A0A096MNS1_PAPAN Loading...

Interleukin-1 receptor-associated kinase 1-binding protein 1

Component of the IRAK1-dependent TNFRSF1A signaling pathway that leads to NF-kappa-B activation and is required for cell survival. Acts by enhancing RELA transcriptional activity.

AlphaFold DB , UniProt , Accession A0A096MNS1, Species PAPAN (Papio anubis, Olive baboon), Gene IRAK1BP1, Length 260 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.2	Very low	51.8	Low	240 Å²	240	136.8 Å²	136.8	100%	1.182	73%	0.725	S	S	*	*				0	107.3	0	-69.4	-62.2	-151.4	0	0	107.5	L3	M1-L3 PolarHBondContact O-N 3.22Å
2	S	32.7	Very low	53.9	Low	125 Å²	125	136.2 Å²	136.2	87%	0.874	71%	0.712	S	S	*	*			trans	-72.3	111.8	179.4	-172.8	0	0	0	0	108.4	Q4	S2-Q4 PolarHBondContact O-N 2.94Å; S2-Q4 VanDerWaalsContact O-N 3.13Å
3	L	37.7	Very low	55.7	Low	163 Å²	163	130 Å²	130	85%	0.853	68%	0.683	S	S	*	*			trans	-60.8	113.7	170.9	-87.5	147.9	0	0	0	107.3	M1 K5	M1-L3 PolarHBondContact O-N 3.22Å; L3-K5 PolarHBondContact O-N 3.11Å
4	Q	32.9	Very low	57.4	Low	186 Å²	186	131.1 Å²	131.1	87%	0.869	68%	0.683	S	S	*	*			trans	-56.5	103.3	169.4	-111.4	174.6	-27.4	0	0	107.6	S2 T6	S2-Q4 PolarHBondContact O-N 2.94Å; S2-Q4 VanDerWaalsContact O-N 3.13Å; Q4-T6 PolarHBondContact O-N 3.06Å
5	K	46.8	Very low	58.6	Low	179 Å²	179	127.8 Å²	127.8	78%	0.778	67%	0.666	S	S	*	*			trans	-67.8	102.2	172.1	-128	175.1	-178.3	179.6	0	106.1	L3	L3-K5 PolarHBondContact O-N 3.11Å
6	T	46.6	Very low	59	Low	108 Å²	108	127.2 Å²	127.2	66%	0.663	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-53.5	133.4	171.3	34.2	0	0	0	0	109	Q4	Q4-T6 PolarHBondContact O-N 3.06Å
7	P	56.4	Low	58.6	Low	111 Å²	111	124.9 Å²	124.9	72%	0.721	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-59.2	138.1	-179	23.3	-31.7	0	0	0	109.7	T9	P7-T9 PolarHBondContact O-N 2.88Å
8	P	63.7	Low	57.6	Low	62 Å²	62	132.1 Å²	132.1	40%	0.403	68%	0.68	S	S	.	*	P	Polyproline II helix	trans	-64.1	129	-178.8	25.1	-32.2	0	0	0	110.1	R10	P8-R10 PolarHBondContact O-N 3.19Å
9	T	69.4	Low	57.1	Low	106 Å²	106	129.3 Å²	129.3	65%	0.65	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-60	126.6	170.6	-41.7	0	0	0	0	108.8	P7	P7-T9 PolarHBondContact O-N 2.88Å
10	R	76.7	Confident	56.2	Low	168 Å²	168	130.8 Å²	130.8	63%	0.634	69%	0.687	S	S	*	*			trans	-112.1	145.2	177.6	-65.2	-173.4	-179.5	-150.4	-0.3	110.4	P8	P8-R10 PolarHBondContact O-N 3.19Å
11	V	75.2	Confident	55.5	Low	57 Å²	57	136 Å²	136	35%	0.345	70%	0.698	S	S	.	*			trans	-93	125.3	175.2	-178.3	0	0	0	0	110.4	V13 I203 E205	V11-V13 HydrophobicContact CG1-CG2 4.1Å; V11-I203 HydrophobicContact CG1-CG2 4.32Å; V11-E205 HydrophobicContact CB-CB 4.47Å; V11-E205 PolarHBondContact N-OE2 2.83Å; V11-E205 PolarHBondContact O-N 3.16Å
12	F	76.5	Confident	55.5	Low	129 Å²	129	127.3 Å²	127.3	57%	0.566	67%	0.669	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-137.7	123.6	168.5	-153.5	-85	0	0	0	108.9	L202 I203 K204	F12-L202 HydrophobicContact CE1-CD1 3.94Å; F12-L202 HydrophobicContact CZ-CD1 3.96Å; F12-I203 WeakPolarHBondContact CA-O 3.39Å; F12-K204 HydrophobicContact CD2-CB 4.21Å; F12-K204 HydrophobicContact CD2-CD 4.33Å; F12-K204 HydrophobicContact CD2-CG 3.82Å; F12-K204 HydrophobicContact CE2-CB 4.09Å; F12-K204 HydrophobicContact CE2-CD 3.68Å; F12-K204 HydrophobicContact CE2-CG 3.66Å
13	V	76.8	Confident	55.8	Low	56 Å²	56	127.4 Å²	127.4	34%	0.339	67%	0.667	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-139.4	121.2	179.3	-175.2	0	0	0	0	109.1	V11 L15 L202 I203	V11-V13 HydrophobicContact CG1-CG2 4.1Å; V13-L15 HydrophobicContact CG1-CD2 3.75Å; V13-L15 HydrophobicContact CG1-CG 3.93Å; V13-L202 WeakPolarHBondContact O-CA 3.3Å; V13-I203 HydrophobicContact CB-CB 4.41Å; V13-I203 PolarHBondContact N-O 2.46Å; V13-I203 PolarHBondContact O-N 3.08Å
14	E	80.7	Confident	55.7	Low	146 Å²	146	124.1 Å²	124.1	68%	0.682	66%	0.663	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-112.5	118.8	170.1	-174.4	176.3	-177.1	0	0	108.5
15	L	74.1	Confident	55.8	Low	81 Å²	81	122.9 Å²	122.9	42%	0.424	66%	0.663	S	S	.	*			trans	-100	99	-175.2	-65.2	173.6	0	0	0	110.2	V13 P200 L201	V13-L15 HydrophobicContact CG1-CD2 3.75Å; V13-L15 HydrophobicContact CG1-CG 3.93Å; L15-P200 HydrophobicContact CD1-CB 4.28Å; L15-P200 HydrophobicContact CD1-CG 3.9Å; L15-P200 VanDerWaalsContact CD1-O 3.31Å; L15-P200 WeakPolarHBondContact CD1-O 3.38Å; L15-L201 PolarHBondContact N-O 3.44Å
16	V	66.1	Low	55.3	Low	118 Å²	118	121.7 Å²	121.7	72%	0.715	67%	0.665	S	S	*	*			trans	-75.1	138	177.9	-172.2	0	0	0	0	110.4	W18	V16-W18 PolarHBondContact O-N 3.07Å
17	P	52.4	Low	54.7	Low	88 Å²	88	124.4 Å²	124.4	57%	0.571	68%	0.675	S	S	*	*			trans	-60.1	129.6	173.7	-20.2	31.5	0	0	0	111.5	A19	P17-A19 PolarHBondContact O-N 2.99Å
18	W	40.5	Very low	53.5	Low	254 Å²	254	125.5 Å²	125.5	96%	0.962	68%	0.679	S	S	*	*			trans	-65.3	105.3	173.7	-153.9	-56.5	0	0	0	108.8	V16 D20	V16-W18 PolarHBondContact O-N 3.07Å; W18-D20 PolarHBondContact O-N 3.38Å
19	A	47	Very low	52	Low	80 Å²	80	131 Å²	131	66%	0.661	70%	0.704	S	S	*	*			trans	-77.2	119.7	171.5	0	0	0	0	0	108.8	P17 R21	P17-A19 PolarHBondContact O-N 2.99Å; A19-R21 PolarHBondContact O-N 3.15Å
20	D	40.7	Very low	50.1	Low	159 Å²	159	129.8 Å²	129.8	85%	0.85	71%	0.713	S	S	*	*			trans	-64.1	100.3	173.6	-164.6	18.9	0	0	0	109.2	W18 G22	W18-D20 PolarHBondContact O-N 3.38Å; D20-G22 PolarHBondContact O-N 3.45Å
21	R	40.5	Very low	47.8	Very low	240 Å²	240	125.7 Å²	125.7	91%	0.906	72%	0.722	S	S	*	*			trans	-81	98.5	171.2	-88.7	-166.5	-167.5	-126	3.4	108.5	A19	A19-R21 PolarHBondContact O-N 3.15Å
22	G	33.2	Very low	45.6	Very low	57 Å²	57	131.7 Å²	131.7	59%	0.588	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-63.1	156.7	163.2	0	0	0	0	0	112.1	D20	D20-G22 PolarHBondContact O-N 3.45Å
23	P	38.1	Very low	43.4	Very low	127 Å²	127	132.4 Å²	132.4	83%	0.825	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-72.5	136.6	-170.2	-10.9	26.7	0	0	0	112.3	N25	P23-N25 PolarHBondContact O-N 3.3Å
24	A	36.1	Very low	41.2	Very low	94 Å²	94	137.8 Å²	137.8	78%	0.777	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-69.8	117.3	173.5	0	0	0	0	0	110.9
25	N	33.5	Very low	39.3	Very low	161 Å²	161	136.9 Å²	136.9	86%	0.861	79%	0.794	S	S	*	*			trans	-96.1	115.1	162.8	-86.2	-9.4	0	0	0	109.4	P23	P23-N25 PolarHBondContact O-N 3.3Å
26	N	38	Very low	37.1	Very low	154 Å²	154	136.4 Å²	136.4	82%	0.824	81%	0.809	S	S	*	*			trans	-77.5	134.2	163.5	-78.5	-44.3	0	0	0	109.9
27	L	33	Very low	35.9	Very low	165 Å²	165	139.2 Å²	139.2	86%	0.864	82%	0.819	S	S	*	*			trans	-167.5	95.4	154.3	-98.4	148.9	0	0	0	106.4
28	V	31.7	Very low	34.9	Very low	134 Å²	134	146.5 Å²	146.5	81%	0.812	84%	0.835	S	S	*	*				66.6	113.6	99.8	179.5	0	0	0	0	115
29	L	32.7	Very low	34.6	Very low	178 Å²	178	142.9 Å²	142.9	93%	0.932	83%	0.828	S	S	*	*			trans	-6.4	133.3	155.2	-121.8	79.6	0	0	0	119.5
30	G	28	Very low	33.9	Very low	80 Å²	80	144.7 Å²	144.7	83%	0.825	83%	0.834	S	S	*	*			trans	174.8	115.8	152.2	0	0	0	0	0	114.6
31	G	28.6	Very low	33.5	Very low	81 Å²	81	145 Å²	145	84%	0.835	83%	0.834	S	S	*	*			trans	98.5	118.2	139.5	0	0	0	0	0	119.3
32	E	30.5	Very low	33.1	Very low	184 Å²	184	138.6 Å²	138.6	86%	0.86	83%	0.826	S	S	*	*			trans	-54.7	143.5	175.8	-61	161	101.9	0	0	116.5
33	T	28.6	Very low	33.3	Very low	144 Å²	144	141.3 Å²	141.3	88%	0.883	84%	0.837	S	S	*	*				161	131.3	120.3	35.7	0	0	0	0	112.5
34	L	30.9	Very low	33.2	Very low	168 Å²	168	141.6 Å²	141.6	88%	0.88	84%	0.836	S	S	*	*			trans	-88.8	171.5	160.3	-75.2	171.7	0	0	0	108.9
35	P	40.8	Very low	33.3	Very low	127 Å²	127	145.4 Å²	145.4	83%	0.825	84%	0.838	S	S	*	*			cis	-135.5	164.7	6.8	34.7	-14.6	0	0	0	115
36	G	27.4	Very low	33.4	Very low	71 Å²	71	141.5 Å²	141.5	73%	0.732	83%	0.828	S	S	*	*			trans	-175	104.2	165.8	0	0	0	0	0	112.6	R38	G36-R38 PolarHBondContact O-N 3.36Å
37	L	42.4	Very low	33.7	Very low	177 Å²	177	142.4 Å²	142.4	93%	0.927	83%	0.827	S	S	*	*			trans	-44.1	116.9	174.5	-89.2	84	0	0	0	112
38	R	30.5	Very low	34.3	Very low	242 Å²	242	140.1 Å²	140.1	91%	0.913	82%	0.82	S	S	*	*			trans	-142.3	123.5	140.6	-69.4	-163.2	177.1	-174.1	-0.7	109.1	G36	G36-R38 PolarHBondContact O-N 3.36Å
39	H	33.7	Very low	35.6	Very low	177 Å²	177	138.2 Å²	138.2	82%	0.819	82%	0.818	S	S	*	*			trans	-36.8	131.5	165.7	-83.5	-83.3	0	0	0	111.3	L41	H39-L41 VanDerWaalsContact C-N 3.28Å; H39-L41 PolarHBondContact O-N 3.28Å
40	P	33.2	Very low	37.4	Very low	119 Å²	119	133.5 Å²	133.5	77%	0.773	80%	0.797	S	S	*	*			trans	-68.1	100.2	156.5	23.5	-19.6	0	0	0	106.2	S42	P40-S42 VanDerWaalsContact C-N 3.33Å; P40-S42 PolarHBondContact O-N 3.43Å
41	L	31.6	Very low	40.3	Very low	164 Å²	164	137.5 Å²	137.5	86%	0.859	79%	0.787	S	S	*	*			trans	-51.2	110	153.2	-78.6	164.4	0	0	0	105.1	H39 S43	H39-L41 VanDerWaalsContact C-N 3.28Å; H39-L41 PolarHBondContact O-N 3.28Å; L41-S43 PolarHBondContact O-N 3.13Å
42	S	33.3	Very low	43.4	Very low	106 Å²	106	137.3 Å²	137.3	74%	0.741	77%	0.765	S	S	*	*			trans	-48	111.4	171.8	-50.3	0	0	0	0	106.5	P40 T44	P40-S42 VanDerWaalsContact C-N 3.33Å; P40-S42 PolarHBondContact O-N 3.43Å; S42-T44 PolarHBondContact O-N 3.02Å
43	S	36.8	Very low	46.4	Very low	115 Å²	115	129.2 Å²	129.2	80%	0.804	73%	0.728	S	S	*	*			trans	-57.6	98.4	166	40.3	0	0	0	0	105	L41 Q45	L41-S43 PolarHBondContact O-N 3.13Å; S43-Q45 PolarHBondContact O-N 3.3Å
44	T	35.3	Very low	49.6	Very low	133 Å²	133	127.3 Å²	127.3	82%	0.816	71%	0.709	S	S	*	*			trans	-58.7	99.1	169.6	-9.7	0	0	0	0	103.2	S42 A46	S42-T44 PolarHBondContact O-N 3.02Å; T44-A46 PolarHBondContact O-N 3.23Å
45	Q	39.1	Very low	52.7	Low	174 Å²	174	119.7 Å²	119.7	81%	0.813	67%	0.669	S	S	*	*			trans	-62.1	90.2	168.2	-153.3	176.9	43.5	0	0	103.3	S43 Q47	S43-Q45 PolarHBondContact O-N 3.3Å; Q45-Q47 PolarHBondContact O-N 3.04Å
46	A	35	Very low	55.4	Low	79 Å²	79	115.3 Å²	115.3	65%	0.653	64%	0.641	S	S	*	*			trans	-62.8	89.9	170.6	0	0	0	0	0	104.8	T44 T48	T44-A46 PolarHBondContact O-N 3.23Å; A46-T48 PolarHBondContact O-N 3.46Å
47	Q	43.9	Very low	58.7	Low	173 Å²	173	112 Å²	112	81%	0.808	61%	0.608	S	S	*	*			trans	-55	92.9	153.2	-75.2	178.9	-15.2	0	0	104.1	Q45 A49	Q45-Q47 PolarHBondContact O-N 3.04Å; Q47-A49 VanDerWaalsContact C-N 3.26Å; Q47-A49 PolarHBondContact O-N 2.9Å
48	T	46.6	Very low	61.4	Low	116 Å²	116	107.7 Å²	107.7	71%	0.712	59%	0.589	S	S	*	*			trans	-58.3	104	164.6	40.8	0	0	0	0	103.6	A46 T50	A46-T48 PolarHBondContact O-N 3.46Å; T48-T50 VanDerWaalsContact C-N 3.27Å; T48-T50 PolarHBondContact O-N 3.24Å
49	A	57.7	Low	64.6	Low	94 Å²	94	96.8 Å²	96.8	78%	0.777	55%	0.549	S	S	*	.			trans	-58.3	101	175.3	0	0	0	0	0	106	Q47 R51	Q47-A49 VanDerWaalsContact C-N 3.26Å; Q47-A49 PolarHBondContact O-N 2.9Å; A49-R51 PolarHBondContact O-N 3.4Å; A49-R51 VanDerWaalsContact O-N 3.17Å
50	T	70.4	Confident	67.6	Low	80 Å²	80	94 Å²	94	49%	0.491	54%	0.537	S	S	.	.			trans	-59.6	121.4	178.8	33.1	0	0	0	0	106.3	T48 E52	T48-T50 VanDerWaalsContact C-N 3.27Å; T48-T50 PolarHBondContact O-N 3.24Å; T50-E52 PolarHBondContact O-N 2.87Å; T50-E52 PolarHBondContact OG1-OE1 3.42Å
51	R	89	Confident	70.6	Confident	163 Å²	163	89.6 Å²	89.6	62%	0.615	51%	0.508	S	S	*	.			trans	-70.2	125.1	175.8	-63.7	179.6	-179.4	-161.7	-2.1	106.3	A49 E249 I250	A49-R51 PolarHBondContact O-N 3.4Å; A49-R51 VanDerWaalsContact O-N 3.17Å; R51-E249 CarbonylContact O-C 3.6Å; R51-I250 HydrophobicContact CB-CB 3.86Å; R51-I250 PolarHBondContact O-N 2.86Å
52	E	93.8	Very high	73.6	Confident	77 Å²	77	85.4 Å²	85.4	36%	0.36	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	146.8	-172.3	-71.5	171	-164.1	0	0	111.2	T50 H54 L201 T247 F248 I250	T50-E52 PolarHBondContact O-N 2.87Å; T50-E52 PolarHBondContact OG1-OE1 3.42Å; E52-H54 IonicContact OE2-CE1 3.66Å; E52-H54 IonicContact OE2-NE2 2.94Å; E52-H54 PolarHBondContact OE2-NE2 2.73Å; E52-L201 HydrophobicContact CG-CD1 3.84Å; E52-T247 HydrophobicContact CB-CG2 3.99Å; E52-T247 HydrophobicContact CG-CG2 4.07Å; E52-T247 WeakPolarHBondContact OE2-CG2 3.29Å; E52-F248 CarbonylContact C-O 3.56Å; E52-F248 WeakPolarHBondContact CA-O 3.34Å; E52-I250 VanDerWaalsContact C-CD1 3.43Å; E52-I250 WeakPolarHBondContact O-CD1 3.18Å
53	V	93.9	Very high	76.6	Confident	15 Å²	15	81.3 Å²	81.3	9%	0.091	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	130.8	167.1	62.2	0	0	0	0	108.4	V55 A186 V189 L197 T247 F248 I250	V53-V55 HydrophobicContact CG2-CG1 4.11Å; V53-A186 HydrophobicContact CG1-CB 4.19Å; V53-V189 HydrophobicContact CG2-CG1 4.5Å; V53-L197 HydrophobicContact CG1-CD1 3.6Å; V53-T247 WeakPolarHBondContact O-CA 3.24Å; V53-F248 HydrophobicContact CG1-CB 3.73Å; V53-F248 HydrophobicContact CG1-CD2 4.3Å; V53-F248 HydrophobicContact CG1-CG 4.46Å; V53-F248 PolarHBondContact N-O 2.94Å; V53-F248 PolarHBondContact O-N 3.24Å; V53-I250 HydrophobicContact CB-CD1 3.88Å; V53-I250 HydrophobicContact CB-CG1 3.96Å; V53-I250 HydrophobicContact CG1-CG1 4.1Å
54	H	96	Very high	79.3	Confident	104 Å²	104	77.6 Å²	77.6	48%	0.481	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	120.7	-176.4	-68	-131.4	0	0	0	107	E52 F245 T247	E52-H54 IonicContact OE2-CE1 3.66Å; E52-H54 IonicContact OE2-NE2 2.94Å; E52-H54 PolarHBondContact OE2-NE2 2.73Å; H54-F245 HydrophobicContact CB-CE2 4.03Å; H54-F245 HydrophobicContact CB-CZ 3.89Å; H54-F245 AromaticContact ND1-CZ 3.48Å; H54-F245 WeakPolarHBondContact ND1-CZ 3.47Å; H54-T247 WeakPolarHBondContact NE2-CG2 3.23Å
55	V	97	Very high	82.3	Confident	8 Å²	8	71.8 Å²	71.8	5%	0.048	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	147.7	-176.7	-71.5	0	0	0	0	111.1	V53 A182 K185 A186 F245 I246 F248	V53-V55 HydrophobicContact CG2-CG1 4.11Å; V55-A182 HydrophobicContact CG2-CB 4.05Å; V55-A182 WeakPolarHBondContact CG2-O 3.42Å; V55-K185 HydrophobicContact CB-CD 4.49Å; V55-K185 HydrophobicContact CG1-CD 4.3Å; V55-K185 HydrophobicContact CG1-CG 4.2Å; V55-A186 HydrophobicContact CB-CB 4.46Å; V55-A186 HydrophobicContact CG1-CB 3.8Å; V55-A186 HydrophobicContact CG2-CB 3.9Å; V55-F245 CarbonylContact O-C 3.36Å; V55-F245 WeakPolarHBondContact O-CA 3.2Å; V55-I246 HydrophobicContact CG2-CB 4.14Å; V55-I246 WeakPolarHBondContact CG2-O 3.42Å; V55-I246 PolarHBondContact N-O 3.44Å; V55-I246 PolarHBondContact O-N 3.07Å; V55-F248 HydrophobicContact CG2-CD2 4.19Å; V55-F248 HydrophobicContact CG2-CE2 3.87Å
56	S	96.8	Very high	85	Confident	34 Å²	34	65.3 Å²	65.3	24%	0.238	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	131.6	166.4	-173.3	0	0	0	0	109.6	K185 K243 V244	S56-K185 PolarHBondContact O-NZ 3.26Å; S56-K243 VanDerWaalsContact OG-CE 3.25Å; S56-K243 WeakPolarHBondContact OG-CE 3.49Å; S56-K243 WeakPolarHBondContact OG-CG 3.43Å; S56-V244 CarbonylContact C-O 3.59Å; S56-V244 VanDerWaalsContact CA-O 3.31Å; S56-V244 WeakPolarHBondContact CA-O 3.35Å; S56-V244 PolarHBondContact OG-O 3.07Å
57	G	97.3	Very high	87.9	Confident	2 Å²	2	65 Å²	65	2%	0.021	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	142	172	0	0	0	0	0	109.8	K243 V244	G57-K243 WeakPolarHBondContact O-CA 3.37Å; G57-V244 PolarHBondContact N-O 3.27Å; G57-V244 PolarHBondContact O-N 3.39Å
58	T	97.5	Very high	90.5	Very high	86 Å²	86	56.8 Å²	56.8	53%	0.528	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	155.6	176	53.1	0	0	0	0	109.4	N181 S242 K243	T58-N181 PolarHBondContact O-ND2 2.82Å; T58-S242 CarbonylContact C-O 3.56Å; T58-S242 VanDerWaalsContact CA-O 3.31Å; T58-S242 WeakPolarHBondContact CA-O 3.5Å; T58-K243 HydrophobicContact CG2-CB 4.09Å; T58-K243 HydrophobicContact CG2-CD 4.39Å; T58-K243 HydrophobicContact CG2-CG 3.84Å
59	S	97.8	Very high	92.9	Very high	13 Å²	13	54 Å²	54	9%	0.091	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	154.6	172.2	66.1	0	0	0	0	110.3	A174 A241 S242	S59-A174 WeakPolarHBondContact CB-O 3.37Å; S59-A174 WeakPolarHBondContact OG-CA 3.37Å; S59-A174 PolarHBondContact OG-O 3.43Å; S59-A241 WeakPolarHBondContact O-CA 3.46Å; S59-A241 VanDerWaalsContact O-CB 3.27Å; S59-A241 WeakPolarHBondContact O-CB 3.37Å; S59-S242 PolarHBondContact N-O 2.76Å; S59-S242 PolarHBondContact O-N 2.86Å; S59-S242 VanDerWaalsContact O-N 3.11Å
60	E	96.7	Very high	94.8	Very high	119 Å²	119	49.5 Å²	49.5	56%	0.556	27%	0.268	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.3	129.5	165.3	-173.7	-178.2	154.6	0	0	107.4	W211 H239 A240 A241	E60-W211 HydrophobicContact CG-CH2 4.09Å; E60-W211 HydrophobicContact CG-CZ2 4.25Å; E60-W211 WeakPolarHBondContact OE1-CZ2 3.18Å; E60-H239 IonicContact OE1-ND1 2.71Å; E60-H239 PolarHBondContact OE1-ND1 3.09Å; E60-A240 WeakPolarHBondContact CA-O 3.44Å; E60-A241 HydrophobicContact CB-CB 4.43Å; E60-A241 HydrophobicContact CG-CB 4.48Å
61	V	96.4	Very high	96.1	Very high	27 Å²	27	47.2 Å²	47.2	16%	0.164	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	149.4	176.1	-62.9	0	0	0	0	108.7	L170 Q173 A174 H239 A240	V61-L170 HydrophobicContact CB-CD1 4.19Å; V61-L170 HydrophobicContact CG2-CD1 3.65Å; V61-L170 HydrophobicContact CG2-CG 3.96Å; V61-Q173 HydrophobicContact CG1-CG 4.47Å; V61-A174 HydrophobicContact CG2-CB 3.7Å; V61-H239 WeakPolarHBondContact O-CA 3.35Å; V61-A240 HydrophobicContact CG2-CB 4.2Å; V61-A240 PolarHBondContact N-O 3.45Å; V61-A240 PolarHBondContact O-N 3.31Å
62	S	95.9	Very high	96.5	Very high	76 Å²	76	39.4 Å²	39.4	53%	0.531	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	149.9	175.9	57	0	0	0	0	110.8	I238	S62-I238 CarbonylContact C-O 3.48Å; S62-I238 VanDerWaalsContact CA-O 3.28Å; S62-I238 WeakPolarHBondContact CA-O 3.25Å
63	G	95.3	Very high	96.6	Very high	19 Å²	19	41.1 Å²	41.1	20%	0.196	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	122.6	179.5	0	0	0	0	0	110.7	H162 I238	G63-H162 PolarHBondContact O-NE2 3.27Å; G63-I238 PolarHBondContact N-O 2.99Å; G63-I238 PolarHBondContact O-N 3.46Å
64	G	94.9	Very high	96.8	Very high	38 Å²	38	40.4 Å²	40.4	39%	0.392	22%	0.223	S	C	.	.			trans	-65.1	164	171.5	0	0	0	0	0	112	H162	G64-H162 PolarHBondContact O-CD2 2.88Å; G64-H162 VanDerWaalsContact O-CD2 3.31Å; G64-H162 PolarHBondContact O-NE2 3.49Å
65	P	96.4	Very high	96.8	Very high	11 Å²	11	37.5 Å²	37.5	7%	0.071	21%	0.214	C	C	.	.			trans	-60.9	142.8	176.6	26.9	-33	0	0	0	110.4	F135 F160 Y161 H162 I233 A236	P65-F135 HydrophobicContact CB-CZ 4.38Å; P65-F135 HydrophobicContact CG-CE2 4.09Å; P65-F135 HydrophobicContact CG-CZ 4.18Å; P65-F135 WeakPolarHBondContact O-CE2 3.42Å; P65-F135 VanDerWaalsContact O-CZ 3.25Å; P65-F135 WeakPolarHBondContact O-CZ 3.48Å; P65-F160 HydrophobicContact CB-CB 3.75Å; P65-F160 HydrophobicContact CG-CB 3.63Å; P65-F160 HydrophobicContact CG-CD1 4.14Å; P65-F160 HydrophobicContact CG-CG 4.15Å; P65-Y161 WeakPolarHBondContact CB-O 3.45Å; P65-H162 WeakPolarHBondContact CA-NE2 3.39Å; P65-I233 HydrophobicContact CG-CG2 4.17Å; P65-A236 HydrophobicContact CB-CB 4.49Å; P65-A236 WeakPolarHBondContact CD-O 3.36Å; P65-A236 HydrophobicContact CG-CB 4.28Å
66	D	96.3	Very high	96.8	Very high	38 Å²	38	37.7 Å²	37.7	20%	0.203	22%	0.215	C	C	.	.	S	Bend	trans	-103	-4.7	179.3	70	-24	0	0	0	112.5	Y161 H162 T163 S166	D66-Y161 PolarHBondContact N-O 2.93Å; D66-H162 WeakPolarHBondContact OD1-CA 3.5Å; D66-T163 PolarHBondContact OD1-N 3.38Å; D66-T163 WeakPolarHBondContact OD2-CB 3.22Å; D66-T163 VanDerWaalsContact OD2-CG2 3.31Å; D66-T163 WeakPolarHBondContact OD2-CG2 3.31Å; D66-T163 PolarHBondContact OD2-OG1 3.17Å; D66-S166 WeakPolarHBondContact OD2-CB 3.3Å
67	R	97.3	Very high	96.8	Very high	73 Å²	73	39.6 Å²	39.6	28%	0.275	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	148.8	177.5	-63.2	-66.2	-178.6	-93.8	2.9	111.8	F132 T133 F160 Y161 T163	R67-F132 CarbonylContact C-O 3.59Å; R67-F132 WeakPolarHBondContact CA-O 3.35Å; R67-T133 VanDerWaalsContact CZ-CG2 3.45Å; R67-T133 VanDerWaalsContact NH1-CG2 3.29Å; R67-F160 WeakPolarHBondContact O-CA 3.37Å; R67-Y161 HydrophobicContact CB-CD1 3.86Å; R67-Y161 HydrophobicContact CB-CD2 4.04Å; R67-Y161 HydrophobicContact CB-CE1 3.4Å; R67-Y161 VanDerWaalsContact CB-CE1 3.4Å; R67-Y161 HydrophobicContact CB-CE2 3.61Å; R67-Y161 HydrophobicContact CB-CG 4.15Å; R67-Y161 HydrophobicContact CG-CE1 4.46Å; R67-Y161 HydrophobicContact CG-CE2 3.94Å; R67-Y161 PolarHBondContact N-O 3.07Å; R67-Y161 VanDerWaalsContact N-O 3.08Å; R67-Y161 PolarHBondContact O-N 3.45Å; R67-T163 HydrophobicContact CG-CG2 3.65Å
68	A	97.5	Very high	96.7	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	137.2	168	0	0	0	0	0	109.8	T131 F132 F135 M138 Q159 F160	A68-T131 CarbonylContact O-C 3.57Å; A68-T131 WeakPolarHBondContact O-CA 3.47Å; A68-F132 HydrophobicContact CB-CB 4.4Å; A68-F132 PolarHBondContact N-O 3.01Å; A68-F132 PolarHBondContact O-N 2.83Å; A68-F135 HydrophobicContact CB-CD1 3.73Å; A68-F135 HydrophobicContact CB-CE1 3.56Å; A68-F135 HydrophobicContact CB-CZ 4.49Å; A68-M138 HydrophobicContact CB-SD 3.5Å; A68-M138 WeakPolarHBondContact CB-SD 3.48Å; A68-Q159 CarbonylContact C-O 3.59Å; A68-Q159 VanDerWaalsContact CA-O 3.26Å; A68-Q159 WeakPolarHBondContact CA-O 3.42Å; A68-F160 HydrophobicContact CB-CD1 3.67Å; A68-F160 HydrophobicContact CB-CE1 3.66Å
69	Q	97.4	Very high	96.7	Very high	57 Å²	57	47.8 Å²	47.8	27%	0.266	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	133.4	174.5	-174.4	175.5	90.9	0	0	110.1	C129 I130 P158 Q159 Y161	Q69-C129 VanDerWaalsContact CG-SG 3.56Å; Q69-C129 PolarHBondContact NE2-SG 3.48Å; Q69-I130 WeakPolarHBondContact CA-O 3.28Å; Q69-P158 WeakPolarHBondContact O-CA 3.25Å; Q69-Q159 PolarHBondContact N-O 3.31Å; Q69-Q159 PolarHBondContact O-N 3.46Å; Q69-Y161 HydrophobicContact CB-CE1 4.09Å
70	V	97.6	Very high	96.7	Very high	0 Å²	0	49 Å²	49	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	134.8	171.4	177.2	0	0	0	0	108.4	M72 I130 F132 M138 I155 P158	V70-M72 HydrophobicContact CG1-CE 4.39Å; V70-I130 PolarHBondContact N-O 3.35Å; V70-I130 PolarHBondContact O-N 2.87Å; V70-F132 HydrophobicContact CB-CE2 4.08Å; V70-F132 HydrophobicContact CG2-CD2 4.27Å; V70-F132 HydrophobicContact CG2-CE2 4.06Å; V70-M138 HydrophobicContact CG2-CG 3.95Å; V70-M138 HydrophobicContact CG2-SD 3.88Å; V70-I155 HydrophobicContact CG1-CG2 3.67Å; V70-P158 HydrophobicContact CG2-CB 3.94Å
71	V	97.4	Very high	96.7	Very high	31 Å²	31	44.7 Å²	44.7	19%	0.188	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	126	176.1	-177.2	0	0	0	0	108.8	E127 V128 S156	V71-E127 HydrophobicContact CG1-CB 4.36Å; V71-V128 WeakPolarHBondContact CA-O 3.43Å; V71-S156 PolarHBondContact N-OG 2.97Å; V71-S156 WeakPolarHBondContact O-CB 3.5Å; V71-S156 PolarHBondContact O-N 3.48Å; V71-S156 PolarHBondContact O-OG 2.92Å
72	M	96.8	Very high	96.7	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	121.5	173.1	-53.1	-177.2	169.9	0	0	108.9	V70 I95 E127 V128 I130 L145 V154 I155	V70-M72 HydrophobicContact CG1-CE 4.39Å; M72-I95 HydrophobicContact SD-CG2 3.78Å; M72-E127 CarbonylContact O-C 3.53Å; M72-E127 WeakPolarHBondContact O-CA 3.42Å; M72-V128 HydrophobicContact CB-CB 4.24Å; M72-V128 PolarHBondContact N-O 2.95Å; M72-V128 PolarHBondContact O-N 3.31Å; M72-I130 HydrophobicContact CE-CD1 3.63Å; M72-I130 HydrophobicContact CG-CD1 4.17Å; M72-I130 HydrophobicContact SD-CD1 3.77Å; M72-L145 HydrophobicContact CE-CD1 3.25Å; M72-L145 HydrophobicContact SD-CD1 3.62Å; M72-V154 CarbonylContact C-O 3.57Å; M72-V154 WeakPolarHBondContact CA-O 3.29Å; M72-I155 HydrophobicContact CE-CD1 4.32Å; M72-I155 HydrophobicContact CE-CG1 4.37Å; M72-I155 HydrophobicContact CE-CG2 4.38Å; M72-I155 HydrophobicContact CG-CG1 4.11Å
73	R	97.4	Very high	96.7	Very high	113 Å²	113	48.7 Å²	48.7	43%	0.426	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	125.2	179.3	-172.9	178.8	-69.9	165.9	1	109.9	E125 A126 E127 V153 V154	R73-E125 WeakPolarHBondContact CD-OE2 3.33Å; R73-E125 HydrophobicContact CG-CG 3.92Å; R73-A126 WeakPolarHBondContact CA-O 3.47Å; R73-E127 HydrophobicContact CG-CG 4.31Å; R73-E127 IonicContact CZ-OE1 3.16Å; R73-E127 IonicContact NE-OE1 3.48Å; R73-E127 PolarHBondContact NE-OE1 2.99Å; R73-E127 IonicContact NH2-OE1 2.73Å; R73-E127 PolarHBondContact NH2-OE1 3.04Å; R73-V153 CarbonylContact O-C 3.58Å; R73-V153 WeakPolarHBondContact O-CA 3.44Å; R73-V154 HydrophobicContact CB-CB 4.47Å; R73-V154 PolarHBondContact N-O 2.98Å; R73-V154 PolarHBondContact O-N 3.26Å
74	V	97.2	Very high	96.8	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	123.4	176.7	-175.4	0	0	0	0	107.5	V88 R91 I95 E125 A126 V153	V74-V88 HydrophobicContact CB-CG1 4.38Å; V74-V88 HydrophobicContact CG1-CB 4.45Å; V74-V88 HydrophobicContact CG1-CG1 4.09Å; V74-V88 HydrophobicContact CG1-CG2 4.4Å; V74-R91 HydrophobicContact CG1-CB 3.69Å; V74-I95 HydrophobicContact CG2-CD1 3.46Å; V74-I95 VanDerWaalsContact CG2-CD1 3.46Å; V74-E125 CarbonylContact O-C 3.6Å; V74-E125 WeakPolarHBondContact O-CA 3.39Å; V74-A126 PolarHBondContact N-O 3Å; V74-A126 PolarHBondContact O-N 3.39Å; V74-V153 HydrophobicContact CG1-CG2 4.4Å; V74-V153 HydrophobicContact CG2-CG1 4.1Å; V74-V153 HydrophobicContact CG2-CG2 4.02Å
75	S	96.1	Very high	96.9	Very high	42 Å²	42	50.6 Å²	50.6	29%	0.294	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	158.3	177.3	69.2	0	0	0	0	113.2	R91 M124	S75-R91 PolarHBondContact O-NH1 3.32Å; S75-R91 PolarHBondContact O-NH2 2.91Å; S75-M124 CarbonylContact C-O 3.52Å; S75-M124 VanDerWaalsContact CA-O 3.26Å; S75-M124 WeakPolarHBondContact CA-O 3.5Å
76	S	96.4	Very high	96.9	Very high	12 Å²	12	55.8 Å²	55.8	8%	0.084	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	130.4	173.1	-167.5	0	0	0	0	110	S87 H123 M124	S76-S87 PolarHBondContact OG-OG 3.42Å; S76-H123 WeakPolarHBondContact O-CA 3.33Å; S76-M124 PolarHBondContact N-O 3.35Å; S76-M124 PolarHBondContact O-N 3.41Å
77	T	96.5	Very high	96.9	Very high	74 Å²	74	55.6 Å²	55.6	45%	0.454	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	125.8	168	-52.6	0	0	0	0	109.1	A121 Y122 H123	T77-A121 HydrophobicContact CG2-CB 3.74Å; T77-Y122 CarbonylContact C-O 3.56Å; T77-Y122 VanDerWaalsContact CA-O 3.29Å; T77-Y122 WeakPolarHBondContact CA-O 3.42Å; T77-H123 PolarHBondContact OG1-ND1 2.74Å
78	K	96.8	Very high	96.8	Very high	91 Å²	91	52.1 Å²	52.1	40%	0.396	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	153	179.2	-59.9	-68.6	175.7	-177.1	0	111	A80 E83 A84 Y122	K78-A80 VanDerWaalsContact C-N 3.3Å; K78-A80 PolarHBondContact O-N 2.78Å; K78-E83 HydrophobicContact CB-CB 4.11Å; K78-E83 HydrophobicContact CG-CB 4.09Å; K78-A84 HydrophobicContact CB-CB 3.97Å; K78-A84 HydrophobicContact CG-CB 4.11Å; K78-Y122 PolarHBondContact N-O 3.33Å; K78-Y122 PolarHBondContact O-N 3.17Å
79	E	97	Very high	96.8	Very high	170 Å²	170	54.1 Å²	54.1	79%	0.794	29%	0.288	S	S	*	.	S	Bend	trans	-63.9	-36.8	174.8	-64.1	-178.6	179.3	0	0	111.9	Y122	E79-Y122 WeakPolarHBondContact O-CD2 3.22Å; E79-Y122 WeakPolarHBondContact O-CE2 3.44Å
80	A	96.8	Very high	96.7	Very high	39 Å²	39	58.9 Å²	58.9	32%	0.322	30%	0.304	S	S	.	.	S	Bend	trans	-95.1	123.7	174.9	0	0	0	0	0	111.7	K78 A82 E83 A84	K78-A80 VanDerWaalsContact C-N 3.3Å; K78-A80 PolarHBondContact O-N 2.78Å; A80-A82 VanDerWaalsContact C-N 3.26Å; A80-A82 PolarHBondContact O-N 2.87Å; A80-E83 HydrophobicContact CB-CB 4.21Å; A80-E83 HydrophobicContact CB-CG 3.84Å; A80-E83 PolarHBondContact O-N 2.78Å; A80-A84 PolarHBondContact O-N 3.48Å; A80-A84 VanDerWaalsContact O-N 3.16Å
81	A	96.5	Very high	96.6	Very high	27 Å²	27	60.3 Å²	60.3	22%	0.223	31%	0.309	C	S	.	.	H	α-helix	trans	-52.4	-42	176.2	0	0	0	0	0	113.2	E83 A84 K85 F115 Y122	A81-E83 VanDerWaalsContact C-N 3.31Å; A81-E83 PolarHBondContact O-N 3.37Å; A81-A84 PolarHBondContact O-N 2.76Å; A81-K85 WeakPolarHBondContact O-CG 3.45Å; A81-K85 PolarHBondContact O-N 2.92Å; A81-K85 VanDerWaalsContact O-N 3.09Å; A81-F115 HydrophobicContact CB-CE1 4.49Å; A81-F115 HydrophobicContact CB-CZ 3.68Å; A81-Y122 HydrophobicContact CB-CD1 3.91Å; A81-Y122 HydrophobicContact CB-CD2 3.87Å; A81-Y122 HydrophobicContact CB-CE1 4.12Å; A81-Y122 HydrophobicContact CB-CE2 4.1Å; A81-Y122 HydrophobicContact CB-CG 3.76Å
82	A	97.1	Very high	96.6	Very high	74 Å²	74	59 Å²	59	61%	0.612	30%	0.301	S	S	*	.	H	α-helix	trans	-64.2	-36.6	-179.7	0	0	0	0	0	112.1	A80 K86	A80-A82 VanDerWaalsContact C-N 3.26Å; A80-A82 PolarHBondContact O-N 2.87Å; A82-K86 WeakPolarHBondContact O-CB 3.45Å; A82-K86 PolarHBondContact O-N 2.94Å
83	E	96.9	Very high	96.6	Very high	114 Å²	114	63.4 Å²	63.4	53%	0.533	33%	0.325	S	S	.	.	H	α-helix	trans	-72	-42.1	179.1	-64.8	-176.1	173	0	0	112	K78 A80 A81 K85 K86 S87	K78-E83 HydrophobicContact CB-CB 4.11Å; K78-E83 HydrophobicContact CG-CB 4.09Å; A80-E83 HydrophobicContact CB-CB 4.21Å; A80-E83 HydrophobicContact CB-CG 3.84Å; A80-E83 PolarHBondContact O-N 2.78Å; A81-E83 VanDerWaalsContact C-N 3.31Å; A81-E83 PolarHBondContact O-N 3.37Å; E83-K85 VanDerWaalsContact C-N 3.34Å; E83-K85 PolarHBondContact O-N 2.74Å; E83-K86 PolarHBondContact O-N 3.03Å; E83-S87 VanDerWaalsContact O-CB 3.22Å; E83-S87 WeakPolarHBondContact O-CB 3.39Å; E83-S87 PolarHBondContact O-N 3.41Å
84	A	95.9	Very high	96.5	Very high	0 Å²	0	62 Å²	62	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-58.2	-48.1	174.3	0	0	0	0	0	110.8	K78 A80 A81 S87 V88 M124	K78-A84 HydrophobicContact CB-CB 3.97Å; K78-A84 HydrophobicContact CG-CB 4.11Å; A80-A84 PolarHBondContact O-N 3.48Å; A80-A84 VanDerWaalsContact O-N 3.16Å; A81-A84 PolarHBondContact O-N 2.76Å; A84-S87 PolarHBondContact O-N 2.87Å; A84-V88 PolarHBondContact O-N 3.45Å; A84-V88 VanDerWaalsContact O-N 3.15Å; A84-M124 HydrophobicContact CB-CB 4.11Å
85	K	97	Very high	96.5	Very high	96 Å²	96	62 Å²	62	42%	0.417	32%	0.32	S	S	.	.	H	α-helix	trans	-61.5	-49.8	177	-71.8	178.5	-179.5	-176.9	0	112	A81 E83 S87 V88 C89 F115 M124	A81-K85 WeakPolarHBondContact O-CG 3.45Å; A81-K85 PolarHBondContact O-N 2.92Å; A81-K85 VanDerWaalsContact O-N 3.09Å; E83-K85 VanDerWaalsContact C-N 3.34Å; E83-K85 PolarHBondContact O-N 2.74Å; K85-S87 VanDerWaalsContact C-N 3.29Å; K85-S87 PolarHBondContact O-N 2.91Å; K85-V88 PolarHBondContact O-N 3.35Å; K85-C89 WeakPolarHBondContact O-CB 3.31Å; K85-C89 PolarHBondContact O-N 2.94Å; K85-C89 PolarHBondContact O-SG 3.19Å; K85-F115 HydrophobicContact CG-CD2 4.27Å; K85-F115 HydrophobicContact CG-CE2 4.13Å; K85-M124 HydrophobicContact CG-SD 4.17Å
86	K	97.1	Very high	96.5	Very high	120 Å²	120	61.6 Å²	61.6	52%	0.522	32%	0.316	S	S	.	.	H	α-helix	trans	-60.3	-39.6	-179.5	-170.2	179.8	-167.8	-176.5	0	112.1	A82 E83 R90	A82-K86 WeakPolarHBondContact O-CB 3.45Å; A82-K86 PolarHBondContact O-N 2.94Å; E83-K86 PolarHBondContact O-N 3.03Å; K86-R90 VanDerWaalsContact CE-NH2 3.26Å; K86-R90 VanDerWaalsContact O-CG 3.28Å; K86-R90 WeakPolarHBondContact O-CG 3.45Å; K86-R90 PolarHBondContact O-N 3.49Å; K86-R90 VanDerWaalsContact O-N 3.13Å
87	S	95.5	Very high	96.5	Very high	34 Å²	34	66 Å²	66	24%	0.238	34%	0.335	C	S	.	.	H	α-helix	trans	-63.1	-46.5	177.6	179.9	0	0	0	0	112.3	S76 E83 A84 K85 R91	S76-S87 PolarHBondContact OG-OG 3.42Å; E83-S87 VanDerWaalsContact O-CB 3.22Å; E83-S87 WeakPolarHBondContact O-CB 3.39Å; E83-S87 PolarHBondContact O-N 3.41Å; A84-S87 PolarHBondContact O-N 2.87Å; K85-S87 VanDerWaalsContact C-N 3.29Å; K85-S87 PolarHBondContact O-N 2.91Å; S87-R91 PolarHBondContact O-NE 2.97Å; S87-R91 VanDerWaalsContact O-NE 3.13Å; S87-R91 PolarHBondContact OG-NH2 2.92Å
88	V	96.9	Very high	96.4	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-70.9	-45	178.2	173.5	0	0	0	0	111.3	V74 A84 K85 R90 R91 L92 M124 A126	V74-V88 HydrophobicContact CB-CG1 4.38Å; V74-V88 HydrophobicContact CG1-CB 4.45Å; V74-V88 HydrophobicContact CG1-CG1 4.09Å; V74-V88 HydrophobicContact CG1-CG2 4.4Å; A84-V88 PolarHBondContact O-N 3.45Å; A84-V88 VanDerWaalsContact O-N 3.15Å; K85-V88 PolarHBondContact O-N 3.35Å; V88-R90 VanDerWaalsContact C-N 3.35Å; V88-R90 PolarHBondContact O-N 2.94Å; V88-R91 PolarHBondContact O-N 3.25Å; V88-L92 VanDerWaalsContact O-CB 3.28Å; V88-L92 WeakPolarHBondContact O-CB 3.25Å; V88-L92 PolarHBondContact O-N 2.91Å; V88-M124 HydrophobicContact CB-CB 4.35Å; V88-M124 HydrophobicContact CB-CG 3.64Å; V88-M124 HydrophobicContact CG1-CE 4.38Å; V88-M124 HydrophobicContact CG1-CG 3.93Å; V88-M124 HydrophobicContact CG2-CB 3.77Å; V88-M124 HydrophobicContact CG2-CG 3.57Å; V88-A126 HydrophobicContact CG1-CB 3.57Å
89	C	96.1	Very high	96.4	Very high	42 Å²	42	58.5 Å²	58.5	28%	0.284	30%	0.297	S	S	.	.	H	α-helix	trans	-57.5	-45.5	179.6	-71.3	0	0	0	0	111.9	K85 R91 L92 D93	K85-C89 WeakPolarHBondContact O-CB 3.31Å; K85-C89 PolarHBondContact O-N 2.94Å; K85-C89 PolarHBondContact O-SG 3.19Å; C89-R91 PolarHBondContact O-N 3.32Å; C89-L92 PolarHBondContact O-N 2.91Å; C89-D93 WeakPolarHBondContact O-CB 3.31Å; C89-D93 PolarHBondContact O-N 3.39Å
90	R	96.3	Very high	96.3	Very high	158 Å²	158	56.8 Å²	56.8	60%	0.596	29%	0.289	S	S	*	.	H	α-helix	trans	-57.3	-45.1	178.7	-76.7	170.2	169.9	175.6	-11.2	113.5	K86 V88 Y94	K86-R90 VanDerWaalsContact CE-NH2 3.26Å; K86-R90 VanDerWaalsContact O-CG 3.28Å; K86-R90 WeakPolarHBondContact O-CG 3.45Å; K86-R90 PolarHBondContact O-N 3.49Å; K86-R90 VanDerWaalsContact O-N 3.13Å; V88-R90 VanDerWaalsContact C-N 3.35Å; V88-R90 PolarHBondContact O-N 2.94Å; R90-Y94 PolarHBondContact O-N 2.92Å; R90-Y94 VanDerWaalsContact O-N 3.15Å
91	R	95.9	Very high	96.2	Very high	29 Å²	29	61.4 Å²	61.4	11%	0.109	30%	0.304	C	S	.	.	H	α-helix	trans	-70.8	-40.5	178.9	-79.9	173.9	-73.9	152.1	-3	111.2	V74 S75 S87 V88 C89 Y94 I95 S152	V74-R91 HydrophobicContact CG1-CB 3.69Å; S75-R91 PolarHBondContact O-NH1 3.32Å; S75-R91 PolarHBondContact O-NH2 2.91Å; S87-R91 PolarHBondContact O-NE 2.97Å; S87-R91 VanDerWaalsContact O-NE 3.13Å; S87-R91 PolarHBondContact OG-NH2 2.92Å; V88-R91 PolarHBondContact O-N 3.25Å; C89-R91 PolarHBondContact O-N 3.32Å; R91-Y94 PolarHBondContact O-N 2.93Å; R91-I95 VanDerWaalsContact O-CG1 3.3Å; R91-I95 WeakPolarHBondContact O-CG1 3.38Å; R91-I95 PolarHBondContact O-N 2.75Å; R91-S152 VanDerWaalsContact NH1-CB 3.3Å; R91-S152 PolarHBondContact NH1-O 3.48Å; R91-S152 PolarHBondContact NH1-OG 3.25Å
92	L	96.9	Very high	96	Very high	5 Å²	5	64.3 Å²	64.3	3%	0.026	31%	0.313	C	S	.	.	H	α-helix	trans	-60.6	-45.7	174.8	177.3	64.5	0	0	0	111.7	V88 C89 Y94 I95 T96 V111 K113 A126 V128	V88-L92 VanDerWaalsContact O-CB 3.28Å; V88-L92 WeakPolarHBondContact O-CB 3.25Å; V88-L92 PolarHBondContact O-N 2.91Å; C89-L92 PolarHBondContact O-N 2.91Å; L92-Y94 VanDerWaalsContact C-N 3.3Å; L92-Y94 PolarHBondContact O-N 2.95Å; L92-I95 PolarHBondContact O-N 2.78Å; L92-T96 HydrophobicContact CD1-CG2 4.07Å; L92-T96 HydrophobicContact CG-CG2 4.42Å; L92-T96 WeakPolarHBondContact O-CG2 3.5Å; L92-T96 PolarHBondContact O-N 2.97Å; L92-T96 PolarHBondContact O-OG1 2.94Å; L92-T96 VanDerWaalsContact O-OG1 3.11Å; L92-V111 HydrophobicContact CD1-CG1 3.89Å; L92-V111 HydrophobicContact CD1-CG2 4.4Å; L92-V111 HydrophobicContact CD2-CG1 3.92Å; L92-K113 HydrophobicContact CD2-CD 4.49Å; L92-A126 HydrophobicContact CD2-CB 4.24Å; L92-V128 HydrophobicContact CD1-CG2 3.29Å
93	D	96.2	Very high	95.8	Very high	92 Å²	92	62.7 Å²	62.7	49%	0.492	30%	0.304	S	S	.	.	H	α-helix	trans	-62.1	-40	178.7	-65.2	-22.6	0	0	0	110.9	C89 T96 Q97	C89-D93 WeakPolarHBondContact O-CB 3.31Å; C89-D93 PolarHBondContact O-N 3.39Å; D93-T96 WeakPolarHBondContact CA-OG1 3.5Å; D93-T96 PolarHBondContact O-OG1 2.78Å; D93-T96 VanDerWaalsContact O-OG1 3.09Å; D93-Q97 WeakPolarHBondContact O-CB 3.41Å; D93-Q97 PolarHBondContact O-N 2.93Å
94	Y	96.5	Very high	95.7	Very high	82 Å²	82	57.9 Å²	57.9	32%	0.322	28%	0.282	S	S	.	.	H	α-helix	trans	-62.9	-45.1	173.6	-177.6	-93	0	0	0	112.3	R90 R91 L92 S98 L145 K148 L149	R90-Y94 PolarHBondContact O-N 2.92Å; R90-Y94 VanDerWaalsContact O-N 3.15Å; R91-Y94 PolarHBondContact O-N 2.93Å; L92-Y94 VanDerWaalsContact C-N 3.3Å; L92-Y94 PolarHBondContact O-N 2.95Å; Y94-S98 VanDerWaalsContact O-CB 3.25Å; Y94-S98 WeakPolarHBondContact O-CB 3.38Å; Y94-S98 PolarHBondContact O-N 2.85Å; Y94-S98 PolarHBondContact O-OG 3.46Å; Y94-L145 HydrophobicContact CE1-CD2 4.25Å; Y94-K148 HydrophobicContact CE1-CB 3.97Å; Y94-K148 WeakPolarHBondContact OH-CB 3.45Å; Y94-K148 WeakPolarHBondContact OH-CG 3.5Å; Y94-L149 HydrophobicContact CD1-CD2 3.67Å; Y94-L149 HydrophobicContact CD1-CG 4.36Å; Y94-L149 HydrophobicContact CE1-CD2 4.08Å; Y94-L149 HydrophobicContact CE1-CG 4.42Å
95	I	96.3	Very high	95.5	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-60.9	-52.8	177.7	-69.7	162.4	0	0	0	109.9	M72 V74 R91 L92 Q97 S98 L99 V128 L149 V153	M72-I95 HydrophobicContact SD-CG2 3.78Å; V74-I95 HydrophobicContact CG2-CD1 3.46Å; V74-I95 VanDerWaalsContact CG2-CD1 3.46Å; R91-I95 VanDerWaalsContact O-CG1 3.3Å; R91-I95 WeakPolarHBondContact O-CG1 3.38Å; R91-I95 PolarHBondContact O-N 2.75Å; L92-I95 PolarHBondContact O-N 2.78Å; I95-Q97 VanDerWaalsContact C-N 3.35Å; I95-Q97 PolarHBondContact O-N 2.53Å; I95-S98 PolarHBondContact O-N 2.87Å; I95-L99 HydrophobicContact CG2-CD1 3.86Å; I95-L99 HydrophobicContact CG2-CG 4.33Å; I95-L99 VanDerWaalsContact O-CG 3.25Å; I95-L99 WeakPolarHBondContact O-CG 3.44Å; I95-L99 PolarHBondContact O-N 3.38Å; I95-V128 HydrophobicContact CG2-CG1 4.39Å; I95-V128 HydrophobicContact CG2-CG2 4.27Å; I95-L149 HydrophobicContact CD1-CD1 3.93Å; I95-L149 HydrophobicContact CG1-CD1 3.58Å; I95-V153 HydrophobicContact CD1-CG1 4.11Å
96	T	95.7	Very high	95.3	Very high	35 Å²	35	62.6 Å²	62.6	22%	0.215	32%	0.319	C	S	.	.	H	α-helix	trans	-63.5	-40.9	-177.3	55.5	0	0	0	0	111.8	L92 D93 L99 Q100 V111	L92-T96 HydrophobicContact CD1-CG2 4.07Å; L92-T96 HydrophobicContact CG-CG2 4.42Å; L92-T96 WeakPolarHBondContact O-CG2 3.5Å; L92-T96 PolarHBondContact O-N 2.97Å; L92-T96 PolarHBondContact O-OG1 2.94Å; L92-T96 VanDerWaalsContact O-OG1 3.11Å; D93-T96 WeakPolarHBondContact CA-OG1 3.5Å; D93-T96 PolarHBondContact O-OG1 2.78Å; D93-T96 VanDerWaalsContact O-OG1 3.09Å; T96-L99 PolarHBondContact O-N 2.88Å; T96-Q100 VanDerWaalsContact O-CG 3.3Å; T96-Q100 WeakPolarHBondContact O-CG 3.25Å; T96-Q100 PolarHBondContact O-N 3.45Å; T96-V111 HydrophobicContact CG2-CG2 4.37Å
97	Q	95.7	Very high	95.2	Very high	104 Å²	104	64.6 Å²	64.6	49%	0.486	33%	0.33	S	S	.	.	H	α-helix	trans	-63.5	-42.9	174.6	-173.6	177.1	21.8	0	0	111.8	D93 I95 Q100 Q101	D93-Q97 WeakPolarHBondContact O-CB 3.41Å; D93-Q97 PolarHBondContact O-N 2.93Å; I95-Q97 VanDerWaalsContact C-N 3.35Å; I95-Q97 PolarHBondContact O-N 2.53Å; Q97-Q100 PolarHBondContact O-N 2.96Å; Q97-Q101 WeakPolarHBondContact O-CB 3.41Å; Q97-Q101 VanDerWaalsContact O-CG 3.28Å; Q97-Q101 WeakPolarHBondContact O-CG 3.48Å; Q97-Q101 PolarHBondContact O-N 3.45Å
98	S	95.6	Very high	95.2	Very high	5 Å²	5	65 Å²	65	4%	0.035	33%	0.33	C	S	.	.	H	α-helix	trans	-63	-42.8	177.5	-62.1	0	0	0	0	111.5	Y94 I95 Q100 Q101 Q102	Y94-S98 VanDerWaalsContact O-CB 3.25Å; Y94-S98 WeakPolarHBondContact O-CB 3.38Å; Y94-S98 PolarHBondContact O-N 2.85Å; Y94-S98 PolarHBondContact O-OG 3.46Å; I95-S98 PolarHBondContact O-N 2.87Å; S98-Q100 PolarHBondContact O-N 3.24Å; S98-Q101 PolarHBondContact O-N 3.29Å; S98-Q102 WeakPolarHBondContact O-CB 3.31Å; S98-Q102 WeakPolarHBondContact O-CG 3.39Å; S98-Q102 PolarHBondContact O-N 3.07Å
99	L	95.8	Very high	95.2	Very high	3 Å²	3	66.4 Å²	66.4	2%	0.016	34%	0.338	C	S	.	.	H	α-helix	trans	-60.6	-44.9	176.2	-69.1	172	0	0	0	111.5	I95 T96 Q102 G103 V104 T109 V128 I130 I141 L145	I95-L99 HydrophobicContact CG2-CD1 3.86Å; I95-L99 HydrophobicContact CG2-CG 4.33Å; I95-L99 VanDerWaalsContact O-CG 3.25Å; I95-L99 WeakPolarHBondContact O-CG 3.44Å; I95-L99 PolarHBondContact O-N 3.38Å; T96-L99 PolarHBondContact O-N 2.88Å; L99-Q102 CarbonylContact O-C 3.57Å; L99-Q102 PolarHBondContact O-N 3.5Å; L99-G103 PolarHBondContact O-N 3.33Å; L99-V104 HydrophobicContact CB-CB 4.1Å; L99-V104 HydrophobicContact CB-CG2 4.33Å; L99-V104 HydrophobicContact CD2-CG2 4.05Å; L99-V104 WeakPolarHBondContact O-CB 3.48Å; L99-V104 PolarHBondContact O-N 3Å; L99-T109 HydrophobicContact CD1-CG2 4.27Å; L99-V128 HydrophobicContact CD1-CG1 4.06Å; L99-I130 HydrophobicContact CD1-CD1 3.65Å; L99-I130 HydrophobicContact CD1-CG1 3.97Å; L99-I130 HydrophobicContact CD2-CD1 3.73Å; L99-I130 HydrophobicContact CG-CD1 4.34Å; L99-I141 HydrophobicContact CD2-CG2 3.71Å; L99-L145 HydrophobicContact CD2-CD1 4.45Å
100	Q	94.6	Very high	95.2	Very high	133 Å²	133	68.5 Å²	68.5	62%	0.621	35%	0.349	S	S	*	.	H	α-helix	trans	-63.4	-44.9	176.8	-72.6	172.5	-1	0	0	112.2	T96 Q97 S98 Q102 G103	T96-Q100 VanDerWaalsContact O-CG 3.3Å; T96-Q100 WeakPolarHBondContact O-CG 3.25Å; T96-Q100 PolarHBondContact O-N 3.45Å; Q97-Q100 PolarHBondContact O-N 2.96Å; S98-Q100 PolarHBondContact O-N 3.24Å; Q100-Q102 VanDerWaalsContact C-N 3.26Å; Q100-Q102 PolarHBondContact O-N 3.25Å; Q100-G103 WeakPolarHBondContact O-CA 3.5Å; Q100-G103 PolarHBondContact O-N 3.45Å
101	Q	94.9	Very high	95.3	Very high	136 Å²	136	63.8 Å²	63.8	64%	0.636	34%	0.338	S	S	*	.	H	α-helix	trans	-62.1	-34.5	177.8	-75	174.1	-4.3	0	0	112.5	Q97 S98 G103	Q97-Q101 WeakPolarHBondContact O-CB 3.41Å; Q97-Q101 VanDerWaalsContact O-CG 3.28Å; Q97-Q101 WeakPolarHBondContact O-CG 3.48Å; Q97-Q101 PolarHBondContact O-N 3.45Å; S98-Q101 PolarHBondContact O-N 3.29Å; Q101-G103 PolarHBondContact O-N 3.27Å
102	Q	93.4	Very high	95.4	Very high	89 Å²	89	66.4 Å²	66.4	42%	0.416	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	5.5	174.7	-62	-69.6	-25.7	0	0	112.3	S98 L99 Q100 K137 I141	S98-Q102 WeakPolarHBondContact O-CB 3.31Å; S98-Q102 WeakPolarHBondContact O-CG 3.39Å; S98-Q102 PolarHBondContact O-N 3.07Å; L99-Q102 CarbonylContact O-C 3.57Å; L99-Q102 PolarHBondContact O-N 3.5Å; Q100-Q102 VanDerWaalsContact C-N 3.26Å; Q100-Q102 PolarHBondContact O-N 3.25Å; Q102-K137 WeakPolarHBondContact O-CE 3.47Å; Q102-K137 PolarHBondContact O-NZ 2.95Å; Q102-I141 HydrophobicContact CB-CD1 3.82Å; Q102-I141 HydrophobicContact CB-CG1 3.96Å; Q102-I141 HydrophobicContact CG-CG1 4.18Å
103	G	92.9	Very high	95.4	Very high	40 Å²	40	71.7 Å²	71.7	41%	0.412	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.4	33.1	175.1	0	0	0	0	0	114.1	L99 Q100 Q101 K137	L99-G103 PolarHBondContact O-N 3.33Å; Q100-G103 WeakPolarHBondContact O-CA 3.5Å; Q100-G103 PolarHBondContact O-N 3.45Å; Q101-G103 PolarHBondContact O-N 3.27Å; G103-K137 PolarHBondContact O-NZ 2.92Å
104	V	94.3	Very high	95.4	Very high	13 Å²	13	70.7 Å²	70.7	8%	0.079	38%	0.375	C	S	.	.			trans	-80.5	123.7	166.2	-179.4	0	0	0	0	108.3	L99 I130 F132 I141	L99-V104 HydrophobicContact CB-CB 4.1Å; L99-V104 HydrophobicContact CB-CG2 4.33Å; L99-V104 HydrophobicContact CD2-CG2 4.05Å; L99-V104 WeakPolarHBondContact O-CB 3.48Å; L99-V104 PolarHBondContact O-N 3Å; V104-I130 HydrophobicContact CG1-CG2 3.91Å; V104-F132 HydrophobicContact CG2-CE1 4.08Å; V104-I141 HydrophobicContact CG2-CD1 3.64Å
105	Q	92.7	Very high	95.4	Very high	116 Å²	116	70.3 Å²	70.3	54%	0.542	38%	0.375	S	S	.	.			trans	-68	144.7	-179.9	-60.3	-65.7	-5.9	0	0	111.4	E107 N108	Q105-E107 VanDerWaalsContact C-N 3.25Å; Q105-E107 HydrophobicContact CB-CG 3.83Å; Q105-E107 PolarHBondContact O-N 2.99Å; Q105-N108 WeakPolarHBondContact O-CB 3.47Å; Q105-N108 PolarHBondContact O-N 2.93Å
106	A	92.3	Very high	95.5	Very high	78 Å²	78	75.2 Å²	75.2	65%	0.645	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-60.5	-35.5	179.7	0	0	0	0	0	112.4	N108 T109	A106-N108 PolarHBondContact O-N 3.19Å; A106-T109 PolarHBondContact O-N 2.93Å; A106-T109 VanDerWaalsContact O-O 3.05Å
107	E	94.4	Very high	95.5	Very high	163 Å²	163	81.7 Å²	81.7	76%	0.762	41%	0.414	S	S	*	.	G	3₁₀ helix	trans	-61.4	-22.9	175.9	67.1	-160	-141.5	0	0	114.1	Q105 T109	Q105-E107 VanDerWaalsContact C-N 3.25Å; Q105-E107 HydrophobicContact CB-CG 3.83Å; Q105-E107 PolarHBondContact O-N 2.99Å; E107-T109 VanDerWaalsContact C-N 3.34Å
108	N	95.3	Very high	95.4	Very high	43 Å²	43	79.5 Å²	79.5	23%	0.23	41%	0.408	C	S	.	.	G	3₁₀ helix	trans	-92	2.6	178.1	-70.7	-45.2	0	0	0	112.6	Q105 A106 I130 T131	Q105-N108 WeakPolarHBondContact O-CB 3.47Å; Q105-N108 PolarHBondContact O-N 2.93Å; A106-N108 PolarHBondContact O-N 3.19Å; N108-I130 CarbonylContact O-C 3.55Å; N108-I130 WeakPolarHBondContact O-CA 3.08Å; N108-T131 WeakPolarHBondContact CB-O 3.44Å; N108-T131 PolarHBondContact O-N 2.85Å
109	T	96.6	Very high	95.3	Very high	29 Å²	29	87.5 Å²	87.5	18%	0.178	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	123.4	-177.4	-54.1	0	0	0	0	110.6	L99 A106 E107 V111 V128 C129 I130	L99-T109 HydrophobicContact CD1-CG2 4.27Å; A106-T109 PolarHBondContact O-N 2.93Å; A106-T109 VanDerWaalsContact O-O 3.05Å; E107-T109 VanDerWaalsContact C-N 3.34Å; T109-V111 HydrophobicContact CG2-CG2 4.39Å; T109-V128 HydrophobicContact CG2-CG1 3.59Å; T109-C129 CarbonylContact C-O 3.55Å; T109-C129 WeakPolarHBondContact CA-O 3.14Å; T109-I130 HydrophobicContact CG2-CG1 4.46Å
110	T	97.4	Very high	95.2	Very high	85 Å²	85	94.3 Å²	94.3	52%	0.521	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	131.1	173.7	-58.2	0	0	0	0	109.3	V128 C129	T110-V128 WeakPolarHBondContact O-CA 3.27Å; T110-C129 PolarHBondContact N-O 2.97Å; T110-C129 PolarHBondContact O-N 3.03Å
111	V	97.4	Very high	95.3	Very high	60 Å²	60	88.8 Å²	88.8	36%	0.364	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	122.2	178	-178.4	0	0	0	0	109.9	L92 T96 T109 K113 E127 V128	L92-V111 HydrophobicContact CD1-CG1 3.89Å; L92-V111 HydrophobicContact CD1-CG2 4.4Å; L92-V111 HydrophobicContact CD2-CG1 3.92Å; T96-V111 HydrophobicContact CG2-CG2 4.37Å; T109-V111 HydrophobicContact CG2-CG2 4.39Å; V111-K113 HydrophobicContact CG1-CG 4.42Å; V111-E127 CarbonylContact C-O 3.59Å; V111-E127 VanDerWaalsContact CA-O 3.32Å; V111-E127 WeakPolarHBondContact CA-O 3.4Å; V111-V128 HydrophobicContact CG2-CG1 4.25Å; V111-V128 HydrophobicContact CG2-CG2 4.31Å
112	T	97.6	Very high	95.4	Very high	84 Å²	84	85.8 Å²	85.8	52%	0.515	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	140.6	174	-54.8	0	0	0	0	109.2	A126 E127	T112-A126 CarbonylContact O-C 3.52Å; T112-A126 VanDerWaalsContact O-CA 3.27Å; T112-A126 WeakPolarHBondContact O-CA 3.25Å; T112-E127 PolarHBondContact N-O 2.97Å; T112-E127 PolarHBondContact O-N 3.31Å
113	K	97.4	Very high	95.6	Very high	116 Å²	116	82.4 Å²	82.4	50%	0.504	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	133.3	-179.6	-68.3	177.8	-177.5	178.7	0	109.6	L92 V111 M124 E125 A126	L92-K113 HydrophobicContact CD2-CD 4.49Å; V111-K113 HydrophobicContact CG1-CG 4.42Å; K113-M124 HydrophobicContact CB-CE 3.75Å; K113-M124 HydrophobicContact CD-CE 3.96Å; K113-M124 HydrophobicContact CG-CE 3.93Å; K113-E125 CarbonylContact C-O 3.59Å; K113-E125 WeakPolarHBondContact CA-O 3.49Å; K113-A126 HydrophobicContact CG-CB 4.13Å
114	D	97.1	Very high	95.8	Very high	71 Å²	71	81.1 Å²	81.1	38%	0.38	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	137.5	173.1	-176.6	54.9	0	0	0	110.1	R116 E125	D114-R116 IonicContact OD2-CZ 2.86Å; D114-R116 IonicContact OD2-NH1 3.19Å; D114-R116 PolarHBondContact OD2-NH1 3.37Å; D114-E125 PolarHBondContact N-O 3.22Å; D114-E125 PolarHBondContact O-N 3.29Å
115	F	96.8	Very high	95.9	Very high	73 Å²	73	82.1 Å²	82.1	32%	0.32	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	116.8	179.3	-176.3	-110	0	0	0	109.9	A81 K85 Y122 H123 M124	A81-F115 HydrophobicContact CB-CE1 4.49Å; A81-F115 HydrophobicContact CB-CZ 3.68Å; K85-F115 HydrophobicContact CG-CD2 4.27Å; K85-F115 HydrophobicContact CG-CE2 4.13Å; F115-Y122 AromaticContact CE1-CD1 4Å; F115-Y122 HydrophobicContact CE1-CD1 4Å; F115-Y122 HydrophobicContact CE2-CD1 4.36Å; F115-Y122 HydrophobicContact CE2-CG 4.47Å; F115-Y122 AromaticContact CZ-CD1 3.48Å; F115-Y122 HydrophobicContact CZ-CD1 3.48Å; F115-Y122 VanDerWaalsContact CZ-CD1 3.48Å; F115-Y122 HydrophobicContact CZ-CE1 4.39Å; F115-Y122 AromaticContact CZ-CG 3.91Å; F115-Y122 HydrophobicContact CZ-CG 3.91Å; F115-H123 WeakPolarHBondContact CA-O 3.32Å; F115-H123 WeakPolarHBondContact CD2-O 3.49Å; F115-M124 HydrophobicContact CB-SD 3.83Å; F115-M124 HydrophobicContact CD2-CB 3.95Å; F115-M124 HydrophobicContact CD2-CG 4.44Å; F115-M124 HydrophobicContact CD2-SD 3.72Å; F115-M124 HydrophobicContact CE2-CB 4.43Å; F115-M124 HydrophobicContact CG-SD 4.17Å
116	R	96.6	Very high	96.2	Very high	104 Å²	104	76.6 Å²	76.6	39%	0.392	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	152	-174.5	61	-175.3	-178	-103.2	2.1	111.7	D114 V118 H123	D114-R116 IonicContact OD2-CZ 2.86Å; D114-R116 IonicContact OD2-NH1 3.19Å; D114-R116 PolarHBondContact OD2-NH1 3.37Å; R116-V118 HydrophobicContact CG-CG2 4Å; R116-H123 HydrophobicContact CG-CB 4.05Å; R116-H123 PolarHBondContact N-O 2.96Å; R116-H123 PolarHBondContact NH2-CD2 3.44Å; R116-H123 PolarHBondContact NH2-NE2 3.01Å; R116-H123 VanDerWaalsContact NH2-NE2 3.19Å; R116-H123 PolarHBondContact O-N 2.93Å
117	R	96.5	Very high	96.4	Very high	171 Å²	171	75.5 Å²	75.5	65%	0.645	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.8	132.6	168.6	-170.1	176	-179.7	163	2.9	108.5	E119 A121	R117-E119 PolarHBondContact NE-O 2.79Å; R117-A121 WeakPolarHBondContact CG-O 3.46Å
118	V	94.6	Very high	96.6	Very high	58 Å²	58	67.8 Å²	67.8	35%	0.352	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	110	178.1	-176.9	0	0	0	0	107.1	R116 N120 A121 H123	R116-V118 HydrophobicContact CG-CG2 4Å; V118-N120 PolarHBondContact O-N 2.85Å; V118-A121 PolarHBondContact N-O 2.85Å; V118-A121 CarbonylContact O-C 3.52Å; V118-A121 WeakPolarHBondContact O-CA 3.28Å; V118-A121 PolarHBondContact O-N 3.13Å; V118-A121 VanDerWaalsContact O-O 3.08Å; V118-H123 HydrophobicContact CB-CB 4.43Å; V118-H123 HydrophobicContact CG2-CB 3.56Å
119	E	92.6	Very high	96.7	Very high	173 Å²	173	67.2 Å²	67.2	81%	0.808	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.6	-118.9	-174.2	-57	173.4	-177.4	0	0	111.6	R117	R117-E119 PolarHBondContact NE-O 2.79Å
120	N	93	Very high	96.7	Very high	145 Å²	145	65.9 Å²	65.9	78%	0.775	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.9	11.7	178.6	-65.1	-35.7	0	0	0	113.4	V118	V118-N120 PolarHBondContact O-N 2.85Å
121	A	96.8	Very high	96.8	Very high	18 Å²	18	63.1 Å²	63.1	15%	0.149	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	174.5	-177.9	0	0	0	0	0	112.2	T77 R117 V118	T77-A121 HydrophobicContact CG2-CB 3.74Å; R117-A121 WeakPolarHBondContact CG-O 3.46Å; V118-A121 PolarHBondContact N-O 2.85Å; V118-A121 CarbonylContact O-C 3.52Å; V118-A121 WeakPolarHBondContact O-CA 3.28Å; V118-A121 PolarHBondContact O-N 3.13Å; V118-A121 VanDerWaalsContact O-O 3.08Å
122	Y	97.6	Very high	96.8	Very high	72 Å²	72	60.7 Å²	60.7	28%	0.282	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	131.6	173.5	-62.6	-88.8	0	0	0	109.7	T77 K78 E79 A81 F115	T77-Y122 CarbonylContact C-O 3.56Å; T77-Y122 VanDerWaalsContact CA-O 3.29Å; T77-Y122 WeakPolarHBondContact CA-O 3.42Å; K78-Y122 PolarHBondContact N-O 3.33Å; K78-Y122 PolarHBondContact O-N 3.17Å; E79-Y122 WeakPolarHBondContact O-CD2 3.22Å; E79-Y122 WeakPolarHBondContact O-CE2 3.44Å; A81-Y122 HydrophobicContact CB-CD1 3.91Å; A81-Y122 HydrophobicContact CB-CD2 3.87Å; A81-Y122 HydrophobicContact CB-CE1 4.12Å; A81-Y122 HydrophobicContact CB-CE2 4.1Å; A81-Y122 HydrophobicContact CB-CG 3.76Å; F115-Y122 AromaticContact CE1-CD1 4Å; F115-Y122 HydrophobicContact CE1-CD1 4Å; F115-Y122 HydrophobicContact CE2-CD1 4.36Å; F115-Y122 HydrophobicContact CE2-CG 4.47Å; F115-Y122 AromaticContact CZ-CD1 3.48Å; F115-Y122 HydrophobicContact CZ-CD1 3.48Å; F115-Y122 VanDerWaalsContact CZ-CD1 3.48Å; F115-Y122 HydrophobicContact CZ-CE1 4.39Å; F115-Y122 AromaticContact CZ-CG 3.91Å; F115-Y122 HydrophobicContact CZ-CG 3.91Å
123	H	97	Very high	96.7	Very high	19 Å²	19	60.1 Å²	60.1	9%	0.088	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	124	175.5	-174.6	81.3	0	0	0	109.6	S76 T77 F115 R116 V118 E125	S76-H123 WeakPolarHBondContact O-CA 3.33Å; T77-H123 PolarHBondContact OG1-ND1 2.74Å; F115-H123 WeakPolarHBondContact CA-O 3.32Å; F115-H123 WeakPolarHBondContact CD2-O 3.49Å; R116-H123 HydrophobicContact CG-CB 4.05Å; R116-H123 PolarHBondContact N-O 2.96Å; R116-H123 PolarHBondContact NH2-CD2 3.44Å; R116-H123 PolarHBondContact NH2-NE2 3.01Å; R116-H123 VanDerWaalsContact NH2-NE2 3.19Å; R116-H123 PolarHBondContact O-N 2.93Å; V118-H123 HydrophobicContact CB-CB 4.43Å; V118-H123 HydrophobicContact CG2-CB 3.56Å; H123-E125 IonicContact NE2-OE2 3.76Å
124	M	97.3	Very high	96.5	Very high	12 Å²	12	60.2 Å²	60.2	6%	0.059	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	134.1	170.8	-178.5	71.7	-166.9	0	0	108.3	S75 S76 A84 K85 V88 K113 F115	S75-M124 CarbonylContact C-O 3.52Å; S75-M124 VanDerWaalsContact CA-O 3.26Å; S75-M124 WeakPolarHBondContact CA-O 3.5Å; S76-M124 PolarHBondContact N-O 3.35Å; S76-M124 PolarHBondContact O-N 3.41Å; A84-M124 HydrophobicContact CB-CB 4.11Å; K85-M124 HydrophobicContact CG-SD 4.17Å; V88-M124 HydrophobicContact CB-CB 4.35Å; V88-M124 HydrophobicContact CB-CG 3.64Å; V88-M124 HydrophobicContact CG1-CE 4.38Å; V88-M124 HydrophobicContact CG1-CG 3.93Å; V88-M124 HydrophobicContact CG2-CB 3.77Å; V88-M124 HydrophobicContact CG2-CG 3.57Å; K113-M124 HydrophobicContact CB-CE 3.75Å; K113-M124 HydrophobicContact CD-CE 3.96Å; K113-M124 HydrophobicContact CG-CE 3.93Å; F115-M124 HydrophobicContact CB-SD 3.83Å; F115-M124 HydrophobicContact CD2-CB 3.95Å; F115-M124 HydrophobicContact CD2-CG 4.44Å; F115-M124 HydrophobicContact CD2-SD 3.72Å; F115-M124 HydrophobicContact CE2-CB 4.43Å; F115-M124 HydrophobicContact CG-SD 4.17Å
125	E	97	Very high	96.4	Very high	34 Å²	34	59 Å²	59	16%	0.159	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	142.1	173.8	-172.5	168.6	83.9	0	0	109.8	R73 V74 K113 D114 H123	R73-E125 WeakPolarHBondContact CD-OE2 3.33Å; R73-E125 HydrophobicContact CG-CG 3.92Å; V74-E125 CarbonylContact O-C 3.6Å; V74-E125 WeakPolarHBondContact O-CA 3.39Å; K113-E125 CarbonylContact C-O 3.59Å; K113-E125 WeakPolarHBondContact CA-O 3.49Å; D114-E125 PolarHBondContact N-O 3.22Å; D114-E125 PolarHBondContact O-N 3.29Å; H123-E125 IonicContact NE2-OE2 3.76Å
126	A	98	Very high	96.3	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	136.2	169.6	0	0	0	0	0	109.3	R73 V74 V88 L92 T112 K113	R73-A126 WeakPolarHBondContact CA-O 3.47Å; V74-A126 PolarHBondContact N-O 3Å; V74-A126 PolarHBondContact O-N 3.39Å; V88-A126 HydrophobicContact CG1-CB 3.57Å; L92-A126 HydrophobicContact CD2-CB 4.24Å; T112-A126 CarbonylContact O-C 3.52Å; T112-A126 VanDerWaalsContact O-CA 3.27Å; T112-A126 WeakPolarHBondContact O-CA 3.25Å; K113-A126 HydrophobicContact CG-CB 4.13Å
127	E	97.9	Very high	96.3	Very high	56 Å²	56	55.7 Å²	55.7	26%	0.262	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	128.1	173.9	-63.7	-165.9	147	0	0	109.3	V71 M72 R73 V111 T112	V71-E127 HydrophobicContact CG1-CB 4.36Å; M72-E127 CarbonylContact O-C 3.53Å; M72-E127 WeakPolarHBondContact O-CA 3.42Å; R73-E127 HydrophobicContact CG-CG 4.31Å; R73-E127 IonicContact CZ-OE1 3.16Å; R73-E127 IonicContact NE-OE1 3.48Å; R73-E127 PolarHBondContact NE-OE1 2.99Å; R73-E127 IonicContact NH2-OE1 2.73Å; R73-E127 PolarHBondContact NH2-OE1 3.04Å; V111-E127 CarbonylContact C-O 3.59Å; V111-E127 VanDerWaalsContact CA-O 3.32Å; V111-E127 WeakPolarHBondContact CA-O 3.4Å; T112-E127 PolarHBondContact N-O 2.97Å; T112-E127 PolarHBondContact O-N 3.31Å
128	V	97.8	Very high	96.2	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	106.2	173.1	-170.4	0	0	0	0	107.1	V71 M72 L92 I95 L99 T109 T110 V111 I130	V71-V128 WeakPolarHBondContact CA-O 3.43Å; M72-V128 HydrophobicContact CB-CB 4.24Å; M72-V128 PolarHBondContact N-O 2.95Å; M72-V128 PolarHBondContact O-N 3.31Å; L92-V128 HydrophobicContact CD1-CG2 3.29Å; I95-V128 HydrophobicContact CG2-CG1 4.39Å; I95-V128 HydrophobicContact CG2-CG2 4.27Å; L99-V128 HydrophobicContact CD1-CG1 4.06Å; T109-V128 HydrophobicContact CG2-CG1 3.59Å; T110-V128 WeakPolarHBondContact O-CA 3.27Å; V111-V128 HydrophobicContact CG2-CG1 4.25Å; V111-V128 HydrophobicContact CG2-CG2 4.31Å; V128-I130 HydrophobicContact CG1-CD1 4.27Å; V128-I130 HydrophobicContact CG1-CG1 3.89Å
129	C	97.6	Very high	96.2	Very high	32 Å²	32	49.2 Å²	49.2	22%	0.216	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	122.5	175.5	-177.2	0	0	0	0	109	Q69 T109 T110	Q69-C129 VanDerWaalsContact CG-SG 3.56Å; Q69-C129 PolarHBondContact NE2-SG 3.48Å; T109-C129 CarbonylContact C-O 3.55Å; T109-C129 WeakPolarHBondContact CA-O 3.14Å; T110-C129 PolarHBondContact N-O 2.97Å; T110-C129 PolarHBondContact O-N 3.03Å
130	I	97.8	Very high	96.4	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	128.8	-173.4	-47.9	156.3	0	0	0	108.8	Q69 V70 M72 L99 V104 N108 T109 V128 F132	Q69-I130 WeakPolarHBondContact CA-O 3.28Å; V70-I130 PolarHBondContact N-O 3.35Å; V70-I130 PolarHBondContact O-N 2.87Å; M72-I130 HydrophobicContact CE-CD1 3.63Å; M72-I130 HydrophobicContact CG-CD1 4.17Å; M72-I130 HydrophobicContact SD-CD1 3.77Å; L99-I130 HydrophobicContact CD1-CD1 3.65Å; L99-I130 HydrophobicContact CD1-CG1 3.97Å; L99-I130 HydrophobicContact CD2-CD1 3.73Å; L99-I130 HydrophobicContact CG-CD1 4.34Å; V104-I130 HydrophobicContact CG1-CG2 3.91Å; N108-I130 CarbonylContact O-C 3.55Å; N108-I130 WeakPolarHBondContact O-CA 3.08Å; T109-I130 HydrophobicContact CG2-CG1 4.46Å; V128-I130 HydrophobicContact CG1-CD1 4.27Å; V128-I130 HydrophobicContact CG1-CG1 3.89Å; I130-F132 HydrophobicContact CB-CD2 4.37Å; I130-F132 HydrophobicContact CB-CE2 3.66Å; I130-F132 HydrophobicContact CB-CZ 4.06Å; I130-F132 HydrophobicContact CD1-CE2 4.43Å; I130-F132 HydrophobicContact CD1-CZ 4.36Å; I130-F132 HydrophobicContact CG2-CD2 3.98Å; I130-F132 HydrophobicContact CG2-CE1 3.98Å; I130-F132 HydrophobicContact CG2-CE2 3.37Å; I130-F132 HydrophobicContact CG2-CZ 3.38Å
131	T	97.9	Very high	96.5	Very high	28 Å²	28	39.5 Å²	39.5	17%	0.172	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	126.7	173.9	-57.7	0	0	0	0	110	A68 N108 Y161	A68-T131 CarbonylContact O-C 3.57Å; A68-T131 WeakPolarHBondContact O-CA 3.47Å; N108-T131 WeakPolarHBondContact CB-O 3.44Å; N108-T131 PolarHBondContact O-N 2.85Å; T131-Y161 WeakPolarHBondContact CG2-OH 2.85Å
132	F	97.3	Very high	96.4	Very high	9 Å²	9	39.5 Å²	39.5	4%	0.039	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	142.2	178.4	-65	-85.3	0	0	0	111	R67 A68 V70 V104 I130 M138 I141	R67-F132 CarbonylContact C-O 3.59Å; R67-F132 WeakPolarHBondContact CA-O 3.35Å; A68-F132 HydrophobicContact CB-CB 4.4Å; A68-F132 PolarHBondContact N-O 3.01Å; A68-F132 PolarHBondContact O-N 2.83Å; V70-F132 HydrophobicContact CB-CE2 4.08Å; V70-F132 HydrophobicContact CG2-CD2 4.27Å; V70-F132 HydrophobicContact CG2-CE2 4.06Å; V104-F132 HydrophobicContact CG2-CE1 4.08Å; I130-F132 HydrophobicContact CB-CD2 4.37Å; I130-F132 HydrophobicContact CB-CE2 3.66Å; I130-F132 HydrophobicContact CB-CZ 4.06Å; I130-F132 HydrophobicContact CD1-CE2 4.43Å; I130-F132 HydrophobicContact CD1-CZ 4.36Å; I130-F132 HydrophobicContact CG2-CD2 3.98Å; I130-F132 HydrophobicContact CG2-CE1 3.98Å; I130-F132 HydrophobicContact CG2-CE2 3.37Å; I130-F132 HydrophobicContact CG2-CZ 3.38Å; F132-M138 HydrophobicContact CB-CB 3.88Å; F132-M138 HydrophobicContact CB-CG 4.27Å; F132-M138 HydrophobicContact CD1-CB 3.75Å; F132-M138 HydrophobicContact CD1-CG 4.3Å; F132-M138 HydrophobicContact CD2-CB 3.88Å; F132-M138 HydrophobicContact CD2-CG 3.54Å; F132-M138 HydrophobicContact CD2-SD 4.24Å; F132-M138 HydrophobicContact CE1-CB 4.2Å; F132-M138 HydrophobicContact CE2-CB 4.3Å; F132-M138 HydrophobicContact CE2-CG 3.82Å; F132-M138 HydrophobicContact CG-CB 3.56Å; F132-M138 HydrophobicContact CG-CG 3.79Å; F132-M138 HydrophobicContact CZ-CB 4.44Å; F132-M138 HydrophobicContact CZ-CG 4.32Å; F132-I141 HydrophobicContact CE1-CD1 3.92Å; F132-I141 HydrophobicContact CZ-CG2 4.46Å
133	T	95.6	Very high	96.3	Very high	71 Å²	71	39.7 Å²	39.7	44%	0.436	21%	0.214	S	C	.	.	S	Bend	trans	-102.9	-27.8	169.9	57.1	0	0	0	0	111.7	R67	R67-T133 VanDerWaalsContact CZ-CG2 3.45Å; R67-T133 VanDerWaalsContact NH1-CG2 3.29Å
134	E	94.7	Very high	96.2	Very high	119 Å²	119	41.5 Å²	41.5	56%	0.556	22%	0.222	S	C	*	.			trans	-107.5	105.2	-179.9	-68.9	177	-107.1	0	0	110.7	G136 K137 M138	E134-G136 VanDerWaalsContact C-N 3.34Å; E134-G136 PolarHBondContact O-N 3.11Å; E134-K137 HydrophobicContact CB-CB 3.83Å; E134-K137 PolarHBondContact O-N 3.25Å; E134-M138 PolarHBondContact O-N 3.37Å
135	F	95.3	Very high	96.1	Very high	45 Å²	45	41 Å²	41	20%	0.197	22%	0.219	C	C	.	.	H	α-helix	trans	-69.3	-29.4	-173.7	-55.5	-22.7	0	0	0	113.7	P65 A68 M138 Q139 F160 I233	P65-F135 HydrophobicContact CB-CZ 4.38Å; P65-F135 HydrophobicContact CG-CE2 4.09Å; P65-F135 HydrophobicContact CG-CZ 4.18Å; P65-F135 WeakPolarHBondContact O-CE2 3.42Å; P65-F135 VanDerWaalsContact O-CZ 3.25Å; P65-F135 WeakPolarHBondContact O-CZ 3.48Å; A68-F135 HydrophobicContact CB-CD1 3.73Å; A68-F135 HydrophobicContact CB-CE1 3.56Å; A68-F135 HydrophobicContact CB-CZ 4.49Å; F135-M138 HydrophobicContact CB-CE 4.36Å; F135-M138 WeakPolarHBondContact O-CB 3.31Å; F135-Q139 WeakPolarHBondContact O-CB 3.44Å; F135-Q139 PolarHBondContact O-N 2.88Å; F135-F160 HydrophobicContact CB-CE1 4.48Å; F135-F160 HydrophobicContact CD1-CD1 4.26Å; F135-F160 AromaticContact CD1-CE1 3.85Å; F135-F160 HydrophobicContact CD1-CE1 3.85Å; F135-F160 HydrophobicContact CD2-CD1 4.21Å; F135-F160 AromaticContact CD2-CE1 3.83Å; F135-F160 HydrophobicContact CD2-CE1 3.83Å; F135-F160 AromaticContact CE1-CD1 3.91Å; F135-F160 HydrophobicContact CE1-CD1 3.91Å; F135-F160 AromaticContact CE1-CE1 3.99Å; F135-F160 HydrophobicContact CE1-CE1 3.99Å; F135-F160 AromaticContact CE2-CD1 3.82Å; F135-F160 HydrophobicContact CE2-CD1 3.82Å; F135-F160 AromaticContact CE2-CE1 3.93Å; F135-F160 HydrophobicContact CE2-CE1 3.93Å; F135-F160 HydrophobicContact CG-CD1 4.42Å; F135-F160 AromaticContact CG-CE1 3.79Å; F135-F160 HydrophobicContact CG-CE1 3.79Å; F135-F160 AromaticContact CZ-CD1 3.66Å; F135-F160 HydrophobicContact CZ-CD1 3.66Å; F135-F160 HydrophobicContact CZ-CE1 4.01Å; F135-I233 HydrophobicContact CD2-CD1 3.72Å; F135-I233 HydrophobicContact CD2-CG1 4.25Å; F135-I233 HydrophobicContact CE2-CD1 4.23Å; F135-I233 HydrophobicContact CE2-CG1 4.31Å
136	G	94.4	Very high	95.9	Very high	46 Å²	46	43.9 Å²	43.9	47%	0.474	24%	0.239	S	C	.	.	H	α-helix	trans	-64.7	-44.7	172.2	0	0	0	0	0	111.8	E134 Q139 N140	E134-G136 VanDerWaalsContact C-N 3.34Å; E134-G136 PolarHBondContact O-N 3.11Å; G136-Q139 PolarHBondContact O-N 2.85Å; G136-N140 VanDerWaalsContact O-CG 3.27Å; G136-N140 PolarHBondContact O-N 3.23Å; G136-N140 PolarHBondContact O-ND2 3.35Å
137	K	94.9	Very high	95.7	Very high	61 Å²	61	50.8 Å²	50.8	27%	0.265	27%	0.271	S	S	.	.	H	α-helix	trans	-62.9	-44.2	176.1	-174.2	176.9	-178	173.3	0	111.6	Q102 G103 E134 Q139 N140 I141	Q102-K137 WeakPolarHBondContact O-CE 3.47Å; Q102-K137 PolarHBondContact O-NZ 2.95Å; G103-K137 PolarHBondContact O-NZ 2.92Å; E134-K137 HydrophobicContact CB-CB 3.83Å; E134-K137 PolarHBondContact O-N 3.25Å; K137-Q139 PolarHBondContact O-N 2.92Å; K137-N140 PolarHBondContact O-N 2.84Å; K137-I141 HydrophobicContact CG-CD1 3.83Å; K137-I141 WeakPolarHBondContact O-CB 3.46Å; K137-I141 WeakPolarHBondContact O-CG1 3.34Å; K137-I141 PolarHBondContact O-N 3Å
138	M	96	Very high	95.6	Very high	3 Å²	3	53.8 Å²	53.8	2%	0.015	28%	0.283	C	S	.	.	H	α-helix	trans	-53	-53	172.4	175.5	-163.8	71.6	0	0	111.2	A68 V70 F132 E134 F135 N140 I141 C142 P158 F160	A68-M138 HydrophobicContact CB-SD 3.5Å; A68-M138 WeakPolarHBondContact CB-SD 3.48Å; V70-M138 HydrophobicContact CG2-CG 3.95Å; V70-M138 HydrophobicContact CG2-SD 3.88Å; F132-M138 HydrophobicContact CB-CB 3.88Å; F132-M138 HydrophobicContact CB-CG 4.27Å; F132-M138 HydrophobicContact CD1-CB 3.75Å; F132-M138 HydrophobicContact CD1-CG 4.3Å; F132-M138 HydrophobicContact CD2-CB 3.88Å; F132-M138 HydrophobicContact CD2-CG 3.54Å; F132-M138 HydrophobicContact CD2-SD 4.24Å; F132-M138 HydrophobicContact CE1-CB 4.2Å; F132-M138 HydrophobicContact CE2-CB 4.3Å; F132-M138 HydrophobicContact CE2-CG 3.82Å; F132-M138 HydrophobicContact CG-CB 3.56Å; F132-M138 HydrophobicContact CG-CG 3.79Å; F132-M138 HydrophobicContact CZ-CB 4.44Å; F132-M138 HydrophobicContact CZ-CG 4.32Å; E134-M138 PolarHBondContact O-N 3.37Å; F135-M138 HydrophobicContact CB-CE 4.36Å; F135-M138 WeakPolarHBondContact O-CB 3.31Å; M138-N140 VanDerWaalsContact C-N 3.35Å; M138-N140 PolarHBondContact O-N 3.35Å; M138-I141 PolarHBondContact O-N 2.89Å; M138-C142 WeakPolarHBondContact O-CB 3.31Å; M138-C142 PolarHBondContact O-N 3.45Å; M138-C142 PolarHBondContact O-SG 3.39Å; M138-P158 HydrophobicContact CE-CB 3.84Å; M138-P158 HydrophobicContact CE-CG 3.98Å; M138-P158 HydrophobicContact SD-CB 3.58Å; M138-P158 VanDerWaalsContact SD-CB 3.58Å; M138-P158 HydrophobicContact SD-CG 4.36Å; M138-F160 HydrophobicContact CE-CE1 4.18Å; M138-F160 HydrophobicContact CE-CZ 3.98Å
139	Q	94.7	Very high	95.4	Very high	90 Å²	90	55.1 Å²	55.1	42%	0.421	29%	0.29	S	S	.	.	H	α-helix	trans	-61.3	-42.9	-177.9	-174.6	171.6	-20.6	0	0	111.9	F135 G136 K137 I141 C142 N143	F135-Q139 WeakPolarHBondContact O-CB 3.44Å; F135-Q139 PolarHBondContact O-N 2.88Å; G136-Q139 PolarHBondContact O-N 2.85Å; K137-Q139 PolarHBondContact O-N 2.92Å; Q139-I141 PolarHBondContact O-N 2.93Å; Q139-C142 PolarHBondContact O-N 3.01Å; Q139-N143 WeakPolarHBondContact O-CB 3.29Å; Q139-N143 PolarHBondContact O-N 3.1Å; Q139-N143 PolarHBondContact O-ND2 3.37Å; Q139-N143 PolarHBondContact O-OD1 3.37Å
140	N	95.8	Very high	95	Very high	112 Å²	112	58.2 Å²	58.2	60%	0.599	31%	0.305	S	S	*	.	H	α-helix	trans	-60.9	-44.9	176.8	-68.7	-16.5	0	0	0	112.1	G136 K137 M138 F144	G136-N140 VanDerWaalsContact O-CG 3.27Å; G136-N140 PolarHBondContact O-N 3.23Å; G136-N140 PolarHBondContact O-ND2 3.35Å; K137-N140 PolarHBondContact O-N 2.84Å; M138-N140 VanDerWaalsContact C-N 3.35Å; M138-N140 PolarHBondContact O-N 3.35Å; N140-F144 WeakPolarHBondContact O-CB 3.5Å; N140-F144 PolarHBondContact O-N 2.72Å
141	I	95.7	Very high	94.6	Very high	3 Å²	3	64.1 Å²	64.1	2%	0.015	35%	0.346	C	S	.	.	H	α-helix	trans	-66.5	-45.1	178.9	-70.5	169.2	0	0	0	110.9	L99 Q102 V104 F132 K137 M138 Q139 N143 F144 L145	L99-I141 HydrophobicContact CD2-CG2 3.71Å; Q102-I141 HydrophobicContact CB-CD1 3.82Å; Q102-I141 HydrophobicContact CB-CG1 3.96Å; Q102-I141 HydrophobicContact CG-CG1 4.18Å; V104-I141 HydrophobicContact CG2-CD1 3.64Å; F132-I141 HydrophobicContact CE1-CD1 3.92Å; F132-I141 HydrophobicContact CZ-CG2 4.46Å; K137-I141 HydrophobicContact CG-CD1 3.83Å; K137-I141 WeakPolarHBondContact O-CB 3.46Å; K137-I141 WeakPolarHBondContact O-CG1 3.34Å; K137-I141 PolarHBondContact O-N 3Å; M138-I141 PolarHBondContact O-N 2.89Å; Q139-I141 PolarHBondContact O-N 2.93Å; I141-N143 PolarHBondContact O-N 2.66Å; I141-F144 PolarHBondContact O-N 2.85Å; I141-L145 HydrophobicContact CG2-CD1 3.86Å; I141-L145 WeakPolarHBondContact O-CG 3.39Å; I141-L145 PolarHBondContact O-N 3.32Å
142	C	94.8	Very high	94	Very high	17 Å²	17	64.6 Å²	64.6	12%	0.115	35%	0.351	C	S	.	.	H	α-helix	trans	-59.4	-47.9	176.7	-70.9	0	0	0	0	111.1	M138 Q139 F144 L145 V146	M138-C142 WeakPolarHBondContact O-CB 3.31Å; M138-C142 PolarHBondContact O-N 3.45Å; M138-C142 PolarHBondContact O-SG 3.39Å; Q139-C142 PolarHBondContact O-N 3.01Å; C142-F144 PolarHBondContact O-N 2.79Å; C142-L145 PolarHBondContact O-N 3.4Å; C142-V146 VanDerWaalsContact O-CG2 3.31Å; C142-V146 WeakPolarHBondContact O-CG2 3.36Å; C142-V146 PolarHBondContact O-N 3.27Å
143	N	94.8	Very high	93.9	Very high	77 Å²	77	65 Å²	65	41%	0.412	35%	0.354	S	S	.	.	H	α-helix	trans	-60.7	-47	177.8	-70.5	-8.3	0	0	0	111.5	Q139 I141 L145 V146 E147	Q139-N143 WeakPolarHBondContact O-CB 3.29Å; Q139-N143 PolarHBondContact O-N 3.1Å; Q139-N143 PolarHBondContact O-ND2 3.37Å; Q139-N143 PolarHBondContact O-OD1 3.37Å; I141-N143 PolarHBondContact O-N 2.66Å; N143-L145 VanDerWaalsContact C-N 3.31Å; N143-L145 PolarHBondContact O-N 2.99Å; N143-V146 PolarHBondContact O-N 3.23Å; N143-E147 WeakPolarHBondContact O-CG 3.26Å; N143-E147 PolarHBondContact O-N 3.47Å
144	F	95.4	Very high	93.8	Very high	57 Å²	57	66 Å²	66	25%	0.25	36%	0.359	C	S	.	.	H	α-helix	trans	-56	-45.1	176.3	172.6	-99.8	0	0	0	112	N140 I141 C142 E147 K148	N140-F144 WeakPolarHBondContact O-CB 3.5Å; N140-F144 PolarHBondContact O-N 2.72Å; I141-F144 PolarHBondContact O-N 2.85Å; C142-F144 PolarHBondContact O-N 2.79Å; F144-E147 PolarHBondContact O-N 2.91Å; F144-K148 HydrophobicContact CD1-CG 4.49Å; F144-K148 HydrophobicContact CD2-CG 4.11Å; F144-K148 HydrophobicContact CE1-CG 4.13Å; F144-K148 HydrophobicContact CE2-CD 4.3Å; F144-K148 HydrophobicContact CE2-CG 3.74Å; F144-K148 HydrophobicContact CG-CG 4.48Å; F144-K148 HydrophobicContact CZ-CG 3.75Å; F144-K148 WeakPolarHBondContact O-CB 3.37Å; F144-K148 VanDerWaalsContact O-CG 3.26Å; F144-K148 WeakPolarHBondContact O-CG 3.32Å; F144-K148 PolarHBondContact O-N 2.8Å
145	L	94.7	Very high	93.9	Very high	1 Å²	1	62.2 Å²	62.2	1%	0.005	34%	0.343	C	S	.	.	H	α-helix	trans	-71.8	-34.1	-179.5	-68.6	170.3	0	0	0	112.5	M72 Y94 L99 I141 C142 N143 E147 K148 L149 I155	M72-L145 HydrophobicContact CE-CD1 3.25Å; M72-L145 HydrophobicContact SD-CD1 3.62Å; Y94-L145 HydrophobicContact CE1-CD2 4.25Å; L99-L145 HydrophobicContact CD2-CD1 4.45Å; I141-L145 HydrophobicContact CG2-CD1 3.86Å; I141-L145 WeakPolarHBondContact O-CG 3.39Å; I141-L145 PolarHBondContact O-N 3.32Å; C142-L145 PolarHBondContact O-N 3.4Å; N143-L145 VanDerWaalsContact C-N 3.31Å; N143-L145 PolarHBondContact O-N 2.99Å; L145-E147 VanDerWaalsContact C-N 3.28Å; L145-E147 PolarHBondContact O-N 2.94Å; L145-K148 PolarHBondContact O-N 3.49Å; L145-L149 HydrophobicContact CB-CD1 4.14Å; L145-L149 HydrophobicContact CD2-CD1 4.09Å; L145-L149 VanDerWaalsContact O-CB 3.25Å; L145-L149 WeakPolarHBondContact O-CB 3.36Å; L145-L149 WeakPolarHBondContact O-CG 3.33Å; L145-L149 PolarHBondContact O-N 3.01Å; L145-I155 HydrophobicContact CB-CD1 3.87Å
146	V	93.6	Very high	93.8	Very high	94 Å²	94	61.5 Å²	61.5	57%	0.57	34%	0.344	S	S	*	.	H	α-helix	trans	-60.5	-38.9	170.2	169.8	0	0	0	0	111.2	C142 N143 I155	C142-V146 VanDerWaalsContact O-CG2 3.31Å; C142-V146 WeakPolarHBondContact O-CG2 3.36Å; C142-V146 PolarHBondContact O-N 3.27Å; N143-V146 PolarHBondContact O-N 3.23Å; V146-I155 HydrophobicContact CG2-CD1 3.64Å
147	E	93.9	Very high	93.7	Very high	145 Å²	145	63.2 Å²	63.2	68%	0.678	35%	0.346	S	S	*	.	H	α-helix	trans	-72.9	-31.9	178.9	-70.9	171	-165.1	0	0	113.4	N143 F144 L145	N143-E147 WeakPolarHBondContact O-CG 3.26Å; N143-E147 PolarHBondContact O-N 3.47Å; F144-E147 PolarHBondContact O-N 2.91Å; L145-E147 VanDerWaalsContact C-N 3.28Å; L145-E147 PolarHBondContact O-N 2.94Å
148	K	94.1	Very high	93.7	Very high	119 Å²	119	61.4 Å²	61.4	52%	0.517	34%	0.341	S	S	.	.	H	α-helix	trans	-95.7	-24.9	-172.9	-64.4	-59.4	176.7	-165.1	0	114.6	Y94 F144 L145	Y94-K148 HydrophobicContact CE1-CB 3.97Å; Y94-K148 WeakPolarHBondContact OH-CB 3.45Å; Y94-K148 WeakPolarHBondContact OH-CG 3.5Å; F144-K148 HydrophobicContact CD1-CG 4.49Å; F144-K148 HydrophobicContact CD2-CG 4.11Å; F144-K148 HydrophobicContact CE1-CG 4.13Å; F144-K148 HydrophobicContact CE2-CD 4.3Å; F144-K148 HydrophobicContact CE2-CG 3.74Å; F144-K148 HydrophobicContact CG-CG 4.48Å; F144-K148 HydrophobicContact CZ-CG 3.75Å; F144-K148 WeakPolarHBondContact O-CB 3.37Å; F144-K148 VanDerWaalsContact O-CG 3.26Å; F144-K148 WeakPolarHBondContact O-CG 3.32Å; F144-K148 PolarHBondContact O-N 2.8Å; L145-K148 PolarHBondContact O-N 3.49Å
149	L	93.9	Very high	93.6	Very high	28 Å²	28	67.1 Å²	67.1	15%	0.147	37%	0.368	C	S	.	.	S	Bend	trans	-100.6	152.5	-178.5	-62.5	169.9	0	0	0	110.4	Y94 I95 L145 V153	Y94-L149 HydrophobicContact CD1-CD2 3.67Å; Y94-L149 HydrophobicContact CD1-CG 4.36Å; Y94-L149 HydrophobicContact CE1-CD2 4.08Å; Y94-L149 HydrophobicContact CE1-CG 4.42Å; I95-L149 HydrophobicContact CD1-CD1 3.93Å; I95-L149 HydrophobicContact CG1-CD1 3.58Å; L145-L149 HydrophobicContact CB-CD1 4.14Å; L145-L149 HydrophobicContact CD2-CD1 4.09Å; L145-L149 VanDerWaalsContact O-CB 3.25Å; L145-L149 WeakPolarHBondContact O-CB 3.36Å; L145-L149 WeakPolarHBondContact O-CG 3.33Å; L145-L149 PolarHBondContact O-N 3.01Å; L149-V153 HydrophobicContact CB-CB 4.13Å; L149-V153 HydrophobicContact CB-CG2 4.04Å; L149-V153 HydrophobicContact CD1-CB 4.17Å; L149-V153 HydrophobicContact CD1-CG1 3.92Å; L149-V153 HydrophobicContact CD1-CG2 4.08Å; L149-V153 HydrophobicContact CD2-CG2 4.4Å; L149-V153 HydrophobicContact CG-CG2 4.41Å
150	D	90.3	Very high	93.7	Very high	98 Å²	98	63.9 Å²	63.9	52%	0.524	35%	0.352	S	S	.	.			trans	-80.9	176.9	175.2	63.1	23	0	0	0	111.4	S152 V153	D150-S152 PolarHBondContact O-N 2.85Å; D150-S152 VanDerWaalsContact OD1-CB 3.28Å; D150-S152 WeakPolarHBondContact OD1-CB 3.36Å; D150-S152 PolarHBondContact OD1-N 3.46Å; D150-S152 VanDerWaalsContact OD1-N 3.08Å; D150-S152 PolarHBondContact OD1-OG 3.48Å; D150-V153 PolarHBondContact O-N 3.22Å; D150-V153 VanDerWaalsContact O-N 3.16Å
151	S	88.3	Confident	93.6	Very high	124 Å²	124	62.7 Å²	62.7	87%	0.867	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-3.2	-178.6	62.9	0	0	0	0	114.8
152	S	86.1	Confident	93.6	Very high	38 Å²	38	63.8 Å²	63.8	27%	0.266	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-3.9	176	76.9	0	0	0	0	112.9	R91 D150	R91-S152 VanDerWaalsContact NH1-CB 3.3Å; R91-S152 PolarHBondContact NH1-O 3.48Å; R91-S152 PolarHBondContact NH1-OG 3.25Å; D150-S152 PolarHBondContact O-N 2.85Å; D150-S152 VanDerWaalsContact OD1-CB 3.28Å; D150-S152 WeakPolarHBondContact OD1-CB 3.36Å; D150-S152 PolarHBondContact OD1-N 3.46Å; D150-S152 VanDerWaalsContact OD1-N 3.08Å; D150-S152 PolarHBondContact OD1-OG 3.48Å
153	V	94.1	Very high	93.6	Very high	16 Å²	16	64.6 Å²	64.6	10%	0.097	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	122.4	169.8	-175.3	0	0	0	0	109.2	R73 V74 I95 L149 D150 I155	R73-V153 CarbonylContact O-C 3.58Å; R73-V153 WeakPolarHBondContact O-CA 3.44Å; V74-V153 HydrophobicContact CG1-CG2 4.4Å; V74-V153 HydrophobicContact CG2-CG1 4.1Å; V74-V153 HydrophobicContact CG2-CG2 4.02Å; I95-V153 HydrophobicContact CD1-CG1 4.11Å; L149-V153 HydrophobicContact CB-CB 4.13Å; L149-V153 HydrophobicContact CB-CG2 4.04Å; L149-V153 HydrophobicContact CD1-CB 4.17Å; L149-V153 HydrophobicContact CD1-CG1 3.92Å; L149-V153 HydrophobicContact CD1-CG2 4.08Å; L149-V153 HydrophobicContact CD2-CG2 4.4Å; L149-V153 HydrophobicContact CG-CG2 4.41Å; D150-V153 PolarHBondContact O-N 3.22Å; D150-V153 VanDerWaalsContact O-N 3.16Å; V153-I155 HydrophobicContact CG1-CG1 4.49Å
154	V	95.3	Very high	93.4	Very high	92 Å²	92	66.3 Å²	66.3	56%	0.558	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.3	120.5	177.3	-179.1	0	0	0	0	108.7	M72 R73	M72-V154 CarbonylContact C-O 3.57Å; M72-V154 WeakPolarHBondContact CA-O 3.29Å; R73-V154 HydrophobicContact CB-CB 4.47Å; R73-V154 PolarHBondContact N-O 2.98Å; R73-V154 PolarHBondContact O-N 3.26Å
155	I	95.4	Very high	93.3	Very high	40 Å²	40	65.1 Å²	65.1	21%	0.205	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	117.5	174.5	-61	170.6	0	0	0	107.6	V70 M72 L145 V146 V153	V70-I155 HydrophobicContact CG1-CG2 3.67Å; M72-I155 HydrophobicContact CE-CD1 4.32Å; M72-I155 HydrophobicContact CE-CG1 4.37Å; M72-I155 HydrophobicContact CE-CG2 4.38Å; M72-I155 HydrophobicContact CG-CG1 4.11Å; L145-I155 HydrophobicContact CB-CD1 3.87Å; V146-I155 HydrophobicContact CG2-CD1 3.64Å; V153-I155 HydrophobicContact CG1-CG1 4.49Å
156	S	94	Very high	93.3	Very high	31 Å²	31	66.6 Å²	66.6	22%	0.217	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-67.1	151.7	178.8	78.7	0	0	0	0	110.7	V71	V71-S156 PolarHBondContact N-OG 2.97Å; V71-S156 WeakPolarHBondContact O-CB 3.5Å; V71-S156 PolarHBondContact O-N 3.48Å; V71-S156 PolarHBondContact O-OG 2.92Å
157	P	92.1	Very high	93.2	Very high	82 Å²	82	63.2 Å²	63.2	53%	0.532	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-57.8	146.5	165.7	-18.5	30.3	0	0	0	110.5	K232	P157-K232 VanDerWaalsContact CB-NZ 3.26Å
158	P	94.6	Very high	93.2	Very high	23 Å²	23	61 Å²	61	15%	0.149	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-66.1	137.5	179.2	26.9	-34.5	0	0	0	110.9	Q69 V70 M138 F160 V229	Q69-P158 WeakPolarHBondContact O-CA 3.25Å; V70-P158 HydrophobicContact CG2-CB 3.94Å; M138-P158 HydrophobicContact CE-CB 3.84Å; M138-P158 HydrophobicContact CE-CG 3.98Å; M138-P158 HydrophobicContact SD-CB 3.58Å; M138-P158 VanDerWaalsContact SD-CB 3.58Å; M138-P158 HydrophobicContact SD-CG 4.36Å; P158-F160 HydrophobicContact CB-CE2 4.03Å; P158-F160 HydrophobicContact CB-CZ 3.93Å; P158-F160 HydrophobicContact CG-CE2 3.86Å; P158-F160 HydrophobicContact CG-CZ 3.88Å; P158-V229 HydrophobicContact CG-CG2 4.49Å
159	Q	94.9	Very high	93.2	Very high	123 Å²	123	60.3 Å²	60.3	58%	0.575	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.1	117.8	170.7	-63.5	-173.9	9.3	0	0	108.8	A68 Q69	A68-Q159 CarbonylContact C-O 3.59Å; A68-Q159 VanDerWaalsContact CA-O 3.26Å; A68-Q159 WeakPolarHBondContact CA-O 3.42Å; Q69-Q159 PolarHBondContact N-O 3.31Å; Q69-Q159 PolarHBondContact O-N 3.46Å
160	F	95.4	Very high	93.3	Very high	22 Å²	22	60.1 Å²	60.1	10%	0.096	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	139	179.2	-61.1	-82.4	0	0	0	110	P65 R67 A68 F135 M138 P158 V229 K232 I233 A236	P65-F160 HydrophobicContact CB-CB 3.75Å; P65-F160 HydrophobicContact CG-CB 3.63Å; P65-F160 HydrophobicContact CG-CD1 4.14Å; P65-F160 HydrophobicContact CG-CG 4.15Å; R67-F160 WeakPolarHBondContact O-CA 3.37Å; A68-F160 HydrophobicContact CB-CD1 3.67Å; A68-F160 HydrophobicContact CB-CE1 3.66Å; F135-F160 HydrophobicContact CB-CE1 4.48Å; F135-F160 HydrophobicContact CD1-CD1 4.26Å; F135-F160 AromaticContact CD1-CE1 3.85Å; F135-F160 HydrophobicContact CD1-CE1 3.85Å; F135-F160 HydrophobicContact CD2-CD1 4.21Å; F135-F160 AromaticContact CD2-CE1 3.83Å; F135-F160 HydrophobicContact CD2-CE1 3.83Å; F135-F160 AromaticContact CE1-CD1 3.91Å; F135-F160 HydrophobicContact CE1-CD1 3.91Å; F135-F160 AromaticContact CE1-CE1 3.99Å; F135-F160 HydrophobicContact CE1-CE1 3.99Å; F135-F160 AromaticContact CE2-CD1 3.82Å; F135-F160 HydrophobicContact CE2-CD1 3.82Å; F135-F160 AromaticContact CE2-CE1 3.93Å; F135-F160 HydrophobicContact CE2-CE1 3.93Å; F135-F160 HydrophobicContact CG-CD1 4.42Å; F135-F160 AromaticContact CG-CE1 3.79Å; F135-F160 HydrophobicContact CG-CE1 3.79Å; F135-F160 AromaticContact CZ-CD1 3.66Å; F135-F160 HydrophobicContact CZ-CD1 3.66Å; F135-F160 HydrophobicContact CZ-CE1 4.01Å; M138-F160 HydrophobicContact CE-CE1 4.18Å; M138-F160 HydrophobicContact CE-CZ 3.98Å; P158-F160 HydrophobicContact CB-CE2 4.03Å; P158-F160 HydrophobicContact CB-CZ 3.93Å; P158-F160 HydrophobicContact CG-CE2 3.86Å; P158-F160 HydrophobicContact CG-CZ 3.88Å; F160-V229 HydrophobicContact CE2-CG1 4.33Å; F160-V229 HydrophobicContact CZ-CG1 3.8Å; F160-K232 HydrophobicContact CD2-CB 3.76Å; F160-K232 HydrophobicContact CE2-CB 3.78Å; F160-K232 HydrophobicContact CE2-CD 4.45Å; F160-I233 HydrophobicContact CD1-CG1 3.9Å; F160-I233 HydrophobicContact CD2-CG1 4.15Å; F160-I233 HydrophobicContact CE1-CD1 4.09Å; F160-I233 HydrophobicContact CE1-CG1 3.74Å; F160-I233 HydrophobicContact CE2-CG1 4Å; F160-I233 HydrophobicContact CG-CG1 4.11Å; F160-I233 HydrophobicContact CZ-CD1 4.16Å; F160-I233 HydrophobicContact CZ-CG1 3.81Å; F160-A236 HydrophobicContact CB-CB 3.89Å
161	Y	94.9	Very high	93.5	Very high	87 Å²	87	57.5 Å²	57.5	34%	0.341	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	167.4	-179.6	68.7	-82	0	0	0	110.9	P65 D66 R67 Q69 T131	P65-Y161 WeakPolarHBondContact CB-O 3.45Å; D66-Y161 PolarHBondContact N-O 2.93Å; R67-Y161 HydrophobicContact CB-CD1 3.86Å; R67-Y161 HydrophobicContact CB-CD2 4.04Å; R67-Y161 HydrophobicContact CB-CE1 3.4Å; R67-Y161 VanDerWaalsContact CB-CE1 3.4Å; R67-Y161 HydrophobicContact CB-CE2 3.61Å; R67-Y161 HydrophobicContact CB-CG 4.15Å; R67-Y161 HydrophobicContact CG-CE1 4.46Å; R67-Y161 HydrophobicContact CG-CE2 3.94Å; R67-Y161 PolarHBondContact N-O 3.07Å; R67-Y161 VanDerWaalsContact N-O 3.08Å; R67-Y161 PolarHBondContact O-N 3.45Å; Q69-Y161 HydrophobicContact CB-CE1 4.09Å; T131-Y161 WeakPolarHBondContact CG2-OH 2.85Å
162	H	95.4	Very high	93.8	Very high	25 Å²	25	59.7 Å²	59.7	12%	0.116	32%	0.321	C	S	.	.			trans	-103.9	140.3	174.6	-58.6	83.8	0	0	0	111.9	G63 G64 P65 D66 V167 A236 I238	G63-H162 PolarHBondContact O-NE2 3.27Å; G64-H162 PolarHBondContact O-CD2 2.88Å; G64-H162 VanDerWaalsContact O-CD2 3.31Å; G64-H162 PolarHBondContact O-NE2 3.49Å; P65-H162 WeakPolarHBondContact CA-NE2 3.39Å; D66-H162 WeakPolarHBondContact OD1-CA 3.5Å; H162-V167 HydrophobicContact CB-CG2 3.52Å; H162-A236 PolarHBondContact CE1-O 2.71Å; H162-I238 HydrophobicContact CB-CD1 4.19Å; H162-I238 VanDerWaalsContact CE1-CD1 3.42Å; H162-I238 WeakPolarHBondContact CE1-CD1 3.35Å; H162-I238 WeakPolarHBondContact CE1-CG1 3.28Å; H162-I238 WeakPolarHBondContact ND1-CD1 3.48Å
163	T	94.9	Very high	94.3	Very high	35 Å²	35	62.5 Å²	62.5	22%	0.215	33%	0.33	C	S	.	.			trans	-65.8	148.5	162.9	64.1	0	0	0	0	110.4	D66 R67 G165 S166 V167	D66-T163 PolarHBondContact OD1-N 3.38Å; D66-T163 WeakPolarHBondContact OD2-CB 3.22Å; D66-T163 VanDerWaalsContact OD2-CG2 3.31Å; D66-T163 WeakPolarHBondContact OD2-CG2 3.31Å; D66-T163 PolarHBondContact OD2-OG1 3.17Å; R67-T163 HydrophobicContact CG-CG2 3.65Å; T163-G165 PolarHBondContact O-N 3.34Å; T163-G165 VanDerWaalsContact O-N 3.14Å; T163-S166 WeakPolarHBondContact O-CB 3.39Å; T163-S166 PolarHBondContact O-N 3.37Å; T163-S166 PolarHBondContact OG1-N 2.93Å; T163-V167 PolarHBondContact O-N 3.5Å
164	P	90.4	Very high	94.5	Very high	113 Å²	113	61.8 Å²	61.8	73%	0.734	33%	0.326	S	S	*	.	H	α-helix	trans	-52.9	-37.3	176.1	-28	35.2	0	0	0	113.3	V167 E168	P164-V167 PolarHBondContact O-N 2.92Å; P164-E168 PolarHBondContact O-N 3.04Å; P164-E168 VanDerWaalsContact O-N 3.07Å
165	G	93.2	Very high	94.6	Very high	32 Å²	32	58 Å²	58	33%	0.33	30%	0.303	S	S	.	.	H	α-helix	trans	-66.6	-36.6	177	0	0	0	0	0	113.5	T163 E168 N169	T163-G165 PolarHBondContact O-N 3.34Å; T163-G165 VanDerWaalsContact O-N 3.14Å; G165-E168 PolarHBondContact O-N 2.96Å; G165-N169 VanDerWaalsContact O-CB 3.31Å; G165-N169 WeakPolarHBondContact O-CB 3.26Å; G165-N169 PolarHBondContact O-N 3.27Å; G165-N169 PolarHBondContact O-ND2 3.26Å; G165-N169 VanDerWaalsContact O-ND2 3.13Å
166	S	93.5	Very high	94.7	Very high	31 Å²	31	60.3 Å²	60.3	22%	0.217	32%	0.315	C	S	.	.	H	α-helix	trans	-64.1	-42.6	175.6	-175.2	0	0	0	0	111.7	D66 T163 N169 L170	D66-S166 WeakPolarHBondContact OD2-CB 3.3Å; T163-S166 WeakPolarHBondContact O-CB 3.39Å; T163-S166 PolarHBondContact O-N 3.37Å; T163-S166 PolarHBondContact OG1-N 2.93Å; S166-N169 PolarHBondContact O-N 3.5Å; S166-L170 WeakPolarHBondContact O-CB 3.38Å; S166-L170 PolarHBondContact O-N 3.21Å
167	V	92.5	Very high	94.9	Very high	23 Å²	23	60.6 Å²	60.6	14%	0.139	32%	0.315	C	S	.	.	H	α-helix	trans	-66.2	-42.7	178.8	-175.3	0	0	0	0	111.1	H162 T163 P164 L170 R171 E210 I238	H162-V167 HydrophobicContact CB-CG2 3.52Å; T163-V167 PolarHBondContact O-N 3.5Å; P164-V167 PolarHBondContact O-N 2.92Å; V167-L170 PolarHBondContact O-N 2.98Å; V167-R171 PolarHBondContact O-N 3.28Å; V167-R171 VanDerWaalsContact O-N 3.1Å; V167-E210 WeakPolarHBondContact CG1-OE2 3.3Å; V167-I238 HydrophobicContact CG1-CD1 4.42Å; V167-I238 HydrophobicContact CG2-CD1 3.71Å
168	E	93.6	Very high	95.1	Very high	100 Å²	100	56.7 Å²	56.7	47%	0.467	29%	0.29	S	S	.	.	H	α-helix	trans	-62.9	-45.3	175.5	-174.6	176.7	-174.6	0	0	112.6	P164 G165 L170 R171 R172	P164-E168 PolarHBondContact O-N 3.04Å; P164-E168 VanDerWaalsContact O-N 3.07Å; G165-E168 PolarHBondContact O-N 2.96Å; E168-L170 VanDerWaalsContact C-N 3.27Å; E168-L170 PolarHBondContact O-N 3.47Å; E168-R171 PolarHBondContact O-N 3.35Å; E168-R172 PolarHBondContact O-N 3.42Å
169	N	95.1	Very high	95.3	Very high	103 Å²	103	57.4 Å²	57.4	55%	0.551	29%	0.294	S	S	*	.	H	α-helix	trans	-59.9	-39.9	176.7	-75.8	-28.6	0	0	0	111.7	G165 S166 R172 Q173	G165-N169 VanDerWaalsContact O-CB 3.31Å; G165-N169 WeakPolarHBondContact O-CB 3.26Å; G165-N169 PolarHBondContact O-N 3.27Å; G165-N169 PolarHBondContact O-ND2 3.26Å; G165-N169 VanDerWaalsContact O-ND2 3.13Å; S166-N169 PolarHBondContact O-N 3.5Å; N169-R172 PolarHBondContact O-N 2.87Å; N169-Q173 WeakPolarHBondContact O-CB 3.46Å; N169-Q173 PolarHBondContact O-N 3.48Å
170	L	95.4	Very high	95.4	Very high	24 Å²	24	56.4 Å²	56.4	13%	0.126	29%	0.29	C	S	.	.	H	α-helix	trans	-63.7	-44.4	177	-169.7	68.6	0	0	0	111.8	V61 S166 V167 E168 Q173 A174 I238 A240	V61-L170 HydrophobicContact CB-CD1 4.19Å; V61-L170 HydrophobicContact CG2-CD1 3.65Å; V61-L170 HydrophobicContact CG2-CG 3.96Å; S166-L170 WeakPolarHBondContact O-CB 3.38Å; S166-L170 PolarHBondContact O-N 3.21Å; V167-L170 PolarHBondContact O-N 2.98Å; E168-L170 VanDerWaalsContact C-N 3.27Å; E168-L170 PolarHBondContact O-N 3.47Å; L170-Q173 WeakPolarHBondContact O-CB 3.42Å; L170-Q173 PolarHBondContact O-N 3.19Å; L170-A174 PolarHBondContact O-N 3.17Å; L170-I238 HydrophobicContact CD2-CB 4.16Å; L170-I238 HydrophobicContact CD2-CG2 3.8Å; L170-A240 HydrophobicContact CD2-CB 4.22Å; L170-A240 HydrophobicContact CG-CB 4.03Å
171	R	94.4	Very high	95.5	Very high	43 Å²	43	57.9 Å²	57.9	16%	0.162	30%	0.298	C	S	.	.	H	α-helix	trans	-60.5	-45.5	174.6	-74	-176.2	-76.8	135.7	-2.3	112	V167 E168 Q173 A174 C175 E210 A240	V167-R171 PolarHBondContact O-N 3.28Å; V167-R171 VanDerWaalsContact O-N 3.1Å; E168-R171 PolarHBondContact O-N 3.35Å; R171-Q173 VanDerWaalsContact C-N 3.31Å; R171-Q173 PolarHBondContact O-N 3.37Å; R171-A174 WeakPolarHBondContact O-CB 3.18Å; R171-A174 PolarHBondContact O-N 3.42Å; R171-C175 PolarHBondContact O-N 2.74Å; R171-E210 WeakPolarHBondContact CD-OE2 3.41Å; R171-E210 IonicContact NE-OE2 3.84Å; R171-E210 PolarHBondContact NE-OE2 2.93Å; R171-A240 HydrophobicContact CG-CB 4.31Å
172	R	95.3	Very high	95.7	Very high	170 Å²	170	53.7 Å²	53.7	64%	0.642	28%	0.282	S	S	*	.	H	α-helix	trans	-60.2	-43.2	176.1	-179.9	179.1	170.9	177	-2	111.3	E168 N169 A174 C175 L176	E168-R172 PolarHBondContact O-N 3.42Å; N169-R172 PolarHBondContact O-N 2.87Å; R172-A174 VanDerWaalsContact C-N 3.35Å; R172-A174 PolarHBondContact O-N 3.46Å; R172-C175 PolarHBondContact O-N 2.88Å; R172-L176 HydrophobicContact CG-CD1 4.25Å; R172-L176 WeakPolarHBondContact O-CG 3.47Å; R172-L176 PolarHBondContact O-N 2.86Å
173	Q	96.8	Very high	95.8	Very high	98 Å²	98	58.5 Å²	58.5	46%	0.458	30%	0.299	S	S	.	.	H	α-helix	trans	-61.7	-43.6	177.2	-173.2	60.7	27.2	0	0	111.4	V61 N169 L170 R171 C175 L176 V177	V61-Q173 HydrophobicContact CG1-CG 4.47Å; N169-Q173 WeakPolarHBondContact O-CB 3.46Å; N169-Q173 PolarHBondContact O-N 3.48Å; L170-Q173 WeakPolarHBondContact O-CB 3.42Å; L170-Q173 PolarHBondContact O-N 3.19Å; R171-Q173 VanDerWaalsContact C-N 3.31Å; R171-Q173 PolarHBondContact O-N 3.37Å; Q173-C175 PolarHBondContact O-N 2.96Å; Q173-L176 PolarHBondContact O-N 2.94Å; Q173-V177 HydrophobicContact CG-CG2 4.47Å; Q173-V177 VanDerWaalsContact O-CG2 3.3Å; Q173-V177 WeakPolarHBondContact O-CG2 3.46Å; Q173-V177 PolarHBondContact O-N 3.03Å
174	A	97.2	Very high	95.9	Very high	1 Å²	1	61.5 Å²	61.5	1%	0.008	31%	0.306	C	S	.	.	H	α-helix	trans	-54.7	-52.9	174.1	0	0	0	0	0	110.7	S59 V61 L170 R171 R172 L176 V177 A178 A240	S59-A174 WeakPolarHBondContact CB-O 3.37Å; S59-A174 WeakPolarHBondContact OG-CA 3.37Å; S59-A174 PolarHBondContact OG-O 3.43Å; V61-A174 HydrophobicContact CG2-CB 3.7Å; L170-A174 PolarHBondContact O-N 3.17Å; R171-A174 WeakPolarHBondContact O-CB 3.18Å; R171-A174 PolarHBondContact O-N 3.42Å; R172-A174 VanDerWaalsContact C-N 3.35Å; R172-A174 PolarHBondContact O-N 3.46Å; A174-L176 PolarHBondContact O-N 3.35Å; A174-V177 PolarHBondContact O-N 3.16Å; A174-A178 PolarHBondContact O-N 3.33Å; A174-A240 HydrophobicContact CB-CB 4.16Å
175	C	97	Very high	96.3	Very high	12 Å²	12	60.9 Å²	60.9	8%	0.081	29%	0.292	C	S	.	.	H	α-helix	trans	-58.1	-45.2	-179.7	-175.1	0	0	0	0	112.4	R171 R172 Q173 V177 A178 V179	R171-C175 PolarHBondContact O-N 2.74Å; R172-C175 PolarHBondContact O-N 2.88Å; Q173-C175 PolarHBondContact O-N 2.96Å; C175-V177 PolarHBondContact O-N 2.89Å; C175-A178 WeakPolarHBondContact O-CB 3.34Å; C175-A178 PolarHBondContact O-N 2.92Å; C175-V179 WeakPolarHBondContact O-CG2 3.35Å; C175-V179 PolarHBondContact O-N 3.43Å
176	L	97.6	Very high	96.4	Very high	89 Å²	89	59.4 Å²	59.4	47%	0.466	28%	0.277	S	S	.	.	H	α-helix	trans	-62.4	-42.6	178.1	-70.1	176	0	0	0	112.8	R172 Q173 A174 A178 V179 E180	R172-L176 HydrophobicContact CG-CD1 4.25Å; R172-L176 WeakPolarHBondContact O-CG 3.47Å; R172-L176 PolarHBondContact O-N 2.86Å; Q173-L176 PolarHBondContact O-N 2.94Å; A174-L176 PolarHBondContact O-N 3.35Å; L176-A178 VanDerWaalsContact C-N 3.32Å; L176-A178 PolarHBondContact O-N 2.92Å; L176-V179 WeakPolarHBondContact O-CB 3.33Å; L176-V179 PolarHBondContact O-N 2.81Å; L176-E180 PolarHBondContact O-N 3.49Å
177	V	98.1	Very high	96.5	Very high	36 Å²	36	60.2 Å²	60.2	22%	0.218	28%	0.277	C	S	.	.	H	α-helix	trans	-65.3	-37.5	176.1	175	0	0	0	0	110.9	Q173 A174 C175 E180 N181	Q173-V177 HydrophobicContact CG-CG2 4.47Å; Q173-V177 VanDerWaalsContact O-CG2 3.3Å; Q173-V177 WeakPolarHBondContact O-CG2 3.46Å; Q173-V177 PolarHBondContact O-N 3.03Å; A174-V177 PolarHBondContact O-N 3.16Å; C175-V177 PolarHBondContact O-N 2.89Å; V177-E180 PolarHBondContact O-N 3.2Å; V177-N181 WeakPolarHBondContact O-CB 3.38Å; V177-N181 PolarHBondContact O-N 2.9Å; V177-N181 PolarHBondContact O-ND2 2.81Å
178	A	98	Very high	96.7	Very high	0 Å²	0	64.6 Å²	64.6	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-65.2	-40.6	176.2	0	0	0	0	0	111.8	A174 C175 L176 N181 A182 V244	A174-A178 PolarHBondContact O-N 3.33Å; C175-A178 WeakPolarHBondContact O-CB 3.34Å; C175-A178 PolarHBondContact O-N 2.92Å; L176-A178 VanDerWaalsContact C-N 3.32Å; L176-A178 PolarHBondContact O-N 2.92Å; A178-N181 PolarHBondContact O-N 3.4Å; A178-A182 WeakPolarHBondContact O-CB 3.25Å; A178-A182 PolarHBondContact O-N 3.08Å; A178-V244 HydrophobicContact CB-CB 4.17Å; A178-V244 HydrophobicContact CB-CG2 3.75Å
179	V	97.6	Very high	96.8	Very high	39 Å²	39	63 Å²	63	24%	0.236	29%	0.293	C	S	.	.	H	α-helix	trans	-60.6	-47.7	173	169.9	0	0	0	0	110.9	C175 L176 N181 A182 W183 I203 V244 I246	C175-V179 WeakPolarHBondContact O-CG2 3.35Å; C175-V179 PolarHBondContact O-N 3.43Å; L176-V179 WeakPolarHBondContact O-CB 3.33Å; L176-V179 PolarHBondContact O-N 2.81Å; V179-N181 VanDerWaalsContact C-N 3.33Å; V179-N181 PolarHBondContact O-N 2.75Å; V179-A182 PolarHBondContact O-N 3.42Å; V179-W183 WeakPolarHBondContact O-CB 3.49Å; V179-W183 PolarHBondContact O-N 3.48Å; V179-I203 HydrophobicContact CG2-CG2 4.45Å; V179-V244 HydrophobicContact CG2-CB 4.34Å; V179-V244 HydrophobicContact CG2-CG1 3.86Å; V179-V244 HydrophobicContact CG2-CG2 4.2Å; V179-I246 HydrophobicContact CB-CD1 4.35Å; V179-I246 HydrophobicContact CG1-CD1 3.89Å; V179-I246 HydrophobicContact CG2-CD1 4.46Å
180	E	97.9	Very high	96.7	Very high	102 Å²	102	58.1 Å²	58.1	48%	0.477	27%	0.267	S	S	.	.	H	α-helix	trans	-61.9	-42.6	179.2	-165.4	-170.4	163.8	0	0	111.5	L176 V177 A182 W183 R184	L176-E180 PolarHBondContact O-N 3.49Å; V177-E180 PolarHBondContact O-N 3.2Å; E180-A182 PolarHBondContact O-N 3.27Å; E180-W183 PolarHBondContact O-N 3.03Å; E180-R184 VanDerWaalsContact CD-NH2 3.26Å; E180-R184 WeakPolarHBondContact O-CB 3.37Å; E180-R184 PolarHBondContact O-N 3.04Å; E180-R184 IonicContact OE1-CZ 3.96Å; E180-R184 IonicContact OE1-NH2 2.76Å; E180-R184 PolarHBondContact OE1-NH2 3.47Å; E180-R184 IonicContact OE2-NH2 3.98Å
181	N	97.9	Very high	96.6	Very high	52 Å²	52	61.5 Å²	61.5	28%	0.278	29%	0.285	S	S	.	.	H	α-helix	trans	-63.4	-40.4	176.4	-73.1	-16.4	0	0	0	112.2	T58 V177 A178 V179 R184 K185	T58-N181 PolarHBondContact O-ND2 2.82Å; V177-N181 WeakPolarHBondContact O-CB 3.38Å; V177-N181 PolarHBondContact O-N 2.9Å; V177-N181 PolarHBondContact O-ND2 2.81Å; A178-N181 PolarHBondContact O-N 3.4Å; V179-N181 VanDerWaalsContact C-N 3.33Å; V179-N181 PolarHBondContact O-N 2.75Å; N181-R184 PolarHBondContact OD1-NH1 3.37Å; N181-K185 WeakPolarHBondContact O-CB 3.14Å; N181-K185 PolarHBondContact O-N 3.07Å; N181-K185 VanDerWaalsContact O-N 3.09Å
182	A	97.6	Very high	96.6	Very high	0 Å²	0	66.8 Å²	66.8	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-63.3	-47.7	174.4	0	0	0	0	0	111.2	V55 A178 V179 E180 R184 K185 A186 I246	V55-A182 HydrophobicContact CG2-CB 4.05Å; V55-A182 WeakPolarHBondContact CG2-O 3.42Å; A178-A182 WeakPolarHBondContact O-CB 3.25Å; A178-A182 PolarHBondContact O-N 3.08Å; V179-A182 PolarHBondContact O-N 3.42Å; E180-A182 PolarHBondContact O-N 3.27Å; A182-R184 PolarHBondContact O-N 3.2Å; A182-K185 PolarHBondContact O-N 3.16Å; A182-A186 PolarHBondContact O-N 2.97Å; A182-I246 HydrophobicContact CB-CD1 3.73Å; A182-I246 HydrophobicContact CB-CG1 4Å
183	W	97.3	Very high	96.4	Very high	126 Å²	126	63 Å²	63	48%	0.477	31%	0.311	S	S	.	.	H	α-helix	trans	-60.1	-46.6	178.7	180	86.2	0	0	0	112.1	V179 E180 K185 A186 Q187 F248	V179-W183 WeakPolarHBondContact O-CB 3.49Å; V179-W183 PolarHBondContact O-N 3.48Å; E180-W183 PolarHBondContact O-N 3.03Å; W183-K185 VanDerWaalsContact C-N 3.34Å; W183-K185 PolarHBondContact O-N 3.46Å; W183-A186 PolarHBondContact O-N 3.02Å; W183-Q187 WeakPolarHBondContact O-CB 3.17Å; W183-Q187 PolarHBondContact O-N 3.3Å; W183-F248 HydrophobicContact CB-CZ 4.22Å; W183-F248 AromaticContact CD1-CE1 3.7Å; W183-F248 AromaticContact CD1-CZ 3.64Å; W183-F248 HydrophobicContact CG-CZ 4.32Å
184	R	97.9	Very high	96.1	Very high	97 Å²	97	59.5 Å²	59.5	37%	0.366	30%	0.301	S	S	.	.	H	α-helix	trans	-59.1	-45.6	177.6	-164.8	-177.8	-57.3	116.2	1.6	111.1	E180 N181 A182 A186 Q187 E188	E180-R184 VanDerWaalsContact CD-NH2 3.26Å; E180-R184 WeakPolarHBondContact O-CB 3.37Å; E180-R184 PolarHBondContact O-N 3.04Å; E180-R184 IonicContact OE1-CZ 3.96Å; E180-R184 IonicContact OE1-NH2 2.76Å; E180-R184 PolarHBondContact OE1-NH2 3.47Å; E180-R184 IonicContact OE2-NH2 3.98Å; N181-R184 PolarHBondContact OD1-NH1 3.37Å; A182-R184 PolarHBondContact O-N 3.2Å; R184-A186 PolarHBondContact O-N 3.14Å; R184-Q187 PolarHBondContact O-N 3.07Å; R184-E188 WeakPolarHBondContact O-CG 3.35Å; R184-E188 PolarHBondContact O-N 3.32Å
185	K	97.6	Very high	95.9	Very high	101 Å²	101	61.7 Å²	61.7	44%	0.439	31%	0.311	S	S	.	.	H	α-helix	trans	-58.9	-45.5	174.8	-178.3	-178.6	-71.3	172.7	0	112	V55 S56 N181 A182 W183 Q187 E188 V189	V55-K185 HydrophobicContact CB-CD 4.49Å; V55-K185 HydrophobicContact CG1-CD 4.3Å; V55-K185 HydrophobicContact CG1-CG 4.2Å; S56-K185 PolarHBondContact O-NZ 3.26Å; N181-K185 WeakPolarHBondContact O-CB 3.14Å; N181-K185 PolarHBondContact O-N 3.07Å; N181-K185 VanDerWaalsContact O-N 3.09Å; A182-K185 PolarHBondContact O-N 3.16Å; W183-K185 VanDerWaalsContact C-N 3.34Å; W183-K185 PolarHBondContact O-N 3.46Å; K185-Q187 VanDerWaalsContact C-N 3.34Å; K185-Q187 PolarHBondContact O-N 2.85Å; K185-E188 PolarHBondContact O-N 3.36Å; K185-V189 HydrophobicContact CG-CG2 4.45Å; K185-V189 WeakPolarHBondContact O-CB 3.41Å; K185-V189 VanDerWaalsContact O-CG2 3.25Å; K185-V189 WeakPolarHBondContact O-CG2 3.3Å; K185-V189 PolarHBondContact O-N 2.98Å
186	A	96.5	Very high	95.7	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-62.5	-42.7	178.6	0	0	0	0	0	111.8	V53 V55 A182 W183 R184 V189 C190 L197 F248	V53-A186 HydrophobicContact CG1-CB 4.19Å; V55-A186 HydrophobicContact CB-CB 4.46Å; V55-A186 HydrophobicContact CG1-CB 3.8Å; V55-A186 HydrophobicContact CG2-CB 3.9Å; A182-A186 PolarHBondContact O-N 2.97Å; W183-A186 PolarHBondContact O-N 3.02Å; R184-A186 PolarHBondContact O-N 3.14Å; A186-V189 PolarHBondContact O-N 3.46Å; A186-C190 WeakPolarHBondContact O-CB 3.49Å; A186-C190 PolarHBondContact O-N 3Å; A186-C190 PolarHBondContact O-SG 3.3Å; A186-C190 VanDerWaalsContact O-SG 3.35Å; A186-L197 HydrophobicContact CB-CD1 3.69Å; A186-L197 HydrophobicContact CB-CD2 4.07Å; A186-F248 HydrophobicContact CB-CD2 3.76Å; A186-F248 HydrophobicContact CB-CE2 3.79Å
187	Q	96.4	Very high	95.5	Very high	48 Å²	48	60.8 Å²	60.8	22%	0.224	31%	0.309	C	S	.	.	H	α-helix	trans	-63.5	-44.7	179.6	-174.7	59.2	76.1	0	0	112	W183 R184 K185 N191 L197	W183-Q187 WeakPolarHBondContact O-CB 3.17Å; W183-Q187 PolarHBondContact O-N 3.3Å; R184-Q187 PolarHBondContact O-N 3.07Å; K185-Q187 VanDerWaalsContact C-N 3.34Å; K185-Q187 PolarHBondContact O-N 2.85Å; Q187-N191 PolarHBondContact NE2-ND2 3.19Å; Q187-N191 PolarHBondContact NE2-OD1 2.97Å; Q187-N191 WeakPolarHBondContact O-CB 3.49Å; Q187-N191 PolarHBondContact O-N 2.94Å; Q187-N191 PolarHBondContact O-ND2 2.87Å; Q187-L197 HydrophobicContact CB-CD2 4.07Å
188	E	96.3	Very high	95.2	Very high	116 Å²	116	59.8 Å²	59.8	54%	0.542	31%	0.305	S	S	.	.	H	α-helix	trans	-63.2	-47	177	-72.7	170	-172.9	0	0	111.7	R184 K185 N191 L192	R184-E188 WeakPolarHBondContact O-CG 3.35Å; R184-E188 PolarHBondContact O-N 3.32Å; K185-E188 PolarHBondContact O-N 3.36Å; E188-N191 PolarHBondContact O-N 2.92Å; E188-L192 WeakPolarHBondContact O-CB 3.21Å; E188-L192 PolarHBondContact O-N 2.88Å
189	V	95.1	Very high	95	Very high	65 Å²	65	64.4 Å²	64.4	39%	0.394	33%	0.325	S	S	.	.	H	α-helix	trans	-62.6	-46.6	178.5	170.9	0	0	0	0	111.1	V53 K185 A186 N191 L192 V193	V53-V189 HydrophobicContact CG2-CG1 4.5Å; K185-V189 HydrophobicContact CG-CG2 4.45Å; K185-V189 WeakPolarHBondContact O-CB 3.41Å; K185-V189 VanDerWaalsContact O-CG2 3.25Å; K185-V189 WeakPolarHBondContact O-CG2 3.3Å; K185-V189 PolarHBondContact O-N 2.98Å; A186-V189 PolarHBondContact O-N 3.46Å; V189-N191 PolarHBondContact O-N 2.88Å; V189-L192 WeakPolarHBondContact O-CB 3.4Å; V189-L192 PolarHBondContact O-N 3.44Å; V189-V193 WeakPolarHBondContact O-CG2 3.25Å; V189-V193 PolarHBondContact O-N 3.09Å; V189-V193 VanDerWaalsContact O-N 3.15Å
190	C	93.3	Very high	94.8	Very high	1 Å²	1	64.6 Å²	64.6	1%	0.007	33%	0.328	C	S	.	.	H	α-helix	trans	-59.7	-45.7	177.6	-76.5	0	0	0	0	112.1	A186 L192 V193 G194 Q195 L197	A186-C190 WeakPolarHBondContact O-CB 3.49Å; A186-C190 PolarHBondContact O-N 3Å; A186-C190 PolarHBondContact O-SG 3.3Å; A186-C190 VanDerWaalsContact O-SG 3.35Å; C190-L192 VanDerWaalsContact C-N 3.32Å; C190-L192 PolarHBondContact O-N 3.34Å; C190-V193 WeakPolarHBondContact O-CG2 3.37Å; C190-V193 PolarHBondContact O-N 2.79Å; C190-G194 PolarHBondContact O-N 3.46Å; C190-Q195 CarbonylContact C-O 3.31Å; C190-Q195 VanDerWaalsContact C-O 3.31Å; C190-Q195 CarbonylContact O-C 3.57Å; C190-Q195 PolarHBondContact O-N 2.97Å; C190-L197 HydrophobicContact CB-CB 4.33Å
191	N	93.1	Very high	94.6	Very high	95 Å²	95	61.4 Å²	61.4	51%	0.508	31%	0.313	S	S	.	.	H	α-helix	trans	-60.6	-42.4	178.3	-73.9	-17.4	0	0	0	111.6	Q187 E188 V189 V193 G194	Q187-N191 PolarHBondContact NE2-ND2 3.19Å; Q187-N191 PolarHBondContact NE2-OD1 2.97Å; Q187-N191 WeakPolarHBondContact O-CB 3.49Å; Q187-N191 PolarHBondContact O-N 2.94Å; Q187-N191 PolarHBondContact O-ND2 2.87Å; E188-N191 PolarHBondContact O-N 2.92Å; V189-N191 PolarHBondContact O-N 2.88Å; N191-V193 VanDerWaalsContact C-N 3.35Å; N191-V193 PolarHBondContact O-N 3.11Å; N191-G194 PolarHBondContact O-N 2.78Å; N191-G194 VanDerWaalsContact O-N 3.13Å
192	L	93.9	Very high	94.4	Very high	155 Å²	155	61 Å²	61	81%	0.812	31%	0.311	S	S	*	.	H	α-helix	trans	-61	-41.2	178.9	-178.2	64.3	0	0	0	112.3	E188 V189 C190 G194	E188-L192 WeakPolarHBondContact O-CB 3.21Å; E188-L192 PolarHBondContact O-N 2.88Å; V189-L192 WeakPolarHBondContact O-CB 3.4Å; V189-L192 PolarHBondContact O-N 3.44Å; C190-L192 VanDerWaalsContact C-N 3.32Å; C190-L192 PolarHBondContact O-N 3.34Å; L192-G194 PolarHBondContact O-N 3.15Å
193	V	91.4	Very high	94.3	Very high	90 Å²	90	62.5 Å²	62.5	55%	0.545	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	9.6	178.5	-57.4	0	0	0	0	113.6	V189 C190 N191 Q195	V189-V193 WeakPolarHBondContact O-CG2 3.25Å; V189-V193 PolarHBondContact O-N 3.09Å; V189-V193 VanDerWaalsContact O-N 3.15Å; C190-V193 WeakPolarHBondContact O-CG2 3.37Å; C190-V193 PolarHBondContact O-N 2.79Å; N191-V193 VanDerWaalsContact C-N 3.35Å; N191-V193 PolarHBondContact O-N 3.11Å; V193-Q195 VanDerWaalsContact C-N 3.3Å; V193-Q195 HydrophobicContact CG2-CB 4.14Å; V193-Q195 HydrophobicContact CG2-CG 3.81Å; V193-Q195 PolarHBondContact O-N 2.87Å
194	G	90.4	Very high	94.2	Very high	24 Å²	24	60.6 Å²	60.6	25%	0.247	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.1	23.4	177.2	0	0	0	0	0	114.4	C190 N191 L192 K253	C190-G194 PolarHBondContact O-N 3.46Å; N191-G194 PolarHBondContact O-N 2.78Å; N191-G194 VanDerWaalsContact O-N 3.13Å; L192-G194 PolarHBondContact O-N 3.15Å; G194-K253 VanDerWaalsContact O-CD 3.23Å; G194-K253 WeakPolarHBondContact O-CD 3.49Å; G194-K253 VanDerWaalsContact O-CE 3.24Å; G194-K253 WeakPolarHBondContact O-CE 3.43Å; G194-K253 WeakPolarHBondContact O-CG 3.44Å
195	Q	92.1	Very high	94.1	Very high	47 Å²	47	56.6 Å²	56.6	22%	0.22	30%	0.299	C	S	.	.			trans	-108.6	169.7	175.2	-57	-65.4	-27.1	0	0	110.8	C190 V193 I250 K251	C190-Q195 CarbonylContact C-O 3.31Å; C190-Q195 VanDerWaalsContact C-O 3.31Å; C190-Q195 CarbonylContact O-C 3.57Å; C190-Q195 PolarHBondContact O-N 2.97Å; V193-Q195 VanDerWaalsContact C-N 3.3Å; V193-Q195 HydrophobicContact CG2-CB 4.14Å; V193-Q195 HydrophobicContact CG2-CG 3.81Å; V193-Q195 PolarHBondContact O-N 2.87Å; Q195-I250 HydrophobicContact CB-CG2 3.43Å; Q195-I250 VanDerWaalsContact CB-CG2 3.43Å; Q195-I250 HydrophobicContact CG-CG2 3.73Å; Q195-K251 PolarHBondContact OE1-O 3.47Å
196	T	92.8	Very high	93.8	Very high	64 Å²	64	55 Å²	55	39%	0.393	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	135.4	175	-55.5	0	0	0	0	109.8	G198 K251	T196-G198 PolarHBondContact O-N 2.85Å; T196-K251 PolarHBondContact N-O 3.33Å; T196-K251 PolarHBondContact O-N 3.02Å
197	L	94.3	Very high	93.6	Very high	19 Å²	19	58.9 Å²	58.9	10%	0.099	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	126.1	174	-169.3	68.7	0	0	0	109.9	V53 A186 Q187 C190 F248	V53-L197 HydrophobicContact CG1-CD1 3.6Å; A186-L197 HydrophobicContact CB-CD1 3.69Å; A186-L197 HydrophobicContact CB-CD2 4.07Å; Q187-L197 HydrophobicContact CB-CD2 4.07Å; C190-L197 HydrophobicContact CB-CB 4.33Å; L197-F248 HydrophobicContact CD1-CB 3.54Å; L197-F248 HydrophobicContact CD1-CD1 4.16Å; L197-F248 HydrophobicContact CD1-CD2 4.09Å; L197-F248 HydrophobicContact CD1-CG 3.7Å; L197-F248 HydrophobicContact CD2-CD1 4.29Å; L197-F248 HydrophobicContact CD2-CE1 4.42Å; L197-F248 HydrophobicContact CG-CB 4.35Å; L197-F248 HydrophobicContact CG-CD1 4.23Å; L197-F248 HydrophobicContact CG-CG 4.28Å
198	G	92.1	Very high	93.5	Very high	14 Å²	14	58.6 Å²	58.6	14%	0.144	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	-160.1	177	0	0	0	0	0	112.8	T196 E249	T196-G198 PolarHBondContact O-N 2.85Å; G198-E249 WeakPolarHBondContact CA-O 3.31Å; G198-E249 PolarHBondContact N-O 3.15Å
199	K	93.4	Very high	93.3	Very high	98 Å²	98	58.7 Å²	58.7	43%	0.426	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	150.3	179	63	-177.3	176.2	176	0	111	L201 E249	K199-L201 HydrophobicContact CG-CD2 4.29Å; K199-E249 HydrophobicContact CG-CB 4.46Å; K199-E249 PolarHBondContact O-N 3.07Å
200	P	94.2	Very high	93.2	Very high	43 Å²	43	59.2 Å²	59.2	28%	0.279	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	144.8	167.1	26.3	-32.3	0	0	0	110.1	L15 I203 I246 F248	L15-P200 HydrophobicContact CD1-CB 4.28Å; L15-P200 HydrophobicContact CD1-CG 3.9Å; L15-P200 VanDerWaalsContact CD1-O 3.31Å; L15-P200 WeakPolarHBondContact CD1-O 3.38Å; P200-I203 HydrophobicContact CB-CD1 4.48Å; P200-I246 HydrophobicContact CB-CG2 4.47Å; P200-F248 HydrophobicContact CB-CD1 3.89Å; P200-F248 HydrophobicContact CB-CE1 3.76Å; P200-F248 HydrophobicContact CG-CE1 4.4Å
201	L	93.6	Very high	93.1	Very high	34 Å²	34	62.5 Å²	62.5	18%	0.178	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	-43.8	177.7	-59.6	178.8	0	0	0	111	L15 E52 K199 T247 E249	L15-L201 PolarHBondContact N-O 3.44Å; E52-L201 HydrophobicContact CG-CD1 3.84Å; K199-L201 HydrophobicContact CG-CD2 4.29Å; L201-T247 HydrophobicContact CB-CG2 4.47Å; L201-T247 HydrophobicContact CD1-CG2 4.32Å; L201-T247 PolarHBondContact N-O 3.23Å; L201-E249 HydrophobicContact CD1-CB 4.38Å; L201-E249 HydrophobicContact CD2-CB 4.45Å; L201-E249 HydrophobicContact CG-CB 4.47Å
202	L	93.9	Very high	92.9	Very high	43 Å²	43	63.8 Å²	63.8	23%	0.225	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	133.6	-179.7	175.5	67.4	0	0	0	109.6	F12 V13 F245 I246 T247	F12-L202 HydrophobicContact CE1-CD1 3.94Å; F12-L202 HydrophobicContact CZ-CD1 3.96Å; V13-L202 WeakPolarHBondContact O-CA 3.3Å; L202-F245 HydrophobicContact CD2-CD1 4.39Å; L202-F245 HydrophobicContact CD2-CE1 4.23Å; L202-I246 CarbonylContact O-C 3.56Å; L202-I246 VanDerWaalsContact O-CA 3.25Å; L202-I246 WeakPolarHBondContact O-CA 3.38Å; L202-I246 WeakPolarHBondContact O-CG2 3.5Å; L202-T247 PolarHBondContact N-O 2.93Å; L202-T247 PolarHBondContact O-N 3.09Å
203	I	95.4	Very high	92.1	Very high	33 Å²	33	57 Å²	57	17%	0.169	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	123.9	167.4	-60	169.9	0	0	0	107.7	V11 F12 V13 V179 P200 V244 I246	V11-I203 HydrophobicContact CG1-CG2 4.32Å; F12-I203 WeakPolarHBondContact CA-O 3.39Å; V13-I203 HydrophobicContact CB-CB 4.41Å; V13-I203 PolarHBondContact N-O 2.46Å; V13-I203 PolarHBondContact O-N 3.08Å; V179-I203 HydrophobicContact CG2-CG2 4.45Å; P200-I203 HydrophobicContact CB-CD1 4.48Å; I203-V244 HydrophobicContact CG2-CG1 3.88Å; I203-I246 HydrophobicContact CG1-CD1 4.3Å; I203-I246 HydrophobicContact CG1-CG1 4.18Å; I203-I246 HydrophobicContact CG1-CG2 3.84Å; I203-I246 HydrophobicContact CG2-CD1 4.47Å; I203-I246 HydrophobicContact CG2-CG1 4.26Å
204	K	94.9	Very high	90.7	Very high	86 Å²	86	60 Å²	60	37%	0.374	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	122.8	-178.4	179.1	-177.5	-176.5	-175.9	0	110.6	F12 E206 V244 F245	F12-K204 HydrophobicContact CD2-CB 4.21Å; F12-K204 HydrophobicContact CD2-CD 4.33Å; F12-K204 HydrophobicContact CD2-CG 3.82Å; F12-K204 HydrophobicContact CE2-CB 4.09Å; F12-K204 HydrophobicContact CE2-CD 3.68Å; F12-K204 HydrophobicContact CE2-CG 3.66Å; K204-E206 PolarHBondContact O-N 2.82Å; K204-V244 CarbonylContact O-C 3.57Å; K204-V244 WeakPolarHBondContact O-CA 3.35Å; K204-F245 PolarHBondContact N-O 2.96Å; K204-F245 PolarHBondContact O-N 2.73Å
205	E	95.4	Very high	88.7	Confident	12 Å²	12	65.6 Å²	65.6	6%	0.056	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	114.4	165.8	-170.6	171.5	-163.4	0	0	109.8	V11 T208 S242 V244	V11-E205 HydrophobicContact CB-CB 4.47Å; V11-E205 PolarHBondContact N-OE2 2.83Å; V11-E205 PolarHBondContact O-N 3.16Å; E205-T208 VanDerWaalsContact CD-OG1 3.23Å; E205-T208 PolarHBondContact OE1-OG1 2.87Å; E205-S242 PolarHBondContact OE1-OG 2.89Å; E205-V244 HydrophobicContact CB-CG2 4.39Å; E205-V244 HydrophobicContact CG-CG2 4.31Å
206	E	92.3	Very high	86.6	Confident	69 Å²	69	68.6 Å²	68.6	32%	0.322	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	-45.3	-176.6	-60.8	-167.5	126.1	0	0	111.8	K204 K243 F245	K204-E206 PolarHBondContact O-N 2.82Å; E206-K243 HydrophobicContact CB-CG 4.47Å; E206-K243 PolarHBondContact N-O 2.86Å; E206-K243 WeakPolarHBondContact OE2-CE 3.26Å; E206-K243 IonicContact OE2-NZ 3.31Å; E206-K243 PolarHBondContact OE2-NZ 3.22Å; E206-F245 HydrophobicContact CG-CB 3.77Å
207	E	91.9	Very high	84.5	Confident	81 Å²	81	72.2 Å²	72.2	38%	0.379	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	141.2	-177.4	-60.7	179.2	-148.3	0	0	111	K209 S242 K243	E207-K209 WeakPolarHBondContact OE2-CE 3.46Å; E207-K209 IonicContact OE2-NZ 3.97Å; E207-K209 PolarHBondContact OE2-NZ 3.34Å; E207-K209 VanDerWaalsContact OE2-NZ 3.16Å; E207-S242 CarbonylContact O-C 3.58Å; E207-S242 WeakPolarHBondContact O-CA 3.27Å; E207-K243 HydrophobicContact CB-CB 3.97Å; E207-K243 HydrophobicContact CG-CD 4.46Å; E207-K243 PolarHBondContact N-O 3.19Å; E207-K243 PolarHBondContact O-N 2.84Å; E207-K243 IonicContact OE1-NZ 3.25Å
208	T	93	Very high	82.3	Confident	41 Å²	41	78.9 Å²	78.9	25%	0.252	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	128.3	169.4	-42.2	0	0	0	0	107.7	E205 A241	E205-T208 VanDerWaalsContact CD-OG1 3.23Å; E205-T208 PolarHBondContact OE1-OG1 2.87Å; T208-A241 CarbonylContact C-O 3.55Å; T208-A241 WeakPolarHBondContact CA-O 3.22Å
209	K	92.9	Very high	80.2	Confident	119 Å²	119	87 Å²	87	52%	0.517	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	138.9	178.6	-66.3	177.5	-172.1	165.8	0	109.3	E207 W211 A240 A241	E207-K209 WeakPolarHBondContact OE2-CE 3.46Å; E207-K209 IonicContact OE2-NZ 3.97Å; E207-K209 PolarHBondContact OE2-NZ 3.34Å; E207-K209 VanDerWaalsContact OE2-NZ 3.16Å; K209-W211 HydrophobicContact CB-CE3 4.04Å; K209-W211 HydrophobicContact CB-CZ3 3.71Å; K209-A240 CarbonylContact O-C 3.59Å; K209-A240 WeakPolarHBondContact O-CA 3.32Å; K209-A241 HydrophobicContact CB-CB 4.45Å; K209-A241 PolarHBondContact N-O 3.39Å; K209-A241 PolarHBondContact O-N 3.48Å
210	E	92.3	Very high	78	Confident	76 Å²	76	86.9 Å²	86.9	36%	0.355	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	131.7	177.7	-180	-170.3	105	0	0	107.9	V167 R171 I238 H239	V167-E210 WeakPolarHBondContact CG1-OE2 3.3Å; R171-E210 WeakPolarHBondContact CD-OE2 3.41Å; R171-E210 IonicContact NE-OE2 3.84Å; R171-E210 PolarHBondContact NE-OE2 2.93Å; E210-I238 HydrophobicContact CG-CG2 3.92Å; E210-H239 WeakPolarHBondContact CA-O 3.4Å
211	W	91.1	Very high	75.8	Confident	69 Å²	69	90 Å²	90	26%	0.261	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	157	175.9	62.4	97	0	0	0	110.7	E60 K209 I238 H239 A241	E60-W211 HydrophobicContact CG-CH2 4.09Å; E60-W211 HydrophobicContact CG-CZ2 4.25Å; E60-W211 WeakPolarHBondContact OE1-CZ2 3.18Å; K209-W211 HydrophobicContact CB-CE3 4.04Å; K209-W211 HydrophobicContact CB-CZ3 3.71Å; W211-I238 WeakPolarHBondContact O-CA 3.28Å; W211-H239 HydrophobicContact CD2-CB 3.75Å; W211-H239 AromaticContact CE2-CG 3.91Å; W211-H239 HydrophobicContact CE3-CB 4.37Å; W211-H239 HydrophobicContact CG-CB 4.15Å; W211-H239 HydrophobicContact CH2-CB 4.16Å; W211-H239 HydrophobicContact CZ2-CB 3.51Å; W211-H239 PolarHBondContact N-O 3.16Å; W211-H239 VanDerWaalsContact NE1-CB 3.35Å; W211-H239 AromaticContact NE1-CD2 3.94Å; W211-H239 AromaticContact NE1-CG 3.55Å; W211-H239 PolarHBondContact O-N 3.28Å; W211-A241 HydrophobicContact CH2-CB 3.74Å; W211-A241 HydrophobicContact CZ3-CB 3.78Å
212	E	89	Confident	73.5	Confident	122 Å²	122	99.2 Å²	99.2	57%	0.57	49%	0.49	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.8	138.8	179	-176.5	177	-159.7	0	0	109.5	A236 I238	E212-A236 WeakPolarHBondContact OE1-CA 3.39Å; E212-I238 HydrophobicContact CB-CG1 4.26Å; E212-I238 HydrophobicContact CG-CG1 4.31Å
213	G	77.4	Confident	71.4	Confident	13 Å²	13	102.7 Å²	102.7	13%	0.134	51%	0.508	C	S	.	.	S	Bend	trans	83.9	176	171.9	0	0	0	0	0	116.3	S235 T237	G213-S235 VanDerWaalsContact CA-O 3.3Å; G213-S235 WeakPolarHBondContact CA-O 3.28Å; G213-S235 PolarHBondContact N-O 2.84Å; G213-T237 PolarHBondContact N-O 2.86Å
214	Q	61.7	Low	69.4	Low	152 Å²	152	106.2 Å²	106.2	71%	0.71	54%	0.535	S	S	*	.			trans	-82.6	136.7	-172.4	-151.7	-166.9	-41.1	0	0	112.1	D216	Q214-D216 HydrophobicContact CG-CB 4.4Å; Q214-D216 VanDerWaalsContact NE2-CB 3.28Å; Q214-D216 PolarHBondContact O-N 3.35Å; Q214-D216 VanDerWaalsContact O-N 3.16Å
215	I	49.7	Very low	67.5	Low	142 Å²	142	107.8 Å²	107.8	73%	0.728	56%	0.557	S	S	*	*			trans	-75	13	177.9	-63.2	169	0	0	0	113	D217	I215-D217 PolarHBondContact O-N 3.13Å
216	D	48.2	Very low	66.1	Low	111 Å²	111	111.5 Å²	111.5	59%	0.594	59%	0.585	S	S	*	*			trans	-100.5	96.1	-174.6	-140.3	1	0	0	0	111.4	Q214 H218	Q214-D216 HydrophobicContact CG-CB 4.4Å; Q214-D216 VanDerWaalsContact NE2-CB 3.28Å; Q214-D216 PolarHBondContact O-N 3.35Å; Q214-D216 VanDerWaalsContact O-N 3.16Å; D216-H218 PolarHBondContact O-N 3.27Å; D216-H218 VanDerWaalsContact O-N 3.07Å
217	D	48.1	Very low	65.4	Low	140 Å²	140	111.6 Å²	111.6	75%	0.749	59%	0.587	S	S	*	*			trans	-82	33.3	-167.7	-155.1	11	0	0	0	114	I215	I215-D217 PolarHBondContact O-N 3.13Å
218	H	46.9	Very low	65.2	Low	158 Å²	158	111.4 Å²	111.4	73%	0.731	59%	0.591	S	S	*	*	S	Bend	trans	-135.4	106.6	178.6	-63.9	-41.3	0	0	0	110.5	D216	D216-H218 PolarHBondContact O-N 3.27Å; D216-H218 VanDerWaalsContact O-N 3.07Å
219	Q	48.2	Very low	65	Low	184 Å²	184	111.8 Å²	111.8	86%	0.86	59%	0.593	S	S	*	*	S	Bend	trans	110.7	8.9	162.7	-55.2	-177.3	5.2	0	0	119.3
220	S	48.4	Very low	64.8	Low	97 Å²	97	112.9 Å²	112.9	68%	0.678	60%	0.601	S	S	*	*	G	3₁₀ helix	trans	-87.9	-11.5	-176	56.9	0	0	0	0	116.3	R222	S220-R222 PolarHBondContact O-N 3.37Å
221	S	47.1	Very low	64.6	Low	109 Å²	109	113.5 Å²	113.5	76%	0.762	60%	0.604	S	S	*	*	G	3₁₀ helix	trans	-79.5	-6.3	-171.8	72.5	0	0	0	0	116
222	R	46.2	Very low	64.6	Low	227 Å²	227	112.7 Å²	112.7	86%	0.857	60%	0.602	S	S	*	*	G	3₁₀ helix	trans	-114.8	0.2	-175.4	-64.6	-162	-168.2	-169.8	5.6	116.6	S220	S220-R222 PolarHBondContact O-N 3.37Å
223	L	49.8	Very low	64.7	Low	115 Å²	115	108.9 Å²	108.9	60%	0.602	59%	0.585	S	S	*	*			trans	-133.6	29.7	-172.4	-62.8	174.6	0	0	0	114.6	S225 S226	L223-S225 PolarHBondContact O-N 2.88Å; L223-S225 VanDerWaalsContact O-N 3.07Å; L223-S226 PolarHBondContact O-N 3.24Å; L223-S226 VanDerWaalsContact O-N 3.15Å
224	S	52	Low	65.3	Low	107 Å²	107	115 Å²	115	75%	0.748	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.2	-20.8	-178.6	48.8	0	0	0	0	114.6
225	S	54.9	Low	66.6	Low	119 Å²	119	110.6 Å²	110.6	83%	0.832	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.9	-8.8	179.1	56.1	0	0	0	0	115.3	L223	L223-S225 PolarHBondContact O-N 2.88Å; L223-S225 VanDerWaalsContact O-N 3.07Å
226	S	66.8	Low	68.6	Low	91 Å²	91	104.2 Å²	104.2	64%	0.636	56%	0.562	S	S	*	*			trans	-129.4	31.3	-172.7	-169.2	0	0	0	0	114.2	L223 T228	L223-S226 PolarHBondContact O-N 3.24Å; L223-S226 VanDerWaalsContact O-N 3.15Å; S226-T228 PolarHBondContact O-N 2.81Å
227	L	78.5	Confident	70.8	Confident	70 Å²	70	99.9 Å²	99.9	37%	0.366	54%	0.54	S	S	.	.			trans	-74.8	126	171.9	-63.7	178.2	0	0	0	110.5	Q231 K232	L227-Q231 HydrophobicContact CB-CB 4.23Å; L227-Q231 HydrophobicContact CD2-CB 4.16Å; L227-K232 HydrophobicContact CB-CG 3.86Å; L227-K232 WeakPolarHBondContact O-CE 3.38Å
228	T	87.5	Confident	73	Confident	77 Å²	77	93.9 Å²	93.9	47%	0.472	51%	0.507	S	S	.	.			trans	-60.3	158.2	169.3	62.7	0	0	0	0	110.8	S226 Q230 Q231 K232	S226-T228 PolarHBondContact O-N 2.81Å; T228-Q230 PolarHBondContact O-N 2.94Å; T228-Q231 PolarHBondContact O-N 2.89Å; T228-Q231 VanDerWaalsContact O-N 3.07Å; T228-Q231 WeakPolarHBondContact OG1-CB 3.3Å; T228-Q231 VanDerWaalsContact OG1-CG 3.29Å; T228-Q231 WeakPolarHBondContact OG1-CG 3.33Å; T228-Q231 PolarHBondContact OG1-N 2.87Å; T228-Q231 PolarHBondContact OG1-OE1 2.88Å; T228-K232 WeakPolarHBondContact O-CG 3.46Å; T228-K232 PolarHBondContact O-N 2.81Å
229	V	87.7	Confident	75.3	Confident	49 Å²	49	88.2 Å²	88.2	30%	0.297	48%	0.481	S	S	.	.	H	α-helix	trans	-53.6	-42.3	175.3	169.4	0	0	0	0	111.5	P158 F160 Q231 K232 I233	P158-V229 HydrophobicContact CG-CG2 4.49Å; F160-V229 HydrophobicContact CE2-CG1 4.33Å; F160-V229 HydrophobicContact CZ-CG1 3.8Å; V229-Q231 PolarHBondContact O-N 3.13Å; V229-K232 PolarHBondContact O-N 3.33Å; V229-I233 HydrophobicContact CG1-CD1 3.85Å; V229-I233 WeakPolarHBondContact O-CG1 3.37Å; V229-I233 PolarHBondContact O-N 2.65Å
230	Q	88.9	Confident	77.6	Confident	143 Å²	143	79.5 Å²	79.5	67%	0.668	44%	0.44	S	S	*	.	H	α-helix	trans	-64.5	-39.8	177.8	-68.1	-173	-6	0	0	112.8	T228 K232 I233 K234	T228-Q230 PolarHBondContact O-N 2.94Å; Q230-K232 VanDerWaalsContact C-N 3.33Å; Q230-I233 PolarHBondContact O-N 2.84Å; Q230-K234 WeakPolarHBondContact O-CG 3.37Å; Q230-K234 PolarHBondContact O-N 2.9Å
231	Q	88.8	Confident	79.8	Confident	89 Å²	89	75.8 Å²	75.8	42%	0.416	42%	0.416	S	S	.	.	H	α-helix	trans	-65.3	-38.4	175.6	-75.4	164.3	-46.4	0	0	111.7	L227 T228 V229 K234 S235	L227-Q231 HydrophobicContact CB-CB 4.23Å; L227-Q231 HydrophobicContact CD2-CB 4.16Å; T228-Q231 PolarHBondContact O-N 2.89Å; T228-Q231 VanDerWaalsContact O-N 3.07Å; T228-Q231 WeakPolarHBondContact OG1-CB 3.3Å; T228-Q231 VanDerWaalsContact OG1-CG 3.29Å; T228-Q231 WeakPolarHBondContact OG1-CG 3.33Å; T228-Q231 PolarHBondContact OG1-N 2.87Å; T228-Q231 PolarHBondContact OG1-OE1 2.88Å; V229-Q231 PolarHBondContact O-N 3.13Å; Q231-K234 PolarHBondContact O-N 3.35Å; Q231-S235 PolarHBondContact O-N 3.39Å; Q231-S235 PolarHBondContact O-OG 3.13Å
232	K	89.7	Confident	82.2	Confident	51 Å²	51	70.8 Å²	70.8	22%	0.222	38%	0.381	C	S	.	.	H	α-helix	trans	-65.1	-39.3	175.5	-67.6	-179.7	177.2	-175.8	0	112.6	P157 F160 L227 T228 V229 Q230 S235 A236	P157-K232 VanDerWaalsContact CB-NZ 3.26Å; F160-K232 HydrophobicContact CD2-CB 3.76Å; F160-K232 HydrophobicContact CE2-CB 3.78Å; F160-K232 HydrophobicContact CE2-CD 4.45Å; L227-K232 HydrophobicContact CB-CG 3.86Å; L227-K232 WeakPolarHBondContact O-CE 3.38Å; T228-K232 WeakPolarHBondContact O-CG 3.46Å; T228-K232 PolarHBondContact O-N 2.81Å; V229-K232 PolarHBondContact O-N 3.33Å; Q230-K232 VanDerWaalsContact C-N 3.33Å; K232-S235 WeakPolarHBondContact CA-OG 3.37Å; K232-S235 PolarHBondContact O-N 2.86Å; K232-S235 PolarHBondContact O-OG 2.81Å; K232-A236 VanDerWaalsContact O-CB 3.3Å; K232-A236 WeakPolarHBondContact O-CB 3.41Å; K232-A236 PolarHBondContact O-N 3.15Å
233	I	91.8	Very high	84.7	Confident	43 Å²	43	63 Å²	63	22%	0.221	35%	0.353	C	S	.	.	H	α-helix	trans	-63.9	-44.2	174.2	-69.8	167	0	0	0	110.4	P65 F135 F160 V229 Q230 A236 T237	P65-I233 HydrophobicContact CG-CG2 4.17Å; F135-I233 HydrophobicContact CD2-CD1 3.72Å; F135-I233 HydrophobicContact CD2-CG1 4.25Å; F135-I233 HydrophobicContact CE2-CD1 4.23Å; F135-I233 HydrophobicContact CE2-CG1 4.31Å; F160-I233 HydrophobicContact CD1-CG1 3.9Å; F160-I233 HydrophobicContact CD2-CG1 4.15Å; F160-I233 HydrophobicContact CE1-CD1 4.09Å; F160-I233 HydrophobicContact CE1-CG1 3.74Å; F160-I233 HydrophobicContact CE2-CG1 4Å; F160-I233 HydrophobicContact CG-CG1 4.11Å; F160-I233 HydrophobicContact CZ-CD1 4.16Å; F160-I233 HydrophobicContact CZ-CG1 3.81Å; V229-I233 HydrophobicContact CG1-CD1 3.85Å; V229-I233 WeakPolarHBondContact O-CG1 3.37Å; V229-I233 PolarHBondContact O-N 2.65Å; Q230-I233 PolarHBondContact O-N 2.84Å; I233-A236 CarbonylContact O-C 3.58Å; I233-A236 PolarHBondContact O-N 3.28Å; I233-T237 PolarHBondContact O-N 3.31Å; I233-T237 PolarHBondContact O-OG1 3.44Å
234	K	90.8	Very high	86.9	Confident	141 Å²	141	57.6 Å²	57.6	61%	0.613	33%	0.325	S	S	*	.	H	α-helix	trans	-63.5	-42.9	176.5	-73.6	-179.5	-179.1	-174.1	0	112.3	Q230 Q231 A236 T237	Q230-K234 WeakPolarHBondContact O-CG 3.37Å; Q230-K234 PolarHBondContact O-N 2.9Å; Q231-K234 PolarHBondContact O-N 3.35Å; K234-A236 VanDerWaalsContact C-N 3.29Å; K234-A236 PolarHBondContact O-N 2.82Å; K234-T237 VanDerWaalsContact O-CB 3.29Å; K234-T237 WeakPolarHBondContact O-CB 3.42Å; K234-T237 PolarHBondContact O-N 2.9Å; K234-T237 PolarHBondContact O-OG1 2.85Å
235	S	88.8	Confident	89.1	Confident	60 Å²	60	54.7 Å²	54.7	42%	0.42	30%	0.299	S	S	.	.	H	α-helix	trans	-66.6	-34	177.9	62.1	0	0	0	0	112.2	G213 Q231 K232 T237	G213-S235 VanDerWaalsContact CA-O 3.3Å; G213-S235 WeakPolarHBondContact CA-O 3.28Å; G213-S235 PolarHBondContact N-O 2.84Å; Q231-S235 PolarHBondContact O-N 3.39Å; Q231-S235 PolarHBondContact O-OG 3.13Å; K232-S235 WeakPolarHBondContact CA-OG 3.37Å; K232-S235 PolarHBondContact O-N 2.86Å; K232-S235 PolarHBondContact O-OG 2.81Å; S235-T237 PolarHBondContact O-N 3.3Å
236	A	91.4	Very high	91.1	Very high	7 Å²	7	49 Å²	49	6%	0.058	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89	23.5	174.8	0	0	0	0	0	112.3	P65 F160 H162 E212 K232 I233 K234	P65-A236 HydrophobicContact CB-CB 4.49Å; P65-A236 WeakPolarHBondContact CD-O 3.36Å; P65-A236 HydrophobicContact CG-CB 4.28Å; F160-A236 HydrophobicContact CB-CB 3.89Å; H162-A236 PolarHBondContact CE1-O 2.71Å; E212-A236 WeakPolarHBondContact OE1-CA 3.39Å; K232-A236 VanDerWaalsContact O-CB 3.3Å; K232-A236 WeakPolarHBondContact O-CB 3.41Å; K232-A236 PolarHBondContact O-N 3.15Å; I233-A236 CarbonylContact O-C 3.58Å; I233-A236 PolarHBondContact O-N 3.28Å; K234-A236 VanDerWaalsContact C-N 3.29Å; K234-A236 PolarHBondContact O-N 2.82Å
237	T	94.4	Very high	92.5	Very high	21 Å²	21	45.1 Å²	45.1	13%	0.129	23%	0.231	C	C	.	.			trans	-89.1	130	172.9	-65.4	0	0	0	0	108.7	G213 I233 K234 S235	G213-T237 PolarHBondContact N-O 2.86Å; I233-T237 PolarHBondContact O-N 3.31Å; I233-T237 PolarHBondContact O-OG1 3.44Å; K234-T237 VanDerWaalsContact O-CB 3.29Å; K234-T237 WeakPolarHBondContact O-CB 3.42Å; K234-T237 PolarHBondContact O-N 2.9Å; K234-T237 PolarHBondContact O-OG1 2.85Å; S235-T237 PolarHBondContact O-N 3.3Å
238	I	94.6	Very high	93.2	Very high	13 Å²	13	42 Å²	42	7%	0.067	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	141.8	175.7	-70.6	170.4	0	0	0	109.1	S62 G63 H162 V167 L170 E210 W211 E212	S62-I238 CarbonylContact C-O 3.48Å; S62-I238 VanDerWaalsContact CA-O 3.28Å; S62-I238 WeakPolarHBondContact CA-O 3.25Å; G63-I238 PolarHBondContact N-O 2.99Å; G63-I238 PolarHBondContact O-N 3.46Å; H162-I238 HydrophobicContact CB-CD1 4.19Å; H162-I238 VanDerWaalsContact CE1-CD1 3.42Å; H162-I238 WeakPolarHBondContact CE1-CD1 3.35Å; H162-I238 WeakPolarHBondContact CE1-CG1 3.28Å; H162-I238 WeakPolarHBondContact ND1-CD1 3.48Å; V167-I238 HydrophobicContact CG1-CD1 4.42Å; V167-I238 HydrophobicContact CG2-CD1 3.71Å; L170-I238 HydrophobicContact CD2-CB 4.16Å; L170-I238 HydrophobicContact CD2-CG2 3.8Å; E210-I238 HydrophobicContact CG-CG2 3.92Å; W211-I238 WeakPolarHBondContact O-CA 3.28Å; E212-I238 HydrophobicContact CB-CG1 4.26Å; E212-I238 HydrophobicContact CG-CG1 4.31Å
239	H	94.8	Very high	93.6	Very high	40 Å²	40	41 Å²	41	19%	0.185	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	138.8	170.8	-67	-109.3	0	0	0	109.2	E60 V61 E210 W211	E60-H239 IonicContact OE1-ND1 2.71Å; E60-H239 PolarHBondContact OE1-ND1 3.09Å; V61-H239 WeakPolarHBondContact O-CA 3.35Å; E210-H239 WeakPolarHBondContact CA-O 3.4Å; W211-H239 HydrophobicContact CD2-CB 3.75Å; W211-H239 AromaticContact CE2-CG 3.91Å; W211-H239 HydrophobicContact CE3-CB 4.37Å; W211-H239 HydrophobicContact CG-CB 4.15Å; W211-H239 HydrophobicContact CH2-CB 4.16Å; W211-H239 HydrophobicContact CZ2-CB 3.51Å; W211-H239 PolarHBondContact N-O 3.16Å; W211-H239 VanDerWaalsContact NE1-CB 3.35Å; W211-H239 AromaticContact NE1-CD2 3.94Å; W211-H239 AromaticContact NE1-CG 3.55Å; W211-H239 PolarHBondContact O-N 3.28Å
240	A	95.9	Very high	93.8	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	130.8	173.4	0	0	0	0	0	109.5	E60 V61 L170 R171 A174 K209	E60-A240 WeakPolarHBondContact CA-O 3.44Å; V61-A240 HydrophobicContact CG2-CB 4.2Å; V61-A240 PolarHBondContact N-O 3.45Å; V61-A240 PolarHBondContact O-N 3.31Å; L170-A240 HydrophobicContact CD2-CB 4.22Å; L170-A240 HydrophobicContact CG-CB 4.03Å; R171-A240 HydrophobicContact CG-CB 4.31Å; A174-A240 HydrophobicContact CB-CB 4.16Å; K209-A240 CarbonylContact O-C 3.59Å; K209-A240 WeakPolarHBondContact O-CA 3.32Å
241	A	96.3	Very high	93.7	Very high	19 Å²	19	38.3 Å²	38.3	16%	0.157	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	144.7	172.6	0	0	0	0	0	110.8	S59 E60 T208 K209 W211	S59-A241 WeakPolarHBondContact O-CA 3.46Å; S59-A241 VanDerWaalsContact O-CB 3.27Å; S59-A241 WeakPolarHBondContact O-CB 3.37Å; E60-A241 HydrophobicContact CB-CB 4.43Å; E60-A241 HydrophobicContact CG-CB 4.48Å; T208-A241 CarbonylContact C-O 3.55Å; T208-A241 WeakPolarHBondContact CA-O 3.22Å; K209-A241 HydrophobicContact CB-CB 4.45Å; K209-A241 PolarHBondContact N-O 3.39Å; K209-A241 PolarHBondContact O-N 3.48Å; W211-A241 HydrophobicContact CH2-CB 3.74Å; W211-A241 HydrophobicContact CZ3-CB 3.78Å
242	S	97.3	Very high	93.1	Very high	5 Å²	5	36.2 Å²	36.2	4%	0.035	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	144.7	175.6	-176.3	0	0	0	0	110.2	T58 S59 E205 E207	T58-S242 CarbonylContact C-O 3.56Å; T58-S242 VanDerWaalsContact CA-O 3.31Å; T58-S242 WeakPolarHBondContact CA-O 3.5Å; S59-S242 PolarHBondContact N-O 2.76Å; S59-S242 PolarHBondContact O-N 2.86Å; S59-S242 VanDerWaalsContact O-N 3.11Å; E205-S242 PolarHBondContact OE1-OG 2.89Å; E207-S242 CarbonylContact O-C 3.58Å; E207-S242 WeakPolarHBondContact O-CA 3.27Å
243	K	97.5	Very high	92.1	Very high	63 Å²	63	40.6 Å²	40.6	27%	0.274	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	120.6	171.4	-176.9	-179.5	177.9	-157.9	0	108.2	S56 G57 T58 E206 E207	S56-K243 VanDerWaalsContact OG-CE 3.25Å; S56-K243 WeakPolarHBondContact OG-CE 3.49Å; S56-K243 WeakPolarHBondContact OG-CG 3.43Å; G57-K243 WeakPolarHBondContact O-CA 3.37Å; T58-K243 HydrophobicContact CG2-CB 4.09Å; T58-K243 HydrophobicContact CG2-CD 4.39Å; T58-K243 HydrophobicContact CG2-CG 3.84Å; E206-K243 HydrophobicContact CB-CG 4.47Å; E206-K243 PolarHBondContact N-O 2.86Å; E206-K243 WeakPolarHBondContact OE2-CE 3.26Å; E206-K243 IonicContact OE2-NZ 3.31Å; E206-K243 PolarHBondContact OE2-NZ 3.22Å; E207-K243 HydrophobicContact CB-CB 3.97Å; E207-K243 HydrophobicContact CG-CD 4.46Å; E207-K243 PolarHBondContact N-O 3.19Å; E207-K243 PolarHBondContact O-N 2.84Å; E207-K243 IonicContact OE1-NZ 3.25Å
244	V	97.5	Very high	90.4	Very high	1 Å²	1	47.5 Å²	47.5	1%	0.006	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	132.6	-178.2	-179.3	0	0	0	0	109.3	S56 G57 A178 V179 I203 K204 E205 I246	S56-V244 CarbonylContact C-O 3.59Å; S56-V244 VanDerWaalsContact CA-O 3.31Å; S56-V244 WeakPolarHBondContact CA-O 3.35Å; S56-V244 PolarHBondContact OG-O 3.07Å; G57-V244 PolarHBondContact N-O 3.27Å; G57-V244 PolarHBondContact O-N 3.39Å; A178-V244 HydrophobicContact CB-CB 4.17Å; A178-V244 HydrophobicContact CB-CG2 3.75Å; V179-V244 HydrophobicContact CG2-CB 4.34Å; V179-V244 HydrophobicContact CG2-CG1 3.86Å; V179-V244 HydrophobicContact CG2-CG2 4.2Å; I203-V244 HydrophobicContact CG2-CG1 3.88Å; K204-V244 CarbonylContact O-C 3.57Å; K204-V244 WeakPolarHBondContact O-CA 3.35Å; E205-V244 HydrophobicContact CB-CG2 4.39Å; E205-V244 HydrophobicContact CG-CG2 4.31Å; V244-I246 HydrophobicContact CG1-CD1 4.28Å; V244-I246 HydrophobicContact CG1-CG1 3.88Å
245	F	96.9	Very high	88.6	Confident	46 Å²	46	50.3 Å²	50.3	20%	0.202	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	133.3	171.8	178.5	-94.9	0	0	0	109.8	H54 V55 L202 K204 E206 T247	H54-F245 HydrophobicContact CB-CE2 4.03Å; H54-F245 HydrophobicContact CB-CZ 3.89Å; H54-F245 AromaticContact ND1-CZ 3.48Å; H54-F245 WeakPolarHBondContact ND1-CZ 3.47Å; V55-F245 CarbonylContact O-C 3.36Å; V55-F245 WeakPolarHBondContact O-CA 3.2Å; L202-F245 HydrophobicContact CD2-CD1 4.39Å; L202-F245 HydrophobicContact CD2-CE1 4.23Å; K204-F245 PolarHBondContact N-O 2.96Å; K204-F245 PolarHBondContact O-N 2.73Å; E206-F245 HydrophobicContact CG-CB 3.77Å; F245-T247 VanDerWaalsContact CE1-OG1 3.31Å; F245-T247 WeakPolarHBondContact CE1-OG1 3.4Å
246	I	96.8	Very high	86.7	Confident	1 Å²	1	58.8 Å²	58.8	1%	0.005	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	134.8	178.3	-48	-176.5	0	0	0	110.2	V55 V179 A182 P200 L202 I203 V244 F248	V55-I246 HydrophobicContact CG2-CB 4.14Å; V55-I246 WeakPolarHBondContact CG2-O 3.42Å; V55-I246 PolarHBondContact N-O 3.44Å; V55-I246 PolarHBondContact O-N 3.07Å; V179-I246 HydrophobicContact CB-CD1 4.35Å; V179-I246 HydrophobicContact CG1-CD1 3.89Å; V179-I246 HydrophobicContact CG2-CD1 4.46Å; A182-I246 HydrophobicContact CB-CD1 3.73Å; A182-I246 HydrophobicContact CB-CG1 4Å; P200-I246 HydrophobicContact CB-CG2 4.47Å; L202-I246 CarbonylContact O-C 3.56Å; L202-I246 VanDerWaalsContact O-CA 3.25Å; L202-I246 WeakPolarHBondContact O-CA 3.38Å; L202-I246 WeakPolarHBondContact O-CG2 3.5Å; I203-I246 HydrophobicContact CG1-CD1 4.3Å; I203-I246 HydrophobicContact CG1-CG1 4.18Å; I203-I246 HydrophobicContact CG1-CG2 3.84Å; I203-I246 HydrophobicContact CG2-CD1 4.47Å; I203-I246 HydrophobicContact CG2-CG1 4.26Å; V244-I246 HydrophobicContact CG1-CD1 4.28Å; V244-I246 HydrophobicContact CG1-CG1 3.88Å; I246-F248 HydrophobicContact CB-CD2 4.36Å; I246-F248 HydrophobicContact CB-CE2 3.69Å; I246-F248 HydrophobicContact CB-CZ 4.17Å; I246-F248 HydrophobicContact CD1-CZ 4.32Å; I246-F248 HydrophobicContact CG2-CD2 3.75Å; I246-F248 HydrophobicContact CG2-CE1 4.05Å; I246-F248 HydrophobicContact CG2-CE2 3.2Å; I246-F248 HydrophobicContact CG2-CG 4.38Å; I246-F248 HydrophobicContact CG2-CZ 3.36Å
247	T	95.8	Very high	84.5	Confident	8 Å²	8	67.6 Å²	67.6	5%	0.049	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	131.2	169.2	-54.5	0	0	0	0	109.2	E52 V53 H54 L201 L202 F245	E52-T247 HydrophobicContact CB-CG2 3.99Å; E52-T247 HydrophobicContact CG-CG2 4.07Å; E52-T247 WeakPolarHBondContact OE2-CG2 3.29Å; V53-T247 WeakPolarHBondContact O-CA 3.24Å; H54-T247 WeakPolarHBondContact NE2-CG2 3.23Å; L201-T247 HydrophobicContact CB-CG2 4.47Å; L201-T247 HydrophobicContact CD1-CG2 4.32Å; L201-T247 PolarHBondContact N-O 3.23Å; L202-T247 PolarHBondContact N-O 2.93Å; L202-T247 PolarHBondContact O-N 3.09Å; F245-T247 VanDerWaalsContact CE1-OG1 3.31Å; F245-T247 WeakPolarHBondContact CE1-OG1 3.4Å
248	F	94.9	Very high	82.2	Confident	6 Å²	6	75.8 Å²	75.8	3%	0.026	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	150.3	174.1	-61.3	-95.5	0	0	0	110.9	E52 V53 V55 W183 A186 L197 P200 I246	E52-F248 CarbonylContact C-O 3.56Å; E52-F248 WeakPolarHBondContact CA-O 3.34Å; V53-F248 HydrophobicContact CG1-CB 3.73Å; V53-F248 HydrophobicContact CG1-CD2 4.3Å; V53-F248 HydrophobicContact CG1-CG 4.46Å; V53-F248 PolarHBondContact N-O 2.94Å; V53-F248 PolarHBondContact O-N 3.24Å; V55-F248 HydrophobicContact CG2-CD2 4.19Å; V55-F248 HydrophobicContact CG2-CE2 3.87Å; W183-F248 HydrophobicContact CB-CZ 4.22Å; W183-F248 AromaticContact CD1-CE1 3.7Å; W183-F248 AromaticContact CD1-CZ 3.64Å; W183-F248 HydrophobicContact CG-CZ 4.32Å; A186-F248 HydrophobicContact CB-CD2 3.76Å; A186-F248 HydrophobicContact CB-CE2 3.79Å; L197-F248 HydrophobicContact CD1-CB 3.54Å; L197-F248 HydrophobicContact CD1-CD1 4.16Å; L197-F248 HydrophobicContact CD1-CD2 4.09Å; L197-F248 HydrophobicContact CD1-CG 3.7Å; L197-F248 HydrophobicContact CD2-CD1 4.29Å; L197-F248 HydrophobicContact CD2-CE1 4.42Å; L197-F248 HydrophobicContact CG-CB 4.35Å; L197-F248 HydrophobicContact CG-CD1 4.23Å; L197-F248 HydrophobicContact CG-CG 4.28Å; P200-F248 HydrophobicContact CB-CD1 3.89Å; P200-F248 HydrophobicContact CB-CE1 3.76Å; P200-F248 HydrophobicContact CG-CE1 4.4Å; I246-F248 HydrophobicContact CB-CD2 4.36Å; I246-F248 HydrophobicContact CB-CE2 3.69Å; I246-F248 HydrophobicContact CB-CZ 4.17Å; I246-F248 HydrophobicContact CD1-CZ 4.32Å; I246-F248 HydrophobicContact CG2-CD2 3.75Å; I246-F248 HydrophobicContact CG2-CE1 4.05Å; I246-F248 HydrophobicContact CG2-CE2 3.2Å; I246-F248 HydrophobicContact CG2-CG 4.38Å; I246-F248 HydrophobicContact CG2-CZ 3.36Å
249	E	94.1	Very high	79.7	Confident	55 Å²	55	83.8 Å²	83.8	26%	0.257	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	145.7	163.9	-177.2	-174.3	-168.2	0	0	110.3	R51 G198 K199 L201	R51-E249 CarbonylContact O-C 3.6Å; G198-E249 WeakPolarHBondContact CA-O 3.31Å; G198-E249 PolarHBondContact N-O 3.15Å; K199-E249 HydrophobicContact CG-CB 4.46Å; K199-E249 PolarHBondContact O-N 3.07Å; L201-E249 HydrophobicContact CD1-CB 4.38Å; L201-E249 HydrophobicContact CD2-CB 4.45Å; L201-E249 HydrophobicContact CG-CB 4.47Å
250	I	92.3	Very high	77.4	Confident	33 Å²	33	93.2 Å²	93.2	17%	0.169	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	125.1	170.8	-58.5	177.6	0	0	0	108.9	R51 E52 V53 Q195	R51-I250 HydrophobicContact CB-CB 3.86Å; R51-I250 PolarHBondContact O-N 2.86Å; E52-I250 VanDerWaalsContact C-CD1 3.43Å; E52-I250 WeakPolarHBondContact O-CD1 3.18Å; V53-I250 HydrophobicContact CB-CD1 3.88Å; V53-I250 HydrophobicContact CB-CG1 3.96Å; V53-I250 HydrophobicContact CG1-CG1 4.1Å; Q195-I250 HydrophobicContact CB-CG2 3.43Å; Q195-I250 VanDerWaalsContact CB-CG2 3.43Å; Q195-I250 HydrophobicContact CG-CG2 3.73Å
251	K	86.9	Confident	76.5	Confident	103 Å²	103	97.9 Å²	97.9	45%	0.448	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	136.3	175.2	-64.1	-178.8	179	-179.4	0	110.8	Q195 T196	Q195-K251 PolarHBondContact OE1-O 3.47Å; T196-K251 PolarHBondContact N-O 3.33Å; T196-K251 PolarHBondContact O-N 3.02Å
252	G	76.3	Confident	75.4	Confident	44 Å²	44	102.1 Å²	102.1	45%	0.454	47%	0.471	S	S	.	.			trans	-62.7	144.4	167.9	0	0	0	0	0	111.2	E254	G252-E254 PolarHBondContact O-N 2.79Å
253	K	69.1	Low	74.2	Confident	144 Å²	144	107.4 Å²	107.4	63%	0.626	50%	0.496	S	S	*	.			trans	-59.1	114.2	168.4	-83.3	179.8	179.2	175.1	0	109.1	G194 K255	G194-K253 VanDerWaalsContact O-CD 3.23Å; G194-K253 WeakPolarHBondContact O-CD 3.49Å; G194-K253 VanDerWaalsContact O-CE 3.24Å; G194-K253 WeakPolarHBondContact O-CE 3.43Å; G194-K253 WeakPolarHBondContact O-CG 3.44Å; K253-K255 PolarHBondContact O-N 2.9Å
254	E	56.9	Low	72.8	Confident	188 Å²	188	110.1 Å²	110.1	88%	0.879	51%	0.509	S	S	*	.			trans	-57.7	122.3	168.2	-78.2	-165.9	153.4	0	0	108.8	G252 R256	G252-E254 PolarHBondContact O-N 2.79Å; E254-R256 PolarHBondContact O-N 2.81Å
255	K	51.6	Low	71.3	Confident	200 Å²	200	116.9 Å²	116.9	87%	0.87	54%	0.54	S	S	*	.			trans	-63.2	111.2	167.8	-71.2	-176.3	178.2	-179.8	0	106.6	K253 K257	K253-K255 PolarHBondContact O-N 2.9Å; K255-K257 PolarHBondContact O-N 2.88Å
256	R	48.8	Very low	69.6	Low	238 Å²	238	121.6 Å²	121.6	90%	0.898	56%	0.563	S	S	*	*			trans	-50.2	108.3	164.8	-81.2	-174.1	179.5	-176.7	-0.1	107.3	E254 K258	E254-R256 PolarHBondContact O-N 2.81Å; R256-K258 PolarHBondContact O-N 2.9Å
257	K	46.7	Very low	67.6	Low	192 Å²	192	130.2 Å²	130.2	84%	0.835	60%	0.602	S	S	*	*			trans	-60.9	103.1	166.6	-86.6	-178.7	174.2	176.7	0	106	K255 H259	K255-K257 PolarHBondContact O-N 2.88Å; K257-H259 PolarHBondContact O-N 3.21Å; K257-H259 VanDerWaalsContact O-N 3.11Å
258	K	45.7	Very low	65.5	Low	192 Å²	192	139.6 Å²	139.6	84%	0.835	65%	0.645	S	S	*	*			trans	-64.2	107.3	162.2	-71.4	-176.8	176.4	-176.9	0	105.3	R256 L260	R256-K258 PolarHBondContact O-N 2.9Å; K258-L260 PolarHBondContact O-N 3.5Å
259	H	42.7	Very low	63	Low	182 Å²	182	150.8 Å²	150.8	84%	0.843	70%	0.697	S	S	*	*			trans	-61.8	117.5	161.4	-94.9	-72.9	0	0	0	106.2	K257	K257-H259 PolarHBondContact O-N 3.21Å; K257-H259 VanDerWaalsContact O-N 3.11Å
260	L	45	Very low	60.2	Low	238 Å²	238	159.5 Å²	159.5	100%	1.246	74%	0.736	S	S	*	*			trans	-61.5	0	170.3	-113.5	92.5	0	0	0	109.8	K258	K258-L260 PolarHBondContact O-N 3.5Å

Retrieved 260 of 260 residues in 247.4 ms (Link to these results)

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