A0A077YX64_TRITR Loading...

Quinone oxidoreductase protein 2 like

AlphaFold DB , UniProt , Accession A0A077YX64, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 381 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	34.8	Very low	32.5	Very low	247 Å²	247	183.3 Å²	183.3	100%	1.217	86%	0.856	S	S	*	*				0	107.8	0	-156.6	165.6	160.6	0	0	107
2	A	32.6	Very low	32.4	Very low	88 Å²	88	178.8 Å²	178.8	73%	0.727	85%	0.85	S	S	*	*			trans	40.2	102.2	174.9	0	0	0	0	0	120
3	L	32.6	Very low	32.1	Very low	155 Å²	155	171.2 Å²	171.2	81%	0.812	84%	0.836	S	S	*	*				64.8	116.1	80.1	-89.2	119.7	0	0	0	115.9
4	R	37.3	Very low	32.2	Very low	253 Å²	253	171 Å²	171	96%	0.955	84%	0.839	S	S	*	*				-165	121.8	117.5	-106.6	170.5	178.6	-168.4	-0.8	112.8
5	Q	31.3	Very low	32.1	Very low	149 Å²	149	168.2 Å²	168.2	70%	0.696	84%	0.836	S	S	*	*			trans	-82.9	155.7	172.7	-67.9	175.2	-17.1	0	0	111
6	F	37.1	Very low	32.4	Very low	216 Å²	216	169.9 Å²	169.9	95%	0.947	84%	0.841	S	S	*	*			trans	-145.7	135.3	135.3	-118	-87.4	0	0	0	110.9
7	R	29.4	Very low	32.5	Very low	209 Å²	209	167.1 Å²	167.1	79%	0.789	84%	0.842	S	S	*	*			trans	-114.3	168	-172.3	-101.6	179.5	154.7	-178.3	-5	110.2
8	R	31.2	Very low	32.6	Very low	219 Å²	219	162.2 Å²	162.2	83%	0.826	84%	0.84	S	S	*	*			trans	99.5	131.6	157.8	-55.6	-178.3	167	172.6	-5	113.7
9	F	31.5	Very low	32.5	Very low	195 Å²	195	164.7 Å²	164.7	86%	0.855	84%	0.844	S	S	*	*			cis	-149.1	160	43.5	-110.4	-92.6	0	0	0	113.9
10	F	27.8	Very low	32.7	Very low	196 Å²	196	164.5 Å²	164.5	86%	0.86	84%	0.843	S	S	*	*			trans	-109.9	168.4	-175.2	-127.3	-91.8	0	0	0	111.1
11	A	32.3	Very low	32.9	Very low	89 Å²	89	164.1 Å²	164.1	74%	0.736	84%	0.842	S	S	*	*			trans	94.2	144.6	152.4	0	0	0	0	0	118.2
12	V	30.7	Very low	32.6	Very low	129 Å²	129	155.9 Å²	155.9	78%	0.782	82%	0.82	S	S	*	*			cis	-177	143.6	-26.1	133.4	0	0	0	0	105.9
13	A	29	Very low	32.7	Very low	80 Å²	80	157 Å²	157	66%	0.661	82%	0.822	S	S	*	*			trans	41.6	132.7	153.3	0	0	0	0	0	123.2
14	L	32.7	Very low	32.5	Very low	169 Å²	169	158.7 Å²	158.7	89%	0.885	83%	0.826	S	S	*	*				177.9	131.1	101.5	-100.2	149.7	0	0	0	111.6
15	T	31.3	Very low	32.2	Very low	129 Å²	129	153 Å²	153	79%	0.791	82%	0.818	S	S	*	*			trans	-74.8	138.8	171.8	41.1	0	0	0	0	112.2
16	Q	36.2	Very low	32.2	Very low	196 Å²	196	151.6 Å²	151.6	92%	0.916	82%	0.82	S	S	*	*			trans	-157.6	141.3	142.5	-110.3	178.4	24	0	0	111.9
17	S	34.6	Very low	31.9	Very low	122 Å²	122	145.7 Å²	145.7	85%	0.853	81%	0.811	S	S	*	*			trans	-67.4	143.7	-173.3	48.2	0	0	0	0	115.5
18	G	34.1	Very low	31.9	Very low	78 Å²	78	146.8 Å²	146.8	80%	0.804	82%	0.816	S	S	*	*			trans	-159.7	107	162.3	0	0	0	0	0	111.9
19	K	31.7	Very low	31.8	Very low	211 Å²	211	143.7 Å²	143.7	92%	0.917	82%	0.815	S	S	*	*			trans	-75.9	126.1	166.3	-86	178.5	173.4	177.2	0	109.3
20	L	35.4	Very low	32.1	Very low	160 Å²	160	142.3 Å²	142.3	84%	0.838	81%	0.809	S	S	*	*			trans	-149.2	95.9	159.4	-92.8	152.7	0	0	0	105.4
21	I	38.5	Very low	32.6	Very low	157 Å²	157	137.3 Å²	137.3	81%	0.805	79%	0.794	S	S	*	*				51.1	101.1	95.1	-53.8	175.3	0	0	0	112.6
22	G	28.5	Very low	34	Very low	74 Å²	74	140.2 Å²	140.2	76%	0.763	79%	0.787	S	S	*	*			trans	47.3	106.2	140.8	0	0	0	0	0	119.4
23	S	33	Very low	36.3	Very low	110 Å²	110	137.1 Å²	137.1	77%	0.769	77%	0.766	S	S	*	*			trans	-151.1	125.8	134.3	52.1	0	0	0	0	110.4	V25	S23-V25 PolarHBondContact O-N 3.03Å; S23-V25 VanDerWaalsContact O-N 3.09Å
24	H	29.1	Very low	39.1	Very low	192 Å²	192	135.1 Å²	135.1	89%	0.889	74%	0.741	S	S	*	*			trans	-58.8	106	166	-82.1	-83.9	0	0	0	108.8	T26	H24-T26 PolarHBondContact O-N 2.8Å
25	V	31.3	Very low	41.8	Very low	132 Å²	132	130.1 Å²	130.1	80%	0.8	71%	0.712	S	S	*	*			trans	-84.5	91.5	161.9	-179.6	0	0	0	0	106.5	S23 A27	S23-V25 PolarHBondContact O-N 3.03Å; S23-V25 VanDerWaalsContact O-N 3.09Å; V25-A27 PolarHBondContact O-N 2.94Å
26	T	31.5	Very low	44.7	Very low	120 Å²	120	124 Å²	124	74%	0.736	67%	0.674	S	S	*	*			trans	-53.9	121	159.1	23.8	0	0	0	0	107.8	H24 R28	H24-T26 PolarHBondContact O-N 2.8Å; T26-R28 PolarHBondContact O-N 3.13Å
27	A	29.5	Very low	47.3	Very low	92 Å²	92	114.6 Å²	114.6	76%	0.76	63%	0.631	S	S	*	*			trans	-54.4	104.1	172.1	0	0	0	0	0	108.4	V25 N29	V25-A27 PolarHBondContact O-N 2.94Å; A27-N29 PolarHBondContact O-N 3.01Å; A27-N29 VanDerWaalsContact O-N 3.07Å
28	R	29.3	Very low	49.9	Very low	233 Å²	233	110.8 Å²	110.8	88%	0.879	60%	0.598	S	S	*	*			trans	-61.1	113	169.9	-96.8	179.3	170.4	167.2	-3.1	107.3	T26 F30	T26-R28 PolarHBondContact O-N 3.13Å; R28-F30 PolarHBondContact O-N 3.25Å
29	N	29.6	Very low	52.6	Low	153 Å²	153	107.1 Å²	107.1	82%	0.818	56%	0.56	S	S	*	*			trans	-49.7	95.7	166.7	-74.8	-24.6	0	0	0	109.8	A27 V31	A27-N29 PolarHBondContact O-N 3.01Å; A27-N29 VanDerWaalsContact O-N 3.07Å; N29-V31 VanDerWaalsContact C-N 3.29Å; N29-V31 PolarHBondContact O-N 3.09Å; N29-V31 VanDerWaalsContact O-N 3.15Å
30	F	37.3	Very low	55.4	Low	166 Å²	166	100.6 Å²	100.6	73%	0.728	54%	0.535	S	S	*	.			trans	-71.8	96.9	151.8	-92.5	-88.3	0	0	0	105.6	R28 R32	R28-F30 PolarHBondContact O-N 3.25Å; F30-R32 VanDerWaalsContact C-N 3.26Å; F30-R32 HydrophobicContact CB-CG 4.23Å; F30-R32 PolarHBondContact O-N 3.48Å
31	V	38.9	Very low	58	Low	91 Å²	91	98.1 Å²	98.1	55%	0.552	52%	0.519	S	S	*	.			trans	-62	100.7	160.7	-176.5	0	0	0	0	105.2	N29 N33 E52	N29-V31 VanDerWaalsContact C-N 3.29Å; N29-V31 PolarHBondContact O-N 3.09Å; N29-V31 VanDerWaalsContact O-N 3.15Å; V31-N33 WeakPolarHBondContact CG1-OD1 3.41Å; V31-N33 PolarHBondContact O-N 3.42Å; V31-E52 VanDerWaalsContact CG1-O 3.31Å; V31-E52 WeakPolarHBondContact CG1-O 3.49Å
32	R	61.9	Low	60.3	Low	151 Å²	151	93.7 Å²	93.7	57%	0.57	50%	0.496	S	S	*	.			trans	-90.8	97.7	171.2	-71.1	-176.9	176.1	171.4	-0	106.1	F30 T54	F30-R32 VanDerWaalsContact C-N 3.26Å; F30-R32 HydrophobicContact CB-CG 4.23Å; F30-R32 PolarHBondContact O-N 3.48Å; R32-T54 PolarHBondContact O-OG1 2.94Å; R32-T54 VanDerWaalsContact O-OG1 3.06Å
33	N	79.2	Confident	62.8	Low	64 Å²	64	92.6 Å²	92.6	34%	0.342	49%	0.485	S	S	.	.			trans	-57.6	152.3	169.1	-61	-6.9	0	0	0	109.4	V31 E50 I51 E52	V31-N33 WeakPolarHBondContact CG1-OD1 3.41Å; V31-N33 PolarHBondContact O-N 3.42Å; N33-E50 HydrophobicContact CB-CG 4.01Å; N33-E50 WeakPolarHBondContact CB-OE1 3.28Å; N33-E50 PolarHBondContact ND2-OE1 3.25Å; N33-I51 WeakPolarHBondContact CA-O 3.47Å; N33-E52 WeakPolarHBondContact OD1-CA 3.42Å
34	Y	87.4	Confident	65.2	Low	38 Å²	38	92.4 Å²	92.4	15%	0.149	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	154.7	168.9	77.3	-77.3	0	0	0	110.2	A36 I51 T53 P55 A129 T130 L131	Y34-A36 HydrophobicContact CD2-CB 4.35Å; Y34-A36 HydrophobicContact CE2-CB 3.93Å; Y34-I51 HydrophobicContact CD1-CB 3.91Å; Y34-I51 HydrophobicContact CD1-CG2 4.2Å; Y34-I51 HydrophobicContact CE1-CB 3.51Å; Y34-I51 HydrophobicContact CE1-CD1 4.06Å; Y34-I51 HydrophobicContact CE1-CG1 4.36Å; Y34-I51 HydrophobicContact CE1-CG2 3.44Å; Y34-I51 VanDerWaalsContact CE1-CG2 3.44Å; Y34-I51 HydrophobicContact CE2-CD1 3.86Å; Y34-I51 VanDerWaalsContact CZ-CD1 3.47Å; Y34-I51 PolarHBondContact N-O 2.72Å; Y34-I51 VanDerWaalsContact N-O 3.13Å; Y34-I51 PolarHBondContact O-N 3.26Å; Y34-I51 VanDerWaalsContact OH-CD1 3.28Å; Y34-I51 WeakPolarHBondContact OH-CD1 3.37Å; Y34-T53 WeakPolarHBondContact CD1-O 3.27Å; Y34-T53 WeakPolarHBondContact CE1-O 3.2Å; Y34-P55 HydrophobicContact CD1-CG 4.09Å; Y34-P55 HydrophobicContact CE1-CG 3.69Å; Y34-P55 HydrophobicContact CE2-CG 4.3Å; Y34-A129 HydrophobicContact CD2-CB 4.3Å; Y34-A129 HydrophobicContact CE2-CB 4.36Å; Y34-T130 WeakPolarHBondContact CA-OG1 3.37Å; Y34-T130 WeakPolarHBondContact CB-OG1 3.48Å; Y34-L131 HydrophobicContact CD2-CB 4.18Å; Y34-L131 HydrophobicContact CG-CB 4.13Å; Y34-L131 HydrophobicContact CG-CD1 4.41Å; Y34-L131 HydrophobicContact CG-CG 4.49Å
35	K	90.3	Very high	67.7	Low	63 Å²	63	87.4 Å²	87.4	27%	0.274	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	138.3	177.6	-61.9	174	-173.6	163.9	0	108.8	I48 E49 E50 A129 T130 E334	K35-I48 HydrophobicContact CB-CG2 4.1Å; K35-E49 WeakPolarHBondContact CA-O 3.5Å; K35-E50 HydrophobicContact CG-CB 4.46Å; K35-E50 HydrophobicContact CG-CG 4.47Å; K35-A129 CarbonylContact O-C 3.02Å; K35-A129 VanDerWaalsContact O-CA 3.22Å; K35-A129 WeakPolarHBondContact O-CA 3.29Å; K35-T130 HydrophobicContact CB-CG2 3.92Å; K35-T130 PolarHBondContact N-OG1 2.91Å; K35-T130 PolarHBondContact O-N 2.77Å; K35-E334 HydrophobicContact CD-CG 4.36Å; K35-E334 IonicContact NZ-OE1 2.86Å; K35-E334 PolarHBondContact NZ-OE1 3.3Å
36	A	90.7	Very high	70.2	Confident	0 Å²	0	81.1 Å²	81.1	0%	0	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	145	176.4	0	0	0	0	0	110.7	Y34 I48 E49 I51 T92 A129	Y34-A36 HydrophobicContact CD2-CB 4.35Å; Y34-A36 HydrophobicContact CE2-CB 3.93Å; A36-I48 WeakPolarHBondContact O-CA 3.45Å; A36-E49 PolarHBondContact N-O 3.1Å; A36-E49 PolarHBondContact O-N 3.16Å; A36-I51 HydrophobicContact CB-CD1 3.98Å; A36-T92 HydrophobicContact CB-CG2 4.22Å; A36-A129 HydrophobicContact CB-CB 3.79Å
37	V	90.7	Very high	72.9	Confident	0 Å²	0	78.3 Å²	78.3	0%	0	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	134.4	164.6	174.4	0	0	0	0	108.2	A46 V47 I48 T92 P93 F128 L333 I354	V37-A46 HydrophobicContact CG1-CB 3.63Å; V37-V47 CarbonylContact C-O 3.49Å; V37-V47 VanDerWaalsContact CA-O 3.32Å; V37-V47 WeakPolarHBondContact CA-O 3.33Å; V37-I48 HydrophobicContact CG2-CG1 4.43Å; V37-T92 VanDerWaalsContact O-CA 3.26Å; V37-T92 WeakPolarHBondContact O-CA 3.26Å; V37-T92 VanDerWaalsContact O-CB 3.27Å; V37-T92 WeakPolarHBondContact O-CB 3.36Å; V37-T92 VanDerWaalsContact O-CG2 3.24Å; V37-T92 WeakPolarHBondContact O-CG2 3.31Å; V37-T92 PolarHBondContact O-OG1 3.26Å; V37-P93 HydrophobicContact CG1-CG 4.42Å; V37-F128 HydrophobicContact CB-CB 3.88Å; V37-F128 HydrophobicContact CG2-CB 3.96Å; V37-F128 PolarHBondContact N-O 2.56Å; V37-L333 HydrophobicContact CG2-CD1 3.65Å; V37-I354 HydrophobicContact CG1-CG1 4.04Å; V37-I354 HydrophobicContact CG1-CG2 4.31Å; V37-I354 HydrophobicContact CG2-CB 4.16Å; V37-I354 HydrophobicContact CG2-CG1 4.06Å; V37-I354 HydrophobicContact CG2-CG2 4.2Å
38	R	90.6	Very high	75.6	Confident	42 Å²	42	76.3 Å²	76.3	16%	0.158	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	131.7	-177.8	-58.2	-63.5	-66.9	168	0.7	111.1	V47 E49 P90 F91 T92	R38-V47 HydrophobicContact CB-CG2 4.05Å; R38-V47 PolarHBondContact N-O 3.18Å; R38-V47 PolarHBondContact O-N 3.46Å; R38-E49 HydrophobicContact CB-CG 4.13Å; R38-E49 HydrophobicContact CG-CB 3.79Å; R38-E49 VanDerWaalsContact CG-CD 3.47Å; R38-E49 HydrophobicContact CG-CG 3.73Å; R38-E49 WeakPolarHBondContact CG-OE2 3.49Å; R38-E49 IonicContact NE-OE2 3.96Å; R38-P90 VanDerWaalsContact NH2-C 3.26Å; R38-P90 VanDerWaalsContact NH2-CB 3.34Å; R38-P90 PolarHBondContact NH2-O 2.8Å; R38-F91 WeakPolarHBondContact CA-O 3.44Å; R38-F91 VanDerWaalsContact NH1-C 3.34Å; R38-T92 WeakPolarHBondContact CD-OG1 3.25Å; R38-T92 PolarHBondContact NH1-OG1 3Å
39	I	90.3	Very high	78.5	Confident	1 Å²	1	68.4 Å²	68.4	1%	0.005	34%	0.342	C	S	.	.	B	Isolated β-bridge	trans	-106	99.3	171.9	-51.6	-55.6	0	0	0	107.1	A46 V79 V89 P90 F91 P93	I39-A46 HydrophobicContact CD1-CB 3.38Å; I39-V79 HydrophobicContact CD1-CB 4.43Å; I39-V79 HydrophobicContact CD1-CG1 3.92Å; I39-V79 HydrophobicContact CD1-CG2 3.74Å; I39-V79 HydrophobicContact CG1-CG2 3.97Å; I39-V89 HydrophobicContact CG2-CG1 4.41Å; I39-V89 WeakPolarHBondContact O-CG1 3.4Å; I39-P90 VanDerWaalsContact O-CA 3.27Å; I39-P90 WeakPolarHBondContact O-CA 3.22Å; I39-F91 HydrophobicContact CB-CD1 3.88Å; I39-F91 HydrophobicContact CB-CE1 3.48Å; I39-F91 VanDerWaalsContact CB-CE1 3.48Å; I39-F91 HydrophobicContact CB-CE2 4.34Å; I39-F91 HydrophobicContact CB-CG 4.46Å; I39-F91 HydrophobicContact CB-CZ 3.74Å; I39-F91 HydrophobicContact CG1-CE1 4.01Å; I39-F91 HydrophobicContact CG1-CE2 4Å; I39-F91 HydrophobicContact CG1-CZ 3.7Å; I39-F91 HydrophobicContact CG2-CD1 4.3Å; I39-F91 HydrophobicContact CG2-CE1 3.54Å; I39-F91 HydrophobicContact CG2-CZ 3.91Å; I39-F91 PolarHBondContact N-O 3.05Å; I39-F91 PolarHBondContact O-N 3.2Å; I39-P93 HydrophobicContact CD1-CG 3.93Å; I39-P93 HydrophobicContact CG1-CG 3.46Å; I39-P93 VanDerWaalsContact CG1-CG 3.46Å
40	N	90.8	Very high	81.3	Confident	73 Å²	73	66.7 Å²	66.7	39%	0.39	33%	0.328	S	S	.	.	S	Bend	trans	-86.1	-21.9	-177.8	-64.6	-23.8	0	0	0	112	E49 V89 P90	N40-E49 PolarHBondContact ND2-OE1 2.96Å; N40-V89 WeakPolarHBondContact O-CB 3.46Å; N40-V89 WeakPolarHBondContact O-CG2 3.39Å; N40-P90 VanDerWaalsContact OD1-CB 3.23Å; N40-P90 WeakPolarHBondContact OD1-CB 3.27Å
41	Q	89.8	Confident	83.6	Confident	109 Å²	109	60.4 Å²	60.4	51%	0.509	30%	0.302	S	S	.	.	S	Bend	trans	-150	138.6	173.6	-173.2	169	6.3	0	0	109.7	Q44	Q41-Q44 HydrophobicContact CB-CB 4.34Å; Q41-Q44 HydrophobicContact CB-CG 3.97Å; Q41-Q44 HydrophobicContact CG-CG 4.16Å; Q41-Q44 PolarHBondContact O-N 3.17Å; Q41-Q44 VanDerWaalsContact OE1-CD 3.27Å
42	L	87.3	Confident	85.8	Confident	63 Å²	63	63.2 Å²	63.2	33%	0.33	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	142	177.7	-59.6	178.7	0	0	0	110.9	Q44 V89 F91	L42-Q44 PolarHBondContact O-N 3.43Å; L42-V89 HydrophobicContact CD2-CG1 4.07Å; L42-V89 HydrophobicContact CG-CG1 4.21Å; L42-F91 HydrophobicContact CD2-CE1 3.97Å
43	G	81.2	Confident	86.8	Confident	51 Å²	51	60.1 Å²	60.1	53%	0.526	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.1	-7.6	-178.3	0	0	0	0	0	114.9	V79	G43-V79 PolarHBondContact N-O 2.9Å
44	Q	82.5	Confident	86.9	Confident	107 Å²	107	59.8 Å²	59.8	50%	0.5	31%	0.308	S	S	.	.	S	Bend	trans	-87.6	165.8	174.8	-65.6	-161.8	-6.7	0	0	112.3	Q41 L42	Q41-Q44 HydrophobicContact CB-CB 4.34Å; Q41-Q44 HydrophobicContact CB-CG 3.97Å; Q41-Q44 HydrophobicContact CG-CG 4.16Å; Q41-Q44 PolarHBondContact O-N 3.17Å; Q41-Q44 VanDerWaalsContact OE1-CD 3.27Å; L42-Q44 PolarHBondContact O-N 3.43Å
45	K	80.8	Confident	86.9	Confident	86 Å²	86	59.1 Å²	59.1	37%	0.374	31%	0.308	S	S	.	.	P	Polyproline II helix	trans	-61.7	138.8	175.8	-68.2	-176.9	-178.8	177.2	0	109.8	S348	K45-S348 PolarHBondContact NZ-O 3.44Å
46	A	84.7	Confident	86.8	Confident	1 Å²	1	62.4 Å²	62.4	1%	0.008	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-71.2	140.5	170.6	0	0	0	0	0	109.8	V37 I39 I354 N355	V37-A46 HydrophobicContact CG1-CB 3.63Å; I39-A46 HydrophobicContact CD1-CB 3.38Å; A46-I354 HydrophobicContact CB-CG2 3.99Å; A46-N355 PolarHBondContact N-OD1 2.82Å; A46-N355 PolarHBondContact O-ND2 3.45Å
47	V	87.4	Confident	86.9	Confident	60 Å²	60	64.4 Å²	64.4	36%	0.364	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	158.7	175.1	-62	0	0	0	0	109.9	V37 R38 E49	V37-V47 CarbonylContact C-O 3.49Å; V37-V47 VanDerWaalsContact CA-O 3.32Å; V37-V47 WeakPolarHBondContact CA-O 3.33Å; R38-V47 HydrophobicContact CB-CG2 4.05Å; R38-V47 PolarHBondContact N-O 3.18Å; R38-V47 PolarHBondContact O-N 3.46Å; V47-E49 HydrophobicContact CG2-CG 4.16Å
48	I	87.5	Confident	87.1	Confident	50 Å²	50	65.8 Å²	65.8	26%	0.256	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	125.7	168.6	-63.4	164.3	0	0	0	106.9	K35 A36 V37 L333 V352	K35-I48 HydrophobicContact CB-CG2 4.1Å; A36-I48 WeakPolarHBondContact O-CA 3.45Å; V37-I48 HydrophobicContact CG2-CG1 4.43Å; I48-L333 WeakPolarHBondContact CD1-O 3.37Å; I48-V352 HydrophobicContact CD1-CG1 3.32Å; I48-V352 HydrophobicContact CG1-CG1 3.66Å
49	E	89.4	Confident	87.4	Confident	68 Å²	68	67.5 Å²	67.5	32%	0.318	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	140.1	172.5	-66.3	176.8	-166.9	0	0	109	K35 A36 R38 N40 V47	K35-E49 WeakPolarHBondContact CA-O 3.5Å; A36-E49 PolarHBondContact N-O 3.1Å; A36-E49 PolarHBondContact O-N 3.16Å; R38-E49 HydrophobicContact CB-CG 4.13Å; R38-E49 HydrophobicContact CG-CB 3.79Å; R38-E49 VanDerWaalsContact CG-CD 3.47Å; R38-E49 HydrophobicContact CG-CG 3.73Å; R38-E49 WeakPolarHBondContact CG-OE2 3.49Å; R38-E49 IonicContact NE-OE2 3.96Å; N40-E49 PolarHBondContact ND2-OE1 2.96Å; V47-E49 HydrophobicContact CG2-CG 4.16Å
50	E	88.4	Confident	87.7	Confident	116 Å²	116	70.6 Å²	70.6	54%	0.542	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	122.2	165.4	-173.7	168.9	171.6	0	0	108	N33 K35	N33-E50 HydrophobicContact CB-CG 4.01Å; N33-E50 WeakPolarHBondContact CB-OE1 3.28Å; N33-E50 PolarHBondContact ND2-OE1 3.25Å; K35-E50 HydrophobicContact CG-CB 4.46Å; K35-E50 HydrophobicContact CG-CG 4.47Å
51	I	86.5	Confident	87.9	Confident	35 Å²	35	70.5 Å²	70.5	18%	0.179	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	116.6	-173.8	-61	168.9	0	0	0	107.8	N33 Y34 A36 T53	N33-I51 WeakPolarHBondContact CA-O 3.47Å; Y34-I51 HydrophobicContact CD1-CB 3.91Å; Y34-I51 HydrophobicContact CD1-CG2 4.2Å; Y34-I51 HydrophobicContact CE1-CB 3.51Å; Y34-I51 HydrophobicContact CE1-CD1 4.06Å; Y34-I51 HydrophobicContact CE1-CG1 4.36Å; Y34-I51 HydrophobicContact CE1-CG2 3.44Å; Y34-I51 VanDerWaalsContact CE1-CG2 3.44Å; Y34-I51 HydrophobicContact CE2-CD1 3.86Å; Y34-I51 VanDerWaalsContact CZ-CD1 3.47Å; Y34-I51 PolarHBondContact N-O 2.72Å; Y34-I51 VanDerWaalsContact N-O 3.13Å; Y34-I51 PolarHBondContact O-N 3.26Å; Y34-I51 VanDerWaalsContact OH-CD1 3.28Å; Y34-I51 WeakPolarHBondContact OH-CD1 3.37Å; A36-I51 HydrophobicContact CB-CD1 3.98Å; I51-T53 PolarHBondContact O-N 3.37Å
52	E	84	Confident	88.2	Confident	149 Å²	149	65.3 Å²	65.3	70%	0.696	36%	0.36	S	S	*	.	S	Bend	trans	-79.5	36.4	-173.1	-59.8	-174.1	163.3	0	0	113.7	V31 N33	V31-E52 VanDerWaalsContact CG1-O 3.31Å; V31-E52 WeakPolarHBondContact CG1-O 3.49Å; N33-E52 WeakPolarHBondContact OD1-CA 3.42Å
53	T	83.8	Confident	88.6	Confident	86 Å²	86	62.6 Å²	62.6	53%	0.528	35%	0.346	S	S	.	.	S	Bend	trans	-148.4	143.7	175.2	53.6	0	0	0	0	109.8	Y34 I51	Y34-T53 WeakPolarHBondContact CD1-O 3.27Å; Y34-T53 WeakPolarHBondContact CE1-O 3.2Å; I51-T53 PolarHBondContact O-N 3.37Å
54	T	80.9	Confident	89.3	Confident	58 Å²	58	60.2 Å²	60.2	36%	0.356	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-74.1	135.6	166.6	-58.3	0	0	0	0	108.7	R32 T56 L63 L131	R32-T54 PolarHBondContact O-OG1 2.94Å; R32-T54 VanDerWaalsContact O-OG1 3.06Å; T54-T56 PolarHBondContact O-N 3.04Å; T54-L63 HydrophobicContact CG2-CD2 3.75Å; T54-L131 HydrophobicContact CG2-CD1 4.43Å
55	P	87.3	Confident	89.9	Confident	24 Å²	24	59.1 Å²	59.1	16%	0.156	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-56.1	131.8	176.3	-25.2	34.3	0	0	0	111.8	Y34 L63 L131 V133	Y34-P55 HydrophobicContact CD1-CG 4.09Å; Y34-P55 HydrophobicContact CE1-CG 3.69Å; Y34-P55 HydrophobicContact CE2-CG 4.3Å; P55-L63 HydrophobicContact CB-CD1 4Å; P55-L63 HydrophobicContact CG-CD1 4.04Å; P55-L131 HydrophobicContact CG-CB 4.35Å; P55-V133 HydrophobicContact CB-CG2 3.41Å; P55-V133 VanDerWaalsContact CB-CG2 3.41Å; P55-V133 HydrophobicContact CG-CG2 4.41Å
56	T	88.4	Confident	90.5	Very high	132 Å²	132	55 Å²	55	81%	0.81	30%	0.297	S	S	*	.	P	Polyproline II helix	trans	-69.8	133.4	170.3	-53.7	0	0	0	0	109.1	T54	T54-T56 PolarHBondContact O-N 3.04Å
57	I	93	Very high	91	Very high	41 Å²	41	55.3 Å²	55.3	21%	0.21	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-103.8	140	173	62.3	174.8	0	0	0	110.5	E61 L63 S103 V104 V133	I57-E61 HydrophobicContact CB-CB 4.27Å; I57-L63 HydrophobicContact CG2-CB 3.79Å; I57-L63 HydrophobicContact CG2-CD1 4.45Å; I57-S103 WeakPolarHBondContact CD1-OG 3.41Å; I57-V104 VanDerWaalsContact CD1-C 3.42Å; I57-V133 HydrophobicContact CG2-CG1 3.97Å; I57-V133 HydrophobicContact CG2-CG2 3.92Å
58	G	94.6	Very high	91.4	Very high	30 Å²	30	52.6 Å²	52.6	31%	0.309	28%	0.281	S	S	.	.	P	Polyproline II helix	trans	-75.2	173.9	167	0	0	0	0	0	112.6	D60 E61 G105	G58-D60 VanDerWaalsContact C-N 3.3Å; G58-D60 PolarHBondContact O-N 3.23Å; G58-E61 PolarHBondContact N-OE2 3.27Å; G58-E61 PolarHBondContact O-N 2.93Å; G58-G105 WeakPolarHBondContact O-CA 3.1Å
59	D	97	Very high	91.7	Very high	78 Å²	78	50.2 Å²	50.2	42%	0.417	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-29.3	-174.3	-67.2	-26.8	0	0	0	114.3	G105 A106 R107 V108	D59-G105 CarbonylContact O-C 3.12Å; D59-G105 VanDerWaalsContact O-CA 3.31Å; D59-G105 WeakPolarHBondContact O-CA 2.94Å; D59-A106 PolarHBondContact O-N 2.74Å; D59-R107 HydrophobicContact CB-CB 4.43Å; D59-R107 HydrophobicContact CB-CG 4.26Å; D59-R107 VanDerWaalsContact CB-NH1 3.34Å; D59-R107 VanDerWaalsContact CB-NH2 3.34Å; D59-R107 WeakPolarHBondContact O-CA 3.5Å; D59-R107 WeakPolarHBondContact O-CB 3.32Å; D59-R107 PolarHBondContact O-N 2.97Å; D59-R107 IonicContact OD2-CZ 3.49Å; D59-R107 IonicContact OD2-NH1 2.62Å; D59-R107 PolarHBondContact OD2-NH1 2.97Å; D59-R107 IonicContact OD2-NH2 2.69Å; D59-V108 PolarHBondContact O-N 3.25Å
60	D	96.3	Very high	91.9	Very high	65 Å²	65	47 Å²	47	35%	0.348	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.9	16.9	-179.3	-51.7	-65.9	0	0	0	112.3	G58 R107 E136	G58-D60 VanDerWaalsContact C-N 3.3Å; G58-D60 PolarHBondContact O-N 3.23Å; D60-R107 VanDerWaalsContact OD1-CB 3.29Å; D60-R107 WeakPolarHBondContact OD1-CB 3.43Å; D60-R107 IonicContact OD1-CZ 2.68Å; D60-R107 IonicContact OD1-NE 2.93Å; D60-R107 PolarHBondContact OD1-NE 2.87Å; D60-R107 IonicContact OD1-NH2 3.19Å; D60-R107 IonicContact OD2-CZ 3.34Å; D60-R107 IonicContact OD2-NE 2.86Å; D60-R107 PolarHBondContact OD2-NE 3.38Å; D60-R107 IonicContact OD2-NH2 3.26Å; D60-R107 PolarHBondContact OD2-NH2 3.09Å; D60-E136 PolarHBondContact O-N 3.22Å
61	E	96.2	Very high	92.1	Very high	71 Å²	71	41.7 Å²	41.7	33%	0.332	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	156.5	-174.3	-62.3	-175.8	144.3	0	0	111.8	I57 G58 G105 V108 V133 V134	I57-E61 HydrophobicContact CB-CB 4.27Å; G58-E61 PolarHBondContact N-OE2 3.27Å; G58-E61 PolarHBondContact O-N 2.93Å; E61-G105 PolarHBondContact O-N 2.99Å; E61-V108 WeakPolarHBondContact O-CG2 3.31Å; E61-V133 HydrophobicContact CB-CG1 3.86Å; E61-V133 HydrophobicContact CG-CG1 4.23Å; E61-V133 VanDerWaalsContact OE2-CG1 3.28Å; E61-V133 WeakPolarHBondContact OE2-CG1 3.18Å; E61-V134 WeakPolarHBondContact CA-O 3.38Å
62	I	95.7	Very high	92.2	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	146.2	173.4	64.5	174.7	0	0	0	109.1	V64 V101 S103 V104 V108 F111 V133 V134 T139	I62-V64 HydrophobicContact CD1-CG2 3.88Å; I62-V64 HydrophobicContact CG1-CG2 4.01Å; I62-V101 HydrophobicContact CD1-CG2 4.26Å; I62-S103 WeakPolarHBondContact CA-O 3.48Å; I62-V104 HydrophobicContact CG2-CB 4.32Å; I62-V104 HydrophobicContact CG2-CG1 3.93Å; I62-V108 HydrophobicContact CG2-CB 4.45Å; I62-V108 HydrophobicContact CG2-CG1 3.76Å; I62-V108 HydrophobicContact CG2-CG2 3.92Å; I62-F111 HydrophobicContact CD1-CD2 4.38Å; I62-F111 HydrophobicContact CG2-CB 4.5Å; I62-V133 WeakPolarHBondContact O-CA 3.19Å; I62-V134 HydrophobicContact CD1-CG2 3.67Å; I62-V134 HydrophobicContact CG1-CG2 3.32Å; I62-V134 PolarHBondContact N-O 3.02Å; I62-V134 PolarHBondContact O-N 2.87Å; I62-T139 HydrophobicContact CD1-CG2 3.53Å
63	L	95.7	Very high	92.2	Very high	7 Å²	7	37 Å²	37	4%	0.037	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	129.3	167.9	-172.6	64.9	0	0	0	108.2	T54 P55 I57 A102 S103 L131 V133	T54-L63 HydrophobicContact CG2-CD2 3.75Å; P55-L63 HydrophobicContact CB-CD1 4Å; P55-L63 HydrophobicContact CG-CD1 4.04Å; I57-L63 HydrophobicContact CG2-CB 3.79Å; I57-L63 HydrophobicContact CG2-CD1 4.45Å; L63-A102 HydrophobicContact CB-CB 4.27Å; L63-A102 HydrophobicContact CD2-CB 4.14Å; L63-A102 HydrophobicContact CG-CB 4.12Å; L63-A102 WeakPolarHBondContact O-CB 3.47Å; L63-A102 PolarHBondContact O-N 3.31Å; L63-S103 WeakPolarHBondContact CB-OG 3.41Å; L63-S103 PolarHBondContact N-O 2.77Å; L63-S103 PolarHBondContact O-N 2.82Å; L63-L131 HydrophobicContact CD1-CB 4.19Å; L63-L131 HydrophobicContact CD2-CD1 4.43Å; L63-V133 HydrophobicContact CD1-CG2 3.87Å
64	V	95.4	Very high	92.3	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	128.6	179.3	-177.4	0	0	0	0	109.9	I62 V66 L97 K100 V117 L131 C132 V134	I62-V64 HydrophobicContact CD1-CG2 3.88Å; I62-V64 HydrophobicContact CG1-CG2 4.01Å; V64-V66 PolarHBondContact O-N 2.56Å; V64-L97 HydrophobicContact CB-CD1 4.13Å; V64-L97 HydrophobicContact CG1-CD1 3.61Å; V64-K100 WeakPolarHBondContact CA-O 3.35Å; V64-V117 HydrophobicContact CG1-CG2 3.85Å; V64-V117 HydrophobicContact CG2-CG2 3.84Å; V64-L131 WeakPolarHBondContact O-CA 3.3Å; V64-C132 PolarHBondContact N-O 3.21Å; V64-C132 PolarHBondContact O-N 3.03Å; V64-V134 HydrophobicContact CG2-CG2 3.73Å
65	K	94.3	Very high	92.7	Very high	84 Å²	84	31.7 Å²	31.7	37%	0.365	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	100.8	160.2	-80	175.1	-179.3	-167.6	0	108.1	R67 G99 K100 A102 L131	K65-R67 PolarHBondContact O-N 3.47Å; K65-G99 CarbonylContact O-C 3.41Å; K65-G99 WeakPolarHBondContact O-CA 3.38Å; K65-K100 PolarHBondContact N-O 3.13Å; K65-K100 PolarHBondContact O-N 2.85Å; K65-A102 HydrophobicContact CD-CB 4.45Å; K65-A102 HydrophobicContact CG-CB 4.04Å; K65-L131 HydrophobicContact CB-CD2 4.37Å; K65-L131 HydrophobicContact CG-CD2 3.59Å
66	V	94.6	Very high	92.6	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	130.2	-176.5	179.3	0	0	0	0	109.1	V64 A69 L97 A129 T130 C132 V374 H376	V64-V66 PolarHBondContact O-N 2.56Å; V66-A69 HydrophobicContact CG1-CB 4.34Å; V66-L97 HydrophobicContact CG1-CB 4.16Å; V66-L97 HydrophobicContact CG2-CD1 4.36Å; V66-L97 HydrophobicContact CG2-CD2 3.98Å; V66-A129 WeakPolarHBondContact CB-O 3.3Å; V66-A129 VanDerWaalsContact CG2-O 3.25Å; V66-A129 WeakPolarHBondContact CG2-O 3.24Å; V66-T130 PolarHBondContact N-O 3.5Å; V66-T130 VanDerWaalsContact N-O 3.16Å; V66-C132 HydrophobicContact CG2-CB 3.73Å; V66-V374 HydrophobicContact CB-CG2 4.36Å; V66-V374 HydrophobicContact CG1-CG2 4.06Å; V66-V374 VanDerWaalsContact O-CB 3.23Å; V66-V374 WeakPolarHBondContact O-CB 3.42Å; V66-V374 WeakPolarHBondContact O-CG1 3.23Å; V66-H376 PolarHBondContact O-NE2 2.84Å
67	R	95.2	Very high	92.4	Very high	8 Å²	8	26.2 Å²	26.2	3%	0.03	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	-42.9	171.3	-69.2	-56.4	-135.7	126.8	18.6	111	K65 T98 Y148 V374 H376 E379 P380	K65-R67 PolarHBondContact O-N 3.47Å; R67-T98 PolarHBondContact N-O 2.68Å; R67-Y148 HydrophobicContact CB-CD1 4.05Å; R67-Y148 HydrophobicContact CB-CD2 4.03Å; R67-Y148 HydrophobicContact CB-CE1 4.49Å; R67-Y148 HydrophobicContact CB-CE2 4.47Å; R67-Y148 HydrophobicContact CB-CG 3.79Å; R67-Y148 HydrophobicContact CG-CD1 4.24Å; R67-Y148 HydrophobicContact CG-CD2 4Å; R67-Y148 HydrophobicContact CG-CE1 4.19Å; R67-Y148 HydrophobicContact CG-CE2 3.95Å; R67-Y148 HydrophobicContact CG-CG 4.14Å; R67-V374 PolarHBondContact O-N 3.21Å; R67-H376 WeakPolarHBondContact CD-CD2 3.46Å; R67-E379 IonicContact CZ-OE2 2.72Å; R67-E379 IonicContact NE-OE2 3.54Å; R67-E379 PolarHBondContact NE-OE2 3.27Å; R67-E379 IonicContact NH2-OE2 3.72Å; R67-E379 PolarHBondContact NH2-OE2 2.87Å; R67-P380 PolarHBondContact NH2-O 3.07Å
68	S	94.9	Very high	92.1	Very high	2 Å²	2	24.4 Å²	24.4	1%	0.014	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	146.5	177.7	-52.7	0	0	0	0	110.3	L97 T98 L372	S68-L97 CarbonylContact O-C 3.58Å; S68-L97 VanDerWaalsContact O-CA 3.23Å; S68-L97 WeakPolarHBondContact O-CA 3.35Å; S68-L97 WeakPolarHBondContact O-CB 3.36Å; S68-T98 WeakPolarHBondContact CB-OG1 3.32Å; S68-T98 PolarHBondContact N-O 3.45Å; S68-T98 PolarHBondContact O-N 2.64Å; S68-L372 CarbonylContact C-O 3.5Å; S68-L372 WeakPolarHBondContact CA-O 3.36Å
69	A	94.8	Very high	91.7	Very high	1 Å²	1	23.4 Å²	23.4	1%	0.008	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	136.1	172.3	0	0	0	0	0	110.9	V66 E96 L97 A127 F128 C152 I371 L372	V66-A69 HydrophobicContact CG1-CB 4.34Å; A69-E96 WeakPolarHBondContact CA-O 3.42Å; A69-L97 HydrophobicContact CB-CB 4.43Å; A69-A127 HydrophobicContact CB-CB 4.14Å; A69-A127 VanDerWaalsContact CB-O 3.31Å; A69-A127 WeakPolarHBondContact CB-O 3.38Å; A69-F128 HydrophobicContact CB-CD1 3.86Å; A69-F128 HydrophobicContact CB-CE1 4.18Å; A69-C152 VanDerWaalsContact CA-SG 3.58Å; A69-I371 WeakPolarHBondContact O-CA 3.46Å; A69-L372 HydrophobicContact CB-CB 4.36Å; A69-L372 PolarHBondContact N-O 3.15Å; A69-L372 PolarHBondContact O-N 3.47Å
70	G	93.3	Very high	91.1	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	127.4	-174.5	0	0	0	0	0	110	N72 E96 F128 C152	G70-N72 PolarHBondContact O-ND2 3.24Å; G70-E96 PolarHBondContact N-O 2.93Å; G70-F128 WeakPolarHBondContact O-CE1 3.47Å; G70-C152 PolarHBondContact N-SG 2.78Å
71	V	91.5	Very high	90.6	Very high	4 Å²	4	22.5 Å²	22.5	2%	0.024	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	122.9	176.5	-163.5	0	0	0	0	109.3	F128 L358 I361 V370 L372	V71-F128 HydrophobicContact CB-CZ 4.13Å; V71-F128 HydrophobicContact CG1-CE2 4.33Å; V71-F128 HydrophobicContact CG1-CZ 3.88Å; V71-F128 HydrophobicContact CG2-CE1 4.15Å; V71-F128 HydrophobicContact CG2-CZ 3.9Å; V71-L358 HydrophobicContact CG1-CD2 4.03Å; V71-I361 HydrophobicContact CB-CD1 3.68Å; V71-I361 HydrophobicContact CG1-CD1 3.26Å; V71-V370 HydrophobicContact CB-CB 4.23Å; V71-V370 HydrophobicContact CB-CG1 4.27Å; V71-V370 HydrophobicContact CG2-CG1 4.16Å; V71-V370 PolarHBondContact N-O 3.06Å; V71-L372 HydrophobicContact CG2-CD1 4.19Å; V71-L372 HydrophobicContact CG2-CD2 4.01Å; V71-L372 HydrophobicContact CG2-CG 3.62Å
72	N	88.7	Confident	90	Very high	16 Å²	16	24.4 Å²	24.4	9%	0.086	13%	0.132	C	C	.	.			trans	-113	157.6	-176.4	-64.1	-77.7	0	0	0	111.7	G70 A74 D75 L76 E96 A156 K369	G70-N72 PolarHBondContact O-ND2 3.24Å; N72-A74 HydrophobicContact CB-CB 4.37Å; N72-A74 PolarHBondContact O-N 2.83Å; N72-D75 WeakPolarHBondContact CA-OD2 3.33Å; N72-D75 VanDerWaalsContact CB-OD2 3.3Å; N72-D75 WeakPolarHBondContact CB-OD2 3.49Å; N72-D75 PolarHBondContact N-OD2 2.99Å; N72-D75 PolarHBondContact ND2-OD2 2.81Å; N72-D75 WeakPolarHBondContact O-CB 3.26Å; N72-D75 PolarHBondContact O-N 3.32Å; N72-L76 PolarHBondContact O-N 3.43Å; N72-E96 PolarHBondContact ND2-OE1 3.05Å; N72-E96 PolarHBondContact OD1-OE1 3.15Å; N72-A156 WeakPolarHBondContact OD1-CB 3.32Å; N72-K369 PolarHBondContact OD1-NZ 2.89Å
73	T	85.2	Confident	89.4	Confident	70 Å²	70	25.5 Å²	25.5	43%	0.429	14%	0.137	S	C	.	.	H	α-helix	trans	-58	-33	168.1	-51.4	0	0	0	0	111.3	D75 L76 L77	T73-D75 VanDerWaalsContact C-N 3.31Å; T73-D75 PolarHBondContact O-N 3.09Å; T73-L76 WeakPolarHBondContact O-CB 3.4Å; T73-L76 PolarHBondContact O-N 3.04Å; T73-L77 HydrophobicContact CG2-CD1 4.37Å; T73-L77 HydrophobicContact CG2-CG 4.4Å; T73-L77 WeakPolarHBondContact O-CG 3.45Å; T73-L77 PolarHBondContact O-N 3.48Å
74	A	85.9	Confident	88.7	Confident	31 Å²	31	31 Å²	31	26%	0.256	16%	0.162	S	C	.	.	H	α-helix	trans	-60.3	-38.5	174.1	0	0	0	0	0	112.4	N72 L76 L77 M78 F95	N72-A74 HydrophobicContact CB-CB 4.37Å; N72-A74 PolarHBondContact O-N 2.83Å; A74-L76 VanDerWaalsContact C-N 3.35Å; A74-L77 PolarHBondContact O-N 2.71Å; A74-M78 WeakPolarHBondContact O-CB 3.46Å; A74-M78 PolarHBondContact O-N 2.98Å; A74-F95 HydrophobicContact CB-CD2 4.25Å; A74-F95 HydrophobicContact CB-CE2 3.59Å; A74-F95 HydrophobicContact CB-CZ 4.08Å
75	D	88	Confident	88.2	Confident	1 Å²	1	34.8 Å²	34.8	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-63.1	-43.9	175.9	-63.4	-64.8	0	0	0	110.7	N72 T73 M78 V79 G94 F95 F128	N72-D75 WeakPolarHBondContact CA-OD2 3.33Å; N72-D75 VanDerWaalsContact CB-OD2 3.3Å; N72-D75 WeakPolarHBondContact CB-OD2 3.49Å; N72-D75 PolarHBondContact N-OD2 2.99Å; N72-D75 PolarHBondContact ND2-OD2 2.81Å; N72-D75 WeakPolarHBondContact O-CB 3.26Å; N72-D75 PolarHBondContact O-N 3.32Å; T73-D75 VanDerWaalsContact C-N 3.31Å; T73-D75 PolarHBondContact O-N 3.09Å; D75-M78 VanDerWaalsContact O-CB 3.28Å; D75-M78 WeakPolarHBondContact O-CB 3.39Å; D75-M78 PolarHBondContact O-N 3.02Å; D75-V79 VanDerWaalsContact O-CG2 3.27Å; D75-V79 WeakPolarHBondContact O-CG2 3.35Å; D75-V79 PolarHBondContact O-N 2.8Å; D75-G94 WeakPolarHBondContact OD1-CA 3.21Å; D75-G94 PolarHBondContact OD1-N 2.89Å; D75-F95 WeakPolarHBondContact OD1-CD2 3.44Å; D75-F95 VanDerWaalsContact OD1-CE2 3.28Å; D75-F95 WeakPolarHBondContact OD1-CE2 3.4Å; D75-F128 HydrophobicContact CB-CE2 4.15Å; D75-F128 HydrophobicContact CB-CZ 4.12Å
76	L	85.2	Confident	87.7	Confident	18 Å²	18	36 Å²	36	9%	0.094	18%	0.184	C	C	.	.	H	α-helix	trans	-62.5	-45.6	176.8	177.2	66.6	0	0	0	112	N72 T73 A74 M78 V79 K80 L358 I361 A362	N72-L76 PolarHBondContact O-N 3.43Å; T73-L76 WeakPolarHBondContact O-CB 3.4Å; T73-L76 PolarHBondContact O-N 3.04Å; A74-L76 VanDerWaalsContact C-N 3.35Å; L76-M78 VanDerWaalsContact C-N 3.26Å; L76-M78 PolarHBondContact O-N 3.32Å; L76-V79 PolarHBondContact O-N 3.41Å; L76-K80 HydrophobicContact CD1-CD 4.26Å; L76-K80 HydrophobicContact CG-CD 4.34Å; L76-K80 WeakPolarHBondContact O-CB 3.48Å; L76-K80 WeakPolarHBondContact O-CG 3.3Å; L76-K80 PolarHBondContact O-N 3.04Å; L76-L358 HydrophobicContact CB-CD2 4.23Å; L76-L358 HydrophobicContact CD1-CB 4.12Å; L76-L358 HydrophobicContact CD1-CD2 4.35Å; L76-I361 HydrophobicContact CD2-CG2 4.1Å; L76-A362 HydrophobicContact CD2-CB 3.62Å
77	L	84.3	Confident	87.3	Confident	24 Å²	24	36.8 Å²	36.8	13%	0.126	19%	0.189	C	C	.	.	H	α-helix	trans	-63.1	-36.4	176.9	-67.5	176	0	0	0	111	T73 A74 K80 G81 L82 H83 F271	T73-L77 HydrophobicContact CG2-CD1 4.37Å; T73-L77 HydrophobicContact CG2-CG 4.4Å; T73-L77 WeakPolarHBondContact O-CG 3.45Å; T73-L77 PolarHBondContact O-N 3.48Å; A74-L77 PolarHBondContact O-N 2.71Å; L77-K80 PolarHBondContact O-N 3.44Å; L77-G81 PolarHBondContact O-N 2.84Å; L77-G81 VanDerWaalsContact O-N 3.13Å; L77-L82 HydrophobicContact CB-CB 4.5Å; L77-L82 HydrophobicContact CD2-CB 4.04Å; L77-L82 HydrophobicContact CD2-CD1 4.42Å; L77-L82 PolarHBondContact O-N 3.41Å; L77-H83 HydrophobicContact CB-CB 3.97Å; L77-H83 PolarHBondContact O-N 2.9Å; L77-F271 HydrophobicContact CD1-CZ 4.37Å
78	M	86.9	Confident	87.1	Confident	3 Å²	3	42.4 Å²	42.4	2%	0.015	22%	0.224	C	C	.	.	H	α-helix	trans	-61.6	-53.2	175.5	-164.8	68.3	70.8	0	0	111.4	A74 D75 L76 K80 G81 H83 Y85 P87 F91 F95 L125	A74-M78 WeakPolarHBondContact O-CB 3.46Å; A74-M78 PolarHBondContact O-N 2.98Å; D75-M78 VanDerWaalsContact O-CB 3.28Å; D75-M78 WeakPolarHBondContact O-CB 3.39Å; D75-M78 PolarHBondContact O-N 3.02Å; L76-M78 VanDerWaalsContact C-N 3.26Å; L76-M78 PolarHBondContact O-N 3.32Å; M78-K80 PolarHBondContact O-N 2.83Å; M78-G81 PolarHBondContact O-N 2.83Å; M78-H83 HydrophobicContact CB-CB 4.41Å; M78-H83 HydrophobicContact CE-CB 4.08Å; M78-H83 WeakPolarHBondContact CE-ND1 3.15Å; M78-H83 HydrophobicContact SD-CB 4.02Å; M78-Y85 HydrophobicContact CE-CD1 3.68Å; M78-Y85 HydrophobicContact CE-CG 4.46Å; M78-Y85 WeakPolarHBondContact CE-O 2.81Å; M78-Y85 HydrophobicContact SD-CD1 4.27Å; M78-P87 HydrophobicContact CG-CG 4.05Å; M78-P87 WeakPolarHBondContact SD-CD 3.19Å; M78-P87 HydrophobicContact SD-CG 3.96Å; M78-F91 HydrophobicContact CG-CE2 3.88Å; M78-F91 HydrophobicContact CG-CZ 3.88Å; M78-F95 HydrophobicContact CE-CE1 4.34Å; M78-F95 HydrophobicContact CE-CZ 3.6Å; M78-L125 HydrophobicContact CG-CD1 4.48Å
79	V	86.5	Confident	86.9	Confident	9 Å²	9	45 Å²	45	6%	0.055	24%	0.24	C	C	.	.	H	α-helix	trans	-57.8	-35.4	178.7	172.3	0	0	0	0	111	I39 G43 D75 L76 P93 L358	I39-V79 HydrophobicContact CD1-CB 4.43Å; I39-V79 HydrophobicContact CD1-CG1 3.92Å; I39-V79 HydrophobicContact CD1-CG2 3.74Å; I39-V79 HydrophobicContact CG1-CG2 3.97Å; G43-V79 PolarHBondContact N-O 2.9Å; D75-V79 VanDerWaalsContact O-CG2 3.27Å; D75-V79 WeakPolarHBondContact O-CG2 3.35Å; D75-V79 PolarHBondContact O-N 2.8Å; L76-V79 PolarHBondContact O-N 3.41Å; V79-P93 HydrophobicContact CG2-CB 4.47Å; V79-P93 HydrophobicContact CG2-CG 3.98Å; V79-L358 HydrophobicContact CG2-CD1 4.28Å
80	K	84.2	Confident	86.8	Confident	106 Å²	106	48.5 Å²	48.5	46%	0.461	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-5.6	177.8	-71.3	-177.8	173.3	-177.2	0	114.8	L76 L77 M78 L82	L76-K80 HydrophobicContact CD1-CD 4.26Å; L76-K80 HydrophobicContact CG-CD 4.34Å; L76-K80 WeakPolarHBondContact O-CB 3.48Å; L76-K80 WeakPolarHBondContact O-CG 3.3Å; L76-K80 PolarHBondContact O-N 3.04Å; L77-K80 PolarHBondContact O-N 3.44Å; M78-K80 PolarHBondContact O-N 2.83Å; K80-L82 VanDerWaalsContact C-N 3.27Å; K80-L82 HydrophobicContact CB-CD1 4.1Å; K80-L82 HydrophobicContact CB-CG 4.09Å; K80-L82 HydrophobicContact CD-CD1 4.42Å; K80-L82 PolarHBondContact O-N 3.06Å
81	G	85	Confident	86.7	Confident	17 Å²	17	49.1 Å²	49.1	18%	0.175	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.1	23.1	-174.8	0	0	0	0	0	114.1	L77 M78 Q86	L77-G81 PolarHBondContact O-N 2.84Å; L77-G81 VanDerWaalsContact O-N 3.13Å; M78-G81 PolarHBondContact O-N 2.83Å; G81-Q86 PolarHBondContact O-NE2 3.49Å
82	L	83.6	Confident	86.7	Confident	111 Å²	111	49.6 Å²	49.6	58%	0.581	27%	0.268	S	S	*	.			trans	-105.6	-5.5	-179.4	-63.3	177.4	0	0	0	112.9	L77 K80	L77-L82 HydrophobicContact CB-CB 4.5Å; L77-L82 HydrophobicContact CD2-CB 4.04Å; L77-L82 HydrophobicContact CD2-CD1 4.42Å; L77-L82 PolarHBondContact O-N 3.41Å; K80-L82 VanDerWaalsContact C-N 3.27Å; K80-L82 HydrophobicContact CB-CD1 4.1Å; K80-L82 HydrophobicContact CB-CG 4.09Å; K80-L82 HydrophobicContact CD-CD1 4.42Å; K80-L82 PolarHBondContact O-N 3.06Å
83	H	83.8	Confident	86.9	Confident	23 Å²	23	48.9 Å²	48.9	11%	0.106	27%	0.265	C	S	.	.	S	Bend	trans	-79.3	150.2	174.1	-167.7	-93.1	0	0	0	110.6	L77 M78 Y85 Q86	L77-H83 HydrophobicContact CB-CB 3.97Å; L77-H83 PolarHBondContact O-N 2.9Å; M78-H83 HydrophobicContact CB-CB 4.41Å; M78-H83 HydrophobicContact CE-CB 4.08Å; M78-H83 WeakPolarHBondContact CE-ND1 3.15Å; M78-H83 HydrophobicContact SD-CB 4.02Å; H83-Y85 CarbonylContact C-O 3.57Å; H83-Y85 PolarHBondContact ND1-N 3.47Å; H83-Y85 VanDerWaalsContact ND1-N 3.12Å; H83-Y85 PolarHBondContact ND1-O 3.04Å; H83-Q86 VanDerWaalsContact O-CG 3.27Å; H83-Q86 WeakPolarHBondContact O-CG 3.47Å; H83-Q86 PolarHBondContact O-NE2 3.33Å
84	H	81.8	Confident	87.2	Confident	123 Å²	123	45.6 Å²	45.6	57%	0.569	24%	0.244	S	C	*	.	S	Bend	trans	-69.8	-37.2	-177.7	58	-89.8	0	0	0	112.4	W295	H84-W295 AromaticContact CE1-CE2 3.86Å; H84-W295 AromaticContact CE1-CZ2 3.68Å; H84-W295 AromaticContact CE1-NE1 3.95Å; H84-W295 AromaticContact NE2-CE2 3.75Å; H84-W295 AromaticContact NE2-CH2 3.66Å; H84-W295 AromaticContact NE2-CZ2 3.1Å; H84-W295 WeakPolarHBondContact NE2-CZ2 3.12Å
85	Y	83.6	Confident	87.5	Confident	79 Å²	79	45.7 Å²	45.7	31%	0.31	24%	0.239	S	C	.	.	S	Bend	trans	-81.7	131.1	163.3	179	-116	0	0	0	108.4	M78 H83 P87 K123 L125	M78-Y85 HydrophobicContact CE-CD1 3.68Å; M78-Y85 HydrophobicContact CE-CG 4.46Å; M78-Y85 WeakPolarHBondContact CE-O 2.81Å; M78-Y85 HydrophobicContact SD-CD1 4.27Å; H83-Y85 CarbonylContact C-O 3.57Å; H83-Y85 PolarHBondContact ND1-N 3.47Å; H83-Y85 VanDerWaalsContact ND1-N 3.12Å; H83-Y85 PolarHBondContact ND1-O 3.04Å; Y85-P87 HydrophobicContact CE1-CB 4.45Å; Y85-K123 PolarHBondContact OH-O 2.84Å; Y85-L125 HydrophobicContact CE1-CD1 4.22Å
86	Q	84.8	Confident	87.8	Confident	110 Å²	110	45.7 Å²	45.7	51%	0.514	24%	0.239	S	C	.	.			trans	-131.9	106.2	179.7	-63.7	-172.5	-2	0	0	109.8	G81 H83	G81-Q86 PolarHBondContact O-NE2 3.49Å; H83-Q86 VanDerWaalsContact O-CG 3.27Å; H83-Q86 WeakPolarHBondContact O-CG 3.47Å; H83-Q86 PolarHBondContact O-NE2 3.33Å
87	P	86	Confident	88.4	Confident	16 Å²	16	44.8 Å²	44.8	10%	0.104	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-71.4	150.1	177.1	30.4	-36.2	0	0	0	110.8	M78 Y85 V89 F91 L125	M78-P87 HydrophobicContact CG-CG 4.05Å; M78-P87 WeakPolarHBondContact SD-CD 3.19Å; M78-P87 HydrophobicContact SD-CG 3.96Å; Y85-P87 HydrophobicContact CE1-CB 4.45Å; P87-V89 PolarHBondContact O-N 3.03Å; P87-F91 HydrophobicContact CB-CB 4.18Å; P87-F91 HydrophobicContact CB-CD1 4.16Å; P87-F91 HydrophobicContact CB-CD2 4.3Å; P87-F91 HydrophobicContact CB-CG 3.97Å; P87-F91 HydrophobicContact CG-CB 4.33Å; P87-F91 HydrophobicContact CG-CD1 3.6Å; P87-F91 HydrophobicContact CG-CD2 3.62Å; P87-F91 HydrophobicContact CG-CE1 3.67Å; P87-F91 HydrophobicContact CG-CE2 3.69Å; P87-F91 HydrophobicContact CG-CG 3.57Å; P87-F91 HydrophobicContact CG-CZ 3.72Å; P87-L125 HydrophobicContact CB-CD1 4.15Å; P87-L125 HydrophobicContact CG-CD1 3.82Å
88	T	90.6	Very high	89	Confident	126 Å²	126	43.7 Å²	43.7	77%	0.773	23%	0.228	S	C	*	.	P	Polyproline II helix	trans	-66.5	130.9	171.1	-52.5	0	0	0	0	109.7
89	V	91.3	Very high	89.5	Confident	56 Å²	56	43.5 Å²	43.5	34%	0.339	23%	0.228	S	C	.	.	S	Bend	trans	-73	144.4	170.8	-65.4	0	0	0	0	110.7	I39 N40 L42 P87 F91	I39-V89 HydrophobicContact CG2-CG1 4.41Å; I39-V89 WeakPolarHBondContact O-CG1 3.4Å; N40-V89 WeakPolarHBondContact O-CB 3.46Å; N40-V89 WeakPolarHBondContact O-CG2 3.39Å; L42-V89 HydrophobicContact CD2-CG1 4.07Å; L42-V89 HydrophobicContact CG-CG1 4.21Å; P87-V89 PolarHBondContact O-N 3.03Å; V89-F91 HydrophobicContact CG1-CD1 4.02Å; V89-F91 HydrophobicContact CG1-CE1 4.09Å
90	P	91.6	Very high	89.9	Confident	75 Å²	75	45.7 Å²	45.7	49%	0.487	24%	0.236	S	C	.	.	S	Bend	cis	-83.8	140	-0.3	34.9	-35.4	0	0	0	112.9	R38 I39 N40	R38-P90 VanDerWaalsContact NH2-C 3.26Å; R38-P90 VanDerWaalsContact NH2-CB 3.34Å; R38-P90 PolarHBondContact NH2-O 2.8Å; I39-P90 VanDerWaalsContact O-CA 3.27Å; I39-P90 WeakPolarHBondContact O-CA 3.22Å; N40-P90 VanDerWaalsContact OD1-CB 3.23Å; N40-P90 WeakPolarHBondContact OD1-CB 3.27Å
91	F	91.9	Very high	90.5	Very high	13 Å²	13	40.8 Å²	40.8	6%	0.057	22%	0.215	C	C	.	.	B	Isolated β-bridge	trans	-134.6	163.6	176.6	74.1	-83.8	0	0	0	112.6	R38 I39 L42 M78 P87 V89 P93 L125	R38-F91 WeakPolarHBondContact CA-O 3.44Å; R38-F91 VanDerWaalsContact NH1-C 3.34Å; I39-F91 HydrophobicContact CB-CD1 3.88Å; I39-F91 HydrophobicContact CB-CE1 3.48Å; I39-F91 VanDerWaalsContact CB-CE1 3.48Å; I39-F91 HydrophobicContact CB-CE2 4.34Å; I39-F91 HydrophobicContact CB-CG 4.46Å; I39-F91 HydrophobicContact CB-CZ 3.74Å; I39-F91 HydrophobicContact CG1-CE1 4.01Å; I39-F91 HydrophobicContact CG1-CE2 4Å; I39-F91 HydrophobicContact CG1-CZ 3.7Å; I39-F91 HydrophobicContact CG2-CD1 4.3Å; I39-F91 HydrophobicContact CG2-CE1 3.54Å; I39-F91 HydrophobicContact CG2-CZ 3.91Å; I39-F91 PolarHBondContact N-O 3.05Å; I39-F91 PolarHBondContact O-N 3.2Å; L42-F91 HydrophobicContact CD2-CE1 3.97Å; M78-F91 HydrophobicContact CG-CE2 3.88Å; M78-F91 HydrophobicContact CG-CZ 3.88Å; P87-F91 HydrophobicContact CB-CB 4.18Å; P87-F91 HydrophobicContact CB-CD1 4.16Å; P87-F91 HydrophobicContact CB-CD2 4.3Å; P87-F91 HydrophobicContact CB-CG 3.97Å; P87-F91 HydrophobicContact CG-CB 4.33Å; P87-F91 HydrophobicContact CG-CD1 3.6Å; P87-F91 HydrophobicContact CG-CD2 3.62Å; P87-F91 HydrophobicContact CG-CE1 3.67Å; P87-F91 HydrophobicContact CG-CE2 3.69Å; P87-F91 HydrophobicContact CG-CG 3.57Å; P87-F91 HydrophobicContact CG-CZ 3.72Å; V89-F91 HydrophobicContact CG1-CD1 4.02Å; V89-F91 HydrophobicContact CG1-CE1 4.09Å; F91-P93 HydrophobicContact CD2-CG 4.34Å; F91-P93 HydrophobicContact CE2-CB 4.16Å; F91-P93 HydrophobicContact CE2-CG 3.82Å; F91-L125 HydrophobicContact CD2-CD1 3.96Å; F91-L125 HydrophobicContact CE2-CD1 4.23Å
92	T	91.9	Very high	91	Very high	15 Å²	15	41.3 Å²	41.3	9%	0.092	22%	0.218	C	C	.	.			trans	-105.4	122.2	172.1	-65.7	0	0	0	0	109	A36 V37 R38 L125 G126 F128 A129	A36-T92 HydrophobicContact CB-CG2 4.22Å; V37-T92 VanDerWaalsContact O-CA 3.26Å; V37-T92 WeakPolarHBondContact O-CA 3.26Å; V37-T92 VanDerWaalsContact O-CB 3.27Å; V37-T92 WeakPolarHBondContact O-CB 3.36Å; V37-T92 VanDerWaalsContact O-CG2 3.24Å; V37-T92 WeakPolarHBondContact O-CG2 3.31Å; V37-T92 PolarHBondContact O-OG1 3.26Å; R38-T92 WeakPolarHBondContact CD-OG1 3.25Å; R38-T92 PolarHBondContact NH1-OG1 3Å; T92-L125 VanDerWaalsContact O-CB 3.31Å; T92-L125 WeakPolarHBondContact O-CB 3.32Å; T92-G126 WeakPolarHBondContact O-CA 3.4Å; T92-G126 PolarHBondContact O-N 3.46Å; T92-F128 HydrophobicContact CG2-CB 4.34Å; T92-F128 WeakPolarHBondContact CG2-O 3.28Å; T92-A129 HydrophobicContact CG2-CB 4.32Å
93	P	91.8	Very high	91.5	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.006	20%	0.203	C	C	.	.			trans	-73	-179.2	179.1	-13.8	28.7	0	0	0	113.2	V37 I39 V79 F91 G126 A127 F128	V37-P93 HydrophobicContact CG1-CG 4.42Å; I39-P93 HydrophobicContact CD1-CG 3.93Å; I39-P93 HydrophobicContact CG1-CG 3.46Å; I39-P93 VanDerWaalsContact CG1-CG 3.46Å; V79-P93 HydrophobicContact CG2-CB 4.47Å; V79-P93 HydrophobicContact CG2-CG 3.98Å; F91-P93 HydrophobicContact CD2-CG 4.34Å; F91-P93 HydrophobicContact CE2-CB 4.16Å; F91-P93 HydrophobicContact CE2-CG 3.82Å; P93-G126 CarbonylContact O-C 3.47Å; P93-A127 PolarHBondContact O-N 2.47Å; P93-F128 HydrophobicContact CB-CD2 3.69Å; P93-F128 HydrophobicContact CB-CE2 3.87Å; P93-F128 HydrophobicContact CG-CD2 4.26Å; P93-F128 WeakPolarHBondContact O-CB 3.39Å; P93-F128 WeakPolarHBondContact O-CG 3.37Å; P93-F128 PolarHBondContact O-N 2.99Å
94	G	91.7	Very high	92.2	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.213	C	C	.	.			trans	104.3	122.5	175.2	0	0	0	0	0	112.2	D75 G126 A127 F128	D75-G94 WeakPolarHBondContact OD1-CA 3.21Å; D75-G94 PolarHBondContact OD1-N 2.89Å; G94-G126 PolarHBondContact O-N 3.49Å; G94-A127 PolarHBondContact O-N 3.09Å; G94-F128 VanDerWaalsContact CA-CE1 3.44Å
95	F	92.4	Very high	92.9	Very high	33 Å²	33	33.7 Å²	33.7	15%	0.145	19%	0.189	C	C	.	.	S	Bend	trans	-96.5	-24.1	-179.4	-66.7	-84.3	0	0	0	114.2	A74 D75 M78 L120 M121 L125	A74-F95 HydrophobicContact CB-CD2 4.25Å; A74-F95 HydrophobicContact CB-CE2 3.59Å; A74-F95 HydrophobicContact CB-CZ 4.08Å; D75-F95 WeakPolarHBondContact OD1-CD2 3.44Å; D75-F95 VanDerWaalsContact OD1-CE2 3.28Å; D75-F95 WeakPolarHBondContact OD1-CE2 3.4Å; M78-F95 HydrophobicContact CE-CE1 4.34Å; M78-F95 HydrophobicContact CE-CZ 3.6Å; F95-L120 CarbonylContact O-C 3.52Å; F95-L120 WeakPolarHBondContact O-CA 3.21Å; F95-M121 VanDerWaalsContact CD1-O 3.31Å; F95-M121 WeakPolarHBondContact CD1-O 3.48Å; F95-M121 PolarHBondContact O-N 3.43Å; F95-L125 HydrophobicContact CD1-CD2 3.68Å; F95-L125 HydrophobicContact CE1-CD2 3.45Å; F95-L125 VanDerWaalsContact CE1-CD2 3.45Å; F95-L125 HydrophobicContact CE2-CD2 4.42Å; F95-L125 HydrophobicContact CG-CD2 4.27Å; F95-L125 HydrophobicContact CZ-CD2 3.87Å
96	E	95.2	Very high	93.6	Very high	1 Å²	1	34.3 Å²	34.3	1%	0.005	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	143.1	-173.1	73.9	-156.5	147.1	0	0	111.4	A69 G70 N72 A119 L120 A127 P155 A156 K369	A69-E96 WeakPolarHBondContact CA-O 3.42Å; G70-E96 PolarHBondContact N-O 2.93Å; N72-E96 PolarHBondContact ND2-OE1 3.05Å; N72-E96 PolarHBondContact OD1-OE1 3.15Å; E96-A119 WeakPolarHBondContact CA-O 3.24Å; E96-L120 HydrophobicContact CB-CG 4.27Å; E96-A127 WeakPolarHBondContact O-CB 3.46Å; E96-P155 WeakPolarHBondContact OE2-CB 3.25Å; E96-P155 VanDerWaalsContact OE2-CD 3.3Å; E96-P155 WeakPolarHBondContact OE2-CD 3.47Å; E96-A156 WeakPolarHBondContact OE2-CB 3.41Å; E96-A156 PolarHBondContact OE2-N 2.73Å; E96-K369 WeakPolarHBondContact OE1-CE 3.33Å; E96-K369 IonicContact OE1-NZ 3.42Å; E96-K369 PolarHBondContact OE1-NZ 2.77Å
97	L	96.7	Very high	94.2	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	161.4	179.8	66	90.8	0	0	0	111.7	V64 V66 S68 A69 A119 M121 A127 C132 V134	V64-L97 HydrophobicContact CB-CD1 4.13Å; V64-L97 HydrophobicContact CG1-CD1 3.61Å; V66-L97 HydrophobicContact CG1-CB 4.16Å; V66-L97 HydrophobicContact CG2-CD1 4.36Å; V66-L97 HydrophobicContact CG2-CD2 3.98Å; S68-L97 CarbonylContact O-C 3.58Å; S68-L97 VanDerWaalsContact O-CA 3.23Å; S68-L97 WeakPolarHBondContact O-CA 3.35Å; S68-L97 WeakPolarHBondContact O-CB 3.36Å; A69-L97 HydrophobicContact CB-CB 4.43Å; L97-A119 HydrophobicContact CD1-CB 4.05Å; L97-A119 HydrophobicContact CG-CB 4.13Å; L97-A119 PolarHBondContact N-O 2.87Å; L97-A119 PolarHBondContact O-N 3.4Å; L97-M121 HydrophobicContact CD2-SD 4.39Å; L97-A127 HydrophobicContact CB-CB 3.92Å; L97-A127 HydrophobicContact CD2-CB 3.87Å; L97-A127 HydrophobicContact CG-CB 4.42Å; L97-C132 HydrophobicContact CD2-CB 3.51Å; L97-C132 VanDerWaalsContact CD2-SG 3.58Å; L97-V134 HydrophobicContact CD2-CG1 4.15Å
98	T	97.7	Very high	94.7	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	152.6	163	65.1	0	0	0	0	109.6	R67 S68 V117 L118 L142 Y148 A151 C152	R67-T98 PolarHBondContact N-O 2.68Å; S68-T98 WeakPolarHBondContact CB-OG1 3.32Å; S68-T98 PolarHBondContact N-O 3.45Å; S68-T98 PolarHBondContact O-N 2.64Å; T98-V117 CarbonylContact C-O 3.6Å; T98-V117 WeakPolarHBondContact CA-O 3.43Å; T98-L118 HydrophobicContact CG2-CB 4.4Å; T98-L118 HydrophobicContact CG2-CD1 3.45Å; T98-L118 VanDerWaalsContact CG2-CD1 3.45Å; T98-L142 HydrophobicContact CG2-CD2 4.35Å; T98-Y148 WeakPolarHBondContact CG2-O 3.43Å; T98-Y148 WeakPolarHBondContact OG1-CA 3.26Å; T98-Y148 WeakPolarHBondContact OG1-CB 3.26Å; T98-Y148 PolarHBondContact OG1-O 3.02Å; T98-A151 HydrophobicContact CG2-CB 3.82Å; T98-C152 HydrophobicContact CG2-CB 3.86Å
99	G	96.4	Very high	95	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	179.7	-162.3	-177.2	0	0	0	0	0	114.8	K65 R116 V117 Y148	K65-G99 CarbonylContact O-C 3.41Å; K65-G99 WeakPolarHBondContact O-CA 3.38Å; G99-R116 WeakPolarHBondContact O-CA 3.35Å; G99-V117 PolarHBondContact N-O 3.42Å; G99-V117 PolarHBondContact O-N 3.21Å; G99-Y148 WeakPolarHBondContact O-CE1 3.45Å
100	K	96.5	Very high	95.3	Very high	54 Å²	54	37.2 Å²	37.2	24%	0.235	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	138.4	174.3	-69.1	-176.8	174.9	174.1	0	111	V64 K65 A102 D115 Y148 E379	V64-K100 WeakPolarHBondContact CA-O 3.35Å; K65-K100 PolarHBondContact N-O 3.13Å; K65-K100 PolarHBondContact O-N 2.85Å; K100-A102 PolarHBondContact O-N 3.21Å; K100-D115 CarbonylContact C-O 3.46Å; K100-D115 VanDerWaalsContact CA-O 3.31Å; K100-D115 WeakPolarHBondContact CA-O 3.34Å; K100-Y148 VanDerWaalsContact CE-OH 3.24Å; K100-Y148 WeakPolarHBondContact CE-OH 3.45Å; K100-Y148 WeakPolarHBondContact CG-OH 3.29Å; K100-E379 WeakPolarHBondContact CE-OE2 3.35Å; K100-E379 IonicContact NZ-OE1 2.89Å; K100-E379 PolarHBondContact NZ-OE1 3.13Å; K100-E379 IonicContact NZ-OE2 2.74Å; K100-E379 PolarHBondContact NZ-OE2 2.87Å
101	V	97	Very high	95.6	Very high	3 Å²	3	34.2 Å²	34.2	2%	0.018	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64	125.2	174.1	-178.7	0	0	0	0	109.8	I62 V104 F111 K112 G114 D115 V117	I62-V101 HydrophobicContact CD1-CG2 4.26Å; V101-V104 HydrophobicContact CG1-CG1 3.53Å; V101-F111 HydrophobicContact CG2-CB 4.34Å; V101-K112 WeakPolarHBondContact CB-O 3.27Å; V101-G114 PolarHBondContact O-N 3.32Å; V101-D115 HydrophobicContact CG2-CB 4.02Å; V101-D115 PolarHBondContact N-O 2.97Å; V101-V117 HydrophobicContact CG2-CG1 3.63Å; V101-V117 HydrophobicContact CG2-CG2 4.22Å
102	A	94.2	Very high	95.9	Very high	28 Å²	28	40 Å²	40	23%	0.231	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	-35.6	-179.7	0	0	0	0	0	112.5	L63 K65 K100	L63-A102 HydrophobicContact CB-CB 4.27Å; L63-A102 HydrophobicContact CD2-CB 4.14Å; L63-A102 HydrophobicContact CG-CB 4.12Å; L63-A102 WeakPolarHBondContact O-CB 3.47Å; L63-A102 PolarHBondContact O-N 3.31Å; K65-A102 HydrophobicContact CD-CB 4.45Å; K65-A102 HydrophobicContact CG-CB 4.04Å; K100-A102 PolarHBondContact O-N 3.21Å
103	S	95.5	Very high	96.1	Very high	39 Å²	39	43.9 Å²	43.9	27%	0.273	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	160.3	173.4	55.6	0	0	0	0	110.1	I57 I62 L63	I57-S103 WeakPolarHBondContact CD1-OG 3.41Å; I62-S103 WeakPolarHBondContact CA-O 3.48Å; L63-S103 WeakPolarHBondContact CB-OG 3.41Å; L63-S103 PolarHBondContact N-O 2.77Å; L63-S103 PolarHBondContact O-N 2.82Å
104	V	97.3	Very high	96.3	Very high	52 Å²	52	45.9 Å²	45.9	32%	0.315	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	144.6	-178.2	-59.8	0	0	0	0	110	I57 I62 V101 V108	I57-V104 VanDerWaalsContact CD1-C 3.42Å; I62-V104 HydrophobicContact CG2-CB 4.32Å; I62-V104 HydrophobicContact CG2-CG1 3.93Å; V101-V104 HydrophobicContact CG1-CG1 3.53Å; V104-V108 HydrophobicContact CB-CB 3.99Å; V104-V108 HydrophobicContact CB-CG1 3.95Å; V104-V108 HydrophobicContact CB-CG2 4.43Å; V104-V108 HydrophobicContact CG1-CG1 4.1Å
105	G	97.2	Very high	96.6	Very high	7 Å²	7	47.4 Å²	47.4	7%	0.072	27%	0.269	C	S	.	.			trans	-70.5	163.8	174.7	0	0	0	0	0	112.2	G58 D59 E61 R107 V108	G58-G105 WeakPolarHBondContact O-CA 3.1Å; D59-G105 CarbonylContact O-C 3.12Å; D59-G105 VanDerWaalsContact O-CA 3.31Å; D59-G105 WeakPolarHBondContact O-CA 2.94Å; E61-G105 PolarHBondContact O-N 2.99Å; G105-R107 PolarHBondContact O-N 2.98Å; G105-R107 VanDerWaalsContact O-N 3.15Å; G105-V108 PolarHBondContact O-N 2.9Å
106	A	97.3	Very high	96.9	Very high	91 Å²	91	47.2 Å²	47.2	75%	0.752	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-23.5	-172.3	0	0	0	0	0	114.8	D59	D59-A106 PolarHBondContact O-N 2.74Å
107	R	97.7	Very high	97	Very high	136 Å²	136	47.1 Å²	47.1	51%	0.513	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.4	-6.5	179.8	-70.2	-166.1	-66.1	-88.4	4.8	114	D59 D60 G105 S109	D59-R107 HydrophobicContact CB-CB 4.43Å; D59-R107 HydrophobicContact CB-CG 4.26Å; D59-R107 VanDerWaalsContact CB-NH1 3.34Å; D59-R107 VanDerWaalsContact CB-NH2 3.34Å; D59-R107 WeakPolarHBondContact O-CA 3.5Å; D59-R107 WeakPolarHBondContact O-CB 3.32Å; D59-R107 PolarHBondContact O-N 2.97Å; D59-R107 IonicContact OD2-CZ 3.49Å; D59-R107 IonicContact OD2-NH1 2.62Å; D59-R107 PolarHBondContact OD2-NH1 2.97Å; D59-R107 IonicContact OD2-NH2 2.69Å; D60-R107 VanDerWaalsContact OD1-CB 3.29Å; D60-R107 WeakPolarHBondContact OD1-CB 3.43Å; D60-R107 IonicContact OD1-CZ 2.68Å; D60-R107 IonicContact OD1-NE 2.93Å; D60-R107 PolarHBondContact OD1-NE 2.87Å; D60-R107 IonicContact OD1-NH2 3.19Å; D60-R107 IonicContact OD2-CZ 3.34Å; D60-R107 IonicContact OD2-NE 2.86Å; D60-R107 PolarHBondContact OD2-NE 3.38Å; D60-R107 IonicContact OD2-NH2 3.26Å; D60-R107 PolarHBondContact OD2-NH2 3.09Å; G105-R107 PolarHBondContact O-N 2.98Å; G105-R107 VanDerWaalsContact O-N 3.15Å; R107-S109 PolarHBondContact O-N 3.14Å
108	V	97.7	Very high	97	Very high	19 Å²	19	47.2 Å²	47.2	12%	0.115	27%	0.267	C	S	.	.			trans	-64.6	130.4	176.3	174.8	0	0	0	0	109.6	D59 E61 I62 V104 G105 F111 E136	D59-V108 PolarHBondContact O-N 3.25Å; E61-V108 WeakPolarHBondContact O-CG2 3.31Å; I62-V108 HydrophobicContact CG2-CB 4.45Å; I62-V108 HydrophobicContact CG2-CG1 3.76Å; I62-V108 HydrophobicContact CG2-CG2 3.92Å; V104-V108 HydrophobicContact CB-CB 3.99Å; V104-V108 HydrophobicContact CB-CG1 3.95Å; V104-V108 HydrophobicContact CB-CG2 4.43Å; V104-V108 HydrophobicContact CG1-CG1 4.1Å; G105-V108 PolarHBondContact O-N 2.9Å; V108-F111 HydrophobicContact CG1-CB 4.18Å; V108-E136 HydrophobicContact CG1-CG 4.39Å; V108-E136 WeakPolarHBondContact CG1-OE1 3.38Å; V108-E136 HydrophobicContact CG2-CB 4.29Å
109	S	96.9	Very high	97	Very high	103 Å²	103	47.2 Å²	47.2	72%	0.72	27%	0.267	S	S	*	.			trans	-129.2	-20.8	-174.5	59.1	0	0	0	0	113.9	R107 E136	R107-S109 PolarHBondContact O-N 3.14Å; S109-E136 PolarHBondContact N-OE1 2.88Å
110	R	97	Very high	96.8	Very high	111 Å²	111	47.7 Å²	47.7	42%	0.419	27%	0.27	S	S	.	.	S	Bend	trans	-85.7	-18.7	-178	-64.4	168.7	61.6	-141.1	-0.2	113.5	E136 T139	R110-E136 HydrophobicContact CB-CG 4.31Å; R110-E136 VanDerWaalsContact CB-OE1 3.24Å; R110-E136 WeakPolarHBondContact CB-OE1 3.48Å; R110-E136 WeakPolarHBondContact CG-OE1 3.21Å; R110-E136 PolarHBondContact N-OE1 2.98Å; R110-E136 PolarHBondContact NH1-O 3.39Å; R110-T139 PolarHBondContact NH1-O 3.37Å; R110-T139 PolarHBondContact NH2-O 2.93Å; R110-T139 VanDerWaalsContact NH2-O 3.16Å
111	F	97.9	Very high	96.3	Very high	12 Å²	12	45.4 Å²	45.4	5%	0.053	26%	0.26	C	S	.	.			trans	-130.6	151.1	-173	-60.1	-72.2	0	0	0	112.6	I62 V101 V108 V117 E136 T139 V141	I62-F111 HydrophobicContact CD1-CD2 4.38Å; I62-F111 HydrophobicContact CG2-CB 4.5Å; V101-F111 HydrophobicContact CG2-CB 4.34Å; V108-F111 HydrophobicContact CG1-CB 4.18Å; F111-V117 HydrophobicContact CD1-CG1 3.73Å; F111-V117 HydrophobicContact CE1-CG1 3.69Å; F111-E136 HydrophobicContact CD2-CG 3.93Å; F111-E136 HydrophobicContact CE2-CG 3.93Å; F111-T139 HydrophobicContact CD2-CG2 4.49Å; F111-T139 HydrophobicContact CE1-CG2 4.01Å; F111-T139 HydrophobicContact CE2-CG2 3.82Å; F111-T139 HydrophobicContact CZ-CG2 3.56Å; F111-T139 WeakPolarHBondContact CZ-O 3.13Å; F111-V141 HydrophobicContact CD1-CG2 4.38Å; F111-V141 HydrophobicContact CE1-CG2 3.7Å
112	K	97.3	Very high	94.9	Very high	135 Å²	135	47.4 Å²	47.4	59%	0.587	27%	0.273	S	S	*	.			trans	-131.4	161.7	170	62.1	-175.4	178.8	-54.6	0	110.9	V101 G114 D115	V101-K112 WeakPolarHBondContact CB-O 3.27Å; K112-G114 PolarHBondContact O-N 3.46Å; K112-D115 WeakPolarHBondContact CE-OD1 3.36Å; K112-D115 WeakPolarHBondContact CG-OD1 3.27Å; K112-D115 WeakPolarHBondContact CG-OD2 3.49Å; K112-D115 PolarHBondContact N-OD2 3.16Å; K112-D115 IonicContact NZ-OD1 3.69Å; K112-D115 PolarHBondContact NZ-OD1 2.86Å; K112-D115 IonicContact NZ-OD2 2.72Å; K112-D115 WeakPolarHBondContact O-CB 3.35Å; K112-D115 VanDerWaalsContact O-CG 3.31Å; K112-D115 PolarHBondContact O-N 3.37Å; K112-D115 VanDerWaalsContact O-N 3.12Å
113	V	97.2	Very high	93.8	Very high	97 Å²	97	51.2 Å²	51.2	59%	0.588	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	132.8	175.6	177.5	0	0	0	0	110.6
114	G	96.1	Very high	92.9	Very high	43 Å²	43	53.2 Å²	53.2	44%	0.443	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.5	-15.4	-178.5	0	0	0	0	0	115	V101 K112	V101-G114 PolarHBondContact O-N 3.32Å; K112-G114 PolarHBondContact O-N 3.46Å
115	D	97.8	Very high	92.4	Very high	32 Å²	32	51.4 Å²	51.4	17%	0.171	29%	0.286	C	S	.	.			trans	-59.9	141.3	176.2	-73.3	-15	0	0	0	110.9	K100 V101 K112	K100-D115 CarbonylContact C-O 3.46Å; K100-D115 VanDerWaalsContact CA-O 3.31Å; K100-D115 WeakPolarHBondContact CA-O 3.34Å; V101-D115 HydrophobicContact CG2-CB 4.02Å; V101-D115 PolarHBondContact N-O 2.97Å; K112-D115 WeakPolarHBondContact CE-OD1 3.36Å; K112-D115 WeakPolarHBondContact CG-OD1 3.27Å; K112-D115 WeakPolarHBondContact CG-OD2 3.49Å; K112-D115 PolarHBondContact N-OD2 3.16Å; K112-D115 IonicContact NZ-OD1 3.69Å; K112-D115 PolarHBondContact NZ-OD1 2.86Å; K112-D115 IonicContact NZ-OD2 2.72Å; K112-D115 WeakPolarHBondContact O-CB 3.35Å; K112-D115 VanDerWaalsContact O-CG 3.31Å; K112-D115 PolarHBondContact O-N 3.37Å; K112-D115 VanDerWaalsContact O-N 3.12Å
116	R	97.7	Very high	92.1	Very high	28 Å²	28	51.5 Å²	51.5	11%	0.106	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	131.1	172.6	-55.6	-175.1	61.7	-148.7	-8	108.7	G99 L142 P143 H144 I146 Y148	G99-R116 WeakPolarHBondContact O-CA 3.35Å; R116-L142 HydrophobicContact CB-CB 3.98Å; R116-L142 HydrophobicContact CB-CG 4.46Å; R116-L142 PolarHBondContact O-N 2.93Å; R116-P143 PolarHBondContact NH1-O 3.27Å; R116-H144 VanDerWaalsContact NH1-CA 3.26Å; R116-H144 PolarHBondContact NH1-O 3.18Å; R116-I146 PolarHBondContact NH1-O 2.91Å; R116-I146 PolarHBondContact NH2-O 2.73Å; R116-Y148 HydrophobicContact CB-CE1 4.32Å; R116-Y148 HydrophobicContact CG-CE1 4.47Å; R116-Y148 WeakPolarHBondContact CG-OH 3.47Å; R116-Y148 VanDerWaalsContact NE-CZ 3.31Å; R116-Y148 PolarHBondContact NE-OH 3.22Å
117	V	98	Very high	92	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	150.1	-175.3	-65.6	0	0	0	0	112.5	V64 T98 G99 V101 F111 T139 F140	V64-V117 HydrophobicContact CG1-CG2 3.85Å; V64-V117 HydrophobicContact CG2-CG2 3.84Å; T98-V117 CarbonylContact C-O 3.6Å; T98-V117 WeakPolarHBondContact CA-O 3.43Å; G99-V117 PolarHBondContact N-O 3.42Å; G99-V117 PolarHBondContact O-N 3.21Å; V101-V117 HydrophobicContact CG2-CG1 3.63Å; V101-V117 HydrophobicContact CG2-CG2 4.22Å; F111-V117 HydrophobicContact CD1-CG1 3.73Å; F111-V117 HydrophobicContact CE1-CG1 3.69Å; V117-T139 HydrophobicContact CB-CG2 3.57Å; V117-T139 HydrophobicContact CG1-CG2 3.68Å; V117-T139 HydrophobicContact CG2-CG2 4.22Å; V117-F140 VanDerWaalsContact CA-O 3.31Å; V117-F140 WeakPolarHBondContact CA-O 3.5Å
118	L	97.8	Very high	91.8	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.005	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	129.4	160.7	174	80.1	0	0	0	106.7	T98 L120 T139 F140 A151 P155 I311 L315	T98-L118 HydrophobicContact CG2-CB 4.4Å; T98-L118 HydrophobicContact CG2-CD1 3.45Å; T98-L118 VanDerWaalsContact CG2-CD1 3.45Å; L118-L120 HydrophobicContact CD2-CD1 4.21Å; L118-L120 HydrophobicContact CG-CD1 4.25Å; L118-T139 WeakPolarHBondContact O-CA 3.47Å; L118-F140 PolarHBondContact N-O 3.22Å; L118-F140 PolarHBondContact O-N 3.49Å; L118-A151 WeakPolarHBondContact CD1-O 2.99Å; L118-P155 HydrophobicContact CD1-CG 3.63Å; L118-P155 HydrophobicContact CD2-CG 3.72Å; L118-P155 HydrophobicContact CG-CG 4.03Å; L118-I311 HydrophobicContact CD2-CG2 3.84Å; L118-L315 HydrophobicContact CD2-CD1 4.02Å; L118-L315 HydrophobicContact CD2-CD2 4.03Å; L118-L315 HydrophobicContact CD2-CG 4.16Å
119	A	96.5	Very high	91.5	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	143.3	177	0	0	0	0	0	111.2	E96 L97 V134 N138 T139	E96-A119 WeakPolarHBondContact CA-O 3.24Å; L97-A119 HydrophobicContact CD1-CB 4.05Å; L97-A119 HydrophobicContact CG-CB 4.13Å; L97-A119 PolarHBondContact N-O 2.87Å; L97-A119 PolarHBondContact O-N 3.4Å; A119-V134 HydrophobicContact CB-CB 4.07Å; A119-V134 HydrophobicContact CB-CG1 3.89Å; A119-V134 HydrophobicContact CB-CG2 3.85Å; A119-N138 WeakPolarHBondContact CA-O 3.41Å; A119-T139 HydrophobicContact CB-CG2 4.35Å
120	L	93.4	Very high	91.3	Very high	11 Å²	11	35.8 Å²	35.8	6%	0.058	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	143	173.9	-72.6	87.3	0	0	0	109.7	F95 E96 L118 N138 F140 P155 F296 W307 I311	F95-L120 CarbonylContact O-C 3.52Å; F95-L120 WeakPolarHBondContact O-CA 3.21Å; E96-L120 HydrophobicContact CB-CG 4.27Å; L118-L120 HydrophobicContact CD2-CD1 4.21Å; L118-L120 HydrophobicContact CG-CD1 4.25Å; L120-N138 PolarHBondContact N-O 2.64Å; L120-N138 WeakPolarHBondContact O-CB 3.18Å; L120-F140 HydrophobicContact CD1-CD2 4.31Å; L120-F140 HydrophobicContact CD1-CE2 4.14Å; L120-P155 HydrophobicContact CD1-CB 3.53Å; L120-P155 HydrophobicContact CD1-CG 3.77Å; L120-P155 HydrophobicContact CD2-CB 3.19Å; L120-P155 HydrophobicContact CD2-CG 4.27Å; L120-P155 HydrophobicContact CG-CB 3.55Å; L120-P155 HydrophobicContact CG-CG 4.13Å; L120-F296 HydrophobicContact CD2-CE1 3.76Å; L120-F296 HydrophobicContact CD2-CZ 4.08Å; L120-W307 HydrophobicContact CB-CH2 3.77Å; L120-W307 HydrophobicContact CB-CZ2 3.6Å; L120-W307 HydrophobicContact CD1-CH2 4.38Å; L120-W307 HydrophobicContact CD1-CZ2 4.28Å; L120-W307 HydrophobicContact CD2-CH2 4.44Å; L120-W307 HydrophobicContact CD2-CZ2 3.58Å; L120-W307 HydrophobicContact CG-CH2 4.44Å; L120-W307 HydrophobicContact CG-CZ2 4.03Å; L120-I311 HydrophobicContact CD1-CD1 4.45Å; L120-I311 HydrophobicContact CD1-CG1 4.43Å; L120-I311 HydrophobicContact CD1-CG2 4.48Å; L120-I311 HydrophobicContact CD2-CD1 4.3Å
121	M	84.2	Confident	91.1	Very high	6 Å²	6	31.4 Å²	31.4	3%	0.03	18%	0.178	C	C	.	.			trans	-125.4	131	-176.2	-51.9	175.7	81.7	0	0	106.4	F95 L97 S124 L125 A127 C132 V133 V134	F95-M121 VanDerWaalsContact CD1-O 3.31Å; F95-M121 WeakPolarHBondContact CD1-O 3.48Å; F95-M121 PolarHBondContact O-N 3.43Å; L97-M121 HydrophobicContact CD2-SD 4.39Å; M121-S124 VanDerWaalsContact CE-OG 3.24Å; M121-S124 WeakPolarHBondContact CE-OG 3.23Å; M121-L125 WeakPolarHBondContact CE-O 3.31Å; M121-A127 HydrophobicContact SD-CB 4.33Å; M121-C132 VanDerWaalsContact CE-SG 3.56Å; M121-V133 WeakPolarHBondContact CE-O 3.08Å; M121-V134 HydrophobicContact CE-CG1 4.13Å; M121-V134 HydrophobicContact CG-CG1 4.09Å; M121-V134 HydrophobicContact SD-CG1 4.03Å
122	T	69.3	Low	90.9	Very high	45 Å²	45	31.1 Å²	31.1	28%	0.276	18%	0.178	S	C	.	.	S	Bend	trans	-101.2	-48.3	176.2	51	0	0	0	0	111	A300	T122-A300 HydrophobicContact CG2-CB 3.98Å
123	K	70.9	Confident	90.8	Very high	107 Å²	107	26.1 Å²	26.1	47%	0.465	16%	0.158	S	C	.	.	S	Bend	trans	-118.2	-29.4	-174.4	-66.2	-179.4	179.4	169	0	114.8	Y85 E301	Y85-K123 PolarHBondContact OH-O 2.84Å; K123-E301 WeakPolarHBondContact CE-OE1 3.33Å; K123-E301 IonicContact NZ-OE1 2.75Å; K123-E301 PolarHBondContact NZ-OE1 2.84Å; K123-E301 IonicContact NZ-OE2 2.76Å
124	S	76.7	Confident	90.7	Very high	82 Å²	82	21.6 Å²	21.6	57%	0.573	13%	0.131	S	C	*	.	S	Bend	trans	-67.1	-38.7	-179.4	41.2	0	0	0	0	112	M121	M121-S124 VanDerWaalsContact CE-OG 3.24Å; M121-S124 WeakPolarHBondContact CE-OG 3.23Å
125	L	85.6	Confident	90.6	Very high	13 Å²	13	21.1 Å²	21.1	7%	0.068	12%	0.121	C	C	.	.			trans	51.7	166.5	-170.2	-55	175.5	0	0	0	112.6	M78 Y85 P87 F91 T92 F95 M121	M78-L125 HydrophobicContact CG-CD1 4.48Å; Y85-L125 HydrophobicContact CE1-CD1 4.22Å; P87-L125 HydrophobicContact CB-CD1 4.15Å; P87-L125 HydrophobicContact CG-CD1 3.82Å; F91-L125 HydrophobicContact CD2-CD1 3.96Å; F91-L125 HydrophobicContact CE2-CD1 4.23Å; T92-L125 VanDerWaalsContact O-CB 3.31Å; T92-L125 WeakPolarHBondContact O-CB 3.32Å; F95-L125 HydrophobicContact CD1-CD2 3.68Å; F95-L125 HydrophobicContact CE1-CD2 3.45Å; F95-L125 VanDerWaalsContact CE1-CD2 3.45Å; F95-L125 HydrophobicContact CE2-CD2 4.42Å; F95-L125 HydrophobicContact CG-CD2 4.27Å; F95-L125 HydrophobicContact CZ-CD2 3.87Å; M121-L125 WeakPolarHBondContact CE-O 3.31Å
126	G	91.9	Very high	90.5	Very high	9 Å²	9	20.6 Å²	20.6	9%	0.093	12%	0.117	C	C	.	.			trans	133.3	6	172.2	0	0	0	0	0	115.6	T92 P93 G94 F128 C132	T92-G126 WeakPolarHBondContact O-CA 3.4Å; T92-G126 PolarHBondContact O-N 3.46Å; P93-G126 CarbonylContact O-C 3.47Å; G94-G126 PolarHBondContact O-N 3.49Å; G126-F128 PolarHBondContact O-N 2.75Å; G126-C132 VanDerWaalsContact C-SG 3.53Å; G126-C132 PolarHBondContact O-SG 3.21Å; G126-C132 VanDerWaalsContact O-SG 3.36Å
127	A	93.9	Very high	90.3	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.146	C	C	.	.			trans	-62.3	-22.3	-178.4	0	0	0	0	0	113.2	A69 P93 G94 E96 L97 M121 A129	A69-A127 HydrophobicContact CB-CB 4.14Å; A69-A127 VanDerWaalsContact CB-O 3.31Å; A69-A127 WeakPolarHBondContact CB-O 3.38Å; P93-A127 PolarHBondContact O-N 2.47Å; G94-A127 PolarHBondContact O-N 3.09Å; E96-A127 WeakPolarHBondContact O-CB 3.46Å; L97-A127 HydrophobicContact CB-CB 3.92Å; L97-A127 HydrophobicContact CD2-CB 3.87Å; L97-A127 HydrophobicContact CG-CB 4.42Å; M121-A127 HydrophobicContact SD-CB 4.33Å; A127-A129 PolarHBondContact O-N 3.31Å
128	F	93.4	Very high	90.1	Very high	1 Å²	1	29.1 Å²	29.1	0%	0.004	16%	0.157	C	C	.	.	S	Bend	trans	-82.5	57.3	177.3	-60.4	-6.3	0	0	0	111.8	V37 A69 G70 V71 D75 T92 P93 G94 G126 L333 I354 L372	V37-F128 HydrophobicContact CB-CB 3.88Å; V37-F128 HydrophobicContact CG2-CB 3.96Å; V37-F128 PolarHBondContact N-O 2.56Å; A69-F128 HydrophobicContact CB-CD1 3.86Å; A69-F128 HydrophobicContact CB-CE1 4.18Å; G70-F128 WeakPolarHBondContact O-CE1 3.47Å; V71-F128 HydrophobicContact CB-CZ 4.13Å; V71-F128 HydrophobicContact CG1-CE2 4.33Å; V71-F128 HydrophobicContact CG1-CZ 3.88Å; V71-F128 HydrophobicContact CG2-CE1 4.15Å; V71-F128 HydrophobicContact CG2-CZ 3.9Å; D75-F128 HydrophobicContact CB-CE2 4.15Å; D75-F128 HydrophobicContact CB-CZ 4.12Å; T92-F128 HydrophobicContact CG2-CB 4.34Å; T92-F128 WeakPolarHBondContact CG2-O 3.28Å; P93-F128 HydrophobicContact CB-CD2 3.69Å; P93-F128 HydrophobicContact CB-CE2 3.87Å; P93-F128 HydrophobicContact CG-CD2 4.26Å; P93-F128 WeakPolarHBondContact O-CB 3.39Å; P93-F128 WeakPolarHBondContact O-CG 3.37Å; P93-F128 PolarHBondContact O-N 2.99Å; G94-F128 VanDerWaalsContact CA-CE1 3.44Å; G126-F128 PolarHBondContact O-N 2.75Å; F128-L333 HydrophobicContact CB-CD1 4.47Å; F128-I354 HydrophobicContact CD2-CD1 3.76Å; F128-I354 HydrophobicContact CD2-CG1 4.44Å; F128-I354 HydrophobicContact CE2-CD1 3.82Å; F128-L372 HydrophobicContact CB-CD1 3.96Å; F128-L372 HydrophobicContact CD1-CD1 3.37Å; F128-L372 HydrophobicContact CD1-CG 4.46Å; F128-L372 HydrophobicContact CD2-CD1 3.9Å; F128-L372 HydrophobicContact CE1-CD1 3.79Å; F128-L372 HydrophobicContact CE2-CD1 4.27Å; F128-L372 HydrophobicContact CG-CD1 3.45Å; F128-L372 VanDerWaalsContact CG-CD1 3.45Å; F128-L372 HydrophobicContact CZ-CD1 4.24Å
129	A	92.1	Very high	90	Very high	2 Å²	2	29 Å²	29	2%	0.017	16%	0.157	C	C	.	.	B	Isolated β-bridge	trans	-147.5	162.8	179.8	0	0	0	0	0	110.9	Y34 K35 A36 V66 T92 A127 L131	Y34-A129 HydrophobicContact CD2-CB 4.3Å; Y34-A129 HydrophobicContact CE2-CB 4.36Å; K35-A129 CarbonylContact O-C 3.02Å; K35-A129 VanDerWaalsContact O-CA 3.22Å; K35-A129 WeakPolarHBondContact O-CA 3.29Å; A36-A129 HydrophobicContact CB-CB 3.79Å; V66-A129 WeakPolarHBondContact CB-O 3.3Å; V66-A129 VanDerWaalsContact CG2-O 3.25Å; V66-A129 WeakPolarHBondContact CG2-O 3.24Å; T92-A129 HydrophobicContact CG2-CB 4.32Å; A127-A129 PolarHBondContact O-N 3.31Å; A129-L131 VanDerWaalsContact C-N 3.34Å; A129-L131 VanDerWaalsContact CB-O 3.24Å; A129-L131 WeakPolarHBondContact CB-O 3.38Å
130	T	92.3	Very high	90	Very high	17 Å²	17	29.3 Å²	29.3	10%	0.104	16%	0.158	C	C	.	.	S	Bend	trans	-77.5	-24	175.2	62.9	0	0	0	0	112.5	Y34 K35 V66 L333 V374	Y34-T130 WeakPolarHBondContact CA-OG1 3.37Å; Y34-T130 WeakPolarHBondContact CB-OG1 3.48Å; K35-T130 HydrophobicContact CB-CG2 3.92Å; K35-T130 PolarHBondContact N-OG1 2.91Å; K35-T130 PolarHBondContact O-N 2.77Å; V66-T130 PolarHBondContact N-O 3.5Å; V66-T130 VanDerWaalsContact N-O 3.16Å; T130-L333 HydrophobicContact CG2-CD2 3.87Å; T130-V374 HydrophobicContact CG2-CG1 3.73Å
131	L	92.3	Very high	90.2	Very high	19 Å²	19	32.9 Å²	32.9	10%	0.099	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	138.5	170.5	-65.1	-178.1	0	0	0	109.4	Y34 T54 P55 L63 V64 K65 A129	Y34-L131 HydrophobicContact CD2-CB 4.18Å; Y34-L131 HydrophobicContact CG-CB 4.13Å; Y34-L131 HydrophobicContact CG-CD1 4.41Å; Y34-L131 HydrophobicContact CG-CG 4.49Å; T54-L131 HydrophobicContact CG2-CD1 4.43Å; P55-L131 HydrophobicContact CG-CB 4.35Å; L63-L131 HydrophobicContact CD1-CB 4.19Å; L63-L131 HydrophobicContact CD2-CD1 4.43Å; V64-L131 WeakPolarHBondContact O-CA 3.3Å; K65-L131 HydrophobicContact CB-CD2 4.37Å; K65-L131 HydrophobicContact CG-CD2 3.59Å; A129-L131 VanDerWaalsContact C-N 3.34Å; A129-L131 VanDerWaalsContact CB-O 3.24Å; A129-L131 WeakPolarHBondContact CB-O 3.38Å
132	C	94.1	Very high	90.8	Very high	6 Å²	6	32.7 Å²	32.7	4%	0.041	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	135.7	178.7	-168.1	0	0	0	0	111	V64 V66 L97 M121 G126	V64-C132 PolarHBondContact N-O 3.21Å; V64-C132 PolarHBondContact O-N 3.03Å; V66-C132 HydrophobicContact CG2-CB 3.73Å; L97-C132 HydrophobicContact CD2-CB 3.51Å; L97-C132 VanDerWaalsContact CD2-SG 3.58Å; M121-C132 VanDerWaalsContact CE-SG 3.56Å; G126-C132 VanDerWaalsContact C-SG 3.53Å; G126-C132 PolarHBondContact O-SG 3.21Å; G126-C132 VanDerWaalsContact O-SG 3.36Å
133	V	94.9	Very high	92	Very high	29 Å²	29	32.2 Å²	32.2	18%	0.176	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	126.6	173.1	-177.7	0	0	0	0	108.5	P55 I57 E61 I62 L63 M121	P55-V133 HydrophobicContact CB-CG2 3.41Å; P55-V133 VanDerWaalsContact CB-CG2 3.41Å; P55-V133 HydrophobicContact CG-CG2 4.41Å; I57-V133 HydrophobicContact CG2-CG1 3.97Å; I57-V133 HydrophobicContact CG2-CG2 3.92Å; E61-V133 HydrophobicContact CB-CG1 3.86Å; E61-V133 HydrophobicContact CG-CG1 4.23Å; E61-V133 VanDerWaalsContact OE2-CG1 3.28Å; E61-V133 WeakPolarHBondContact OE2-CG1 3.18Å; I62-V133 WeakPolarHBondContact O-CA 3.19Å; L63-V133 HydrophobicContact CD1-CG2 3.87Å; M121-V133 WeakPolarHBondContact CE-O 3.08Å
134	V	95.7	Very high	93.2	Very high	2 Å²	2	35.1 Å²	35.1	1%	0.012	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	150.6	-180	-58.9	0	0	0	0	110.5	E61 I62 V64 L97 A119 M121 T139	E61-V134 WeakPolarHBondContact CA-O 3.38Å; I62-V134 HydrophobicContact CD1-CG2 3.67Å; I62-V134 HydrophobicContact CG1-CG2 3.32Å; I62-V134 PolarHBondContact N-O 3.02Å; I62-V134 PolarHBondContact O-N 2.87Å; V64-V134 HydrophobicContact CG2-CG2 3.73Å; L97-V134 HydrophobicContact CD2-CG1 4.15Å; A119-V134 HydrophobicContact CB-CB 4.07Å; A119-V134 HydrophobicContact CB-CG1 3.89Å; A119-V134 HydrophobicContact CB-CG2 3.85Å; M121-V134 HydrophobicContact CE-CG1 4.13Å; M121-V134 HydrophobicContact CG-CG1 4.09Å; M121-V134 HydrophobicContact SD-CG1 4.03Å; V134-T139 WeakPolarHBondContact CG2-OG1 3.46Å
135	S	94.9	Very high	94	Very high	34 Å²	34	35.1 Å²	35.1	24%	0.238	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	140.1	173.7	179.8	0	0	0	0	110.3	K137 N138 T139	S135-K137 PolarHBondContact O-N 2.81Å; S135-K137 PolarHBondContact OG-N 3.23Å; S135-N138 PolarHBondContact O-N 2.65Å; S135-N138 VanDerWaalsContact O-N 3.15Å; S135-T139 PolarHBondContact O-N 3.33Å; S135-T139 PolarHBondContact O-OG1 3.28Å
136	E	94.7	Very high	94.5	Very high	21 Å²	21	34.8 Å²	34.8	10%	0.098	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-51.8	-37.7	170.4	175.6	178.7	-136.8	0	0	111.4	D60 V108 S109 R110 F111 N138 T139	D60-E136 PolarHBondContact O-N 3.22Å; V108-E136 HydrophobicContact CG1-CG 4.39Å; V108-E136 WeakPolarHBondContact CG1-OE1 3.38Å; V108-E136 HydrophobicContact CG2-CB 4.29Å; S109-E136 PolarHBondContact N-OE1 2.88Å; R110-E136 HydrophobicContact CB-CG 4.31Å; R110-E136 VanDerWaalsContact CB-OE1 3.24Å; R110-E136 WeakPolarHBondContact CB-OE1 3.48Å; R110-E136 WeakPolarHBondContact CG-OE1 3.21Å; R110-E136 PolarHBondContact N-OE1 2.98Å; R110-E136 PolarHBondContact NH1-O 3.39Å; F111-E136 HydrophobicContact CD2-CG 3.93Å; F111-E136 HydrophobicContact CE2-CG 3.93Å; E136-N138 VanDerWaalsContact C-N 3.29Å; E136-N138 PolarHBondContact O-N 3.07Å; E136-T139 PolarHBondContact O-N 2.85Å
137	K	93.1	Very high	94.7	Very high	163 Å²	163	37.8 Å²	37.8	71%	0.709	20%	0.204	S	C	*	.	G	3₁₀ helix	trans	-65	-29.5	-177.1	-66.7	-176.4	179.3	177.7	0	113.9	S135	S135-K137 PolarHBondContact O-N 2.81Å; S135-K137 PolarHBondContact OG-N 3.23Å
138	N	93.6	Very high	94.7	Very high	43 Å²	43	38.5 Å²	38.5	23%	0.23	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-102.4	16.6	-179.8	-55.9	-14	0	0	0	112.5	A119 L120 S135 E136 W307	A119-N138 WeakPolarHBondContact CA-O 3.41Å; L120-N138 PolarHBondContact N-O 2.64Å; L120-N138 WeakPolarHBondContact O-CB 3.18Å; S135-N138 PolarHBondContact O-N 2.65Å; S135-N138 VanDerWaalsContact O-N 3.15Å; E136-N138 VanDerWaalsContact C-N 3.29Å; E136-N138 PolarHBondContact O-N 3.07Å; N138-W307 HydrophobicContact CB-CH2 4.05Å; N138-W307 HydrophobicContact CB-CZ3 4.29Å
139	T	96.2	Very high	94.8	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	140.2	179.7	-53.9	0	0	0	0	109.8	I62 R110 F111 V117 L118 A119 V134 S135 E136	I62-T139 HydrophobicContact CD1-CG2 3.53Å; R110-T139 PolarHBondContact NH1-O 3.37Å; R110-T139 PolarHBondContact NH2-O 2.93Å; R110-T139 VanDerWaalsContact NH2-O 3.16Å; F111-T139 HydrophobicContact CD2-CG2 4.49Å; F111-T139 HydrophobicContact CE1-CG2 4.01Å; F111-T139 HydrophobicContact CE2-CG2 3.82Å; F111-T139 HydrophobicContact CZ-CG2 3.56Å; F111-T139 WeakPolarHBondContact CZ-O 3.13Å; V117-T139 HydrophobicContact CB-CG2 3.57Å; V117-T139 HydrophobicContact CG1-CG2 3.68Å; V117-T139 HydrophobicContact CG2-CG2 4.22Å; L118-T139 WeakPolarHBondContact O-CA 3.47Å; A119-T139 HydrophobicContact CB-CG2 4.35Å; V134-T139 WeakPolarHBondContact CG2-OG1 3.46Å; S135-T139 PolarHBondContact O-N 3.33Å; S135-T139 PolarHBondContact O-OG1 3.28Å; E136-T139 PolarHBondContact O-N 2.85Å
140	F	97.4	Very high	95	Very high	5 Å²	5	40.6 Å²	40.6	2%	0.022	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	145.4	-179.3	-55.1	-90.4	0	0	0	109.6	V117 L118 L120 L142 W307 G308 I311 E312 L315	V117-F140 VanDerWaalsContact CA-O 3.31Å; V117-F140 WeakPolarHBondContact CA-O 3.5Å; L118-F140 PolarHBondContact N-O 3.22Å; L118-F140 PolarHBondContact O-N 3.49Å; L120-F140 HydrophobicContact CD1-CD2 4.31Å; L120-F140 HydrophobicContact CD1-CE2 4.14Å; F140-L142 PolarHBondContact O-N 2.79Å; F140-W307 AromaticContact CE2-CH2 3.79Å; F140-W307 HydrophobicContact CE2-CH2 3.79Å; F140-W307 AromaticContact CE2-CZ3 3.85Å; F140-W307 HydrophobicContact CE2-CZ3 3.85Å; F140-W307 HydrophobicContact CZ-CE3 4.24Å; F140-W307 HydrophobicContact CZ-CH2 4.05Å; F140-W307 AromaticContact CZ-CZ3 3.64Å; F140-W307 HydrophobicContact CZ-CZ3 3.64Å; F140-G308 WeakPolarHBondContact CE1-O 3.24Å; F140-I311 HydrophobicContact CB-CG2 4.47Å; F140-I311 HydrophobicContact CD1-CB 4.31Å; F140-I311 HydrophobicContact CD1-CG2 3.9Å; F140-I311 HydrophobicContact CD2-CB 4.31Å; F140-I311 HydrophobicContact CD2-CG2 3.51Å; F140-I311 HydrophobicContact CE1-CB 3.89Å; F140-I311 HydrophobicContact CE1-CG2 3.97Å; F140-I311 HydrophobicContact CE2-CB 3.91Å; F140-I311 HydrophobicContact CE2-CG1 4.14Å; F140-I311 HydrophobicContact CE2-CG2 3.6Å; F140-I311 HydrophobicContact CG-CG2 3.68Å; F140-I311 HydrophobicContact CZ-CB 3.68Å; F140-I311 HydrophobicContact CZ-CG1 4.09Å; F140-I311 HydrophobicContact CZ-CG2 3.83Å; F140-E312 HydrophobicContact CD1-CG 3.76Å; F140-E312 HydrophobicContact CE1-CG 4.05Å; F140-L315 HydrophobicContact CB-CD1 3.84Å
141	V	97	Very high	95.2	Very high	87 Å²	87	39.8 Å²	39.8	53%	0.527	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66	131.7	172	177.1	0	0	0	0	108.2	F111 P143	F111-V141 HydrophobicContact CD1-CG2 4.38Å; F111-V141 HydrophobicContact CE1-CG2 3.7Å; V141-P143 WeakPolarHBondContact O-CD 3.24Å
142	L	97.4	Very high	95.2	Very high	2 Å²	2	38.9 Å²	38.9	1%	0.01	21%	0.208	C	C	.	.			trans	-95.9	113.7	175	176.1	57.2	0	0	0	109.6	T98 R116 F140 I146 Y148 A151 L315	T98-L142 HydrophobicContact CG2-CD2 4.35Å; R116-L142 HydrophobicContact CB-CB 3.98Å; R116-L142 HydrophobicContact CB-CG 4.46Å; R116-L142 PolarHBondContact O-N 2.93Å; F140-L142 PolarHBondContact O-N 2.79Å; L142-I146 HydrophobicContact CD1-CB 3.93Å; L142-I146 HydrophobicContact CD1-CG2 4.22Å; L142-Y148 HydrophobicContact CD2-CD1 3.62Å; L142-Y148 HydrophobicContact CD2-CE1 3.88Å; L142-A151 HydrophobicContact CD1-CB 3.34Å; L142-A151 HydrophobicContact CD2-CB 4.04Å; L142-A151 HydrophobicContact CG-CB 4.36Å; L142-L315 HydrophobicContact CD1-CD2 4.34Å
143	P	94.9	Very high	95.2	Very high	35 Å²	35	38.7 Å²	38.7	23%	0.227	21%	0.207	C	C	.	.			trans	-55.2	152.8	176.4	-28.4	36.5	0	0	0	113.7	R116 V141 S145 I146	R116-P143 PolarHBondContact NH1-O 3.27Å; V141-P143 WeakPolarHBondContact O-CD 3.24Å; P143-S145 VanDerWaalsContact C-N 3.28Å; P143-S145 WeakPolarHBondContact CB-OG 3.41Å; P143-S145 PolarHBondContact O-N 3.28Å; P143-I146 HydrophobicContact CB-CD1 4.46Å; P143-I146 HydrophobicContact CB-CG1 4.45Å; P143-I146 HydrophobicContact CG-CD1 4.25Å; P143-I146 PolarHBondContact O-N 3.38Å
144	H	94.5	Very high	95.3	Very high	167 Å²	167	37.3 Å²	37.3	77%	0.773	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-28	-178.6	-87.3	-81.6	0	0	0	114.4	R116 I146	R116-H144 VanDerWaalsContact NH1-CA 3.26Å; R116-H144 PolarHBondContact NH1-O 3.18Å; H144-I146 VanDerWaalsContact C-N 3.33Å
145	S	95.1	Very high	95.2	Very high	83 Å²	83	37.3 Å²	37.3	58%	0.58	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-28.4	175.8	42.3	0	0	0	0	114.1	P143 D319	P143-S145 VanDerWaalsContact C-N 3.28Å; P143-S145 WeakPolarHBondContact CB-OG 3.41Å; P143-S145 PolarHBondContact O-N 3.28Å; S145-D319 VanDerWaalsContact CB-OD1 3.27Å; S145-D319 WeakPolarHBondContact CB-OD1 3.12Å; S145-D319 PolarHBondContact OG-OD1 3.5Å
146	I	95.6	Very high	95.2	Very high	5 Å²	5	36.4 Å²	36.4	3%	0.026	19%	0.193	C	C	.	.	S	Bend	trans	-100.9	123.5	-177	-46.8	174.2	0	0	0	108.6	R116 L142 P143 H144 T150 A151 L315 Q318 D319	R116-I146 PolarHBondContact NH1-O 2.91Å; R116-I146 PolarHBondContact NH2-O 2.73Å; L142-I146 HydrophobicContact CD1-CB 3.93Å; L142-I146 HydrophobicContact CD1-CG2 4.22Å; P143-I146 HydrophobicContact CB-CD1 4.46Å; P143-I146 HydrophobicContact CB-CG1 4.45Å; P143-I146 HydrophobicContact CG-CD1 4.25Å; P143-I146 PolarHBondContact O-N 3.38Å; H144-I146 VanDerWaalsContact C-N 3.33Å; I146-T150 HydrophobicContact CG2-CG2 3.95Å; I146-A151 HydrophobicContact CG2-CB 3.77Å; I146-L315 HydrophobicContact CD1-CD2 4.2Å; I146-Q318 HydrophobicContact CD1-CB 3.86Å; I146-Q318 HydrophobicContact CD1-CG 3.64Å; I146-Q318 HydrophobicContact CG1-CG 3.92Å; I146-Q318 HydrophobicContact CG2-CG 3.86Å; I146-D319 HydrophobicContact CD1-CB 4.2Å
147	D	95.2	Very high	95.2	Very high	72 Å²	72	35.5 Å²	35.5	39%	0.385	19%	0.189	S	C	.	.			trans	-71.1	165.1	174.5	72.3	82.8	0	0	0	111.9	E149 T150 A151	D147-E149 VanDerWaalsContact C-N 3.33Å; D147-E149 PolarHBondContact O-N 3.35Å; D147-E149 WeakPolarHBondContact OD1-CA 3.1Å; D147-E149 WeakPolarHBondContact OD1-CB 3.48Å; D147-E149 PolarHBondContact OD1-N 3.26Å; D147-T150 VanDerWaalsContact CG-OG1 3.29Å; D147-T150 PolarHBondContact OD1-N 3.28Å; D147-T150 PolarHBondContact OD1-OG1 3.39Å; D147-T150 WeakPolarHBondContact OD2-CB 3.39Å; D147-T150 PolarHBondContact OD2-OG1 3.07Å; D147-A151 VanDerWaalsContact O-CB 3.31Å; D147-A151 WeakPolarHBondContact O-CB 3.46Å; D147-A151 PolarHBondContact O-N 3.22Å; D147-A151 VanDerWaalsContact O-N 3.12Å
148	Y	95.5	Very high	95.4	Very high	15 Å²	15	28 Å²	28	6%	0.059	16%	0.157	C	C	.	.	H	α-helix	trans	-64.2	-35.2	-175.3	-72.2	-65.2	0	0	0	113.6	R67 T98 G99 K100 R116 L142 C152	R67-Y148 HydrophobicContact CB-CD1 4.05Å; R67-Y148 HydrophobicContact CB-CD2 4.03Å; R67-Y148 HydrophobicContact CB-CE1 4.49Å; R67-Y148 HydrophobicContact CB-CE2 4.47Å; R67-Y148 HydrophobicContact CB-CG 3.79Å; R67-Y148 HydrophobicContact CG-CD1 4.24Å; R67-Y148 HydrophobicContact CG-CD2 4Å; R67-Y148 HydrophobicContact CG-CE1 4.19Å; R67-Y148 HydrophobicContact CG-CE2 3.95Å; R67-Y148 HydrophobicContact CG-CG 4.14Å; T98-Y148 WeakPolarHBondContact CG2-O 3.43Å; T98-Y148 WeakPolarHBondContact OG1-CA 3.26Å; T98-Y148 WeakPolarHBondContact OG1-CB 3.26Å; T98-Y148 PolarHBondContact OG1-O 3.02Å; G99-Y148 WeakPolarHBondContact O-CE1 3.45Å; K100-Y148 VanDerWaalsContact CE-OH 3.24Å; K100-Y148 WeakPolarHBondContact CE-OH 3.45Å; K100-Y148 WeakPolarHBondContact CG-OH 3.29Å; R116-Y148 HydrophobicContact CB-CE1 4.32Å; R116-Y148 HydrophobicContact CG-CE1 4.47Å; R116-Y148 WeakPolarHBondContact CG-OH 3.47Å; R116-Y148 VanDerWaalsContact NE-CZ 3.31Å; R116-Y148 PolarHBondContact NE-OH 3.22Å; L142-Y148 HydrophobicContact CD2-CD1 3.62Å; L142-Y148 HydrophobicContact CD2-CE1 3.88Å; Y148-C152 WeakPolarHBondContact O-CB 3.36Å; Y148-C152 PolarHBondContact O-N 3.42Å
149	E	94.9	Very high	95.5	Very high	22 Å²	22	26 Å²	26	10%	0.103	15%	0.146	C	C	.	.	H	α-helix	trans	-77.9	-47.5	-175.6	-64.1	-175.6	170	0	0	111.2	D147 A151 C152 C153 V327 R330 I371 T373	D147-E149 VanDerWaalsContact C-N 3.33Å; D147-E149 PolarHBondContact O-N 3.35Å; D147-E149 WeakPolarHBondContact OD1-CA 3.1Å; D147-E149 WeakPolarHBondContact OD1-CB 3.48Å; D147-E149 PolarHBondContact OD1-N 3.26Å; E149-A151 VanDerWaalsContact C-N 3.33Å; E149-A151 PolarHBondContact O-N 3.29Å; E149-C152 WeakPolarHBondContact O-CB 3.14Å; E149-C152 PolarHBondContact O-N 3.49Å; E149-C152 VanDerWaalsContact O-N 3.09Å; E149-C153 PolarHBondContact O-N 3.14Å; E149-C153 PolarHBondContact O-SG 3.43Å; E149-C153 VanDerWaalsContact O-SG 3.34Å; E149-V327 HydrophobicContact CB-CG2 4.34Å; E149-R330 IonicContact OE1-NE 3.24Å; E149-R330 PolarHBondContact OE1-NE 2.98Å; E149-R330 IonicContact OE2-CZ 2.77Å; E149-R330 IonicContact OE2-NE 2.69Å; E149-R330 PolarHBondContact OE2-NE 2.9Å; E149-R330 IonicContact OE2-NH2 3.45Å; E149-R330 PolarHBondContact OE2-NH2 2.87Å; E149-I371 HydrophobicContact CB-CD1 3.69Å; E149-I371 HydrophobicContact CG-CD1 4.38Å; E149-I371 WeakPolarHBondContact O-CD1 3.41Å; E149-T373 WeakPolarHBondContact OE1-CG2 3.28Å
150	T	95	Very high	95.5	Very high	25 Å²	25	27 Å²	27	15%	0.153	15%	0.152	C	C	.	.	H	α-helix	trans	-55.3	-50	174.4	-64.6	0	0	0	0	110.3	I146 D147 C152 C153 Q318 P325	I146-T150 HydrophobicContact CG2-CG2 3.95Å; D147-T150 VanDerWaalsContact CG-OG1 3.29Å; D147-T150 PolarHBondContact OD1-N 3.28Å; D147-T150 PolarHBondContact OD1-OG1 3.39Å; D147-T150 WeakPolarHBondContact OD2-CB 3.39Å; D147-T150 PolarHBondContact OD2-OG1 3.07Å; T150-C152 PolarHBondContact O-N 2.71Å; T150-C153 VanDerWaalsContact O-CB 3.3Å; T150-C153 WeakPolarHBondContact O-CB 3.31Å; T150-C153 PolarHBondContact O-N 3.15Å; T150-Q318 HydrophobicContact CG2-CG 4.25Å; T150-P325 HydrophobicContact CG2-CG 3.59Å
151	A	96.4	Very high	95.5	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-60.4	-34.2	178.1	0	0	0	0	0	113.1	T98 L118 L142 I146 D147 E149 C153 L154 P155	T98-A151 HydrophobicContact CG2-CB 3.82Å; L118-A151 WeakPolarHBondContact CD1-O 2.99Å; L142-A151 HydrophobicContact CD1-CB 3.34Å; L142-A151 HydrophobicContact CD2-CB 4.04Å; L142-A151 HydrophobicContact CG-CB 4.36Å; I146-A151 HydrophobicContact CG2-CB 3.77Å; D147-A151 VanDerWaalsContact O-CB 3.31Å; D147-A151 WeakPolarHBondContact O-CB 3.46Å; D147-A151 PolarHBondContact O-N 3.22Å; D147-A151 VanDerWaalsContact O-N 3.12Å; E149-A151 VanDerWaalsContact C-N 3.33Å; E149-A151 PolarHBondContact O-N 3.29Å; A151-C153 PolarHBondContact O-N 2.92Å; A151-L154 WeakPolarHBondContact O-CB 3.28Å; A151-L154 PolarHBondContact O-N 2.92Å; A151-P155 WeakPolarHBondContact O-CD 3.24Å
152	C	93.9	Very high	95.5	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-72.6	-13.2	179	-155.4	0	0	0	0	113.5	A69 G70 T98 Y148 E149 T150	A69-C152 VanDerWaalsContact CA-SG 3.58Å; G70-C152 PolarHBondContact N-SG 2.78Å; T98-C152 HydrophobicContact CG2-CB 3.86Å; Y148-C152 WeakPolarHBondContact O-CB 3.36Å; Y148-C152 PolarHBondContact O-N 3.42Å; E149-C152 WeakPolarHBondContact O-CB 3.14Å; E149-C152 PolarHBondContact O-N 3.49Å; E149-C152 VanDerWaalsContact O-N 3.09Å; T150-C152 PolarHBondContact O-N 2.71Å
153	C	94.3	Very high	95.5	Very high	2 Å²	2	24.4 Å²	24.4	1%	0.014	13%	0.134	C	C	.	.	H	α-helix	trans	-79.9	-22	174	-63.3	0	0	0	0	113.4	E149 T150 A151 A157 P325 K369	E149-C153 PolarHBondContact O-N 3.14Å; E149-C153 PolarHBondContact O-SG 3.43Å; E149-C153 VanDerWaalsContact O-SG 3.34Å; T150-C153 VanDerWaalsContact O-CB 3.3Å; T150-C153 WeakPolarHBondContact O-CB 3.31Å; T150-C153 PolarHBondContact O-N 3.15Å; A151-C153 PolarHBondContact O-N 2.92Å; C153-A157 WeakPolarHBondContact O-CB 3.36Å; C153-P325 HydrophobicContact CB-CB 3.68Å; C153-K369 HydrophobicContact CB-CB 4.1Å; C153-K369 HydrophobicContact CB-CG 4.24Å; C153-K369 WeakPolarHBondContact SG-CB 3.27Å
154	L	96.1	Very high	95.6	Very high	1 Å²	1	22.8 Å²	22.8	1%	0.005	12%	0.123	C	C	.	.	H	α-helix	trans	-72.3	-54.2	-167	-59.5	176.2	0	0	0	113.7	A151 A156 A157 Y158 I314 L315 Q318 I323 P325	A151-L154 WeakPolarHBondContact O-CB 3.28Å; A151-L154 PolarHBondContact O-N 2.92Å; L154-A156 PolarHBondContact O-N 3.32Å; L154-A157 PolarHBondContact O-N 3.02Å; L154-Y158 HydrophobicContact CD2-CD2 3.89Å; L154-Y158 HydrophobicContact CD2-CE2 4.13Å; L154-Y158 HydrophobicContact CD2-CG 4.29Å; L154-Y158 WeakPolarHBondContact O-CA 3.42Å; L154-Y158 VanDerWaalsContact O-CB 3.26Å; L154-Y158 WeakPolarHBondContact O-CB 3.33Å; L154-Y158 PolarHBondContact O-N 3.4Å; L154-I314 HydrophobicContact CB-CG2 3.81Å; L154-I314 HydrophobicContact CD1-CG2 4.3Å; L154-I314 HydrophobicContact CD2-CG2 4.19Å; L154-I314 HydrophobicContact CG-CG2 4.32Å; L154-L315 HydrophobicContact CD1-CD2 4Å; L154-Q318 HydrophobicContact CD1-CB 3.87Å; L154-Q318 HydrophobicContact CD1-CG 4.06Å; L154-Q318 HydrophobicContact CD2-CB 4.42Å; L154-I323 HydrophobicContact CD2-CD1 3.83Å; L154-P325 HydrophobicContact CD2-CB 4.1Å; L154-P325 HydrophobicContact CD2-CG 3.83Å
155	P	94.5	Very high	95.8	Very high	1 Å²	1	14.8 Å²	14.8	1%	0.006	9%	0.086	C	C	.	.	H	α-helix	trans	-68.1	-54.1	-152	-24.2	35.3	0	0	0	114.4	E96 L118 L120 A151 G159 F296 I311	E96-P155 WeakPolarHBondContact OE2-CB 3.25Å; E96-P155 VanDerWaalsContact OE2-CD 3.3Å; E96-P155 WeakPolarHBondContact OE2-CD 3.47Å; L118-P155 HydrophobicContact CD1-CG 3.63Å; L118-P155 HydrophobicContact CD2-CG 3.72Å; L118-P155 HydrophobicContact CG-CG 4.03Å; L120-P155 HydrophobicContact CD1-CB 3.53Å; L120-P155 HydrophobicContact CD1-CG 3.77Å; L120-P155 HydrophobicContact CD2-CB 3.19Å; L120-P155 HydrophobicContact CD2-CG 4.27Å; L120-P155 HydrophobicContact CG-CB 3.55Å; L120-P155 HydrophobicContact CG-CG 4.13Å; A151-P155 WeakPolarHBondContact O-CD 3.24Å; P155-G159 WeakPolarHBondContact O-CA 3.26Å; P155-G159 PolarHBondContact O-N 3.29Å; P155-F296 WeakPolarHBondContact O-CZ 3.2Å; P155-I311 HydrophobicContact CB-CD1 3.92Å
156	A	93.7	Very high	95.8	Very high	16 Å²	16	13 Å²	13	13%	0.132	7%	0.074	C	C	.	.	H	α-helix	trans	-68	-40.4	178.6	0	0	0	0	0	112.1	N72 E96 L154 S160	N72-A156 WeakPolarHBondContact OD1-CB 3.32Å; E96-A156 WeakPolarHBondContact OE2-CB 3.41Å; E96-A156 PolarHBondContact OE2-N 2.73Å; L154-A156 PolarHBondContact O-N 3.32Å; A156-S160 WeakPolarHBondContact O-CB 3.33Å; A156-S160 PolarHBondContact O-N 3.42Å; A156-S160 PolarHBondContact O-OG 2.62Å
157	A	95.2	Very high	95.8	Very high	1 Å²	1	16.9 Å²	16.9	1%	0.008	9%	0.092	C	C	.	.	H	α-helix	trans	-76.3	-59.1	-174.1	0	0	0	0	0	112.1	C153 L154 S160 A161 A188	C153-A157 WeakPolarHBondContact O-CB 3.36Å; L154-A157 PolarHBondContact O-N 3.02Å; A157-S160 PolarHBondContact O-N 3.06Å; A157-A161 VanDerWaalsContact O-CB 3.29Å; A157-A161 WeakPolarHBondContact O-CB 3.24Å; A157-A161 PolarHBondContact O-N 2.85Å; A157-A188 HydrophobicContact CB-CB 4.13Å
158	Y	97.2	Very high	95.9	Very high	7 Å²	7	14.7 Å²	14.7	3%	0.027	8%	0.079	C	C	.	.	H	α-helix	trans	-71.7	-32.1	179.3	-74.7	-100.9	0	0	0	112	L154 A161 Y162 A188 D191 L192 I314 I323 P325	L154-Y158 HydrophobicContact CD2-CD2 3.89Å; L154-Y158 HydrophobicContact CD2-CE2 4.13Å; L154-Y158 HydrophobicContact CD2-CG 4.29Å; L154-Y158 WeakPolarHBondContact O-CA 3.42Å; L154-Y158 VanDerWaalsContact O-CB 3.26Å; L154-Y158 WeakPolarHBondContact O-CB 3.33Å; L154-Y158 PolarHBondContact O-N 3.4Å; Y158-A161 PolarHBondContact O-N 3Å; Y158-Y162 WeakPolarHBondContact O-CB 3.46Å; Y158-Y162 PolarHBondContact O-N 2.84Å; Y158-A188 HydrophobicContact CD1-CB 4.02Å; Y158-A188 HydrophobicContact CD2-CB 3.63Å; Y158-A188 HydrophobicContact CE1-CB 4.04Å; Y158-A188 HydrophobicContact CE2-CB 3.65Å; Y158-A188 HydrophobicContact CG-CB 3.83Å; Y158-D191 HydrophobicContact CE1-CB 4.33Å; Y158-D191 VanDerWaalsContact CE1-OD2 3.27Å; Y158-D191 WeakPolarHBondContact CE1-OD2 3.47Å; Y158-D191 PolarHBondContact OH-OD2 3.43Å; Y158-L192 HydrophobicContact CD1-CD1 3.97Å; Y158-L192 HydrophobicContact CD1-CD2 4.19Å; Y158-L192 HydrophobicContact CD1-CG 3.92Å; Y158-L192 HydrophobicContact CE1-CG 4.22Å; Y158-I314 HydrophobicContact CG-CG2 4.37Å; Y158-I323 HydrophobicContact CD1-CB 4.25Å; Y158-I323 HydrophobicContact CD1-CD1 3.62Å; Y158-I323 HydrophobicContact CD1-CG2 4.12Å; Y158-I323 HydrophobicContact CE1-CB 3.56Å; Y158-I323 HydrophobicContact CE1-CD1 3.73Å; Y158-I323 HydrophobicContact CE1-CG1 4.19Å; Y158-I323 HydrophobicContact CE1-CG2 3.69Å; Y158-I323 HydrophobicContact CG-CD1 4.21Å; Y158-P325 HydrophobicContact CE2-CB 3.7Å; Y158-P325 VanDerWaalsContact OH-CA 3.26Å; Y158-P325 WeakPolarHBondContact OH-CA 3.46Å; Y158-P325 VanDerWaalsContact OH-N 3.15Å
159	G	96.3	Very high	95.8	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-60.3	-48.8	172.9	0	0	0	0	0	111.7	P155 L163 I314	P155-G159 WeakPolarHBondContact O-CA 3.26Å; P155-G159 PolarHBondContact O-N 3.29Å; G159-L163 VanDerWaalsContact O-CB 3.26Å; G159-L163 WeakPolarHBondContact O-CB 3.18Å; G159-L163 PolarHBondContact O-N 3.43Å; G159-I314 VanDerWaalsContact CA-CD1 3.49Å
160	S	95.7	Very high	95.8	Very high	20 Å²	20	23 Å²	23	14%	0.14	12%	0.121	C	C	.	.	H	α-helix	trans	-63.7	-47.3	176.1	-59.4	0	0	0	0	112	A156 A157 L163 A164 F296	A156-S160 WeakPolarHBondContact O-CB 3.33Å; A156-S160 PolarHBondContact O-N 3.42Å; A156-S160 PolarHBondContact O-OG 2.62Å; A157-S160 PolarHBondContact O-N 3.06Å; S160-L163 PolarHBondContact O-N 3.48Å; S160-A164 WeakPolarHBondContact O-CB 3.49Å; S160-A164 PolarHBondContact O-N 2.92Å; S160-F296 VanDerWaalsContact OG-CB 3.29Å; S160-F296 WeakPolarHBondContact OG-CB 3.5Å
161	A	97.5	Very high	95.9	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-64.4	-45.9	-178	0	0	0	0	0	112.7	A157 Y158 A164 L165 A188 V189 L192	A157-A161 VanDerWaalsContact O-CB 3.29Å; A157-A161 WeakPolarHBondContact O-CB 3.24Å; A157-A161 PolarHBondContact O-N 2.85Å; Y158-A161 PolarHBondContact O-N 3Å; A161-A164 PolarHBondContact O-N 2.96Å; A161-L165 PolarHBondContact O-N 3.44Å; A161-A188 HydrophobicContact CB-CB 3.83Å; A161-V189 HydrophobicContact CB-CB 4.26Å; A161-V189 HydrophobicContact CB-CG2 3.48Å; A161-V189 VanDerWaalsContact CB-CG2 3.48Å; A161-L192 HydrophobicContact CB-CD1 3.72Å
162	Y	97.8	Very high	95.8	Very high	33 Å²	33	26.6 Å²	26.6	13%	0.129	15%	0.145	C	C	.	.	H	α-helix	trans	-64.4	-42.7	177.5	-176.9	-80.5	0	0	0	110.9	Y158 A164 L165 S166 L192 F197 L310 K313 M317	Y158-Y162 WeakPolarHBondContact O-CB 3.46Å; Y158-Y162 PolarHBondContact O-N 2.84Å; Y162-A164 VanDerWaalsContact C-N 3.29Å; Y162-A164 PolarHBondContact O-N 3.25Å; Y162-L165 PolarHBondContact O-N 3.39Å; Y162-S166 WeakPolarHBondContact CE1-OG 3.41Å; Y162-S166 WeakPolarHBondContact O-CB 3.2Å; Y162-S166 PolarHBondContact O-N 2.92Å; Y162-S166 PolarHBondContact O-OG 2.91Å; Y162-L192 HydrophobicContact CD2-CD2 4.43Å; Y162-F197 HydrophobicContact CD2-CE2 4.13Å; Y162-F197 HydrophobicContact CD2-CZ 4Å; Y162-F197 HydrophobicContact CE2-CE2 4.27Å; Y162-F197 AromaticContact CE2-CZ 3.76Å; Y162-F197 HydrophobicContact CE2-CZ 3.76Å; Y162-L310 HydrophobicContact CD1-CD1 3.14Å; Y162-L310 HydrophobicContact CD1-CG 4.49Å; Y162-L310 HydrophobicContact CE1-CD1 3.74Å; Y162-L310 HydrophobicContact CG-CD1 3.68Å; Y162-K313 HydrophobicContact CE2-CD 4.27Å; Y162-K313 WeakPolarHBondContact OH-CE 2.9Å; Y162-K313 PolarHBondContact OH-NZ 3.32Å; Y162-M317 HydrophobicContact CD2-CE 4.15Å; Y162-M317 HydrophobicContact CE2-CE 3.75Å
163	L	96.4	Very high	95.9	Very high	8 Å²	8	35 Å²	35	4%	0.042	18%	0.181	C	C	.	.	H	α-helix	trans	-62.5	-38	177.4	-172.3	63.2	0	0	0	111.6	G159 S160 Q167 V294 F299 L310	G159-L163 VanDerWaalsContact O-CB 3.26Å; G159-L163 WeakPolarHBondContact O-CB 3.18Å; G159-L163 PolarHBondContact O-N 3.43Å; S160-L163 PolarHBondContact O-N 3.48Å; L163-Q167 VanDerWaalsContact CD1-NE2 3.27Å; L163-Q167 VanDerWaalsContact O-CG 3.29Å; L163-Q167 WeakPolarHBondContact O-CG 3.3Å; L163-V294 HydrophobicContact CB-CG1 4.05Å; L163-V294 HydrophobicContact CD2-CG1 3.75Å; L163-V294 HydrophobicContact CG-CG1 3.81Å; L163-F299 HydrophobicContact CD1-CD1 4.28Å; L163-F299 HydrophobicContact CD1-CD2 4.32Å; L163-F299 HydrophobicContact CD1-CE1 4.27Å; L163-F299 HydrophobicContact CD1-CE2 4.32Å; L163-F299 HydrophobicContact CD1-CG 4.31Å; L163-F299 HydrophobicContact CD1-CZ 4.3Å; L163-F299 HydrophobicContact CD2-CB 3.75Å; L163-F299 HydrophobicContact CD2-CD1 4.12Å; L163-F299 HydrophobicContact CD2-CD2 4.4Å; L163-F299 HydrophobicContact CD2-CG 3.85Å; L163-L310 HydrophobicContact CB-CD2 4.47Å
164	A	97.3	Very high	96	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-65.6	-43.3	175.5	0	0	0	0	0	113.1	S160 A161 Y162 E168 I247 V267 L269 V294	S160-A164 WeakPolarHBondContact O-CB 3.49Å; S160-A164 PolarHBondContact O-N 2.92Å; A161-A164 PolarHBondContact O-N 2.96Å; Y162-A164 VanDerWaalsContact C-N 3.29Å; Y162-A164 PolarHBondContact O-N 3.25Å; A164-E168 WeakPolarHBondContact O-CG 3.41Å; A164-I247 HydrophobicContact CB-CD1 4.46Å; A164-V267 HydrophobicContact CB-CG1 3.89Å; A164-L269 HydrophobicContact CB-CD1 3.77Å; A164-L269 HydrophobicContact CB-CD2 3.89Å; A164-L269 HydrophobicContact CB-CG 3.89Å; A164-V294 HydrophobicContact CB-CG1 4.4Å; A164-V294 HydrophobicContact CB-CG2 4.36Å
165	L	98.1	Very high	96.1	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-76.3	-50.3	-179.5	-73.6	160.9	0	0	0	111.9	A161 Y162 Q167 E168 L171 V189 L192 A193 F197 L245 I247	A161-L165 PolarHBondContact O-N 3.44Å; Y162-L165 PolarHBondContact O-N 3.39Å; L165-Q167 PolarHBondContact O-N 3.39Å; L165-E168 VanDerWaalsContact O-CB 3.27Å; L165-E168 WeakPolarHBondContact O-CB 3.29Å; L165-E168 PolarHBondContact O-N 3.2Å; L165-L171 HydrophobicContact CB-CD1 4.13Å; L165-L171 HydrophobicContact CD2-CD1 4.3Å; L165-L171 HydrophobicContact CD2-CD2 4.19Å; L165-L171 WeakPolarHBondContact O-CD1 3.31Å; L165-V189 HydrophobicContact CD1-CG1 4.36Å; L165-L192 HydrophobicContact CD1-CB 3.64Å; L165-A193 HydrophobicContact CD1-CB 4.32Å; L165-A193 HydrophobicContact CD2-CB 4.38Å; L165-F197 HydrophobicContact CB-CD2 3.79Å; L165-F197 HydrophobicContact CB-CE1 4.46Å; L165-F197 HydrophobicContact CB-CE2 3.46Å; L165-F197 VanDerWaalsContact CB-CE2 3.46Å; L165-F197 HydrophobicContact CB-CG 4.43Å; L165-F197 HydrophobicContact CB-CZ 3.83Å; L165-F197 HydrophobicContact CD1-CD2 3.79Å; L165-F197 HydrophobicContact CD1-CE2 3.91Å; L165-F197 HydrophobicContact CG-CD2 4.27Å; L165-F197 HydrophobicContact CG-CE2 4.28Å; L165-L245 HydrophobicContact CD2-CD2 4.44Å; L165-I247 HydrophobicContact CD2-CD1 3.43Å; L165-I247 VanDerWaalsContact CD2-CD1 3.43Å; L165-I247 HydrophobicContact CG-CD1 3.7Å
166	S	96.4	Very high	96.3	Very high	45 Å²	45	35.9 Å²	35.9	32%	0.315	19%	0.187	S	C	.	.	H	α-helix	trans	-61.6	-18	-171.7	60	0	0	0	0	115.6	Y162 E168	Y162-S166 WeakPolarHBondContact CE1-OG 3.41Å; Y162-S166 WeakPolarHBondContact O-CB 3.2Å; Y162-S166 PolarHBondContact O-N 2.92Å; Y162-S166 PolarHBondContact O-OG 2.91Å; S166-E168 VanDerWaalsContact C-N 3.31Å
167	Q	94.3	Very high	96.5	Very high	87 Å²	87	35.1 Å²	35.1	41%	0.407	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86	-3.7	175.4	-66.7	178.4	2.2	0	0	113.4	L163 L165	L163-Q167 VanDerWaalsContact CD1-NE2 3.27Å; L163-Q167 VanDerWaalsContact O-CG 3.29Å; L163-Q167 WeakPolarHBondContact O-CG 3.3Å; L165-Q167 PolarHBondContact O-N 3.39Å
168	E	97	Very high	96.6	Very high	25 Å²	25	35.1 Å²	35.1	12%	0.117	18%	0.18	C	C	.	.			trans	-97	143.9	-177.6	-59.3	-54.2	144.1	0	0	111.6	A164 L165 S166 L171 L245 R265 V267 K292	A164-E168 WeakPolarHBondContact O-CG 3.41Å; L165-E168 VanDerWaalsContact O-CB 3.27Å; L165-E168 WeakPolarHBondContact O-CB 3.29Å; L165-E168 PolarHBondContact O-N 3.2Å; S166-E168 VanDerWaalsContact C-N 3.31Å; E168-L171 HydrophobicContact CB-CD1 4.29Å; E168-L171 HydrophobicContact CB-CD2 3.83Å; E168-L171 HydrophobicContact CB-CG 4.01Å; E168-L245 HydrophobicContact CB-CD2 4.27Å; E168-L245 HydrophobicContact CG-CD1 4.04Å; E168-L245 HydrophobicContact CG-CD2 3.85Å; E168-R265 VanDerWaalsContact OE2-CD 3.26Å; E168-R265 WeakPolarHBondContact OE2-CD 3.47Å; E168-R265 IonicContact OE2-CZ 2.64Å; E168-R265 IonicContact OE2-NE 3.61Å; E168-R265 IonicContact OE2-NH1 2.73Å; E168-R265 PolarHBondContact OE2-NH1 2.95Å; E168-V267 WeakPolarHBondContact OE1-CG2 3.39Å; E168-K292 WeakPolarHBondContact OE1-CE 3.48Å; E168-K292 IonicContact OE1-NZ 3.56Å; E168-K292 PolarHBondContact OE1-NZ 2.96Å
169	H	94.6	Very high	96.6	Very high	113 Å²	113	34.8 Å²	34.8	52%	0.523	18%	0.179	S	C	.	.	S	Bend	trans	-88.9	161.2	173.3	57.6	-93.8	0	0	0	112.7	L171 R265	H169-L171 PolarHBondContact O-N 2.8Å; H169-L171 VanDerWaalsContact O-N 3.13Å; H169-R265 PolarHBondContact CE1-NH1 2.89Å; H169-R265 VanDerWaalsContact CE1-NH1 3.31Å; H169-R265 PolarHBondContact ND1-NH1 2.82Å; H169-R265 PolarHBondContact O-NH1 3.45Å; H169-R265 VanDerWaalsContact O-NH1 3.13Å; H169-R265 PolarHBondContact O-NH2 2.86Å
170	D	94.5	Very high	96.4	Very high	99 Å²	99	34.8 Å²	34.8	53%	0.529	18%	0.179	S	C	.	.	S	Bend	trans	57	21.5	173.3	-64	-44.6	0	0	0	116.1	K173 A174	D170-K173 CarbonylContact O-C 3.39Å; D170-K173 WeakPolarHBondContact O-CA 3.42Å; D170-K173 PolarHBondContact O-N 2.72Å; D170-A174 PolarHBondContact O-N 3.34Å
171	L	96.3	Very high	96	Very high	8 Å²	8	34.3 Å²	34.3	4%	0.042	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	-51.1	-46.8	-174.5	-76.1	-178.6	0	0	0	115.3	L165 E168 H169 K173 A174 V176 F197 C199 L245	L165-L171 HydrophobicContact CB-CD1 4.13Å; L165-L171 HydrophobicContact CD2-CD1 4.3Å; L165-L171 HydrophobicContact CD2-CD2 4.19Å; L165-L171 WeakPolarHBondContact O-CD1 3.31Å; E168-L171 HydrophobicContact CB-CD1 4.29Å; E168-L171 HydrophobicContact CB-CD2 3.83Å; E168-L171 HydrophobicContact CB-CG 4.01Å; H169-L171 PolarHBondContact O-N 2.8Å; H169-L171 VanDerWaalsContact O-N 3.13Å; L171-K173 PolarHBondContact O-N 3.38Å; L171-A174 WeakPolarHBondContact O-CB 3.38Å; L171-A174 PolarHBondContact O-N 2.98Å; L171-V176 HydrophobicContact CD2-CG2 4.38Å; L171-F197 HydrophobicContact CB-CB 4.21Å; L171-F197 HydrophobicContact CB-CD1 4.46Å; L171-F197 HydrophobicContact CD1-CB 4Å; L171-F197 HydrophobicContact CD1-CD1 3.32Å; L171-F197 HydrophobicContact CD1-CD2 4.46Å; L171-F197 HydrophobicContact CD1-CE1 3.83Å; L171-F197 HydrophobicContact CD1-CG 3.68Å; L171-C199 PolarHBondContact O-SG 3.24Å; L171-L245 HydrophobicContact CD2-CD2 3.73Å
172	P	95.1	Very high	95.1	Very high	93 Å²	93	34.5 Å²	34.5	60%	0.604	18%	0.176	S	C	*	.	G	3₁₀ helix	trans	-62.1	-18.5	179	-23.6	34.3	0	0	0	114.4	F197	P172-F197 WeakPolarHBondContact CA-O 3.3Å
173	K	95.4	Very high	94.5	Very high	177 Å²	177	34.8 Å²	34.8	77%	0.77	19%	0.188	S	C	*	.	G	3₁₀ helix	trans	-102.2	-10.9	175.6	-62.5	176.9	-176.7	170.4	0	112.6	D170 L171	D170-K173 CarbonylContact O-C 3.39Å; D170-K173 WeakPolarHBondContact O-CA 3.42Å; D170-K173 PolarHBondContact O-N 2.72Å; L171-K173 PolarHBondContact O-N 3.38Å
174	A	97.1	Very high	94.3	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.008	19%	0.193	C	C	.	.			trans	-79.6	142.3	-173.5	0	0	0	0	0	111.2	D170 L171 V176 K200 D244	D170-A174 PolarHBondContact O-N 3.34Å; L171-A174 WeakPolarHBondContact O-CB 3.38Å; L171-A174 PolarHBondContact O-N 2.98Å; A174-V176 HydrophobicContact CB-CG2 4.31Å; A174-K200 PolarHBondContact O-N 3.42Å; A174-K200 VanDerWaalsContact O-N 3.13Å; A174-D244 HydrophobicContact CB-CB 3.82Å
175	T	98.2	Very high	94.1	Very high	21 Å²	21	37 Å²	37	13%	0.129	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	116.3	159.8	-53.3	0	0	0	0	109	K200 I202 T238 V243 D244 L245	T175-K200 CarbonylContact C-O 3.55Å; T175-K200 VanDerWaalsContact CA-O 3.3Å; T175-K200 WeakPolarHBondContact CA-O 3.48Å; T175-K200 HydrophobicContact CG2-CD 4.26Å; T175-K200 HydrophobicContact CG2-CG 4.31Å; T175-I202 HydrophobicContact CG2-CD1 3.71Å; T175-I202 HydrophobicContact CG2-CG1 4.21Å; T175-T238 HydrophobicContact CG2-CG2 4.03Å; T175-V243 HydrophobicContact CG2-CB 4.46Å; T175-V243 HydrophobicContact CG2-CG1 3.97Å; T175-D244 PolarHBondContact N-OD2 2.82Å; T175-D244 PolarHBondContact O-N 2.74Å; T175-L245 PolarHBondContact O-N 3.22Å
176	V	98.5	Very high	93.9	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	123.3	-178.2	-176.1	0	0	0	0	109.4	L171 A174 V178 C199 K200 T201 I202 L245 I247	L171-V176 HydrophobicContact CD2-CG2 4.38Å; A174-V176 HydrophobicContact CB-CG2 4.31Å; V176-V178 HydrophobicContact CG1-CG2 4.09Å; V176-C199 HydrophobicContact CB-CB 4.42Å; V176-C199 HydrophobicContact CG2-CB 3.73Å; V176-K200 PolarHBondContact N-O 3.44Å; V176-T201 WeakPolarHBondContact O-CA 3.39Å; V176-I202 PolarHBondContact O-N 3.11Å; V176-L245 CarbonylContact C-O 3.52Å; V176-L245 WeakPolarHBondContact CA-O 3.38Å; V176-L245 HydrophobicContact CG1-CB 4.49Å; V176-L245 HydrophobicContact CG1-CD2 4.14Å; V176-L245 HydrophobicContact CG1-CG 4.3Å; V176-L245 HydrophobicContact CG2-CB 4.24Å; V176-L245 HydrophobicContact CG2-CD2 4.04Å; V176-I247 HydrophobicContact CG1-CD1 4.37Å; V176-I247 HydrophobicContact CG1-CG1 4.36Å
177	L	98.4	Very high	93.8	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	117.2	167.5	176.7	61.7	0	0	0	109.4	I179 I202 A204 I223 L230 V243 L245 V246 I247 C259	L177-I179 HydrophobicContact CD2-CD1 4.35Å; L177-I179 HydrophobicContact CD2-CG1 4.24Å; L177-I179 HydrophobicContact CG-CG1 4.06Å; L177-I202 CarbonylContact C-O 3.41Å; L177-I202 WeakPolarHBondContact CA-O 3.44Å; L177-I202 HydrophobicContact CD1-CB 4.04Å; L177-I202 HydrophobicContact CD1-CG2 3.69Å; L177-A204 HydrophobicContact CD1-CB 4.01Å; L177-I223 HydrophobicContact CD1-CD1 4.44Å; L177-L230 HydrophobicContact CD2-CD1 4.43Å; L177-V243 HydrophobicContact CB-CB 4.34Å; L177-V243 HydrophobicContact CB-CG1 4.1Å; L177-V243 HydrophobicContact CB-CG2 3.9Å; L177-L245 PolarHBondContact N-O 2.95Å; L177-V246 HydrophobicContact CB-CG2 4.15Å; L177-V246 HydrophobicContact CD2-CG2 4.17Å; L177-V246 CarbonylContact O-C 3.52Å; L177-V246 VanDerWaalsContact O-CA 3.31Å; L177-V246 WeakPolarHBondContact O-CA 3.47Å; L177-I247 PolarHBondContact O-N 2.94Å; L177-C259 HydrophobicContact CD2-CB 3.92Å
178	V	97.8	Very high	93.9	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	111.4	174.1	-173	0	0	0	0	108.6	V176 T180 V189 V190 T201 I202 V203 A204 I247	V176-V178 HydrophobicContact CG1-CG2 4.09Å; V178-T180 HydrophobicContact CG1-CG2 4.25Å; V178-V189 HydrophobicContact CB-CG1 4.41Å; V178-V189 HydrophobicContact CG1-CB 4.09Å; V178-V189 HydrophobicContact CG1-CG1 3.85Å; V178-V189 HydrophobicContact CG2-CG1 3.63Å; V178-V190 HydrophobicContact CB-CG2 4.11Å; V178-V190 HydrophobicContact CG1-CG2 3.98Å; V178-V190 HydrophobicContact CG2-CG2 4.2Å; V178-T201 HydrophobicContact CG2-CG2 3.94Å; V178-I202 PolarHBondContact N-O 2.97Å; V178-V203 WeakPolarHBondContact O-CA 3.48Å; V178-A204 PolarHBondContact O-N 3.33Å; V178-I247 WeakPolarHBondContact CA-O 3.36Å
179	I	96.2	Very high	94	Very high	0 Å²	0	30 Å²	30	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	111.4	174.5	-57.9	176.5	0	0	0	107.7	L177 A204 Y225 L230 V246 I247 D248 T249 V250 L252 A256	L177-I179 HydrophobicContact CD2-CD1 4.35Å; L177-I179 HydrophobicContact CD2-CG1 4.24Å; L177-I179 HydrophobicContact CG-CG1 4.06Å; I179-A204 HydrophobicContact CG1-CB 4.35Å; I179-Y225 HydrophobicContact CG2-CE1 4.28Å; I179-L230 HydrophobicContact CD1-CD2 3.9Å; I179-V246 HydrophobicContact CD1-CG1 3.73Å; I179-V246 HydrophobicContact CG1-CG1 4.09Å; I179-I247 PolarHBondContact N-O 2.86Å; I179-D248 HydrophobicContact CB-CB 4.45Å; I179-T249 PolarHBondContact O-N 2.83Å; I179-T249 PolarHBondContact O-OG1 2.89Å; I179-V250 HydrophobicContact CG2-CB 4.25Å; I179-V250 HydrophobicContact CG2-CG2 4.03Å; I179-L252 HydrophobicContact CG2-CD1 4Å; I179-A256 HydrophobicContact CD1-CB 3.64Å
180	T	92.9	Very high	94.1	Very high	1 Å²	1	24.7 Å²	24.7	1%	0.006	14%	0.142	C	C	.	.			trans	-152.7	153.5	-178.1	-166.4	0	0	0	0	113	V178 Q182 G186 V203 A204 C205 T249	V178-T180 HydrophobicContact CG1-CG2 4.25Å; T180-Q182 PolarHBondContact OG1-N 2.87Å; T180-G186 WeakPolarHBondContact OG1-CA 3.44Å; T180-V203 HydrophobicContact CG2-CG1 4.09Å; T180-A204 PolarHBondContact N-O 3.36Å; T180-C205 VanDerWaalsContact O-CA 3.32Å; T180-C205 WeakPolarHBondContact O-CA 3.34Å; T180-C205 PolarHBondContact O-SG 3.47Å; T180-C205 VanDerWaalsContact O-SG 3.33Å; T180-T249 VanDerWaalsContact CA-OG1 3.31Å; T180-T249 WeakPolarHBondContact CA-OG1 3.48Å; T180-T249 VanDerWaalsContact CB-OG1 3.28Å; T180-T249 WeakPolarHBondContact CB-OG1 3.3Å; T180-T249 PolarHBondContact OG1-OG1 3.2Å
181	N	86.2	Confident	94.2	Very high	9 Å²	9	20.4 Å²	20.4	5%	0.048	12%	0.119	C	C	.	.	S	Bend	trans	-111.1	41.9	171.7	-67.8	-40	0	0	0	110.6	G183 D206 K210 Y225 V250 R364	N181-G183 VanDerWaalsContact C-N 3.28Å; N181-G183 PolarHBondContact O-N 3.33Å; N181-D206 VanDerWaalsContact CG-OD2 3.28Å; N181-D206 VanDerWaalsContact OD1-CB 3.28Å; N181-D206 WeakPolarHBondContact OD1-CB 3.46Å; N181-D206 PolarHBondContact OD1-N 3.26Å; N181-D206 PolarHBondContact OD1-OD1 2.98Å; N181-D206 PolarHBondContact OD1-OD2 3.27Å; N181-K210 HydrophobicContact CB-CD 4.49Å; N181-Y225 PolarHBondContact ND2-OH 3.22Å; N181-Y225 VanDerWaalsContact ND2-OH 3.1Å; N181-Y225 PolarHBondContact OD1-OH 3.44Å; N181-V250 WeakPolarHBondContact ND2-CG2 3.46Å; N181-R364 PolarHBondContact ND2-NH1 2.98Å; N181-R364 VanDerWaalsContact ND2-NH1 3.14Å
182	Q	79.2	Confident	94.3	Very high	5 Å²	5	20 Å²	20	2%	0.023	12%	0.117	C	C	.	.	S	Bend	trans	63	21.3	176.6	-55.1	-175.4	-31.9	0	0	117	T180 K210 T213 I367 G368	T180-Q182 PolarHBondContact OG1-N 2.87Å; Q182-K210 VanDerWaalsContact CD-CB 3.41Å; Q182-K210 VanDerWaalsContact CD-CG 3.45Å; Q182-K210 HydrophobicContact CG-CB 3.8Å; Q182-K210 HydrophobicContact CG-CD 4.02Å; Q182-K210 HydrophobicContact CG-CG 3.98Å; Q182-K210 PolarHBondContact NE2-O 3.37Å; Q182-T213 PolarHBondContact NE2-OG1 3.27Å; Q182-I367 HydrophobicContact CB-CG2 4.16Å; Q182-I367 HydrophobicContact CG-CG2 4.47Å; Q182-G368 PolarHBondContact O-N 2.89Å
183	G	84.9	Confident	94.4	Very high	38 Å²	38	15.6 Å²	15.6	39%	0.392	9%	0.088	S	C	.	.	B	Isolated β-bridge	trans	-61.2	148.7	165.7	0	0	0	0	0	110.4	N181 T185 G186 L187	N181-G183 VanDerWaalsContact C-N 3.28Å; N181-G183 PolarHBondContact O-N 3.33Å; G183-T185 PolarHBondContact O-N 2.6Å; G183-T185 VanDerWaalsContact O-N 3.1Å; G183-G186 PolarHBondContact O-N 3.13Å; G183-L187 PolarHBondContact O-N 2.92Å; G183-L187 VanDerWaalsContact O-N 3.13Å
184	S	91	Very high	94.5	Very high	20 Å²	20	8.5 Å²	8.5	14%	0.14	6%	0.058	C	C	.	.	H	α-helix	trans	-44.3	-44	178	53.9	0	0	0	0	114.2	G186 L187 A188 K369	S184-G186 PolarHBondContact O-N 3.29Å; S184-L187 PolarHBondContact O-N 2.92Å; S184-A188 WeakPolarHBondContact O-CB 3.19Å; S184-A188 PolarHBondContact O-N 3.42Å; S184-K369 WeakPolarHBondContact OG-CD 3.5Å
185	T	93.9	Very high	94.5	Very high	35 Å²	35	12.5 Å²	12.5	22%	0.215	8%	0.08	C	C	.	.	H	α-helix	trans	-61.3	-43.1	177.3	-52.6	0	0	0	0	112.9	G183 A188 V189 T249 L269	G183-T185 PolarHBondContact O-N 2.6Å; G183-T185 VanDerWaalsContact O-N 3.1Å; T185-A188 PolarHBondContact O-N 3.48Å; T185-V189 WeakPolarHBondContact O-CG2 3.34Å; T185-V189 PolarHBondContact O-N 3.1Å; T185-T249 HydrophobicContact CG2-CG2 4.33Å; T185-L269 HydrophobicContact CG2-CD1 4.01Å
186	G	94.1	Very high	94.4	Very high	1 Å²	1	13.7 Å²	13.7	1%	0.01	9%	0.087	C	C	.	.	H	α-helix	trans	-68.5	-39.3	179.9	0	0	0	0	0	112.5	T180 G183 S184 A188 V189 V190	T180-G186 WeakPolarHBondContact OG1-CA 3.44Å; G183-G186 PolarHBondContact O-N 3.13Å; S184-G186 PolarHBondContact O-N 3.29Å; G186-A188 VanDerWaalsContact C-N 3.33Å; G186-V189 WeakPolarHBondContact O-CB 3.34Å; G186-V189 PolarHBondContact O-N 3.03Å; G186-V190 WeakPolarHBondContact O-CG2 3.45Å; G186-V190 PolarHBondContact O-N 2.85Å
187	L	94.4	Very high	94.4	Very high	9 Å²	9	15.1 Å²	15.1	5%	0.047	9%	0.093	C	C	.	.	H	α-helix	trans	-65.5	-37.7	173.6	-63.9	175.6	0	0	0	111.7	G183 S184 V189 V190 D191 V214 F217 L326 I367	G183-L187 PolarHBondContact O-N 2.92Å; G183-L187 VanDerWaalsContact O-N 3.13Å; S184-L187 PolarHBondContact O-N 2.92Å; L187-V189 VanDerWaalsContact C-N 3.31Å; L187-V189 PolarHBondContact O-N 3.4Å; L187-V190 PolarHBondContact O-N 2.98Å; L187-D191 WeakPolarHBondContact O-CB 3.47Å; L187-D191 PolarHBondContact O-N 2.83Å; L187-V214 HydrophobicContact CD2-CG1 3.62Å; L187-F217 HydrophobicContact CD2-CE2 4.21Å; L187-L326 HydrophobicContact CD1-CD1 4.09Å; L187-I367 HydrophobicContact CD1-CG2 3.85Å
188	A	96.7	Very high	94.3	Very high	1 Å²	1	19.1 Å²	19.1	1%	0.008	12%	0.12	C	C	.	.	H	α-helix	trans	-62.9	-36.4	172.9	0	0	0	0	0	112.4	A157 Y158 A161 S184 T185 G186 L192	A157-A188 HydrophobicContact CB-CB 4.13Å; Y158-A188 HydrophobicContact CD1-CB 4.02Å; Y158-A188 HydrophobicContact CD2-CB 3.63Å; Y158-A188 HydrophobicContact CE1-CB 4.04Å; Y158-A188 HydrophobicContact CE2-CB 3.65Å; Y158-A188 HydrophobicContact CG-CB 3.83Å; A161-A188 HydrophobicContact CB-CB 3.83Å; S184-A188 WeakPolarHBondContact O-CB 3.19Å; S184-A188 PolarHBondContact O-N 3.42Å; T185-A188 PolarHBondContact O-N 3.48Å; G186-A188 VanDerWaalsContact C-N 3.33Å; A188-L192 WeakPolarHBondContact O-CB 3.47Å; A188-L192 VanDerWaalsContact O-CG 3.32Å; A188-L192 WeakPolarHBondContact O-CG 3.41Å; A188-L192 PolarHBondContact O-N 3.47Å
189	V	97.6	Very high	94.3	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-63.3	-46.7	172.3	175	0	0	0	0	110.7	A161 L165 V178 T185 G186 L187 A193 I247 L269	A161-V189 HydrophobicContact CB-CB 4.26Å; A161-V189 HydrophobicContact CB-CG2 3.48Å; A161-V189 VanDerWaalsContact CB-CG2 3.48Å; L165-V189 HydrophobicContact CD1-CG1 4.36Å; V178-V189 HydrophobicContact CB-CG1 4.41Å; V178-V189 HydrophobicContact CG1-CB 4.09Å; V178-V189 HydrophobicContact CG1-CG1 3.85Å; V178-V189 HydrophobicContact CG2-CG1 3.63Å; T185-V189 WeakPolarHBondContact O-CG2 3.34Å; T185-V189 PolarHBondContact O-N 3.1Å; G186-V189 WeakPolarHBondContact O-CB 3.34Å; G186-V189 PolarHBondContact O-N 3.03Å; L187-V189 VanDerWaalsContact C-N 3.31Å; L187-V189 PolarHBondContact O-N 3.4Å; V189-A193 WeakPolarHBondContact O-CB 3.46Å; V189-A193 PolarHBondContact O-N 2.96Å; V189-I247 HydrophobicContact CG1-CB 4.02Å; V189-I247 HydrophobicContact CG1-CD1 3.63Å; V189-I247 HydrophobicContact CG1-CG1 4.37Å; V189-I247 HydrophobicContact CG1-CG2 3.9Å; V189-I247 HydrophobicContact CG2-CG2 3.89Å; V189-L269 HydrophobicContact CG2-CD1 3.64Å
190	V	97.3	Very high	94.3	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-59.6	-48.5	178.6	175	0	0	0	0	110.9	V178 G186 L187 A193 L194 V203 F217 V219	V178-V190 HydrophobicContact CB-CG2 4.11Å; V178-V190 HydrophobicContact CG1-CG2 3.98Å; V178-V190 HydrophobicContact CG2-CG2 4.2Å; G186-V190 WeakPolarHBondContact O-CG2 3.45Å; G186-V190 PolarHBondContact O-N 2.85Å; L187-V190 PolarHBondContact O-N 2.98Å; V190-A193 PolarHBondContact O-N 3.28Å; V190-L194 HydrophobicContact CG1-CD1 3.81Å; V190-L194 WeakPolarHBondContact O-CB 3.32Å; V190-L194 WeakPolarHBondContact O-CG 3.32Å; V190-L194 PolarHBondContact O-N 2.89Å; V190-V203 HydrophobicContact CG1-CG2 4.17Å; V190-V203 HydrophobicContact CG2-CG1 4.31Å; V190-V203 HydrophobicContact CG2-CG2 3.55Å; V190-F217 HydrophobicContact CG1-CD2 4.05Å; V190-V219 HydrophobicContact CG1-CG1 3.71Å
191	D	96.9	Very high	94.6	Very high	9 Å²	9	23.5 Å²	23.5	5%	0.048	14%	0.14	C	C	.	.	H	α-helix	trans	-59.8	-53.2	-179.5	-175	19.4	0	0	0	111.7	Y158 L187 A193 L194 N195 I323 S324	Y158-D191 HydrophobicContact CE1-CB 4.33Å; Y158-D191 VanDerWaalsContact CE1-OD2 3.27Å; Y158-D191 WeakPolarHBondContact CE1-OD2 3.47Å; Y158-D191 PolarHBondContact OH-OD2 3.43Å; L187-D191 WeakPolarHBondContact O-CB 3.47Å; L187-D191 PolarHBondContact O-N 2.83Å; D191-A193 PolarHBondContact O-N 3.48Å; D191-L194 PolarHBondContact O-N 2.74Å; D191-N195 WeakPolarHBondContact O-CB 3.44Å; D191-N195 PolarHBondContact O-N 3.44Å; D191-N195 PolarHBondContact O-ND2 3.03Å; D191-N195 PolarHBondContact OD1-ND2 2.92Å; D191-I323 WeakPolarHBondContact OD2-CA 3.28Å; D191-I323 WeakPolarHBondContact OD2-CB 3.27Å; D191-S324 PolarHBondContact OD2-N 3.31Å
192	L	98	Very high	95.2	Very high	0 Å²	0	23 Å²	23	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-62.8	-42	177.5	-72.5	170.4	0	0	0	112.4	Y158 A161 Y162 L165 A188 L194 V196 F197 M317 I323	Y158-L192 HydrophobicContact CD1-CD1 3.97Å; Y158-L192 HydrophobicContact CD1-CD2 4.19Å; Y158-L192 HydrophobicContact CD1-CG 3.92Å; Y158-L192 HydrophobicContact CE1-CG 4.22Å; A161-L192 HydrophobicContact CB-CD1 3.72Å; Y162-L192 HydrophobicContact CD2-CD2 4.43Å; L165-L192 HydrophobicContact CD1-CB 3.64Å; A188-L192 WeakPolarHBondContact O-CB 3.47Å; A188-L192 VanDerWaalsContact O-CG 3.32Å; A188-L192 WeakPolarHBondContact O-CG 3.41Å; A188-L192 PolarHBondContact O-N 3.47Å; L192-L194 VanDerWaalsContact C-N 3.31Å; L192-L194 PolarHBondContact O-N 3.1Å; L192-V196 HydrophobicContact CD2-CB 4.12Å; L192-V196 HydrophobicContact CD2-CG2 3.68Å; L192-V196 WeakPolarHBondContact O-CA 3.39Å; L192-V196 WeakPolarHBondContact O-CB 3.49Å; L192-V196 PolarHBondContact O-N 3.12Å; L192-F197 HydrophobicContact CB-CD2 4.24Å; L192-F197 HydrophobicContact CB-CE2 4.27Å; L192-F197 WeakPolarHBondContact O-CD2 3.49Å; L192-F197 PolarHBondContact O-N 3.23Å; L192-M317 HydrophobicContact CD2-SD 4.21Å; L192-I323 HydrophobicContact CD2-CG2 3.72Å; L192-I323 HydrophobicContact CG-CG2 4.47Å
193	A	97.9	Very high	96.1	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-60.4	-42.1	179.6	0	0	0	0	0	111.3	L165 V189 V190 D191 F197 C198 C199 T201	L165-A193 HydrophobicContact CD1-CB 4.32Å; L165-A193 HydrophobicContact CD2-CB 4.38Å; V189-A193 WeakPolarHBondContact O-CB 3.46Å; V189-A193 PolarHBondContact O-N 2.96Å; V190-A193 PolarHBondContact O-N 3.28Å; D191-A193 PolarHBondContact O-N 3.48Å; A193-F197 CarbonylContact O-C 3.59Å; A193-C198 PolarHBondContact O-N 3.15Å; A193-C199 HydrophobicContact CB-CB 4.28Å; A193-C199 WeakPolarHBondContact O-CB 3.3Å; A193-C199 PolarHBondContact O-N 2.98Å; A193-T201 HydrophobicContact CB-CG2 4.39Å; A193-T201 WeakPolarHBondContact CB-OG1 3.45Å
194	L	97	Very high	96.7	Very high	29 Å²	29	21 Å²	21	15%	0.152	12%	0.118	C	C	.	.	H	α-helix	trans	-74.9	-54	178.3	-69.2	170.6	0	0	0	112.3	V190 D191 L192 C198 F217 V219	V190-L194 HydrophobicContact CG1-CD1 3.81Å; V190-L194 WeakPolarHBondContact O-CB 3.32Å; V190-L194 WeakPolarHBondContact O-CG 3.32Å; V190-L194 PolarHBondContact O-N 2.89Å; D191-L194 PolarHBondContact O-N 2.74Å; L192-L194 VanDerWaalsContact C-N 3.31Å; L192-L194 PolarHBondContact O-N 3.1Å; L194-C198 WeakPolarHBondContact O-CA 3.34Å; L194-F217 HydrophobicContact CD1-CB 4.07Å; L194-F217 WeakPolarHBondContact CD1-O 3.46Å; L194-V219 HydrophobicContact CD1-CG1 3.91Å
195	N	96.5	Very high	96.8	Very high	85 Å²	85	20 Å²	20	46%	0.455	11%	0.111	S	C	.	.	H	α-helix	trans	-92.5	-23.4	-162.9	-64.5	-42.8	0	0	0	114	D191 Y322	D191-N195 WeakPolarHBondContact O-CB 3.44Å; D191-N195 PolarHBondContact O-N 3.44Å; D191-N195 PolarHBondContact O-ND2 3.03Å; D191-N195 PolarHBondContact OD1-ND2 2.92Å; N195-Y322 WeakPolarHBondContact CB-O 3.41Å
196	V	97	Very high	96.8	Very high	45 Å²	45	20.7 Å²	20.7	27%	0.273	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.3	-44.4	-177.4	178.1	0	0	0	0	111.7	L192 M317 I323	L192-V196 HydrophobicContact CD2-CB 4.12Å; L192-V196 HydrophobicContact CD2-CG2 3.68Å; L192-V196 WeakPolarHBondContact O-CA 3.39Å; L192-V196 WeakPolarHBondContact O-CB 3.49Å; L192-V196 PolarHBondContact O-N 3.12Å; V196-M317 HydrophobicContact CG1-CE 4Å; V196-M317 HydrophobicContact CG2-SD 4.34Å; V196-I323 HydrophobicContact CG2-CG2 4.21Å
197	F	97.4	Very high	96.7	Very high	31 Å²	31	23.1 Å²	23.1	14%	0.136	13%	0.128	C	C	.	.	S	Bend	trans	-98.3	-7.4	-177	-64.4	-78.9	0	0	0	113.8	Y162 L165 L171 P172 L192 A193 C199	Y162-F197 HydrophobicContact CD2-CE2 4.13Å; Y162-F197 HydrophobicContact CD2-CZ 4Å; Y162-F197 HydrophobicContact CE2-CE2 4.27Å; Y162-F197 AromaticContact CE2-CZ 3.76Å; Y162-F197 HydrophobicContact CE2-CZ 3.76Å; L165-F197 HydrophobicContact CB-CD2 3.79Å; L165-F197 HydrophobicContact CB-CE1 4.46Å; L165-F197 HydrophobicContact CB-CE2 3.46Å; L165-F197 VanDerWaalsContact CB-CE2 3.46Å; L165-F197 HydrophobicContact CB-CG 4.43Å; L165-F197 HydrophobicContact CB-CZ 3.83Å; L165-F197 HydrophobicContact CD1-CD2 3.79Å; L165-F197 HydrophobicContact CD1-CE2 3.91Å; L165-F197 HydrophobicContact CG-CD2 4.27Å; L165-F197 HydrophobicContact CG-CE2 4.28Å; L171-F197 HydrophobicContact CB-CB 4.21Å; L171-F197 HydrophobicContact CB-CD1 4.46Å; L171-F197 HydrophobicContact CD1-CB 4Å; L171-F197 HydrophobicContact CD1-CD1 3.32Å; L171-F197 HydrophobicContact CD1-CD2 4.46Å; L171-F197 HydrophobicContact CD1-CE1 3.83Å; L171-F197 HydrophobicContact CD1-CG 3.68Å; P172-F197 WeakPolarHBondContact CA-O 3.3Å; L192-F197 HydrophobicContact CB-CD2 4.24Å; L192-F197 HydrophobicContact CB-CE2 4.27Å; L192-F197 WeakPolarHBondContact O-CD2 3.49Å; L192-F197 PolarHBondContact O-N 3.23Å; A193-F197 CarbonylContact O-C 3.59Å; F197-C199 PolarHBondContact O-N 3.33Å
198	C	97	Very high	96.7	Very high	84 Å²	84	26.5 Å²	26.5	57%	0.568	14%	0.143	S	C	*	.			trans	53.1	37.3	175.8	-54.1	0	0	0	0	114	A193 L194	A193-C198 PolarHBondContact O-N 3.15Å; L194-C198 WeakPolarHBondContact O-CA 3.34Å
199	C	97.8	Very high	96.5	Very high	9 Å²	9	29.8 Å²	29.8	6%	0.061	17%	0.17	C	C	.	.			trans	-75.4	155.1	179.5	-56.8	0	0	0	0	111.8	L171 V176 A193 F197 T201	L171-C199 PolarHBondContact O-SG 3.24Å; V176-C199 HydrophobicContact CB-CB 4.42Å; V176-C199 HydrophobicContact CG2-CB 3.73Å; A193-C199 HydrophobicContact CB-CB 4.28Å; A193-C199 WeakPolarHBondContact O-CB 3.3Å; A193-C199 PolarHBondContact O-N 2.98Å; F197-C199 PolarHBondContact O-N 3.33Å; C199-T201 PolarHBondContact O-N 3.3Å; C199-T201 PolarHBondContact O-OG1 2.86Å
200	K	97.7	Very high	96.2	Very high	83 Å²	83	31.1 Å²	31.1	36%	0.361	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	104.2	161.2	-174.6	-179.1	175.9	179.6	0	108.5	A174 T175 V176 T220	A174-K200 PolarHBondContact O-N 3.42Å; A174-K200 VanDerWaalsContact O-N 3.13Å; T175-K200 CarbonylContact C-O 3.55Å; T175-K200 VanDerWaalsContact CA-O 3.3Å; T175-K200 WeakPolarHBondContact CA-O 3.48Å; T175-K200 HydrophobicContact CG2-CD 4.26Å; T175-K200 HydrophobicContact CG2-CG 4.31Å; V176-K200 PolarHBondContact N-O 3.44Å; K200-T220 HydrophobicContact CD-CG2 4.33Å; K200-T220 HydrophobicContact CG-CG2 4.04Å; K200-T220 WeakPolarHBondContact CG-OG1 3.24Å
201	T	98.4	Very high	96	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	124.5	-170	-56	0	0	0	0	112.2	V176 V178 A193 C199 V203 V219 T220	V176-T201 WeakPolarHBondContact O-CA 3.39Å; V178-T201 HydrophobicContact CG2-CG2 3.94Å; A193-T201 HydrophobicContact CB-CG2 4.39Å; A193-T201 WeakPolarHBondContact CB-OG1 3.45Å; C199-T201 PolarHBondContact O-N 3.3Å; C199-T201 PolarHBondContact O-OG1 2.86Å; T201-V203 HydrophobicContact CG2-CG2 4.12Å; T201-V219 HydrophobicContact CG2-CG1 4.5Å; T201-T220 WeakPolarHBondContact O-CB 3.32Å; T201-T220 PolarHBondContact O-N 3.34Å; T201-T220 PolarHBondContact O-OG1 2.74Å
202	I	98.4	Very high	95.9	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	136.5	169.7	-58.2	171.1	0	0	0	107.4	T175 V176 L177 V178 S221 I223 A237 T238 V243	T175-I202 HydrophobicContact CG2-CD1 3.71Å; T175-I202 HydrophobicContact CG2-CG1 4.21Å; V176-I202 PolarHBondContact O-N 3.11Å; L177-I202 CarbonylContact C-O 3.41Å; L177-I202 WeakPolarHBondContact CA-O 3.44Å; L177-I202 HydrophobicContact CD1-CB 4.04Å; L177-I202 HydrophobicContact CD1-CG2 3.69Å; V178-I202 PolarHBondContact N-O 2.97Å; I202-S221 WeakPolarHBondContact CA-O 3.39Å; I202-S221 WeakPolarHBondContact CG2-OG 3.19Å; I202-I223 HydrophobicContact CG2-CD1 3.74Å; I202-I223 HydrophobicContact CG2-CG1 4.09Å; I202-A237 HydrophobicContact CD1-CB 3.82Å; I202-T238 HydrophobicContact CD1-CG2 3.73Å; I202-V243 HydrophobicContact CD1-CG1 4.21Å
203	V	98	Very high	95.4	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	127.9	179.8	-174.7	0	0	0	0	110.8	V178 T180 V190 T201 V214 V219 S221 T222 I223	V178-V203 WeakPolarHBondContact O-CA 3.48Å; T180-V203 HydrophobicContact CG2-CG1 4.09Å; V190-V203 HydrophobicContact CG1-CG2 4.17Å; V190-V203 HydrophobicContact CG2-CG1 4.31Å; V190-V203 HydrophobicContact CG2-CG2 3.55Å; T201-V203 HydrophobicContact CG2-CG2 4.12Å; V203-V214 HydrophobicContact CB-CG2 4.11Å; V203-V214 HydrophobicContact CG1-CG2 4.02Å; V203-V214 HydrophobicContact CG2-CG2 4.49Å; V203-V219 HydrophobicContact CG2-CB 4.21Å; V203-V219 HydrophobicContact CG2-CG1 3.59Å; V203-S221 PolarHBondContact N-O 3.19Å; V203-T222 CarbonylContact O-C 3.54Å; V203-T222 WeakPolarHBondContact O-CA 3.4Å; V203-I223 PolarHBondContact O-N 3.24Å
204	A	97.1	Very high	95.1	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	124	175.6	0	0	0	0	0	110.8	L177 V178 I179 T180 I223 Y225 L230	L177-A204 HydrophobicContact CD1-CB 4.01Å; V178-A204 PolarHBondContact O-N 3.33Å; I179-A204 HydrophobicContact CG1-CB 4.35Å; T180-A204 PolarHBondContact N-O 3.36Å; A204-I223 CarbonylContact C-O 3.58Å; A204-I223 VanDerWaalsContact CA-O 3.24Å; A204-I223 WeakPolarHBondContact CA-O 3.34Å; A204-I223 HydrophobicContact CB-CB 4.06Å; A204-I223 HydrophobicContact CB-CG2 4.46Å; A204-Y225 HydrophobicContact CB-CD1 3.82Å; A204-Y225 HydrophobicContact CB-CG 4.49Å; A204-L230 HydrophobicContact CB-CD1 3.85Å
205	C	94.8	Very high	95	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	156.2	176.1	-57.4	0	0	0	0	111.3	T180 T207 K210 I223 E224 Y225	T180-C205 VanDerWaalsContact O-CA 3.32Å; T180-C205 WeakPolarHBondContact O-CA 3.34Å; T180-C205 PolarHBondContact O-SG 3.47Å; T180-C205 VanDerWaalsContact O-SG 3.33Å; C205-T207 PolarHBondContact O-N 3.46Å; C205-K210 HydrophobicContact CB-CB 3.65Å; C205-I223 PolarHBondContact N-O 3.12Å; C205-E224 CarbonylContact O-C 3.58Å; C205-E224 WeakPolarHBondContact O-CA 3.39Å; C205-Y225 VanDerWaalsContact O-CD1 3.23Å; C205-Y225 WeakPolarHBondContact O-CD1 3.31Å; C205-Y225 PolarHBondContact O-N 2.93Å
206	D	92.1	Very high	94.8	Very high	49 Å²	49	39.5 Å²	39.5	26%	0.262	23%	0.226	S	C	.	.	S	Bend	trans	-71.8	-6	-179.1	62.5	9.2	0	0	0	115.4	N181 K210 Y225	N181-D206 VanDerWaalsContact CG-OD2 3.28Å; N181-D206 VanDerWaalsContact OD1-CB 3.28Å; N181-D206 WeakPolarHBondContact OD1-CB 3.46Å; N181-D206 PolarHBondContact OD1-N 3.26Å; N181-D206 PolarHBondContact OD1-OD1 2.98Å; N181-D206 PolarHBondContact OD1-OD2 3.27Å; D206-K210 VanDerWaalsContact OD1-CD 3.25Å; D206-K210 WeakPolarHBondContact OD1-CD 3.45Å; D206-K210 VanDerWaalsContact OD1-CE 3.27Å; D206-K210 WeakPolarHBondContact OD1-CE 3.31Å; D206-K210 IonicContact OD1-NZ 2.62Å; D206-K210 PolarHBondContact OD1-NZ 3.01Å; D206-K210 IonicContact OD2-NZ 2.85Å; D206-K210 PolarHBondContact OD2-NZ 2.85Å; D206-Y225 HydrophobicContact CB-CE1 4.31Å
207	T	93.1	Very high	94.6	Very high	51 Å²	51	41 Å²	41	31%	0.313	23%	0.229	S	C	.	.	S	Bend	trans	-150.9	149.8	-177.9	51.7	0	0	0	0	111.1	C205 A209 K210 C211 E224	C205-T207 PolarHBondContact O-N 3.46Å; T207-A209 VanDerWaalsContact C-N 3.31Å; T207-A209 PolarHBondContact O-N 2.97Å; T207-K210 PolarHBondContact O-N 2.97Å; T207-K210 VanDerWaalsContact O-N 3.14Å; T207-K210 WeakPolarHBondContact OG1-CB 3.2Å; T207-K210 WeakPolarHBondContact OG1-CG 3.37Å; T207-C211 PolarHBondContact O-N 2.84Å; T207-C211 PolarHBondContact O-SG 3.31Å; T207-E224 WeakPolarHBondContact CA-OE1 3.17Å
208	E	94.7	Very high	94.4	Very high	80 Å²	80	42.1 Å²	42.1	37%	0.374	25%	0.249	S	C	.	.	H	α-helix	trans	-62.1	-37.7	175.1	174.6	51.5	-155.6	0	0	112.6	K210 C211 S212 R215 E224	E208-K210 PolarHBondContact O-N 2.65Å; E208-C211 WeakPolarHBondContact O-CB 3.21Å; E208-C211 PolarHBondContact O-N 2.61Å; E208-C211 VanDerWaalsContact O-N 3.07Å; E208-S212 PolarHBondContact O-N 3.28Å; E208-R215 IonicContact OE1-CZ 3.47Å; E208-R215 IonicContact OE1-NH1 2.77Å; E208-R215 PolarHBondContact OE1-NH1 3.03Å; E208-R215 IonicContact OE1-NH2 3.11Å; E208-R215 PolarHBondContact OE1-NH2 3.47Å; E208-R215 IonicContact OE2-CZ 2.56Å; E208-R215 IonicContact OE2-NH2 3.79Å; E208-R215 PolarHBondContact OE2-NH2 3.24Å; E208-E224 VanDerWaalsContact N-CD 3.3Å; E208-E224 PolarHBondContact N-OE1 3.09Å
209	A	91.4	Very high	94.4	Very high	70 Å²	70	38.9 Å²	38.9	58%	0.579	23%	0.227	S	C	*	.	H	α-helix	trans	-55.4	-41.4	174.4	0	0	0	0	0	111	T207 S212 T213	T207-A209 VanDerWaalsContact C-N 3.31Å; T207-A209 PolarHBondContact O-N 2.97Å; A209-S212 PolarHBondContact O-N 3.48Å; A209-S212 PolarHBondContact O-OG 2.77Å; A209-T213 WeakPolarHBondContact O-CG2 3.38Å
210	K	91.5	Very high	94.3	Very high	29 Å²	29	41.8 Å²	41.8	13%	0.126	24%	0.244	C	C	.	.	H	α-helix	trans	-74.7	-32.7	176.3	-68.3	-172.7	-159.6	159.3	0	113.6	N181 Q182 C205 D206 T207 E208 S212	N181-K210 HydrophobicContact CB-CD 4.49Å; Q182-K210 VanDerWaalsContact CD-CB 3.41Å; Q182-K210 VanDerWaalsContact CD-CG 3.45Å; Q182-K210 HydrophobicContact CG-CB 3.8Å; Q182-K210 HydrophobicContact CG-CD 4.02Å; Q182-K210 HydrophobicContact CG-CG 3.98Å; Q182-K210 PolarHBondContact NE2-O 3.37Å; C205-K210 HydrophobicContact CB-CB 3.65Å; D206-K210 VanDerWaalsContact OD1-CD 3.25Å; D206-K210 WeakPolarHBondContact OD1-CD 3.45Å; D206-K210 VanDerWaalsContact OD1-CE 3.27Å; D206-K210 WeakPolarHBondContact OD1-CE 3.31Å; D206-K210 IonicContact OD1-NZ 2.62Å; D206-K210 PolarHBondContact OD1-NZ 3.01Å; D206-K210 IonicContact OD2-NZ 2.85Å; D206-K210 PolarHBondContact OD2-NZ 2.85Å; T207-K210 PolarHBondContact O-N 2.97Å; T207-K210 VanDerWaalsContact O-N 3.14Å; T207-K210 WeakPolarHBondContact OG1-CB 3.2Å; T207-K210 WeakPolarHBondContact OG1-CG 3.37Å; E208-K210 PolarHBondContact O-N 2.65Å; K210-S212 VanDerWaalsContact C-N 3.3Å
211	C	94.5	Very high	94.3	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-63.1	-41.4	171.7	-69.8	0	0	0	0	111.1	T207 E208 T213 V214 R215 T222 I223	T207-C211 PolarHBondContact O-N 2.84Å; T207-C211 PolarHBondContact O-SG 3.31Å; E208-C211 WeakPolarHBondContact O-CB 3.21Å; E208-C211 PolarHBondContact O-N 2.61Å; E208-C211 VanDerWaalsContact O-N 3.07Å; C211-T213 PolarHBondContact O-N 2.99Å; C211-T213 VanDerWaalsContact O-N 3.15Å; C211-V214 WeakPolarHBondContact O-CG2 3.4Å; C211-V214 PolarHBondContact O-N 3.36Å; C211-R215 VanDerWaalsContact CB-NH2 3.32Å; C211-T222 HydrophobicContact CB-CG2 4.32Å; C211-I223 VanDerWaalsContact SG-C 3.51Å; C211-I223 PolarHBondContact SG-O 2.74Å; C211-I223 VanDerWaalsContact SG-O 3.37Å
212	S	93.1	Very high	94.3	Very high	52 Å²	52	40.9 Å²	40.9	36%	0.364	25%	0.247	S	C	.	.	H	α-helix	trans	-58.4	-32.2	-175	78	0	0	0	0	114.2	E208 A209 K210 P216	E208-S212 PolarHBondContact O-N 3.28Å; A209-S212 PolarHBondContact O-N 3.48Å; A209-S212 PolarHBondContact O-OG 2.77Å; K210-S212 VanDerWaalsContact C-N 3.3Å; S212-P216 WeakPolarHBondContact O-CD 3.38Å
213	T	88.3	Confident	94.2	Very high	44 Å²	44	41.2 Å²	41.2	27%	0.27	25%	0.249	S	C	.	.	H	α-helix	trans	-82.8	-16.6	-173.9	82.6	0	0	0	0	113.9	Q182 A209 C211 I367	Q182-T213 PolarHBondContact NE2-OG1 3.27Å; A209-T213 WeakPolarHBondContact O-CG2 3.38Å; C211-T213 PolarHBondContact O-N 2.99Å; C211-T213 VanDerWaalsContact O-N 3.15Å; T213-I367 HydrophobicContact CG2-CD1 3.37Å
214	V	92.4	Very high	94.2	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-94.9	-15.8	177.2	-63.3	0	0	0	0	112.5	L187 V203 C211 P216 F217 T222	L187-V214 HydrophobicContact CD2-CG1 3.62Å; V203-V214 HydrophobicContact CB-CG2 4.11Å; V203-V214 HydrophobicContact CG1-CG2 4.02Å; V203-V214 HydrophobicContact CG2-CG2 4.49Å; C211-V214 WeakPolarHBondContact O-CG2 3.4Å; C211-V214 PolarHBondContact O-N 3.36Å; V214-P216 VanDerWaalsContact C-CD 3.48Å; V214-F217 HydrophobicContact CB-CD2 4.39Å; V214-F217 HydrophobicContact CG1-CD2 4.5Å; V214-F217 HydrophobicContact CG1-CE2 4.27Å; V214-F217 VanDerWaalsContact O-CB 3.3Å; V214-F217 WeakPolarHBondContact O-CB 3.48Å; V214-F217 PolarHBondContact O-N 2.95Å; V214-T222 HydrophobicContact CG2-CG2 3.76Å
215	R	94.3	Very high	94	Very high	95 Å²	95	46.7 Å²	46.7	36%	0.358	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-55.7	-42.5	176	-67.5	179.5	-169.3	122.7	7.9	113.4	E208 C211 F217 G218 T222	E208-R215 IonicContact OE1-CZ 3.47Å; E208-R215 IonicContact OE1-NH1 2.77Å; E208-R215 PolarHBondContact OE1-NH1 3.03Å; E208-R215 IonicContact OE1-NH2 3.11Å; E208-R215 PolarHBondContact OE1-NH2 3.47Å; E208-R215 IonicContact OE2-CZ 2.56Å; E208-R215 IonicContact OE2-NH2 3.79Å; E208-R215 PolarHBondContact OE2-NH2 3.24Å; C211-R215 VanDerWaalsContact CB-NH2 3.32Å; R215-F217 PolarHBondContact O-N 3.48Å; R215-G218 PolarHBondContact O-N 2.69Å; R215-T222 HydrophobicContact CG-CG2 3.6Å; R215-T222 PolarHBondContact NE-OG1 3.27Å; R215-T222 PolarHBondContact NH2-OG1 3.41Å
216	P	93	Very high	93.9	Very high	107 Å²	107	49.6 Å²	49.6	70%	0.695	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-61.6	-13.5	177.5	-24.5	36.1	0	0	0	114.5	S212 V214 G218	S212-P216 WeakPolarHBondContact O-CD 3.38Å; V214-P216 VanDerWaalsContact C-CD 3.48Å; P216-G218 PolarHBondContact O-N 2.88Å
217	F	92	Very high	93.7	Very high	76 Å²	76	51.8 Å²	51.8	33%	0.333	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-78	-9.6	179.3	-59.2	-3.7	0	0	0	112.9	L187 V190 L194 V214 R215 L326	L187-F217 HydrophobicContact CD2-CE2 4.21Å; V190-F217 HydrophobicContact CG1-CD2 4.05Å; L194-F217 HydrophobicContact CD1-CB 4.07Å; L194-F217 WeakPolarHBondContact CD1-O 3.46Å; V214-F217 HydrophobicContact CB-CD2 4.39Å; V214-F217 HydrophobicContact CG1-CD2 4.5Å; V214-F217 HydrophobicContact CG1-CE2 4.27Å; V214-F217 VanDerWaalsContact O-CB 3.3Å; V214-F217 WeakPolarHBondContact O-CB 3.48Å; V214-F217 PolarHBondContact O-N 2.95Å; R215-F217 PolarHBondContact O-N 3.48Å; F217-L326 HydrophobicContact CE2-CD1 4.49Å; F217-L326 HydrophobicContact CZ-CD1 3.67Å
218	G	93.3	Very high	93.6	Very high	55 Å²	55	56.5 Å²	56.5	57%	0.567	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.2	22.5	-177.7	0	0	0	0	0	114.1	R215 P216	R215-G218 PolarHBondContact O-N 2.69Å; P216-G218 PolarHBondContact O-N 2.88Å
219	V	96.8	Very high	93.7	Very high	16 Å²	16	54.9 Å²	54.9	10%	0.097	32%	0.316	C	S	.	.			trans	-59.2	146	169.6	-60.7	0	0	0	0	110.3	V190 L194 T201 V203 S221 T222	V190-V219 HydrophobicContact CG1-CG1 3.71Å; L194-V219 HydrophobicContact CD1-CG1 3.91Å; T201-V219 HydrophobicContact CG2-CG1 4.5Å; V203-V219 HydrophobicContact CG2-CB 4.21Å; V203-V219 HydrophobicContact CG2-CG1 3.59Å; V219-S221 VanDerWaalsContact C-N 3.34Å; V219-S221 PolarHBondContact O-N 3.45Å; V219-T222 HydrophobicContact CG2-CG2 3.79Å
220	T	96.7	Very high	93.9	Very high	70 Å²	70	51.6 Å²	51.6	43%	0.429	29%	0.288	S	S	.	.	S	Bend	trans	-61.9	-44	-179.6	-59.8	0	0	0	0	111.6	K200 T201	K200-T220 HydrophobicContact CD-CG2 4.33Å; K200-T220 HydrophobicContact CG-CG2 4.04Å; K200-T220 WeakPolarHBondContact CG-OG1 3.24Å; T201-T220 WeakPolarHBondContact O-CB 3.32Å; T201-T220 PolarHBondContact O-N 3.34Å; T201-T220 PolarHBondContact O-OG1 2.74Å
221	S	96.9	Very high	94.1	Very high	34 Å²	34	53.9 Å²	53.9	24%	0.238	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.4	162.6	176.6	61.2	0	0	0	0	110.5	I202 V203 V219 A237	I202-S221 WeakPolarHBondContact CA-O 3.39Å; I202-S221 WeakPolarHBondContact CG2-OG 3.19Å; V203-S221 PolarHBondContact N-O 3.19Å; V219-S221 VanDerWaalsContact C-N 3.34Å; V219-S221 PolarHBondContact O-N 3.45Å; S221-A237 WeakPolarHBondContact OG-CB 3.5Å
222	T	97.8	Very high	94.3	Very high	30 Å²	30	58.3 Å²	58.3	18%	0.184	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	145.4	173.8	57.9	0	0	0	0	110.1	V203 C211 V214 R215 V219	V203-T222 CarbonylContact O-C 3.54Å; V203-T222 WeakPolarHBondContact O-CA 3.4Å; C211-T222 HydrophobicContact CB-CG2 4.32Å; V214-T222 HydrophobicContact CG2-CG2 3.76Å; R215-T222 HydrophobicContact CG-CG2 3.6Å; R215-T222 PolarHBondContact NE-OG1 3.27Å; R215-T222 PolarHBondContact NH2-OG1 3.41Å; V219-T222 HydrophobicContact CG2-CG2 3.79Å
223	I	97.6	Very high	94.5	Very high	7 Å²	7	58.4 Å²	58.4	4%	0.036	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	116	179.1	-62.4	174.7	0	0	0	108.5	L177 I202 V203 A204 C205 C211 Y225 L230 L233 A234	L177-I223 HydrophobicContact CD1-CD1 4.44Å; I202-I223 HydrophobicContact CG2-CD1 3.74Å; I202-I223 HydrophobicContact CG2-CG1 4.09Å; V203-I223 PolarHBondContact O-N 3.24Å; A204-I223 CarbonylContact C-O 3.58Å; A204-I223 VanDerWaalsContact CA-O 3.24Å; A204-I223 WeakPolarHBondContact CA-O 3.34Å; A204-I223 HydrophobicContact CB-CB 4.06Å; A204-I223 HydrophobicContact CB-CG2 4.46Å; C205-I223 PolarHBondContact N-O 3.12Å; C211-I223 VanDerWaalsContact SG-C 3.51Å; C211-I223 PolarHBondContact SG-O 2.74Å; C211-I223 VanDerWaalsContact SG-O 3.37Å; I223-Y225 PolarHBondContact O-N 3.25Å; I223-L230 HydrophobicContact CG2-CD1 4.17Å; I223-L233 HydrophobicContact CD1-CB 4.08Å; I223-L233 HydrophobicContact CG1-CB 4.16Å; I223-L233 HydrophobicContact CG2-CB 3.75Å; I223-L233 HydrophobicContact CG2-CD1 3.66Å; I223-L233 HydrophobicContact CG2-CG 4.35Å; I223-A234 HydrophobicContact CD1-CB 4.17Å
224	E	97	Very high	94.9	Very high	93 Å²	93	56.3 Å²	56.3	44%	0.435	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	104.6	161.2	179.3	177.1	-143.6	0	0	108	C205 T207 E208 N229	C205-E224 CarbonylContact O-C 3.58Å; C205-E224 WeakPolarHBondContact O-CA 3.39Å; T207-E224 WeakPolarHBondContact CA-OE1 3.17Å; E208-E224 VanDerWaalsContact N-CD 3.3Å; E208-E224 PolarHBondContact N-OE1 3.09Å; E224-N229 PolarHBondContact O-ND2 3.25Å
225	Y	94.1	Very high	95.1	Very high	23 Å²	23	58 Å²	58	9%	0.09	31%	0.314	C	S	.	.			trans	-95.9	146.2	-169	79	-99.7	0	0	0	113.3	I179 N181 A204 C205 D206 I223 N229 L230 L252	I179-Y225 HydrophobicContact CG2-CE1 4.28Å; N181-Y225 PolarHBondContact ND2-OH 3.22Å; N181-Y225 VanDerWaalsContact ND2-OH 3.1Å; N181-Y225 PolarHBondContact OD1-OH 3.44Å; A204-Y225 HydrophobicContact CB-CD1 3.82Å; A204-Y225 HydrophobicContact CB-CG 4.49Å; C205-Y225 VanDerWaalsContact O-CD1 3.23Å; C205-Y225 WeakPolarHBondContact O-CD1 3.31Å; C205-Y225 PolarHBondContact O-N 2.93Å; D206-Y225 HydrophobicContact CB-CE1 4.31Å; I223-Y225 PolarHBondContact O-N 3.25Å; Y225-N229 VanDerWaalsContact CA-OD1 3.31Å; Y225-N229 WeakPolarHBondContact CA-OD1 3.48Å; Y225-L230 HydrophobicContact CG-CD1 4.45Å; Y225-L252 HydrophobicContact CD2-CD1 3.8Å; Y225-L252 HydrophobicContact CE1-CD1 4.35Å; Y225-L252 HydrophobicContact CE2-CD1 3.16Å; Y225-L252 VanDerWaalsContact CZ-CD1 3.49Å
226	T	92.4	Very high	95.2	Very high	61 Å²	61	60 Å²	60	37%	0.374	33%	0.328	S	S	.	.			trans	-119.4	168.1	152.4	77.9	0	0	0	0	108.1	E228 N229 L230	T226-E228 VanDerWaalsContact CB-OE2 3.24Å; T226-E228 WeakPolarHBondContact CB-OE2 3.49Å; T226-E228 PolarHBondContact O-N 3.03Å; T226-E228 PolarHBondContact OG1-N 2.86Å; T226-E228 PolarHBondContact OG1-OE2 3.34Å; T226-N229 PolarHBondContact N-OD1 3.02Å; T226-N229 PolarHBondContact O-N 3.29Å; T226-N229 PolarHBondContact O-OD1 3.06Å; T226-N229 PolarHBondContact OG1-N 2.74Å; T226-L230 WeakPolarHBondContact O-CB 3.23Å; T226-L230 PolarHBondContact O-N 3.39Å
227	D	86.8	Confident	95.4	Very high	95 Å²	95	56.3 Å²	56.3	51%	0.508	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-31.2	177.5	-73	-6.4	0	0	0	111.5	P255	D227-P255 HydrophobicContact CB-CG 4.2Å
228	E	91.8	Very high	95.6	Very high	150 Å²	150	53 Å²	53	70%	0.701	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-31.9	-177.2	-54.2	77.3	-169	0	0	113.8	T226	T226-E228 VanDerWaalsContact CB-OE2 3.24Å; T226-E228 WeakPolarHBondContact CB-OE2 3.49Å; T226-E228 PolarHBondContact O-N 3.03Å; T226-E228 PolarHBondContact OG1-N 2.86Å; T226-E228 PolarHBondContact OG1-OE2 3.34Å
229	N	95.9	Very high	95.7	Very high	46 Å²	46	56.7 Å²	56.7	25%	0.246	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.6	-21.2	-171.8	82	6.2	0	0	0	113.7	E224 Y225 T226 K231 N232 L233	E224-N229 PolarHBondContact O-ND2 3.25Å; Y225-N229 VanDerWaalsContact CA-OD1 3.31Å; Y225-N229 WeakPolarHBondContact CA-OD1 3.48Å; T226-N229 PolarHBondContact N-OD1 3.02Å; T226-N229 PolarHBondContact O-N 3.29Å; T226-N229 PolarHBondContact O-OD1 3.06Å; T226-N229 PolarHBondContact OG1-N 2.74Å; N229-K231 VanDerWaalsContact C-N 3.3Å; N229-K231 PolarHBondContact O-N 3.32Å; N229-N232 PolarHBondContact O-N 2.65Å; N229-L233 HydrophobicContact CB-CD1 4.17Å; N229-L233 PolarHBondContact O-N 2.75Å
230	L	96.6	Very high	95.7	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-54.8	-46.9	-167.4	177.7	61.4	0	0	0	111.7	L177 I179 A204 I223 Y225 T226 L233 A234 P255	L177-L230 HydrophobicContact CD2-CD1 4.43Å; I179-L230 HydrophobicContact CD1-CD2 3.9Å; A204-L230 HydrophobicContact CB-CD1 3.85Å; I223-L230 HydrophobicContact CG2-CD1 4.17Å; Y225-L230 HydrophobicContact CG-CD1 4.45Å; T226-L230 WeakPolarHBondContact O-CB 3.23Å; T226-L230 PolarHBondContact O-N 3.39Å; L230-L233 PolarHBondContact O-N 2.9Å; L230-A234 VanDerWaalsContact O-CB 3.26Å; L230-A234 WeakPolarHBondContact O-CB 3.13Å; L230-A234 PolarHBondContact O-N 3.19Å; L230-P255 HydrophobicContact CB-CB 4.47Å; L230-P255 HydrophobicContact CD2-CB 3.78Å
231	K	96	Very high	95.7	Very high	77 Å²	77	65 Å²	65	34%	0.335	33%	0.329	S	S	.	.	H	α-helix	trans	-56.5	-52.5	177.4	178.6	-176.1	-170.2	159.7	0	112.4	N229 L233 A234 L235 D258	N229-K231 VanDerWaalsContact C-N 3.3Å; N229-K231 PolarHBondContact O-N 3.32Å; K231-L233 VanDerWaalsContact C-N 3.33Å; K231-L233 PolarHBondContact O-N 2.75Å; K231-A234 PolarHBondContact O-N 3.14Å; K231-L235 HydrophobicContact CG-CD1 4.02Å; K231-L235 WeakPolarHBondContact O-CB 3.3Å; K231-L235 WeakPolarHBondContact O-CG 3.49Å; K231-L235 PolarHBondContact O-N 3.01Å; K231-D258 HydrophobicContact CB-CB 4.14Å; K231-D258 HydrophobicContact CD-CB 3.85Å; K231-D258 HydrophobicContact CG-CB 4.06Å; K231-D258 IonicContact NZ-OD1 2.83Å; K231-D258 PolarHBondContact NZ-OD1 2.82Å
232	N	96.8	Very high	95.7	Very high	93 Å²	93	63.6 Å²	63.6	50%	0.497	32%	0.32	S	S	.	.	H	α-helix	trans	-65.3	-41.4	-173.8	-69.4	-22.3	0	0	0	110.7	N229 L235 Q236	N229-N232 PolarHBondContact O-N 2.65Å; N232-L235 PolarHBondContact O-N 3.32Å; N232-Q236 VanDerWaalsContact O-CG 3.27Å; N232-Q236 WeakPolarHBondContact O-CG 3.35Å; N232-Q236 PolarHBondContact O-N 2.89Å
233	L	97.3	Very high	95.7	Very high	54 Å²	54	62.2 Å²	62.2	28%	0.283	31%	0.311	S	S	.	.	H	α-helix	trans	-69	-38.3	177.6	-63.9	177.3	0	0	0	111.9	I223 N229 L230 K231 Q236 A237	I223-L233 HydrophobicContact CD1-CB 4.08Å; I223-L233 HydrophobicContact CG1-CB 4.16Å; I223-L233 HydrophobicContact CG2-CB 3.75Å; I223-L233 HydrophobicContact CG2-CD1 3.66Å; I223-L233 HydrophobicContact CG2-CG 4.35Å; N229-L233 HydrophobicContact CB-CD1 4.17Å; N229-L233 PolarHBondContact O-N 2.75Å; L230-L233 PolarHBondContact O-N 2.9Å; K231-L233 VanDerWaalsContact C-N 3.33Å; K231-L233 PolarHBondContact O-N 2.75Å; L233-Q236 PolarHBondContact O-N 3.33Å; L233-A237 WeakPolarHBondContact O-CB 3.22Å; L233-A237 PolarHBondContact O-N 3.23Å
234	A	97.4	Very high	95.7	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-64.6	-41	173.8	0	0	0	0	0	112	I223 L230 K231 A237 T238 C259	I223-A234 HydrophobicContact CD1-CB 4.17Å; L230-A234 VanDerWaalsContact O-CB 3.26Å; L230-A234 WeakPolarHBondContact O-CB 3.13Å; L230-A234 PolarHBondContact O-N 3.19Å; K231-A234 PolarHBondContact O-N 3.14Å; A234-A237 PolarHBondContact O-N 3.43Å; A234-T238 WeakPolarHBondContact O-CB 3.19Å; A234-T238 WeakPolarHBondContact O-CG2 3.46Å; A234-T238 PolarHBondContact O-N 3.27Å; A234-T238 VanDerWaalsContact O-N 3.16Å; A234-T238 PolarHBondContact O-OG1 3.16Å; A234-C259 HydrophobicContact CB-CB 3.88Å
235	L	96.9	Very high	95.8	Very high	37 Å²	37	58.8 Å²	58.8	19%	0.194	30%	0.296	C	S	.	.	H	α-helix	trans	-64.4	-42.9	174.3	-73	173.2	0	0	0	111.6	K231 N232 A237 T238 E239 N240	K231-L235 HydrophobicContact CG-CD1 4.02Å; K231-L235 WeakPolarHBondContact O-CB 3.3Å; K231-L235 WeakPolarHBondContact O-CG 3.49Å; K231-L235 PolarHBondContact O-N 3.01Å; N232-L235 PolarHBondContact O-N 3.32Å; L235-A237 PolarHBondContact O-N 3.43Å; L235-T238 WeakPolarHBondContact CA-OG1 3.46Å; L235-T238 CarbonylContact O-C 3.34Å; L235-T238 PolarHBondContact O-N 3.06Å; L235-T238 VanDerWaalsContact O-N 3.1Å; L235-T238 PolarHBondContact O-OG1 3.42Å; L235-E239 PolarHBondContact O-N 3.32Å; L235-E239 VanDerWaalsContact O-N 3.09Å; L235-N240 PolarHBondContact O-N 2.93Å
236	Q	96.7	Very high	96	Very high	137 Å²	137	57.7 Å²	57.7	64%	0.64	29%	0.292	S	S	*	.	H	α-helix	trans	-59.6	-45.4	175	-74.4	172.5	2.6	0	0	111.8	N232 L233 T238 E239	N232-Q236 VanDerWaalsContact O-CG 3.27Å; N232-Q236 WeakPolarHBondContact O-CG 3.35Å; N232-Q236 PolarHBondContact O-N 2.89Å; L233-Q236 PolarHBondContact O-N 3.33Å; Q236-T238 PolarHBondContact O-N 2.91Å; Q236-E239 PolarHBondContact O-N 3.45Å
237	A	96.2	Very high	96.3	Very high	28 Å²	28	54.8 Å²	54.8	23%	0.231	27%	0.274	C	S	.	.	H	α-helix	trans	-66.6	-14.4	177.5	0	0	0	0	0	114.1	I202 S221 L233 A234 L235	I202-A237 HydrophobicContact CD1-CB 3.82Å; S221-A237 WeakPolarHBondContact OG-CB 3.5Å; L233-A237 WeakPolarHBondContact O-CB 3.22Å; L233-A237 PolarHBondContact O-N 3.23Å; A234-A237 PolarHBondContact O-N 3.43Å; L235-A237 PolarHBondContact O-N 3.43Å
238	T	97	Very high	96.7	Very high	6 Å²	6	50.2 Å²	50.2	4%	0.037	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.5	17.8	-177	58.2	0	0	0	0	113.6	T175 I202 A234 L235 Q236 N240 K241 G242 V243	T175-T238 HydrophobicContact CG2-CG2 4.03Å; I202-T238 HydrophobicContact CD1-CG2 3.73Å; A234-T238 WeakPolarHBondContact O-CB 3.19Å; A234-T238 WeakPolarHBondContact O-CG2 3.46Å; A234-T238 PolarHBondContact O-N 3.27Å; A234-T238 VanDerWaalsContact O-N 3.16Å; A234-T238 PolarHBondContact O-OG1 3.16Å; L235-T238 WeakPolarHBondContact CA-OG1 3.46Å; L235-T238 CarbonylContact O-C 3.34Å; L235-T238 PolarHBondContact O-N 3.06Å; L235-T238 VanDerWaalsContact O-N 3.1Å; L235-T238 PolarHBondContact O-OG1 3.42Å; Q236-T238 PolarHBondContact O-N 2.91Å; T238-N240 PolarHBondContact O-N 3.27Å; T238-K241 VanDerWaalsContact O-CB 3.28Å; T238-K241 WeakPolarHBondContact O-CB 3.47Å; T238-K241 WeakPolarHBondContact O-CG 3.39Å; T238-K241 PolarHBondContact O-N 3.27Å; T238-G242 WeakPolarHBondContact OG1-CA 3.41Å; T238-G242 PolarHBondContact OG1-N 3.5Å; T238-V243 HydrophobicContact CG2-CG1 3.71Å
239	E	95.9	Very high	96.8	Very high	133 Å²	133	44 Å²	44	62%	0.621	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.8	41.1	-179.7	-56.4	163.6	-170.1	0	0	112.3	L235 Q236 K241	L235-E239 PolarHBondContact O-N 3.32Å; L235-E239 VanDerWaalsContact O-N 3.09Å; Q236-E239 PolarHBondContact O-N 3.45Å; E239-K241 PolarHBondContact O-N 3.07Å; E239-K241 IonicContact OE2-NZ 2.8Å; E239-K241 PolarHBondContact OE2-NZ 3.28Å
240	N	96.1	Very high	96.5	Very high	126 Å²	126	42 Å²	42	67%	0.674	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.7	15.9	-176.3	-57.4	-60.7	0	0	0	115.7	L235 T238	L235-N240 PolarHBondContact O-N 2.93Å; T238-N240 PolarHBondContact O-N 3.27Å
241	K	95.9	Very high	96.1	Very high	135 Å²	135	42.7 Å²	42.7	59%	0.587	22%	0.219	S	C	*	.	S	Bend	trans	-83.4	-31.1	177.7	-65.9	164.6	-179.7	152.6	0	113	T238 E239 K261	T238-K241 VanDerWaalsContact O-CB 3.28Å; T238-K241 WeakPolarHBondContact O-CB 3.47Å; T238-K241 WeakPolarHBondContact O-CG 3.39Å; T238-K241 PolarHBondContact O-N 3.27Å; E239-K241 PolarHBondContact O-N 3.07Å; E239-K241 IonicContact OE2-NZ 2.8Å; E239-K241 PolarHBondContact OE2-NZ 3.28Å; K241-K261 WeakPolarHBondContact O-CB 3.1Å
242	G	97.1	Very high	95.8	Very high	5 Å²	5	40.2 Å²	40.2	5%	0.052	21%	0.209	C	C	.	.			trans	82.2	173.4	-167	0	0	0	0	0	112.3	T238 C259	T238-G242 WeakPolarHBondContact OG1-CA 3.41Å; T238-G242 PolarHBondContact OG1-N 3.5Å; G242-C259 CarbonylContact C-O 3.55Å; G242-C259 VanDerWaalsContact CA-O 3.24Å; G242-C259 WeakPolarHBondContact CA-O 3.39Å
243	V	98.4	Very high	95.5	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	153.3	-177.5	-57.4	0	0	0	0	111.9	T175 L177 I202 T238 V246 C259 L260 K261	T175-V243 HydrophobicContact CG2-CB 4.46Å; T175-V243 HydrophobicContact CG2-CG1 3.97Å; L177-V243 HydrophobicContact CB-CB 4.34Å; L177-V243 HydrophobicContact CB-CG1 4.1Å; L177-V243 HydrophobicContact CB-CG2 3.9Å; I202-V243 HydrophobicContact CD1-CG1 4.21Å; T238-V243 HydrophobicContact CG2-CG1 3.71Å; V243-V246 HydrophobicContact CG2-CG2 3.73Å; V243-C259 HydrophobicContact CG2-CB 4.23Å; V243-C259 PolarHBondContact N-O 2.87Å; V243-L260 HydrophobicContact CG2-CD2 4Å; V243-K261 PolarHBondContact O-N 3.38Å; V243-K261 VanDerWaalsContact O-N 3.09Å
244	D	98.4	Very high	95.2	Very high	28 Å²	28	37.4 Å²	37.4	15%	0.15	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	-38.9	178	-69	-93.3	0	0	0	112.3	A174 T175 K261 G264 R265	A174-D244 HydrophobicContact CB-CB 3.82Å; T175-D244 PolarHBondContact N-OD2 2.82Å; T175-D244 PolarHBondContact O-N 2.74Å; D244-K261 VanDerWaalsContact CG-NZ 3.26Å; D244-K261 WeakPolarHBondContact OD1-CE 3.33Å; D244-K261 IonicContact OD1-NZ 3.8Å; D244-K261 PolarHBondContact OD1-NZ 2.94Å; D244-K261 IonicContact OD2-NZ 2.7Å; D244-K261 PolarHBondContact OD2-NZ 2.94Å; D244-G264 VanDerWaalsContact O-CA 3.31Å; D244-G264 WeakPolarHBondContact O-CA 3.42Å; D244-R265 PolarHBondContact O-N 2.87Å
245	L	98.6	Very high	95	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	132.6	-171.3	177.3	65.5	0	0	0	109.1	L165 E168 L171 T175 V176 L177 I247 R265 V267	L165-L245 HydrophobicContact CD2-CD2 4.44Å; E168-L245 HydrophobicContact CB-CD2 4.27Å; E168-L245 HydrophobicContact CG-CD1 4.04Å; E168-L245 HydrophobicContact CG-CD2 3.85Å; L171-L245 HydrophobicContact CD2-CD2 3.73Å; T175-L245 PolarHBondContact O-N 3.22Å; V176-L245 CarbonylContact C-O 3.52Å; V176-L245 WeakPolarHBondContact CA-O 3.38Å; V176-L245 HydrophobicContact CG1-CB 4.49Å; V176-L245 HydrophobicContact CG1-CD2 4.14Å; V176-L245 HydrophobicContact CG1-CG 4.3Å; V176-L245 HydrophobicContact CG2-CB 4.24Å; V176-L245 HydrophobicContact CG2-CD2 4.04Å; L177-L245 PolarHBondContact N-O 2.95Å; L245-I247 HydrophobicContact CD2-CD1 4.1Å; L245-I247 HydrophobicContact CD2-CG1 4.12Å; L245-I247 HydrophobicContact CG-CG1 4.11Å; L245-R265 CarbonylContact C-O 3.56Å; L245-R265 WeakPolarHBondContact CA-O 3.2Å; L245-R265 HydrophobicContact CD1-CB 3.9Å; L245-V267 HydrophobicContact CD1-CG2 3.79Å
246	V	98.4	Very high	94.9	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	130.7	164	178.6	0	0	0	0	108.6	L177 I179 V243 D248 A256 L260 R265 Y266 V267	L177-V246 HydrophobicContact CB-CG2 4.15Å; L177-V246 HydrophobicContact CD2-CG2 4.17Å; L177-V246 CarbonylContact O-C 3.52Å; L177-V246 VanDerWaalsContact O-CA 3.31Å; L177-V246 WeakPolarHBondContact O-CA 3.47Å; I179-V246 HydrophobicContact CD1-CG1 3.73Å; I179-V246 HydrophobicContact CG1-CG1 4.09Å; V243-V246 HydrophobicContact CG2-CG2 3.73Å; V246-D248 HydrophobicContact CG1-CB 4.34Å; V246-A256 HydrophobicContact CG1-CB 3.94Å; V246-L260 HydrophobicContact CB-CD2 4.44Å; V246-L260 HydrophobicContact CG2-CD2 3.71Å; V246-L260 HydrophobicContact CG2-CG 4.1Å; V246-R265 PolarHBondContact N-O 2.73Å; V246-Y266 HydrophobicContact CB-CD2 4.11Å; V246-Y266 HydrophobicContact CG1-CD2 4.01Å; V246-Y266 HydrophobicContact CG1-CE2 4.36Å; V246-V267 PolarHBondContact O-N 3.32Å
247	I	98.1	Very high	94.8	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	115.3	165.7	-59.1	-177.3	0	0	0	108.2	A164 L165 V176 L177 V178 I179 V189 L245 V267 L269	A164-I247 HydrophobicContact CB-CD1 4.46Å; L165-I247 HydrophobicContact CD2-CD1 3.43Å; L165-I247 VanDerWaalsContact CD2-CD1 3.43Å; L165-I247 HydrophobicContact CG-CD1 3.7Å; V176-I247 HydrophobicContact CG1-CD1 4.37Å; V176-I247 HydrophobicContact CG1-CG1 4.36Å; L177-I247 PolarHBondContact O-N 2.94Å; V178-I247 WeakPolarHBondContact CA-O 3.36Å; I179-I247 PolarHBondContact N-O 2.86Å; V189-I247 HydrophobicContact CG1-CB 4.02Å; V189-I247 HydrophobicContact CG1-CD1 3.63Å; V189-I247 HydrophobicContact CG1-CG1 4.37Å; V189-I247 HydrophobicContact CG1-CG2 3.9Å; V189-I247 HydrophobicContact CG2-CG2 3.89Å; L245-I247 HydrophobicContact CD2-CD1 4.1Å; L245-I247 HydrophobicContact CD2-CG1 4.12Å; L245-I247 HydrophobicContact CG-CG1 4.11Å; I247-V267 WeakPolarHBondContact CA-O 2.79Å; I247-V267 HydrophobicContact CG1-CB 4.39Å; I247-L269 HydrophobicContact CG2-CD1 3.6Å; I247-L269 HydrophobicContact CG2-CG 4.18Å
248	D	95.5	Very high	94.7	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	118.4	-172.5	-172	-2.3	0	0	0	111.8	I179 V246 V250 G251 L252 Y266 V267 L269 G270	I179-D248 HydrophobicContact CB-CB 4.45Å; V246-D248 HydrophobicContact CG1-CB 4.34Å; D248-V250 WeakPolarHBondContact OD1-CA 2.91Å; D248-V250 WeakPolarHBondContact OD1-CB 3.44Å; D248-V250 PolarHBondContact OD1-N 2.93Å; D248-G251 VanDerWaalsContact CG-N 3.33Å; D248-G251 PolarHBondContact OD1-N 2.76Å; D248-G251 WeakPolarHBondContact OD2-CA 3.39Å; D248-G251 PolarHBondContact OD2-N 2.75Å; D248-L252 PolarHBondContact OD2-N 2.78Å; D248-Y266 HydrophobicContact CB-CD2 4.45Å; D248-Y266 HydrophobicContact CB-CE2 3.49Å; D248-Y266 VanDerWaalsContact CB-CE2 3.49Å; D248-Y266 PolarHBondContact OD2-OH 3.24Å; D248-V267 PolarHBondContact N-O 3.09Å; D248-L269 PolarHBondContact O-N 3.01Å; D248-G270 PolarHBondContact O-N 3.36Å
249	T	93	Very high	94.7	Very high	19 Å²	19	30.6 Å²	30.6	12%	0.117	16%	0.155	C	C	.	.	S	Bend	trans	-102	-1	176.6	62.3	0	0	0	0	112.9	I179 T180 T185 L269 S272	I179-T249 PolarHBondContact O-N 2.83Å; I179-T249 PolarHBondContact O-OG1 2.89Å; T180-T249 VanDerWaalsContact CA-OG1 3.31Å; T180-T249 WeakPolarHBondContact CA-OG1 3.48Å; T180-T249 VanDerWaalsContact CB-OG1 3.28Å; T180-T249 WeakPolarHBondContact CB-OG1 3.3Å; T180-T249 PolarHBondContact OG1-OG1 3.2Å; T185-T249 HydrophobicContact CG2-CG2 4.33Å; T249-L269 HydrophobicContact CG2-CB 4.1Å; T249-L269 HydrophobicContact CG2-CD1 4.4Å; T249-S272 PolarHBondContact O-OG 3.07Å
250	V	89.5	Confident	94.8	Very high	4 Å²	4	25.1 Å²	25.1	2%	0.024	13%	0.129	C	C	.	.	S	Bend	trans	-107.3	-45	-174	-174.9	0	0	0	0	111.5	I179 N181 D248 L252 F271 S272 S273	I179-V250 HydrophobicContact CG2-CB 4.25Å; I179-V250 HydrophobicContact CG2-CG2 4.03Å; N181-V250 WeakPolarHBondContact ND2-CG2 3.46Å; D248-V250 WeakPolarHBondContact OD1-CA 2.91Å; D248-V250 WeakPolarHBondContact OD1-CB 3.44Å; D248-V250 PolarHBondContact OD1-N 2.93Å; V250-L252 HydrophobicContact CB-CG 4.38Å; V250-L252 HydrophobicContact CG1-CD1 4.42Å; V250-L252 HydrophobicContact CG1-CG 4.08Å; V250-F271 CarbonylContact O-C 3.55Å; V250-F271 WeakPolarHBondContact O-CA 3.11Å; V250-S272 WeakPolarHBondContact CA-OG 3.48Å; V250-S272 PolarHBondContact O-N 2.62Å; V250-S273 WeakPolarHBondContact O-CB 3.24Å; V250-S273 PolarHBondContact O-N 3.34Å; V250-S273 PolarHBondContact O-OG 2.84Å
251	G	88.8	Confident	94.9	Very high	15 Å²	15	22.5 Å²	22.5	16%	0.155	11%	0.112	C	C	.	.			trans	100.6	42.3	-177.7	0	0	0	0	0	113.8	D248 L253	D248-G251 VanDerWaalsContact CG-N 3.33Å; D248-G251 PolarHBondContact OD1-N 2.76Å; D248-G251 WeakPolarHBondContact OD2-CA 3.39Å; D248-G251 PolarHBondContact OD2-N 2.75Å; G251-L253 PolarHBondContact O-N 2.66Å
252	L	89.2	Confident	94.8	Very high	24 Å²	24	20.8 Å²	20.8	13%	0.126	12%	0.115	C	C	.	.			trans	-95.6	58.1	176.5	-63	180	0	0	0	111.7	I179 Y225 D248 V250 Y254 P255 A256	I179-L252 HydrophobicContact CG2-CD1 4Å; Y225-L252 HydrophobicContact CD2-CD1 3.8Å; Y225-L252 HydrophobicContact CE1-CD1 4.35Å; Y225-L252 HydrophobicContact CE2-CD1 3.16Å; Y225-L252 VanDerWaalsContact CZ-CD1 3.49Å; D248-L252 PolarHBondContact OD2-N 2.78Å; V250-L252 HydrophobicContact CB-CG 4.38Å; V250-L252 HydrophobicContact CG1-CD1 4.42Å; V250-L252 HydrophobicContact CG1-CG 4.08Å; L252-Y254 PolarHBondContact O-N 3.02Å; L252-P255 WeakPolarHBondContact O-CD 3.45Å; L252-A256 WeakPolarHBondContact O-CB 3.42Å; L252-A256 PolarHBondContact O-N 2.81Å
253	L	91.9	Very high	94.7	Very high	11 Å²	11	23 Å²	23	6%	0.058	14%	0.138	C	C	.	.	H	α-helix	trans	-51.6	-58.5	-169.5	179.7	62.2	0	0	0	113.6	G251 A256 L257 Y266 P277 V279 I291	G251-L253 PolarHBondContact O-N 2.66Å; L253-A256 WeakPolarHBondContact O-CB 3.34Å; L253-A256 PolarHBondContact O-N 2.87Å; L253-L257 HydrophobicContact CD1-CD1 3.91Å; L253-L257 HydrophobicContact CD1-CD2 4.27Å; L253-L257 HydrophobicContact CD1-CG 3.92Å; L253-L257 HydrophobicContact CG-CD1 4Å; L253-L257 HydrophobicContact CG-CG 4.34Å; L253-L257 VanDerWaalsContact O-CG 3.24Å; L253-L257 WeakPolarHBondContact O-CG 3.34Å; L253-L257 PolarHBondContact O-N 2.96Å; L253-Y266 HydrophobicContact CD1-CD1 3.78Å; L253-Y266 HydrophobicContact CD1-CD2 4.3Å; L253-Y266 HydrophobicContact CD1-CE1 3.53Å; L253-Y266 HydrophobicContact CD1-CE2 4.1Å; L253-Y266 HydrophobicContact CD1-CG 4.14Å; L253-P277 HydrophobicContact CB-CB 4.38Å; L253-P277 HydrophobicContact CB-CG 4.25Å; L253-P277 HydrophobicContact CD2-CB 4.18Å; L253-P277 HydrophobicContact CD2-CG 3.99Å; L253-V279 HydrophobicContact CD2-CG2 4.03Å; L253-I291 HydrophobicContact CD1-CD1 3.91Å; L253-I291 HydrophobicContact CD1-CG1 4.36Å; L253-I291 HydrophobicContact CD2-CD1 4.44Å
254	Y	91.3	Very high	94.7	Very high	77 Å²	77	23.1 Å²	23.1	30%	0.302	14%	0.138	S	C	.	.	H	α-helix	trans	-68.1	-48.4	-173.5	-72.5	-75.6	0	0	0	114.1	L252 A256 L257 D258 E278 N280	L252-Y254 PolarHBondContact O-N 3.02Å; Y254-A256 PolarHBondContact O-N 3.02Å; Y254-L257 HydrophobicContact CD1-CD1 4.48Å; Y254-L257 PolarHBondContact O-N 2.68Å; Y254-D258 PolarHBondContact O-N 2.85Å; Y254-E278 WeakPolarHBondContact CE2-O 3.32Å; Y254-E278 VanDerWaalsContact CZ-O 3.29Å; Y254-E278 PolarHBondContact OH-O 3.46Å; Y254-N280 HydrophobicContact CE1-CB 4.38Å; Y254-N280 VanDerWaalsContact OH-CB 3.3Å; Y254-N280 WeakPolarHBondContact OH-CB 3.47Å; Y254-N280 PolarHBondContact OH-N 3.28Å
255	P	92.5	Very high	94.6	Very high	25 Å²	25	22.5 Å²	22.5	16%	0.162	13%	0.134	C	C	.	.	H	α-helix	trans	-54.8	-38.7	172.4	-28	36.4	0	0	0	112.8	D227 L230 L252 D258 C259	D227-P255 HydrophobicContact CB-CG 4.2Å; L230-P255 HydrophobicContact CB-CB 4.47Å; L230-P255 HydrophobicContact CD2-CB 3.78Å; L252-P255 WeakPolarHBondContact O-CD 3.45Å; P255-D258 WeakPolarHBondContact O-CB 3.49Å; P255-D258 PolarHBondContact O-N 2.81Å; P255-C259 PolarHBondContact O-SG 2.9Å
256	A	94.5	Very high	94.6	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-66.5	-46.2	176.2	0	0	0	0	0	113.1	I179 V246 L252 L253 Y254 D258 C259 Y266	I179-A256 HydrophobicContact CD1-CB 3.64Å; V246-A256 HydrophobicContact CG1-CB 3.94Å; L252-A256 WeakPolarHBondContact O-CB 3.42Å; L252-A256 PolarHBondContact O-N 2.81Å; L253-A256 WeakPolarHBondContact O-CB 3.34Å; L253-A256 PolarHBondContact O-N 2.87Å; Y254-A256 PolarHBondContact O-N 3.02Å; A256-D258 PolarHBondContact O-N 3.34Å; A256-C259 WeakPolarHBondContact O-CB 3.06Å; A256-C259 PolarHBondContact O-N 3.07Å; A256-Y266 HydrophobicContact CB-CD2 3.71Å; A256-Y266 HydrophobicContact CB-CE2 3.63Å
257	L	95.4	Very high	94.6	Very high	2 Å²	2	22.9 Å²	22.9	1%	0.01	14%	0.135	C	C	.	.	H	α-helix	trans	-60.6	-28.1	176.6	-69.9	179.3	0	0	0	112.2	L253 Y254 C259 L260 Y266 V289 I291	L253-L257 HydrophobicContact CD1-CD1 3.91Å; L253-L257 HydrophobicContact CD1-CD2 4.27Å; L253-L257 HydrophobicContact CD1-CG 3.92Å; L253-L257 HydrophobicContact CG-CD1 4Å; L253-L257 HydrophobicContact CG-CG 4.34Å; L253-L257 VanDerWaalsContact O-CG 3.24Å; L253-L257 WeakPolarHBondContact O-CG 3.34Å; L253-L257 PolarHBondContact O-N 2.96Å; Y254-L257 HydrophobicContact CD1-CD1 4.48Å; Y254-L257 PolarHBondContact O-N 2.68Å; L257-C259 VanDerWaalsContact C-N 3.28Å; L257-C259 PolarHBondContact O-N 3.49Å; L257-L260 HydrophobicContact CD2-CD1 3.87Å; L257-L260 PolarHBondContact O-N 3.25Å; L257-Y266 HydrophobicContact CD2-CG 4.35Å; L257-V289 HydrophobicContact CD2-CG2 4.03Å; L257-I291 HydrophobicContact CD1-CD1 4.17Å; L257-I291 HydrophobicContact CD2-CD1 4.35Å; L257-I291 HydrophobicContact CD2-CG1 4.08Å
258	D	94.3	Very high	94.4	Very high	39 Å²	39	24.4 Å²	24.4	21%	0.209	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-19.4	175.7	-101.1	-51.2	0	0	0	114.6	K231 Y254 P255 A256 R287	K231-D258 HydrophobicContact CB-CB 4.14Å; K231-D258 HydrophobicContact CD-CB 3.85Å; K231-D258 HydrophobicContact CG-CB 4.06Å; K231-D258 IonicContact NZ-OD1 2.83Å; K231-D258 PolarHBondContact NZ-OD1 2.82Å; Y254-D258 PolarHBondContact O-N 2.85Å; P255-D258 WeakPolarHBondContact O-CB 3.49Å; P255-D258 PolarHBondContact O-N 2.81Å; A256-D258 PolarHBondContact O-N 3.34Å; D258-R287 IonicContact OD1-CZ 2.74Å; D258-R287 IonicContact OD1-NH1 3.44Å; D258-R287 PolarHBondContact OD1-NH1 3.31Å; D258-R287 IonicContact OD1-NH2 2.75Å; D258-R287 PolarHBondContact OD1-NH2 3.36Å; D258-R287 IonicContact OD2-NH2 3.14Å; D258-R287 PolarHBondContact OD2-NH2 3.12Å
259	C	97	Very high	94.3	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-19.5	176.6	-58.2	0	0	0	0	112.8	L177 A234 G242 V243 P255 A256 L257	L177-C259 HydrophobicContact CD2-CB 3.92Å; A234-C259 HydrophobicContact CB-CB 3.88Å; G242-C259 CarbonylContact C-O 3.55Å; G242-C259 VanDerWaalsContact CA-O 3.24Å; G242-C259 WeakPolarHBondContact CA-O 3.39Å; V243-C259 HydrophobicContact CG2-CB 4.23Å; V243-C259 PolarHBondContact N-O 2.87Å; P255-C259 PolarHBondContact O-SG 2.9Å; A256-C259 WeakPolarHBondContact O-CB 3.06Å; A256-C259 PolarHBondContact O-N 3.07Å; L257-C259 VanDerWaalsContact C-N 3.28Å; L257-C259 PolarHBondContact O-N 3.49Å
260	L	97.7	Very high	93.7	Very high	17 Å²	17	25.8 Å²	25.8	9%	0.089	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	141.6	-176.3	-69.2	174.7	0	0	0	111.6	V243 V246 L257 R265 V289	V243-L260 HydrophobicContact CG2-CD2 4Å; V246-L260 HydrophobicContact CB-CD2 4.44Å; V246-L260 HydrophobicContact CG2-CD2 3.71Å; V246-L260 HydrophobicContact CG2-CG 4.1Å; L257-L260 HydrophobicContact CD2-CD1 3.87Å; L257-L260 PolarHBondContact O-N 3.25Å; L260-R265 WeakPolarHBondContact CD2-O 3.31Å; L260-V289 HydrophobicContact CB-CG1 3.94Å; L260-V289 HydrophobicContact CD1-CB 4.03Å; L260-V289 HydrophobicContact CD1-CG1 3.83Å
261	K	96.7	Very high	93.2	Very high	72 Å²	72	31.1 Å²	31.1	31%	0.313	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	164.4	163.3	74.6	-175.7	-175.6	-175.9	0	110.9	K241 V243 D244 G263 G264	K241-K261 WeakPolarHBondContact O-CB 3.1Å; V243-K261 PolarHBondContact O-N 3.38Å; V243-K261 VanDerWaalsContact O-N 3.09Å; D244-K261 VanDerWaalsContact CG-NZ 3.26Å; D244-K261 WeakPolarHBondContact OD1-CE 3.33Å; D244-K261 IonicContact OD1-NZ 3.8Å; D244-K261 PolarHBondContact OD1-NZ 2.94Å; D244-K261 IonicContact OD2-NZ 2.7Å; D244-K261 PolarHBondContact OD2-NZ 2.94Å; K261-G263 PolarHBondContact O-N 3.47Å; K261-G264 WeakPolarHBondContact O-CA 3.31Å; K261-G264 PolarHBondContact O-N 3.33Å
262	P	95.3	Very high	92.3	Very high	99 Å²	99	32.2 Å²	32.2	64%	0.643	19%	0.186	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-54.1	133.9	170.4	-25.1	35	0	0	0	111.8	G264	P262-G264 PolarHBondContact O-N 2.89Å
263	G	94.8	Very high	91.4	Very high	52 Å²	52	32.8 Å²	32.8	54%	0.536	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	81.3	-1.8	-171.6	0	0	0	0	0	114.5	K261 Q288	K261-G263 PolarHBondContact O-N 3.47Å; G263-Q288 WeakPolarHBondContact CA-O 3.36Å; G263-Q288 PolarHBondContact N-O 3.47Å
264	G	97.5	Very high	90.3	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.01	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	160.6	179	0	0	0	0	0	113.4	D244 K261 P262 V289 S290	D244-G264 VanDerWaalsContact O-CA 3.31Å; D244-G264 WeakPolarHBondContact O-CA 3.42Å; K261-G264 WeakPolarHBondContact O-CA 3.31Å; K261-G264 PolarHBondContact O-N 3.33Å; P262-G264 PolarHBondContact O-N 2.89Å; G264-V289 VanDerWaalsContact O-CA 3.25Å; G264-V289 WeakPolarHBondContact O-CA 3.28Å; G264-V289 VanDerWaalsContact O-CB 3.28Å; G264-V289 WeakPolarHBondContact O-CB 3.03Å; G264-S290 PolarHBondContact O-N 3.21Å; G264-S290 VanDerWaalsContact O-N 3.14Å
265	R	97.7	Very high	89.5	Confident	15 Å²	15	40.3 Å²	40.3	6%	0.057	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	134.4	-170.4	-58.2	165	-73.7	174	-15.1	110.6	E168 H169 D244 L245 V246 L260 S290	E168-R265 VanDerWaalsContact OE2-CD 3.26Å; E168-R265 WeakPolarHBondContact OE2-CD 3.47Å; E168-R265 IonicContact OE2-CZ 2.64Å; E168-R265 IonicContact OE2-NE 3.61Å; E168-R265 IonicContact OE2-NH1 2.73Å; E168-R265 PolarHBondContact OE2-NH1 2.95Å; H169-R265 PolarHBondContact CE1-NH1 2.89Å; H169-R265 VanDerWaalsContact CE1-NH1 3.31Å; H169-R265 PolarHBondContact ND1-NH1 2.82Å; H169-R265 PolarHBondContact O-NH1 3.45Å; H169-R265 VanDerWaalsContact O-NH1 3.13Å; H169-R265 PolarHBondContact O-NH2 2.86Å; D244-R265 PolarHBondContact O-N 2.87Å; L245-R265 CarbonylContact C-O 3.56Å; L245-R265 WeakPolarHBondContact CA-O 3.2Å; L245-R265 HydrophobicContact CD1-CB 3.9Å; V246-R265 PolarHBondContact N-O 2.73Å; L260-R265 WeakPolarHBondContact CD2-O 3.31Å; R265-S290 WeakPolarHBondContact CG-OG 3.25Å
266	Y	97.5	Very high	88.8	Confident	8 Å²	8	46.8 Å²	46.8	3%	0.031	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	127.6	172.5	171.4	-85.7	0	0	0	109.7	V246 D248 L253 A256 L257 S290 I291 K292	V246-Y266 HydrophobicContact CB-CD2 4.11Å; V246-Y266 HydrophobicContact CG1-CD2 4.01Å; V246-Y266 HydrophobicContact CG1-CE2 4.36Å; D248-Y266 HydrophobicContact CB-CD2 4.45Å; D248-Y266 HydrophobicContact CB-CE2 3.49Å; D248-Y266 VanDerWaalsContact CB-CE2 3.49Å; D248-Y266 PolarHBondContact OD2-OH 3.24Å; L253-Y266 HydrophobicContact CD1-CD1 3.78Å; L253-Y266 HydrophobicContact CD1-CD2 4.3Å; L253-Y266 HydrophobicContact CD1-CE1 3.53Å; L253-Y266 HydrophobicContact CD1-CE2 4.1Å; L253-Y266 HydrophobicContact CD1-CG 4.14Å; A256-Y266 HydrophobicContact CB-CD2 3.71Å; A256-Y266 HydrophobicContact CB-CE2 3.63Å; L257-Y266 HydrophobicContact CD2-CG 4.35Å; Y266-S290 PolarHBondContact N-O 3.48Å; Y266-I291 HydrophobicContact CD1-CB 4.49Å; Y266-I291 HydrophobicContact CD1-CG1 4.41Å; Y266-I291 HydrophobicContact CD1-CG2 3.92Å; Y266-I291 HydrophobicContact CE1-CG2 4.35Å; Y266-I291 CarbonylContact O-C 3.54Å; Y266-I291 WeakPolarHBondContact O-CA 3.37Å; Y266-K292 PolarHBondContact O-N 3.11Å
267	V	97.6	Very high	88.2	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	116.5	176.4	-179.7	0	0	0	0	109.3	A164 E168 L245 V246 I247 D248 K292 V294	A164-V267 HydrophobicContact CB-CG1 3.89Å; E168-V267 WeakPolarHBondContact OE1-CG2 3.39Å; L245-V267 HydrophobicContact CD1-CG2 3.79Å; V246-V267 PolarHBondContact O-N 3.32Å; I247-V267 WeakPolarHBondContact CA-O 2.79Å; I247-V267 HydrophobicContact CG1-CB 4.39Å; D248-V267 PolarHBondContact N-O 3.09Å; V267-K292 CarbonylContact C-O 3.56Å; V267-K292 WeakPolarHBondContact CA-O 3.1Å; V267-V294 HydrophobicContact CG1-CB 4.38Å; V267-V294 HydrophobicContact CG1-CG2 3.73Å
268	S	94.7	Very high	87.9	Confident	32 Å²	32	57.8 Å²	57.8	22%	0.224	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	125.1	171.6	-172.6	0	0	0	0	110.7	G270 K292 V294	S268-G270 PolarHBondContact OG-O 3.43Å; S268-K292 PolarHBondContact N-O 2.86Å; S268-V294 PolarHBondContact O-N 2.71Å
269	L	92.6	Very high	87.7	Confident	29 Å²	29	59.6 Å²	59.6	15%	0.152	34%	0.335	C	S	.	.			trans	-106.4	-13.5	171.4	-85.6	179.4	0	0	0	113.2	A164 T185 V189 I247 D248 T249 V294	A164-L269 HydrophobicContact CB-CD1 3.77Å; A164-L269 HydrophobicContact CB-CD2 3.89Å; A164-L269 HydrophobicContact CB-CG 3.89Å; T185-L269 HydrophobicContact CG2-CD1 4.01Å; V189-L269 HydrophobicContact CG2-CD1 3.64Å; I247-L269 HydrophobicContact CG2-CD1 3.6Å; I247-L269 HydrophobicContact CG2-CG 4.18Å; D248-L269 PolarHBondContact O-N 3.01Å; T249-L269 HydrophobicContact CG2-CB 4.1Å; T249-L269 HydrophobicContact CG2-CD1 4.4Å; L269-V294 HydrophobicContact CD2-CB 3.83Å; L269-V294 HydrophobicContact CD2-CG1 3.79Å
270	G	80.6	Confident	87.3	Confident	19 Å²	19	62.9 Å²	62.9	20%	0.196	35%	0.353	C	S	.	.			trans	-172.1	162.3	-179.2	0	0	0	0	0	112.5	D248 S268	D248-G270 PolarHBondContact O-N 3.36Å; S268-G270 PolarHBondContact OG-O 3.43Å
271	F	78.8	Confident	87.2	Confident	116 Å²	116	68 Å²	68	51%	0.509	38%	0.379	S	S	.	.			trans	-128.6	53.8	179.6	57.1	-83.5	0	0	0	109.1	L77 V250 S273 C274	L77-F271 HydrophobicContact CD1-CZ 4.37Å; V250-F271 CarbonylContact O-C 3.55Å; V250-F271 WeakPolarHBondContact O-CA 3.11Å; F271-S273 PolarHBondContact O-N 2.77Å; F271-C274 PolarHBondContact O-N 2.84Å
272	S	71	Confident	87	Confident	39 Å²	39	71.5 Å²	71.5	27%	0.273	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-10	-178.6	64.5	0	0	0	0	113.6	T249 V250 R364	T249-S272 PolarHBondContact O-OG 3.07Å; V250-S272 WeakPolarHBondContact CA-OG 3.48Å; V250-S272 PolarHBondContact O-N 2.62Å; S272-R364 VanDerWaalsContact C-NH2 3.34Å; S272-R364 PolarHBondContact O-NH2 2.8Å; S272-R364 PolarHBondContact OG-NH2 2.95Å
273	S	69.8	Low	86.7	Confident	36 Å²	36	69.6 Å²	69.6	25%	0.252	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-19.3	166.7	68.2	0	0	0	0	113.8	V250 F271 K275	V250-S273 WeakPolarHBondContact O-CB 3.24Å; V250-S273 PolarHBondContact O-N 3.34Å; V250-S273 PolarHBondContact O-OG 2.84Å; F271-S273 PolarHBondContact O-N 2.77Å; S273-K275 PolarHBondContact O-N 3.19Å; S273-K275 PolarHBondContact OG-N 2.69Å
274	C	69.8	Low	86.7	Confident	81 Å²	81	68.5 Å²	68.5	55%	0.547	36%	0.361	S	S	.	.			trans	53.8	19	-171.8	-61.4	0	0	0	0	114.2	F271	F271-C274 PolarHBondContact O-N 2.84Å
275	K	73.4	Confident	86.5	Confident	164 Å²	164	73.8 Å²	73.8	71%	0.713	39%	0.393	S	S	*	.			trans	-104.5	123.7	174.7	-67.1	-179	-178	179.2	0	108.4	S273 P277	S273-K275 PolarHBondContact O-N 3.19Å; S273-K275 PolarHBondContact OG-N 2.69Å; K275-P277 VanDerWaalsContact O-CD 3.32Å; K275-P277 WeakPolarHBondContact O-CD 3.37Å
276	I	79.1	Confident	86.2	Confident	162 Å²	162	80.9 Å²	80.9	83%	0.831	42%	0.424	S	S	*	.			trans	-83.9	112.8	173.8	-58.1	175.2	0	0	0	107.1
277	P	82	Confident	85.9	Confident	60 Å²	60	83.3 Å²	83.3	39%	0.39	43%	0.433	S	S	.	.			trans	-75.2	141.8	178.3	31.2	-33.7	0	0	0	110.5	L253 K275	L253-P277 HydrophobicContact CB-CB 4.38Å; L253-P277 HydrophobicContact CB-CG 4.25Å; L253-P277 HydrophobicContact CD2-CB 4.18Å; L253-P277 HydrophobicContact CD2-CG 3.99Å; K275-P277 VanDerWaalsContact O-CD 3.32Å; K275-P277 WeakPolarHBondContact O-CD 3.37Å
278	E	87.4	Confident	85.8	Confident	173 Å²	173	90.2 Å²	90.2	81%	0.808	47%	0.465	S	S	*	.			trans	-72.5	136	161.8	-68.7	-174.8	177.1	0	0	109.3	Y254	Y254-E278 WeakPolarHBondContact CE2-O 3.32Å; Y254-E278 VanDerWaalsContact CZ-O 3.29Å; Y254-E278 PolarHBondContact OH-O 3.46Å
279	V	90.1	Very high	85.9	Confident	77 Å²	77	89.4 Å²	89.4	47%	0.467	46%	0.459	S	S	.	.			trans	-101.9	108.8	-177.3	-177.7	0	0	0	0	110.4	L253 L281 I284 I291	L253-V279 HydrophobicContact CD2-CG2 4.03Å; V279-L281 HydrophobicContact CG1-CD2 4.3Å; V279-L281 PolarHBondContact O-N 2.86Å; V279-I284 HydrophobicContact CG1-CD1 3.51Å; V279-I291 HydrophobicContact CG1-CD1 4.31Å
280	N	90.6	Very high	86.1	Confident	69 Å²	69	90.7 Å²	90.7	37%	0.369	47%	0.471	S	S	.	.			trans	-85.1	102.1	176.4	-175.5	-32.1	0	0	0	110.3	Y254 Q282 Q283 I284	Y254-N280 HydrophobicContact CE1-CB 4.38Å; Y254-N280 VanDerWaalsContact OH-CB 3.3Å; Y254-N280 WeakPolarHBondContact OH-CB 3.47Å; Y254-N280 PolarHBondContact OH-N 3.28Å; N280-Q282 PolarHBondContact O-N 3.38Å; N280-Q282 WeakPolarHBondContact OD1-CA 3.23Å; N280-Q282 VanDerWaalsContact OD1-CB 3.24Å; N280-Q282 WeakPolarHBondContact OD1-CB 3.45Å; N280-Q282 PolarHBondContact OD1-N 2.93Å; N280-Q283 HydrophobicContact CB-CB 4.43Å; N280-Q283 HydrophobicContact CB-CG 4.19Å; N280-Q283 WeakPolarHBondContact O-CB 3.36Å; N280-Q283 PolarHBondContact O-N 2.7Å; N280-Q283 VanDerWaalsContact O-N 3.11Å; N280-Q283 PolarHBondContact OD1-N 3.1Å; N280-I284 PolarHBondContact O-N 2.86Å
281	L	93.9	Very high	86.8	Confident	123 Å²	123	93 Å²	93	64%	0.644	48%	0.478	S	S	*	.	H	α-helix	trans	-60.9	-29.3	-178.9	-61.6	-178	0	0	0	113.4	V279 Q283 I284 V285	V279-L281 HydrophobicContact CG1-CD2 4.3Å; V279-L281 PolarHBondContact O-N 2.86Å; L281-Q283 VanDerWaalsContact C-N 3.3Å; L281-Q283 PolarHBondContact O-N 2.75Å; L281-I284 HydrophobicContact CD2-CD1 4Å; L281-I284 PolarHBondContact O-N 2.79Å; L281-V285 WeakPolarHBondContact O-CG2 3.45Å; L281-V285 PolarHBondContact O-N 3.32Å
282	Q	92.9	Very high	87.6	Confident	147 Å²	147	90.2 Å²	90.2	69%	0.687	47%	0.465	S	S	*	.	H	α-helix	trans	-64.3	-37.1	177	-168.8	-176.4	12	0	0	111.4	N280 K286	N280-Q282 PolarHBondContact O-N 3.38Å; N280-Q282 WeakPolarHBondContact OD1-CA 3.23Å; N280-Q282 VanDerWaalsContact OD1-CB 3.24Å; N280-Q282 WeakPolarHBondContact OD1-CB 3.45Å; N280-Q282 PolarHBondContact OD1-N 2.93Å; Q282-K286 WeakPolarHBondContact O-CB 3.35Å; Q282-K286 PolarHBondContact O-N 3.18Å
283	Q	89.7	Confident	88.7	Confident	59 Å²	59	91.3 Å²	91.3	28%	0.276	48%	0.483	S	S	.	.	H	α-helix	trans	-66.2	-39.9	175.7	-72	-68.6	-23.3	0	0	111.7	N280 L281 R287	N280-Q283 HydrophobicContact CB-CB 4.43Å; N280-Q283 HydrophobicContact CB-CG 4.19Å; N280-Q283 WeakPolarHBondContact O-CB 3.36Å; N280-Q283 PolarHBondContact O-N 2.7Å; N280-Q283 VanDerWaalsContact O-N 3.11Å; N280-Q283 PolarHBondContact OD1-N 3.1Å; L281-Q283 VanDerWaalsContact C-N 3.3Å; L281-Q283 PolarHBondContact O-N 2.75Å; Q283-R287 WeakPolarHBondContact O-CB 3.42Å; Q283-R287 WeakPolarHBondContact O-CD 3.26Å; Q283-R287 WeakPolarHBondContact O-CG 3.48Å; Q283-R287 PolarHBondContact O-N 2.89Å; Q283-R287 VanDerWaalsContact O-N 3.09Å
284	I	93.4	Very high	89.8	Confident	28 Å²	28	90.3 Å²	90.3	14%	0.144	48%	0.475	C	S	.	.	H	α-helix	trans	-64.1	-50.6	177.7	-60	173.1	0	0	0	110.2	V279 N280 L281 K286 R287 Q288 V289 I291	V279-I284 HydrophobicContact CG1-CD1 3.51Å; N280-I284 PolarHBondContact O-N 2.86Å; L281-I284 HydrophobicContact CD2-CD1 4Å; L281-I284 PolarHBondContact O-N 2.79Å; I284-K286 PolarHBondContact O-N 3.19Å; I284-R287 PolarHBondContact O-N 3.37Å; I284-Q288 PolarHBondContact O-N 2.83Å; I284-V289 HydrophobicContact CG2-CG2 4.17Å; I284-V289 WeakPolarHBondContact CG2-O 3.37Å; I284-V289 PolarHBondContact O-N 3.04Å; I284-I291 HydrophobicContact CD1-CD1 3.39Å; I284-I291 HydrophobicContact CD1-CG1 4.35Å; I284-I291 HydrophobicContact CG1-CD1 3.88Å
285	V	94	Very high	90.8	Very high	113 Å²	113	92.6 Å²	92.6	69%	0.685	47%	0.473	S	S	*	.	H	α-helix	trans	-60.6	-46.8	179	172.4	0	0	0	0	110.9	L281 R287 Q288	L281-V285 WeakPolarHBondContact O-CG2 3.45Å; L281-V285 PolarHBondContact O-N 3.32Å; V285-R287 PolarHBondContact O-N 3.15Å; V285-Q288 PolarHBondContact O-N 3.29Å; V285-Q288 VanDerWaalsContact O-N 3.15Å
286	K	92.5	Very high	91.7	Very high	163 Å²	163	85.7 Å²	85.7	71%	0.709	44%	0.442	S	S	*	.	H	α-helix	trans	-59.3	-36.4	179.4	-177.7	-179.8	177.8	-177.5	0	112.4	Q282 I284	Q282-K286 WeakPolarHBondContact O-CB 3.35Å; Q282-K286 PolarHBondContact O-N 3.18Å; I284-K286 PolarHBondContact O-N 3.19Å
287	R	90.8	Very high	92	Very high	60 Å²	60	79 Å²	79	23%	0.226	41%	0.414	C	S	.	.	H	α-helix	trans	-86.1	-14.6	-179	-67.8	170.3	-173.2	-88.5	4.4	113.4	D258 Q283 I284 V285 V289	D258-R287 IonicContact OD1-CZ 2.74Å; D258-R287 IonicContact OD1-NH1 3.44Å; D258-R287 PolarHBondContact OD1-NH1 3.31Å; D258-R287 IonicContact OD1-NH2 2.75Å; D258-R287 PolarHBondContact OD1-NH2 3.36Å; D258-R287 IonicContact OD2-NH2 3.14Å; D258-R287 PolarHBondContact OD2-NH2 3.12Å; Q283-R287 WeakPolarHBondContact O-CB 3.42Å; Q283-R287 WeakPolarHBondContact O-CD 3.26Å; Q283-R287 WeakPolarHBondContact O-CG 3.48Å; Q283-R287 PolarHBondContact O-N 2.89Å; Q283-R287 VanDerWaalsContact O-N 3.09Å; I284-R287 PolarHBondContact O-N 3.37Å; V285-R287 PolarHBondContact O-N 3.15Å; R287-V289 VanDerWaalsContact C-N 3.34Å; R287-V289 HydrophobicContact CB-CB 4.46Å; R287-V289 HydrophobicContact CB-CG1 3.89Å; R287-V289 HydrophobicContact CB-CG2 3.87Å
288	Q	95.1	Very high	92.3	Very high	144 Å²	144	76.3 Å²	76.3	67%	0.673	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.1	48.5	-174.3	-54.7	179.3	45	0	0	111.8	G263 I284 V285	G263-Q288 WeakPolarHBondContact CA-O 3.36Å; G263-Q288 PolarHBondContact N-O 3.47Å; I284-Q288 PolarHBondContact O-N 2.83Å; V285-Q288 PolarHBondContact O-N 3.29Å; V285-Q288 VanDerWaalsContact O-N 3.15Å
289	V	96.6	Very high	92.4	Very high	15 Å²	15	69.1 Å²	69.1	9%	0.091	36%	0.363	C	S	.	.			trans	-116.5	161.6	-177.5	-65.4	0	0	0	0	111.2	L257 L260 G264 I284 R287	L257-V289 HydrophobicContact CD2-CG2 4.03Å; L260-V289 HydrophobicContact CB-CG1 3.94Å; L260-V289 HydrophobicContact CD1-CB 4.03Å; L260-V289 HydrophobicContact CD1-CG1 3.83Å; G264-V289 VanDerWaalsContact O-CA 3.25Å; G264-V289 WeakPolarHBondContact O-CA 3.28Å; G264-V289 VanDerWaalsContact O-CB 3.28Å; G264-V289 WeakPolarHBondContact O-CB 3.03Å; I284-V289 HydrophobicContact CG2-CG2 4.17Å; I284-V289 WeakPolarHBondContact CG2-O 3.37Å; I284-V289 PolarHBondContact O-N 3.04Å; R287-V289 VanDerWaalsContact C-N 3.34Å; R287-V289 HydrophobicContact CB-CB 4.46Å; R287-V289 HydrophobicContact CB-CG1 3.89Å; R287-V289 HydrophobicContact CB-CG2 3.87Å
290	S	96.3	Very high	92.3	Very high	57 Å²	57	66.2 Å²	66.2	40%	0.399	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	148.5	172.3	67.8	0	0	0	0	112.2	G264 R265 Y266	G264-S290 PolarHBondContact O-N 3.21Å; G264-S290 VanDerWaalsContact O-N 3.14Å; R265-S290 WeakPolarHBondContact CG-OG 3.25Å; Y266-S290 PolarHBondContact N-O 3.48Å
291	I	95.9	Very high	92.2	Very high	67 Å²	67	67.6 Å²	67.6	34%	0.344	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	129.1	173.2	-63.3	174.1	0	0	0	108.1	L253 L257 Y266 V279 I284	L253-I291 HydrophobicContact CD1-CD1 3.91Å; L253-I291 HydrophobicContact CD1-CG1 4.36Å; L253-I291 HydrophobicContact CD2-CD1 4.44Å; L257-I291 HydrophobicContact CD1-CD1 4.17Å; L257-I291 HydrophobicContact CD2-CD1 4.35Å; L257-I291 HydrophobicContact CD2-CG1 4.08Å; Y266-I291 HydrophobicContact CD1-CB 4.49Å; Y266-I291 HydrophobicContact CD1-CG1 4.41Å; Y266-I291 HydrophobicContact CD1-CG2 3.92Å; Y266-I291 HydrophobicContact CE1-CG2 4.35Å; Y266-I291 CarbonylContact O-C 3.54Å; Y266-I291 WeakPolarHBondContact O-CA 3.37Å; V279-I291 HydrophobicContact CG1-CD1 4.31Å; I284-I291 HydrophobicContact CD1-CD1 3.39Å; I284-I291 HydrophobicContact CD1-CG1 4.35Å; I284-I291 HydrophobicContact CG1-CD1 3.88Å
292	K	95.5	Very high	92	Very high	57 Å²	57	69.1 Å²	69.1	25%	0.248	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	141	176.3	-176.5	175.2	62.9	172.5	0	110.8	E168 Y266 V267 S268	E168-K292 WeakPolarHBondContact OE1-CE 3.48Å; E168-K292 IonicContact OE1-NZ 3.56Å; E168-K292 PolarHBondContact OE1-NZ 2.96Å; Y266-K292 PolarHBondContact O-N 3.11Å; V267-K292 CarbonylContact C-O 3.56Å; V267-K292 WeakPolarHBondContact CA-O 3.1Å; S268-K292 PolarHBondContact N-O 2.86Å
293	G	93.8	Very high	92	Very high	62 Å²	62	65.1 Å²	65.1	64%	0.639	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.8	144	167	0	0	0	0	0	110.6
294	V	94.2	Very high	92.1	Very high	16 Å²	16	66.3 Å²	66.3	10%	0.097	35%	0.345	C	S	.	.			trans	-124.1	125.5	175.7	171.2	0	0	0	0	109.2	L163 A164 V267 S268 L269	L163-V294 HydrophobicContact CB-CG1 4.05Å; L163-V294 HydrophobicContact CD2-CG1 3.75Å; L163-V294 HydrophobicContact CG-CG1 3.81Å; A164-V294 HydrophobicContact CB-CG1 4.4Å; A164-V294 HydrophobicContact CB-CG2 4.36Å; V267-V294 HydrophobicContact CG1-CB 4.38Å; V267-V294 HydrophobicContact CG1-CG2 3.73Å; S268-V294 PolarHBondContact O-N 2.71Å; L269-V294 HydrophobicContact CD2-CB 3.83Å; L269-V294 HydrophobicContact CD2-CG1 3.79Å
295	W	90.4	Very high	92.1	Very high	129 Å²	129	68 Å²	68	49%	0.489	36%	0.364	S	S	.	.			trans	-127.8	105.9	179.7	179	35.8	0	0	0	110.8	H84 G297 G298 F299	H84-W295 AromaticContact CE1-CE2 3.86Å; H84-W295 AromaticContact CE1-CZ2 3.68Å; H84-W295 AromaticContact CE1-NE1 3.95Å; H84-W295 AromaticContact NE2-CE2 3.75Å; H84-W295 AromaticContact NE2-CH2 3.66Å; H84-W295 AromaticContact NE2-CZ2 3.1Å; H84-W295 WeakPolarHBondContact NE2-CZ2 3.12Å; W295-G297 PolarHBondContact O-N 2.81Å; W295-G298 VanDerWaalsContact CZ3-CA 3.5Å; W295-G298 PolarHBondContact O-N 2.99Å; W295-F299 PolarHBondContact O-N 2.94Å
296	F	91.4	Very high	92.1	Very high	18 Å²	18	63 Å²	63	8%	0.079	34%	0.336	C	S	.	.	H	α-helix	trans	-63.4	-39.7	-178.6	177.9	-110.5	0	0	0	113.2	L120 P155 S160 G298 F299 A300 W307 L310 I311	L120-F296 HydrophobicContact CD2-CE1 3.76Å; L120-F296 HydrophobicContact CD2-CZ 4.08Å; P155-F296 WeakPolarHBondContact O-CZ 3.2Å; S160-F296 VanDerWaalsContact OG-CB 3.29Å; S160-F296 WeakPolarHBondContact OG-CB 3.5Å; F296-G298 VanDerWaalsContact C-N 3.32Å; F296-G298 PolarHBondContact O-N 3.27Å; F296-F299 WeakPolarHBondContact O-CB 3.28Å; F296-F299 PolarHBondContact O-N 3.16Å; F296-A300 PolarHBondContact O-N 3.45Å; F296-W307 AromaticContact CE1-NE1 3.52Å; F296-W307 AromaticContact CE2-CD1 3.51Å; F296-W307 AromaticContact CE2-NE1 3.44Å; F296-W307 AromaticContact CZ-CD1 3.6Å; F296-W307 AromaticContact CZ-CE2 3.97Å; F296-W307 AromaticContact CZ-NE1 2.98Å; F296-L310 HydrophobicContact CD2-CD2 4.32Å; F296-L310 HydrophobicContact CE2-CD2 3.91Å; F296-I311 HydrophobicContact CE2-CD1 4.38Å; F296-I311 HydrophobicContact CZ-CD1 3.76Å; F296-I311 HydrophobicContact CZ-CG1 4.46Å
297	G	86.7	Confident	92.1	Very high	23 Å²	23	55.7 Å²	55.7	24%	0.237	30%	0.303	C	S	.	.	H	α-helix	trans	-62.4	-39.4	175.7	0	0	0	0	0	112.5	W295 A300	W295-G297 PolarHBondContact O-N 2.81Å; G297-A300 WeakPolarHBondContact O-CB 3.1Å; G297-A300 PolarHBondContact O-N 2.93Å
298	G	86.8	Confident	92.3	Very high	2 Å²	2	53.5 Å²	53.5	2%	0.021	30%	0.299	C	S	.	.	H	α-helix	trans	-67.4	-37.7	175.7	0	0	0	0	0	112.6	W295 F296 A300 E301 Y302	W295-G298 VanDerWaalsContact CZ3-CA 3.5Å; W295-G298 PolarHBondContact O-N 2.99Å; F296-G298 VanDerWaalsContact C-N 3.32Å; F296-G298 PolarHBondContact O-N 3.27Å; G298-A300 PolarHBondContact O-N 3.42Å; G298-E301 WeakPolarHBondContact O-CA 2.8Å; G298-E301 WeakPolarHBondContact O-CB 3.44Å; G298-E301 PolarHBondContact O-N 3.04Å; G298-Y302 VanDerWaalsContact C-CD1 3.45Å; G298-Y302 VanDerWaalsContact C-CE1 3.46Å; G298-Y302 WeakPolarHBondContact O-CD1 2.9Å; G298-Y302 WeakPolarHBondContact O-CE1 3.48Å; G298-Y302 PolarHBondContact O-N 2.88Å; G298-Y302 VanDerWaalsContact O-N 3.1Å
299	F	90.2	Very high	92.3	Very high	22 Å²	22	52.6 Å²	52.6	10%	0.096	30%	0.297	C	S	.	.	H	α-helix	trans	-56.2	-39.6	175	-174.3	-122.4	0	0	0	112.2	L163 W295 F296 E301 Y302 D303 W307 L310	L163-F299 HydrophobicContact CD1-CD1 4.28Å; L163-F299 HydrophobicContact CD1-CD2 4.32Å; L163-F299 HydrophobicContact CD1-CE1 4.27Å; L163-F299 HydrophobicContact CD1-CE2 4.32Å; L163-F299 HydrophobicContact CD1-CG 4.31Å; L163-F299 HydrophobicContact CD1-CZ 4.3Å; L163-F299 HydrophobicContact CD2-CB 3.75Å; L163-F299 HydrophobicContact CD2-CD1 4.12Å; L163-F299 HydrophobicContact CD2-CD2 4.4Å; L163-F299 HydrophobicContact CD2-CG 3.85Å; W295-F299 PolarHBondContact O-N 2.94Å; F296-F299 WeakPolarHBondContact O-CB 3.28Å; F296-F299 PolarHBondContact O-N 3.16Å; F299-E301 PolarHBondContact O-N 2.95Å; F299-Y302 HydrophobicContact CB-CE1 4.21Å; F299-Y302 HydrophobicContact CD2-CD2 4.36Å; F299-Y302 HydrophobicContact CD2-CE1 4.4Å; F299-Y302 AromaticContact CD2-CE2 3.48Å; F299-Y302 HydrophobicContact CD2-CE2 3.48Å; F299-Y302 VanDerWaalsContact CD2-CE2 3.48Å; F299-Y302 AromaticContact CD2-CZ 3.5Å; F299-Y302 VanDerWaalsContact CD2-CZ 3.5Å; F299-Y302 VanDerWaalsContact CD2-OH 3.3Å; F299-Y302 WeakPolarHBondContact CD2-OH 3.16Å; F299-Y302 HydrophobicContact CE2-CE2 4.06Å; F299-D303 HydrophobicContact CD2-CB 4.14Å; F299-D303 HydrophobicContact CE2-CB 3.77Å; F299-D303 HydrophobicContact CZ-CB 4.36Å; F299-D303 CarbonylContact O-C 3.45Å; F299-D303 WeakPolarHBondContact O-CA 3.39Å; F299-D303 PolarHBondContact O-N 3.37Å; F299-W307 HydrophobicContact CD1-CB 3.92Å; F299-W307 HydrophobicContact CD1-CG 4.49Å; F299-W307 HydrophobicContact CE1-CB 4.09Å; F299-L310 HydrophobicContact CD1-CD2 4.22Å; F299-L310 HydrophobicContact CE1-CB 4.47Å; F299-L310 HydrophobicContact CE1-CD2 4.01Å
300	A	88.2	Confident	92.3	Very high	16 Å²	16	52.4 Å²	52.4	13%	0.132	30%	0.295	C	S	.	.	H	α-helix	trans	-62.6	-26.2	174	0	0	0	0	0	113.7	T122 F296 G297 G298 W307	T122-A300 HydrophobicContact CG2-CB 3.98Å; F296-A300 PolarHBondContact O-N 3.45Å; G297-A300 WeakPolarHBondContact O-CB 3.1Å; G297-A300 PolarHBondContact O-N 2.93Å; G298-A300 PolarHBondContact O-N 3.42Å; A300-W307 HydrophobicContact CB-CB 4.3Å; A300-W307 HydrophobicContact CB-CD2 3.9Å; A300-W307 HydrophobicContact CB-CG 3.66Å
301	E	87.1	Confident	92.3	Very high	98 Å²	98	49.8 Å²	49.8	46%	0.458	28%	0.277	S	S	.	.	H	α-helix	trans	-83.3	-45.5	179.4	-58.1	-165.8	164.5	0	0	112.6	K123 G298 F299	K123-E301 WeakPolarHBondContact CE-OE1 3.33Å; K123-E301 IonicContact NZ-OE1 2.75Å; K123-E301 PolarHBondContact NZ-OE1 2.84Å; K123-E301 IonicContact NZ-OE2 2.76Å; G298-E301 WeakPolarHBondContact O-CA 2.8Å; G298-E301 WeakPolarHBondContact O-CB 3.44Å; G298-E301 PolarHBondContact O-N 3.04Å; F299-E301 PolarHBondContact O-N 2.95Å
302	Y	90.4	Very high	92.3	Very high	156 Å²	156	51.6 Å²	51.6	61%	0.612	28%	0.284	S	S	*	.	H	α-helix	trans	-90.2	-22.7	-175.5	67.5	-104.9	0	0	0	114.2	G298 F299	G298-Y302 VanDerWaalsContact C-CD1 3.45Å; G298-Y302 VanDerWaalsContact C-CE1 3.46Å; G298-Y302 WeakPolarHBondContact O-CD1 2.9Å; G298-Y302 WeakPolarHBondContact O-CE1 3.48Å; G298-Y302 PolarHBondContact O-N 2.88Å; G298-Y302 VanDerWaalsContact O-N 3.1Å; F299-Y302 HydrophobicContact CB-CE1 4.21Å; F299-Y302 HydrophobicContact CD2-CD2 4.36Å; F299-Y302 HydrophobicContact CD2-CE1 4.4Å; F299-Y302 AromaticContact CD2-CE2 3.48Å; F299-Y302 HydrophobicContact CD2-CE2 3.48Å; F299-Y302 VanDerWaalsContact CD2-CE2 3.48Å; F299-Y302 AromaticContact CD2-CZ 3.5Å; F299-Y302 VanDerWaalsContact CD2-CZ 3.5Å; F299-Y302 VanDerWaalsContact CD2-OH 3.3Å; F299-Y302 WeakPolarHBondContact CD2-OH 3.16Å; F299-Y302 HydrophobicContact CE2-CE2 4.06Å
303	D	93.3	Very high	92.4	Very high	62 Å²	62	53.4 Å²	53.4	33%	0.332	29%	0.291	S	S	.	.			trans	-139.5	73.1	174	-175.4	10.1	0	0	0	111.3	F299 A305 G306 W307	F299-D303 HydrophobicContact CD2-CB 4.14Å; F299-D303 HydrophobicContact CE2-CB 3.77Å; F299-D303 HydrophobicContact CZ-CB 4.36Å; F299-D303 CarbonylContact O-C 3.45Å; F299-D303 WeakPolarHBondContact O-CA 3.39Å; F299-D303 PolarHBondContact O-N 3.37Å; D303-A305 PolarHBondContact O-N 3.23Å; D303-G306 PolarHBondContact O-N 3.42Å; D303-G306 PolarHBondContact OD1-N 2.7Å; D303-G306 WeakPolarHBondContact OD2-CA 3.37Å; D303-W307 WeakPolarHBondContact O-CB 2.84Å; D303-W307 PolarHBondContact O-N 2.87Å
304	P	91	Very high	92.5	Very high	84 Å²	84	50.5 Å²	50.5	55%	0.545	26%	0.261	S	S	.	.	H	α-helix	trans	-62.4	-30.2	-178.3	24.1	-34.1	0	0	0	113.1	G308	P304-G308 PolarHBondContact O-N 3.26Å
305	A	93.2	Very high	92.7	Very high	64 Å²	64	50.2 Å²	50.2	53%	0.529	26%	0.259	S	S	.	.	H	α-helix	trans	-71.8	-47.7	178	0	0	0	0	0	111.1	D303 W307 G308 M309	D303-A305 PolarHBondContact O-N 3.23Å; A305-W307 VanDerWaalsContact C-N 3.29Å; A305-W307 PolarHBondContact O-N 3.19Å; A305-G308 PolarHBondContact O-N 3.34Å; A305-M309 WeakPolarHBondContact O-CG 3.49Å; A305-M309 PolarHBondContact O-N 3.03Å
306	G	94.2	Very high	93	Very high	9 Å²	9	49.8 Å²	49.8	9%	0.093	26%	0.261	C	S	.	.	H	α-helix	trans	-59.8	-39.4	173.7	0	0	0	0	0	112.6	D303 M309 L310	D303-G306 PolarHBondContact O-N 3.42Å; D303-G306 PolarHBondContact OD1-N 2.7Å; D303-G306 WeakPolarHBondContact OD2-CA 3.37Å; G306-M309 PolarHBondContact O-N 3.47Å; G306-L310 VanDerWaalsContact O-CB 3.32Å; G306-L310 WeakPolarHBondContact O-CB 3.44Å; G306-L310 PolarHBondContact O-N 3.31Å
307	W	93.7	Very high	93.3	Very high	8 Å²	8	49.7 Å²	49.7	3%	0.03	26%	0.261	C	S	.	.	H	α-helix	trans	-62.2	-43.9	174.5	178.2	88.2	0	0	0	112.6	L120 N138 F140 F296 F299 A300 D303 A305 L310 I311	L120-W307 HydrophobicContact CB-CH2 3.77Å; L120-W307 HydrophobicContact CB-CZ2 3.6Å; L120-W307 HydrophobicContact CD1-CH2 4.38Å; L120-W307 HydrophobicContact CD1-CZ2 4.28Å; L120-W307 HydrophobicContact CD2-CH2 4.44Å; L120-W307 HydrophobicContact CD2-CZ2 3.58Å; L120-W307 HydrophobicContact CG-CH2 4.44Å; L120-W307 HydrophobicContact CG-CZ2 4.03Å; N138-W307 HydrophobicContact CB-CH2 4.05Å; N138-W307 HydrophobicContact CB-CZ3 4.29Å; F140-W307 AromaticContact CE2-CH2 3.79Å; F140-W307 HydrophobicContact CE2-CH2 3.79Å; F140-W307 AromaticContact CE2-CZ3 3.85Å; F140-W307 HydrophobicContact CE2-CZ3 3.85Å; F140-W307 HydrophobicContact CZ-CE3 4.24Å; F140-W307 HydrophobicContact CZ-CH2 4.05Å; F140-W307 AromaticContact CZ-CZ3 3.64Å; F140-W307 HydrophobicContact CZ-CZ3 3.64Å; F296-W307 AromaticContact CE1-NE1 3.52Å; F296-W307 AromaticContact CE2-CD1 3.51Å; F296-W307 AromaticContact CE2-NE1 3.44Å; F296-W307 AromaticContact CZ-CD1 3.6Å; F296-W307 AromaticContact CZ-CE2 3.97Å; F296-W307 AromaticContact CZ-NE1 2.98Å; F299-W307 HydrophobicContact CD1-CB 3.92Å; F299-W307 HydrophobicContact CD1-CG 4.49Å; F299-W307 HydrophobicContact CE1-CB 4.09Å; A300-W307 HydrophobicContact CB-CB 4.3Å; A300-W307 HydrophobicContact CB-CD2 3.9Å; A300-W307 HydrophobicContact CB-CG 3.66Å; D303-W307 WeakPolarHBondContact O-CB 2.84Å; D303-W307 PolarHBondContact O-N 2.87Å; A305-W307 VanDerWaalsContact C-N 3.29Å; A305-W307 PolarHBondContact O-N 3.19Å; W307-L310 WeakPolarHBondContact O-CB 3.14Å; W307-L310 PolarHBondContact O-N 2.85Å; W307-I311 HydrophobicContact CZ2-CG1 4.34Å; W307-I311 PolarHBondContact O-N 2.81Å; W307-I311 VanDerWaalsContact O-N 3.15Å
308	G	94.1	Very high	93.8	Very high	14 Å²	14	50 Å²	50	14%	0.144	26%	0.256	C	S	.	.	H	α-helix	trans	-60.7	-48.9	175.3	0	0	0	0	0	112.5	F140 P304 A305 L310 I311 E312	F140-G308 WeakPolarHBondContact CE1-O 3.24Å; P304-G308 PolarHBondContact O-N 3.26Å; A305-G308 PolarHBondContact O-N 3.34Å; G308-L310 VanDerWaalsContact C-N 3.26Å; G308-L310 PolarHBondContact O-N 3.35Å; G308-I311 PolarHBondContact O-N 3.13Å; G308-E312 PolarHBondContact O-N 3.14Å; G308-E312 VanDerWaalsContact O-N 3.12Å
309	M	95.4	Very high	94.2	Very high	125 Å²	125	53.4 Å²	53.4	62%	0.616	27%	0.274	S	S	*	.	H	α-helix	trans	-61	-35.6	176.9	-69.6	-173.3	-67.1	0	0	112.5	A305 G306 K313	A305-M309 WeakPolarHBondContact O-CG 3.49Å; A305-M309 PolarHBondContact O-N 3.03Å; G306-M309 PolarHBondContact O-N 3.47Å; M309-K313 VanDerWaalsContact O-CB 3.3Å; M309-K313 WeakPolarHBondContact O-CB 3.45Å; M309-K313 PolarHBondContact O-N 2.87Å
310	L	96.2	Very high	94.4	Very high	12 Å²	12	57 Å²	57	6%	0.063	29%	0.291	C	S	.	.	H	α-helix	trans	-63.4	-45.2	176.7	173.3	57	0	0	0	111.7	Y162 L163 F296 F299 G306 W307 G308 K313 I314	Y162-L310 HydrophobicContact CD1-CD1 3.14Å; Y162-L310 HydrophobicContact CD1-CG 4.49Å; Y162-L310 HydrophobicContact CE1-CD1 3.74Å; Y162-L310 HydrophobicContact CG-CD1 3.68Å; L163-L310 HydrophobicContact CB-CD2 4.47Å; F296-L310 HydrophobicContact CD2-CD2 4.32Å; F296-L310 HydrophobicContact CE2-CD2 3.91Å; F299-L310 HydrophobicContact CD1-CD2 4.22Å; F299-L310 HydrophobicContact CE1-CB 4.47Å; F299-L310 HydrophobicContact CE1-CD2 4.01Å; G306-L310 VanDerWaalsContact O-CB 3.32Å; G306-L310 WeakPolarHBondContact O-CB 3.44Å; G306-L310 PolarHBondContact O-N 3.31Å; W307-L310 WeakPolarHBondContact O-CB 3.14Å; W307-L310 PolarHBondContact O-N 2.85Å; G308-L310 VanDerWaalsContact C-N 3.26Å; G308-L310 PolarHBondContact O-N 3.35Å; L310-K313 WeakPolarHBondContact O-CB 3.41Å; L310-K313 PolarHBondContact O-N 2.99Å; L310-I314 HydrophobicContact CD1-CD1 3.8Å; L310-I314 HydrophobicContact CD1-CG1 4.21Å; L310-I314 HydrophobicContact CG-CD1 3.98Å; L310-I314 WeakPolarHBondContact O-CG1 3.46Å; L310-I314 PolarHBondContact O-N 3.25Å
311	I	96.2	Very high	94.7	Very high	2 Å²	2	64.2 Å²	64.2	1%	0.01	32%	0.322	C	S	.	.	H	α-helix	trans	-64.9	-43.5	177.9	-66.3	-55.2	0	0	0	111.4	L118 L120 F140 P155 F296 W307 G308 K313 I314 L315	L118-I311 HydrophobicContact CD2-CG2 3.84Å; L120-I311 HydrophobicContact CD1-CD1 4.45Å; L120-I311 HydrophobicContact CD1-CG1 4.43Å; L120-I311 HydrophobicContact CD1-CG2 4.48Å; L120-I311 HydrophobicContact CD2-CD1 4.3Å; F140-I311 HydrophobicContact CB-CG2 4.47Å; F140-I311 HydrophobicContact CD1-CB 4.31Å; F140-I311 HydrophobicContact CD1-CG2 3.9Å; F140-I311 HydrophobicContact CD2-CB 4.31Å; F140-I311 HydrophobicContact CD2-CG2 3.51Å; F140-I311 HydrophobicContact CE1-CB 3.89Å; F140-I311 HydrophobicContact CE1-CG2 3.97Å; F140-I311 HydrophobicContact CE2-CB 3.91Å; F140-I311 HydrophobicContact CE2-CG1 4.14Å; F140-I311 HydrophobicContact CE2-CG2 3.6Å; F140-I311 HydrophobicContact CG-CG2 3.68Å; F140-I311 HydrophobicContact CZ-CB 3.68Å; F140-I311 HydrophobicContact CZ-CG1 4.09Å; F140-I311 HydrophobicContact CZ-CG2 3.83Å; P155-I311 HydrophobicContact CB-CD1 3.92Å; F296-I311 HydrophobicContact CE2-CD1 4.38Å; F296-I311 HydrophobicContact CZ-CD1 3.76Å; F296-I311 HydrophobicContact CZ-CG1 4.46Å; W307-I311 HydrophobicContact CZ2-CG1 4.34Å; W307-I311 PolarHBondContact O-N 2.81Å; W307-I311 VanDerWaalsContact O-N 3.15Å; G308-I311 PolarHBondContact O-N 3.13Å; I311-K313 VanDerWaalsContact C-N 3.28Å; I311-K313 PolarHBondContact O-N 3.34Å; I311-I314 HydrophobicContact CD1-CD1 4.45Å; I311-I314 PolarHBondContact O-N 3.2Å; I311-L315 HydrophobicContact CG2-CD1 4.27Å; I311-L315 PolarHBondContact O-N 2.96Å
312	E	96.2	Very high	95.1	Very high	105 Å²	105	65.8 Å²	65.8	49%	0.491	33%	0.325	S	S	.	.	H	α-helix	trans	-60.5	-40.1	175.3	-69.7	-177.1	170.5	0	0	111.7	F140 G308 I314 L315 K316	F140-E312 HydrophobicContact CD1-CG 3.76Å; F140-E312 HydrophobicContact CE1-CG 4.05Å; G308-E312 PolarHBondContact O-N 3.14Å; G308-E312 VanDerWaalsContact O-N 3.12Å; E312-I314 PolarHBondContact O-N 3.21Å; E312-L315 PolarHBondContact O-N 3.42Å; E312-K316 WeakPolarHBondContact O-CB 3.31Å; E312-K316 PolarHBondContact O-N 3.31Å
313	K	96.8	Very high	95.4	Very high	94 Å²	94	58.4 Å²	58.4	41%	0.409	30%	0.296	S	S	.	.	H	α-helix	trans	-62.2	-42.2	175.3	-177.3	169.4	-173.4	168.2	0	112.1	Y162 M309 L310 I311 K316 M317	Y162-K313 HydrophobicContact CE2-CD 4.27Å; Y162-K313 WeakPolarHBondContact OH-CE 2.9Å; Y162-K313 PolarHBondContact OH-NZ 3.32Å; M309-K313 VanDerWaalsContact O-CB 3.3Å; M309-K313 WeakPolarHBondContact O-CB 3.45Å; M309-K313 PolarHBondContact O-N 2.87Å; L310-K313 WeakPolarHBondContact O-CB 3.41Å; L310-K313 PolarHBondContact O-N 2.99Å; I311-K313 VanDerWaalsContact C-N 3.28Å; I311-K313 PolarHBondContact O-N 3.34Å; K313-K316 PolarHBondContact O-N 3.03Å; K313-M317 HydrophobicContact CD-CE 4.03Å; K313-M317 HydrophobicContact CG-CE 3.74Å; K313-M317 HydrophobicContact CG-SD 4.49Å; K313-M317 WeakPolarHBondContact O-CG 3.44Å; K313-M317 PolarHBondContact O-N 3.42Å
314	I	97.6	Very high	95.4	Very high	1 Å²	1	59.3 Å²	59.3	1%	0.005	31%	0.307	C	S	.	.	H	α-helix	trans	-68	-43.6	178.2	-69.3	161.9	0	0	0	111	L154 Y158 G159 L310 I311 E312 K316 M317 Q318 I323	L154-I314 HydrophobicContact CB-CG2 3.81Å; L154-I314 HydrophobicContact CD1-CG2 4.3Å; L154-I314 HydrophobicContact CD2-CG2 4.19Å; L154-I314 HydrophobicContact CG-CG2 4.32Å; Y158-I314 HydrophobicContact CG-CG2 4.37Å; G159-I314 VanDerWaalsContact CA-CD1 3.49Å; L310-I314 HydrophobicContact CD1-CD1 3.8Å; L310-I314 HydrophobicContact CD1-CG1 4.21Å; L310-I314 HydrophobicContact CG-CD1 3.98Å; L310-I314 WeakPolarHBondContact O-CG1 3.46Å; L310-I314 PolarHBondContact O-N 3.25Å; I311-I314 HydrophobicContact CD1-CD1 4.45Å; I311-I314 PolarHBondContact O-N 3.2Å; E312-I314 PolarHBondContact O-N 3.21Å; I314-K316 VanDerWaalsContact C-N 3.26Å; I314-K316 PolarHBondContact O-N 3.42Å; I314-M317 PolarHBondContact O-N 3.15Å; I314-Q318 PolarHBondContact O-N 2.86Å; I314-I323 HydrophobicContact CG2-CD1 4.04Å
315	L	97.1	Very high	95.6	Very high	11 Å²	11	56.1 Å²	56.1	6%	0.058	29%	0.286	C	S	.	.	H	α-helix	trans	-58.2	-42.6	174.1	-79.2	172.6	0	0	0	111.1	L118 F140 L142 I146 L154 I311 E312 Q318 D319	L118-L315 HydrophobicContact CD2-CD1 4.02Å; L118-L315 HydrophobicContact CD2-CD2 4.03Å; L118-L315 HydrophobicContact CD2-CG 4.16Å; F140-L315 HydrophobicContact CB-CD1 3.84Å; L142-L315 HydrophobicContact CD1-CD2 4.34Å; I146-L315 HydrophobicContact CD1-CD2 4.2Å; L154-L315 HydrophobicContact CD1-CD2 4Å; I311-L315 HydrophobicContact CG2-CD1 4.27Å; I311-L315 PolarHBondContact O-N 2.96Å; E312-L315 PolarHBondContact O-N 3.42Å; L315-Q318 PolarHBondContact O-N 2.8Å; L315-D319 WeakPolarHBondContact O-CB 3.23Å; L315-D319 PolarHBondContact O-N 2.89Å
316	K	97	Very high	95.4	Very high	119 Å²	119	56.4 Å²	56.4	52%	0.517	28%	0.278	S	S	.	.	H	α-helix	trans	-63.8	-43.9	175.7	-176.2	176.5	176	-179.2	0	112.4	E312 K313 I314 Q318 D319 E320	E312-K316 WeakPolarHBondContact O-CB 3.31Å; E312-K316 PolarHBondContact O-N 3.31Å; K313-K316 PolarHBondContact O-N 3.03Å; I314-K316 VanDerWaalsContact C-N 3.26Å; I314-K316 PolarHBondContact O-N 3.42Å; K316-Q318 VanDerWaalsContact C-N 3.27Å; K316-Q318 PolarHBondContact O-N 2.9Å; K316-D319 PolarHBondContact O-N 3.18Å; K316-E320 WeakPolarHBondContact CE-OE1 3.24Å; K316-E320 WeakPolarHBondContact CE-OE2 3.47Å; K316-E320 HydrophobicContact CG-CG 4.38Å; K316-E320 IonicContact NZ-OE1 3.79Å; K316-E320 WeakPolarHBondContact O-CB 3.27Å; K316-E320 WeakPolarHBondContact O-CG 3.35Å; K316-E320 PolarHBondContact O-N 2.75Å
317	M	97.4	Very high	95.1	Very high	17 Å²	17	57.4 Å²	57.4	8%	0.084	28%	0.283	C	S	.	.	H	α-helix	trans	-59.1	-39.6	175	-73.7	169.6	179.6	0	0	112.2	Y162 L192 V196 K313 I314 E321 Y322 I323	Y162-M317 HydrophobicContact CD2-CE 4.15Å; Y162-M317 HydrophobicContact CE2-CE 3.75Å; L192-M317 HydrophobicContact CD2-SD 4.21Å; V196-M317 HydrophobicContact CG1-CE 4Å; V196-M317 HydrophobicContact CG2-SD 4.34Å; K313-M317 HydrophobicContact CD-CE 4.03Å; K313-M317 HydrophobicContact CG-CE 3.74Å; K313-M317 HydrophobicContact CG-SD 4.49Å; K313-M317 WeakPolarHBondContact O-CG 3.44Å; K313-M317 PolarHBondContact O-N 3.42Å; I314-M317 PolarHBondContact O-N 3.15Å; M317-E321 PolarHBondContact O-N 3.06Å; M317-E321 VanDerWaalsContact O-N 3.16Å; M317-Y322 PolarHBondContact O-N 2.83Å; M317-I323 HydrophobicContact CB-CD1 3.96Å; M317-I323 HydrophobicContact CB-CG1 3.98Å; M317-I323 HydrophobicContact CB-CG2 4.4Å
318	Q	97.2	Very high	94.6	Very high	28 Å²	28	58.2 Å²	58.2	13%	0.131	29%	0.294	C	S	.	.	H	α-helix	trans	-66.7	-44	175.6	178.7	61	46.9	0	0	111.7	I146 T150 L154 I314 L315 K316 E320 E321 I323 P325	I146-Q318 HydrophobicContact CD1-CB 3.86Å; I146-Q318 HydrophobicContact CD1-CG 3.64Å; I146-Q318 HydrophobicContact CG1-CG 3.92Å; I146-Q318 HydrophobicContact CG2-CG 3.86Å; T150-Q318 HydrophobicContact CG2-CG 4.25Å; L154-Q318 HydrophobicContact CD1-CB 3.87Å; L154-Q318 HydrophobicContact CD1-CG 4.06Å; L154-Q318 HydrophobicContact CD2-CB 4.42Å; I314-Q318 PolarHBondContact O-N 2.86Å; L315-Q318 PolarHBondContact O-N 2.8Å; K316-Q318 VanDerWaalsContact C-N 3.27Å; K316-Q318 PolarHBondContact O-N 2.9Å; Q318-E320 VanDerWaalsContact C-N 3.28Å; Q318-E320 PolarHBondContact O-N 3.33Å; Q318-E321 PolarHBondContact O-N 2.96Å; Q318-E321 VanDerWaalsContact O-N 3.09Å; Q318-I323 HydrophobicContact CB-CD1 4.1Å; Q318-I323 HydrophobicContact CB-CG1 4.09Å; Q318-I323 PolarHBondContact OE1-O 3Å; Q318-P325 VanDerWaalsContact OE1-CG 3.31Å
319	D	95.2	Very high	94.1	Very high	75 Å²	75	57.7 Å²	57.7	40%	0.401	29%	0.289	S	S	.	.	H	α-helix	trans	-62.6	-37	179.2	-168.6	41.7	0	0	0	112.1	S145 I146 L315 K316 E321	S145-D319 VanDerWaalsContact CB-OD1 3.27Å; S145-D319 WeakPolarHBondContact CB-OD1 3.12Å; S145-D319 PolarHBondContact OG-OD1 3.5Å; I146-D319 HydrophobicContact CD1-CB 4.2Å; L315-D319 WeakPolarHBondContact O-CB 3.23Å; L315-D319 PolarHBondContact O-N 2.89Å; K316-D319 PolarHBondContact O-N 3.18Å; D319-E321 VanDerWaalsContact C-N 3.28Å
320	E	95.5	Very high	93.7	Very high	97 Å²	97	58.5 Å²	58.5	45%	0.453	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	8	175.6	-65.4	175.9	162.9	0	0	113.1	K316 Q318 Y322	K316-E320 WeakPolarHBondContact CE-OE1 3.24Å; K316-E320 WeakPolarHBondContact CE-OE2 3.47Å; K316-E320 HydrophobicContact CG-CG 4.38Å; K316-E320 IonicContact NZ-OE1 3.79Å; K316-E320 WeakPolarHBondContact O-CB 3.27Å; K316-E320 WeakPolarHBondContact O-CG 3.35Å; K316-E320 PolarHBondContact O-N 2.75Å; Q318-E320 VanDerWaalsContact C-N 3.28Å; Q318-E320 PolarHBondContact O-N 3.33Å; E320-Y322 HydrophobicContact CB-CD2 3.59Å; E320-Y322 HydrophobicContact CB-CE2 3.64Å; E320-Y322 HydrophobicContact CG-CE2 4.49Å; E320-Y322 PolarHBondContact O-N 2.82Å; E320-Y322 WeakPolarHBondContact OE2-CE2 3.45Å
321	E	94.7	Very high	93.3	Very high	168 Å²	168	58.9 Å²	58.9	79%	0.785	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.2	24.7	176.4	-56	-177.1	166.9	0	0	115.4	M317 Q318 D319 I323	M317-E321 PolarHBondContact O-N 3.06Å; M317-E321 VanDerWaalsContact O-N 3.16Å; Q318-E321 PolarHBondContact O-N 2.96Å; Q318-E321 VanDerWaalsContact O-N 3.09Å; D319-E321 VanDerWaalsContact C-N 3.28Å; E321-I323 VanDerWaalsContact C-N 3.28Å; E321-I323 PolarHBondContact O-N 3.36Å
322	Y	95.4	Very high	92.7	Very high	130 Å²	130	62.8 Å²	62.8	51%	0.51	30%	0.303	S	S	.	.			trans	-74	-18.1	174.2	-75.3	-69.4	0	0	0	113.9	N195 M317 E320	N195-Y322 WeakPolarHBondContact CB-O 3.41Å; M317-Y322 PolarHBondContact O-N 2.83Å; E320-Y322 HydrophobicContact CB-CD2 3.59Å; E320-Y322 HydrophobicContact CB-CE2 3.64Å; E320-Y322 HydrophobicContact CG-CE2 4.49Å; E320-Y322 PolarHBondContact O-N 2.82Å; E320-Y322 WeakPolarHBondContact OE2-CE2 3.45Å
323	I	96.7	Very high	92	Very high	1 Å²	1	58 Å²	58	1%	0.005	28%	0.28	C	S	.	.			trans	-132.9	151.9	-177.7	56.4	171.6	0	0	0	110.8	L154 Y158 D191 L192 V196 I314 M317 Q318 E321	L154-I323 HydrophobicContact CD2-CD1 3.83Å; Y158-I323 HydrophobicContact CD1-CB 4.25Å; Y158-I323 HydrophobicContact CD1-CD1 3.62Å; Y158-I323 HydrophobicContact CD1-CG2 4.12Å; Y158-I323 HydrophobicContact CE1-CB 3.56Å; Y158-I323 HydrophobicContact CE1-CD1 3.73Å; Y158-I323 HydrophobicContact CE1-CG1 4.19Å; Y158-I323 HydrophobicContact CE1-CG2 3.69Å; Y158-I323 HydrophobicContact CG-CD1 4.21Å; D191-I323 WeakPolarHBondContact OD2-CA 3.28Å; D191-I323 WeakPolarHBondContact OD2-CB 3.27Å; L192-I323 HydrophobicContact CD2-CG2 3.72Å; L192-I323 HydrophobicContact CG-CG2 4.47Å; V196-I323 HydrophobicContact CG2-CG2 4.21Å; I314-I323 HydrophobicContact CG2-CD1 4.04Å; M317-I323 HydrophobicContact CB-CD1 3.96Å; M317-I323 HydrophobicContact CB-CG1 3.98Å; M317-I323 HydrophobicContact CB-CG2 4.4Å; Q318-I323 HydrophobicContact CB-CD1 4.1Å; Q318-I323 HydrophobicContact CB-CG1 4.09Å; Q318-I323 PolarHBondContact OE1-O 3Å; E321-I323 VanDerWaalsContact C-N 3.28Å; E321-I323 PolarHBondContact O-N 3.36Å
324	S	93.3	Very high	90.6	Very high	81 Å²	81	57.3 Å²	57.3	57%	0.566	28%	0.279	S	S	*	.			trans	-134.3	73.9	-171.8	-68.7	0	0	0	0	111.5	D191	D191-S324 PolarHBondContact OD2-N 3.31Å
325	P	93.7	Very high	88.7	Confident	17 Å²	17	61.3 Å²	61.3	11%	0.11	30%	0.298	C	S	.	.			trans	-61.5	138	179.1	27.6	-37.3	0	0	0	111.4	T150 C153 L154 Y158 Q318	T150-P325 HydrophobicContact CG2-CG 3.59Å; C153-P325 HydrophobicContact CB-CB 3.68Å; L154-P325 HydrophobicContact CD2-CB 4.1Å; L154-P325 HydrophobicContact CD2-CG 3.83Å; Y158-P325 HydrophobicContact CE2-CB 3.7Å; Y158-P325 VanDerWaalsContact OH-CA 3.26Å; Y158-P325 WeakPolarHBondContact OH-CA 3.46Å; Y158-P325 VanDerWaalsContact OH-N 3.15Å; Q318-P325 VanDerWaalsContact OE1-CG 3.31Å
326	L	90.2	Very high	85.6	Confident	70 Å²	70	64.9 Å²	64.9	37%	0.366	32%	0.32	S	S	.	.			trans	-100.3	121.2	177.2	-68.7	-178.5	0	0	0	112.2	L187 F217 G328 G368 K369	L187-L326 HydrophobicContact CD1-CD1 4.09Å; F217-L326 HydrophobicContact CE2-CD1 4.49Å; F217-L326 HydrophobicContact CZ-CD1 3.67Å; L326-G328 PolarHBondContact O-N 3.12Å; L326-G368 WeakPolarHBondContact O-CA 3.11Å; L326-K369 PolarHBondContact O-N 3.37Å
327	V	87	Confident	82.5	Confident	30 Å²	30	60.6 Å²	60.6	18%	0.182	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	105.3	166	-174.6	0	0	0	0	108.6	E149 R330 I371	E149-V327 HydrophobicContact CB-CG2 4.34Å; V327-R330 HydrophobicContact CG1-CG 4.02Å; V327-I371 HydrophobicContact CB-CD1 4.32Å; V327-I371 HydrophobicContact CG1-CD1 3.65Å; V327-I371 HydrophobicContact CG1-CG1 4.17Å; V327-I371 HydrophobicContact CG2-CD1 3.79Å
328	G	83	Confident	79.1	Confident	25 Å²	25	68.4 Å²	68.4	26%	0.258	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	-43.8	-177.7	0	0	0	0	0	114.1	L326 F366 I367 K369	L326-G328 PolarHBondContact O-N 3.12Å; G328-F366 WeakPolarHBondContact O-CD1 3.32Å; G328-I367 WeakPolarHBondContact CA-O 3.33Å; G328-K369 WeakPolarHBondContact CA-O 3.27Å; G328-K369 PolarHBondContact N-O 3.41Å
329	G	83.4	Confident	75.8	Confident	4 Å²	4	71.1 Å²	71.1	4%	0.041	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	139.8	-176.5	0	0	0	0	0	112.2	K369 V370 I371	G329-K369 PolarHBondContact N-O 3.34Å; G329-V370 WeakPolarHBondContact O-CA 3.49Å; G329-I371 PolarHBondContact O-N 2.91Å
330	R	87.8	Confident	72.6	Confident	142 Å²	142	74.5 Å²	74.5	54%	0.536	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	128.2	177.3	-67.4	174.7	177.5	76.2	7.4	110	E149 V327	E149-R330 IonicContact OE1-NE 3.24Å; E149-R330 PolarHBondContact OE1-NE 2.98Å; E149-R330 IonicContact OE2-CZ 2.77Å; E149-R330 IonicContact OE2-NE 2.69Å; E149-R330 PolarHBondContact OE2-NE 2.9Å; E149-R330 IonicContact OE2-NH2 3.45Å; E149-R330 PolarHBondContact OE2-NH2 2.87Å; V327-R330 HydrophobicContact CG1-CG 4.02Å
331	F	87.2	Confident	69.3	Low	20 Å²	20	75.8 Å²	75.8	9%	0.088	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	131	177	-66.6	-86.3	0	0	0	108.1	Q353 E356 A357 F366 V370 I371 L372 T373	F331-Q353 VanDerWaalsContact C-OE1 3.29Å; F331-Q353 VanDerWaalsContact CA-OE1 3.29Å; F331-Q353 HydrophobicContact CB-CB 4.15Å; F331-Q353 HydrophobicContact CD1-CB 4.04Å; F331-Q353 HydrophobicContact CD1-CG 4.15Å; F331-E356 HydrophobicContact CE1-CB 4.04Å; F331-E356 HydrophobicContact CE1-CG 3.71Å; F331-E356 HydrophobicContact CZ-CG 4.25Å; F331-A357 HydrophobicContact CB-CB 4.41Å; F331-A357 HydrophobicContact CD1-CB 4.47Å; F331-A357 HydrophobicContact CD2-CB 3.67Å; F331-A357 HydrophobicContact CE2-CB 3.99Å; F331-A357 HydrophobicContact CG-CB 3.93Å; F331-F366 AromaticContact CE2-CE2 3.55Å; F331-F366 HydrophobicContact CE2-CE2 3.55Å; F331-F366 AromaticContact CE2-CZ 3.94Å; F331-F366 HydrophobicContact CE2-CZ 3.94Å; F331-F366 AromaticContact CZ-CE2 3.58Å; F331-F366 HydrophobicContact CZ-CE2 3.58Å; F331-F366 AromaticContact CZ-CZ 3.75Å; F331-F366 HydrophobicContact CZ-CZ 3.75Å; F331-V370 HydrophobicContact CD2-CG1 3.56Å; F331-V370 HydrophobicContact CE2-CG1 3.61Å; F331-I371 PolarHBondContact N-O 3.27Å; F331-L372 HydrophobicContact CB-CD2 3.93Å; F331-L372 CarbonylContact O-C 3.59Å; F331-L372 WeakPolarHBondContact O-CA 3.33Å; F331-T373 PolarHBondContact O-N 2.91Å; F331-T373 PolarHBondContact O-OG1 2.95Å
332	K	85.4	Confident	66.2	Low	83 Å²	83	75 Å²	75	36%	0.361	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	133	169.7	-58.9	-167.6	-170.7	176.2	0	109.9	E334 Q335 Q353 T373	K332-E334 PolarHBondContact O-N 3.17Å; K332-Q335 HydrophobicContact CB-CB 4.16Å; K332-Q335 HydrophobicContact CB-CG 4Å; K332-Q335 HydrophobicContact CD-CG 4.14Å; K332-Q335 PolarHBondContact O-N 3.03Å; K332-Q353 PolarHBondContact O-OE1 3.3Å; K332-Q353 VanDerWaalsContact O-OE1 3.13Å; K332-T373 CarbonylContact C-O 3.6Å; K332-T373 WeakPolarHBondContact CA-O 3.31Å
333	L	79.7	Confident	63.1	Low	4 Å²	4	73.5 Å²	73.5	2%	0.021	40%	0.401	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-35	176.6	-169	71.4	0	0	0	111.7	V37 I48 F128 T130 L372 T373 V374	V37-L333 HydrophobicContact CG2-CD1 3.65Å; I48-L333 WeakPolarHBondContact CD1-O 3.37Å; F128-L333 HydrophobicContact CB-CD1 4.47Å; T130-L333 HydrophobicContact CG2-CD2 3.87Å; L333-L372 HydrophobicContact CD1-CD1 3.91Å; L333-T373 PolarHBondContact N-O 3.46Å; L333-V374 HydrophobicContact CB-CG2 3.98Å; L333-V374 HydrophobicContact CD2-CG2 3.82Å
334	E	68.8	Low	60	Low	80 Å²	80	78.3 Å²	78.3	37%	0.374	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-13.7	-171.9	-53.4	-166.5	126.8	0	0	114.9	K35 K332 P375	K35-E334 HydrophobicContact CD-CG 4.36Å; K35-E334 IonicContact NZ-OE1 2.86Å; K35-E334 PolarHBondContact NZ-OE1 3.3Å; K332-E334 PolarHBondContact O-N 3.17Å; E334-P375 HydrophobicContact CG-CG 4.41Å; E334-P375 WeakPolarHBondContact OE2-CG 3.38Å
335	Q	56.3	Low	57.1	Low	86 Å²	86	80.8 Å²	80.8	40%	0.402	45%	0.447	S	S	.	.			trans	-90	123.1	-171.7	-77	-174.3	-36.7	0	0	111.2	K332 S337 Q353	K332-Q335 HydrophobicContact CB-CB 4.16Å; K332-Q335 HydrophobicContact CB-CG 4Å; K332-Q335 HydrophobicContact CD-CG 4.14Å; K332-Q335 PolarHBondContact O-N 3.03Å; Q335-S337 PolarHBondContact O-N 3.25Å; Q335-Q353 VanDerWaalsContact CB-CD 3.42Å; Q335-Q353 HydrophobicContact CB-CG 4.09Å; Q335-Q353 WeakPolarHBondContact O-CB 3.41Å; Q335-Q353 WeakPolarHBondContact O-CG 2.91Å; Q335-Q353 PolarHBondContact O-N 2.84Å
336	V	33.8	Very low	54.1	Low	86 Å²	86	88.9 Å²	88.9	52%	0.521	48%	0.483	S	S	.	.			trans	-84	89	160.5	179.3	0	0	0	0	106	E338 K351	V336-E338 PolarHBondContact O-N 3.41Å; V336-K351 CarbonylContact C-O 3.57Å; V336-K351 WeakPolarHBondContact CA-O 3.22Å; V336-K351 WeakPolarHBondContact CB-O 3.39Å; V336-K351 WeakPolarHBondContact CG1-O 3.47Å
337	S	31.3	Very low	51.2	Low	29 Å²	29	95.9 Å²	95.9	20%	0.203	51%	0.505	C	S	.	.			trans	-74.2	108	-174.2	56	0	0	0	0	111.6	Q335 C339 K351 Q353	Q335-S337 PolarHBondContact O-N 3.25Å; S337-C339 PolarHBondContact O-N 2.95Å; S337-K351 PolarHBondContact N-O 3.17Å; S337-K351 WeakPolarHBondContact O-CB 3.49Å; S337-K351 WeakPolarHBondContact O-CD 3.48Å; S337-K351 WeakPolarHBondContact O-CG 2.97Å; S337-Q353 VanDerWaalsContact OG-CG 3.28Å; S337-Q353 WeakPolarHBondContact OG-CG 3.49Å
338	E	25.8	Very low	48.7	Very low	181 Å²	181	99.3 Å²	99.3	85%	0.846	53%	0.53	S	S	*	.			trans	-67.5	92.2	159.2	-73.3	-176	160.9	0	0	110.6	V336	V336-E338 PolarHBondContact O-N 3.41Å
339	C	26.8	Very low	46.1	Very low	85 Å²	85	102.8 Å²	102.8	57%	0.574	55%	0.55	S	S	*	*			trans	-147.8	109.2	165.7	-104.8	0	0	0	0	115.8	S337 K351	S337-C339 PolarHBondContact O-N 2.95Å; C339-K351 WeakPolarHBondContact O-CE 2.96Å; C339-K351 PolarHBondContact O-NZ 3.25Å
340	I	28.4	Very low	43.5	Very low	146 Å²	146	109.4 Å²	109.4	75%	0.749	58%	0.584	S	S	*	*			trans	45.2	113.3	145.3	-51.5	169.7	0	0	0	119.5
341	T	26.2	Very low	41.3	Very low	123 Å²	123	105.6 Å²	105.6	76%	0.755	57%	0.571	S	S	*	*			trans	-72.8	128.4	166.5	-48.2	0	0	0	0	110.3
342	I	30.3	Very low	39.7	Very low	151 Å²	151	105.6 Å²	105.6	77%	0.774	57%	0.573	S	S	*	*			trans	-111	132.9	146.9	-63.2	176.9	0	0	0	105.9
343	S	30.4	Very low	39.1	Very low	99 Å²	99	102.5 Å²	102.5	69%	0.692	56%	0.56	S	S	*	*	S	Bend	trans	-26.2	149.2	178.1	59	0	0	0	0	116.1
344	S	31.6	Very low	38.8	Very low	103 Å²	103	102.5 Å²	102.5	72%	0.72	56%	0.56	S	S	*	*			cis	-163.8	148.9	14.9	36.2	0	0	0	0	107.5
345	T	32.9	Very low	39.3	Very low	132 Å²	132	100.2 Å²	100.2	81%	0.81	55%	0.55	S	S	*	*	S	Bend	trans	96	87.1	-179.4	62	0	0	0	0	116.5
346	Q	29.7	Very low	40.2	Very low	188 Å²	188	98.1 Å²	98.1	88%	0.879	54%	0.54	S	S	*	.			trans	35.7	85.9	146.9	-68.8	179	-25.3	0	0	118.6
347	W	29.9	Very low	42.2	Very low	217 Å²	217	94 Å²	94	82%	0.822	52%	0.516	S	S	*	.			trans	-143.7	89.7	144.6	-75	95.4	0	0	0	108.4	S349	W347-S349 PolarHBondContact O-N 3.2Å
348	S	33.1	Very low	44.3	Very low	102 Å²	102	93.1 Å²	93.1	71%	0.713	51%	0.508	S	S	*	.			trans	-61.6	121.8	176.7	27.7	0	0	0	0	111.4	K45	K45-S348 PolarHBondContact NZ-O 3.44Å
349	S	29.4	Very low	46.9	Very low	97 Å²	97	89.1 Å²	89.1	68%	0.678	49%	0.488	S	S	*	.	S	Bend	trans	35.7	105.3	147	56.8	0	0	0	0	119.5	W347	W347-S349 PolarHBondContact O-N 3.2Å
350	L	28.6	Very low	49.3	Very low	143 Å²	143	85.1 Å²	85.1	75%	0.749	46%	0.462	S	S	*	.			trans	171	111.4	138.2	-91.7	152.5	0	0	0	106.6
351	K	41.2	Very low	51.5	Low	62 Å²	62	79.5 Å²	79.5	27%	0.27	43%	0.433	S	S	.	.			trans	-106.9	89.4	-159.8	-71.6	178.6	-178.8	141	0	112.5	V336 S337 C339	V336-K351 CarbonylContact C-O 3.57Å; V336-K351 WeakPolarHBondContact CA-O 3.22Å; V336-K351 WeakPolarHBondContact CB-O 3.39Å; V336-K351 WeakPolarHBondContact CG1-O 3.47Å; S337-K351 PolarHBondContact N-O 3.17Å; S337-K351 WeakPolarHBondContact O-CB 3.49Å; S337-K351 WeakPolarHBondContact O-CD 3.48Å; S337-K351 WeakPolarHBondContact O-CG 2.97Å; C339-K351 WeakPolarHBondContact O-CE 2.96Å; C339-K351 PolarHBondContact O-NZ 3.25Å
352	V	54.5	Low	53.8	Low	21 Å²	21	76 Å²	76	13%	0.127	42%	0.416	C	S	.	.			trans	-79	130.2	161.6	-166.1	0	0	0	0	107.8	I48 I354 N355 E356	I48-V352 HydrophobicContact CD1-CG1 3.32Å; I48-V352 HydrophobicContact CG1-CG1 3.66Å; V352-I354 HydrophobicContact CB-CG2 3.9Å; V352-I354 HydrophobicContact CG1-CB 4.45Å; V352-I354 HydrophobicContact CG1-CG2 3.47Å; V352-I354 VanDerWaalsContact CG1-CG2 3.47Å; V352-I354 PolarHBondContact O-N 3.13Å; V352-N355 WeakPolarHBondContact O-CB 3.31Å; V352-N355 PolarHBondContact O-N 3.02Å; V352-E356 PolarHBondContact O-N 2.85Å
353	Q	71.9	Confident	56.2	Low	18 Å²	18	73.4 Å²	73.4	8%	0.084	40%	0.4	C	S	.	.	H	α-helix	trans	-56.6	-24.7	-178.1	-85.4	-173	20	0	0	113.5	F331 K332 Q335 S337 E356 A357	F331-Q353 VanDerWaalsContact C-OE1 3.29Å; F331-Q353 VanDerWaalsContact CA-OE1 3.29Å; F331-Q353 HydrophobicContact CB-CB 4.15Å; F331-Q353 HydrophobicContact CD1-CB 4.04Å; F331-Q353 HydrophobicContact CD1-CG 4.15Å; K332-Q353 PolarHBondContact O-OE1 3.3Å; K332-Q353 VanDerWaalsContact O-OE1 3.13Å; Q335-Q353 VanDerWaalsContact CB-CD 3.42Å; Q335-Q353 HydrophobicContact CB-CG 4.09Å; Q335-Q353 WeakPolarHBondContact O-CB 3.41Å; Q335-Q353 WeakPolarHBondContact O-CG 2.91Å; Q335-Q353 PolarHBondContact O-N 2.84Å; S337-Q353 VanDerWaalsContact OG-CG 3.28Å; S337-Q353 WeakPolarHBondContact OG-CG 3.49Å; Q353-E356 PolarHBondContact O-N 3.46Å; Q353-A357 WeakPolarHBondContact O-CB 3.28Å; Q353-A357 PolarHBondContact O-N 3.05Å
354	I	74.6	Confident	58.3	Low	3 Å²	3	72.5 Å²	72.5	2%	0.015	38%	0.382	C	S	.	.	H	α-helix	trans	-62.6	-42.3	170.3	-172.9	55	0	0	0	113.1	V37 A46 F128 V352 E356 A357 L358 L372	V37-I354 HydrophobicContact CG1-CG1 4.04Å; V37-I354 HydrophobicContact CG1-CG2 4.31Å; V37-I354 HydrophobicContact CG2-CB 4.16Å; V37-I354 HydrophobicContact CG2-CG1 4.06Å; V37-I354 HydrophobicContact CG2-CG2 4.2Å; A46-I354 HydrophobicContact CB-CG2 3.99Å; F128-I354 HydrophobicContact CD2-CD1 3.76Å; F128-I354 HydrophobicContact CD2-CG1 4.44Å; F128-I354 HydrophobicContact CE2-CD1 3.82Å; V352-I354 HydrophobicContact CB-CG2 3.9Å; V352-I354 HydrophobicContact CG1-CB 4.45Å; V352-I354 HydrophobicContact CG1-CG2 3.47Å; V352-I354 VanDerWaalsContact CG1-CG2 3.47Å; V352-I354 PolarHBondContact O-N 3.13Å; I354-E356 VanDerWaalsContact C-N 3.25Å; I354-E356 PolarHBondContact O-N 3.37Å; I354-A357 PolarHBondContact O-N 2.85Å; I354-L358 HydrophobicContact CD1-CD1 4.48Å; I354-L358 HydrophobicContact CD1-CG 4.19Å; I354-L358 HydrophobicContact CG1-CD1 4.13Å; I354-L358 HydrophobicContact CG1-CG 4.31Å; I354-L358 WeakPolarHBondContact O-CB 3.29Å; I354-L358 VanDerWaalsContact O-CG 3.26Å; I354-L358 WeakPolarHBondContact O-CG 3.18Å; I354-L358 PolarHBondContact O-N 3.38Å; I354-L372 HydrophobicContact CD1-CD1 3.59Å; I354-L372 HydrophobicContact CD1-CD2 3.9Å; I354-L372 HydrophobicContact CD1-CG 4.27Å
355	N	77.5	Confident	60.3	Low	32 Å²	32	73.2 Å²	73.2	17%	0.171	37%	0.369	C	S	.	.	H	α-helix	trans	-66.5	-34.7	178.1	-71	-62.7	0	0	0	110	A46 V352 K359	A46-N355 PolarHBondContact N-OD1 2.82Å; A46-N355 PolarHBondContact O-ND2 3.45Å; V352-N355 WeakPolarHBondContact O-CB 3.31Å; V352-N355 PolarHBondContact O-N 3.02Å; N355-K359 WeakPolarHBondContact O-CB 3.41Å; N355-K359 PolarHBondContact O-N 2.86Å
356	E	77.1	Confident	62.3	Low	42 Å²	42	69.8 Å²	69.8	20%	0.196	34%	0.343	C	S	.	.	H	α-helix	trans	-68.1	-43.8	172.6	-170.7	60.6	-159.8	0	0	111.5	F331 V352 Q353 I354 L358 K359 C360 R365	F331-E356 HydrophobicContact CE1-CB 4.04Å; F331-E356 HydrophobicContact CE1-CG 3.71Å; F331-E356 HydrophobicContact CZ-CG 4.25Å; V352-E356 PolarHBondContact O-N 2.85Å; Q353-E356 PolarHBondContact O-N 3.46Å; I354-E356 VanDerWaalsContact C-N 3.25Å; I354-E356 PolarHBondContact O-N 3.37Å; E356-L358 PolarHBondContact O-N 2.86Å; E356-K359 CarbonylContact O-C 3.57Å; E356-K359 WeakPolarHBondContact O-CB 3.49Å; E356-K359 PolarHBondContact O-N 3.07Å; E356-C360 WeakPolarHBondContact O-CB 3.49Å; E356-C360 PolarHBondContact O-N 3.23Å; E356-C360 PolarHBondContact O-SG 2.77Å; E356-R365 IonicContact OE1-CZ 3.11Å; E356-R365 VanDerWaalsContact OE1-CZ 3.26Å; E356-R365 IonicContact OE1-NH1 2.74Å; E356-R365 PolarHBondContact OE1-NH1 2.92Å; E356-R365 IonicContact OE1-NH2 2.75Å; E356-R365 PolarHBondContact OE1-NH2 3.06Å
357	A	74.2	Confident	64.7	Low	0 Å²	0	63.8 Å²	63.8	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-58.8	-47.6	174.8	0	0	0	0	0	112	F331 Q353 I354 K359 C360 I361 V370 L372	F331-A357 HydrophobicContact CB-CB 4.41Å; F331-A357 HydrophobicContact CD1-CB 4.47Å; F331-A357 HydrophobicContact CD2-CB 3.67Å; F331-A357 HydrophobicContact CE2-CB 3.99Å; F331-A357 HydrophobicContact CG-CB 3.93Å; Q353-A357 WeakPolarHBondContact O-CB 3.28Å; Q353-A357 PolarHBondContact O-N 3.05Å; I354-A357 PolarHBondContact O-N 2.85Å; A357-K359 VanDerWaalsContact C-N 3.34Å; A357-K359 PolarHBondContact O-N 3.29Å; A357-C360 PolarHBondContact O-N 2.69Å; A357-I361 PolarHBondContact O-N 2.72Å; A357-I361 VanDerWaalsContact O-N 3.11Å; A357-V370 HydrophobicContact CB-CG1 3.83Å; A357-L372 HydrophobicContact CB-CD2 4.17Å
358	L	76.9	Confident	67.4	Low	10 Å²	10	53.8 Å²	53.8	5%	0.052	28%	0.281	C	S	.	.	H	α-helix	trans	-61.9	-40.9	175.4	-71.6	176	0	0	0	111.6	V71 L76 V79 I354 E356 I361 A362	V71-L358 HydrophobicContact CG1-CD2 4.03Å; L76-L358 HydrophobicContact CB-CD2 4.23Å; L76-L358 HydrophobicContact CD1-CB 4.12Å; L76-L358 HydrophobicContact CD1-CD2 4.35Å; V79-L358 HydrophobicContact CG2-CD1 4.28Å; I354-L358 HydrophobicContact CD1-CD1 4.48Å; I354-L358 HydrophobicContact CD1-CG 4.19Å; I354-L358 HydrophobicContact CG1-CD1 4.13Å; I354-L358 HydrophobicContact CG1-CG 4.31Å; I354-L358 WeakPolarHBondContact O-CB 3.29Å; I354-L358 VanDerWaalsContact O-CG 3.26Å; I354-L358 WeakPolarHBondContact O-CG 3.18Å; I354-L358 PolarHBondContact O-N 3.38Å; E356-L358 PolarHBondContact O-N 2.86Å; L358-I361 PolarHBondContact O-N 2.76Å; L358-A362 PolarHBondContact O-N 2.83Å
359	K	79.5	Confident	70.1	Confident	97 Å²	97	49 Å²	49	42%	0.422	25%	0.247	S	C	.	.	H	α-helix	trans	-65	-43.5	175.6	-178.2	-177.4	174.3	-171.6	0	111.5	N355 E356 A357 I361 A362 E363	N355-K359 WeakPolarHBondContact O-CB 3.41Å; N355-K359 PolarHBondContact O-N 2.86Å; E356-K359 CarbonylContact O-C 3.57Å; E356-K359 WeakPolarHBondContact O-CB 3.49Å; E356-K359 PolarHBondContact O-N 3.07Å; A357-K359 VanDerWaalsContact C-N 3.34Å; A357-K359 PolarHBondContact O-N 3.29Å; K359-I361 VanDerWaalsContact C-N 3.28Å; K359-I361 PolarHBondContact O-N 3.03Å; K359-A362 WeakPolarHBondContact O-CB 3.28Å; K359-A362 PolarHBondContact O-N 3.22Å; K359-A362 VanDerWaalsContact O-N 3.09Å; K359-E363 WeakPolarHBondContact CE-OE1 3.27Å; K359-E363 WeakPolarHBondContact CE-OE2 3.44Å; K359-E363 HydrophobicContact CG-CG 4.28Å; K359-E363 WeakPolarHBondContact CG-OE2 3.26Å; K359-E363 IonicContact NZ-OE1 3.38Å; K359-E363 WeakPolarHBondContact O-CB 3.22Å; K359-E363 WeakPolarHBondContact O-CG 3.24Å; K359-E363 PolarHBondContact O-N 3.24Å
360	C	77.5	Confident	73	Confident	2 Å²	2	44.6 Å²	44.6	1%	0.014	22%	0.216	C	C	.	.	H	α-helix	trans	-62	-36	177.3	-68.1	0	0	0	0	112.6	E356 A357 R364 R365 F366	E356-C360 WeakPolarHBondContact O-CB 3.49Å; E356-C360 PolarHBondContact O-N 3.23Å; E356-C360 PolarHBondContact O-SG 2.77Å; A357-C360 PolarHBondContact O-N 2.69Å; C360-R364 WeakPolarHBondContact O-CA 3.49Å; C360-R364 PolarHBondContact O-N 3.29Å; C360-R365 HydrophobicContact CB-CB 4.44Å; C360-R365 PolarHBondContact O-N 3.13Å; C360-R365 PolarHBondContact SG-NH1 2.88Å; C360-R365 VanDerWaalsContact SG-NH1 3.38Å; C360-R365 PolarHBondContact SG-NH2 2.81Å; C360-F366 HydrophobicContact CB-CD2 3.48Å; C360-F366 VanDerWaalsContact CB-CD2 3.48Å; C360-F366 HydrophobicContact CB-CE2 3.33Å; C360-F366 HydrophobicContact CB-CZ 4.5Å; C360-F366 WeakPolarHBondContact SG-CE2 3.43Å
361	I	74.7	Confident	76	Confident	28 Å²	28	37.8 Å²	37.8	14%	0.144	18%	0.18	C	C	.	.	H	α-helix	trans	-66.2	-45.6	171.6	-69.5	175.3	0	0	0	110.5	V71 L76 A357 L358 K359 E363 R364 V370	V71-I361 HydrophobicContact CB-CD1 3.68Å; V71-I361 HydrophobicContact CG1-CD1 3.26Å; L76-I361 HydrophobicContact CD2-CG2 4.1Å; A357-I361 PolarHBondContact O-N 2.72Å; A357-I361 VanDerWaalsContact O-N 3.11Å; L358-I361 PolarHBondContact O-N 2.76Å; K359-I361 VanDerWaalsContact C-N 3.28Å; K359-I361 PolarHBondContact O-N 3.03Å; I361-E363 VanDerWaalsContact C-N 3.29Å; I361-E363 PolarHBondContact O-N 2.94Å; I361-R364 PolarHBondContact O-N 2.91Å; I361-V370 HydrophobicContact CD1-CB 4.36Å; I361-V370 HydrophobicContact CG1-CB 4.38Å; I361-V370 HydrophobicContact CG1-CG2 4.06Å
362	A	75.1	Confident	78.3	Confident	48 Å²	48	34.9 Å²	34.9	40%	0.397	17%	0.168	S	C	.	.	H	α-helix	trans	-59.7	-40.6	178.4	0	0	0	0	0	112.2	L76 L358 K359	L76-A362 HydrophobicContact CD2-CB 3.62Å; L358-A362 PolarHBondContact O-N 2.83Å; K359-A362 WeakPolarHBondContact O-CB 3.28Å; K359-A362 PolarHBondContact O-N 3.22Å; K359-A362 VanDerWaalsContact O-N 3.09Å
363	E	79.4	Confident	80.1	Confident	97 Å²	97	34.1 Å²	34.1	45%	0.453	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-2.7	-178.1	-66.1	173	162.2	0	0	113.3	K359 I361 R365	K359-E363 WeakPolarHBondContact CE-OE1 3.27Å; K359-E363 WeakPolarHBondContact CE-OE2 3.44Å; K359-E363 HydrophobicContact CG-CG 4.28Å; K359-E363 WeakPolarHBondContact CG-OE2 3.26Å; K359-E363 IonicContact NZ-OE1 3.38Å; K359-E363 WeakPolarHBondContact O-CB 3.22Å; K359-E363 WeakPolarHBondContact O-CG 3.24Å; K359-E363 PolarHBondContact O-N 3.24Å; I361-E363 VanDerWaalsContact C-N 3.29Å; I361-E363 PolarHBondContact O-N 2.94Å; E363-R365 VanDerWaalsContact C-N 3.28Å; E363-R365 HydrophobicContact CB-CG 3.97Å; E363-R365 PolarHBondContact O-N 2.94Å; E363-R365 IonicContact OE2-CZ 2.65Å; E363-R365 IonicContact OE2-NE 3.56Å; E363-R365 PolarHBondContact OE2-NE 2.77Å; E363-R365 IonicContact OE2-NH2 3.43Å; E363-R365 PolarHBondContact OE2-NH2 3.2Å
364	R	75.2	Confident	80.7	Confident	81 Å²	81	33.3 Å²	33.3	31%	0.306	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.8	42	-179.6	-52.6	175.4	-176.2	167.1	1.1	112.9	N181 S272 C360 I361	N181-R364 PolarHBondContact ND2-NH1 2.98Å; N181-R364 VanDerWaalsContact ND2-NH1 3.14Å; S272-R364 VanDerWaalsContact C-NH2 3.34Å; S272-R364 PolarHBondContact O-NH2 2.8Å; S272-R364 PolarHBondContact OG-NH2 2.95Å; C360-R364 WeakPolarHBondContact O-CA 3.49Å; C360-R364 PolarHBondContact O-N 3.29Å; I361-R364 PolarHBondContact O-N 2.91Å
365	R	73.4	Confident	80.7	Confident	118 Å²	118	35.4 Å²	35.4	45%	0.445	17%	0.173	S	C	.	.			trans	-82	-13.3	-174.3	-82.4	-164.7	-76.2	140.1	-7.1	115.5	E356 C360 E363	E356-R365 IonicContact OE1-CZ 3.11Å; E356-R365 VanDerWaalsContact OE1-CZ 3.26Å; E356-R365 IonicContact OE1-NH1 2.74Å; E356-R365 PolarHBondContact OE1-NH1 2.92Å; E356-R365 IonicContact OE1-NH2 2.75Å; E356-R365 PolarHBondContact OE1-NH2 3.06Å; C360-R365 HydrophobicContact CB-CB 4.44Å; C360-R365 PolarHBondContact O-N 3.13Å; C360-R365 PolarHBondContact SG-NH1 2.88Å; C360-R365 VanDerWaalsContact SG-NH1 3.38Å; C360-R365 PolarHBondContact SG-NH2 2.81Å; E363-R365 VanDerWaalsContact C-N 3.28Å; E363-R365 HydrophobicContact CB-CG 3.97Å; E363-R365 PolarHBondContact O-N 2.94Å; E363-R365 IonicContact OE2-CZ 2.65Å; E363-R365 IonicContact OE2-NE 3.56Å; E363-R365 PolarHBondContact OE2-NE 2.77Å; E363-R365 IonicContact OE2-NH2 3.43Å; E363-R365 PolarHBondContact OE2-NH2 3.2Å
366	F	74	Confident	80.4	Confident	60 Å²	60	35.8 Å²	35.8	26%	0.263	17%	0.174	S	C	.	.	S	Bend	trans	-116.8	152.5	-178.6	-68.9	-66.7	0	0	0	112.6	G328 F331 C360 V370	G328-F366 WeakPolarHBondContact O-CD1 3.32Å; F331-F366 AromaticContact CE2-CE2 3.55Å; F331-F366 HydrophobicContact CE2-CE2 3.55Å; F331-F366 AromaticContact CE2-CZ 3.94Å; F331-F366 HydrophobicContact CE2-CZ 3.94Å; F331-F366 AromaticContact CZ-CE2 3.58Å; F331-F366 HydrophobicContact CZ-CE2 3.58Å; F331-F366 AromaticContact CZ-CZ 3.75Å; F331-F366 HydrophobicContact CZ-CZ 3.75Å; C360-F366 HydrophobicContact CB-CD2 3.48Å; C360-F366 VanDerWaalsContact CB-CD2 3.48Å; C360-F366 HydrophobicContact CB-CE2 3.33Å; C360-F366 HydrophobicContact CB-CZ 4.5Å; C360-F366 WeakPolarHBondContact SG-CE2 3.43Å; F366-V370 HydrophobicContact CB-CG2 4.3Å; F366-V370 HydrophobicContact CD2-CG2 3.6Å; F366-V370 HydrophobicContact CE2-CG2 4.29Å; F366-V370 HydrophobicContact CG-CG2 4.28Å
367	I	81.4	Confident	79.4	Confident	61 Å²	61	41.9 Å²	41.9	31%	0.313	21%	0.208	S	C	.	.	S	Bend	trans	-97.3	109.6	173.6	-44.4	-162.9	0	0	0	107	Q182 L187 T213 G328	Q182-I367 HydrophobicContact CB-CG2 4.16Å; Q182-I367 HydrophobicContact CG-CG2 4.47Å; L187-I367 HydrophobicContact CD1-CG2 3.85Å; T213-I367 HydrophobicContact CG2-CD1 3.37Å; G328-I367 WeakPolarHBondContact CA-O 3.33Å
368	G	87	Confident	78.3	Confident	8 Å²	8	45.9 Å²	45.9	8%	0.082	25%	0.249	C	C	.	.	B	Isolated β-bridge	trans	99.1	-152.7	-178.5	0	0	0	0	0	114.8	Q182 L326	Q182-G368 PolarHBondContact O-N 2.89Å; L326-G368 WeakPolarHBondContact O-CA 3.11Å
369	K	89.8	Confident	77.2	Confident	1 Å²	1	49.2 Å²	49.2	0%	0.004	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	139.2	-172.8	-165.5	73.7	170	-161.2	0	111.5	N72 E96 C153 S184 L326 G328 G329 I371	N72-K369 PolarHBondContact OD1-NZ 2.89Å; E96-K369 WeakPolarHBondContact OE1-CE 3.33Å; E96-K369 IonicContact OE1-NZ 3.42Å; E96-K369 PolarHBondContact OE1-NZ 2.77Å; C153-K369 HydrophobicContact CB-CB 4.1Å; C153-K369 HydrophobicContact CB-CG 4.24Å; C153-K369 WeakPolarHBondContact SG-CB 3.27Å; S184-K369 WeakPolarHBondContact OG-CD 3.5Å; L326-K369 PolarHBondContact O-N 3.37Å; G328-K369 WeakPolarHBondContact CA-O 3.27Å; G328-K369 PolarHBondContact N-O 3.41Å; G329-K369 PolarHBondContact N-O 3.34Å; K369-I371 HydrophobicContact CG-CG1 4.11Å
370	V	90	Very high	75.7	Confident	5 Å²	5	50.1 Å²	50.1	3%	0.03	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	130.1	165.7	179.3	0	0	0	0	108.6	V71 G329 F331 A357 I361 F366	V71-V370 HydrophobicContact CB-CB 4.23Å; V71-V370 HydrophobicContact CB-CG1 4.27Å; V71-V370 HydrophobicContact CG2-CG1 4.16Å; V71-V370 PolarHBondContact N-O 3.06Å; G329-V370 WeakPolarHBondContact O-CA 3.49Å; F331-V370 HydrophobicContact CD2-CG1 3.56Å; F331-V370 HydrophobicContact CE2-CG1 3.61Å; A357-V370 HydrophobicContact CB-CG1 3.83Å; I361-V370 HydrophobicContact CD1-CB 4.36Å; I361-V370 HydrophobicContact CG1-CB 4.38Å; I361-V370 HydrophobicContact CG1-CG2 4.06Å; F366-V370 HydrophobicContact CB-CG2 4.3Å; F366-V370 HydrophobicContact CD2-CG2 3.6Å; F366-V370 HydrophobicContact CE2-CG2 4.29Å; F366-V370 HydrophobicContact CG-CG2 4.28Å
371	I	90.4	Very high	73.9	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	135.6	-177.1	-61.1	-179.2	0	0	0	109.9	A69 E149 V327 G329 F331 K369 T373	A69-I371 WeakPolarHBondContact O-CA 3.46Å; E149-I371 HydrophobicContact CB-CD1 3.69Å; E149-I371 HydrophobicContact CG-CD1 4.38Å; E149-I371 WeakPolarHBondContact O-CD1 3.41Å; V327-I371 HydrophobicContact CB-CD1 4.32Å; V327-I371 HydrophobicContact CG1-CD1 3.65Å; V327-I371 HydrophobicContact CG1-CG1 4.17Å; V327-I371 HydrophobicContact CG2-CD1 3.79Å; G329-I371 PolarHBondContact O-N 2.91Å; F331-I371 PolarHBondContact N-O 3.27Å; K369-I371 HydrophobicContact CG-CG1 4.11Å; I371-T373 HydrophobicContact CG2-CG2 4.21Å
372	L	91.2	Very high	73.9	Confident	1 Å²	1	56.7 Å²	56.7	1%	0.005	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	128.5	161.1	-55.6	178	0	0	0	109.2	S68 A69 V71 F128 F331 L333 I354 A357	S68-L372 CarbonylContact C-O 3.5Å; S68-L372 WeakPolarHBondContact CA-O 3.36Å; A69-L372 HydrophobicContact CB-CB 4.36Å; A69-L372 PolarHBondContact N-O 3.15Å; A69-L372 PolarHBondContact O-N 3.47Å; V71-L372 HydrophobicContact CG2-CD1 4.19Å; V71-L372 HydrophobicContact CG2-CD2 4.01Å; V71-L372 HydrophobicContact CG2-CG 3.62Å; F128-L372 HydrophobicContact CB-CD1 3.96Å; F128-L372 HydrophobicContact CD1-CD1 3.37Å; F128-L372 HydrophobicContact CD1-CG 4.46Å; F128-L372 HydrophobicContact CD2-CD1 3.9Å; F128-L372 HydrophobicContact CE1-CD1 3.79Å; F128-L372 HydrophobicContact CE2-CD1 4.27Å; F128-L372 HydrophobicContact CG-CD1 3.45Å; F128-L372 VanDerWaalsContact CG-CD1 3.45Å; F128-L372 HydrophobicContact CZ-CD1 4.24Å; F331-L372 HydrophobicContact CB-CD2 3.93Å; F331-L372 CarbonylContact O-C 3.59Å; F331-L372 WeakPolarHBondContact O-CA 3.33Å; L333-L372 HydrophobicContact CD1-CD1 3.91Å; I354-L372 HydrophobicContact CD1-CD1 3.59Å; I354-L372 HydrophobicContact CD1-CD2 3.9Å; I354-L372 HydrophobicContact CD1-CG 4.27Å; A357-L372 HydrophobicContact CB-CD2 4.17Å
373	T	91.5	Very high	73.8	Confident	5 Å²	5	57.1 Å²	57.1	3%	0.031	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	140	175.9	55	0	0	0	0	109.3	E149 F331 K332 L333 I371	E149-T373 WeakPolarHBondContact OE1-CG2 3.28Å; F331-T373 PolarHBondContact O-N 2.91Å; F331-T373 PolarHBondContact O-OG1 2.95Å; K332-T373 CarbonylContact C-O 3.6Å; K332-T373 WeakPolarHBondContact CA-O 3.31Å; L333-T373 PolarHBondContact N-O 3.46Å; I371-T373 HydrophobicContact CG2-CG2 4.21Å
374	V	85.2	Confident	73.5	Confident	1 Å²	1	54.9 Å²	54.9	1%	0.006	30%	0.303	C	S	.	.			trans	-116.9	108.9	177.5	178.2	0	0	0	0	107.7	V66 R67 T130 L333 H376	V66-V374 HydrophobicContact CB-CG2 4.36Å; V66-V374 HydrophobicContact CG1-CG2 4.06Å; V66-V374 VanDerWaalsContact O-CB 3.23Å; V66-V374 WeakPolarHBondContact O-CB 3.42Å; V66-V374 WeakPolarHBondContact O-CG1 3.23Å; R67-V374 PolarHBondContact O-N 3.21Å; T130-V374 HydrophobicContact CG2-CG1 3.73Å; L333-V374 HydrophobicContact CB-CG2 3.98Å; L333-V374 HydrophobicContact CD2-CG2 3.82Å; V374-H376 PolarHBondContact O-CD2 3.3Å
375	P	73.8	Confident	73.4	Confident	46 Å²	46	53.4 Å²	53.4	30%	0.299	30%	0.303	S	S	.	.			trans	-65.6	139.1	172.7	28.9	-32.1	0	0	0	109.2	E334	E334-P375 HydrophobicContact CG-CG 4.41Å; E334-P375 WeakPolarHBondContact OE2-CG 3.38Å
376	H	70.4	Confident	73.4	Confident	40 Å²	40	49.3 Å²	49.3	19%	0.185	29%	0.294	C	S	.	.	B	Isolated β-bridge	trans	-120.4	133.8	167.5	-74.1	-91.9	0	0	0	108	V66 R67 V374 G378 E379	V66-H376 PolarHBondContact O-NE2 2.84Å; R67-H376 WeakPolarHBondContact CD-CD2 3.46Å; V374-H376 PolarHBondContact O-CD2 3.3Å; H376-G378 PolarHBondContact O-N 2.89Å; H376-E379 PolarHBondContact O-N 3.09Å
377	D	57.3	Low	73.4	Confident	171 Å²	171	48.6 Å²	48.6	91%	0.914	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	129.2	-178.6	-64	-34.5	0	0	0	111.3	E379	D377-E379 PolarHBondContact O-N 3.26Å
378	G	50.6	Low	72.8	Confident	84 Å²	84	47.7 Å²	47.7	87%	0.866	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.9	2.5	173.6	0	0	0	0	0	116.2	H376	H376-G378 PolarHBondContact O-N 2.89Å
379	E	53.4	Low	71.7	Confident	80 Å²	80	50.8 Å²	50.8	37%	0.374	31%	0.311	S	S	.	.	B	Isolated β-bridge	trans	-122.8	130.2	173.7	-58.9	-168.4	168.7	0	0	111.3	R67 K100 H376 D377	R67-E379 IonicContact CZ-OE2 2.72Å; R67-E379 IonicContact NE-OE2 3.54Å; R67-E379 PolarHBondContact NE-OE2 3.27Å; R67-E379 IonicContact NH2-OE2 3.72Å; R67-E379 PolarHBondContact NH2-OE2 2.87Å; K100-E379 WeakPolarHBondContact CE-OE2 3.35Å; K100-E379 IonicContact NZ-OE1 2.89Å; K100-E379 PolarHBondContact NZ-OE1 3.13Å; K100-E379 IonicContact NZ-OE2 2.74Å; K100-E379 PolarHBondContact NZ-OE2 2.87Å; H376-E379 PolarHBondContact O-N 3.09Å; D377-E379 PolarHBondContact O-N 3.26Å
380	P	48.2	Very low	70.2	Confident	116 Å²	116	54.9 Å²	54.9	75%	0.753	34%	0.337	S	S	*	.			trans	-57.1	152.3	168.5	23	-29	0	0	0	110.3	R67	R67-P380 PolarHBondContact NH2-O 3.07Å
381	L	40.5	Very low	68.4	Low	110 Å²	110	59.5 Å²	59.5	58%	0.576	36%	0.364	S	S	*	.			trans	-64.6	0	174.2	-78.3	170	0	0	0	110.7

Retrieved 381 of 381 residues in 376.1 ms (Link to these results)

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