	.	S	Bend	trans	-69.5	142.6	-178.8	-73.4	171.9	0	0	0	111.1	Q505 C506 V572 S748 V750	Q505-L576 HydrophobicContact CB-CD2 3.56Å; C506-L576 HydrophobicContact CB-CD2 4.16Å; V572-L576 HydrophobicContact CG1-CD1 4.08Å; V572-L576 HydrophobicContact CG1-CG 4.17Å; V572-L576 WeakPolarHBondContact O-CG 3.02Å; V572-L576 PolarHBondContact O-N 3.44Å; L576-S748 VanDerWaalsContact CB-OG 3.24Å; L576-S748 WeakPolarHBondContact CB-OG 3.34Å; L576-V750 HydrophobicContact CD1-CG2 3.59Å
577	P	78.6	Confident	85	Confident	80 Å²	80	53.7 Å²	53.7	52%	0.519	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-68.8	140	175.7	29.7	-31.1	0	0	0	108.9	I477 V579 S748	I477-P577 VanDerWaalsContact CD1-CD 3.49Å; I477-P577 HydrophobicContact CD1-CG 4.14Å; P577-V579 PolarHBondContact O-N 2.83Å; P577-S748 PolarHBondContact O-OG 3.24Å
578	S	77.2	Confident	85	Confident	63 Å²	63	52.4 Å²	52.4	44%	0.441	27%	0.269	S	S	.	.	P	Polyproline II helix	trans	-60	133.8	172.6	55.4	0	0	0	0	110.1	E746	S578-E746 CarbonylContact C-O 3.5Å; S578-E746 VanDerWaalsContact CA-O 3.29Å; S578-E746 WeakPolarHBondContact CA-O 3.22Å; S578-E746 WeakPolarHBondContact CB-O 3.43Å
579	V	78.7	Confident	85.1	Confident	80 Å²	80	55.9 Å²	55.9	49%	0.485	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	126.3	174.8	177.2	0	0	0	0	107.9	P577 V581 E746	P577-V579 PolarHBondContact O-N 2.83Å; V579-V581 HydrophobicContact CG1-CG2 4.07Å; V579-V581 PolarHBondContact O-N 3.47Å; V579-E746 PolarHBondContact N-O 2.86Å; V579-E746 PolarHBondContact O-N 3.08Å
580	L	80.4	Confident	85.3	Confident	105 Å²	105	52.3 Å²	52.3	55%	0.55	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	106.9	176.4	-67.3	178.6	0	0	0	108.9	T743 I744	L580-T743 HydrophobicContact CB-CG2 3.6Å; L580-T743 HydrophobicContact CD1-CG2 4.21Å; L580-T743 HydrophobicContact CD2-CG2 3.88Å; L580-T743 HydrophobicContact CG-CG2 4.09Å; L580-I744 WeakPolarHBondContact CA-O 3.41Å
581	V	83.5	Confident	85.4	Confident	44 Å²	44	51.2 Å²	51.2	27%	0.267	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	125.7	179.5	179.9	0	0	0	0	109.6	V579 K583 I744 E746	V579-V581 HydrophobicContact CG1-CG2 4.07Å; V579-V581 PolarHBondContact O-N 3.47Å; V581-K583 HydrophobicContact CG1-CG 4.32Å; V581-I744 PolarHBondContact N-O 2.78Å; V581-I744 PolarHBondContact O-N 3.33Å; V581-E746 HydrophobicContact CB-CG 4.41Å; V581-E746 HydrophobicContact CG2-CB 4.24Å; V581-E746 HydrophobicContact CG2-CG 4.16Å; V581-E746 WeakPolarHBondContact CG2-OE2 3.1Å
582	E	85.5	Confident	85.5	Confident	75 Å²	75	56.5 Å²	56.5	35%	0.35	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	114.4	174.5	-63.8	-175.2	178.4	0	0	109.8	R646 R682 Y741	E582-R646 IonicContact OE2-NH1 3.63Å; E582-R646 PolarHBondContact OE2-NH1 3.15Å; E582-R646 VanDerWaalsContact OE2-NH1 3.15Å; E582-R682 IonicContact OE1-NH2 3.71Å; E582-R682 PolarHBondContact OE1-NH2 3.14Å; E582-Y741 HydrophobicContact CB-CD2 3.9Å; E582-Y741 HydrophobicContact CB-CE2 4.44Å; E582-Y741 HydrophobicContact CG-CD2 3.77Å; E582-Y741 HydrophobicContact CG-CE2 3.8Å
583	K	84.4	Confident	85.5	Confident	60 Å²	60	59.9 Å²	59.9	26%	0.261	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	124.6	171	-62.8	-165	-166.9	172.9	0	110.7	V581 I585 V636 Y741 V742 I744 E746	V581-K583 HydrophobicContact CG1-CG 4.32Å; K583-I585 PolarHBondContact O-N 3.33Å; K583-V636 HydrophobicContact CD-CB 4.49Å; K583-V636 HydrophobicContact CD-CG1 3.9Å; K583-V636 HydrophobicContact CD-CG2 3.77Å; K583-Y741 CarbonylContact O-C 3.52Å; K583-Y741 VanDerWaalsContact O-CA 3.25Å; K583-Y741 WeakPolarHBondContact O-CA 3.32Å; K583-Y741 WeakPolarHBondContact O-CB 3.41Å; K583-V742 PolarHBondContact N-O 2.96Å; K583-V742 PolarHBondContact O-N 3.5Å; K583-I744 HydrophobicContact CB-CD1 4.18Å; K583-I744 HydrophobicContact CD-CD1 3.69Å; K583-I744 HydrophobicContact CG-CD1 4Å; K583-E746 WeakPolarHBondContact CE-OE1 3.49Å; K583-E746 IonicContact NZ-OE1 2.84Å; K583-E746 PolarHBondContact NZ-OE1 3.13Å
584	I	86	Confident	85.6	Confident	79 Å²	79	62.4 Å²	62.4	41%	0.405	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	118.8	-178.9	-55.2	171.3	0	0	0	108.9	E587 C740	I584-E587 HydrophobicContact CG2-CG 4.27Å; I584-C740 CarbonylContact C-O 3.57Å
585	I	85.6	Confident	85.6	Confident	13 Å²	13	61.1 Å²	61.1	7%	0.067	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	-36.4	177.3	-59.5	-168.3	0	0	0	111	K583 G618 N619 I621 I627 I630 C740 V742	K583-I585 PolarHBondContact O-N 3.33Å; I585-G618 VanDerWaalsContact O-CA 3.25Å; I585-G618 WeakPolarHBondContact O-CA 3.47Å; I585-N619 HydrophobicContact CG2-CB 4.36Å; I585-N619 WeakPolarHBondContact CG2-O 3.31Å; I585-N619 PolarHBondContact O-N 2.82Å; I585-I621 HydrophobicContact CD1-CD1 4.03Å; I585-I621 HydrophobicContact CG2-CD1 3.91Å; I585-I627 HydrophobicContact CD1-CG2 4.25Å; I585-I630 HydrophobicContact CG2-CG2 4.35Å; I585-C740 PolarHBondContact N-O 3.08Å; I585-V742 HydrophobicContact CD1-CB 3.95Å; I585-V742 HydrophobicContact CD1-CG2 3.21Å; I585-V742 HydrophobicContact CG1-CB 4.38Å; I585-V742 HydrophobicContact CG1-CG2 4.01Å
586	G	86.6	Confident	85.5	Confident	3 Å²	3	60.9 Å²	60.9	3%	0.031	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.9	163.9	-176.3	0	0	0	0	0	114.7	K617 C740	G586-K617 CarbonylContact C-O 3.59Å; G586-K617 WeakPolarHBondContact CA-O 3.27Å; G586-C740 PolarHBondContact N-O 2.75Å; G586-C740 PolarHBondContact O-N 3.05Å
587	E	90.4	Very high	85.3	Confident	37 Å²	37	69.1 Å²	69.1	17%	0.173	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	130.9	-178.2	-51.1	-172.3	133.6	0	0	109.6	I584 C615 I616 K617 I737 I738 Q739	I584-E587 HydrophobicContact CG2-CG 4.27Å; E587-C615 CarbonylContact O-C 3.59Å; E587-I616 PolarHBondContact O-N 2.96Å; E587-K617 HydrophobicContact CB-CB 4.38Å; E587-K617 HydrophobicContact CG-CB 4.43Å; E587-K617 PolarHBondContact N-O 2.95Å; E587-K617 PolarHBondContact O-N 2.89Å; E587-K617 IonicContact OE2-NZ 3.93Å; E587-I737 HydrophobicContact CB-CG2 4.18Å; E587-I738 CarbonylContact C-O 3.55Å; E587-I738 WeakPolarHBondContact CA-O 3.46Å; E587-Q739 HydrophobicContact CG-CG 4.13Å; E587-Q739 PolarHBondContact OE1-NE2 2.83Å
588	A	90.7	Very high	85	Confident	0 Å²	0	66.7 Å²	66.7	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	139.3	174.1	0	0	0	0	0	110.5	C613 R614 I620 I737 I738	A588-C613 HydrophobicContact CB-CB 3.83Å; A588-R614 CarbonylContact C-O 3.56Å; A588-R614 VanDerWaalsContact CA-O 3.31Å; A588-R614 WeakPolarHBondContact CA-O 3.36Å; A588-I620 HydrophobicContact CB-CD1 3.25Å; A588-I737 CarbonylContact O-C 3.56Å; A588-I737 WeakPolarHBondContact O-CA 3.41Å; A588-I738 HydrophobicContact CB-CB 4.25Å; A588-I738 PolarHBondContact N-O 2.94Å; A588-I738 PolarHBondContact O-N 2.84Å
589	E	91.7	Very high	84.3	Confident	74 Å²	74	67.7 Å²	67.7	35%	0.346	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	134.7	170	176.1	179.8	-169.7	0	0	110.4	L591 C613 R614 I616	E589-L591 PolarHBondContact O-N 3.04Å; E589-C613 CarbonylContact O-C 3.57Å; E589-C613 WeakPolarHBondContact O-CA 3.38Å; E589-C613 WeakPolarHBondContact O-CB 3.47Å; E589-R614 PolarHBondContact N-O 3.3Å; E589-R614 PolarHBondContact O-N 3.06Å; E589-I616 HydrophobicContact CB-CD1 3.52Å; E589-I616 HydrophobicContact CB-CG1 4.09Å
590	I	90.7	Very high	83.5	Confident	0 Å²	0	72.7 Å²	72.7	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	115.7	177.6	-63.4	163.9	0	0	0	109.2	L593 A611 W732 G735 D736 I738	I590-L593 HydrophobicContact CG2-CD2 3.81Å; I590-L593 HydrophobicContact CG2-CG 4.36Å; I590-A611 HydrophobicContact CG1-CB 4.22Å; I590-A611 HydrophobicContact CG2-CB 4.34Å; I590-W732 HydrophobicContact CD1-CB 4.33Å; I590-G735 PolarHBondContact O-N 2.99Å; I590-D736 HydrophobicContact CD1-CB 3.89Å; I590-D736 WeakPolarHBondContact CG1-O 3.33Å; I590-D736 PolarHBondContact N-O 3.15Å; I590-I738 HydrophobicContact CD1-CD1 3.91Å; I590-I738 HydrophobicContact CD1-CG1 3.83Å; I590-I738 HydrophobicContact CG1-CD1 3.81Å; I590-I738 HydrophobicContact CG1-CG1 3.95Å
591	L	90.5	Very high	82.4	Confident	75 Å²	75	71.5 Å²	71.5	39%	0.393	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	-44.1	178.1	-61.3	179.5	0	0	0	111.9	E589 G612 R614 V734	E589-L591 PolarHBondContact O-N 3.04Å; L591-G612 PolarHBondContact N-O 3Å; L591-R614 HydrophobicContact CD1-CB 3.79Å; L591-R614 HydrophobicContact CG-CB 4.31Å; L591-V734 VanDerWaalsContact O-CG1 3.29Å; L591-V734 WeakPolarHBondContact O-CG1 3.42Å
592	Q	89.9	Confident	81.3	Confident	113 Å²	113	71.6 Å²	71.6	53%	0.528	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	145.5	-174.7	-170.3	170.8	4.1	0	0	111.5	F594 G612	Q592-F594 HydrophobicContact CB-CE2 4.07Å; Q592-F594 HydrophobicContact CB-CZ 4.18Å; Q592-F594 HydrophobicContact CG-CE1 4.26Å; Q592-F594 HydrophobicContact CG-CE2 4.09Å; Q592-F594 HydrophobicContact CG-CZ 3.85Å; Q592-G612 PolarHBondContact N-O 3.24Å; Q592-G612 VanDerWaalsContact N-O 3.1Å; Q592-G612 WeakPolarHBondContact O-CA 3.17Å; Q592-G612 PolarHBondContact O-N 3Å
593	L	88.2	Confident	80	Confident	73 Å²	73	68 Å²	68	38%	0.382	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	129.6	178.4	-60.8	169.1	0	0	0	109.7	I590 A611 W732	I590-L593 HydrophobicContact CG2-CD2 3.81Å; I590-L593 HydrophobicContact CG2-CG 4.36Å; L593-A611 HydrophobicContact CD2-CB 4.39Å; L593-W732 HydrophobicContact CD1-CB 4.28Å; L593-W732 VanDerWaalsContact CD1-O 3.23Å; L593-W732 WeakPolarHBondContact CD1-O 3.24Å; L593-W732 HydrophobicContact CD2-CB 3.5Å; L593-W732 VanDerWaalsContact CD2-CB 3.5Å; L593-W732 HydrophobicContact CD2-CD2 4.3Å; L593-W732 HydrophobicContact CD2-CE3 3.7Å; L593-W732 HydrophobicContact CD2-CG 4.3Å
594	F	87.5	Confident	78.7	Confident	92 Å²	92	72.8 Å²	72.8	40%	0.404	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	153.7	177.8	-61.1	-81.2	0	0	0	110.7	Q592 P609 V610	Q592-F594 HydrophobicContact CB-CE2 4.07Å; Q592-F594 HydrophobicContact CB-CZ 4.18Å; Q592-F594 HydrophobicContact CG-CE1 4.26Å; Q592-F594 HydrophobicContact CG-CE2 4.09Å; Q592-F594 HydrophobicContact CG-CZ 3.85Å; F594-P609 WeakPolarHBondContact O-CA 3.49Å; F594-V610 HydrophobicContact CB-CB 4.24Å; F594-V610 PolarHBondContact N-O 3.39Å; F594-V610 PolarHBondContact O-N 2.93Å
595	T	84.2	Confident	77.4	Confident	107 Å²	107	73.6 Å²	73.6	66%	0.656	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.9	110.6	169.5	48.5	0	0	0	0	108.6	L608	T595-L608 WeakPolarHBondContact CA-O 3.26Å
596	I	83.6	Confident	76.4	Confident	93 Å²	93	73.7 Å²	73.7	48%	0.477	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	137.6	-176.6	-55.8	-176.8	0	0	0	108.9	A598 L608 V610	I596-A598 PolarHBondContact O-N 2.83Å; I596-L608 PolarHBondContact N-O 2.78Å; I596-L608 PolarHBondContact O-N 3.09Å; I596-V610 HydrophobicContact CB-CG2 4.4Å; I596-V610 HydrophobicContact CD1-CB 4.35Å; I596-V610 HydrophobicContact CD1-CG2 3.62Å; I596-V610 HydrophobicContact CG1-CG2 3.82Å
597	K	78.6	Confident	75.7	Confident	186 Å²	186	78 Å²	78	81%	0.809	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.6	110.5	171.6	-69.9	-177.8	-179.4	177	0	109.4	G606 L607	K597-G606 WeakPolarHBondContact CA-O 3.41Å; K597-L607 HydrophobicContact CG-CD2 4.46Å
598	A	70.3	Confident	75.2	Confident	28 Å²	28	77.1 Å²	77.1	23%	0.231	40%	0.404	C	S	.	.			trans	-100	157.2	175.7	0	0	0	0	0	110.6	I596 K600 V603 G606 L608	I596-A598 PolarHBondContact O-N 2.83Å; A598-K600 PolarHBondContact O-N 3.44Å; A598-V603 HydrophobicContact CB-CG2 4.42Å; A598-G606 PolarHBondContact N-O 2.95Å; A598-L608 HydrophobicContact CB-CB 4.04Å
599	S	63.9	Low	74.8	Confident	84 Å²	84	78.4 Å²	78.4	59%	0.587	41%	0.412	S	S	*	.			trans	-56.4	140.7	173.7	-179.6	0	0	0	0	110.3	S601 V602 V603	S599-S601 PolarHBondContact O-N 2.99Å; S599-V602 PolarHBondContact O-N 2.9Å; S599-V603 PolarHBondContact O-N 2.76Å
600	K	61.1	Low	74.6	Confident	186 Å²	186	75.5 Å²	75.5	81%	0.809	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-19.1	176.9	-71.1	-176.2	178.5	178.9	0	113.1	A598 V602	A598-K600 PolarHBondContact O-N 3.44Å; K600-V602 VanDerWaalsContact C-N 3.29Å; K600-V602 PolarHBondContact O-N 2.79Å
601	S	57.8	Low	74.5	Confident	79 Å²	79	75.6 Å²	75.6	55%	0.552	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-24.3	173.6	-172.3	0	0	0	0	113.9	S599 N722	S599-S601 PolarHBondContact O-N 2.99Å; S601-N722 PolarHBondContact O-OD1 3.06Å
602	V	60	Low	74.5	Confident	46 Å²	46	72.7 Å²	72.7	28%	0.279	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	-39.4	-174.2	-178	0	0	0	0	111.2	S599 K600 Y686	S599-V602 PolarHBondContact O-N 2.9Å; K600-V602 VanDerWaalsContact C-N 3.29Å; K600-V602 PolarHBondContact O-N 2.79Å; V602-Y686 HydrophobicContact CG1-CE1 4.3Å; V602-Y686 VanDerWaalsContact CG1-OH 3.31Å; V602-Y686 WeakPolarHBondContact CG1-OH 3.35Å
603	V	59.3	Low	74.6	Confident	1 Å²	1	67.4 Å²	67.4	1%	0.006	36%	0.364	C	S	.	.			trans	-134.9	122.5	179.4	-168.1	0	0	0	0	109.4	A598 S599 T605 G606 L608 A725 F728	A598-V603 HydrophobicContact CB-CG2 4.42Å; S599-V603 PolarHBondContact O-N 2.76Å; V603-T605 VanDerWaalsContact CG1-OG1 3.23Å; V603-T605 WeakPolarHBondContact CG1-OG1 3.21Å; V603-T605 PolarHBondContact O-N 2.94Å; V603-T605 VanDerWaalsContact O-N 3.17Å; V603-G606 PolarHBondContact O-N 3.49Å; V603-L608 HydrophobicContact CG2-CB 4.48Å; V603-L608 HydrophobicContact CG2-CD1 3.58Å; V603-A725 HydrophobicContact CG1-CB 3.89Å; V603-F728 HydrophobicContact CG1-CD2 4.46Å; V603-F728 HydrophobicContact CG1-CE2 4.38Å; V603-F728 HydrophobicContact CG2-CD2 4.48Å; V603-F728 HydrophobicContact CG2-CE2 3.82Å; V603-F728 HydrophobicContact CG2-CZ 4.08Å
604	K	55.6	Low	74.7	Confident	159 Å²	159	69.5 Å²	69.5	69%	0.691	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-30.3	179.5	-75.3	-177.2	178.2	174.3	0	113.7	A725	K604-A725 HydrophobicContact CB-CB 4.36Å
605	T	60.2	Low	74.9	Confident	96 Å²	96	65.2 Å²	65.2	59%	0.589	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-10.6	178.3	52.8	0	0	0	0	113.4	V603 L607 A725	V603-T605 VanDerWaalsContact CG1-OG1 3.23Å; V603-T605 WeakPolarHBondContact CG1-OG1 3.21Å; V603-T605 PolarHBondContact O-N 2.94Å; V603-T605 VanDerWaalsContact O-N 3.17Å; T605-L607 PolarHBondContact O-N 3.19Å; T605-A725 HydrophobicContact CG2-CB 3.86Å
606	G	64	Low	75.1	Confident	16 Å²	16	63 Å²	63	17%	0.165	33%	0.332	C	S	.	.	S	Bend	trans	72.3	-0.3	-179.3	0	0	0	0	0	115.7	K597 A598 V603	K597-G606 WeakPolarHBondContact CA-O 3.41Å; A598-G606 PolarHBondContact N-O 2.95Å; V603-G606 PolarHBondContact O-N 3.49Å
607	L	72.4	Confident	75.3	Confident	92 Å²	92	64.4 Å²	64.4	48%	0.482	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	118.4	-179.2	-69.1	159.9	0	0	0	109.3	K597 T605	K597-L607 HydrophobicContact CG-CD2 4.46Å; T605-L607 PolarHBondContact O-N 3.19Å
608	L	78.6	Confident	75.6	Confident	20 Å²	20	57.1 Å²	57.1	11%	0.105	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	119.6	177.9	-169.4	79	0	0	0	109.5	T595 I596 A598 V603 V610 V707 F728	T595-L608 WeakPolarHBondContact CA-O 3.26Å; I596-L608 PolarHBondContact N-O 2.78Å; I596-L608 PolarHBondContact O-N 3.09Å; A598-L608 HydrophobicContact CB-CB 4.04Å; V603-L608 HydrophobicContact CG2-CB 4.48Å; V603-L608 HydrophobicContact CG2-CD1 3.58Å; L608-V610 HydrophobicContact CD2-CG2 4.32Å; L608-V707 HydrophobicContact CD1-CG1 4.01Å; L608-V707 HydrophobicContact CD2-CG1 4.12Å; L608-V707 HydrophobicContact CD2-CG2 3.99Å; L608-V707 HydrophobicContact CG-CG1 4.07Å; L608-F728 HydrophobicContact CD1-CD1 4.02Å; L608-F728 HydrophobicContact CD1-CE1 3.6Å; L608-F728 HydrophobicContact CD1-CZ 3.88Å
609	P	83.7	Confident	76.3	Confident	26 Å²	26	57.8 Å²	57.8	17%	0.169	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	131.6	172.8	29.8	-32.1	0	0	0	110.2	F594 F728 W732	F594-P609 WeakPolarHBondContact O-CA 3.49Å; P609-F728 HydrophobicContact CG-CB 4.17Å; P609-W732 HydrophobicContact CB-CH2 4.34Å; P609-W732 HydrophobicContact CB-CZ3 4.03Å
610	V	87.1	Confident	77.4	Confident	14 Å²	14	53.8 Å²	53.8	9%	0.085	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	126.4	178.1	-173.7	0	0	0	0	109.3	F594 I596 L608 V707	F594-V610 HydrophobicContact CB-CB 4.24Å; F594-V610 PolarHBondContact N-O 3.39Å; F594-V610 PolarHBondContact O-N 2.93Å; I596-V610 HydrophobicContact CB-CG2 4.4Å; I596-V610 HydrophobicContact CD1-CB 4.35Å; I596-V610 HydrophobicContact CD1-CG2 3.62Å; I596-V610 HydrophobicContact CG1-CG2 3.82Å; L608-V610 HydrophobicContact CD2-CG2 4.32Å; V610-V707 HydrophobicContact CB-CG2 4.28Å; V610-V707 HydrophobicContact CG1-CG2 4.11Å; V610-V707 HydrophobicContact CG2-CG2 3.77Å
611	A	87.5	Confident	78.5	Confident	1 Å²	1	45 Å²	45	1%	0.008	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	116.5	177.4	0	0	0	0	0	109.1	I590 L593 C613 G705 I706 W732	I590-A611 HydrophobicContact CG1-CB 4.22Å; I590-A611 HydrophobicContact CG2-CB 4.34Å; L593-A611 HydrophobicContact CD2-CB 4.39Å; A611-C613 VanDerWaalsContact CB-SG 3.51Å; A611-C613 PolarHBondContact O-N 3.28Å; A611-C613 PolarHBondContact O-SG 3.1Å; A611-C613 VanDerWaalsContact O-SG 3.34Å; A611-G705 CarbonylContact O-C 3.46Å; A611-G705 WeakPolarHBondContact O-CA 3.43Å; A611-I706 PolarHBondContact N-O 2.86Å; A611-I706 PolarHBondContact O-N 2.97Å; A611-W732 HydrophobicContact CB-CD2 4.29Å; A611-W732 HydrophobicContact CB-CE3 3.55Å; A611-W732 HydrophobicContact CB-CH2 4.35Å; A611-W732 HydrophobicContact CB-CZ3 3.6Å
612	G	91.6	Very high	79.3	Confident	15 Å²	15	42.7 Å²	42.7	16%	0.155	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	108.3	164.8	0	0	0	0	0	109.2	L591 Q592 C704	L591-G612 PolarHBondContact N-O 3Å; Q592-G612 PolarHBondContact N-O 3.24Å; Q592-G612 VanDerWaalsContact N-O 3.1Å; Q592-G612 WeakPolarHBondContact O-CA 3.17Å; Q592-G612 PolarHBondContact O-N 3Å; G612-C704 CarbonylContact C-O 3.58Å; G612-C704 WeakPolarHBondContact CA-O 3.43Å
613	C	90.7	Very high	79.9	Confident	2 Å²	2	43.1 Å²	43.1	1%	0.014	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	158	-175	-43.6	0	0	0	0	110.9	A588 E589 A611 D703 C704 I738	A588-C613 HydrophobicContact CB-CB 3.83Å; E589-C613 CarbonylContact O-C 3.57Å; E589-C613 WeakPolarHBondContact O-CA 3.38Å; E589-C613 WeakPolarHBondContact O-CB 3.47Å; A611-C613 VanDerWaalsContact CB-SG 3.51Å; A611-C613 PolarHBondContact O-N 3.28Å; A611-C613 PolarHBondContact O-SG 3.1Å; A611-C613 VanDerWaalsContact O-SG 3.34Å; C613-D703 CarbonylContact O-C 3.6Å; C613-D703 WeakPolarHBondContact O-CA 3.32Å; C613-C704 PolarHBondContact N-O 3.13Å; C613-C704 PolarHBondContact O-N 3.48Å; C613-C704 PolarHBondContact O-SG 3.33Å; C613-I738 VanDerWaalsContact SG-CD1 3.53Å
614	R	91.9	Very high	80.2	Confident	116 Å²	116	45.8 Å²	45.8	44%	0.438	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	127.9	169.7	177.1	171.7	-69.6	174.7	-0.4	109.6	A588 E589 L591 I616 D703	A588-R614 CarbonylContact C-O 3.56Å; A588-R614 VanDerWaalsContact CA-O 3.31Å; A588-R614 WeakPolarHBondContact CA-O 3.36Å; E589-R614 PolarHBondContact N-O 3.3Å; E589-R614 PolarHBondContact O-N 3.06Å; L591-R614 HydrophobicContact CD1-CB 3.79Å; L591-R614 HydrophobicContact CG-CB 4.31Å; R614-I616 PolarHBondContact O-N 2.84Å; R614-D703 WeakPolarHBondContact CB-OD1 3.46Å; R614-D703 WeakPolarHBondContact CG-OD1 3.39Å; R614-D703 IonicContact CZ-OD1 3.39Å; R614-D703 IonicContact CZ-OD2 3.89Å; R614-D703 IonicContact NE-OD1 3.57Å; R614-D703 PolarHBondContact NE-OD1 2.7Å; R614-D703 IonicContact NE-OD2 3.67Å; R614-D703 IonicContact NH2-OD1 3.19Å; R614-D703 PolarHBondContact NH2-OD1 3.47Å; R614-D703 IonicContact NH2-OD2 2.95Å; R614-D703 PolarHBondContact NH2-OD2 3.21Å
615	C	90.7	Very high	80.7	Confident	2 Å²	2	44.9 Å²	44.9	1%	0.014	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	115	176.2	-62.3	0	0	0	0	110.7	E587 I620 I698 R699 G701 V702	E587-C615 CarbonylContact O-C 3.59Å; C615-I620 WeakPolarHBondContact SG-CD1 3.3Å; C615-I698 WeakPolarHBondContact SG-CG2 3.46Å; C615-R699 WeakPolarHBondContact CB-O 3.41Å; C615-G701 PolarHBondContact O-N 2.9Å; C615-V702 PolarHBondContact N-O 2.95Å
616	I	89.1	Confident	80.8	Confident	62 Å²	62	45.2 Å²	45.2	32%	0.318	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	-45.4	176.8	-56.7	175.6	0	0	0	110.4	E587 E589 R614 K700	E587-I616 PolarHBondContact O-N 2.96Å; E589-I616 HydrophobicContact CB-CD1 3.52Å; E589-I616 HydrophobicContact CB-CG1 4.09Å; R614-I616 PolarHBondContact O-N 2.84Å; I616-K700 VanDerWaalsContact O-CD 3.25Å; I616-K700 WeakPolarHBondContact O-CD 3.49Å; I616-K700 WeakPolarHBondContact O-CE 3.32Å; I616-K700 VanDerWaalsContact O-CG 3.32Å; I616-K700 WeakPolarHBondContact O-CG 3.37Å
617	K	87.4	Confident	80.9	Confident	122 Å²	122	44.5 Å²	44.5	53%	0.53	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	147.7	-175.9	-65.1	-173.6	-170.7	161.5	0	110.9	G586 E587	G586-K617 CarbonylContact C-O 3.59Å; G586-K617 WeakPolarHBondContact CA-O 3.27Å; E587-K617 HydrophobicContact CB-CB 4.38Å; E587-K617 HydrophobicContact CG-CB 4.43Å; E587-K617 PolarHBondContact N-O 2.95Å; E587-K617 PolarHBondContact O-N 2.89Å; E587-K617 IonicContact OE2-NZ 3.93Å
618	G	84.7	Confident	80.4	Confident	33 Å²	33	41.9 Å²	41.9	34%	0.34	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	62.8	-151.9	174.5	0	0	0	0	0	114.1	I585 K700	I585-G618 VanDerWaalsContact O-CA 3.25Å; I585-G618 WeakPolarHBondContact O-CA 3.47Å; G618-K700 PolarHBondContact O-N 3.11Å
619	N	85.4	Confident	79.9	Confident	42 Å²	42	44.8 Å²	44.8	23%	0.225	25%	0.253	C	S	.	.			trans	-122.4	144.7	-178.8	-65.3	-21.8	0	0	0	110.7	I585 I698	I585-N619 HydrophobicContact CG2-CB 4.36Å; I585-N619 WeakPolarHBondContact CG2-O 3.31Å; I585-N619 PolarHBondContact O-N 2.82Å; N619-I698 CarbonylContact C-O 3.44Å; N619-I698 VanDerWaalsContact CA-O 3.26Å; N619-I698 WeakPolarHBondContact CA-O 3.47Å
620	I	85.9	Confident	79	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	127.6	170.9	-62.7	-179.4	0	0	0	108.2	A588 C615 Y645 L688 S697 I698 I706	A588-I620 HydrophobicContact CB-CD1 3.25Å; C615-I620 WeakPolarHBondContact SG-CD1 3.3Å; I620-Y645 HydrophobicContact CG2-CE1 3.89Å; I620-Y645 WeakPolarHBondContact CG2-OH 3.25Å; I620-L688 HydrophobicContact CG2-CD1 3.99Å; I620-L688 HydrophobicContact CG2-CD2 3.96Å; I620-S697 CarbonylContact O-C 3.59Å; I620-S697 VanDerWaalsContact O-CA 3.23Å; I620-S697 WeakPolarHBondContact O-CA 3.38Å; I620-I698 HydrophobicContact CB-CB 4.44Å; I620-I698 PolarHBondContact N-O 3.39Å; I620-I698 PolarHBondContact O-N 3.34Å; I620-I706 HydrophobicContact CD1-CD1 3.92Å; I620-I706 HydrophobicContact CG2-CD1 4.08Å
621	I	83.9	Confident	77.8	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	126.2	-171.6	-55.1	168.2	0	0	0	109.8	I585 N623 I627 I630 L643 Y645 D696	I585-I621 HydrophobicContact CD1-CD1 4.03Å; I585-I621 HydrophobicContact CG2-CD1 3.91Å; I621-N623 VanDerWaalsContact CG2-O 3.26Å; I621-N623 WeakPolarHBondContact CG2-O 3.39Å; I621-I627 HydrophobicContact CD1-CG1 4.14Å; I621-I627 HydrophobicContact CG2-CG1 4.12Å; I621-I630 HydrophobicContact CD1-CD1 3.49Å; I621-I630 VanDerWaalsContact CD1-CD1 3.49Å; I621-I630 HydrophobicContact CD1-CG2 4.47Å; I621-I630 HydrophobicContact CG1-CD1 4.08Å; I621-L643 HydrophobicContact CB-CD1 3.91Å; I621-L643 HydrophobicContact CG2-CD1 4.28Å; I621-L643 WeakPolarHBondContact O-CD2 3.07Å; I621-Y645 VanDerWaalsContact C-OH 3.3Å; I621-Y645 PolarHBondContact O-OH 3.07Å; I621-D696 CarbonylContact C-O 3.55Å; I621-D696 WeakPolarHBondContact CA-O 3.43Å
622	A	76.4	Confident	76.8	Confident	32 Å²	32	49.8 Å²	49.8	26%	0.264	28%	0.281	S	S	.	.	S	Bend	trans	-84.8	-24.5	-179.2	0	0	0	0	0	114	L688 D696	A622-L688 HydrophobicContact CB-CB 3.69Å; A622-L688 HydrophobicContact CB-CD2 3.93Å; A622-L688 HydrophobicContact CB-CG 4.47Å; A622-D696 PolarHBondContact N-O 3.35Å
623	N	70.7	Confident	75.5	Confident	54 Å²	54	55.9 Å²	55.9	29%	0.289	31%	0.31	S	S	.	.			trans	-131.6	131.6	-169.9	-167.4	-17.4	0	0	0	112	I621 N625 K626	I621-N623 VanDerWaalsContact CG2-O 3.26Å; I621-N623 WeakPolarHBondContact CG2-O 3.39Å; N623-N625 PolarHBondContact O-N 2.72Å; N623-N625 PolarHBondContact OD1-N 2.98Å; N623-K626 PolarHBondContact O-N 3.01Å
624	V	66	Low	74.2	Confident	58 Å²	58	60.7 Å²	60.7	35%	0.352	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-57.5	-34.2	-179	-176.2	0	0	0	0	112.1	K626 I627 L643	V624-K626 PolarHBondContact O-N 2.93Å; V624-I627 HydrophobicContact CB-CD1 4.18Å; V624-I627 HydrophobicContact CG1-CD1 4.02Å; V624-I627 HydrophobicContact CG2-CD1 4.45Å; V624-I627 WeakPolarHBondContact O-CB 3.22Å; V624-I627 WeakPolarHBondContact O-CG1 3.28Å; V624-I627 PolarHBondContact O-N 3.14Å; V624-I627 VanDerWaalsContact O-N 3.08Å; V624-L643 HydrophobicContact CG2-CB 4.1Å
625	N	66.1	Low	72.8	Confident	139 Å²	139	58.3 Å²	58.3	74%	0.743	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-64.1	-16	-173.1	-64.3	-7.8	0	0	0	114.9	N623	N623-N625 PolarHBondContact O-N 2.72Å; N623-N625 PolarHBondContact OD1-N 2.98Å
626	K	62.6	Low	71.4	Confident	104 Å²	104	59.4 Å²	59.4	45%	0.452	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-108	5.4	179.9	-73.4	-175.4	175	175.6	0	113.8	N623 V624 D696	N623-K626 PolarHBondContact O-N 3.01Å; V624-K626 PolarHBondContact O-N 2.93Å; K626-D696 HydrophobicContact CD-CB 3.97Å; K626-D696 IonicContact NZ-OD2 2.91Å; K626-D696 PolarHBondContact NZ-OD2 3.16Å
627	I	65.5	Low	70.1	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-71.3	-35	179.1	-63.1	171.6	0	0	0	111	I585 I621 V624 I630 L631 P640 L643 V742	I585-I627 HydrophobicContact CD1-CG2 4.25Å; I621-I627 HydrophobicContact CD1-CG1 4.14Å; I621-I627 HydrophobicContact CG2-CG1 4.12Å; V624-I627 HydrophobicContact CB-CD1 4.18Å; V624-I627 HydrophobicContact CG1-CD1 4.02Å; V624-I627 HydrophobicContact CG2-CD1 4.45Å; V624-I627 WeakPolarHBondContact O-CB 3.22Å; V624-I627 WeakPolarHBondContact O-CG1 3.28Å; V624-I627 PolarHBondContact O-N 3.14Å; V624-I627 VanDerWaalsContact O-N 3.08Å; I627-I630 WeakPolarHBondContact O-CA 3.48Å; I627-I630 PolarHBondContact O-N 3.2Å; I627-L631 HydrophobicContact CG2-CD1 3.35Å; I627-L631 HydrophobicContact CG2-CD2 4.4Å; I627-L631 HydrophobicContact CG2-CG 3.5Å; I627-L631 VanDerWaalsContact CG2-CG 3.5Å; I627-L631 PolarHBondContact O-N 2.83Å; I627-P640 HydrophobicContact CG2-CB 4.25Å; I627-P640 HydrophobicContact CG2-CG 4.41Å; I627-L643 HydrophobicContact CD1-CB 3.88Å; I627-L643 HydrophobicContact CD1-CD1 3.46Å; I627-L643 VanDerWaalsContact CD1-CD1 3.46Å; I627-L643 HydrophobicContact CD1-CG 4.28Å; I627-L643 HydrophobicContact CG1-CD1 3.99Å; I627-V742 HydrophobicContact CD1-CG2 3.83Å; I627-V742 HydrophobicContact CG2-CG2 4.39Å
628	G	63.4	Low	68.9	Low	37 Å²	37	59.7 Å²	59.7	38%	0.381	37%	0.369	S	S	.	.	H	α-helix	trans	-39.4	-63.3	-176.8	0	0	0	0	0	114.6	I630 L631 T632	G628-I630 VanDerWaalsContact C-N 3.28Å; G628-I630 PolarHBondContact O-N 3.3Å; G628-L631 PolarHBondContact O-N 2.94Å; G628-T632 PolarHBondContact O-N 2.82Å; G628-T632 VanDerWaalsContact O-N 3.15Å; G628-T632 PolarHBondContact O-OG1 3.27Å
629	P	66.8	Low	68.1	Low	82 Å²	82	65.4 Å²	65.4	53%	0.532	39%	0.387	S	S	.	.	H	α-helix	trans	-62.8	-32	-178.7	22.5	-32.3	0	0	0	113.7	T632 D633	P629-T632 PolarHBondContact O-N 2.78Å; P629-D633 VanDerWaalsContact O-CG 3.24Å; P629-D633 PolarHBondContact O-N 3.04Å; P629-D633 VanDerWaalsContact O-N 3.08Å
630	I	64.5	Low	67.2	Low	28 Å²	28	65.5 Å²	65.5	14%	0.144	39%	0.39	C	S	.	.	H	α-helix	trans	-73.9	-33.9	-178.8	-62.2	169.1	0	0	0	111	I585 I621 I627 G628 L634	I585-I630 HydrophobicContact CG2-CG2 4.35Å; I621-I630 HydrophobicContact CD1-CD1 3.49Å; I621-I630 VanDerWaalsContact CD1-CD1 3.49Å; I621-I630 HydrophobicContact CD1-CG2 4.47Å; I621-I630 HydrophobicContact CG1-CD1 4.08Å; I627-I630 WeakPolarHBondContact O-CA 3.48Å; I627-I630 PolarHBondContact O-N 3.2Å; G628-I630 VanDerWaalsContact C-N 3.28Å; G628-I630 PolarHBondContact O-N 3.3Å; I630-L634 HydrophobicContact CG2-CD1 4.22Å; I630-L634 WeakPolarHBondContact O-CD1 3.44Å; I630-L634 VanDerWaalsContact O-CG 3.28Å; I630-L634 WeakPolarHBondContact O-CG 3.44Å; I630-L634 PolarHBondContact O-N 3.41Å
631	L	63.4	Low	66.4	Low	9 Å²	9	68.7 Å²	68.7	5%	0.047	41%	0.41	C	S	.	.	H	α-helix	trans	-70.9	-38.3	173.7	-75.8	174.8	0	0	0	112.1	I627 G628 D633 L634 G635 V636 P640 I744	I627-L631 HydrophobicContact CG2-CD1 3.35Å; I627-L631 HydrophobicContact CG2-CD2 4.4Å; I627-L631 HydrophobicContact CG2-CG 3.5Å; I627-L631 VanDerWaalsContact CG2-CG 3.5Å; I627-L631 PolarHBondContact O-N 2.83Å; G628-L631 PolarHBondContact O-N 2.94Å; L631-D633 VanDerWaalsContact C-N 3.3Å; L631-D633 PolarHBondContact O-N 3.45Å; L631-L634 PolarHBondContact O-N 2.95Å; L631-L634 VanDerWaalsContact O-N 3.09Å; L631-G635 PolarHBondContact O-N 2.86Å; L631-V636 HydrophobicContact CD2-CB 4.41Å; L631-V636 PolarHBondContact O-N 3.49Å; L631-P640 HydrophobicContact CD1-CB 3.86Å; L631-P640 HydrophobicContact CD1-CG 3.94Å; L631-I744 HydrophobicContact CD2-CD1 3.94Å
632	T	65.9	Low	65.9	Low	109 Å²	109	74.4 Å²	74.4	67%	0.669	44%	0.437	S	S	*	.	H	α-helix	trans	-61.9	-40.7	174.9	-40.9	0	0	0	0	111.1	G628 P629 L634 G635	G628-T632 PolarHBondContact O-N 2.82Å; G628-T632 VanDerWaalsContact O-N 3.15Å; G628-T632 PolarHBondContact O-OG1 3.27Å; P629-T632 PolarHBondContact O-N 2.78Å; T632-L634 PolarHBondContact O-N 2.93Å; T632-G635 PolarHBondContact O-N 2.81Å
633	D	64.4	Low	66	Low	142 Å²	142	73.8 Å²	73.8	76%	0.759	43%	0.428	S	S	*	.	H	α-helix	trans	-66.3	-23.7	175.2	-70.6	-18	0	0	0	113.2	P629 L631	P629-D633 VanDerWaalsContact O-CG 3.24Å; P629-D633 PolarHBondContact O-N 3.04Å; P629-D633 VanDerWaalsContact O-N 3.08Å; L631-D633 VanDerWaalsContact C-N 3.3Å; L631-D633 PolarHBondContact O-N 3.45Å
634	L	63.1	Low	66.5	Low	104 Å²	104	72 Å²	72	55%	0.545	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-0.2	177.4	-71.9	167	0	0	0	113.3	I630 L631 T632 V636	I630-L634 HydrophobicContact CG2-CD1 4.22Å; I630-L634 WeakPolarHBondContact O-CD1 3.44Å; I630-L634 VanDerWaalsContact O-CG 3.28Å; I630-L634 WeakPolarHBondContact O-CG 3.44Å; I630-L634 PolarHBondContact O-N 3.41Å; L631-L634 PolarHBondContact O-N 2.95Å; L631-L634 VanDerWaalsContact O-N 3.09Å; T632-L634 PolarHBondContact O-N 2.93Å; L634-V636 VanDerWaalsContact C-N 3.28Å; L634-V636 HydrophobicContact CB-CG2 4.25Å; L634-V636 PolarHBondContact O-N 3.44Å
635	G	62.3	Low	67.5	Low	65 Å²	65	69.2 Å²	69.2	67%	0.67	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.3	28.5	179.9	0	0	0	0	0	113.6	L631 T632	L631-G635 PolarHBondContact O-N 2.86Å; T632-G635 PolarHBondContact O-N 2.81Å
636	V	62.7	Low	68.5	Low	26 Å²	26	64.8 Å²	64.8	16%	0.158	38%	0.376	C	S	.	.			trans	-102.8	114.2	-178.5	175.6	0	0	0	0	110.7	K583 L631 L634 I744	K583-V636 HydrophobicContact CD-CB 4.49Å; K583-V636 HydrophobicContact CD-CG1 3.9Å; K583-V636 HydrophobicContact CD-CG2 3.77Å; L631-V636 HydrophobicContact CD2-CB 4.41Å; L631-V636 PolarHBondContact O-N 3.49Å; L634-V636 VanDerWaalsContact C-N 3.28Å; L634-V636 HydrophobicContact CB-CG2 4.25Å; L634-V636 PolarHBondContact O-N 3.44Å; V636-I744 HydrophobicContact CG1-CD1 3.4Å
637	D	61	Low	69.6	Low	154 Å²	154	59.8 Å²	59.8	82%	0.824	35%	0.354	S	S	*	.			trans	-82.3	120.7	170.1	-61.8	-32.2	0	0	0	109.8
638	G	62.9	Low	70.6	Confident	35 Å²	35	59.9 Å²	59.9	36%	0.361	36%	0.355	S	S	.	.	S	Bend	trans	155.7	152.5	175.3	0	0	0	0	0	113.4
639	E	66.5	Low	71.5	Confident	153 Å²	153	61.2 Å²	61.2	72%	0.715	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.8	123.6	178.5	-68	-175.3	173.9	0	0	110.1	T641 S745	E639-T641 PolarHBondContact O-N 3.12Å; E639-S745 PolarHBondContact O-OG 2.81Å
640	P	68	Low	72	Confident	44 Å²	44	59.2 Å²	59.2	29%	0.286	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	117.5	175.6	26.4	-31.4	0	0	0	109.4	I627 L631 V742	I627-P640 HydrophobicContact CG2-CB 4.25Å; I627-P640 HydrophobicContact CG2-CG 4.41Å; L631-P640 HydrophobicContact CD1-CB 3.86Å; L631-P640 HydrophobicContact CD1-CG 3.94Å; P640-V742 HydrophobicContact CB-CG1 3.73Å
641	T	67.6	Low	72	Confident	68 Å²	68	60.9 Å²	60.9	42%	0.417	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	-49.7	178.8	39.3	0	0	0	0	111	E639 T743	E639-T641 PolarHBondContact O-N 3.12Å; T641-T743 PolarHBondContact N-O 3.16Å; T641-T743 PolarHBondContact OG1-O 3Å
642	E	73.1	Confident	71.7	Confident	120 Å²	120	68.9 Å²	68.9	56%	0.561	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.3	144	-174.5	-64.9	-176.3	170.8	0	0	111.4	V742 T743	E642-V742 WeakPolarHBondContact O-CA 3.29Å; E642-T743 PolarHBondContact O-N 3.47Å
643	L	78.6	Confident	70.5	Confident	18 Å²	18	69.6 Å²	69.6	9%	0.094	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	118.5	171.2	-178.7	135.2	0	0	0	109.3	I621 V624 I627 Y645 V742	I621-L643 HydrophobicContact CB-CD1 3.91Å; I621-L643 HydrophobicContact CG2-CD1 4.28Å; I621-L643 WeakPolarHBondContact O-CD2 3.07Å; V624-L643 HydrophobicContact CG2-CB 4.1Å; I627-L643 HydrophobicContact CD1-CB 3.88Å; I627-L643 HydrophobicContact CD1-CD1 3.46Å; I627-L643 VanDerWaalsContact CD1-CD1 3.46Å; I627-L643 HydrophobicContact CD1-CG 4.28Å; I627-L643 HydrophobicContact CG1-CD1 3.99Å; L643-Y645 HydrophobicContact CD2-CD2 4.26Å; L643-Y645 HydrophobicContact CD2-CE2 3.4Å; L643-V742 HydrophobicContact CB-CG2 4.1Å; L643-V742 HydrophobicContact CD1-CG2 3.73Å; L643-V742 HydrophobicContact CG-CG2 4.1Å
644	C	82.2	Confident	69.4	Low	16 Å²	16	67.8 Å²	67.8	11%	0.108	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	158	-173.1	-72.4	0	0	0	0	110.9	Y741	C644-Y741 HydrophobicContact CB-CD1 4.45Å; C644-Y741 HydrophobicContact CB-CD2 4.31Å; C644-Y741 HydrophobicContact CB-CE1 3.81Å; C644-Y741 HydrophobicContact CB-CE2 3.67Å; C644-Y741 PolarHBondContact N-O 3.3Å; C644-Y741 WeakPolarHBondContact O-CD1 3.44Å; C644-Y741 PolarHBondContact O-N 2.85Å
645	Y	86.3	Confident	68.1	Low	0 Å²	0	69.2 Å²	69.2	0%	0	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	141.2	176	-67.7	-96.7	0	0	0	109.5	I620 I621 L643 R682 A683 C685 L708 I738 Q739 C740	I620-Y645 HydrophobicContact CG2-CE1 3.89Å; I620-Y645 WeakPolarHBondContact CG2-OH 3.25Å; I621-Y645 VanDerWaalsContact C-OH 3.3Å; I621-Y645 PolarHBondContact O-OH 3.07Å; L643-Y645 HydrophobicContact CD2-CD2 4.26Å; L643-Y645 HydrophobicContact CD2-CE2 3.4Å; Y645-R682 CarbonylContact O-C 3.58Å; Y645-R682 WeakPolarHBondContact O-CA 3.49Å; Y645-A683 WeakPolarHBondContact CA-O 3.41Å; Y645-A683 WeakPolarHBondContact CB-O 3.5Å; Y645-A683 PolarHBondContact N-O 3.34Å; Y645-A683 PolarHBondContact O-N 3.17Å; Y645-C685 HydrophobicContact CD2-CB 3.84Å; Y645-C685 HydrophobicContact CE2-CB 3.25Å; Y645-L708 HydrophobicContact CD1-CD2 4.28Å; Y645-L708 HydrophobicContact CD2-CD2 4.2Å; Y645-L708 HydrophobicContact CG-CD2 3.89Å; Y645-I738 HydrophobicContact CD1-CG2 3.64Å; Y645-I738 HydrophobicContact CE1-CG2 4.4Å; Y645-Q739 WeakPolarHBondContact CA-O 3.1Å; Y645-C740 HydrophobicContact CD1-CB 4.02Å; Y645-C740 HydrophobicContact CE1-CB 3.71Å
646	R	86.9	Confident	66.7	Low	46 Å²	46	71 Å²	71	17%	0.174	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	141.6	168.6	63.4	-172.2	-169.4	-168.5	7.3	110.2	E582 V648 I679 D681 Q739 Y741	E582-R646 IonicContact OE2-NH1 3.63Å; E582-R646 PolarHBondContact OE2-NH1 3.15Å; E582-R646 VanDerWaalsContact OE2-NH1 3.15Å; R646-V648 HydrophobicContact CG-CG2 4.23Å; R646-I679 HydrophobicContact CB-CG2 4.44Å; R646-D681 WeakPolarHBondContact CA-O 3.13Å; R646-Q739 HydrophobicContact CG-CB 3.85Å; R646-Q739 PolarHBondContact N-O 2.76Å; R646-Q739 PolarHBondContact O-N 3.38Å; R646-Y741 HydrophobicContact CB-CD1 4.48Å; R646-Y741 HydrophobicContact CB-CE1 3.85Å; R646-Y741 HydrophobicContact CG-CD1 3.97Å; R646-Y741 HydrophobicContact CG-CE1 3.8Å
647	I	86.4	Confident	65.4	Low	0 Å²	0	75.2 Å²	75.2	0%	0	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	123.9	177.5	-54.4	174	0	0	0	107.5	V680 D681 L708 I729 W732 D736	I647-V680 HydrophobicContact CB-CB 4.28Å; I647-V680 HydrophobicContact CG2-CB 4.22Å; I647-V680 HydrophobicContact CG2-CG2 4.48Å; I647-V680 PolarHBondContact O-N 3.24Å; I647-D681 HydrophobicContact CD1-CB 4.45Å; I647-D681 PolarHBondContact N-O 3.47Å; I647-L708 HydrophobicContact CD1-CD1 4.03Å; I647-L708 HydrophobicContact CG1-CD1 4.13Å; I647-I729 HydrophobicContact CD1-CG2 4.15Å; I647-W732 VanDerWaalsContact CD1-CD1 3.49Å; I647-W732 VanDerWaalsContact CD1-NE1 3.35Å; I647-D736 HydrophobicContact CG2-CB 3.96Å
648	V	86.4	Confident	64.1	Low	2 Å²	2	75.3 Å²	75.3	1%	0.012	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	123.8	-176.6	178.9	0	0	0	0	108.9	R646 N677 I737 Q739	R646-V648 HydrophobicContact CG-CG2 4.23Å; V648-N677 HydrophobicContact CG1-CB 3.47Å; V648-N677 VanDerWaalsContact CG1-CB 3.47Å; V648-I737 HydrophobicContact CB-CB 4.49Å; V648-I737 PolarHBondContact N-O 3.27Å; V648-I737 PolarHBondContact O-N 3.36Å; V648-Q739 HydrophobicContact CG2-CG 4.2Å
649	R	83.1	Confident	62.9	Low	64 Å²	64	81.7 Å²	81.7	24%	0.242	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	117.5	174.4	-176.8	170.6	-63.8	141	7.3	109.7	T678 V680 Q731 D736	R649-T678 PolarHBondContact N-O 3.31Å; R649-T678 PolarHBondContact O-N 3.06Å; R649-T678 VanDerWaalsContact O-N 3.16Å; R649-T678 PolarHBondContact O-OG1 3.06Å; R649-V680 HydrophobicContact CB-CG2 3.77Å; R649-Q731 PolarHBondContact NH2-O 2.74Å; R649-D736 WeakPolarHBondContact CB-OD1 3.22Å; R649-D736 VanDerWaalsContact CG-OD1 3.29Å; R649-D736 WeakPolarHBondContact CG-OD1 3.33Å; R649-D736 IonicContact CZ-OD1 2.88Å; R649-D736 IonicContact CZ-OD2 3.78Å; R649-D736 IonicContact NE-OD1 2.83Å; R649-D736 PolarHBondContact NE-OD1 3.21Å; R649-D736 IonicContact NE-OD2 2.69Å; R649-D736 IonicContact NH2-OD1 3.25Å; R649-D736 IonicContact NH2-OD2 2.62Å; R649-D736 PolarHBondContact NH2-OD2 2.81Å
650	P	75.9	Confident	61.5	Low	40 Å²	40	83.4 Å²	83.4	26%	0.26	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	129.7	174.9	27	-31.3	0	0	0	110
651	T	66	Low	60.1	Low	63 Å²	63	90.2 Å²	90.2	39%	0.387	48%	0.48	S	S	.	.			trans	-90.8	104.8	174.5	57.2	0	0	0	0	110.3	H653 K676 T678	T651-H653 PolarHBondContact O-N 2.95Å; T651-K676 PolarHBondContact N-O 2.8Å; T651-K676 VanDerWaalsContact OG1-CB 3.32Å; T651-K676 WeakPolarHBondContact OG1-CB 3.41Å; T651-K676 PolarHBondContact OG1-O 3.4Å; T651-T678 HydrophobicContact CG2-CG2 4.15Å
652	H	55.6	Low	58.4	Low	177 Å²	177	90.2 Å²	90.2	82%	0.819	49%	0.494	S	S	*	.			trans	-75.3	113.8	168.9	-72.3	-74.1	0	0	0	109.4	S654	H652-S654 PolarHBondContact O-N 3Å
653	H	42	Very low	56.7	Low	125 Å²	125	93.9 Å²	93.9	58%	0.579	51%	0.511	S	S	*	.			trans	-68.3	111.6	161.1	-87.9	-80.9	0	0	0	109	T651 T655 K676	T651-H653 PolarHBondContact O-N 2.95Å; H653-T655 PolarHBondContact O-N 2.8Å; H653-T655 VanDerWaalsContact O-N 3.08Å; H653-K676 VanDerWaalsContact CD2-CD 3.41Å; H653-K676 WeakPolarHBondContact CD2-CD 3.29Å; H653-K676 VanDerWaalsContact CD2-CE 3.42Å; H653-K676 WeakPolarHBondContact CD2-CE 3.4Å; H653-K676 PolarHBondContact CD2-NZ 2.95Å; H653-K676 WeakPolarHBondContact NE2-CD 3.45Å; H653-K676 WeakPolarHBondContact NE2-CE 3.46Å; H653-K676 PolarHBondContact NE2-NZ 2.9Å
654	S	40.4	Very low	54.6	Low	103 Å²	103	100.2 Å²	100.2	72%	0.72	55%	0.545	S	S	*	.			trans	-65.5	101.1	152.7	45.5	0	0	0	0	108.1	H652 S656	H652-S654 PolarHBondContact O-N 3Å; S654-S656 PolarHBondContact O-N 2.87Å; S654-S656 VanDerWaalsContact O-N 3.11Å
655	T	35.3	Very low	52.3	Low	134 Å²	134	105.6 Å²	105.6	82%	0.822	58%	0.58	S	S	*	*			trans	-63.9	105.8	166.7	-8.7	0	0	0	0	107.4	H653	H653-T655 PolarHBondContact O-N 2.8Å; H653-T655 VanDerWaalsContact O-N 3.08Å
656	S	34.4	Very low	49.9	Very low	102 Å²	102	111.7 Å²	111.7	71%	0.713	62%	0.617	S	S	*	*			trans	-86.8	124.5	164.5	-59.9	0	0	0	0	107.6	S654 N658	S654-S656 PolarHBondContact O-N 2.87Å; S654-S656 VanDerWaalsContact O-N 3.11Å; S656-N658 PolarHBondContact O-N 2.75Å
657	P	34.1	Very low	47.4	Very low	116 Å²	116	116.5 Å²	116.5	75%	0.753	65%	0.652	S	S	*	*			trans	-85.1	104	178.4	32.3	-27	0	0	0	108.1
658	N	35.2	Very low	44.7	Very low	156 Å²	156	121 Å²	121	83%	0.834	69%	0.689	S	S	*	*			trans	174.2	96	153.8	-92.6	-21.5	0	0	0	110.7	S656	S656-N658 PolarHBondContact O-N 2.75Å
659	N	37	Very low	42.1	Very low	168 Å²	168	129.9 Å²	129.9	90%	0.898	73%	0.731	S	S	*	*				-167.8	128.1	125.5	-102	-16.5	0	0	0	110.3
660	K	36.1	Very low	39.6	Very low	189 Å²	189	135.9 Å²	135.9	82%	0.822	76%	0.759	S	S	*	*			trans	-76.7	162.1	172.9	-68.5	174.7	174	177.4	0	109.7
661	H	39.3	Very low	37.4	Very low	187 Å²	187	141.6 Å²	141.6	87%	0.866	79%	0.787	S	S	*	*			trans	89.1	105.7	-177.3	-55.5	-69.1	0	0	0	112
662	G	32.3	Very low	35.5	Very low	69 Å²	69	147.8 Å²	147.8	71%	0.711	81%	0.809	S	S	*	*				87.7	94.6	55.1	0	0	0	0	0	106.1
663	E	36.4	Very low	34.3	Very low	196 Å²	196	144 Å²	144	92%	0.916	80%	0.802	S	S	*	*				-169	163.2	93	-87.3	167.7	175.1	0	0	111.7
664	N	35.7	Very low	34	Very low	152 Å²	152	146.4 Å²	146.4	81%	0.813	82%	0.819	S	S	*	*			trans	-58	149.5	-160.7	-55.8	-41.7	0	0	0	118.1
665	P	33.2	Very low	34	Very low	129 Å²	129	146.2 Å²	146.2	84%	0.838	82%	0.818	S	S	*	*			trans	-103.8	129.8	160.4	35.3	-23.5	0	0	0	111.5
666	T	37.2	Very low	34.8	Very low	127 Å²	127	144.9 Å²	144.9	78%	0.779	80%	0.801	S	S	*	*			trans	-133.4	152.3	163.3	43.9	0	0	0	0	109.7
667	T	33.6	Very low	36.3	Very low	147 Å²	147	144.5 Å²	144.5	90%	0.902	79%	0.791	S	S	*	*			trans	81.3	102.3	178.6	36.5	0	0	0	0	117.4
668	A	30.4	Very low	38.1	Very low	96 Å²	96	142.4 Å²	142.4	79%	0.793	78%	0.776	S	S	*	*			trans	-69.6	131.2	176.7	0	0	0	0	0	113
669	E	31.8	Very low	40.1	Very low	188 Å²	188	139.8 Å²	139.8	88%	0.879	76%	0.761	S	S	*	*			trans	-128	128.2	145.5	-76.2	-176	162	0	0	107.5	D671	E669-D671 PolarHBondContact O-N 3.34Å
670	K	28.9	Very low	41.8	Very low	190 Å²	190	133.7 Å²	133.7	83%	0.826	73%	0.729	S	S	*	*			trans	-84.3	90.5	-176.7	-75.3	175.4	174.6	173.3	0	109
671	D	30.3	Very low	43.6	Very low	159 Å²	159	127.1 Å²	127.1	85%	0.85	70%	0.704	S	S	*	*			trans	-113.5	99.3	155.3	-75.4	-27	0	0	0	108.2	E669	E669-D671 PolarHBondContact O-N 3.34Å
672	F	26.7	Very low	45.6	Very low	193 Å²	193	124.4 Å²	124.4	85%	0.846	69%	0.686	S	S	*	*			trans	-83.2	126.9	178.2	-114.3	-99.8	0	0	0	109.6
673	S	29.2	Very low	47.8	Very low	98 Å²	98	121.2 Å²	121.2	69%	0.685	65%	0.652	S	S	*	*			trans	73.5	84.3	155.9	68	0	0	0	0	119.9
674	D	36.8	Very low	50	Low	175 Å²	175	114 Å²	114	94%	0.936	62%	0.62	S	S	*	*			trans	-137.2	33.9	153.1	-115.8	-5.4	0	0	0	112.6	K676	D674-K676 PolarHBondContact O-N 3.08Å
675	S	40	Very low	52.2	Low	99 Å²	99	107.9 Å²	107.9	69%	0.692	59%	0.589	S	S	*	*			trans	-85.7	109.7	176	63.9	0	0	0	0	111.8
676	K	52.2	Low	54.4	Low	107 Å²	107	106.4 Å²	106.4	47%	0.465	57%	0.567	S	S	.	*	S	Bend	trans	95.1	36.2	132.9	-68.2	-179.9	-168.9	170.1	0	121.4	T651 H653 D674	T651-K676 PolarHBondContact N-O 2.8Å; T651-K676 VanDerWaalsContact OG1-CB 3.32Å; T651-K676 WeakPolarHBondContact OG1-CB 3.41Å; T651-K676 PolarHBondContact OG1-O 3.4Å; H653-K676 VanDerWaalsContact CD2-CD 3.41Å; H653-K676 WeakPolarHBondContact CD2-CD 3.29Å; H653-K676 VanDerWaalsContact CD2-CE 3.42Å; H653-K676 WeakPolarHBondContact CD2-CE 3.4Å; H653-K676 PolarHBondContact CD2-NZ 2.95Å; H653-K676 WeakPolarHBondContact NE2-CD 3.45Å; H653-K676 WeakPolarHBondContact NE2-CE 3.46Å; H653-K676 PolarHBondContact NE2-NZ 2.9Å; D674-K676 PolarHBondContact O-N 3.08Å
677	N	65.3	Low	56.6	Low	94 Å²	94	101.4 Å²	101.4	50%	0.503	54%	0.537	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	119.8	170.1	-82.6	-3.5	0	0	0	111.5	V648	V648-N677 HydrophobicContact CG1-CB 3.47Å; V648-N677 VanDerWaalsContact CG1-CB 3.47Å
678	T	73.3	Confident	59.1	Low	71 Å²	71	94.6 Å²	94.6	44%	0.436	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	121.2	175	54.9	0	0	0	0	110.2	R649 T651 V680	R649-T678 PolarHBondContact N-O 3.31Å; R649-T678 PolarHBondContact O-N 3.06Å; R649-T678 VanDerWaalsContact O-N 3.16Å; R649-T678 PolarHBondContact O-OG1 3.06Å; T651-T678 HydrophobicContact CG2-CG2 4.15Å; T678-V680 PolarHBondContact O-N 3.46Å
679	I	75.5	Confident	61.9	Low	101 Å²	101	95.8 Å²	95.8	52%	0.518	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	118.9	172.3	-57.1	172.6	0	0	0	108	R646	R646-I679 HydrophobicContact CB-CG2 4.44Å
680	V	73.1	Confident	64.7	Low	40 Å²	40	89.2 Å²	89.2	24%	0.242	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	-47	-176.5	-179.2	0	0	0	0	110.9	I647 R649 T678	I647-V680 HydrophobicContact CB-CB 4.28Å; I647-V680 HydrophobicContact CG2-CB 4.22Å; I647-V680 HydrophobicContact CG2-CG2 4.48Å; I647-V680 PolarHBondContact O-N 3.24Å; R649-V680 HydrophobicContact CB-CG2 3.77Å; T678-V680 PolarHBondContact O-N 3.46Å
681	D	75.2	Confident	67.4	Low	52 Å²	52	88.2 Å²	88.2	28%	0.278	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.6	154.7	-177.2	-147.1	-15.3	0	0	0	111.8	R646 I647 I729	R646-D681 WeakPolarHBondContact CA-O 3.13Å; I647-D681 HydrophobicContact CD1-CB 4.45Å; I647-D681 PolarHBondContact N-O 3.47Å; D681-I729 HydrophobicContact CB-CD1 4.06Å; D681-I729 HydrophobicContact CB-CG2 4.35Å; D681-I729 WeakPolarHBondContact OD2-CD1 3.19Å; D681-I729 WeakPolarHBondContact OD2-CG1 3.32Å; D681-I729 WeakPolarHBondContact OD2-CG2 3.12Å
682	R	80.3	Confident	69.9	Low	130 Å²	130	90.1 Å²	90.1	49%	0.491	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	141.1	169.6	-76.8	-179.8	167.6	168.9	-7.5	108.6	E582 Y645 P711	E582-R682 IonicContact OE1-NH2 3.71Å; E582-R682 PolarHBondContact OE1-NH2 3.14Å; Y645-R682 CarbonylContact O-C 3.58Å; Y645-R682 WeakPolarHBondContact O-CA 3.49Å; R682-P711 HydrophobicContact CB-CG 4.45Å; R682-P711 WeakPolarHBondContact O-CD 3.42Å
683	A	78.8	Confident	72.7	Confident	1 Å²	1	83.8 Å²	83.8	1%	0.008	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	157.7	-171.3	0	0	0	0	0	113.8	Y645 L708 V709 I729	Y645-A683 WeakPolarHBondContact CA-O 3.41Å; Y645-A683 WeakPolarHBondContact CB-O 3.5Å; Y645-A683 PolarHBondContact N-O 3.34Å; Y645-A683 PolarHBondContact O-N 3.17Å; A683-L708 HydrophobicContact CB-CB 3.72Å; A683-L708 HydrophobicContact CB-CD1 4.14Å; A683-L708 HydrophobicContact CB-CD2 4.35Å; A683-L708 HydrophobicContact CB-CG 4.29Å; A683-V709 CarbonylContact C-O 3.58Å; A683-V709 VanDerWaalsContact CA-O 3.31Å; A683-V709 WeakPolarHBondContact CA-O 2.98Å; A683-I729 HydrophobicContact CB-CD1 3.33Å
684	N	81.9	Confident	75.3	Confident	45 Å²	45	83.6 Å²	83.6	24%	0.241	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	145.5	168.9	-67.9	-9	0	0	0	109.8	Y686 L708 V709	N684-Y686 PolarHBondContact O-N 3.02Å; N684-L708 WeakPolarHBondContact O-CA 3.21Å; N684-V709 PolarHBondContact N-O 3.11Å; N684-V709 PolarHBondContact O-N 3.2Å
685	C	81.6	Confident	77.6	Confident	23 Å²	23	77.2 Å²	77.2	16%	0.155	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	119.2	176.8	176.1	0	0	0	0	110.7	Y645 L708	Y645-C685 HydrophobicContact CD2-CB 3.84Å; Y645-C685 HydrophobicContact CE2-CB 3.25Å; C685-L708 HydrophobicContact CB-CD2 4.29Å
686	Y	79.7	Confident	79.5	Confident	98 Å²	98	75.5 Å²	75.5	38%	0.384	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	-43.1	174	179.4	-101.3	0	0	0	112	V602 N684 V707 V709	V602-Y686 HydrophobicContact CG1-CE1 4.3Å; V602-Y686 VanDerWaalsContact CG1-OH 3.31Å; V602-Y686 WeakPolarHBondContact CG1-OH 3.35Å; N684-Y686 PolarHBondContact O-N 3.02Å; Y686-V707 HydrophobicContact CD1-CB 4.43Å; Y686-V707 HydrophobicContact CD1-CG1 4.07Å; Y686-V707 HydrophobicContact CG-CG1 4.5Å; Y686-V707 PolarHBondContact N-O 2.93Å; Y686-V709 HydrophobicContact CD2-CG2 4.37Å; Y686-V709 HydrophobicContact CG-CG2 4.25Å
687	S	83.6	Confident	81.1	Confident	22 Å²	22	72.9 Å²	72.9	15%	0.154	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	130.7	179.1	-167	0	0	0	0	110.4	R689 V707	S687-R689 PolarHBondContact OG-NE 3.32Å; S687-V707 PolarHBondContact N-O 3.4Å; S687-V707 PolarHBondContact O-N 3.41Å
688	L	87.6	Confident	82.2	Confident	4 Å²	4	68.6 Å²	68.6	2%	0.021	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	122.9	171.7	-174.7	64.1	0	0	0	108.1	I620 A622 V695 I698 C704 I706	I620-L688 HydrophobicContact CG2-CD1 3.99Å; I620-L688 HydrophobicContact CG2-CD2 3.96Å; A622-L688 HydrophobicContact CB-CB 3.69Å; A622-L688 HydrophobicContact CB-CD2 3.93Å; A622-L688 HydrophobicContact CB-CG 4.47Å; L688-V695 WeakPolarHBondContact CB-O 3.23Å; L688-V695 WeakPolarHBondContact CD2-O 3.37Å; L688-V695 PolarHBondContact O-N 3.06Å; L688-V695 VanDerWaalsContact O-N 3.09Å; L688-I698 HydrophobicContact CD1-CD1 3.64Å; L688-I698 HydrophobicContact CD1-CG1 4.47Å; L688-I698 HydrophobicContact CD2-CD1 3.93Å; L688-I698 HydrophobicContact CD2-CG1 3.9Å; L688-I698 HydrophobicContact CG-CD1 3.66Å; L688-I698 HydrophobicContact CG-CG1 4.18Å; L688-C704 HydrophobicContact CD1-CB 4.28Å; L688-I706 HydrophobicContact CD1-CD1 4.01Å; L688-I706 HydrophobicContact CD1-CG1 3.61Å
689	R	88.7	Confident	82.9	Confident	121 Å²	121	74.4 Å²	74.4	46%	0.457	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	136	-177.2	-68.5	-178.4	177.6	-120.6	-0.2	110.8	S687 S693 T694 G705	S687-R689 PolarHBondContact OG-NE 3.32Å; R689-S693 CarbonylContact C-O 3.58Å; R689-S693 WeakPolarHBondContact CA-O 3.46Å; R689-S693 WeakPolarHBondContact CB-O 3.41Å; R689-T694 HydrophobicContact CG-CG2 3.95Å; R689-G705 PolarHBondContact N-O 3.04Å; R689-G705 PolarHBondContact O-N 3.18Å
690	H	89.5	Confident	83.5	Confident	51 Å²	51	76.5 Å²	76.5	24%	0.236	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	119.9	163.1	-177.2	-82.8	0	0	0	107.5	K692 S693 V695 V702 D703	H690-K692 PolarHBondContact O-N 3.31Å; H690-K692 VanDerWaalsContact O-N 3.07Å; H690-S693 PolarHBondContact N-O 3.41Å; H690-S693 PolarHBondContact O-N 3.44Å; H690-S693 VanDerWaalsContact O-O 3.11Å; H690-S693 PolarHBondContact O-OG 3.24Å; H690-V695 HydrophobicContact CB-CB 4.44Å; H690-V695 HydrophobicContact CB-CG2 3.54Å; H690-V702 WeakPolarHBondContact CD2-CG1 3.46Å; H690-V702 WeakPolarHBondContact NE2-CG1 3.47Å; H690-D703 PolarHBondContact CD2-O 3.19Å
691	E	85.3	Confident	84.2	Confident	169 Å²	169	77.1 Å²	77.1	79%	0.79	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.4	-112.1	-173.6	-62.1	172	178.8	0	0	111.9
692	K	83.5	Confident	85	Confident	199 Å²	199	77 Å²	77	87%	0.865	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.5	-9.6	178.2	-64.1	-179.7	-178	174.6	0	113.3	H690	H690-K692 PolarHBondContact O-N 3.31Å; H690-K692 VanDerWaalsContact O-N 3.07Å
693	S	85.9	Confident	85.6	Confident	60 Å²	60	74.3 Å²	74.3	42%	0.42	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	138.6	-175.6	64.7	0	0	0	0	111.8	R689 H690	R689-S693 CarbonylContact C-O 3.58Å; R689-S693 WeakPolarHBondContact CA-O 3.46Å; R689-S693 WeakPolarHBondContact CB-O 3.41Å; H690-S693 PolarHBondContact N-O 3.41Å; H690-S693 PolarHBondContact O-N 3.44Å; H690-S693 VanDerWaalsContact O-O 3.11Å; H690-S693 PolarHBondContact O-OG 3.24Å
694	T	84.2	Confident	86.1	Confident	93 Å²	93	74.5 Å²	74.5	57%	0.571	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.2	125.5	167.2	47.2	0	0	0	0	108.5	R689	R689-T694 HydrophobicContact CG-CG2 3.95Å
695	V	83.8	Confident	86.5	Confident	41 Å²	41	73.2 Å²	73.2	25%	0.248	37%	0.373	C	S	.	.			trans	-122.7	136.8	-175.8	-176.1	0	0	0	0	108.8	L688 H690 S697 I698	L688-V695 WeakPolarHBondContact CB-O 3.23Å; L688-V695 WeakPolarHBondContact CD2-O 3.37Å; L688-V695 PolarHBondContact O-N 3.06Å; L688-V695 VanDerWaalsContact O-N 3.09Å; H690-V695 HydrophobicContact CB-CB 4.44Å; H690-V695 HydrophobicContact CB-CG2 3.54Å; V695-S697 WeakPolarHBondContact CG1-O 3.34Å; V695-I698 HydrophobicContact CB-CG1 4.43Å; V695-I698 HydrophobicContact CG1-CG1 4.15Å
696	D	81.7	Confident	86.8	Confident	64 Å²	64	72.1 Å²	72.1	34%	0.342	37%	0.366	S	S	.	.	S	Bend	trans	-82.1	-29.9	-178.7	-61.1	-32.3	0	0	0	112.9	I621 A622 K626	I621-D696 CarbonylContact C-O 3.55Å; I621-D696 WeakPolarHBondContact CA-O 3.43Å; A622-D696 PolarHBondContact N-O 3.35Å; K626-D696 HydrophobicContact CD-CB 3.97Å; K626-D696 IonicContact NZ-OD2 2.91Å; K626-D696 PolarHBondContact NZ-OD2 3.16Å
697	S	85.9	Confident	87.1	Confident	51 Å²	51	67.8 Å²	67.8	36%	0.357	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	138.7	178.7	64.1	0	0	0	0	112.9	I620 V695	I620-S697 CarbonylContact O-C 3.59Å; I620-S697 VanDerWaalsContact O-CA 3.23Å; I620-S697 WeakPolarHBondContact O-CA 3.38Å; V695-S697 WeakPolarHBondContact CG1-O 3.34Å
698	I	87.5	Confident	87.1	Confident	4 Å²	4	66.7 Å²	66.7	2%	0.021	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	126	-177.8	-59.4	-174.2	0	0	0	109.2	C615 N619 I620 L688 V695 V702 C704	C615-I698 WeakPolarHBondContact SG-CG2 3.46Å; N619-I698 CarbonylContact C-O 3.44Å; N619-I698 VanDerWaalsContact CA-O 3.26Å; N619-I698 WeakPolarHBondContact CA-O 3.47Å; I620-I698 HydrophobicContact CB-CB 4.44Å; I620-I698 PolarHBondContact N-O 3.39Å; I620-I698 PolarHBondContact O-N 3.34Å; L688-I698 HydrophobicContact CD1-CD1 3.64Å; L688-I698 HydrophobicContact CD1-CG1 4.47Å; L688-I698 HydrophobicContact CD2-CD1 3.93Å; L688-I698 HydrophobicContact CD2-CG1 3.9Å; L688-I698 HydrophobicContact CG-CD1 3.66Å; L688-I698 HydrophobicContact CG-CG1 4.18Å; V695-I698 HydrophobicContact CB-CG1 4.43Å; V695-I698 HydrophobicContact CG1-CG1 4.15Å; I698-V702 HydrophobicContact CG2-CB 3.68Å; I698-V702 HydrophobicContact CG2-CG1 3.76Å; I698-C704 HydrophobicContact CD1-CB 3.12Å; I698-C704 HydrophobicContact CG1-CB 4.45Å; I698-C704 HydrophobicContact CG2-CB 4.29Å
699	R	87.3	Confident	86.8	Confident	194 Å²	194	66.9 Å²	66.9	73%	0.732	34%	0.343	S	S	*	.			trans	-83	162.8	-179	-63.1	-179.8	-179.5	-176.8	-1.8	111.3	C615 G701 V702	C615-R699 WeakPolarHBondContact CB-O 3.41Å; R699-G701 PolarHBondContact O-N 3.04Å; R699-V702 WeakPolarHBondContact O-CB 3.46Å; R699-V702 PolarHBondContact O-N 3.23Å
700	K	89.3	Confident	86	Confident	145 Å²	145	62.5 Å²	62.5	63%	0.63	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.4	135.5	172.2	177.6	172.4	175.2	177.5	0	112.6	I616 G618 V702	I616-K700 VanDerWaalsContact O-CD 3.25Å; I616-K700 WeakPolarHBondContact O-CD 3.49Å; I616-K700 WeakPolarHBondContact O-CE 3.32Å; I616-K700 VanDerWaalsContact O-CG 3.32Å; I616-K700 WeakPolarHBondContact O-CG 3.37Å; G618-K700 PolarHBondContact O-N 3.11Å; K700-V702 VanDerWaalsContact C-N 3.33Å
701	G	88	Confident	84.8	Confident	52 Å²	52	63.2 Å²	63.2	54%	0.536	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.7	-7	175.9	0	0	0	0	0	115.4	C615 R699	C615-G701 PolarHBondContact O-N 2.9Å; R699-G701 PolarHBondContact O-N 3.04Å
702	V	91	Very high	83.6	Confident	50 Å²	50	63.8 Å²	63.8	30%	0.303	34%	0.343	S	S	.	.			trans	-91.7	141.2	-179.1	178.7	0	0	0	0	110.4	C615 H690 I698 R699 K700	C615-V702 PolarHBondContact N-O 2.95Å; H690-V702 WeakPolarHBondContact CD2-CG1 3.46Å; H690-V702 WeakPolarHBondContact NE2-CG1 3.47Å; I698-V702 HydrophobicContact CG2-CB 3.68Å; I698-V702 HydrophobicContact CG2-CG1 3.76Å; R699-V702 WeakPolarHBondContact O-CB 3.46Å; R699-V702 PolarHBondContact O-N 3.23Å; K700-V702 VanDerWaalsContact C-N 3.33Å
703	D	92	Very high	81.9	Confident	73 Å²	73	56.9 Å²	56.9	39%	0.39	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	137.7	179.3	-68.9	-19.3	0	0	0	110.9	C613 R614 H690	C613-D703 CarbonylContact O-C 3.6Å; C613-D703 WeakPolarHBondContact O-CA 3.32Å; R614-D703 WeakPolarHBondContact CB-OD1 3.46Å; R614-D703 WeakPolarHBondContact CG-OD1 3.39Å; R614-D703 IonicContact CZ-OD1 3.39Å; R614-D703 IonicContact CZ-OD2 3.89Å; R614-D703 IonicContact NE-OD1 3.57Å; R614-D703 PolarHBondContact NE-OD1 2.7Å; R614-D703 IonicContact NE-OD2 3.67Å; R614-D703 IonicContact NH2-OD1 3.19Å; R614-D703 PolarHBondContact NH2-OD1 3.47Å; R614-D703 IonicContact NH2-OD2 2.95Å; R614-D703 PolarHBondContact NH2-OD2 3.21Å; H690-D703 PolarHBondContact CD2-O 3.19Å
704	C	90.1	Very high	79.9	Confident	6 Å²	6	59 Å²	59	4%	0.041	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	141.1	-172.1	65.4	0	0	0	0	113.1	G612 C613 L688 I698	G612-C704 CarbonylContact C-O 3.58Å; G612-C704 WeakPolarHBondContact CA-O 3.43Å; C613-C704 PolarHBondContact N-O 3.13Å; C613-C704 PolarHBondContact O-N 3.48Å; C613-C704 PolarHBondContact O-SG 3.33Å; L688-C704 HydrophobicContact CD1-CB 4.28Å; I698-C704 HydrophobicContact CD1-CB 3.12Å; I698-C704 HydrophobicContact CG1-CB 4.45Å; I698-C704 HydrophobicContact CG2-CB 4.29Å
705	G	89.7	Confident	77.9	Confident	17 Å²	17	61 Å²	61	18%	0.175	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	118.2	165.4	0	0	0	0	0	110.3	A611 R689	A611-G705 CarbonylContact O-C 3.46Å; A611-G705 WeakPolarHBondContact O-CA 3.43Å; R689-G705 PolarHBondContact N-O 3.04Å; R689-G705 PolarHBondContact O-N 3.18Å
706	I	88.1	Confident	76	Confident	1 Å²	1	63.5 Å²	63.5	1%	0.005	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	138.3	178.1	-48.9	-169.9	0	0	0	109.9	A611 I620 L688 L708 I738	A611-I706 PolarHBondContact N-O 2.86Å; A611-I706 PolarHBondContact O-N 2.97Å; I620-I706 HydrophobicContact CD1-CD1 3.92Å; I620-I706 HydrophobicContact CG2-CD1 4.08Å; L688-I706 HydrophobicContact CD1-CD1 4.01Å; L688-I706 HydrophobicContact CD1-CG1 3.61Å; I706-L708 HydrophobicContact CG2-CD2 3.61Å; I706-L708 HydrophobicContact CG2-CG 3.9Å; I706-I738 HydrophobicContact CD1-CD1 4.25Å
707	V	87	Confident	74.1	Confident	6 Å²	6	69 Å²	69	4%	0.036	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	120.5	169.6	-175.6	0	0	0	0	108.5	L608 V610 Y686 S687 F728	L608-V707 HydrophobicContact CD1-CG1 4.01Å; L608-V707 HydrophobicContact CD2-CG1 4.12Å; L608-V707 HydrophobicContact CD2-CG2 3.99Å; L608-V707 HydrophobicContact CG-CG1 4.07Å; V610-V707 HydrophobicContact CB-CG2 4.28Å; V610-V707 HydrophobicContact CG1-CG2 4.11Å; V610-V707 HydrophobicContact CG2-CG2 3.77Å; Y686-V707 HydrophobicContact CD1-CB 4.43Å; Y686-V707 HydrophobicContact CD1-CG1 4.07Å; Y686-V707 HydrophobicContact CG-CG1 4.5Å; Y686-V707 PolarHBondContact N-O 2.93Å; S687-V707 PolarHBondContact N-O 3.4Å; S687-V707 PolarHBondContact O-N 3.41Å; V707-F728 HydrophobicContact CG1-CD1 4.21Å; V707-F728 HydrophobicContact CG1-CE1 4.12Å
708	L	83.7	Confident	71.9	Confident	0 Å²	0	70 Å²	70	0%	0	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	145.4	-178.7	-57.7	175.2	0	0	0	111.9	Y645 I647 A683 N684 C685 I706 I729 W732 I738	Y645-L708 HydrophobicContact CD1-CD2 4.28Å; Y645-L708 HydrophobicContact CD2-CD2 4.2Å; Y645-L708 HydrophobicContact CG-CD2 3.89Å; I647-L708 HydrophobicContact CD1-CD1 4.03Å; I647-L708 HydrophobicContact CG1-CD1 4.13Å; A683-L708 HydrophobicContact CB-CB 3.72Å; A683-L708 HydrophobicContact CB-CD1 4.14Å; A683-L708 HydrophobicContact CB-CD2 4.35Å; A683-L708 HydrophobicContact CB-CG 4.29Å; N684-L708 WeakPolarHBondContact O-CA 3.21Å; C685-L708 HydrophobicContact CB-CD2 4.29Å; I706-L708 HydrophobicContact CG2-CD2 3.61Å; I706-L708 HydrophobicContact CG2-CG 3.9Å; L708-I729 HydrophobicContact CB-CD1 4.49Å; L708-W732 HydrophobicContact CB-CZ2 3.88Å; L708-W732 HydrophobicContact CD1-CZ2 4.44Å; L708-W732 HydrophobicContact CG-CZ2 4.27Å; L708-I738 HydrophobicContact CD1-CD1 4.23Å; L708-I738 HydrophobicContact CD1-CG2 4.49Å
709	V	79.7	Confident	69.2	Low	8 Å²	8	77.4 Å²	77.4	5%	0.048	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	143.3	179.1	176.8	0	0	0	0	109.2	A683 N684 Y686 N727 F728	A683-V709 CarbonylContact C-O 3.58Å; A683-V709 VanDerWaalsContact CA-O 3.31Å; A683-V709 WeakPolarHBondContact CA-O 2.98Å; N684-V709 PolarHBondContact N-O 3.11Å; N684-V709 PolarHBondContact O-N 3.2Å; Y686-V709 HydrophobicContact CD2-CG2 4.37Å; Y686-V709 HydrophobicContact CG-CG2 4.25Å; V709-N727 WeakPolarHBondContact CA-O 3.18Å; V709-N727 HydrophobicContact CG1-CB 4.22Å; V709-F728 HydrophobicContact CG2-CD1 3.62Å; V709-F728 HydrophobicContact CG2-CE1 3.37Å; V709-F728 HydrophobicContact CG2-CZ 4.12Å
710	S	73	Confident	66.6	Low	28 Å²	28	75.7 Å²	75.7	20%	0.196	42%	0.423	C	S	.	.			trans	-64.8	143.5	177.1	-59.2	0	0	0	0	112	E712 N727	S710-E712 PolarHBondContact O-N 3.01Å; S710-E712 VanDerWaalsContact O-N 3.14Å; S710-N727 PolarHBondContact N-O 2.91Å; S710-N727 PolarHBondContact OG-O 2.91Å
711	P	64.8	Low	64.4	Low	66 Å²	66	76.7 Å²	76.7	43%	0.429	43%	0.43	S	S	.	.	S	Bend	trans	-72.7	-2.9	-170	27.5	-35.9	0	0	0	115.4	R682 V713	R682-P711 HydrophobicContact CB-CG 4.45Å; R682-P711 WeakPolarHBondContact O-CD 3.42Å; P711-V713 PolarHBondContact O-N 3.27Å
712	E	58.5	Low	62.4	Low	182 Å²	182	80.1 Å²	80.1	85%	0.85	44%	0.436	S	S	*	.			trans	-69.2	11.4	-176.8	-62.3	-174.2	167.9	0	0	115.1	S710	S710-E712 PolarHBondContact O-N 3.01Å; S710-E712 VanDerWaalsContact O-N 3.14Å
713	V	49.1	Very low	60.5	Low	53 Å²	53	79.6 Å²	79.6	32%	0.321	43%	0.433	S	S	.	.	S	Bend	trans	-120	113.3	179.6	-170.2	0	0	0	0	110.4	P711 N727	P711-V713 PolarHBondContact O-N 3.27Å; V713-N727 WeakPolarHBondContact CG2-ND2 3.34Å
714	P	43.4	Very low	58.5	Low	106 Å²	106	78.3 Å²	78.3	69%	0.688	43%	0.43	S	S	*	.			trans	-72.7	138.3	172.3	28.9	-29.5	0	0	0	110.8
715	D	43.1	Very low	56.6	Low	134 Å²	134	79.4 Å²	79.4	72%	0.717	44%	0.439	S	S	*	.			trans	64.3	82.8	161.2	-54.2	-26.5	0	0	0	119.3	H717	D715-H717 PolarHBondContact O-N 3.24Å
716	I	43	Very low	54.7	Low	94 Å²	94	87.8 Å²	87.8	48%	0.482	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-1.7	173.7	-62	170.9	0	0	0	112.8
717	H	42.9	Very low	53.3	Low	178 Å²	178	89.8 Å²	89.8	82%	0.824	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	5.3	-176.2	-70.8	-57	0	0	0	115.9	D715	D715-H717 PolarHBondContact O-N 3.24Å
718	S	37.9	Very low	52.3	Low	73 Å²	73	90.2 Å²	90.2	51%	0.51	48%	0.483	S	S	.	.	S	Bend	trans	-101.6	116.1	168.6	65.2	0	0	0	0	110.8	N720	S718-N720 PolarHBondContact O-N 3.42Å
719	N	31.2	Very low	51.4	Low	159 Å²	159	90.5 Å²	90.5	85%	0.85	48%	0.484	S	S	*	.	S	Bend	trans	-49.9	129.3	175.4	-84.9	-31.9	0	0	0	110.8
720	N	34	Very low	50.6	Low	159 Å²	159	94.9 Å²	94.9	85%	0.85	52%	0.515	S	S	*	.			trans	82	62.2	168.9	-60.2	-27.9	0	0	0	119.1	S718	S718-N720 PolarHBondContact O-N 3.42Å
721	Q	43.1	Very low	50.4	Low	166 Å²	166	100 Å²	100	78%	0.776	54%	0.536	S	S	*	.			trans	-130	128.5	154.3	-66.3	-166.7	12	0	0	113	V723	Q721-V723 PolarHBondContact O-N 2.93Å
722	N	46	Very low	51	Low	123 Å²	123	97.7 Å²	97.7	66%	0.658	52%	0.519	S	S	*	.			trans	-68.6	110.4	-178.8	-72.5	-40.1	0	0	0	110.9	S601 S724	S601-N722 PolarHBondContact O-OD1 3.06Å; N722-S724 PolarHBondContact O-N 2.8Å
723	V	50.6	Low	52.1	Low	39 Å²	39	94.7 Å²	94.7	24%	0.236	50%	0.503	C	S	.	.			trans	-71.5	125.9	173.7	-177	0	0	0	0	109.4	Q721 N727 F728	Q721-V723 PolarHBondContact O-N 2.93Å; V723-N727 HydrophobicContact CG1-CB 3.85Å; V723-F728 HydrophobicContact CG1-CE2 4.15Å; V723-F728 HydrophobicContact CG1-CZ 4.42Å
724	S	49.7	Very low	53.7	Low	47 Å²	47	96.9 Å²	96.9	33%	0.329	52%	0.516	S	S	.	.			trans	-69.4	138.1	178.8	-162.2	0	0	0	0	110.1	N722 K726 N727	N722-S724 PolarHBondContact O-N 2.8Å; S724-K726 PolarHBondContact O-N 3.14Å; S724-N727 WeakPolarHBondContact O-CB 3.47Å; S724-N727 PolarHBondContact O-N 2.82Å; S724-N727 PolarHBondContact O-OD1 3.48Å
725	A	49.5	Very low	55.6	Low	29 Å²	29	92.8 Å²	92.8	24%	0.24	49%	0.494	C	S	.	.	G	3₁₀ helix	trans	-59.6	-12.2	-176	0	0	0	0	0	114.8	V603 K604 T605 N727	V603-A725 HydrophobicContact CG1-CB 3.89Å; K604-A725 HydrophobicContact CB-CB 4.36Å; T605-A725 HydrophobicContact CG2-CB 3.86Å; A725-N727 PolarHBondContact O-N 2.89Å
726	K	50.1	Low	57.7	Low	193 Å²	193	86.6 Å²	86.6	84%	0.839	46%	0.46	S	S	*	.	G	3₁₀ helix	trans	-70.7	-13.4	173	-70.8	-172.2	175.8	-175.2	0	113.5	S724	S724-K726 PolarHBondContact O-N 3.14Å
727	N	60	Low	59.9	Low	42 Å²	42	83.7 Å²	83.7	23%	0.225	45%	0.446	C	S	.	.	G	3₁₀ helix	trans	-93.5	-5.2	-171	-56.8	8.9	0	0	0	112.9	V709 S710 V713 V723 S724 A725	V709-N727 WeakPolarHBondContact CA-O 3.18Å; V709-N727 HydrophobicContact CG1-CB 4.22Å; S710-N727 PolarHBondContact N-O 2.91Å; S710-N727 PolarHBondContact OG-O 2.91Å; V713-N727 WeakPolarHBondContact CG2-ND2 3.34Å; V723-N727 HydrophobicContact CG1-CB 3.85Å; S724-N727 WeakPolarHBondContact O-CB 3.47Å; S724-N727 PolarHBondContact O-N 2.82Å; S724-N727 PolarHBondContact O-OD1 3.48Å; A725-N727 PolarHBondContact O-N 2.89Å
728	F	64.4	Low	62.1	Low	15 Å²	15	75.3 Å²	75.3	7%	0.066	41%	0.407	C	S	.	.	B	Isolated β-bridge	trans	-92.6	127.7	176.8	-67.6	-83.5	0	0	0	110.4	V603 L608 P609 V707 V709 V723 S730	V603-F728 HydrophobicContact CG1-CD2 4.46Å; V603-F728 HydrophobicContact CG1-CE2 4.38Å; V603-F728 HydrophobicContact CG2-CD2 4.48Å; V603-F728 HydrophobicContact CG2-CE2 3.82Å; V603-F728 HydrophobicContact CG2-CZ 4.08Å; L608-F728 HydrophobicContact CD1-CD1 4.02Å; L608-F728 HydrophobicContact CD1-CE1 3.6Å; L608-F728 HydrophobicContact CD1-CZ 3.88Å; P609-F728 HydrophobicContact CG-CB 4.17Å; V707-F728 HydrophobicContact CG1-CD1 4.21Å; V707-F728 HydrophobicContact CG1-CE1 4.12Å; V709-F728 HydrophobicContact CG2-CD1 3.62Å; V709-F728 HydrophobicContact CG2-CE1 3.37Å; V709-F728 HydrophobicContact CG2-CZ 4.12Å; V723-F728 HydrophobicContact CG1-CE2 4.15Å; V723-F728 HydrophobicContact CG1-CZ 4.42Å; F728-S730 PolarHBondContact O-N 3.49Å
729	I	65.9	Low	64.6	Low	6 Å²	6	72.4 Å²	72.4	3%	0.031	39%	0.385	C	S	.	.			trans	-72.8	117.7	-178.1	-56	170.1	0	0	0	108.2	I647 D681 A683 L708 W732	I647-I729 HydrophobicContact CD1-CG2 4.15Å; D681-I729 HydrophobicContact CB-CD1 4.06Å; D681-I729 HydrophobicContact CB-CG2 4.35Å; D681-I729 WeakPolarHBondContact OD2-CD1 3.19Å; D681-I729 WeakPolarHBondContact OD2-CG1 3.32Å; D681-I729 WeakPolarHBondContact OD2-CG2 3.12Å; A683-I729 HydrophobicContact CB-CD1 3.33Å; L708-I729 HydrophobicContact CB-CD1 4.49Å; I729-W732 HydrophobicContact CB-CZ2 4.48Å; I729-W732 VanDerWaalsContact CG2-NE1 3.34Å; I729-W732 VanDerWaalsContact O-CE2 3.26Å; I729-W732 WeakPolarHBondContact O-CZ2 3.24Å; I729-W732 PolarHBondContact O-NE1 2.95Å
730	S	62.1	Low	67.3	Low	100 Å²	100	64.9 Å²	64.9	70%	0.699	35%	0.345	S	S	*	.			trans	-107.7	-0.6	-177.8	50.6	0	0	0	0	113.7	F728 W732	F728-S730 PolarHBondContact O-N 3.49Å; S730-W732 VanDerWaalsContact C-N 3.3Å; S730-W732 PolarHBondContact O-N 3.01Å
731	Q	69.6	Low	69.8	Low	137 Å²	137	57.6 Å²	57.6	64%	0.64	31%	0.306	S	S	*	.			trans	-90.7	25.1	-173	-60.3	-172.1	5	0	0	114.5	R649	R649-Q731 PolarHBondContact NH2-O 2.74Å
732	W	77.5	Confident	71.7	Confident	17 Å²	17	49.7 Å²	49.7	6%	0.064	27%	0.269	C	S	.	.			trans	-72.6	138.6	-179.5	-54.4	-19	0	0	0	111	I590 L593 P609 A611 I647 L708 I729 S730	I590-W732 HydrophobicContact CD1-CB 4.33Å; L593-W732 HydrophobicContact CD1-CB 4.28Å; L593-W732 VanDerWaalsContact CD1-O 3.23Å; L593-W732 WeakPolarHBondContact CD1-O 3.24Å; L593-W732 HydrophobicContact CD2-CB 3.5Å; L593-W732 VanDerWaalsContact CD2-CB 3.5Å; L593-W732 HydrophobicContact CD2-CD2 4.3Å; L593-W732 HydrophobicContact CD2-CE3 3.7Å; L593-W732 HydrophobicContact CD2-CG 4.3Å; P609-W732 HydrophobicContact CB-CH2 4.34Å; P609-W732 HydrophobicContact CB-CZ3 4.03Å; A611-W732 HydrophobicContact CB-CD2 4.29Å; A611-W732 HydrophobicContact CB-CE3 3.55Å; A611-W732 HydrophobicContact CB-CH2 4.35Å; A611-W732 HydrophobicContact CB-CZ3 3.6Å; I647-W732 VanDerWaalsContact CD1-CD1 3.49Å; I647-W732 VanDerWaalsContact CD1-NE1 3.35Å; L708-W732 HydrophobicContact CB-CZ2 3.88Å; L708-W732 HydrophobicContact CD1-CZ2 4.44Å; L708-W732 HydrophobicContact CG-CZ2 4.27Å; I729-W732 HydrophobicContact CB-CZ2 4.48Å; I729-W732 VanDerWaalsContact CG2-NE1 3.34Å; I729-W732 VanDerWaalsContact O-CE2 3.26Å; I729-W732 WeakPolarHBondContact O-CZ2 3.24Å; I729-W732 PolarHBondContact O-NE1 2.95Å; S730-W732 VanDerWaalsContact C-N 3.3Å; S730-W732 PolarHBondContact O-N 3.01Å
733	K	81	Confident	73.5	Confident	119 Å²	119	44.5 Å²	44.5	52%	0.517	24%	0.241	S	C	.	.			trans	-116.7	152.3	168.6	-64.6	-174.9	-176	178.3	0	110.4	G735 D736	K733-G735 PolarHBondContact O-N 2.84Å; K733-D736 PolarHBondContact N-OD2 3.4Å; K733-D736 WeakPolarHBondContact O-CB 3.32Å; K733-D736 PolarHBondContact O-N 2.76Å; K733-D736 VanDerWaalsContact O-N 3.16Å
734	V	83.5	Confident	74.9	Confident	98 Å²	98	42.7 Å²	42.7	59%	0.594	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.5	130.5	169.6	178.4	0	0	0	0	108.2	L591	L591-V734 VanDerWaalsContact O-CG1 3.29Å; L591-V734 WeakPolarHBondContact O-CG1 3.42Å
735	G	82.9	Confident	76.2	Confident	21 Å²	21	41.9 Å²	41.9	22%	0.216	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.1	-2.2	-173.4	0	0	0	0	0	115.3	I590 K733	I590-G735 PolarHBondContact O-N 2.99Å; K733-G735 PolarHBondContact O-N 2.84Å
736	D	87.7	Confident	77.5	Confident	4 Å²	4	43.6 Å²	43.6	2%	0.021	23%	0.228	C	C	.	.			trans	-71.4	142.2	168.4	-71.7	-16.6	0	0	0	109.6	I590 I647 R649 K733	I590-D736 HydrophobicContact CD1-CB 3.89Å; I590-D736 WeakPolarHBondContact CG1-O 3.33Å; I590-D736 PolarHBondContact N-O 3.15Å; I647-D736 HydrophobicContact CG2-CB 3.96Å; R649-D736 WeakPolarHBondContact CB-OD1 3.22Å; R649-D736 VanDerWaalsContact CG-OD1 3.29Å; R649-D736 WeakPolarHBondContact CG-OD1 3.33Å; R649-D736 IonicContact CZ-OD1 2.88Å; R649-D736 IonicContact CZ-OD2 3.78Å; R649-D736 IonicContact NE-OD1 2.83Å; R649-D736 PolarHBondContact NE-OD1 3.21Å; R649-D736 IonicContact NE-OD2 2.69Å; R649-D736 IonicContact NH2-OD1 3.25Å; R649-D736 IonicContact NH2-OD2 2.62Å; R649-D736 PolarHBondContact NH2-OD2 2.81Å; K733-D736 PolarHBondContact N-OD2 3.4Å; K733-D736 WeakPolarHBondContact O-CB 3.32Å; K733-D736 PolarHBondContact O-N 2.76Å; K733-D736 VanDerWaalsContact O-N 3.16Å
737	I	89	Confident	78.5	Confident	33 Å²	33	43.8 Å²	43.8	17%	0.169	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	122.4	-179.8	-58.1	172.4	0	0	0	109.3	E587 A588 V648 Q739	E587-I737 HydrophobicContact CB-CG2 4.18Å; A588-I737 CarbonylContact O-C 3.56Å; A588-I737 WeakPolarHBondContact O-CA 3.41Å; V648-I737 HydrophobicContact CB-CB 4.49Å; V648-I737 PolarHBondContact N-O 3.27Å; V648-I737 PolarHBondContact O-N 3.36Å; I737-Q739 HydrophobicContact CG2-CG 4.13Å
738	I	89.1	Confident	79	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.005	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	114.8	170.2	-59	176.7	0	0	0	108.3	E587 A588 I590 C613 Y645 I706 L708	E587-I738 CarbonylContact C-O 3.55Å; E587-I738 WeakPolarHBondContact CA-O 3.46Å; A588-I738 HydrophobicContact CB-CB 4.25Å; A588-I738 PolarHBondContact N-O 2.94Å; A588-I738 PolarHBondContact O-N 2.84Å; I590-I738 HydrophobicContact CD1-CD1 3.91Å; I590-I738 HydrophobicContact CD1-CG1 3.83Å; I590-I738 HydrophobicContact CG1-CD1 3.81Å; I590-I738 HydrophobicContact CG1-CG1 3.95Å; C613-I738 VanDerWaalsContact SG-CD1 3.53Å; Y645-I738 HydrophobicContact CD1-CG2 3.64Å; Y645-I738 HydrophobicContact CE1-CG2 4.4Å; I706-I738 HydrophobicContact CD1-CD1 4.25Å; L708-I738 HydrophobicContact CD1-CD1 4.23Å; L708-I738 HydrophobicContact CD1-CG2 4.49Å
739	Q	89.4	Confident	79.3	Confident	13 Å²	13	46 Å²	46	6%	0.061	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	124.3	172.3	-64.9	-176.6	-36.3	0	0	109.6	E587 Y645 R646 V648 I737	E587-Q739 HydrophobicContact CG-CG 4.13Å; E587-Q739 PolarHBondContact OE1-NE2 2.83Å; Y645-Q739 WeakPolarHBondContact CA-O 3.1Å; R646-Q739 HydrophobicContact CG-CB 3.85Å; R646-Q739 PolarHBondContact N-O 2.76Å; R646-Q739 PolarHBondContact O-N 3.38Å; V648-Q739 HydrophobicContact CG2-CG 4.2Å; I737-Q739 HydrophobicContact CG2-CG 4.13Å
740	C	87.3	Confident	79.5	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.007	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	120.4	171	-178.3	0	0	0	0	108.1	I584 I585 G586 Y645	I584-C740 CarbonylContact C-O 3.57Å; I585-C740 PolarHBondContact N-O 3.08Å; G586-C740 PolarHBondContact N-O 2.75Å; G586-C740 PolarHBondContact O-N 3.05Å; Y645-C740 HydrophobicContact CD1-CB 4.02Å; Y645-C740 HydrophobicContact CE1-CB 3.71Å
741	Y	86.8	Confident	79.8	Confident	6 Å²	6	48.7 Å²	48.7	2%	0.024	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	151.2	178.5	66.6	-84.1	0	0	0	110.4	E582 K583 C644 R646	E582-Y741 HydrophobicContact CB-CD2 3.9Å; E582-Y741 HydrophobicContact CB-CE2 4.44Å; E582-Y741 HydrophobicContact CG-CD2 3.77Å; E582-Y741 HydrophobicContact CG-CE2 3.8Å; K583-Y741 CarbonylContact O-C 3.52Å; K583-Y741 VanDerWaalsContact O-CA 3.25Å; K583-Y741 WeakPolarHBondContact O-CA 3.32Å; K583-Y741 WeakPolarHBondContact O-CB 3.41Å; C644-Y741 HydrophobicContact CB-CD1 4.45Å; C644-Y741 HydrophobicContact CB-CD2 4.31Å; C644-Y741 HydrophobicContact CB-CE1 3.81Å; C644-Y741 HydrophobicContact CB-CE2 3.67Å; C644-Y741 PolarHBondContact N-O 3.3Å; C644-Y741 WeakPolarHBondContact O-CD1 3.44Å; C644-Y741 PolarHBondContact O-N 2.85Å; R646-Y741 HydrophobicContact CB-CD1 4.48Å; R646-Y741 HydrophobicContact CB-CE1 3.85Å; R646-Y741 HydrophobicContact CG-CD1 3.97Å; R646-Y741 HydrophobicContact CG-CE1 3.8Å
742	V	84.3	Confident	79.8	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	136.7	174.1	167.5	0	0	0	0	108.7	K583 I585 I627 P640 E642 L643 I744	K583-V742 PolarHBondContact N-O 2.96Å; K583-V742 PolarHBondContact O-N 3.5Å; I585-V742 HydrophobicContact CD1-CB 3.95Å; I585-V742 HydrophobicContact CD1-CG2 3.21Å; I585-V742 HydrophobicContact CG1-CB 4.38Å; I585-V742 HydrophobicContact CG1-CG2 4.01Å; I627-V742 HydrophobicContact CD1-CG2 3.83Å; I627-V742 HydrophobicContact CG2-CG2 4.39Å; P640-V742 HydrophobicContact CB-CG1 3.73Å; E642-V742 WeakPolarHBondContact O-CA 3.29Å; L643-V742 HydrophobicContact CB-CG2 4.1Å; L643-V742 HydrophobicContact CD1-CG2 3.73Å; L643-V742 HydrophobicContact CG-CG2 4.1Å; V742-I744 HydrophobicContact CG1-CG1 3.86Å
743	T	82.4	Confident	79.2	Confident	14 Å²	14	46.7 Å²	46.7	9%	0.086	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	121.2	171	-47.2	0	0	0	0	107.9	L580 T641 E642	L580-T743 HydrophobicContact CB-CG2 3.6Å; L580-T743 HydrophobicContact CD1-CG2 4.21Å; L580-T743 HydrophobicContact CD2-CG2 3.88Å; L580-T743 HydrophobicContact CG-CG2 4.09Å; T641-T743 PolarHBondContact N-O 3.16Å; T641-T743 PolarHBondContact OG1-O 3Å; E642-T743 PolarHBondContact O-N 3.47Å
744	I	81	Confident	78.2	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	131.6	179.7	-56	-179.7	0	0	0	107.7	L580 V581 K583 L631 V636 V742 E746	L580-I744 WeakPolarHBondContact CA-O 3.41Å; V581-I744 PolarHBondContact N-O 2.78Å; V581-I744 PolarHBondContact O-N 3.33Å; K583-I744 HydrophobicContact CB-CD1 4.18Å; K583-I744 HydrophobicContact CD-CD1 3.69Å; K583-I744 HydrophobicContact CG-CD1 4Å; L631-I744 HydrophobicContact CD2-CD1 3.94Å; V636-I744 HydrophobicContact CG1-CD1 3.4Å; V742-I744 HydrophobicContact CG1-CG1 3.86Å; I744-E746 HydrophobicContact CG2-CG 4.31Å; I744-E746 PolarHBondContact O-N 3.41Å
745	S	76.3	Confident	76.8	Confident	30 Å²	30	45.6 Å²	45.6	21%	0.21	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	101.3	170.8	47.4	0	0	0	0	109.2	E639	E639-S745 PolarHBondContact O-OG 2.81Å
746	E	76.6	Confident	75.2	Confident	65 Å²	65	48 Å²	48	30%	0.304	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	138.4	170.4	-68.6	-172.6	174.7	0	0	109.3	S578 V579 V581 K583 I744 S748	S578-E746 CarbonylContact C-O 3.5Å; S578-E746 VanDerWaalsContact CA-O 3.29Å; S578-E746 WeakPolarHBondContact CA-O 3.22Å; S578-E746 WeakPolarHBondContact CB-O 3.43Å; V579-E746 PolarHBondContact N-O 2.86Å; V579-E746 PolarHBondContact O-N 3.08Å; V581-E746 HydrophobicContact CB-CG 4.41Å; V581-E746 HydrophobicContact CG2-CB 4.24Å; V581-E746 HydrophobicContact CG2-CG 4.16Å; V581-E746 WeakPolarHBondContact CG2-OE2 3.1Å; K583-E746 WeakPolarHBondContact CE-OE1 3.49Å; K583-E746 IonicContact NZ-OE1 2.84Å; K583-E746 PolarHBondContact NZ-OE1 3.13Å; I744-E746 HydrophobicContact CG2-CG 4.31Å; I744-E746 PolarHBondContact O-N 3.41Å; E746-S748 PolarHBondContact O-N 3.46Å
747	K	71.9	Confident	73	Confident	198 Å²	198	50.5 Å²	50.5	86%	0.861	27%	0.268	S	S	*	.	P	Polyproline II helix	trans	-68.5	126.6	173.6	-68.1	-176	179.7	-178.6	0	108.2
748	S	71.1	Confident	71	Confident	17 Å²	17	50.9 Å²	50.9	12%	0.119	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-69.5	130.8	170.5	34.9	0	0	0	0	109.2	L576 P577 E746	L576-S748 VanDerWaalsContact CB-OG 3.24Å; L576-S748 WeakPolarHBondContact CB-OG 3.34Å; P577-S748 PolarHBondContact O-OG 3.24Å; E746-S748 PolarHBondContact O-N 3.46Å
749	S	71.1	Confident	68.7	Low	86 Å²	86	54.6 Å²	54.6	60%	0.601	30%	0.296	S	S	*	.			trans	-115.7	135.5	166.8	56.5	0	0	0	0	109.1
750	V	69.4	Low	66.1	Low	20 Å²	20	61.3 Å²	61.3	12%	0.121	33%	0.328	C	S	.	.			trans	-94.1	120.7	169.3	179.9	0	0	0	0	108.5	Y501 P502 N573 L576 W752	Y501-V750 HydrophobicContact CE2-CB 4.47Å; Y501-V750 HydrophobicContact CE2-CG1 3.93Å; P502-V750 HydrophobicContact CG-CG1 4.48Å; N573-V750 PolarHBondContact OD1-N 3.02Å; L576-V750 HydrophobicContact CD1-CG2 3.59Å; V750-W752 VanDerWaalsContact C-N 3.33Å; V750-W752 HydrophobicContact CG1-CB 4.42Å; V750-W752 PolarHBondContact O-N 2.92Å
751	D	67.3	Low	63.6	Low	142 Å²	142	66.1 Å²	66.1	76%	0.759	36%	0.357	S	S	*	.			trans	-75.7	90.6	169.9	-67	-19.9	0	0	0	107.8
752	W	69.6	Low	60.9	Low	8 Å²	8	71.5 Å²	71.5	3%	0.03	39%	0.393	C	S	.	.			trans	-106.6	101	174.6	-178.3	25.4	0	0	0	109.3	L497 L498 Y501 R569 V750 F754	L497-W752 HydrophobicContact CD2-CH2 3.72Å; L497-W752 HydrophobicContact CD2-CZ2 3.95Å; L497-W752 WeakPolarHBondContact O-CZ2 3.21Å; L498-W752 HydrophobicContact CD2-CH2 4Å; Y501-W752 AromaticContact CD2-CD2 3.69Å; Y501-W752 HydrophobicContact CD2-CD2 3.69Å; Y501-W752 AromaticContact CD2-CE3 3.6Å; Y501-W752 HydrophobicContact CD2-CE3 3.6Å; Y501-W752 HydrophobicContact CD2-CG 4.11Å; Y501-W752 HydrophobicContact CD2-CH2 4.42Å; Y501-W752 AromaticContact CD2-CZ3 3.98Å; Y501-W752 HydrophobicContact CD2-CZ3 3.98Å; Y501-W752 HydrophobicContact CE2-CD2 4.5Å; Y501-W752 HydrophobicContact CE2-CE3 4.28Å; R569-W752 HydrophobicContact CB-CE3 4.16Å; R569-W752 HydrophobicContact CG-CE3 4.44Å; V750-W752 VanDerWaalsContact C-N 3.33Å; V750-W752 HydrophobicContact CG1-CB 4.42Å; V750-W752 PolarHBondContact O-N 2.92Å; W752-F754 HydrophobicContact CD2-CD1 4.12Å; W752-F754 AromaticContact CD2-CE1 3.56Å; W752-F754 HydrophobicContact CD2-CE1 3.56Å; W752-F754 HydrophobicContact CD2-CZ 4.13Å; W752-F754 AromaticContact CE2-CD1 3.82Å; W752-F754 AromaticContact CE2-CE1 3.61Å; W752-F754 HydrophobicContact CE3-CD1 4.44Å; W752-F754 AromaticContact CE3-CE1 3.47Å; W752-F754 HydrophobicContact CE3-CE1 3.47Å; W752-F754 VanDerWaalsContact CE3-CE1 3.47Å; W752-F754 AromaticContact CE3-CZ 3.81Å; W752-F754 HydrophobicContact CE3-CZ 3.81Å; W752-F754 HydrophobicContact CG-CE1 4.41Å; W752-F754 HydrophobicContact CH2-CD1 4.28Å; W752-F754 AromaticContact CH2-CE1 3.57Å; W752-F754 HydrophobicContact CH2-CE1 3.57Å; W752-F754 AromaticContact CZ2-CD1 3.9Å; W752-F754 HydrophobicContact CZ2-CD1 3.9Å; W752-F754 AromaticContact CZ2-CE1 3.62Å; W752-F754 HydrophobicContact CZ2-CE1 3.62Å; W752-F754 AromaticContact CZ3-CE1 3.48Å; W752-F754 HydrophobicContact CZ3-CE1 3.48Å; W752-F754 VanDerWaalsContact CZ3-CE1 3.48Å; W752-F754 HydrophobicContact CZ3-CZ 4.04Å
753	D	64.9	Low	58.3	Low	104 Å²	104	78.3 Å²	78.3	56%	0.556	43%	0.429	S	S	*	.			trans	-89.3	119.5	173.6	-72.5	-19.4	0	0	0	110.1	E755 T756	D753-E755 VanDerWaalsContact C-N 3.32Å; D753-E755 PolarHBondContact O-N 2.82Å; D753-T756 VanDerWaalsContact CB-OG1 3.27Å; D753-T756 WeakPolarHBondContact CB-OG1 3.23Å
754	F	60.5	Low	55.8	Low	32 Å²	32	83.7 Å²	83.7	14%	0.14	46%	0.462	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-25.5	-176.5	-59.7	-72.5	0	0	0	113.5	L497 A565 E566 W752 I758	L497-F754 HydrophobicContact CD2-CD1 4.17Å; L497-F754 HydrophobicContact CD2-CE1 4.12Å; A565-F754 HydrophobicContact CB-CD1 4.14Å; A565-F754 HydrophobicContact CB-CE1 3.39Å; A565-F754 HydrophobicContact CB-CE2 4.47Å; A565-F754 HydrophobicContact CB-CZ 3.59Å; E566-F754 HydrophobicContact CG-CE2 4.23Å; W752-F754 HydrophobicContact CD2-CD1 4.12Å; W752-F754 AromaticContact CD2-CE1 3.56Å; W752-F754 HydrophobicContact CD2-CE1 3.56Å; W752-F754 HydrophobicContact CD2-CZ 4.13Å; W752-F754 AromaticContact CE2-CD1 3.82Å; W752-F754 AromaticContact CE2-CE1 3.61Å; W752-F754 HydrophobicContact CE3-CD1 4.44Å; W752-F754 AromaticContact CE3-CE1 3.47Å; W752-F754 HydrophobicContact CE3-CE1 3.47Å; W752-F754 VanDerWaalsContact CE3-CE1 3.47Å; W752-F754 AromaticContact CE3-CZ 3.81Å; W752-F754 HydrophobicContact CE3-CZ 3.81Å; W752-F754 HydrophobicContact CG-CE1 4.41Å; W752-F754 HydrophobicContact CH2-CD1 4.28Å; W752-F754 AromaticContact CH2-CE1 3.57Å; W752-F754 HydrophobicContact CH2-CE1 3.57Å; W752-F754 AromaticContact CZ2-CD1 3.9Å; W752-F754 HydrophobicContact CZ2-CD1 3.9Å; W752-F754 AromaticContact CZ2-CE1 3.62Å; W752-F754 HydrophobicContact CZ2-CE1 3.62Å; W752-F754 AromaticContact CZ3-CE1 3.48Å; W752-F754 HydrophobicContact CZ3-CE1 3.48Å; W752-F754 VanDerWaalsContact CZ3-CE1 3.48Å; W752-F754 HydrophobicContact CZ3-CZ 4.04Å; F754-I758 WeakPolarHBondContact O-CD1 3.4Å; F754-I758 WeakPolarHBondContact O-CG1 3.43Å
755	E	54	Low	53.3	Low	162 Å²	162	95.4 Å²	95.4	76%	0.757	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-38	-171.8	-65	-169.4	159.5	0	0	113.4	D753	D753-E755 VanDerWaalsContact C-N 3.32Å; D753-E755 PolarHBondContact O-N 2.82Å
756	T	50.2	Low	51	Low	73 Å²	73	100.9 Å²	100.9	45%	0.448	53%	0.533	S	S	.	.	H	α-helix	trans	-73.9	-45.8	-175.7	44.9	0	0	0	0	111.4	D753 I758 S759 E760	D753-T756 VanDerWaalsContact CB-OG1 3.27Å; D753-T756 WeakPolarHBondContact CB-OG1 3.23Å; T756-I758 VanDerWaalsContact C-N 3.31Å; T756-I758 PolarHBondContact O-N 2.99Å; T756-S759 PolarHBondContact O-N 2.97Å; T756-S759 PolarHBondContact O-OG 3.43Å; T756-E760 PolarHBondContact O-N 3.48Å
757	C	41.3	Very low	48.9	Very low	56 Å²	56	103 Å²	103	38%	0.378	55%	0.553	S	S	.	*	H	α-helix	trans	-66.3	-25.7	-173.4	-63.4	0	0	0	0	114.7	T500	T500-C757 HydrophobicContact CG2-CB 3.42Å; T500-C757 VanDerWaalsContact CG2-CB 3.42Å
758	I	47.6	Very low	47	Very low	40 Å²	40	101.7 Å²	101.7	21%	0.205	55%	0.553	C	S	.	*	H	α-helix	trans	-81.8	-28.8	179.8	-52.6	172.5	0	0	0	111.1	A202 T500 F754 T756	A202-I758 HydrophobicContact CB-CB 4.08Å; A202-I758 HydrophobicContact CB-CD1 4.06Å; A202-I758 HydrophobicContact CB-CG2 3.54Å; T500-I758 HydrophobicContact CG2-CG1 4.35Å; F754-I758 WeakPolarHBondContact O-CD1 3.4Å; F754-I758 WeakPolarHBondContact O-CG1 3.43Å; T756-I758 VanDerWaalsContact C-N 3.31Å; T756-I758 PolarHBondContact O-N 2.99Å
759	S	40.7	Very low	45	Very low	79 Å²	79	110.3 Å²	110.3	55%	0.552	61%	0.605	S	S	*	*	H	α-helix	trans	-74.4	-28.5	178.8	71.7	0	0	0	0	113	T756 T761	T756-S759 PolarHBondContact O-N 2.97Å; T756-S759 PolarHBondContact O-OG 3.43Å; S759-T761 PolarHBondContact O-N 2.95Å
760	E	34.7	Very low	43.7	Very low	155 Å²	155	111.5 Å²	111.5	72%	0.724	61%	0.606	S	S	*	*			trans	-98.7	57.4	177.9	-63.3	-173.5	173.3	0	0	111.3	T756	T756-E760 PolarHBondContact O-N 3.48Å
761	T	34.4	Very low	42.3	Very low	101 Å²	101	116.3 Å²	116.3	62%	0.62	63%	0.631	S	S	*	*			trans	-66.3	127.9	159.3	45.8	0	0	0	0	108	S759 N763	S759-T761 PolarHBondContact O-N 2.95Å; T761-N763 PolarHBondContact O-N 3.06Å
762	P	30.6	Very low	40.9	Very low	119 Å²	119	114.9 Å²	114.9	77%	0.773	62%	0.624	S	S	*	*			trans	-69.4	105	-172.9	26.4	-31.9	0	0	0	109.3	T764	P762-T764 PolarHBondContact O-N 2.95Å
763	N	28.7	Very low	39.3	Very low	143 Å²	143	121.2 Å²	121.2	77%	0.765	66%	0.659	S	S	*	*			trans	-47.2	125.7	147	-80.5	-30.3	0	0	0	106.8	T761	T761-N763 PolarHBondContact O-N 3.06Å
764	T	29.3	Very low	37.6	Very low	127 Å²	127	122.3 Å²	122.3	78%	0.779	67%	0.665	S	S	*	*			trans	100	81.7	175.9	73.3	0	0	0	0	118.1	P762	P762-T764 PolarHBondContact O-N 2.95Å
765	R	29.2	Very low	36.1	Very low	246 Å²	246	128.3 Å²	128.3	93%	0.928	70%	0.7	S	S	*	*				-136.2	79.8	127.4	-78.6	-167.7	179.3	168.2	1.4	108.7
766	N	28.5	Very low	34.8	Very low	146 Å²	146	125.9 Å²	125.9	78%	0.781	70%	0.696	S	S	*	*			trans	-62	127.4	153.4	-81.2	-14.2	0	0	0	106.8	I768	N766-I768 PolarHBondContact O-N 2.85Å; N766-I768 VanDerWaalsContact O-N 3.11Å
767	P	32.5	Very low	33.7	Very low	110 Å²	110	129.9 Å²	129.9	71%	0.714	72%	0.715	S	S	*	*			trans	-69.6	109.9	167.2	29.1	-27.9	0	0	0	106.6	T769	P767-T769 VanDerWaalsContact C-N 3.26Å; P767-T769 PolarHBondContact O-N 2.65Å
768	I	31	Very low	33	Very low	169 Å²	169	136.1 Å²	136.1	87%	0.867	74%	0.744	S	S	*	*			trans	-71.4	93.7	161.3	-60.9	172	0	0	0	105.9	N766	N766-I768 PolarHBondContact O-N 2.85Å; N766-I768 VanDerWaalsContact O-N 3.11Å
769	T	29	Very low	31.7	Very low	198 Å²	198	144.8 Å²	144.8	100%	1.215	79%	0.793	S	S	*	*			trans	-144.5	0	151.1	39.7	0	0	0	0	108.3	P767	P767-T769 VanDerWaalsContact C-N 3.26Å; P767-T769 PolarHBondContact O-N 2.65Å

Retrieved 769 of 769 residues in 256.9 ms (Link to these results)

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