A0A087XC67_POEFO Loading...

Spondin-2

AlphaFold DB , UniProt , Accession A0A087XC67, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 338 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.8	Very low	48.6	Very low	237 Å²	237	149.4 Å²	149.4	100%	1.167	80%	0.799	S	S	*	*				0	112.7	0	-71.9	164.4	147	0	0	105
2	E	39.4	Very low	49.2	Very low	179 Å²	179	144.1 Å²	144.1	84%	0.836	77%	0.771	S	S	*	*			cis	-139.3	137.1	26.6	-140.6	92.1	166.7	0	0	108
3	A	39.8	Very low	49.9	Very low	98 Å²	98	137.7 Å²	137.7	81%	0.81	75%	0.75	S	S	*	*			trans	-84.8	120.7	177.1	0	0	0	0	0	110.4	R5	A3-R5 PolarHBondContact O-N 3.23Å
4	S	39.2	Very low	50.4	Low	117 Å²	117	135 Å²	135	82%	0.818	73%	0.734	S	S	*	*			trans	-68.4	109.9	175.5	-173.6	0	0	0	0	110.6	K6	S4-K6 PolarHBondContact O-N 3.39Å
5	R	48.1	Very low	50.8	Low	235 Å²	235	138.3 Å²	138.3	89%	0.887	73%	0.732	S	S	*	*			trans	-88.2	101.4	179.3	-166.8	-179.9	-86.3	-171.4	-5	108.8	A3 T7	A3-R5 PolarHBondContact O-N 3.23Å; R5-T7 PolarHBondContact O-N 3.47Å
6	K	50.4	Low	51.1	Low	197 Å²	197	141.4 Å²	141.4	86%	0.857	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-69.2	118.6	169.8	-79.5	-177.1	177	179.3	0	109.7	S4	S4-K6 PolarHBondContact O-N 3.39Å
7	T	56.3	Low	51.3	Low	128 Å²	128	139.9 Å²	139.9	79%	0.785	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-75.1	132	170.7	46	0	0	0	0	110.2	R5	R5-T7 PolarHBondContact O-N 3.47Å
8	P	49	Very low	51.4	Low	114 Å²	114	138.1 Å²	138.1	74%	0.74	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-71.2	141	177.9	28.1	-30.8	0	0	0	111.1
9	S	60.8	Low	51.5	Low	76 Å²	76	135.7 Å²	135.7	53%	0.531	71%	0.706	S	S	.	*	P	Polyproline II helix	trans	-65.6	143.3	177.9	170.5	0	0	0	0	111.3	S11 D12	S9-S11 PolarHBondContact O-N 3.02Å; S9-S11 PolarHBondContact OG-N 2.93Å; S9-D12 PolarHBondContact O-N 3.47Å
10	F	55	Low	51.3	Low	182 Å²	182	134.4 Å²	134.4	80%	0.798	70%	0.699	S	S	*	*	H	α-helix	trans	-52.6	-27.6	178.3	-149	-95.9	0	0	0	112.8	L14	F10-L14 PolarHBondContact O-N 3.03Å
11	S	57.3	Low	51.2	Low	80 Å²	80	134.8 Å²	134.8	56%	0.559	70%	0.699	S	S	*	*	H	α-helix	trans	-66.7	-34.7	175.8	-179.3	0	0	0	0	113.7	S9 R15	S9-S11 PolarHBondContact O-N 3.02Å; S9-S11 PolarHBondContact OG-N 2.93Å; S11-R15 WeakPolarHBondContact O-CB 3.44Å; S11-R15 PolarHBondContact O-N 2.95Å; S11-R15 VanDerWaalsContact O-N 3.12Å
12	D	55.8	Low	51.5	Low	86 Å²	86	129.5 Å²	129.5	46%	0.46	68%	0.675	S	S	.	*	H	α-helix	trans	-78.5	-31.9	-179.2	-91.5	-28.4	0	0	0	111.8	S9 R16	S9-D12 PolarHBondContact O-N 3.47Å; D12-R16 WeakPolarHBondContact O-CB 3.35Å; D12-R16 VanDerWaalsContact O-CG 3.28Å; D12-R16 WeakPolarHBondContact O-CG 3.39Å; D12-R16 PolarHBondContact O-N 3.43Å
13	A	57.3	Low	52	Low	61 Å²	61	126.1 Å²	126.1	50%	0.504	67%	0.667	S	S	.	*	H	α-helix	trans	-66.8	-43	173.5	0	0	0	0	0	111.2	R16 L17	A13-R16 PolarHBondContact O-N 3.21Å; A13-L17 WeakPolarHBondContact O-CB 3.28Å; A13-L17 PolarHBondContact O-N 3.12Å
14	L	56.8	Low	52.3	Low	100 Å²	100	127.6 Å²	127.6	52%	0.524	66%	0.661	S	S	.	*	H	α-helix	trans	-67.9	-38.5	178.3	-157.4	77.3	0	0	0	112.1	F10 L17 L18	F10-L14 PolarHBondContact O-N 3.03Å; L14-L17 PolarHBondContact O-N 3.17Å; L14-L18 PolarHBondContact O-N 3.32Å
15	R	56.8	Low	52.8	Low	185 Å²	185	128 Å²	128	70%	0.698	65%	0.652	S	S	*	*	H	α-helix	trans	-68.8	-36.5	177.4	-151.8	175.3	-169.8	-152.5	2	112	S11 V19	S11-R15 WeakPolarHBondContact O-CB 3.44Å; S11-R15 PolarHBondContact O-N 2.95Å; S11-R15 VanDerWaalsContact O-N 3.12Å; R15-V19 VanDerWaalsContact O-CG2 3.28Å; R15-V19 WeakPolarHBondContact O-CG2 3.28Å; R15-V19 PolarHBondContact O-N 3.02Å; R15-V19 VanDerWaalsContact O-N 3.17Å
16	R	56.1	Low	53	Low	187 Å²	187	121.6 Å²	121.6	71%	0.706	64%	0.641	S	S	*	*	H	α-helix	trans	-69.7	-35.4	172.2	-73.8	-179.6	-178.5	-135.8	0.9	112.4	D12 A13 V19 L20	D12-R16 WeakPolarHBondContact O-CB 3.35Å; D12-R16 VanDerWaalsContact O-CG 3.28Å; D12-R16 WeakPolarHBondContact O-CG 3.39Å; D12-R16 PolarHBondContact O-N 3.43Å; A13-R16 PolarHBondContact O-N 3.21Å; R16-V19 PolarHBondContact O-N 3.48Å; R16-L20 PolarHBondContact O-N 2.98Å
17	L	54.2	Low	53.3	Low	117 Å²	117	116.9 Å²	116.9	61%	0.613	64%	0.639	S	S	*	*	H	α-helix	trans	-66.5	-40.3	175.2	-151.1	85.5	0	0	0	111.9	A13 L14 L20 M21	A13-L17 WeakPolarHBondContact O-CB 3.28Å; A13-L17 PolarHBondContact O-N 3.12Å; L14-L17 PolarHBondContact O-N 3.17Å; L17-L20 PolarHBondContact O-N 3.43Å; L17-M21 VanDerWaalsContact O-CG 3.3Å; L17-M21 WeakPolarHBondContact O-CG 3.3Å; L17-M21 PolarHBondContact O-N 3.2Å
18	L	53	Low	53.1	Low	107 Å²	107	117 Å²	117	56%	0.56	64%	0.639	S	S	*	*	H	α-helix	trans	-67.2	-36.9	176.4	-111.9	125.7	0	0	0	112.8	L14 L22	L14-L18 PolarHBondContact O-N 3.32Å; L18-L22 PolarHBondContact O-N 3.29Å
19	V	53.9	Low	53.4	Low	93 Å²	93	114 Å²	114	56%	0.564	63%	0.63	S	S	*	*	H	α-helix	trans	-73.9	-32.8	176.9	175.1	0	0	0	0	111.9	R15 R16 T23	R15-V19 VanDerWaalsContact O-CG2 3.28Å; R15-V19 WeakPolarHBondContact O-CG2 3.28Å; R15-V19 PolarHBondContact O-N 3.02Å; R15-V19 VanDerWaalsContact O-N 3.17Å; R16-V19 PolarHBondContact O-N 3.48Å; V19-T23 PolarHBondContact O-OG1 3.02Å
20	L	47.7	Very low	52.9	Low	109 Å²	109	115.6 Å²	115.6	57%	0.571	64%	0.641	S	S	*	*	H	α-helix	trans	-71.8	-32	172.6	-103.5	114.2	0	0	0	113.1	R16 L17 L22 T23	R16-L20 PolarHBondContact O-N 2.98Å; L17-L20 PolarHBondContact O-N 3.43Å; L20-L22 VanDerWaalsContact C-N 3.32Å; L20-T23 PolarHBondContact O-N 3.17Å; L20-T23 PolarHBondContact O-OG1 3.45Å
21	M	48.4	Very low	52.6	Low	142 Å²	142	114.9 Å²	114.9	70%	0.7	64%	0.642	S	S	*	*	H	α-helix	trans	-73.9	-22.3	175.8	-72.1	-70.7	-95.7	0	0	113.1	L17	L17-M21 VanDerWaalsContact O-CG 3.3Å; L17-M21 WeakPolarHBondContact O-CG 3.3Å; L17-M21 PolarHBondContact O-N 3.2Å
22	L	47	Very low	52.4	Low	126 Å²	126	116.4 Å²	116.4	66%	0.66	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	-10.6	174.8	-99.9	142.4	0	0	0	114.1	L18 L20	L18-L22 PolarHBondContact O-N 3.29Å; L20-L22 VanDerWaalsContact C-N 3.32Å
23	T	48.8	Very low	52.1	Low	108 Å²	108	117.8 Å²	117.8	66%	0.663	66%	0.661	S	S	*	*	S	Bend	trans	-105.7	2.1	179.9	46.9	0	0	0	0	113.7	V19 L20	V19-T23 PolarHBondContact O-OG1 3.02Å; L20-T23 PolarHBondContact O-N 3.17Å; L20-T23 PolarHBondContact O-OG1 3.45Å
24	L	45.7	Very low	51.5	Low	129 Å²	129	119.9 Å²	119.9	68%	0.675	67%	0.67	S	S	*	*			trans	-118.6	20.3	-179.9	-86.3	159.3	0	0	0	113.3	P26	L24-P26 WeakPolarHBondContact O-CD 3.09Å
25	I	51.4	Low	51.3	Low	126 Å²	126	119.8 Å²	119.8	65%	0.646	67%	0.673	S	S	*	*			trans	-81.2	104.5	160.4	-55.3	175.7	0	0	0	104.6	A27	I25-A27 PolarHBondContact O-N 3.1Å; I25-A27 VanDerWaalsContact O-N 3.1Å
26	P	51.2	Low	51	Low	100 Å²	100	118.3 Å²	118.3	65%	0.649	68%	0.679	S	S	*	*			trans	-54.1	127.7	166.3	24.6	-31	0	0	0	105.3	L24 V28	L24-P26 WeakPolarHBondContact O-CD 3.09Å; P26-V28 PolarHBondContact O-N 2.71Å
27	A	56.2	Low	51	Low	99 Å²	99	113.5 Å²	113.5	82%	0.818	67%	0.671	S	S	*	*			trans	-52.3	102.1	165.7	0	0	0	0	0	105.2	I25 G29	I25-A27 PolarHBondContact O-N 3.1Å; I25-A27 VanDerWaalsContact O-N 3.1Å; A27-G29 PolarHBondContact O-N 2.75Å
28	V	51.7	Low	51.5	Low	129 Å²	129	113.3 Å²	113.3	78%	0.782	68%	0.676	S	S	*	*			trans	-67.1	87.5	164.9	-178.8	0	0	0	0	101.6	P26 S30	P26-V28 PolarHBondContact O-N 2.71Å; V28-S30 VanDerWaalsContact C-N 3.34Å; V28-S30 PolarHBondContact O-N 2.75Å
29	G	55.8	Low	52.6	Low	53 Å²	53	114.4 Å²	114.4	55%	0.546	68%	0.68	S	S	.	*			trans	-50.3	114.3	163	0	0	0	0	0	103.6	A27 M31	A27-G29 PolarHBondContact O-N 2.75Å; G29-M31 PolarHBondContact O-N 2.93Å
30	S	51.4	Low	54.2	Low	109 Å²	109	111 Å²	111	76%	0.762	66%	0.66	S	S	*	*			trans	-50	102.6	170	47	0	0	0	0	105.3	V28 P32	V28-S30 VanDerWaalsContact C-N 3.34Å; V28-S30 PolarHBondContact O-N 2.75Å; S30-P32 WeakPolarHBondContact O-CD 3.38Å; S30-P32 VanDerWaalsContact O-N 3.13Å
31	M	47.1	Very low	56.3	Low	167 Å²	167	110.4 Å²	110.4	82%	0.823	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-57.9	122.2	169.1	-66.2	-120.3	97.1	0	0	103.8	G29 V33	G29-M31 PolarHBondContact O-N 2.93Å; M31-V33 PolarHBondContact O-N 3.01Å
32	P	53.7	Low	58.2	Low	112 Å²	112	104.1 Å²	104.1	73%	0.727	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-55.2	122.1	170.5	22.1	-28.4	0	0	0	105.6	S30 P34	S30-P32 WeakPolarHBondContact O-CD 3.38Å; S30-P32 VanDerWaalsContact O-N 3.13Å; P32-P34 WeakPolarHBondContact O-CD 3.33Å; P32-P34 VanDerWaalsContact O-N 3.11Å
33	V	49.8	Very low	59.9	Low	115 Å²	115	103.8 Å²	103.8	70%	0.697	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-50.3	122.9	166.5	174.6	0	0	0	0	104.8	M31 T35	M31-V33 PolarHBondContact O-N 3.01Å; V33-T35 PolarHBondContact O-N 2.98Å
34	P	44.9	Very low	61.8	Low	105 Å²	105	105.9 Å²	105.9	68%	0.682	64%	0.642	S	S	*	*			trans	-62.9	96.6	173.2	-15.2	28.5	0	0	0	106.5	P32 D36	P32-P34 WeakPolarHBondContact O-CD 3.33Å; P32-P34 VanDerWaalsContact O-N 3.11Å; P34-D36 PolarHBondContact O-N 2.77Å
35	T	51.4	Low	63.9	Low	97 Å²	97	102.3 Å²	102.3	60%	0.595	63%	0.626	S	S	*	*			trans	-78.7	70.3	168.9	53.2	0	0	0	0	106.5	V33 V37	V33-T35 PolarHBondContact O-N 2.98Å; T35-V37 PolarHBondContact O-N 2.96Å
36	D	51.1	Low	65.8	Low	154 Å²	154	96.4 Å²	96.4	82%	0.824	60%	0.596	S	S	*	*			trans	-73.2	37.3	164.5	-79.8	-26.8	0	0	0	110.1	P34	P34-D36 PolarHBondContact O-N 2.77Å
37	V	56.6	Low	67.9	Low	87 Å²	87	94.9 Å²	94.9	53%	0.527	58%	0.58	S	S	.	*	S	Bend	trans	-87.2	120	161.9	-170.8	0	0	0	0	104.2	T35 M39	T35-V37 PolarHBondContact O-N 2.96Å; V37-M39 HydrophobicContact CB-CG 4.41Å; V37-M39 VanDerWaalsContact O-CG 3.32Å; V37-M39 WeakPolarHBondContact O-CG 3.32Å; V37-M39 PolarHBondContact O-N 2.71Å
38	P	65	Low	69.7	Low	112 Å²	112	90.2 Å²	90.2	73%	0.727	54%	0.541	S	S	*	.			trans	-62.7	90.6	173.7	23.9	-30.1	0	0	0	108
39	M	76.4	Confident	71.8	Confident	131 Å²	131	85.4 Å²	85.4	65%	0.645	51%	0.513	S	S	*	.			trans	-78.6	136.4	178.9	-58	-164.6	88.5	0	0	108	V37 T41	V37-M39 HydrophobicContact CB-CG 4.41Å; V37-M39 VanDerWaalsContact O-CG 3.32Å; V37-M39 WeakPolarHBondContact O-CG 3.32Å; V37-M39 PolarHBondContact O-N 2.71Å; M39-T41 PolarHBondContact O-N 2.91Å
40	C	87.7	Confident	73.8	Confident	20 Å²	20	82.9 Å²	82.9	14%	0.135	49%	0.487	C	S	.	.			trans	-62.5	122.8	173.5	-178.3	0	0	0	0	110	A149 C176	C40-A149 HydrophobicContact CB-CB 4.44Å; C40-A149 WeakPolarHBondContact CB-O 3.49Å; C40-C176 VanDerWaalsContact CA-SG 3.53Å; C40-C176 HydrophobicContact CB-CB 3.5Å; C40-C176 VanDerWaalsContact CB-CB 3.5Å; C40-C176 WeakPolarHBondContact CB-SG 3.48Å; C40-C176 WeakPolarHBondContact SG-CB 2.96Å; C40-C176 CovalentContact SG-SG 2.02Å; C40-C176 PolarHBondContact SG-SG 3.2Å
41	T	90.5	Very high	76	Confident	98 Å²	98	79.1 Å²	79.1	60%	0.601	46%	0.46	S	S	*	.			trans	-109.4	16.7	177.8	59.7	0	0	0	0	112.3	M39 S43 G178	M39-T41 PolarHBondContact O-N 2.91Å; T41-S43 PolarHBondContact O-N 3.45Å; T41-G178 PolarHBondContact N-O 3.02Å; T41-G178 PolarHBondContact OG1-O 3.29Å
42	A	89.3	Confident	78.4	Confident	9 Å²	9	71.1 Å²	71.1	7%	0.074	42%	0.42	C	S	.	.			trans	-60.3	128.3	178.1	0	0	0	0	0	111	A149 W181	A42-A149 WeakPolarHBondContact O-CB 3.21Å; A42-W181 HydrophobicContact CB-CD2 4.44Å; A42-W181 HydrophobicContact CB-CZ2 4.07Å
43	S	82.4	Confident	80.5	Confident	120 Å²	120	67 Å²	67	84%	0.839	39%	0.393	S	S	*	.			trans	-80.6	-29.3	-173.9	53.1	0	0	0	0	113.9	T41	T41-S43 PolarHBondContact O-N 3.45Å
44	E	88.1	Confident	82.8	Confident	151 Å²	151	61.7 Å²	61.7	71%	0.706	36%	0.362	S	S	*	.	S	Bend	trans	-109.7	147.1	-176.6	-64	-173.8	172.1	0	0	111.6	W181	E44-W181 PolarHBondContact O-NE1 3.19Å
45	T	90.4	Very high	85.3	Confident	55 Å²	55	60.2 Å²	60.2	34%	0.337	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-66.1	135.7	169.5	-53.8	0	0	0	0	110.6	E146 A147 F148	T45-E146 HydrophobicContact CG2-CB 4.12Å; T45-A147 WeakPolarHBondContact CG2-O 3.49Å; T45-F148 HydrophobicContact CG2-CD1 4.14Å; T45-F148 HydrophobicContact CG2-CD2 4.06Å; T45-F148 HydrophobicContact CG2-CE1 3.73Å; T45-F148 HydrophobicContact CG2-CE2 3.54Å; T45-F148 HydrophobicContact CG2-CG 4.3Å; T45-F148 HydrophobicContact CG2-CZ 3.39Å; T45-F148 WeakPolarHBondContact OG1-CD1 3.46Å; T45-F148 WeakPolarHBondContact OG1-CE1 3.45Å
46	A	91.8	Very high	87.5	Confident	2 Å²	2	55.6 Å²	55.6	2%	0.017	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	140	173.5	0	0	0	0	0	111.5	Y48 E146 A147 W181	A46-Y48 HydrophobicContact CB-CD2 4.05Å; A46-Y48 HydrophobicContact CB-CE2 3.49Å; A46-Y48 VanDerWaalsContact CB-CE2 3.49Å; A46-E146 WeakPolarHBondContact O-CA 3.14Å; A46-A147 PolarHBondContact N-O 3.04Å; A46-A147 PolarHBondContact O-N 3.45Å; A46-W181 HydrophobicContact CB-CB 4.06Å; A46-W181 HydrophobicContact CB-CD2 3.48Å; A46-W181 VanDerWaalsContact CB-CD2 3.48Å; A46-W181 HydrophobicContact CB-CE3 4.09Å; A46-W181 HydrophobicContact CB-CG 3.45Å; A46-W181 VanDerWaalsContact CB-CG 3.45Å; A46-W181 HydrophobicContact CB-CZ2 4.41Å
47	H	93.5	Very high	89.7	Confident	68 Å²	68	50.5 Å²	50.5	32%	0.315	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	135.4	171.3	-66.6	42.1	0	0	0	108.4	E146 I249	H47-E146 IonicContact CE1-OE1 2.69Å; H47-E146 PolarHBondContact CE1-OE1 3.43Å; H47-E146 IonicContact NE2-OE1 2.76Å; H47-E146 PolarHBondContact NE2-OE1 2.78Å; H47-I249 HydrophobicContact CB-CB 4.23Å; H47-I249 HydrophobicContact CB-CD1 4.44Å; H47-I249 PolarHBondContact O-N 3.24Å
48	Y	95.4	Very high	91.6	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	146.2	-178.6	-79.4	-91.5	0	0	0	110.9	A46 E144 F145 A147 L175 W181 K182 L246 T247 K248	A46-Y48 HydrophobicContact CB-CD2 4.05Å; A46-Y48 HydrophobicContact CB-CE2 3.49Å; A46-Y48 VanDerWaalsContact CB-CE2 3.49Å; Y48-E144 VanDerWaalsContact O-CA 3.31Å; Y48-E144 WeakPolarHBondContact O-CA 3Å; Y48-F145 HydrophobicContact CD2-CE2 4.27Å; Y48-F145 HydrophobicContact CD2-CZ 4.42Å; Y48-F145 HydrophobicContact CG-CE2 4.25Å; Y48-F145 AromaticContact CG-CZ 3.97Å; Y48-F145 HydrophobicContact CG-CZ 3.97Å; Y48-F145 PolarHBondContact N-O 3.39Å; Y48-F145 PolarHBondContact O-N 2.95Å; Y48-A147 HydrophobicContact CD2-CB 4.25Å; Y48-A147 HydrophobicContact CE2-CB 4.26Å; Y48-L175 HydrophobicContact CD2-CD1 4.17Å; Y48-L175 HydrophobicContact CE1-CD2 4.42Å; Y48-L175 HydrophobicContact CE2-CB 4.31Å; Y48-L175 HydrophobicContact CE2-CD1 4.16Å; Y48-L175 HydrophobicContact CG-CD1 4.49Å; Y48-W181 HydrophobicContact CE2-CE3 4.08Å; Y48-W181 WeakPolarHBondContact OH-CB 3.31Å; Y48-K182 VanDerWaalsContact CE1-O 3.24Å; Y48-K182 WeakPolarHBondContact CE1-O 3.4Å; Y48-K182 PolarHBondContact OH-N 3.02Å; Y48-K182 PolarHBondContact OH-O 3.34Å; Y48-L246 HydrophobicContact CD1-CB 4.43Å; Y48-T247 WeakPolarHBondContact CA-O 3.23Å; Y48-K248 HydrophobicContact CD1-CB 4.16Å; Y48-K248 HydrophobicContact CE1-CB 3.71Å; Y48-K248 HydrophobicContact CE1-CG 4.39Å
49	S	95.7	Very high	92.9	Very high	29 Å²	29	48 Å²	48	20%	0.203	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	125.5	163.7	175	0	0	0	0	108.6	L246 T247	S49-L246 CarbonylContact O-C 3.2Å; S49-L246 WeakPolarHBondContact O-CA 3.1Å; S49-T247 PolarHBondContact N-O 3.04Å; S49-T247 PolarHBondContact O-N 3.16Å
50	L	96.8	Very high	93.8	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	121.8	170.8	-176.8	154.2	0	0	0	108.4	F52 L77 L129 D142 A143 F145 L154 F156 V244 L246	L50-F52 HydrophobicContact CD2-CB 4.16Å; L50-L77 HydrophobicContact CD1-CD1 4.43Å; L50-L77 HydrophobicContact CD2-CD1 3.59Å; L50-L129 HydrophobicContact CD1-CD1 3.95Å; L50-D142 CarbonylContact O-C 3.53Å; L50-D142 VanDerWaalsContact O-CA 3.24Å; L50-D142 WeakPolarHBondContact O-CA 3.29Å; L50-A143 PolarHBondContact N-O 3.37Å; L50-A143 PolarHBondContact O-N 2.85Å; L50-F145 HydrophobicContact CB-CD1 4.34Å; L50-F145 HydrophobicContact CB-CE1 4.02Å; L50-L154 HydrophobicContact CD1-CD2 4.06Å; L50-F156 HydrophobicContact CD1-CD1 4.2Å; L50-F156 HydrophobicContact CD1-CE1 4.43Å; L50-V244 HydrophobicContact CD1-CG2 4.13Å; L50-V244 HydrophobicContact CD2-CG2 3.99Å; L50-V244 HydrophobicContact CG-CG2 3.74Å; L50-L246 HydrophobicContact CB-CD2 3.77Å; L50-L246 HydrophobicContact CD1-CD2 3.66Å; L50-L246 HydrophobicContact CG-CD2 3.58Å
51	T	97.4	Very high	94.2	Very high	29 Å²	29	42.6 Å²	42.6	18%	0.178	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	110.5	169.8	-57.6	0	0	0	0	109.1	M141 D142 V244 T245	T51-M141 CarbonylContact C-O 3.58Å; T51-M141 WeakPolarHBondContact CA-O 3.35Å; T51-D142 VanDerWaalsContact CB-OD1 3.29Å; T51-D142 WeakPolarHBondContact CB-OD1 3.5Å; T51-D142 VanDerWaalsContact CG2-OD1 3.3Å; T51-D142 WeakPolarHBondContact CG2-OD1 3.34Å; T51-D142 PolarHBondContact OG1-OD1 3.3Å; T51-V244 CarbonylContact O-C 3.57Å; T51-V244 WeakPolarHBondContact O-CA 3.42Å; T51-T245 PolarHBondContact N-O 3.04Å; T51-T245 PolarHBondContact O-N 3.21Å
52	F	98.3	Very high	94.5	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	134.3	167.8	176.3	-77.4	0	0	0	109.1	L50 W74 L77 Q140 M141 F156 V158 V168 L189 A242	L50-F52 HydrophobicContact CD2-CB 4.16Å; F52-W74 AromaticContact CE1-CD2 3.96Å; F52-W74 HydrophobicContact CE1-CD2 3.96Å; F52-W74 HydrophobicContact CE1-CE3 4.39Å; F52-W74 HydrophobicContact CE1-CG 4.15Å; F52-W74 HydrophobicContact CE1-CZ2 4.5Å; F52-W74 AromaticContact CZ-CD2 3.85Å; F52-W74 HydrophobicContact CZ-CD2 3.85Å; F52-W74 AromaticContact CZ-CE3 3.82Å; F52-W74 HydrophobicContact CZ-CE3 3.82Å; F52-W74 HydrophobicContact CZ-CG 4.45Å; F52-W74 HydrophobicContact CZ-CH2 4.16Å; F52-W74 HydrophobicContact CZ-CZ2 4.19Å; F52-W74 AromaticContact CZ-CZ3 3.99Å; F52-W74 HydrophobicContact CZ-CZ3 3.99Å; F52-L77 HydrophobicContact CB-CD1 4.11Å; F52-L77 HydrophobicContact CD2-CD1 4.42Å; F52-Q140 CarbonylContact O-C 3.56Å; F52-Q140 WeakPolarHBondContact O-CA 3.06Å; F52-M141 HydrophobicContact CB-CB 4.37Å; F52-M141 HydrophobicContact CB-CG 3.75Å; F52-M141 HydrophobicContact CB-SD 3.86Å; F52-M141 HydrophobicContact CD1-CE 3.2Å; F52-M141 HydrophobicContact CD1-CG 3.54Å; F52-M141 HydrophobicContact CD1-SD 3.61Å; F52-M141 HydrophobicContact CD2-CE 4.38Å; F52-M141 HydrophobicContact CD2-SD 4.46Å; F52-M141 HydrophobicContact CE1-CE 3.23Å; F52-M141 HydrophobicContact CE1-CG 4.46Å; F52-M141 HydrophobicContact CE1-SD 4.24Å; F52-M141 HydrophobicContact CE2-CE 4.39Å; F52-M141 HydrophobicContact CG-CE 3.82Å; F52-M141 HydrophobicContact CG-CG 3.93Å; F52-M141 HydrophobicContact CG-SD 3.72Å; F52-M141 HydrophobicContact CZ-CE 3.85Å; F52-M141 PolarHBondContact N-O 3.07Å; F52-M141 PolarHBondContact O-N 2.92Å; F52-F156 HydrophobicContact CD2-CE2 4.42Å; F52-V158 HydrophobicContact CD2-CG2 4.12Å; F52-V158 HydrophobicContact CE2-CB 4.37Å; F52-V158 HydrophobicContact CE2-CG2 3.94Å; F52-V158 HydrophobicContact CZ-CG1 4.49Å; F52-V168 HydrophobicContact CE2-CG2 3.75Å; F52-V168 HydrophobicContact CZ-CG2 4.05Å; F52-L189 HydrophobicContact CD2-CD1 3.97Å; F52-L189 HydrophobicContact CE2-CD1 3.69Å; F52-A242 HydrophobicContact CD2-CB 4.5Å; F52-A242 HydrophobicContact CE1-CB 4.08Å; F52-A242 HydrophobicContact CE2-CB 3.58Å; F52-A242 HydrophobicContact CZ-CB 3.34Å
53	T	98	Very high	94.7	Very high	25 Å²	25	39 Å²	39	15%	0.153	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	112.7	176.3	-57.4	0	0	0	0	108.9	Q140 A242 K243	T53-Q140 HydrophobicContact CG2-CG 4.07Å; T53-Q140 PolarHBondContact OG1-NE2 3.02Å; T53-A242 CarbonylContact O-C 3.2Å; T53-A242 VanDerWaalsContact O-CA 3.31Å; T53-A242 WeakPolarHBondContact O-CA 3.44Å; T53-K243 PolarHBondContact N-O 3.07Å; T53-K243 PolarHBondContact O-N 3.28Å
54	G	97.8	Very high	95.4	Very high	4 Å²	4	37.4 Å²	37.4	4%	0.041	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	135.3	170.9	0	0	0	0	0	110.4	G137 S138 G139	G54-G137 CarbonylContact C-O 3.56Å; G54-G137 VanDerWaalsContact CA-O 3.3Å; G54-G137 WeakPolarHBondContact CA-O 3.3Å; G54-S138 CarbonylContact O-C 3.58Å; G54-S138 VanDerWaalsContact O-CA 3.3Å; G54-S138 WeakPolarHBondContact O-CA 3.38Å; G54-G139 PolarHBondContact N-O 2.98Å
55	K	97.9	Very high	95.8	Very high	73 Å²	73	32.3 Å²	32.3	32%	0.317	18%	0.182	S	C	.	.			trans	-123.7	15.9	172	-65.5	-177.7	169.1	-174.5	0	111.1	T57 G137 I241 K243	K55-T57 PolarHBondContact O-N 3.36Å; K55-G137 PolarHBondContact N-O 3.24Å; K55-I241 CarbonylContact C-O 3.59Å; K55-I241 VanDerWaalsContact C-O 3.23Å; K55-I241 VanDerWaalsContact CA-O 3.26Å; K55-I241 WeakPolarHBondContact CA-O 3.3Å; K55-I241 WeakPolarHBondContact CB-O 3.23Å; K55-I241 PolarHBondContact N-O 3.41Å; K55-K243 HydrophobicContact CD-CB 4.49Å
56	W	97.9	Very high	96.1	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.17	C	C	.	.			trans	-78.3	93.7	177.8	-171.5	22.7	0	0	0	108.6	F61 Y65 P66 A72 W74 G137 L160 V161 F202 I241	W56-F61 AromaticContact CD1-CD2 3.79Å; W56-F61 AromaticContact CD1-CG 3.99Å; W56-Y65 AromaticContact CD1-CE2 3.78Å; W56-Y65 HydrophobicContact CD2-CE2 4.37Å; W56-Y65 HydrophobicContact CG-CE2 4.11Å; W56-Y65 AromaticContact NE1-CD2 3.74Å; W56-Y65 AromaticContact NE1-CE2 3.81Å; W56-Y65 PolarHBondContact O-OH 3.04Å; W56-P66 HydrophobicContact CH2-CG 4.01Å; W56-P66 HydrophobicContact CZ2-CG 3.9Å; W56-A72 HydrophobicContact CD2-CB 4.05Å; W56-A72 HydrophobicContact CE3-CB 3.85Å; W56-A72 HydrophobicContact CH2-CB 3.81Å; W56-A72 HydrophobicContact CZ2-CB 4Å; W56-A72 HydrophobicContact CZ3-CB 3.73Å; W56-W74 HydrophobicContact CB-CH2 4.4Å; W56-W74 HydrophobicContact CB-CZ2 3.64Å; W56-G137 PolarHBondContact N-O 2.84Å; W56-G137 CarbonylContact O-C 3.58Å; W56-G137 WeakPolarHBondContact O-CA 3.42Å; W56-L160 HydrophobicContact CZ3-CB 4.32Å; W56-V161 WeakPolarHBondContact CZ3-O 2.95Å; W56-F202 AromaticContact CE2-CZ 3.92Å; W56-F202 AromaticContact CH2-CD1 3.89Å; W56-F202 HydrophobicContact CH2-CD1 3.89Å; W56-F202 AromaticContact CH2-CE1 3.89Å; W56-F202 HydrophobicContact CH2-CE1 3.89Å; W56-F202 HydrophobicContact CH2-CZ 4.46Å; W56-F202 AromaticContact CZ2-CD1 3.64Å; W56-F202 HydrophobicContact CZ2-CD1 3.64Å; W56-F202 HydrophobicContact CZ2-CD2 4.25Å; W56-F202 AromaticContact CZ2-CE1 3.29Å; W56-F202 HydrophobicContact CZ2-CE1 3.29Å; W56-F202 AromaticContact CZ2-CE2 3.91Å; W56-F202 HydrophobicContact CZ2-CE2 3.91Å; W56-F202 HydrophobicContact CZ2-CG 4.14Å; W56-F202 AromaticContact CZ2-CZ 3.45Å; W56-F202 HydrophobicContact CZ2-CZ 3.45Å; W56-F202 VanDerWaalsContact CZ2-CZ 3.45Å; W56-F202 AromaticContact NE1-CZ 3.9Å; W56-I241 HydrophobicContact CB-CD1 4.16Å; W56-I241 HydrophobicContact CB-CG1 3.71Å; W56-I241 HydrophobicContact CD2-CD1 4.33Å; W56-I241 HydrophobicContact CG-CD1 3.91Å; W56-I241 HydrophobicContact CG-CG1 3.98Å; W56-I241 PolarHBondContact N-O 2.85Å; W56-I241 VanDerWaalsContact N-O 3.13Å
57	T	96.8	Very high	96.2	Very high	47 Å²	47	35.6 Å²	35.6	29%	0.288	20%	0.197	S	C	.	.			trans	-120.6	155.1	-179.2	61.7	0	0	0	0	110.2	K55 A59 A60 F61 Y65	K55-T57 PolarHBondContact O-N 3.36Å; T57-A59 PolarHBondContact O-N 3.33Å; T57-A60 PolarHBondContact O-N 2.75Å; T57-A60 WeakPolarHBondContact OG1-CB 3.38Å; T57-A60 PolarHBondContact OG1-N 2.9Å; T57-F61 PolarHBondContact O-N 3.43Å; T57-Y65 VanDerWaalsContact C-CE2 3.4Å
58	Q	95.6	Very high	96.1	Very high	83 Å²	83	39.9 Å²	39.9	39%	0.388	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-28.6	175.1	-170.9	174.9	10.3	0	0	112.3	F61 P62 Y65	Q58-F61 CarbonylContact O-C 3.55Å; Q58-P62 WeakPolarHBondContact O-CA 3.14Å; Q58-P62 VanDerWaalsContact O-CB 3.3Å; Q58-P62 WeakPolarHBondContact O-CB 3.03Å; Q58-Y65 HydrophobicContact CB-CD1 3.8Å; Q58-Y65 HydrophobicContact CB-CD2 4.26Å; Q58-Y65 HydrophobicContact CB-CE1 4.16Å; Q58-Y65 HydrophobicContact CB-CG 3.84Å; Q58-Y65 HydrophobicContact CG-CD1 4.19Å; Q58-Y65 HydrophobicContact CG-CG 4.13Å
59	A	93.9	Very high	95.8	Very high	63 Å²	63	49.2 Å²	49.2	52%	0.521	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-44.9	176.5	0	0	0	0	0	112.3	T57	T57-A59 PolarHBondContact O-N 3.33Å
60	A	94.1	Very high	95.8	Very high	39 Å²	39	50.2 Å²	50.2	32%	0.322	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-33.5	179.9	0	0	0	0	0	112.9	T57 P239	T57-A60 PolarHBondContact O-N 2.75Å; T57-A60 WeakPolarHBondContact OG1-CB 3.38Å; T57-A60 PolarHBondContact OG1-N 2.9Å; A60-P239 HydrophobicContact CB-CG 4.4Å
61	F	97.2	Very high	95.7	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	27%	0.268	C	S	.	.			trans	-130.6	71.3	-178	-58	-87.8	0	0	0	110.5	W56 T57 Q58 K63 F230 Y232 L238 P239 I241	W56-F61 AromaticContact CD1-CD2 3.79Å; W56-F61 AromaticContact CD1-CG 3.99Å; T57-F61 PolarHBondContact O-N 3.43Å; Q58-F61 CarbonylContact O-C 3.55Å; F61-K63 VanDerWaalsContact C-N 3.32Å; F61-K63 PolarHBondContact O-N 3.16Å; F61-F230 HydrophobicContact CD1-CD1 4Å; F61-F230 AromaticContact CD1-CE1 3.76Å; F61-F230 HydrophobicContact CD1-CE1 3.76Å; F61-F230 HydrophobicContact CE1-CD1 4.21Å; F61-F230 AromaticContact CE1-CE1 3.98Å; F61-F230 HydrophobicContact CE1-CE1 3.98Å; F61-Y232 VanDerWaalsContact C-OH 3.32Å; F61-Y232 WeakPolarHBondContact CA-OH 3.3Å; F61-Y232 HydrophobicContact CD1-CE2 4.44Å; F61-L238 HydrophobicContact CE1-CD2 4.45Å; F61-P239 HydrophobicContact CE1-CG 3.99Å; F61-P239 HydrophobicContact CE2-CG 4.18Å; F61-P239 HydrophobicContact CZ-CG 3.72Å; F61-P239 VanDerWaalsContact CZ-O 3.32Å; F61-P239 WeakPolarHBondContact CZ-O 3.41Å; F61-I241 HydrophobicContact CD2-CG1 4.35Å; F61-I241 HydrophobicContact CE1-CB 4.45Å; F61-I241 HydrophobicContact CE1-CG1 4.49Å; F61-I241 HydrophobicContact CE2-CB 3.97Å; F61-I241 HydrophobicContact CE2-CG1 3.74Å; F61-I241 HydrophobicContact CZ-CB 3.63Å; F61-I241 HydrophobicContact CZ-CD1 4.41Å; F61-I241 HydrophobicContact CZ-CG1 3.8Å
62	P	95.8	Very high	95.7	Very high	11 Å²	11	51.4 Å²	51.4	7%	0.071	26%	0.261	C	S	.	.			trans	-72.1	-23.6	-173.4	26.8	-34.5	0	0	0	113.9	Q58 Q64 Y232 L283	Q58-P62 WeakPolarHBondContact O-CA 3.14Å; Q58-P62 VanDerWaalsContact O-CB 3.3Å; Q58-P62 WeakPolarHBondContact O-CB 3.03Å; P62-Q64 PolarHBondContact O-N 3.36Å; P62-Y232 HydrophobicContact CG-CE1 4.32Å; P62-L283 HydrophobicContact CG-CD2 4.08Å
63	K	95.1	Very high	95.7	Very high	20 Å²	20	53.6 Å²	53.6	9%	0.087	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	116.3	-176.2	-166.8	-179.7	-175.7	-171.2	0	109.9	F61 Y65 P226 N228 F231 Y232	F61-K63 VanDerWaalsContact C-N 3.32Å; F61-K63 PolarHBondContact O-N 3.16Å; K63-Y65 PolarHBondContact O-N 3.44Å; K63-Y65 VanDerWaalsContact O-N 3.07Å; K63-P226 PolarHBondContact NZ-O 3.16Å; K63-N228 WeakPolarHBondContact CE-O 3.44Å; K63-N228 PolarHBondContact NZ-O 2.88Å; K63-F231 PolarHBondContact NZ-O 2.86Å; K63-Y232 HydrophobicContact CB-CE1 3.71Å; K63-Y232 HydrophobicContact CB-CE2 4.44Å; K63-Y232 WeakPolarHBondContact CB-OH 3.17Å; K63-Y232 PolarHBondContact N-OH 2.69Å; K63-Y232 VanDerWaalsContact N-OH 3.08Å
64	Q	95.6	Very high	95.7	Very high	86 Å²	86	52.4 Å²	52.4	40%	0.402	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	54	26.7	176.2	-60.3	168.9	-26.7	0	0	114.3	P62 P66 F202 A227 S229	P62-Q64 PolarHBondContact O-N 3.36Å; Q64-P66 VanDerWaalsContact O-CD 3.23Å; Q64-P66 WeakPolarHBondContact O-CD 3.24Å; Q64-P66 VanDerWaalsContact O-N 3.12Å; Q64-F202 HydrophobicContact CB-CD2 4.34Å; Q64-F202 WeakPolarHBondContact O-CD2 3.46Å; Q64-A227 PolarHBondContact NE2-O 3.13Å; Q64-A227 PolarHBondContact OE1-O 2.81Å; Q64-S229 PolarHBondContact OE1-OG 3.2Å
65	Y	97.3	Very high	95.6	Very high	44 Å²	44	52.6 Å²	52.6	17%	0.173	26%	0.264	C	S	.	.			trans	-52.4	120.4	-179.5	-173	-95	0	0	0	110.7	W56 T57 Q58 K63 I67 A72	W56-Y65 AromaticContact CD1-CE2 3.78Å; W56-Y65 HydrophobicContact CD2-CE2 4.37Å; W56-Y65 HydrophobicContact CG-CE2 4.11Å; W56-Y65 AromaticContact NE1-CD2 3.74Å; W56-Y65 AromaticContact NE1-CE2 3.81Å; W56-Y65 PolarHBondContact O-OH 3.04Å; T57-Y65 VanDerWaalsContact C-CE2 3.4Å; Q58-Y65 HydrophobicContact CB-CD1 3.8Å; Q58-Y65 HydrophobicContact CB-CD2 4.26Å; Q58-Y65 HydrophobicContact CB-CE1 4.16Å; Q58-Y65 HydrophobicContact CB-CG 3.84Å; Q58-Y65 HydrophobicContact CG-CD1 4.19Å; Q58-Y65 HydrophobicContact CG-CG 4.13Å; K63-Y65 PolarHBondContact O-N 3.44Å; K63-Y65 VanDerWaalsContact O-N 3.07Å; Y65-I67 HydrophobicContact CD1-CG1 4.07Å; Y65-I67 PolarHBondContact O-N 3.06Å; Y65-A72 HydrophobicContact CE1-CB 3.9Å; Y65-A72 HydrophobicContact CE2-CB 3.8Å; Y65-A72 VanDerWaalsContact CZ-CB 3.47Å
66	P	96.3	Very high	95.3	Very high	15 Å²	15	52.2 Å²	52.2	10%	0.097	27%	0.266	C	S	.	.			trans	-68.8	113.2	-176	-24.1	35.5	0	0	0	112	W56 Q64 P71 A72 P162 F202	W56-P66 HydrophobicContact CH2-CG 4.01Å; W56-P66 HydrophobicContact CZ2-CG 3.9Å; Q64-P66 VanDerWaalsContact O-CD 3.23Å; Q64-P66 WeakPolarHBondContact O-CD 3.24Å; Q64-P66 VanDerWaalsContact O-N 3.12Å; P66-P71 CarbonylContact O-C 3.58Å; P66-A72 HydrophobicContact CB-CB 4.29Å; P66-A72 WeakPolarHBondContact O-CB 3.2Å; P66-A72 PolarHBondContact O-N 3.26Å; P66-P162 HydrophobicContact CB-CG 3.97Å; P66-P162 HydrophobicContact CG-CG 4.02Å; P66-F202 HydrophobicContact CG-CB 3.65Å; P66-F202 HydrophobicContact CG-CD1 4.44Å; P66-F202 HydrophobicContact CG-CD2 3.74Å; P66-F202 HydrophobicContact CG-CG 3.71Å
67	I	94.6	Very high	95.1	Very high	112 Å²	112	52.2 Å²	52.2	57%	0.574	27%	0.266	S	S	*	.			trans	-100.6	-23	179.3	-58.5	167.8	0	0	0	111.3	Y65	Y65-I67 HydrophobicContact CD1-CG1 4.07Å; Y65-I67 PolarHBondContact O-N 3.06Å
68	Y	91.1	Very high	94.8	Very high	157 Å²	157	50.1 Å²	50.1	62%	0.616	25%	0.253	S	S	*	.	S	Bend	trans	-153.7	143.9	-171.5	-177.6	-114.4	0	0	0	113.4	P70	Y68-P70 CarbonylContact C-O 3.5Å
69	R	89.6	Confident	94.6	Very high	197 Å²	197	46.2 Å²	46.2	74%	0.743	23%	0.234	S	C	*	.	S	Bend	trans	46.1	73.9	176.8	-80.5	-163.9	-80.6	-132.7	-1.8	115.5
70	P	94.2	Very high	94.5	Very high	49 Å²	49	43.2 Å²	43.2	32%	0.318	21%	0.21	S	C	.	.	S	Bend	cis	-86	160.3	-18.7	32.3	-30.6	0	0	0	112	Y68 V161 P162	Y68-P70 CarbonylContact C-O 3.5Å; P70-V161 HydrophobicContact CG-CG1 4.11Å; P70-P162 HydrophobicContact CG-CB 3.88Å; P70-P162 HydrophobicContact CG-CG 4.02Å
71	P	96.1	Very high	94.4	Very high	53 Å²	53	41.4 Å²	41.4	34%	0.344	20%	0.195	S	C	.	.	P	Polyproline II helix	trans	-65.5	158.7	168.2	30.6	-34.8	0	0	0	111.2	P66 Q73	P66-P71 CarbonylContact O-C 3.58Å; P71-Q73 PolarHBondContact O-N 3.35Å; P71-Q73 PolarHBondContact O-OE1 3.03Å
72	A	97.3	Very high	94.2	Very high	2 Å²	2	41.5 Å²	41.5	2%	0.017	20%	0.195	C	C	.	.	S	Bend	trans	-56.6	121.5	175.8	0	0	0	0	0	110.6	W56 Y65 P66 G136 G137 V161	W56-A72 HydrophobicContact CD2-CB 4.05Å; W56-A72 HydrophobicContact CE3-CB 3.85Å; W56-A72 HydrophobicContact CH2-CB 3.81Å; W56-A72 HydrophobicContact CZ2-CB 4Å; W56-A72 HydrophobicContact CZ3-CB 3.73Å; Y65-A72 HydrophobicContact CE1-CB 3.9Å; Y65-A72 HydrophobicContact CE2-CB 3.8Å; Y65-A72 VanDerWaalsContact CZ-CB 3.47Å; P66-A72 HydrophobicContact CB-CB 4.29Å; P66-A72 WeakPolarHBondContact O-CB 3.2Å; P66-A72 PolarHBondContact O-N 3.26Å; A72-G136 CarbonylContact O-C 3.6Å; A72-G136 WeakPolarHBondContact O-CA 3.42Å; A72-G136 PolarHBondContact O-N 2.72Å; A72-G137 PolarHBondContact O-N 3.02Å; A72-G137 VanDerWaalsContact O-N 3.09Å; A72-V161 WeakPolarHBondContact CA-O 3.22Å
73	Q	97.1	Very high	94	Very high	45 Å²	45	41.5 Å²	41.5	21%	0.21	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	177	-175.9	68	-175	67.7	0	0	110.2	P71 V134 V161	P71-Q73 PolarHBondContact O-N 3.35Å; P71-Q73 PolarHBondContact O-OE1 3.03Å; Q73-V134 WeakPolarHBondContact CB-O 3.29Å; Q73-V161 HydrophobicContact CG-CB 3.56Å; Q73-V161 HydrophobicContact CG-CG1 3.57Å; Q73-V161 PolarHBondContact N-O 3.45Å; Q73-V161 PolarHBondContact O-N 2.86Å
74	W	98	Very high	93.8	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	143.4	179.8	-58.7	94.6	0	0	0	110	F52 W56 A133 V134 G137 M141 V158 L160 V168 I241 A242	F52-W74 AromaticContact CE1-CD2 3.96Å; F52-W74 HydrophobicContact CE1-CD2 3.96Å; F52-W74 HydrophobicContact CE1-CE3 4.39Å; F52-W74 HydrophobicContact CE1-CG 4.15Å; F52-W74 HydrophobicContact CE1-CZ2 4.5Å; F52-W74 AromaticContact CZ-CD2 3.85Å; F52-W74 HydrophobicContact CZ-CD2 3.85Å; F52-W74 AromaticContact CZ-CE3 3.82Å; F52-W74 HydrophobicContact CZ-CE3 3.82Å; F52-W74 HydrophobicContact CZ-CG 4.45Å; F52-W74 HydrophobicContact CZ-CH2 4.16Å; F52-W74 HydrophobicContact CZ-CZ2 4.19Å; F52-W74 AromaticContact CZ-CZ3 3.99Å; F52-W74 HydrophobicContact CZ-CZ3 3.99Å; W56-W74 HydrophobicContact CB-CH2 4.4Å; W56-W74 HydrophobicContact CB-CZ2 3.64Å; W74-A133 WeakPolarHBondContact O-CB 3.46Å; W74-V134 PolarHBondContact N-O 2.87Å; W74-V134 PolarHBondContact O-N 2.87Å; W74-G137 PolarHBondContact NE1-O 3.34Å; W74-M141 HydrophobicContact CB-CE 3.45Å; W74-M141 VanDerWaalsContact CB-CE 3.45Å; W74-M141 HydrophobicContact CG-CE 3.93Å; W74-V158 HydrophobicContact CB-CG1 3.92Å; W74-V158 HydrophobicContact CD2-CG1 4.49Å; W74-V158 HydrophobicContact CE3-CG1 3.88Å; W74-L160 HydrophobicContact CH2-CG 4.38Å; W74-L160 HydrophobicContact CZ3-CD1 3.8Å; W74-L160 HydrophobicContact CZ3-CG 3.86Å; W74-V168 HydrophobicContact CE3-CG2 4.19Å; W74-V168 HydrophobicContact CH2-CG1 4.32Å; W74-V168 HydrophobicContact CH2-CG2 4.25Å; W74-V168 HydrophobicContact CZ3-CB 4.46Å; W74-V168 HydrophobicContact CZ3-CG1 4.09Å; W74-V168 HydrophobicContact CZ3-CG2 3.52Å; W74-I241 HydrophobicContact CH2-CD1 4.21Å; W74-I241 HydrophobicContact CH2-CG1 3.94Å; W74-I241 HydrophobicContact CH2-CG2 4.18Å; W74-I241 HydrophobicContact CZ2-CG1 4.29Å; W74-I241 WeakPolarHBondContact CZ2-O 3.48Å; W74-A242 HydrophobicContact CH2-CB 4.05Å; W74-A242 HydrophobicContact CZ2-CB 4.21Å
75	S	96.7	Very high	93.6	Very high	9 Å²	9	45.2 Å²	45.2	6%	0.063	22%	0.224	C	C	.	.			trans	-65.7	179.7	169.3	71.1	0	0	0	0	111.2	R159	S75-R159 PolarHBondContact N-O 2.85Å; S75-R159 VanDerWaalsContact N-O 3.07Å; S75-R159 WeakPolarHBondContact OG-CB 3.41Å; S75-R159 PolarHBondContact OG-N 2.82Å
76	N	90.8	Very high	93.4	Very high	64 Å²	64	44.3 Å²	44.3	34%	0.342	22%	0.22	S	C	.	.			trans	-53.7	150.8	162.4	-51.1	-41.2	0	0	0	109.1	F102 A131 A133	N76-F102 VanDerWaalsContact O-CZ 3.26Å; N76-F102 WeakPolarHBondContact O-CZ 3.43Å; N76-A131 WeakPolarHBondContact CA-O 3.31Å; N76-A133 VanDerWaalsContact OD1-CB 3.27Å; N76-A133 WeakPolarHBondContact OD1-CB 3.48Å; N76-A133 PolarHBondContact OD1-N 2.76Å
77	L	94.3	Very high	93.3	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	133.7	165.6	-179.7	151.7	0	0	0	108.1	L50 F52 L129 S130 A131 M141 F156 V158	L50-L77 HydrophobicContact CD1-CD1 4.43Å; L50-L77 HydrophobicContact CD2-CD1 3.59Å; F52-L77 HydrophobicContact CB-CD1 4.11Å; F52-L77 HydrophobicContact CD2-CD1 4.42Å; L77-L129 HydrophobicContact CD2-CD1 3.79Å; L77-S130 CarbonylContact O-C 3.43Å; L77-S130 WeakPolarHBondContact O-CA 3.4Å; L77-S130 PolarHBondContact O-OG 3.26Å; L77-A131 HydrophobicContact CB-CB 3.89Å; L77-A131 PolarHBondContact N-O 2.89Å; L77-A131 PolarHBondContact O-N 2.88Å; L77-M141 HydrophobicContact CB-SD 3.74Å; L77-M141 HydrophobicContact CD1-SD 4.18Å; L77-F156 HydrophobicContact CD1-CD2 3.8Å; L77-F156 HydrophobicContact CD1-CE2 4.16Å; L77-F156 HydrophobicContact CD1-CG 4.4Å; L77-F156 HydrophobicContact CD2-CB 4.25Å; L77-F156 HydrophobicContact CG-CB 4.48Å; L77-F156 HydrophobicContact CG-CD2 4.08Å; L77-V158 HydrophobicContact CB-CG2 3.84Å; L77-V158 HydrophobicContact CD1-CG2 3.84Å; L77-V158 HydrophobicContact CG-CG2 3.83Å
78	I	91.2	Very high	93.3	Very high	4 Å²	4	42.2 Å²	42.2	2%	0.021	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	129.7	169.1	-59.2	-66.4	0	0	0	107.4	M88 F102 A108 F156 M157	I78-M88 HydrophobicContact CB-CE 4.28Å; I78-M88 HydrophobicContact CG2-CE 3.9Å; I78-F102 HydrophobicContact CB-CE2 4.31Å; I78-F102 HydrophobicContact CB-CZ 4.3Å; I78-F102 HydrophobicContact CG1-CD2 4.35Å; I78-F102 HydrophobicContact CG1-CE2 3.53Å; I78-F102 HydrophobicContact CG1-CZ 3.88Å; I78-A108 HydrophobicContact CD1-CB 3.87Å; I78-A108 HydrophobicContact CG1-CB 3.82Å; I78-F156 CarbonylContact O-C 3.2Å; I78-F156 WeakPolarHBondContact O-CA 3.32Å; I78-F156 WeakPolarHBondContact O-CB 3.49Å; I78-M157 PolarHBondContact N-O 3.34Å; I78-M157 PolarHBondContact O-N 3.45Å
79	G	91.4	Very high	93.6	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	166.3	177.2	0	0	0	0	0	112	I128 L129 S155	G79-I128 CarbonylContact O-C 3.23Å; G79-I128 WeakPolarHBondContact O-CA 3.46Å; G79-L129 PolarHBondContact N-O 3.16Å; G79-L129 WeakPolarHBondContact O-CD2 3.41Å; G79-L129 PolarHBondContact O-N 3Å; G79-S155 CarbonylContact C-O 3.57Å; G79-S155 WeakPolarHBondContact CA-O 3.24Å
80	V	92.1	Very high	93.9	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	139.1	-173.7	-63.2	0	0	0	0	109.9	H82 Y86 M88 V115 G127 I128 L154 S155	V80-H82 PolarHBondContact O-CD2 2.77Å; V80-Y86 HydrophobicContact CG2-CD1 4.49Å; V80-Y86 HydrophobicContact CG2-CE1 3.83Å; V80-M88 HydrophobicContact CG2-CB 4.17Å; V80-M88 HydrophobicContact CG2-CG 4.43Å; V80-M88 HydrophobicContact CG2-SD 4.07Å; V80-V115 HydrophobicContact CB-CG1 4.44Å; V80-V115 HydrophobicContact CG1-CB 4.33Å; V80-V115 HydrophobicContact CG1-CG1 3.62Å; V80-V115 HydrophobicContact CG1-CG2 3.72Å; V80-G127 CarbonylContact C-O 3.53Å; V80-G127 VanDerWaalsContact CA-O 3.28Å; V80-G127 WeakPolarHBondContact CA-O 3.43Å; V80-I128 HydrophobicContact CG1-CG1 4.31Å; V80-L154 WeakPolarHBondContact O-CA 3.33Å; V80-S155 PolarHBondContact N-O 3.02Å; V80-S155 PolarHBondContact O-N 3.4Å
81	T	90.7	Very high	94	Very high	2 Å²	2	29.8 Å²	29.8	1%	0.012	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	130.1	167.1	53.1	0	0	0	0	110.5	Y126 G127 F145 E146 Y153 L154	T81-Y126 PolarHBondContact O-N 3.18Å; T81-G127 PolarHBondContact N-O 2.79Å; T81-G127 PolarHBondContact OG1-N 3.15Å; T81-F145 HydrophobicContact CG2-CD2 3.39Å; T81-F145 HydrophobicContact CG2-CE2 3.83Å; T81-F145 HydrophobicContact CG2-CG 4.28Å; T81-E146 WeakPolarHBondContact CG2-O 3.49Å; T81-E146 PolarHBondContact OG1-O 2.98Å; T81-Y153 CarbonylContact C-O 3.57Å; T81-Y153 VanDerWaalsContact CA-O 3.29Å; T81-Y153 WeakPolarHBondContact CA-O 3.43Å; T81-L154 HydrophobicContact CG2-CD1 4.04Å
82	H	93.1	Very high	94.1	Very high	1 Å²	1	32 Å²	32	1%	0.005	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	169.7	-167	64.9	95.1	0	0	0	113.3	V80 Y86 S124 V125 H151 S152 Y153 S155	V80-H82 PolarHBondContact O-CD2 2.77Å; H82-Y86 HydrophobicContact CB-CD1 3.8Å; H82-Y86 HydrophobicContact CB-CG 4.37Å; H82-Y86 PolarHBondContact CE1-O 3.34Å; H82-Y86 AromaticContact CG-CD1 3.74Å; H82-Y86 AromaticContact ND1-CD1 3.97Å; H82-Y86 PolarHBondContact ND1-O 2.8Å; H82-S124 CarbonylContact C-O 3.35Å; H82-S124 WeakPolarHBondContact CA-O 3.09Å; H82-S124 WeakPolarHBondContact CB-O 3.49Å; H82-V125 HydrophobicContact CB-CG2 4.35Å; H82-H151 CarbonylContact O-C 3.6Å; H82-H151 VanDerWaalsContact O-C 3.23Å; H82-H151 WeakPolarHBondContact O-CA 3.44Å; H82-S152 PolarHBondContact O-N 3.26Å; H82-Y153 PolarHBondContact N-O 3.36Å; H82-Y153 WeakPolarHBondContact O-CB 3.26Å; H82-Y153 PolarHBondContact O-N 3.46Å; H82-Y153 VanDerWaalsContact O-N 3.07Å; H82-S155 PolarHBondContact CE1-OG 3.35Å; H82-S155 WeakPolarHBondContact NE2-CB 3.38Å; H82-S155 PolarHBondContact NE2-N 3.43Å; H82-S155 PolarHBondContact NE2-OG 2.96Å
83	S	91.5	Very high	94.1	Very high	12 Å²	12	36 Å²	36	8%	0.084	19%	0.192	C	C	.	.			trans	-85	172.2	168.6	77.7	0	0	0	0	110.5	D85 Y86 S124 R150	S83-D85 PolarHBondContact O-N 3.39Å; S83-D85 PolarHBondContact OG-N 3.02Å; S83-D85 PolarHBondContact OG-OD2 2.92Å; S83-Y86 PolarHBondContact O-N 3.18Å; S83-S124 PolarHBondContact N-O 2.93Å; S83-S124 VanDerWaalsContact OG-CB 3.24Å; S83-S124 WeakPolarHBondContact OG-CB 3.21Å; S83-R150 VanDerWaalsContact CB-O 3.22Å; S83-R150 WeakPolarHBondContact CB-O 3.38Å
84	S	91.6	Very high	94.2	Very high	63 Å²	63	38.9 Å²	38.9	44%	0.441	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-11.8	174.1	53.8	0	0	0	0	114.8	Y86	S84-Y86 VanDerWaalsContact C-N 3.31Å
85	D	91.2	Very high	94.2	Very high	121 Å²	121	39.2 Å²	39.2	65%	0.647	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85	-6.9	-176.7	-49	-59	0	0	0	113	S83	S83-D85 PolarHBondContact O-N 3.39Å; S83-D85 PolarHBondContact OG-N 3.02Å; S83-D85 PolarHBondContact OG-OD2 2.92Å
86	Y	92.3	Very high	94.3	Very high	24 Å²	24	40.7 Å²	40.7	9%	0.094	22%	0.217	C	C	.	.			trans	-122.2	140.8	179.5	176.8	-92.4	0	0	0	110.7	V80 H82 S83 S84 M88 V115 A118 S124 V125	V80-Y86 HydrophobicContact CG2-CD1 4.49Å; V80-Y86 HydrophobicContact CG2-CE1 3.83Å; H82-Y86 HydrophobicContact CB-CD1 3.8Å; H82-Y86 HydrophobicContact CB-CG 4.37Å; H82-Y86 PolarHBondContact CE1-O 3.34Å; H82-Y86 AromaticContact CG-CD1 3.74Å; H82-Y86 AromaticContact ND1-CD1 3.97Å; H82-Y86 PolarHBondContact ND1-O 2.8Å; S83-Y86 PolarHBondContact O-N 3.18Å; S84-Y86 VanDerWaalsContact C-N 3.31Å; Y86-M88 HydrophobicContact CE1-CB 4.06Å; Y86-V115 VanDerWaalsContact OH-CG2 3.26Å; Y86-V115 WeakPolarHBondContact OH-CG2 3.49Å; Y86-A118 HydrophobicContact CD2-CB 3.7Å; Y86-A118 HydrophobicContact CE2-CB 3.68Å; Y86-S124 WeakPolarHBondContact CB-OG 2.98Å; Y86-V125 HydrophobicContact CD1-CG2 3.95Å; Y86-V125 HydrophobicContact CD2-CG2 4Å; Y86-V125 HydrophobicContact CE1-CG2 4.24Å; Y86-V125 HydrophobicContact CE2-CG2 4.28Å; Y86-V125 HydrophobicContact CG-CG2 3.83Å
87	H	94.1	Very high	94.6	Very high	77 Å²	77	42.9 Å²	42.9	36%	0.356	23%	0.229	S	C	.	.			trans	-131.6	128.3	171.5	-67.8	-81.2	0	0	0	109	Q90 D171	H87-Q90 HydrophobicContact CB-CG 3.45Å; H87-Q90 VanDerWaalsContact CB-CG 3.45Å; H87-Q90 PolarHBondContact CD2-NE2 2.85Å; H87-Q90 PolarHBondContact CD2-OE1 3.5Å; H87-Q90 PolarHBondContact CE1-NE2 2.78Å; H87-Q90 VanDerWaalsContact CG-NE2 3.31Å; H87-Q90 PolarHBondContact ND1-NE2 2.96Å; H87-Q90 VanDerWaalsContact ND1-NE2 3.16Å; H87-Q90 PolarHBondContact NE2-NE2 2.02Å; H87-D171 IonicContact CE1-OD1 3.94Å; H87-D171 IonicContact CG-OD1 3.85Å; H87-D171 IonicContact ND1-OD1 3.02Å; H87-D171 PolarHBondContact ND1-OD1 2.91Å; H87-D171 IonicContact ND1-OD2 3.86Å
88	M	94.2	Very high	94.6	Very high	7 Å²	7	42.9 Å²	42.9	3%	0.034	23%	0.229	C	C	.	.	S	Bend	trans	-71.6	-40.5	176.6	-173.5	179.7	-176.9	0	0	110.8	I78 V80 Y86 V99 I111 M157	I78-M88 HydrophobicContact CB-CE 4.28Å; I78-M88 HydrophobicContact CG2-CE 3.9Å; V80-M88 HydrophobicContact CG2-CB 4.17Å; V80-M88 HydrophobicContact CG2-CG 4.43Å; V80-M88 HydrophobicContact CG2-SD 4.07Å; Y86-M88 HydrophobicContact CE1-CB 4.06Å; M88-V99 WeakPolarHBondContact O-CG2 3.35Å; M88-I111 HydrophobicContact CE-CD1 3.3Å; M88-I111 HydrophobicContact CE-CG1 4.05Å; M88-I111 HydrophobicContact CG-CD1 4.01Å; M88-M157 HydrophobicContact CE-CG 3.61Å; M88-M157 HydrophobicContact CE-SD 3.87Å; M88-M157 HydrophobicContact SD-CG 4.47Å
89	W	97.7	Very high	94.9	Very high	14 Å²	14	42.7 Å²	42.7	5%	0.053	23%	0.228	C	C	.	.			trans	-160.6	155.4	174.5	64.2	-88.3	0	0	0	107.1	V99 F156 F167 G169 D171 Y192 I215	W89-V99 HydrophobicContact CB-CG1 4.42Å; W89-V99 HydrophobicContact CB-CG2 4.1Å; W89-F156 PolarHBondContact NE1-O 3.39Å; W89-F156 VanDerWaalsContact NE1-O 3.15Å; W89-F167 AromaticContact CD2-CE2 3.7Å; W89-F167 HydrophobicContact CD2-CE2 3.7Å; W89-F167 HydrophobicContact CD2-CZ 4.02Å; W89-F167 AromaticContact CE2-CE2 3.78Å; W89-F167 AromaticContact CE3-CE2 3.88Å; W89-F167 HydrophobicContact CE3-CE2 3.88Å; W89-F167 AromaticContact CE3-CZ 3.86Å; W89-F167 HydrophobicContact CE3-CZ 3.86Å; W89-F167 HydrophobicContact CG-CE2 4.21Å; W89-F167 HydrophobicContact CG-CZ 4.46Å; W89-F167 HydrophobicContact CH2-CE2 4.2Å; W89-F167 HydrophobicContact CZ2-CE2 4.04Å; W89-F167 HydrophobicContact CZ3-CE2 4.12Å; W89-F167 HydrophobicContact CZ3-CZ 4.23Å; W89-G169 VanDerWaalsContact CZ2-C 3.48Å; W89-D171 HydrophobicContact CD2-CB 4.45Å; W89-D171 HydrophobicContact CH2-CB 4.49Å; W89-D171 HydrophobicContact CZ2-CB 4.24Å; W89-D171 VanDerWaalsContact O-CB 3.3Å; W89-D171 WeakPolarHBondContact O-CB 3.27Å; W89-Y192 HydrophobicContact CH2-CD1 4.5Å; W89-Y192 HydrophobicContact CH2-CD2 4.1Å; W89-Y192 HydrophobicContact CH2-CE1 4.34Å; W89-Y192 AromaticContact CH2-CE2 3.92Å; W89-Y192 HydrophobicContact CH2-CE2 3.92Å; W89-Y192 HydrophobicContact CH2-CG 4.38Å; W89-Y192 HydrophobicContact CZ3-CD1 4.08Å; W89-Y192 HydrophobicContact CZ3-CD2 4.44Å; W89-Y192 HydrophobicContact CZ3-CE1 4.06Å; W89-Y192 HydrophobicContact CZ3-CE2 4.41Å; W89-Y192 HydrophobicContact CZ3-CG 4.27Å; W89-I215 HydrophobicContact CB-CD1 3.94Å; W89-I215 HydrophobicContact CE3-CD1 4.4Å; W89-I215 HydrophobicContact CE3-CG2 4.08Å; W89-I215 HydrophobicContact CZ3-CG2 4.25Å
90	Q	96.9	Very high	95.2	Very high	65 Å²	65	46 Å²	46	30%	0.304	24%	0.24	S	C	.	.			trans	-139.7	144.3	177.4	-52.5	-169.4	-98.8	0	0	110.6	H87 E93 D171 I215	H87-Q90 HydrophobicContact CB-CG 3.45Å; H87-Q90 VanDerWaalsContact CB-CG 3.45Å; H87-Q90 PolarHBondContact CD2-NE2 2.85Å; H87-Q90 PolarHBondContact CD2-OE1 3.5Å; H87-Q90 PolarHBondContact CE1-NE2 2.78Å; H87-Q90 VanDerWaalsContact CG-NE2 3.31Å; H87-Q90 PolarHBondContact ND1-NE2 2.96Å; H87-Q90 VanDerWaalsContact ND1-NE2 3.16Å; H87-Q90 PolarHBondContact NE2-NE2 2.02Å; Q90-E93 HydrophobicContact CB-CB 4.12Å; Q90-E93 HydrophobicContact CB-CG 4.08Å; Q90-E93 PolarHBondContact O-N 3.28Å; Q90-D171 WeakPolarHBondContact CG-OD2 3.42Å; Q90-I215 WeakPolarHBondContact O-CB 3.47Å
91	S	96.8	Very high	95.4	Very high	62 Å²	62	49.3 Å²	49.3	43%	0.434	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	139.6	172	-172.6	0	0	0	0	110.1	E93	S91-E93 PolarHBondContact O-N 3.02Å
92	N	97.3	Very high	95.7	Very high	101 Å²	101	49.2 Å²	49.2	54%	0.54	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.3	19.8	-177	-164.7	49.6	0	0	0	114.3	R214 I215	N92-R214 VanDerWaalsContact O-CD 3.27Å; N92-R214 WeakPolarHBondContact O-CD 3.39Å; N92-R214 PolarHBondContact O-NH1 3.48Å; N92-R214 WeakPolarHBondContact OD1-CD 3.4Å; N92-I215 WeakPolarHBondContact CA-O 3.48Å; N92-I215 PolarHBondContact N-O 2.81Å
93	E	98.1	Very high	96	Very high	86 Å²	86	49.2 Å²	49.2	40%	0.402	26%	0.255	S	S	.	.	S	Bend	trans	-117.5	165.4	167.4	-69.5	-59.1	158.1	0	0	111.6	Q90 S91 R214 I215	Q90-E93 HydrophobicContact CB-CB 4.12Å; Q90-E93 HydrophobicContact CB-CG 4.08Å; Q90-E93 PolarHBondContact O-N 3.28Å; S91-E93 PolarHBondContact O-N 3.02Å; E93-R214 WeakPolarHBondContact O-CA 3.5Å; E93-R214 IonicContact OE1-NH1 3.7Å; E93-R214 IonicContact OE2-NH1 2.9Å; E93-R214 PolarHBondContact OE2-NH1 2.83Å; E93-I215 WeakPolarHBondContact O-CG1 3.3Å; E93-I215 PolarHBondContact O-N 2.96Å
94	F	98.3	Very high	96.3	Very high	105 Å²	105	49.3 Å²	49.3	46%	0.461	26%	0.255	S	S	.	.	B	Isolated β-bridge	trans	-75.2	136.9	177.8	-63	-73.3	0	0	0	111.1	Q212 R214	F94-Q212 HydrophobicContact CD1-CG 4.32Å; F94-Q212 VanDerWaalsContact CE1-O 3.3Å; F94-Q212 WeakPolarHBondContact CE1-O 3.34Å; F94-R214 HydrophobicContact CD1-CG 4.11Å; F94-R214 HydrophobicContact CE1-CG 3.87Å; F94-R214 HydrophobicContact CE2-CG 4.46Å; F94-R214 HydrophobicContact CZ-CG 4.07Å
95	A	98.1	Very high	96.2	Very high	7 Å²	7	52.8 Å²	52.8	6%	0.058	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-62.8	135.4	171	0	0	0	0	0	111	V99 A194 T196 Q212 I215	A95-V99 HydrophobicContact CB-CB 4Å; A95-V99 HydrophobicContact CB-CG1 3.68Å; A95-A194 HydrophobicContact CB-CB 4.47Å; A95-T196 HydrophobicContact CB-CG2 4.27Å; A95-Q212 PolarHBondContact O-NE2 3.28Å; A95-I215 HydrophobicContact CB-CD1 4.18Å; A95-I215 HydrophobicContact CB-CG1 4.22Å
96	S	97.8	Very high	96.2	Very high	40 Å²	40	47.8 Å²	47.8	28%	0.28	24%	0.239	S	C	.	.	P	Polyproline II helix	trans	-65.6	169.7	168.2	76.5	0	0	0	0	110.8	G98 V99 R100 E114	S96-G98 VanDerWaalsContact C-N 3.26Å; S96-G98 PolarHBondContact O-N 2.89Å; S96-G98 PolarHBondContact OG-N 3.07Å; S96-V99 PolarHBondContact O-N 3.38Å; S96-V99 WeakPolarHBondContact OG-CG2 3.41Å; S96-V99 PolarHBondContact OG-N 2.94Å; S96-R100 WeakPolarHBondContact O-CB 3.42Å; S96-R100 PolarHBondContact O-N 2.93Å; S96-E114 VanDerWaalsContact CB-OE2 3.31Å; S96-E114 WeakPolarHBondContact CB-OE2 3.35Å; S96-E114 PolarHBondContact OG-OE2 3.27Å
97	N	97.1	Very high	95.8	Very high	110 Å²	110	52.1 Å²	52.1	59%	0.588	26%	0.26	S	S	*	.	H	α-helix	trans	-62.1	-38.4	174.3	-68.3	-36.6	0	0	0	111.2	R100 E101 T110	N97-R100 PolarHBondContact O-N 2.88Å; N97-E101 WeakPolarHBondContact O-CG 3.29Å; N97-E101 PolarHBondContact O-N 3.44Å; N97-T110 HydrophobicContact CB-CG2 4.42Å
98	G	95.3	Very high	95.3	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-62	-46	173.9	0	0	0	0	0	113	S96 F102 E114	S96-G98 VanDerWaalsContact C-N 3.26Å; S96-G98 PolarHBondContact O-N 2.89Å; S96-G98 PolarHBondContact OG-N 3.07Å; G98-F102 WeakPolarHBondContact O-CB 3.46Å; G98-F102 PolarHBondContact O-N 3.07Å; G98-E114 PolarHBondContact N-OE1 3.47Å
99	V	97.9	Very high	94.8	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-63.3	-43.5	176.6	174	0	0	0	0	110.6	M88 W89 A95 S96 F102 A103 I111 M157 I215	M88-V99 WeakPolarHBondContact O-CG2 3.35Å; W89-V99 HydrophobicContact CB-CG1 4.42Å; W89-V99 HydrophobicContact CB-CG2 4.1Å; A95-V99 HydrophobicContact CB-CB 4Å; A95-V99 HydrophobicContact CB-CG1 3.68Å; S96-V99 PolarHBondContact O-N 3.38Å; S96-V99 WeakPolarHBondContact OG-CG2 3.41Å; S96-V99 PolarHBondContact OG-N 2.94Å; V99-F102 PolarHBondContact O-N 2.74Å; V99-A103 WeakPolarHBondContact O-CA 3.48Å; V99-A103 WeakPolarHBondContact O-CB 3.4Å; V99-A103 PolarHBondContact O-N 3.4Å; V99-I111 HydrophobicContact CG2-CD1 3.86Å; V99-M157 HydrophobicContact CG1-CE 3.96Å; V99-M157 HydrophobicContact CG1-SD 4.5Å; V99-M157 HydrophobicContact CG2-SD 4.42Å; V99-I215 HydrophobicContact CG1-CD1 4.49Å
100	R	98.1	Very high	94.3	Very high	68 Å²	68	58.8 Å²	58.8	26%	0.257	29%	0.289	S	S	.	.	H	α-helix	trans	-57	-54.2	176.1	175.7	175.1	175.5	-177.9	-4.3	112	S96 N97 F102 A103 E104 T196 E208	S96-R100 WeakPolarHBondContact O-CB 3.42Å; S96-R100 PolarHBondContact O-N 2.93Å; N97-R100 PolarHBondContact O-N 2.88Å; R100-F102 VanDerWaalsContact C-N 3.31Å; R100-F102 PolarHBondContact O-N 3.35Å; R100-A103 PolarHBondContact O-N 3.04Å; R100-E104 VanDerWaalsContact CG-OE1 3.29Å; R100-E104 WeakPolarHBondContact CG-OE1 3.28Å; R100-E104 IonicContact CZ-OE1 3.14Å; R100-E104 IonicContact NE-OE1 3.53Å; R100-E104 PolarHBondContact NE-OE1 3.4Å; R100-E104 IonicContact NH2-OE1 2.93Å; R100-E104 WeakPolarHBondContact O-CB 3.22Å; R100-E104 WeakPolarHBondContact O-CG 3.4Å; R100-E104 PolarHBondContact O-N 2.69Å; R100-T196 HydrophobicContact CB-CG2 3.99Å; R100-T196 HydrophobicContact CG-CG2 3.77Å; R100-E208 IonicContact CZ-OE1 3.17Å; R100-E208 VanDerWaalsContact CZ-OE1 3.29Å; R100-E208 IonicContact NH1-OE1 3.62Å; R100-E208 PolarHBondContact NH1-OE1 3.49Å; R100-E208 IonicContact NH2-OE1 3.26Å; R100-E208 PolarHBondContact NH2-OE1 3.39Å
101	E	96.1	Very high	93.8	Very high	71 Å²	71	55.8 Å²	55.8	33%	0.332	28%	0.275	S	S	.	.	H	α-helix	trans	-63	-39.6	-177.6	-74.1	-174.5	173.8	0	0	112.2	N97 K105 G106 T110	N97-E101 WeakPolarHBondContact O-CG 3.29Å; N97-E101 PolarHBondContact O-N 3.44Å; E101-K105 WeakPolarHBondContact O-CB 3.11Å; E101-K105 PolarHBondContact O-N 2.63Å; E101-G106 PolarHBondContact O-N 3.06Å; E101-T110 WeakPolarHBondContact OE2-CB 3.42Å; E101-T110 PolarHBondContact OE2-OG1 3.44Å
102	F	96.6	Very high	93.1	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-69.7	-43.5	176.6	-172.5	-92.4	0	0	0	111.9	N76 I78 G98 V99 R100 E104 G106 E107 A108 M157 R159	N76-F102 VanDerWaalsContact O-CZ 3.26Å; N76-F102 WeakPolarHBondContact O-CZ 3.43Å; I78-F102 HydrophobicContact CB-CE2 4.31Å; I78-F102 HydrophobicContact CB-CZ 4.3Å; I78-F102 HydrophobicContact CG1-CD2 4.35Å; I78-F102 HydrophobicContact CG1-CE2 3.53Å; I78-F102 HydrophobicContact CG1-CZ 3.88Å; G98-F102 WeakPolarHBondContact O-CB 3.46Å; G98-F102 PolarHBondContact O-N 3.07Å; V99-F102 PolarHBondContact O-N 2.74Å; R100-F102 VanDerWaalsContact C-N 3.31Å; R100-F102 PolarHBondContact O-N 3.35Å; F102-E104 PolarHBondContact O-N 3.02Å; F102-G106 VanDerWaalsContact O-CA 3.22Å; F102-G106 WeakPolarHBondContact O-CA 3.38Å; F102-G106 PolarHBondContact O-N 2.88Å; F102-E107 WeakPolarHBondContact CA-O 3.41Å; F102-A108 HydrophobicContact CD2-CB 3.97Å; F102-A108 HydrophobicContact CE2-CB 4.06Å; F102-M157 HydrophobicContact CB-SD 4.35Å; F102-M157 HydrophobicContact CD1-CE 3.47Å; F102-M157 VanDerWaalsContact CD1-CE 3.47Å; F102-M157 HydrophobicContact CD1-CG 3.69Å; F102-M157 HydrophobicContact CD1-SD 3.49Å; F102-M157 WeakPolarHBondContact CD1-SD 3.12Å; F102-M157 HydrophobicContact CE1-CB 4.44Å; F102-M157 HydrophobicContact CE1-CE 4.13Å; F102-M157 HydrophobicContact CE1-CG 3.55Å; F102-M157 HydrophobicContact CE1-SD 4.03Å; F102-M157 HydrophobicContact CG-CE 4.41Å; F102-M157 HydrophobicContact CG-SD 4.14Å; F102-M157 HydrophobicContact CZ-CG 4.39Å; F102-R159 HydrophobicContact CE1-CB 4.45Å; F102-R159 VanDerWaalsContact O-CD 3.29Å; F102-R159 WeakPolarHBondContact O-CD 3.31Å
103	A	98.3	Very high	92.4	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-67	-33	-179.6	0	0	0	0	0	112.5	V99 R100 M157 R159 D165 F167 A194	V99-A103 WeakPolarHBondContact O-CA 3.48Å; V99-A103 WeakPolarHBondContact O-CB 3.4Å; V99-A103 PolarHBondContact O-N 3.4Å; R100-A103 PolarHBondContact O-N 3.04Å; A103-M157 HydrophobicContact CB-CE 4.36Å; A103-R159 WeakPolarHBondContact O-CD 3.16Å; A103-R159 WeakPolarHBondContact O-CG 3.26Å; A103-R159 PolarHBondContact O-NH1 3.07Å; A103-D165 WeakPolarHBondContact O-CA 3.26Å; A103-F167 HydrophobicContact CB-CD1 4.23Å; A103-A194 HydrophobicContact CB-CB 3.81Å
104	E	97.7	Very high	92	Very high	15 Å²	15	55.9 Å²	55.9	7%	0.07	26%	0.264	C	S	.	.	H	α-helix	trans	-90	-35.1	179.2	-71.1	176.3	-159.8	0	0	113.9	R100 F102 R159 P164 D165 T196	R100-E104 VanDerWaalsContact CG-OE1 3.29Å; R100-E104 WeakPolarHBondContact CG-OE1 3.28Å; R100-E104 IonicContact CZ-OE1 3.14Å; R100-E104 IonicContact NE-OE1 3.53Å; R100-E104 PolarHBondContact NE-OE1 3.4Å; R100-E104 IonicContact NH2-OE1 2.93Å; R100-E104 WeakPolarHBondContact O-CB 3.22Å; R100-E104 WeakPolarHBondContact O-CG 3.4Å; R100-E104 PolarHBondContact O-N 2.69Å; F102-E104 PolarHBondContact O-N 3.02Å; E104-R159 PolarHBondContact O-NE 2.87Å; E104-R159 PolarHBondContact O-NH1 3.27Å; E104-R159 PolarHBondContact O-NH2 3.5Å; E104-P164 WeakPolarHBondContact CA-O 3.45Å; E104-D165 HydrophobicContact CG-CB 3.99Å; E104-T196 VanDerWaalsContact OE1-CB 3.31Å; E104-T196 WeakPolarHBondContact OE1-CB 3.46Å; E104-T196 PolarHBondContact OE1-OG1 2.92Å
105	K	91.4	Very high	91.3	Very high	135 Å²	135	51 Å²	51	59%	0.587	24%	0.243	S	C	*	.	H	α-helix	trans	-124.7	-15.5	-168.3	-59.8	170.7	-170.7	163.3	0	113.8	E101 E107	E101-K105 WeakPolarHBondContact O-CB 3.11Å; E101-K105 PolarHBondContact O-N 2.63Å; K105-E107 VanDerWaalsContact C-N 3.26Å; K105-E107 HydrophobicContact CB-CB 4.46Å; K105-E107 HydrophobicContact CB-CG 3.93Å
106	G	89.4	Confident	90.4	Very high	16 Å²	16	56 Å²	56	17%	0.165	27%	0.265	C	S	.	.			trans	75.2	15	-171.4	0	0	0	0	0	113.4	E101 F102	E101-G106 PolarHBondContact O-N 3.06Å; F102-G106 VanDerWaalsContact O-CA 3.22Å; F102-G106 WeakPolarHBondContact O-CA 3.38Å; F102-G106 PolarHBondContact O-N 2.88Å
107	E	85	Confident	89.9	Confident	115 Å²	115	56 Å²	56	54%	0.537	26%	0.263	S	S	.	.			trans	-82.2	113.7	178.7	-70	-67.4	173.7	0	0	110.3	F102 K105	F102-E107 WeakPolarHBondContact CA-O 3.41Å; K105-E107 VanDerWaalsContact C-N 3.26Å; K105-E107 HydrophobicContact CB-CB 4.46Å; K105-E107 HydrophobicContact CB-CG 3.93Å
108	A	84.3	Confident	89.2	Confident	15 Å²	15	51.4 Å²	51.4	12%	0.124	24%	0.24	C	C	.	.			trans	-91.7	-10.1	-172.7	0	0	0	0	0	114.5	I78 F102 T110 I111 M112	I78-A108 HydrophobicContact CD1-CB 3.87Å; I78-A108 HydrophobicContact CG1-CB 3.82Å; F102-A108 HydrophobicContact CD2-CB 3.97Å; F102-A108 HydrophobicContact CE2-CB 4.06Å; A108-T110 PolarHBondContact O-N 2.94Å; A108-I111 HydrophobicContact CB-CG2 4.45Å; A108-I111 WeakPolarHBondContact O-CG2 3.44Å; A108-I111 PolarHBondContact O-N 3.33Å; A108-M112 HydrophobicContact CB-SD 4.28Å; A108-M112 WeakPolarHBondContact O-CB 3.2Å; A108-M112 WeakPolarHBondContact O-CG 3.05Å; A108-M112 PolarHBondContact O-N 3.35Å
109	W	82.1	Confident	88.4	Confident	189 Å²	189	52.5 Å²	52.5	72%	0.716	25%	0.252	S	S	*	.	H	α-helix	trans	-60.2	-47.2	-171	177.2	-100.7	0	0	0	113.2	M112 K113	W109-M112 PolarHBondContact O-N 3.41Å; W109-K113 PolarHBondContact O-N 2.85Å
110	T	87.2	Confident	87.5	Confident	35 Å²	35	60.3 Å²	60.3	22%	0.215	29%	0.288	C	S	.	.	H	α-helix	trans	-67.6	-41.6	-175.8	-60.4	0	0	0	0	111.6	N97 E101 A108 K113 E114	N97-T110 HydrophobicContact CB-CG2 4.42Å; E101-T110 WeakPolarHBondContact OE2-CB 3.42Å; E101-T110 PolarHBondContact OE2-OG1 3.44Å; A108-T110 PolarHBondContact O-N 2.94Å; T110-K113 PolarHBondContact O-N 2.88Å; T110-E114 WeakPolarHBondContact O-CG 3.36Å; T110-E114 PolarHBondContact O-N 3Å
111	I	87.1	Confident	86.7	Confident	1 Å²	1	66.7 Å²	66.7	1%	0.005	31%	0.313	C	S	.	.	H	α-helix	trans	-66.8	-38.4	176.3	-167.2	159	0	0	0	111.8	M88 V99 A108 K113 E114 V115 M157	M88-I111 HydrophobicContact CE-CD1 3.3Å; M88-I111 HydrophobicContact CE-CG1 4.05Å; M88-I111 HydrophobicContact CG-CD1 4.01Å; V99-I111 HydrophobicContact CG2-CD1 3.86Å; A108-I111 HydrophobicContact CB-CG2 4.45Å; A108-I111 WeakPolarHBondContact O-CG2 3.44Å; A108-I111 PolarHBondContact O-N 3.33Å; I111-K113 VanDerWaalsContact C-N 3.29Å; I111-K113 PolarHBondContact O-N 2.87Å; I111-E114 PolarHBondContact O-N 3.22Å; I111-V115 HydrophobicContact CG1-CG2 4.46Å; I111-V115 WeakPolarHBondContact O-CG2 3.46Å; I111-V115 PolarHBondContact O-N 2.93Å; I111-M157 HydrophobicContact CD1-SD 3.75Å
112	M	82.1	Confident	85.7	Confident	64 Å²	64	67.9 Å²	67.9	32%	0.315	32%	0.32	S	S	.	.	H	α-helix	trans	-59.6	-41.8	174	-71.3	174.7	73.1	0	0	111.4	A108 W109 V115 E116 I128	A108-M112 HydrophobicContact CB-SD 4.28Å; A108-M112 WeakPolarHBondContact O-CB 3.2Å; A108-M112 WeakPolarHBondContact O-CG 3.05Å; A108-M112 PolarHBondContact O-N 3.35Å; W109-M112 PolarHBondContact O-N 3.41Å; M112-V115 PolarHBondContact O-N 3.33Å; M112-E116 WeakPolarHBondContact O-CG 3.12Å; M112-E116 PolarHBondContact O-N 3.38Å; M112-I128 HydrophobicContact CB-CD1 4.47Å
113	K	83.7	Confident	85	Confident	129 Å²	129	73.8 Å²	73.8	56%	0.561	35%	0.348	S	S	*	.	H	α-helix	trans	-66	-38.7	176.4	-173.5	177.3	-178.6	178.9	0	113.2	W109 T110 I111 V115 T117	W109-K113 PolarHBondContact O-N 2.85Å; T110-K113 PolarHBondContact O-N 2.88Å; I111-K113 VanDerWaalsContact C-N 3.29Å; I111-K113 PolarHBondContact O-N 2.87Å; K113-V115 VanDerWaalsContact C-N 3.33Å; K113-T117 WeakPolarHBondContact O-CB 3.48Å; K113-T117 PolarHBondContact O-N 3.05Å; K113-T117 PolarHBondContact O-OG1 3.36Å
114	E	88.9	Confident	84	Confident	58 Å²	58	73.9 Å²	73.9	27%	0.271	35%	0.348	S	S	.	.	H	α-helix	trans	-61.6	-43.9	174.7	-73.7	176	178.2	0	0	110.9	S96 G98 T110 I111 T117 A118	S96-E114 VanDerWaalsContact CB-OE2 3.31Å; S96-E114 WeakPolarHBondContact CB-OE2 3.35Å; S96-E114 PolarHBondContact OG-OE2 3.27Å; G98-E114 PolarHBondContact N-OE1 3.47Å; T110-E114 WeakPolarHBondContact O-CG 3.36Å; T110-E114 PolarHBondContact O-N 3Å; I111-E114 PolarHBondContact O-N 3.22Å; E114-T117 PolarHBondContact O-N 2.76Å; E114-A118 PolarHBondContact O-N 3.21Å
115	V	83.6	Confident	83	Confident	2 Å²	2	74 Å²	74	1%	0.012	35%	0.35	C	S	.	.	H	α-helix	trans	-64.4	-46.8	178	174.3	0	0	0	0	111.7	V80 Y86 I111 M112 K113 T117 A118 G119 V125 I128	V80-V115 HydrophobicContact CB-CG1 4.44Å; V80-V115 HydrophobicContact CG1-CB 4.33Å; V80-V115 HydrophobicContact CG1-CG1 3.62Å; V80-V115 HydrophobicContact CG1-CG2 3.72Å; Y86-V115 VanDerWaalsContact OH-CG2 3.26Å; Y86-V115 WeakPolarHBondContact OH-CG2 3.49Å; I111-V115 HydrophobicContact CG1-CG2 4.46Å; I111-V115 WeakPolarHBondContact O-CG2 3.46Å; I111-V115 PolarHBondContact O-N 2.93Å; M112-V115 PolarHBondContact O-N 3.33Å; K113-V115 VanDerWaalsContact C-N 3.33Å; V115-T117 VanDerWaalsContact C-N 3.31Å; V115-T117 PolarHBondContact O-N 2.94Å; V115-A118 WeakPolarHBondContact O-CB 3.26Å; V115-A118 PolarHBondContact O-N 3.02Å; V115-G119 PolarHBondContact O-N 2.98Å; V115-V125 HydrophobicContact CG1-CB 4.43Å; V115-V125 HydrophobicContact CG1-CG1 3.54Å; V115-V125 HydrophobicContact CG1-CG2 4.3Å; V115-I128 HydrophobicContact CB-CD1 4.26Å; V115-I128 HydrophobicContact CG1-CD1 3.86Å; V115-I128 HydrophobicContact CG1-CG1 3.74Å
116	E	79.8	Confident	82.2	Confident	112 Å²	112	72.8 Å²	72.8	52%	0.523	34%	0.342	S	S	.	.	H	α-helix	trans	-57.7	-45.7	175.3	-75.3	171.8	-173.8	0	0	111.2	M112 A118 G119 E120 I128	M112-E116 WeakPolarHBondContact O-CG 3.12Å; M112-E116 PolarHBondContact O-N 3.38Å; E116-A118 VanDerWaalsContact C-N 3.3Å; E116-A118 PolarHBondContact O-N 2.94Å; E116-G119 PolarHBondContact O-N 2.92Å; E116-E120 PolarHBondContact O-N 2.65Å; E116-I128 HydrophobicContact CG-CD1 4.42Å
117	T	85.6	Confident	81.3	Confident	41 Å²	41	73 Å²	73	25%	0.252	35%	0.345	S	S	.	.	H	α-helix	trans	-62.3	-37.3	177.9	-56.4	0	0	0	0	111.8	K113 E114 V115 R121	K113-T117 WeakPolarHBondContact O-CB 3.48Å; K113-T117 PolarHBondContact O-N 3.05Å; K113-T117 PolarHBondContact O-OG1 3.36Å; E114-T117 PolarHBondContact O-N 2.76Å; V115-T117 VanDerWaalsContact C-N 3.31Å; V115-T117 PolarHBondContact O-N 2.94Å; T117-R121 HydrophobicContact CG2-CG 4.36Å; T117-R121 WeakPolarHBondContact O-CB 3.21Å; T117-R121 VanDerWaalsContact O-CG 3.29Å; T117-R121 WeakPolarHBondContact O-CG 3.42Å; T117-R121 PolarHBondContact O-N 3.31Å
118	A	82.8	Confident	80.9	Confident	13 Å²	13	70.6 Å²	70.6	11%	0.107	34%	0.335	C	S	.	.	H	α-helix	trans	-67.3	-43.4	174.7	0	0	0	0	0	111.6	Y86 E114 V115 E116 E120 R121 I122 Q123 V125	Y86-A118 HydrophobicContact CD2-CB 3.7Å; Y86-A118 HydrophobicContact CE2-CB 3.68Å; E114-A118 PolarHBondContact O-N 3.21Å; V115-A118 WeakPolarHBondContact O-CB 3.26Å; V115-A118 PolarHBondContact O-N 3.02Å; E116-A118 VanDerWaalsContact C-N 3.3Å; E116-A118 PolarHBondContact O-N 2.94Å; A118-E120 VanDerWaalsContact C-N 3.32Å; A118-E120 PolarHBondContact O-N 2.97Å; A118-R121 PolarHBondContact O-N 3.46Å; A118-I122 HydrophobicContact CB-CD1 4.26Å; A118-I122 HydrophobicContact CB-CG1 4.26Å; A118-I122 WeakPolarHBondContact O-CG1 3.45Å; A118-I122 PolarHBondContact O-N 3.45Å; A118-Q123 PolarHBondContact O-N 2.76Å; A118-V125 HydrophobicContact CB-CG2 4.04Å
119	G	78.1	Confident	81	Confident	23 Å²	23	70.2 Å²	70.2	24%	0.237	33%	0.331	C	S	.	.	H	α-helix	trans	-55.8	-44.2	174.4	0	0	0	0	0	112.8	V115 E116 Q123	V115-G119 PolarHBondContact O-N 2.98Å; E116-G119 PolarHBondContact O-N 2.92Å; G119-Q123 VanDerWaalsContact O-CA 3.31Å; G119-Q123 WeakPolarHBondContact O-CA 3.4Å; G119-Q123 PolarHBondContact O-N 3.11Å
120	E	80.8	Confident	81	Confident	165 Å²	165	64.7 Å²	64.7	77%	0.771	32%	0.321	S	S	*	.	H	α-helix	trans	-70.6	-40.8	179	-69.6	-177.9	170	0	0	113.6	E116 A118	E116-E120 PolarHBondContact O-N 2.65Å; A118-E120 VanDerWaalsContact C-N 3.32Å; A118-E120 PolarHBondContact O-N 2.97Å
121	R	80.8	Confident	80.8	Confident	202 Å²	202	63 Å²	63	76%	0.762	31%	0.311	S	S	*	.	H	α-helix	trans	-84.9	-43.4	-171.5	-71.6	-177.8	-179	175.8	1.6	114	T117 A118	T117-R121 HydrophobicContact CG2-CG 4.36Å; T117-R121 WeakPolarHBondContact O-CB 3.21Å; T117-R121 VanDerWaalsContact O-CG 3.29Å; T117-R121 WeakPolarHBondContact O-CG 3.42Å; T117-R121 PolarHBondContact O-N 3.31Å; A118-R121 PolarHBondContact O-N 3.46Å
122	I	75.6	Confident	80.7	Confident	95 Å²	95	67.5 Å²	67.5	49%	0.487	34%	0.34	S	S	.	.	H	α-helix	trans	-116.9	-4.2	-170.6	54.1	167.8	0	0	0	112.7	A118 S124	A118-I122 HydrophobicContact CB-CD1 4.26Å; A118-I122 HydrophobicContact CB-CG1 4.26Å; A118-I122 WeakPolarHBondContact O-CG1 3.45Å; A118-I122 PolarHBondContact O-N 3.45Å; I122-S124 WeakPolarHBondContact CD1-OG 3.43Å; I122-S124 WeakPolarHBondContact CG1-OG 3.49Å; I122-S124 PolarHBondContact O-N 3.39Å
123	Q	80.7	Confident	81	Confident	125 Å²	125	66.7 Å²	66.7	58%	0.584	34%	0.344	S	S	*	.	S	Bend	trans	54.6	21.8	179.3	-57.4	-177.6	-29.3	0	0	113.7	A118 G119 H151	A118-Q123 PolarHBondContact O-N 2.76Å; G119-Q123 VanDerWaalsContact O-CA 3.31Å; G119-Q123 WeakPolarHBondContact O-CA 3.4Å; G119-Q123 PolarHBondContact O-N 3.11Å; Q123-H151 PolarHBondContact O-NE2 3.3Å
124	S	76.9	Confident	81.3	Confident	1 Å²	1	61.5 Å²	61.5	1%	0.007	32%	0.323	C	S	.	.			trans	-92.9	-5.8	-175.4	63.2	0	0	0	0	112.8	H82 S83 Y86 I122 H151	H82-S124 CarbonylContact C-O 3.35Å; H82-S124 WeakPolarHBondContact CA-O 3.09Å; H82-S124 WeakPolarHBondContact CB-O 3.49Å; S83-S124 PolarHBondContact N-O 2.93Å; S83-S124 VanDerWaalsContact OG-CB 3.24Å; S83-S124 WeakPolarHBondContact OG-CB 3.21Å; Y86-S124 WeakPolarHBondContact CB-OG 2.98Å; I122-S124 WeakPolarHBondContact CD1-OG 3.43Å; I122-S124 WeakPolarHBondContact CG1-OG 3.49Å; I122-S124 PolarHBondContact O-N 3.39Å; S124-H151 PolarHBondContact O-CD2 2.79Å; S124-H151 VanDerWaalsContact O-CD2 3.26Å
125	V	76.4	Confident	81.1	Confident	19 Å²	19	64.3 Å²	64.3	12%	0.115	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	136.2	176.7	178.4	0	0	0	0	108.8	H82 Y86 V115 A118	H82-V125 HydrophobicContact CB-CG2 4.35Å; Y86-V125 HydrophobicContact CD1-CG2 3.95Å; Y86-V125 HydrophobicContact CD2-CG2 4Å; Y86-V125 HydrophobicContact CE1-CG2 4.24Å; Y86-V125 HydrophobicContact CE2-CG2 4.28Å; Y86-V125 HydrophobicContact CG-CG2 3.83Å; V115-V125 HydrophobicContact CG1-CB 4.43Å; V115-V125 HydrophobicContact CG1-CG1 3.54Å; V115-V125 HydrophobicContact CG1-CG2 4.3Å; A118-V125 HydrophobicContact CB-CG2 4.04Å
126	Y	74.8	Confident	81.4	Confident	108 Å²	108	65.5 Å²	65.5	42%	0.424	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	-57.6	174.5	175.9	-96.6	0	0	0	112.4	T81 E146 F148	T81-Y126 PolarHBondContact O-N 3.18Å; Y126-E146 HydrophobicContact CE1-CB 4.12Å; Y126-E146 PolarHBondContact OH-OE2 3.09Å; Y126-F148 AromaticContact CD1-CD2 3.8Å; Y126-F148 HydrophobicContact CD1-CD2 3.8Å; Y126-F148 AromaticContact CD1-CE2 3.71Å; Y126-F148 HydrophobicContact CD1-CE2 3.71Å; Y126-F148 AromaticContact CD2-CD2 3.88Å; Y126-F148 HydrophobicContact CD2-CD2 3.88Å; Y126-F148 AromaticContact CD2-CE2 3.95Å; Y126-F148 HydrophobicContact CD2-CE2 3.95Å; Y126-F148 HydrophobicContact CD2-CG 4.5Å; Y126-F148 AromaticContact CE1-CD2 3.76Å; Y126-F148 HydrophobicContact CE1-CD2 3.76Å; Y126-F148 AromaticContact CE1-CE2 3.15Å; Y126-F148 HydrophobicContact CE1-CE2 3.15Å; Y126-F148 AromaticContact CE1-CZ 4Å; Y126-F148 HydrophobicContact CE1-CZ 4Å; Y126-F148 AromaticContact CE2-CD2 3.82Å; Y126-F148 HydrophobicContact CE2-CD2 3.82Å; Y126-F148 HydrophobicContact CE2-CE1 4.3Å; Y126-F148 AromaticContact CE2-CE2 3.41Å; Y126-F148 HydrophobicContact CE2-CE2 3.41Å; Y126-F148 VanDerWaalsContact CE2-CE2 3.41Å; Y126-F148 HydrophobicContact CE2-CG 4.49Å; Y126-F148 AromaticContact CE2-CZ 3.65Å; Y126-F148 HydrophobicContact CE2-CZ 3.65Å; Y126-F148 AromaticContact CG-CD2 3.87Å; Y126-F148 HydrophobicContact CG-CD2 3.87Å; Y126-F148 HydrophobicContact CG-CE2 4.08Å; Y126-F148 AromaticContact CZ-CD2 3.76Å; Y126-F148 AromaticContact CZ-CE2 2.97Å; Y126-F148 AromaticContact CZ-CZ 3.34Å; Y126-F148 WeakPolarHBondContact OH-CE2 3.44Å; Y126-F148 WeakPolarHBondContact OH-CZ 3.12Å
127	G	70.6	Confident	81.9	Confident	21 Å²	21	60.2 Å²	60.2	22%	0.216	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	150	-170.7	0	0	0	0	0	113.3	V80 T81	V80-G127 CarbonylContact C-O 3.53Å; V80-G127 VanDerWaalsContact CA-O 3.28Å; V80-G127 WeakPolarHBondContact CA-O 3.43Å; T81-G127 PolarHBondContact N-O 2.79Å; T81-G127 PolarHBondContact OG1-N 3.15Å
128	I	77.5	Confident	82.3	Confident	65 Å²	65	62.1 Å²	62.1	33%	0.333	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	133.1	170.5	-57.9	176.1	0	0	0	107.5	G79 V80 M112 V115 E116	G79-I128 CarbonylContact O-C 3.23Å; G79-I128 WeakPolarHBondContact O-CA 3.46Å; V80-I128 HydrophobicContact CG1-CG1 4.31Å; M112-I128 HydrophobicContact CB-CD1 4.47Å; V115-I128 HydrophobicContact CB-CD1 4.26Å; V115-I128 HydrophobicContact CG1-CD1 3.86Å; V115-I128 HydrophobicContact CG1-CG1 3.74Å; E116-I128 HydrophobicContact CG-CD1 4.42Å
129	L	85.5	Confident	82.6	Confident	7 Å²	7	62.5 Å²	62.5	4%	0.037	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	149.5	167.5	64.2	137.7	0	0	0	110.2	L50 L77 G79 A143 F145 L154	L50-L129 HydrophobicContact CD1-CD1 3.95Å; L77-L129 HydrophobicContact CD2-CD1 3.79Å; G79-L129 PolarHBondContact N-O 3.16Å; G79-L129 WeakPolarHBondContact O-CD2 3.41Å; G79-L129 PolarHBondContact O-N 3Å; L129-A143 HydrophobicContact CD1-CB 3.91Å; L129-F145 HydrophobicContact CB-CB 4.21Å; L129-F145 HydrophobicContact CD1-CD1 4.24Å; L129-F145 HydrophobicContact CD2-CB 4.1Å; L129-F145 HydrophobicContact CD2-CD1 4.45Å; L129-F145 HydrophobicContact CD2-CG 4.23Å; L129-L154 HydrophobicContact CD2-CD1 3.52Å
130	S	82.3	Confident	83.4	Confident	73 Å²	73	67 Å²	67	51%	0.51	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	141.4	175	-179.2	0	0	0	0	110	L77	L77-S130 CarbonylContact O-C 3.43Å; L77-S130 WeakPolarHBondContact O-CA 3.4Å; L77-S130 PolarHBondContact O-OG 3.26Å
131	A	84.1	Confident	83.9	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	143.7	169.3	0	0	0	0	0	109.4	N76 L77 M141 A143	N76-A131 WeakPolarHBondContact CA-O 3.31Å; L77-A131 HydrophobicContact CB-CB 3.89Å; L77-A131 PolarHBondContact N-O 2.89Å; L77-A131 PolarHBondContact O-N 2.88Å; A131-M141 HydrophobicContact CB-CB 3.8Å; A131-A143 HydrophobicContact CB-CB 4.09Å
132	P	83.9	Confident	84.4	Confident	94 Å²	94	53.9 Å²	53.9	61%	0.61	32%	0.317	S	S	*	.			trans	-63.5	148.1	-179.2	27	-34.5	0	0	0	111.9
133	A	88.4	Confident	84.9	Confident	48 Å²	48	49.9 Å²	49.9	40%	0.397	30%	0.298	S	S	.	.			trans	-56	149	173.1	0	0	0	0	0	112.4	W74 N76	W74-A133 WeakPolarHBondContact O-CB 3.46Å; N76-A133 VanDerWaalsContact OD1-CB 3.27Å; N76-A133 WeakPolarHBondContact OD1-CB 3.48Å; N76-A133 PolarHBondContact OD1-N 2.76Å
134	V	89.4	Confident	85.3	Confident	20 Å²	20	50.8 Å²	50.8	12%	0.121	30%	0.302	C	S	.	.	B	Isolated β-bridge	trans	-118.8	123.8	-179.4	178.4	0	0	0	0	109.9	Q73 W74 G139 Q140 M141	Q73-V134 WeakPolarHBondContact CB-O 3.29Å; W74-V134 PolarHBondContact N-O 2.87Å; W74-V134 PolarHBondContact O-N 2.87Å; V134-G139 VanDerWaalsContact CG1-CA 3.5Å; V134-Q140 VanDerWaalsContact CG2-O 3.3Å; V134-Q140 WeakPolarHBondContact CG2-O 3.46Å; V134-M141 HydrophobicContact CG2-CB 4.05Å; V134-M141 HydrophobicContact CG2-CG 3.67Å
135	V	85.6	Confident	85.8	Confident	117 Å²	117	51.6 Å²	51.6	71%	0.709	31%	0.306	S	S	*	.	S	Bend	trans	-78.2	130.1	173.3	-176.7	0	0	0	0	109
136	G	89.1	Confident	86.3	Confident	26 Å²	26	53.8 Å²	53.8	27%	0.268	31%	0.314	S	S	.	.	S	Bend	trans	92.3	143.4	-174.9	0	0	0	0	0	112.5	A72 S138	A72-G136 CarbonylContact O-C 3.6Å; A72-G136 WeakPolarHBondContact O-CA 3.42Å; A72-G136 PolarHBondContact O-N 2.72Å; G136-S138 VanDerWaalsContact C-N 3.27Å; G136-S138 PolarHBondContact O-N 2.81Å
137	G	90.9	Very high	86.9	Confident	1 Å²	1	48.6 Å²	48.6	1%	0.01	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-9.9	-173.9	0	0	0	0	0	115.5	G54 K55 W56 A72 W74	G54-G137 CarbonylContact C-O 3.56Å; G54-G137 VanDerWaalsContact CA-O 3.3Å; G54-G137 WeakPolarHBondContact CA-O 3.3Å; K55-G137 PolarHBondContact N-O 3.24Å; W56-G137 PolarHBondContact N-O 2.84Å; W56-G137 CarbonylContact O-C 3.58Å; W56-G137 WeakPolarHBondContact O-CA 3.42Å; A72-G137 PolarHBondContact O-N 3.02Å; A72-G137 VanDerWaalsContact O-N 3.09Å; W74-G137 PolarHBondContact NE1-O 3.34Å
138	S	93.5	Very high	87.9	Confident	81 Å²	81	50 Å²	50	57%	0.566	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.3	10.7	-177	68.6	0	0	0	0	116	G54 G136	G54-S138 CarbonylContact O-C 3.58Å; G54-S138 VanDerWaalsContact O-CA 3.3Å; G54-S138 WeakPolarHBondContact O-CA 3.38Å; G136-S138 VanDerWaalsContact C-N 3.27Å; G136-S138 PolarHBondContact O-N 2.81Å
139	G	89.9	Confident	88.5	Confident	21 Å²	21	48.6 Å²	48.6	22%	0.216	29%	0.292	C	S	.	.			trans	-83.2	175.9	-178.4	0	0	0	0	0	113.7	G54 V134	G54-G139 PolarHBondContact N-O 2.98Å; V134-G139 VanDerWaalsContact CG1-CA 3.5Å
140	Q	94.3	Very high	88.6	Confident	118 Å²	118	56.8 Å²	56.8	55%	0.551	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.1	147.4	-176.7	-62.3	-174.2	-70.2	0	0	111.6	F52 T53 V134	F52-Q140 CarbonylContact O-C 3.56Å; F52-Q140 WeakPolarHBondContact O-CA 3.06Å; T53-Q140 HydrophobicContact CG2-CG 4.07Å; T53-Q140 PolarHBondContact OG1-NE2 3.02Å; V134-Q140 VanDerWaalsContact CG2-O 3.3Å; V134-Q140 WeakPolarHBondContact CG2-O 3.46Å
141	M	92.5	Very high	89.1	Confident	3 Å²	3	54.3 Å²	54.3	2%	0.015	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	138.4	174.5	1	163.5	160.4	0	0	108.4	T51 F52 W74 L77 A131 V134 V158	T51-M141 CarbonylContact C-O 3.58Å; T51-M141 WeakPolarHBondContact CA-O 3.35Å; F52-M141 HydrophobicContact CB-CB 4.37Å; F52-M141 HydrophobicContact CB-CG 3.75Å; F52-M141 HydrophobicContact CB-SD 3.86Å; F52-M141 HydrophobicContact CD1-CE 3.2Å; F52-M141 HydrophobicContact CD1-CG 3.54Å; F52-M141 HydrophobicContact CD1-SD 3.61Å; F52-M141 HydrophobicContact CD2-CE 4.38Å; F52-M141 HydrophobicContact CD2-SD 4.46Å; F52-M141 HydrophobicContact CE1-CE 3.23Å; F52-M141 HydrophobicContact CE1-CG 4.46Å; F52-M141 HydrophobicContact CE1-SD 4.24Å; F52-M141 HydrophobicContact CE2-CE 4.39Å; F52-M141 HydrophobicContact CG-CE 3.82Å; F52-M141 HydrophobicContact CG-CG 3.93Å; F52-M141 HydrophobicContact CG-SD 3.72Å; F52-M141 HydrophobicContact CZ-CE 3.85Å; F52-M141 PolarHBondContact N-O 3.07Å; F52-M141 PolarHBondContact O-N 2.92Å; W74-M141 HydrophobicContact CB-CE 3.45Å; W74-M141 VanDerWaalsContact CB-CE 3.45Å; W74-M141 HydrophobicContact CG-CE 3.93Å; L77-M141 HydrophobicContact CB-SD 3.74Å; L77-M141 HydrophobicContact CD1-SD 4.18Å; A131-M141 HydrophobicContact CB-CB 3.8Å; V134-M141 HydrophobicContact CG2-CB 4.05Å; V134-M141 HydrophobicContact CG2-CG 3.67Å; M141-V158 HydrophobicContact CE-CG1 3.56Å; M141-V158 HydrophobicContact CE-CG2 4.27Å; M141-V158 HydrophobicContact SD-CG2 4.4Å
142	D	90.9	Very high	89.6	Confident	89 Å²	89	54.6 Å²	54.6	48%	0.476	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	139.8	179.8	-62.5	-75.8	0	0	0	110.6	L50 T51	L50-D142 CarbonylContact O-C 3.53Å; L50-D142 VanDerWaalsContact O-CA 3.24Å; L50-D142 WeakPolarHBondContact O-CA 3.29Å; T51-D142 VanDerWaalsContact CB-OD1 3.29Å; T51-D142 WeakPolarHBondContact CB-OD1 3.5Å; T51-D142 VanDerWaalsContact CG2-OD1 3.3Å; T51-D142 WeakPolarHBondContact CG2-OD1 3.34Å; T51-D142 PolarHBondContact OG1-OD1 3.3Å
143	A	86.6	Confident	90.1	Very high	10 Å²	10	52.9 Å²	52.9	8%	0.083	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	149.2	172.4	0	0	0	0	0	110.2	L50 L129 A131	L50-A143 PolarHBondContact N-O 3.37Å; L50-A143 PolarHBondContact O-N 2.85Å; L129-A143 HydrophobicContact CD1-CB 3.91Å; A131-A143 HydrophobicContact CB-CB 4.09Å
144	E	88.6	Confident	90.5	Very high	145 Å²	145	50.6 Å²	50.6	68%	0.678	27%	0.268	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110	145.7	173	-64.9	-174.8	179.8	0	0	110	Y48 I249	Y48-E144 VanDerWaalsContact O-CA 3.31Å; Y48-E144 WeakPolarHBondContact O-CA 3Å; E144-I249 HydrophobicContact CG-CD1 4.18Å
145	F	87.2	Confident	90.9	Very high	18 Å²	18	49.7 Å²	49.7	8%	0.079	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	162.8	178.3	69	-87.8	0	0	0	111.6	Y48 L50 T81 L129 L154 L175 L246	Y48-F145 HydrophobicContact CD2-CE2 4.27Å; Y48-F145 HydrophobicContact CD2-CZ 4.42Å; Y48-F145 HydrophobicContact CG-CE2 4.25Å; Y48-F145 AromaticContact CG-CZ 3.97Å; Y48-F145 HydrophobicContact CG-CZ 3.97Å; Y48-F145 PolarHBondContact N-O 3.39Å; Y48-F145 PolarHBondContact O-N 2.95Å; L50-F145 HydrophobicContact CB-CD1 4.34Å; L50-F145 HydrophobicContact CB-CE1 4.02Å; T81-F145 HydrophobicContact CG2-CD2 3.39Å; T81-F145 HydrophobicContact CG2-CE2 3.83Å; T81-F145 HydrophobicContact CG2-CG 4.28Å; L129-F145 HydrophobicContact CB-CB 4.21Å; L129-F145 HydrophobicContact CD1-CD1 4.24Å; L129-F145 HydrophobicContact CD2-CB 4.1Å; L129-F145 HydrophobicContact CD2-CD1 4.45Å; L129-F145 HydrophobicContact CD2-CG 4.23Å; F145-L154 HydrophobicContact CD2-CD1 4.45Å; F145-L154 HydrophobicContact CE1-CD1 4.43Å; F145-L154 HydrophobicContact CE1-CD2 4.06Å; F145-L154 HydrophobicContact CE2-CD1 4.19Å; F145-L154 HydrophobicContact CE2-CD2 4.43Å; F145-L154 HydrophobicContact CZ-CD1 4.18Å; F145-L154 HydrophobicContact CZ-CD2 3.74Å; F145-L154 HydrophobicContact CZ-CG 4.43Å; F145-L175 HydrophobicContact CE2-CD1 3.46Å; F145-L175 VanDerWaalsContact CE2-CD1 3.46Å; F145-L175 HydrophobicContact CZ-CD1 3.67Å; F145-L246 HydrophobicContact CE1-CD2 4.21Å; F145-L246 HydrophobicContact CZ-CD2 4.43Å
146	E	86.1	Confident	91.5	Very high	64 Å²	64	44.1 Å²	44.1	30%	0.299	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	141.7	176.8	-60.4	-177	134.3	0	0	111	T45 A46 H47 T81 Y126 F148	T45-E146 HydrophobicContact CG2-CB 4.12Å; A46-E146 WeakPolarHBondContact O-CA 3.14Å; H47-E146 IonicContact CE1-OE1 2.69Å; H47-E146 PolarHBondContact CE1-OE1 3.43Å; H47-E146 IonicContact NE2-OE1 2.76Å; H47-E146 PolarHBondContact NE2-OE1 2.78Å; T81-E146 WeakPolarHBondContact CG2-O 3.49Å; T81-E146 PolarHBondContact OG1-O 2.98Å; Y126-E146 HydrophobicContact CE1-CB 4.12Å; Y126-E146 PolarHBondContact OH-OE2 3.09Å; E146-F148 HydrophobicContact CB-CE2 3.77Å
147	A	88.8	Confident	91.9	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	136.4	173.9	0	0	0	0	0	110.5	T45 A46 Y48 L175 W181	T45-A147 WeakPolarHBondContact CG2-O 3.49Å; A46-A147 PolarHBondContact N-O 3.04Å; A46-A147 PolarHBondContact O-N 3.45Å; Y48-A147 HydrophobicContact CD2-CB 4.25Å; Y48-A147 HydrophobicContact CE2-CB 4.26Å; A147-L175 HydrophobicContact CB-CD1 4.06Å; A147-W181 HydrophobicContact CB-CE3 4.34Å; A147-W181 HydrophobicContact CB-CH2 3.65Å; A147-W181 HydrophobicContact CB-CZ2 4.46Å; A147-W181 HydrophobicContact CB-CZ3 3.58Å; A147-W181 WeakPolarHBondContact O-CZ2 3.2Å
148	F	90.3	Very high	92.2	Very high	51 Å²	51	42.8 Å²	42.8	22%	0.224	22%	0.215	C	C	.	.	B	Isolated β-bridge	trans	-118.5	156.9	-178.6	-70.1	-101.8	0	0	0	109.9	T45 Y126 E146 R150 H151 S152 W181	T45-F148 HydrophobicContact CG2-CD1 4.14Å; T45-F148 HydrophobicContact CG2-CD2 4.06Å; T45-F148 HydrophobicContact CG2-CE1 3.73Å; T45-F148 HydrophobicContact CG2-CE2 3.54Å; T45-F148 HydrophobicContact CG2-CG 4.3Å; T45-F148 HydrophobicContact CG2-CZ 3.39Å; T45-F148 WeakPolarHBondContact OG1-CD1 3.46Å; T45-F148 WeakPolarHBondContact OG1-CE1 3.45Å; Y126-F148 AromaticContact CD1-CD2 3.8Å; Y126-F148 HydrophobicContact CD1-CD2 3.8Å; Y126-F148 AromaticContact CD1-CE2 3.71Å; Y126-F148 HydrophobicContact CD1-CE2 3.71Å; Y126-F148 AromaticContact CD2-CD2 3.88Å; Y126-F148 HydrophobicContact CD2-CD2 3.88Å; Y126-F148 AromaticContact CD2-CE2 3.95Å; Y126-F148 HydrophobicContact CD2-CE2 3.95Å; Y126-F148 HydrophobicContact CD2-CG 4.5Å; Y126-F148 AromaticContact CE1-CD2 3.76Å; Y126-F148 HydrophobicContact CE1-CD2 3.76Å; Y126-F148 AromaticContact CE1-CE2 3.15Å; Y126-F148 HydrophobicContact CE1-CE2 3.15Å; Y126-F148 AromaticContact CE1-CZ 4Å; Y126-F148 HydrophobicContact CE1-CZ 4Å; Y126-F148 AromaticContact CE2-CD2 3.82Å; Y126-F148 HydrophobicContact CE2-CD2 3.82Å; Y126-F148 HydrophobicContact CE2-CE1 4.3Å; Y126-F148 AromaticContact CE2-CE2 3.41Å; Y126-F148 HydrophobicContact CE2-CE2 3.41Å; Y126-F148 VanDerWaalsContact CE2-CE2 3.41Å; Y126-F148 HydrophobicContact CE2-CG 4.49Å; Y126-F148 AromaticContact CE2-CZ 3.65Å; Y126-F148 HydrophobicContact CE2-CZ 3.65Å; Y126-F148 AromaticContact CG-CD2 3.87Å; Y126-F148 HydrophobicContact CG-CD2 3.87Å; Y126-F148 HydrophobicContact CG-CE2 4.08Å; Y126-F148 AromaticContact CZ-CD2 3.76Å; Y126-F148 AromaticContact CZ-CE2 2.97Å; Y126-F148 AromaticContact CZ-CZ 3.34Å; Y126-F148 WeakPolarHBondContact OH-CE2 3.44Å; Y126-F148 WeakPolarHBondContact OH-CZ 3.12Å; E146-F148 HydrophobicContact CB-CE2 3.77Å; F148-R150 PolarHBondContact O-N 2.82Å; F148-R150 VanDerWaalsContact O-N 3.16Å; F148-H151 HydrophobicContact CB-CB 4.43Å; F148-H151 CarbonylContact O-C 3.59Å; F148-H151 WeakPolarHBondContact O-CA 3.29Å; F148-H151 PolarHBondContact O-N 2.93Å; F148-S152 PolarHBondContact O-N 3.17Å; F148-S152 VanDerWaalsContact O-N 3.07Å; F148-W181 WeakPolarHBondContact O-CH2 3.26Å
149	A	90.4	Very high	92.5	Very high	34 Å²	34	40.1 Å²	40.1	28%	0.281	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-34	-179.6	0	0	0	0	0	113.6	C40 A42 H151	C40-A149 HydrophobicContact CB-CB 4.44Å; C40-A149 WeakPolarHBondContact CB-O 3.49Å; A42-A149 WeakPolarHBondContact O-CB 3.21Å; A149-H151 VanDerWaalsContact C-N 3.35Å
150	R	88.2	Confident	92.9	Very high	179 Å²	179	39.1 Å²	39.1	68%	0.675	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-16.1	175.5	-66.8	-172.3	66.8	-160.3	-3.3	113.9	S83 F148	S83-R150 VanDerWaalsContact CB-O 3.22Å; S83-R150 WeakPolarHBondContact CB-O 3.38Å; F148-R150 PolarHBondContact O-N 2.82Å; F148-R150 VanDerWaalsContact O-N 3.16Å
151	H	91.8	Very high	93.1	Very high	21 Å²	21	34.7 Å²	34.7	10%	0.097	16%	0.163	C	C	.	.	B	Isolated β-bridge	trans	-134.6	55.9	-173.7	-55	92.4	0	0	0	109.6	H82 Q123 S124 F148 A149 Y153	H82-H151 CarbonylContact O-C 3.6Å; H82-H151 VanDerWaalsContact O-C 3.23Å; H82-H151 WeakPolarHBondContact O-CA 3.44Å; Q123-H151 PolarHBondContact O-NE2 3.3Å; S124-H151 PolarHBondContact O-CD2 2.79Å; S124-H151 VanDerWaalsContact O-CD2 3.26Å; F148-H151 HydrophobicContact CB-CB 4.43Å; F148-H151 CarbonylContact O-C 3.59Å; F148-H151 WeakPolarHBondContact O-CA 3.29Å; F148-H151 PolarHBondContact O-N 2.93Å; A149-H151 VanDerWaalsContact C-N 3.35Å; H151-Y153 VanDerWaalsContact C-N 3.33Å
152	S	94.6	Very high	93.3	Very high	6 Å²	6	35.4 Å²	35.4	4%	0.042	17%	0.168	C	C	.	.			trans	-84.5	-8.9	-174.5	66.1	0	0	0	0	113.5	H82 F148 D174 L175	H82-S152 PolarHBondContact O-N 3.26Å; F148-S152 PolarHBondContact O-N 3.17Å; F148-S152 VanDerWaalsContact O-N 3.07Å; S152-D174 WeakPolarHBondContact CB-OD1 3.29Å; S152-D174 PolarHBondContact OG-OD1 2.81Å; S152-L175 WeakPolarHBondContact O-CB 3.25Å; S152-L175 PolarHBondContact O-N 2.54Å
153	Y	95.5	Very high	93.7	Very high	59 Å²	59	31.5 Å²	31.5	23%	0.231	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	144.2	179.7	-64.3	-91.5	0	0	0	111.1	T81 H82 H151 G172 V173 D174	T81-Y153 CarbonylContact C-O 3.57Å; T81-Y153 VanDerWaalsContact CA-O 3.29Å; T81-Y153 WeakPolarHBondContact CA-O 3.43Å; H82-Y153 PolarHBondContact N-O 3.36Å; H82-Y153 WeakPolarHBondContact O-CB 3.26Å; H82-Y153 PolarHBondContact O-N 3.46Å; H82-Y153 VanDerWaalsContact O-N 3.07Å; H151-Y153 VanDerWaalsContact C-N 3.33Å; Y153-G172 WeakPolarHBondContact CD1-O 3.15Å; Y153-V173 WeakPolarHBondContact CA-O 3.5Å; Y153-D174 HydrophobicContact CD1-CB 3.97Å; Y153-D174 HydrophobicContact CE1-CB 3.64Å
154	L	96.6	Very high	94.3	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	131.3	171.3	173.1	77.4	0	0	0	109.2	L50 V80 T81 L129 F145 F156 G172 V173 L175 L246	L50-L154 HydrophobicContact CD1-CD2 4.06Å; V80-L154 WeakPolarHBondContact O-CA 3.33Å; T81-L154 HydrophobicContact CG2-CD1 4.04Å; L129-L154 HydrophobicContact CD2-CD1 3.52Å; F145-L154 HydrophobicContact CD2-CD1 4.45Å; F145-L154 HydrophobicContact CE1-CD1 4.43Å; F145-L154 HydrophobicContact CE1-CD2 4.06Å; F145-L154 HydrophobicContact CE2-CD1 4.19Å; F145-L154 HydrophobicContact CE2-CD2 4.43Å; F145-L154 HydrophobicContact CZ-CD1 4.18Å; F145-L154 HydrophobicContact CZ-CD2 3.74Å; F145-L154 HydrophobicContact CZ-CG 4.43Å; L154-F156 HydrophobicContact CD2-CD1 4.43Å; L154-G172 PolarHBondContact O-N 3.31Å; L154-V173 HydrophobicContact CB-CG1 3.8Å; L154-V173 HydrophobicContact CD2-CG1 4.17Å; L154-V173 HydrophobicContact CG-CG1 4.35Å; L154-V173 PolarHBondContact N-O 2.82Å; L154-V173 WeakPolarHBondContact O-CG1 3.44Å; L154-V173 PolarHBondContact O-N 2.79Å; L154-L175 HydrophobicContact CB-CD1 4.28Å; L154-L246 HydrophobicContact CD2-CD1 3.69Å; L154-L246 HydrophobicContact CD2-CD2 3.71Å; L154-L246 HydrophobicContact CD2-CG 4.38Å
155	S	97.5	Very high	94.7	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	145.5	165.5	-66.1	0	0	0	0	109.9	G79 V80 H82 V170 G172	G79-S155 CarbonylContact C-O 3.57Å; G79-S155 WeakPolarHBondContact CA-O 3.24Å; V80-S155 PolarHBondContact N-O 3.02Å; V80-S155 PolarHBondContact O-N 3.4Å; H82-S155 PolarHBondContact CE1-OG 3.35Å; H82-S155 WeakPolarHBondContact NE2-CB 3.38Å; H82-S155 PolarHBondContact NE2-N 3.43Å; H82-S155 PolarHBondContact NE2-OG 2.96Å; S155-V170 CarbonylContact C-O 3.42Å; S155-V170 WeakPolarHBondContact CA-O 3.48Å; S155-G172 PolarHBondContact OG-N 3.21Å
156	F	97.6	Very high	95.3	Very high	0 Å²	0	24 Å²	24	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153	163.9	172.3	72.6	-90.7	0	0	0	111.4	L50 F52 L77 I78 W89 L154 V158 G169 V170 L189 V244	L50-F156 HydrophobicContact CD1-CD1 4.2Å; L50-F156 HydrophobicContact CD1-CE1 4.43Å; F52-F156 HydrophobicContact CD2-CE2 4.42Å; L77-F156 HydrophobicContact CD1-CD2 3.8Å; L77-F156 HydrophobicContact CD1-CE2 4.16Å; L77-F156 HydrophobicContact CD1-CG 4.4Å; L77-F156 HydrophobicContact CD2-CB 4.25Å; L77-F156 HydrophobicContact CG-CB 4.48Å; L77-F156 HydrophobicContact CG-CD2 4.08Å; I78-F156 CarbonylContact O-C 3.2Å; I78-F156 WeakPolarHBondContact O-CA 3.32Å; I78-F156 WeakPolarHBondContact O-CB 3.49Å; W89-F156 PolarHBondContact NE1-O 3.39Å; W89-F156 VanDerWaalsContact NE1-O 3.15Å; L154-F156 HydrophobicContact CD2-CD1 4.43Å; F156-V158 HydrophobicContact CD2-CG2 4.27Å; F156-V158 HydrophobicContact CE2-CG2 4.41Å; F156-G169 CarbonylContact O-C 3.22Å; F156-G169 WeakPolarHBondContact O-CA 3.24Å; F156-V170 HydrophobicContact CD1-CB 4.04Å; F156-V170 HydrophobicContact CD1-CG2 4.34Å; F156-V170 HydrophobicContact CE1-CB 3.62Å; F156-V170 HydrophobicContact CE1-CG2 3.43Å; F156-V170 VanDerWaalsContact CE1-CG2 3.43Å; F156-V170 HydrophobicContact CZ-CB 4.23Å; F156-V170 HydrophobicContact CZ-CG2 3.68Å; F156-V170 PolarHBondContact N-O 2.74Å; F156-V170 PolarHBondContact O-N 2.86Å; F156-L189 HydrophobicContact CE2-CD1 4.09Å; F156-L189 HydrophobicContact CZ-CD1 3.95Å; F156-L189 HydrophobicContact CZ-CD2 4.33Å; F156-V244 HydrophobicContact CE1-CB 4.35Å; F156-V244 HydrophobicContact CE1-CG1 4.06Å; F156-V244 HydrophobicContact CE1-CG2 4.05Å; F156-V244 HydrophobicContact CZ-CB 3.87Å; F156-V244 HydrophobicContact CZ-CG1 3.82Å; F156-V244 HydrophobicContact CZ-CG2 3.91Å
157	M	98.1	Very high	95.9	Very high	0 Å²	0	21 Å²	21	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	154.1	172.4	66.8	-179.8	-48.3	0	0	112	I78 M88 V99 F102 A103 I111 F167 V168	I78-M157 PolarHBondContact N-O 3.34Å; I78-M157 PolarHBondContact O-N 3.45Å; M88-M157 HydrophobicContact CE-CG 3.61Å; M88-M157 HydrophobicContact CE-SD 3.87Å; M88-M157 HydrophobicContact SD-CG 4.47Å; V99-M157 HydrophobicContact CG1-CE 3.96Å; V99-M157 HydrophobicContact CG1-SD 4.5Å; V99-M157 HydrophobicContact CG2-SD 4.42Å; F102-M157 HydrophobicContact CB-SD 4.35Å; F102-M157 HydrophobicContact CD1-CE 3.47Å; F102-M157 VanDerWaalsContact CD1-CE 3.47Å; F102-M157 HydrophobicContact CD1-CG 3.69Å; F102-M157 HydrophobicContact CD1-SD 3.49Å; F102-M157 WeakPolarHBondContact CD1-SD 3.12Å; F102-M157 HydrophobicContact CE1-CB 4.44Å; F102-M157 HydrophobicContact CE1-CE 4.13Å; F102-M157 HydrophobicContact CE1-CG 3.55Å; F102-M157 HydrophobicContact CE1-SD 4.03Å; F102-M157 HydrophobicContact CG-CE 4.41Å; F102-M157 HydrophobicContact CG-SD 4.14Å; F102-M157 HydrophobicContact CZ-CG 4.39Å; A103-M157 HydrophobicContact CB-CE 4.36Å; I111-M157 HydrophobicContact CD1-SD 3.75Å; M157-F167 HydrophobicContact CB-CD2 4.05Å; M157-F167 HydrophobicContact CE-CB 4.27Å; M157-F167 HydrophobicContact CE-CD1 4.35Å; M157-F167 HydrophobicContact CE-CD2 3.95Å; M157-F167 HydrophobicContact CE-CE2 4.38Å; M157-F167 HydrophobicContact CE-CG 3.93Å; M157-V168 CarbonylContact C-O 3.55Å; M157-V168 WeakPolarHBondContact CA-O 3.31Å
158	V	98.4	Very high	96.4	Very high	0 Å²	0	21 Å²	21	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	122.2	176.8	-172.4	0	0	0	0	108.2	F52 W74 L77 M141 F156 F167 V168	F52-V158 HydrophobicContact CD2-CG2 4.12Å; F52-V158 HydrophobicContact CE2-CB 4.37Å; F52-V158 HydrophobicContact CE2-CG2 3.94Å; F52-V158 HydrophobicContact CZ-CG1 4.49Å; W74-V158 HydrophobicContact CB-CG1 3.92Å; W74-V158 HydrophobicContact CD2-CG1 4.49Å; W74-V158 HydrophobicContact CE3-CG1 3.88Å; L77-V158 HydrophobicContact CB-CG2 3.84Å; L77-V158 HydrophobicContact CD1-CG2 3.84Å; L77-V158 HydrophobicContact CG-CG2 3.83Å; M141-V158 HydrophobicContact CE-CG1 3.56Å; M141-V158 HydrophobicContact CE-CG2 4.27Å; M141-V158 HydrophobicContact SD-CG2 4.4Å; F156-V158 HydrophobicContact CD2-CG2 4.27Å; F156-V158 HydrophobicContact CE2-CG2 4.41Å; V158-F167 CarbonylContact O-C 3.56Å; V158-F167 VanDerWaalsContact O-CA 3.26Å; V158-F167 WeakPolarHBondContact O-CA 3.33Å; V158-F167 WeakPolarHBondContact O-CB 3.34Å; V158-V168 HydrophobicContact CB-CG2 3.89Å; V158-V168 PolarHBondContact N-O 3.39Å; V158-V168 PolarHBondContact O-N 3.46Å
159	R	98.5	Very high	96.7	Very high	24 Å²	24	18.9 Å²	18.9	9%	0.091	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	140.2	176.3	167.5	-178.9	168.7	67.5	-5.1	111.1	S75 F102 A103 E104 V161 S163 P164	S75-R159 PolarHBondContact N-O 2.85Å; S75-R159 VanDerWaalsContact N-O 3.07Å; S75-R159 WeakPolarHBondContact OG-CB 3.41Å; S75-R159 PolarHBondContact OG-N 2.82Å; F102-R159 HydrophobicContact CE1-CB 4.45Å; F102-R159 VanDerWaalsContact O-CD 3.29Å; F102-R159 WeakPolarHBondContact O-CD 3.31Å; A103-R159 WeakPolarHBondContact O-CD 3.16Å; A103-R159 WeakPolarHBondContact O-CG 3.26Å; A103-R159 PolarHBondContact O-NH1 3.07Å; E104-R159 PolarHBondContact O-NE 2.87Å; E104-R159 PolarHBondContact O-NH1 3.27Å; E104-R159 PolarHBondContact O-NH2 3.5Å; R159-V161 HydrophobicContact CG-CG2 4.04Å; R159-S163 VanDerWaalsContact CZ-O 3.28Å; R159-S163 PolarHBondContact NH1-O 2.86Å; R159-S163 PolarHBondContact NH1-OG 2.96Å; R159-S163 PolarHBondContact NH2-O 2.82Å; R159-P164 PolarHBondContact NH1-O 3.04Å
160	L	98.5	Very high	97	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	130	166.4	-76.8	72.4	0	0	0	108.9	W56 W74 P162 S163 W166 F167 V168 P191 F202 F230 I241	W56-L160 HydrophobicContact CZ3-CB 4.32Å; W74-L160 HydrophobicContact CH2-CG 4.38Å; W74-L160 HydrophobicContact CZ3-CD1 3.8Å; W74-L160 HydrophobicContact CZ3-CG 3.86Å; L160-P162 CarbonylContact O-C 3.57Å; L160-S163 WeakPolarHBondContact O-CB 3.24Å; L160-S163 PolarHBondContact O-N 3.23Å; L160-S163 PolarHBondContact O-OG 2.77Å; L160-W166 HydrophobicContact CB-CB 4.45Å; L160-W166 HydrophobicContact CD1-CB 4.47Å; L160-W166 HydrophobicContact CD2-CB 4.42Å; L160-W166 PolarHBondContact N-O 2.87Å; L160-F167 VanDerWaalsContact CD1-C 3.48Å; L160-V168 HydrophobicContact CD1-CG1 3.97Å; L160-P191 HydrophobicContact CD2-CB 4.47Å; L160-F202 HydrophobicContact CD2-CE1 4.28Å; L160-F230 HydrophobicContact CD2-CE2 3.9Å; L160-F230 HydrophobicContact CD2-CZ 3.66Å; L160-I241 HydrophobicContact CD2-CD1 3.73Å; L160-I241 HydrophobicContact CG-CD1 4.49Å
161	V	98.1	Very high	97.4	Very high	26 Å²	26	11.9 Å²	11.9	16%	0.158	6%	0.062	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	125	-178	178.9	0	0	0	0	110.2	W56 P70 A72 Q73 R159	W56-V161 WeakPolarHBondContact CZ3-O 2.95Å; P70-V161 HydrophobicContact CG-CG1 4.11Å; A72-V161 WeakPolarHBondContact CA-O 3.22Å; Q73-V161 HydrophobicContact CG-CB 3.56Å; Q73-V161 HydrophobicContact CG-CG1 3.57Å; Q73-V161 PolarHBondContact N-O 3.45Å; Q73-V161 PolarHBondContact O-N 2.86Å; R159-V161 HydrophobicContact CG-CG2 4.04Å
162	P	97.9	Very high	97.5	Very high	17 Å²	17	11.9 Å²	11.9	11%	0.11	7%	0.068	C	C	.	.	S	Bend	cis	-77.3	152	-9.7	34.9	-33.3	0	0	0	111.5	P66 P70 L160 F202	P66-P162 HydrophobicContact CB-CG 3.97Å; P66-P162 HydrophobicContact CG-CG 4.02Å; P70-P162 HydrophobicContact CG-CB 3.88Å; P70-P162 HydrophobicContact CG-CG 4.02Å; L160-P162 CarbonylContact O-C 3.57Å; P162-F202 CarbonylContact C-O 3.59Å; P162-F202 WeakPolarHBondContact CB-O 3.34Å; P162-F202 HydrophobicContact CG-CB 4.3Å; P162-F202 WeakPolarHBondContact O-CB 3.29Å; P162-F202 WeakPolarHBondContact O-CD1 3.31Å
163	S	98.4	Very high	97.6	Very high	7 Å²	7	12.6 Å²	12.6	5%	0.049	7%	0.072	C	C	.	.			trans	-158.2	165.7	166.4	66.5	0	0	0	0	109.9	R159 L160 W166 F202	R159-S163 VanDerWaalsContact CZ-O 3.28Å; R159-S163 PolarHBondContact NH1-O 2.86Å; R159-S163 PolarHBondContact NH1-OG 2.96Å; R159-S163 PolarHBondContact NH2-O 2.82Å; L160-S163 WeakPolarHBondContact O-CB 3.24Å; L160-S163 PolarHBondContact O-N 3.23Å; L160-S163 PolarHBondContact O-OG 2.77Å; S163-W166 PolarHBondContact OG-N 2.88Å; S163-W166 PolarHBondContact OG-O 3.36Å; S163-F202 VanDerWaalsContact CA-O 3.31Å; S163-F202 WeakPolarHBondContact CA-O 3.38Å; S163-F202 PolarHBondContact N-O 2.84Å
164	P	98.4	Very high	97.6	Very high	7 Å²	7	11.6 Å²	11.6	5%	0.045	7%	0.071	C	C	.	.	S	Bend	trans	-59.8	-73	169.9	-17	30.2	0	0	0	109.8	E104 R159 W166 D197 G199	E104-P164 WeakPolarHBondContact CA-O 3.45Å; R159-P164 PolarHBondContact NH1-O 3.04Å; P164-W166 HydrophobicContact CG-CD2 4.49Å; P164-W166 HydrophobicContact CG-CH2 4.47Å; P164-W166 HydrophobicContact CG-CZ2 3.88Å; P164-D197 HydrophobicContact CB-CB 3.88Å; P164-G199 VanDerWaalsContact CG-O 3.29Å; P164-G199 WeakPolarHBondContact CG-O 3.32Å
165	D	98.4	Very high	97.6	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	7%	0.071	C	C	.	.	S	Bend	trans	-143.2	28.9	-177.6	65	-10.5	0	0	0	111.7	A103 E104 A194 G195 T196 D197	A103-D165 WeakPolarHBondContact O-CA 3.26Å; E104-D165 HydrophobicContact CG-CB 3.99Å; D165-A194 HydrophobicContact CB-CB 3.97Å; D165-A194 WeakPolarHBondContact O-CB 3.38Å; D165-A194 PolarHBondContact O-N 2.99Å; D165-G195 PolarHBondContact OD2-N 3.47Å; D165-G195 VanDerWaalsContact OD2-N 3.09Å; D165-T196 PolarHBondContact OD2-N 2.88Å; D165-D197 HydrophobicContact CB-CB 3.98Å; D165-D197 PolarHBondContact OD2-N 2.96Å
166	W	98.8	Very high	97.4	Very high	9 Å²	9	11.8 Å²	11.8	3%	0.034	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	138.7	-172.5	-52.2	-21.6	0	0	0	112.5	L160 S163 P164 Y192 D193 F200 F202 I218 F230	L160-W166 HydrophobicContact CB-CB 4.45Å; L160-W166 HydrophobicContact CD1-CB 4.47Å; L160-W166 HydrophobicContact CD2-CB 4.42Å; L160-W166 PolarHBondContact N-O 2.87Å; S163-W166 PolarHBondContact OG-N 2.88Å; S163-W166 PolarHBondContact OG-O 3.36Å; P164-W166 HydrophobicContact CG-CD2 4.49Å; P164-W166 HydrophobicContact CG-CH2 4.47Å; P164-W166 HydrophobicContact CG-CZ2 3.88Å; W166-Y192 CarbonylContact C-O 3.6Å; W166-Y192 VanDerWaalsContact CA-O 3.24Å; W166-Y192 WeakPolarHBondContact CA-O 3.5Å; W166-D193 PolarHBondContact NE1-OD2 3.36Å; W166-F200 WeakPolarHBondContact CH2-O 3.47Å; W166-F202 AromaticContact CE3-CD1 3.71Å; W166-F202 HydrophobicContact CE3-CD1 3.71Å; W166-F202 AromaticContact CE3-CE1 3.74Å; W166-F202 HydrophobicContact CE3-CE1 3.74Å; W166-F202 AromaticContact CZ3-CD1 3.36Å; W166-F202 HydrophobicContact CZ3-CD1 3.36Å; W166-F202 AromaticContact CZ3-CE1 3.49Å; W166-F202 HydrophobicContact CZ3-CE1 3.49Å; W166-F202 VanDerWaalsContact CZ3-CE1 3.49Å; W166-F202 AromaticContact CZ3-CG 3.99Å; W166-F202 HydrophobicContact CZ3-CG 3.99Å; W166-F202 HydrophobicContact CZ3-CZ 4.26Å; W166-I218 HydrophobicContact CB-CD1 4.35Å; W166-I218 HydrophobicContact CD2-CD1 4.01Å; W166-I218 HydrophobicContact CG-CD1 3.75Å; W166-F230 HydrophobicContact CD2-CE2 4.42Å; W166-F230 HydrophobicContact CE3-CD2 4.14Å; W166-F230 AromaticContact CE3-CE2 3.65Å; W166-F230 HydrophobicContact CE3-CE2 3.65Å; W166-F230 HydrophobicContact CZ3-CD2 4.08Å; W166-F230 AromaticContact CZ3-CE2 3.88Å; W166-F230 HydrophobicContact CZ3-CE2 3.88Å
167	F	98.8	Very high	97.2	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	168.8	179.2	69.9	-82.9	0	0	0	112.3	W89 A103 M157 V158 L160 P191 Y192 A194 I215	W89-F167 AromaticContact CD2-CE2 3.7Å; W89-F167 HydrophobicContact CD2-CE2 3.7Å; W89-F167 HydrophobicContact CD2-CZ 4.02Å; W89-F167 AromaticContact CE2-CE2 3.78Å; W89-F167 AromaticContact CE3-CE2 3.88Å; W89-F167 HydrophobicContact CE3-CE2 3.88Å; W89-F167 AromaticContact CE3-CZ 3.86Å; W89-F167 HydrophobicContact CE3-CZ 3.86Å; W89-F167 HydrophobicContact CG-CE2 4.21Å; W89-F167 HydrophobicContact CG-CZ 4.46Å; W89-F167 HydrophobicContact CH2-CE2 4.2Å; W89-F167 HydrophobicContact CZ2-CE2 4.04Å; W89-F167 HydrophobicContact CZ3-CE2 4.12Å; W89-F167 HydrophobicContact CZ3-CZ 4.23Å; A103-F167 HydrophobicContact CB-CD1 4.23Å; M157-F167 HydrophobicContact CB-CD2 4.05Å; M157-F167 HydrophobicContact CE-CB 4.27Å; M157-F167 HydrophobicContact CE-CD1 4.35Å; M157-F167 HydrophobicContact CE-CD2 3.95Å; M157-F167 HydrophobicContact CE-CE2 4.38Å; M157-F167 HydrophobicContact CE-CG 3.93Å; V158-F167 CarbonylContact O-C 3.56Å; V158-F167 VanDerWaalsContact O-CA 3.26Å; V158-F167 WeakPolarHBondContact O-CA 3.33Å; V158-F167 WeakPolarHBondContact O-CB 3.34Å; L160-F167 VanDerWaalsContact CD1-C 3.48Å; F167-P191 CarbonylContact O-C 3.55Å; F167-P191 WeakPolarHBondContact O-CA 3.32Å; F167-Y192 HydrophobicContact CZ-CG 4.46Å; F167-Y192 PolarHBondContact N-O 2.94Å; F167-Y192 PolarHBondContact O-N 2.85Å; F167-A194 HydrophobicContact CD1-CB 4.34Å; F167-A194 HydrophobicContact CE1-CB 4.05Å; F167-I215 HydrophobicContact CE1-CG2 4.27Å; F167-I215 HydrophobicContact CZ-CG2 3.86Å
168	V	98.7	Very high	96.8	Very high	0 Å²	0	19 Å²	19	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	154.9	165.3	-68.2	0	0	0	0	108.3	F52 W74 M157 V158 L160 L189 I241	F52-V168 HydrophobicContact CE2-CG2 3.75Å; F52-V168 HydrophobicContact CZ-CG2 4.05Å; W74-V168 HydrophobicContact CE3-CG2 4.19Å; W74-V168 HydrophobicContact CH2-CG1 4.32Å; W74-V168 HydrophobicContact CH2-CG2 4.25Å; W74-V168 HydrophobicContact CZ3-CB 4.46Å; W74-V168 HydrophobicContact CZ3-CG1 4.09Å; W74-V168 HydrophobicContact CZ3-CG2 3.52Å; M157-V168 CarbonylContact C-O 3.55Å; M157-V168 WeakPolarHBondContact CA-O 3.31Å; V158-V168 HydrophobicContact CB-CG2 3.89Å; V158-V168 PolarHBondContact N-O 3.39Å; V158-V168 PolarHBondContact O-N 3.46Å; L160-V168 HydrophobicContact CD1-CG1 3.97Å; V168-L189 HydrophobicContact CB-CB 4.21Å; V168-L189 HydrophobicContact CB-CD1 4.44Å; V168-L189 HydrophobicContact CG1-CB 4.43Å; V168-L189 HydrophobicContact CG2-CD1 4.35Å; V168-I241 HydrophobicContact CG1-CG2 3.48Å; V168-I241 VanDerWaalsContact CG1-CG2 3.48Å
169	G	97.9	Very high	96.5	Very high	8 Å²	8	24.2 Å²	24.2	8%	0.082	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-179.3	-176.2	178.6	0	0	0	0	0	112.4	W89 F156	W89-G169 VanDerWaalsContact CZ2-C 3.48Å; F156-G169 CarbonylContact O-C 3.22Å; F156-G169 WeakPolarHBondContact O-CA 3.24Å
170	V	97.2	Very high	96.2	Very high	17 Å²	17	30.8 Å²	30.8	10%	0.103	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	137.5	168	178.6	0	0	0	0	108.3	S155 F156 V173 L187 L189 V244	S155-V170 CarbonylContact C-O 3.42Å; S155-V170 WeakPolarHBondContact CA-O 3.48Å; F156-V170 HydrophobicContact CD1-CB 4.04Å; F156-V170 HydrophobicContact CD1-CG2 4.34Å; F156-V170 HydrophobicContact CE1-CB 3.62Å; F156-V170 HydrophobicContact CE1-CG2 3.43Å; F156-V170 VanDerWaalsContact CE1-CG2 3.43Å; F156-V170 HydrophobicContact CZ-CB 4.23Å; F156-V170 HydrophobicContact CZ-CG2 3.68Å; F156-V170 PolarHBondContact N-O 2.74Å; F156-V170 PolarHBondContact O-N 2.86Å; V170-V173 HydrophobicContact CG1-CB 3.76Å; V170-V173 HydrophobicContact CG1-CG1 3.9Å; V170-L187 HydrophobicContact CG1-CD1 3.99Å; V170-L187 HydrophobicContact CG2-CD1 3.74Å; V170-L189 HydrophobicContact CG2-CD2 3.64Å; V170-V244 HydrophobicContact CG2-CG1 4.33Å
171	D	95.4	Very high	96	Very high	48 Å²	48	31.7 Å²	31.7	26%	0.257	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	115.7	169.7	171.3	29.9	0	0	0	108.4	H87 W89 Q90	H87-D171 IonicContact CE1-OD1 3.94Å; H87-D171 IonicContact CG-OD1 3.85Å; H87-D171 IonicContact ND1-OD1 3.02Å; H87-D171 PolarHBondContact ND1-OD1 2.91Å; H87-D171 IonicContact ND1-OD2 3.86Å; W89-D171 HydrophobicContact CD2-CB 4.45Å; W89-D171 HydrophobicContact CH2-CB 4.49Å; W89-D171 HydrophobicContact CZ2-CB 4.24Å; W89-D171 VanDerWaalsContact O-CB 3.3Å; W89-D171 WeakPolarHBondContact O-CB 3.27Å; Q90-D171 WeakPolarHBondContact CG-OD2 3.42Å
172	G	94.6	Very high	95.9	Very high	22 Å²	22	34 Å²	34	23%	0.227	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	60.7	55.1	168.5	0	0	0	0	0	115.6	Y153 L154 S155 D174	Y153-G172 WeakPolarHBondContact CD1-O 3.15Å; L154-G172 PolarHBondContact O-N 3.31Å; S155-G172 PolarHBondContact OG-N 3.21Å; G172-D174 PolarHBondContact O-N 2.99Å
173	V	95.9	Very high	95.8	Very high	20 Å²	20	37.1 Å²	37.1	12%	0.121	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	118.1	167.3	61	0	0	0	0	110.6	Y153 L154 V170 L175 V185 L187 L246	Y153-V173 WeakPolarHBondContact CA-O 3.5Å; L154-V173 HydrophobicContact CB-CG1 3.8Å; L154-V173 HydrophobicContact CD2-CG1 4.17Å; L154-V173 HydrophobicContact CG-CG1 4.35Å; L154-V173 PolarHBondContact N-O 2.82Å; L154-V173 WeakPolarHBondContact O-CG1 3.44Å; L154-V173 PolarHBondContact O-N 2.79Å; V170-V173 HydrophobicContact CG1-CB 3.76Å; V170-V173 HydrophobicContact CG1-CG1 3.9Å; V173-L175 PolarHBondContact O-N 2.91Å; V173-V185 HydrophobicContact CG2-CG1 4.16Å; V173-L187 HydrophobicContact CB-CD1 4.29Å; V173-L187 HydrophobicContact CG2-CD1 4.13Å; V173-L246 HydrophobicContact CG1-CD1 3.88Å
174	D	95.8	Very high	95.8	Very high	39 Å²	39	43.4 Å²	43.4	21%	0.209	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	120.1	174.7	-168.6	4.3	0	0	0	111	S152 Y153 G172 C176 K182	S152-D174 WeakPolarHBondContact CB-OD1 3.29Å; S152-D174 PolarHBondContact OG-OD1 2.81Å; Y153-D174 HydrophobicContact CD1-CB 3.97Å; Y153-D174 HydrophobicContact CE1-CB 3.64Å; G172-D174 PolarHBondContact O-N 2.99Å; D174-C176 PolarHBondContact OD1-N 3.5Å; D174-K182 PolarHBondContact O-NZ 3.48Å
175	L	95.6	Very high	95.7	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.23	C	C	.	.			trans	-89	-12.7	177.9	-62	174.6	0	0	0	112.9	Y48 F145 A147 S152 L154 V173 W181 K182 V185 L246	Y48-L175 HydrophobicContact CD2-CD1 4.17Å; Y48-L175 HydrophobicContact CE1-CD2 4.42Å; Y48-L175 HydrophobicContact CE2-CB 4.31Å; Y48-L175 HydrophobicContact CE2-CD1 4.16Å; Y48-L175 HydrophobicContact CG-CD1 4.49Å; F145-L175 HydrophobicContact CE2-CD1 3.46Å; F145-L175 VanDerWaalsContact CE2-CD1 3.46Å; F145-L175 HydrophobicContact CZ-CD1 3.67Å; A147-L175 HydrophobicContact CB-CD1 4.06Å; S152-L175 WeakPolarHBondContact O-CB 3.25Å; S152-L175 PolarHBondContact O-N 2.54Å; L154-L175 HydrophobicContact CB-CD1 4.28Å; V173-L175 PolarHBondContact O-N 2.91Å; L175-W181 HydrophobicContact CB-CE3 4.04Å; L175-W181 HydrophobicContact CB-CZ3 3.93Å; L175-K182 WeakPolarHBondContact O-CG 3.46Å; L175-K182 PolarHBondContact O-N 3.38Å; L175-V185 HydrophobicContact CD2-CG2 4.24Å; L175-L246 HydrophobicContact CD2-CB 4.46Å; L175-L246 HydrophobicContact CD2-CD1 3.66Å
176	C	94.9	Very high	95.7	Very high	3 Å²	3	47.2 Å²	47.2	2%	0.02	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	153.3	177.6	-164.1	0	0	0	0	111.2	C40 D174 G178 W181 K182	C40-C176 VanDerWaalsContact CA-SG 3.53Å; C40-C176 HydrophobicContact CB-CB 3.5Å; C40-C176 VanDerWaalsContact CB-CB 3.5Å; C40-C176 WeakPolarHBondContact CB-SG 3.48Å; C40-C176 WeakPolarHBondContact SG-CB 2.96Å; C40-C176 CovalentContact SG-SG 2.02Å; C40-C176 PolarHBondContact SG-SG 3.2Å; D174-C176 PolarHBondContact OD1-N 3.5Å; C176-G178 PolarHBondContact SG-O 2.97Å; C176-G178 VanDerWaalsContact SG-O 3.33Å; C176-W181 HydrophobicContact CB-CE3 4.23Å; C176-W181 HydrophobicContact CB-CH2 4.5Å; C176-W181 HydrophobicContact CB-CZ3 3.99Å; C176-K182 WeakPolarHBondContact O-CE 3.22Å; C176-K182 PolarHBondContact O-NZ 3.19Å
177	D	92.9	Very high	95.7	Very high	114 Å²	114	49.4 Å²	49.4	61%	0.61	26%	0.261	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.5	90.3	173.9	-173.5	15.2	0	0	0	107.4	D179 R180 K182	D177-D179 PolarHBondContact O-N 3.06Å; D177-R180 PolarHBondContact N-O 2.59Å; D177-R180 PolarHBondContact O-N 3.47Å; D177-K182 HydrophobicContact CB-CG 4.33Å
178	G	89.2	Confident	95.6	Very high	38 Å²	38	54.5 Å²	54.5	39%	0.392	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.4	-106	-173.6	0	0	0	0	0	112.3	T41 C176	T41-G178 PolarHBondContact N-O 3.02Å; T41-G178 PolarHBondContact OG1-O 3.29Å; C176-G178 PolarHBondContact SG-O 2.97Å; C176-G178 VanDerWaalsContact SG-O 3.33Å
179	D	91.6	Very high	95.6	Very high	110 Å²	110	54.8 Å²	54.8	59%	0.588	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.1	-1.6	-179.3	67.5	-25.2	0	0	0	113.7	D177	D177-D179 PolarHBondContact O-N 3.06Å
180	R	92.9	Very high	95.7	Very high	162 Å²	162	57.2 Å²	57.2	61%	0.611	30%	0.295	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.7	150	-172.9	-69.8	175.7	69.5	-178.2	-0.2	112.6	D177	D177-R180 PolarHBondContact N-O 2.59Å; D177-R180 PolarHBondContact O-N 3.47Å
181	W	95.1	Very high	95.7	Very high	18 Å²	18	56.4 Å²	56.4	7%	0.068	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	133	171.6	-69.5	108.4	0	0	0	110.5	A42 E44 A46 Y48 A147 F148 L175 C176 D183 K248	A42-W181 HydrophobicContact CB-CD2 4.44Å; A42-W181 HydrophobicContact CB-CZ2 4.07Å; E44-W181 PolarHBondContact O-NE1 3.19Å; A46-W181 HydrophobicContact CB-CB 4.06Å; A46-W181 HydrophobicContact CB-CD2 3.48Å; A46-W181 VanDerWaalsContact CB-CD2 3.48Å; A46-W181 HydrophobicContact CB-CE3 4.09Å; A46-W181 HydrophobicContact CB-CG 3.45Å; A46-W181 VanDerWaalsContact CB-CG 3.45Å; A46-W181 HydrophobicContact CB-CZ2 4.41Å; Y48-W181 HydrophobicContact CE2-CE3 4.08Å; Y48-W181 WeakPolarHBondContact OH-CB 3.31Å; A147-W181 HydrophobicContact CB-CE3 4.34Å; A147-W181 HydrophobicContact CB-CH2 3.65Å; A147-W181 HydrophobicContact CB-CZ2 4.46Å; A147-W181 HydrophobicContact CB-CZ3 3.58Å; A147-W181 WeakPolarHBondContact O-CZ2 3.2Å; F148-W181 WeakPolarHBondContact O-CH2 3.26Å; L175-W181 HydrophobicContact CB-CE3 4.04Å; L175-W181 HydrophobicContact CB-CZ3 3.93Å; C176-W181 HydrophobicContact CB-CE3 4.23Å; C176-W181 HydrophobicContact CB-CH2 4.5Å; C176-W181 HydrophobicContact CB-CZ3 3.99Å; W181-D183 PolarHBondContact O-N 2.88Å; W181-K248 HydrophobicContact CB-CD 3.95Å
182	K	95.8	Very high	95.9	Very high	74 Å²	74	56 Å²	56	32%	0.322	29%	0.285	S	S	.	.			trans	-63.9	124.8	176.9	-67	172.7	-173.6	164.2	0	109.9	Y48 D174 L175 C176 D177 K184 V185	Y48-K182 VanDerWaalsContact CE1-O 3.24Å; Y48-K182 WeakPolarHBondContact CE1-O 3.4Å; Y48-K182 PolarHBondContact OH-N 3.02Å; Y48-K182 PolarHBondContact OH-O 3.34Å; D174-K182 PolarHBondContact O-NZ 3.48Å; L175-K182 WeakPolarHBondContact O-CG 3.46Å; L175-K182 PolarHBondContact O-N 3.38Å; C176-K182 WeakPolarHBondContact O-CE 3.22Å; C176-K182 PolarHBondContact O-NZ 3.19Å; D177-K182 HydrophobicContact CB-CG 4.33Å; K182-K184 VanDerWaalsContact C-N 3.33Å; K182-K184 PolarHBondContact O-N 2.94Å; K182-V185 HydrophobicContact CB-CG2 3.91Å; K182-V185 HydrophobicContact CD-CG2 3.93Å
183	D	95.9	Very high	96.1	Very high	84 Å²	84	56.2 Å²	56.2	45%	0.449	28%	0.281	S	S	.	.	S	Bend	trans	-67.5	-34.9	-177.7	-74.8	-45.8	0	0	0	112.6	W181 K248	W181-D183 PolarHBondContact O-N 2.88Å; D183-K248 PolarHBondContact O-N 3.09Å
184	K	97.1	Very high	96.2	Very high	139 Å²	139	55.2 Å²	55.2	60%	0.604	28%	0.275	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-150	134.7	179.4	-172.5	177.1	-179.4	177.9	0	110.9	K182 T245 L246	K182-K184 VanDerWaalsContact C-N 3.33Å; K182-K184 PolarHBondContact O-N 2.94Å; K184-T245 HydrophobicContact CD-CG2 4.49Å; K184-T245 HydrophobicContact CG-CG2 4.24Å; K184-L246 CarbonylContact C-O 3.23Å; K184-L246 VanDerWaalsContact CA-O 3.26Å; K184-L246 WeakPolarHBondContact CA-O 3.27Å
185	V	97.7	Very high	96.3	Very high	21 Å²	21	53.4 Å²	53.4	13%	0.127	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	136.8	170.7	-176.2	0	0	0	0	108	V173 L175 K182 L187 T245 L246	V173-V185 HydrophobicContact CG2-CG1 4.16Å; L175-V185 HydrophobicContact CD2-CG2 4.24Å; K182-V185 HydrophobicContact CB-CG2 3.91Å; K182-V185 HydrophobicContact CD-CG2 3.93Å; V185-L187 HydrophobicContact CG1-CD1 4.43Å; V185-L187 HydrophobicContact CG1-CD2 4.36Å; V185-L187 HydrophobicContact CG1-CG 4.13Å; V185-T245 CarbonylContact O-C 3.6Å; V185-T245 WeakPolarHBondContact O-CA 3.41Å; V185-L246 HydrophobicContact CB-CB 4.2Å; V185-L246 HydrophobicContact CB-CD1 4.29Å; V185-L246 PolarHBondContact N-O 3.31Å; V185-L246 PolarHBondContact O-N 3.26Å
186	T	98.1	Very high	96.4	Very high	66 Å²	66	53.5 Å²	53.5	41%	0.405	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	125.8	177.7	-59.7	0	0	0	0	108.5	K243 V244	T186-K243 HydrophobicContact CG2-CD 3.82Å; T186-K243 HydrophobicContact CG2-CG 4.01Å; T186-V244 WeakPolarHBondContact CA-O 3.49Å
187	L	98	Very high	96.6	Very high	54 Å²	54	53.7 Å²	53.7	28%	0.283	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	137.5	-177.4	-57.6	168.8	0	0	0	109.7	V170 V173 V185 K243 V244	V170-L187 HydrophobicContact CG1-CD1 3.99Å; V170-L187 HydrophobicContact CG2-CD1 3.74Å; V173-L187 HydrophobicContact CB-CD1 4.29Å; V173-L187 HydrophobicContact CG2-CD1 4.13Å; V185-L187 HydrophobicContact CG1-CD1 4.43Å; V185-L187 HydrophobicContact CG1-CD2 4.36Å; V185-L187 HydrophobicContact CG1-CG 4.13Å; L187-K243 WeakPolarHBondContact O-CA 3.43Å; L187-K243 WeakPolarHBondContact O-CG 3.33Å; L187-V244 HydrophobicContact CB-CG1 3.73Å; L187-V244 HydrophobicContact CD1-CG1 4.32Å; L187-V244 HydrophobicContact CG-CG1 4.42Å; L187-V244 PolarHBondContact N-O 2.88Å; L187-V244 PolarHBondContact O-N 3.19Å
188	E	98.3	Very high	96.8	Very high	107 Å²	107	50.2 Å²	50.2	50%	0.5	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	134.5	170.8	-61.9	-162.1	135.5	0	0	109.2	F190 P240	E188-F190 HydrophobicContact CB-CE2 4.23Å; E188-F190 HydrophobicContact CB-CZ 4.47Å; E188-P240 HydrophobicContact CB-CB 3.98Å; E188-P240 HydrophobicContact CB-CG 3.95Å; E188-P240 HydrophobicContact CG-CB 4.4Å; E188-P240 HydrophobicContact CG-CG 4.11Å; E188-P240 WeakPolarHBondContact OE1-CG 3.14Å; E188-P240 WeakPolarHBondContact OE2-CG 3.33Å
189	L	98.4	Very high	97.1	Very high	6 Å²	6	48.8 Å²	48.8	3%	0.031	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	142.1	-173.7	-54.3	-179.7	0	0	0	110.4	F52 F156 V168 V170 I241 A242 V244	F52-L189 HydrophobicContact CD2-CD1 3.97Å; F52-L189 HydrophobicContact CE2-CD1 3.69Å; F156-L189 HydrophobicContact CE2-CD1 4.09Å; F156-L189 HydrophobicContact CZ-CD1 3.95Å; F156-L189 HydrophobicContact CZ-CD2 4.33Å; V168-L189 HydrophobicContact CB-CB 4.21Å; V168-L189 HydrophobicContact CB-CD1 4.44Å; V168-L189 HydrophobicContact CG1-CB 4.43Å; V168-L189 HydrophobicContact CG2-CD1 4.35Å; V170-L189 HydrophobicContact CG2-CD2 3.64Å; L189-I241 PolarHBondContact O-N 3.49Å; L189-A242 HydrophobicContact CB-CB 4.05Å; L189-A242 HydrophobicContact CD1-CB 4.01Å; L189-A242 HydrophobicContact CG-CB 4.46Å; L189-A242 PolarHBondContact N-O 3.23Å; L189-A242 PolarHBondContact O-N 3.17Å; L189-V244 HydrophobicContact CD1-CB 4.27Å; L189-V244 HydrophobicContact CD1-CG1 4.38Å; L189-V244 HydrophobicContact CD2-CG1 4.07Å; L189-V244 HydrophobicContact CG-CG1 4.4Å
190	F	98.5	Very high	97.2	Very high	59 Å²	59	48.5 Å²	48.5	26%	0.259	23%	0.231	S	C	.	.			trans	-127.3	151	-179.7	-62.1	-81.3	0	0	0	109.4	E188 Y192 L238 P240	E188-F190 HydrophobicContact CB-CE2 4.23Å; E188-F190 HydrophobicContact CB-CZ 4.47Å; F190-Y192 WeakPolarHBondContact O-CD2 3.44Å; F190-L238 WeakPolarHBondContact CE1-O 3.39Å; F190-P240 HydrophobicContact CE1-CB 4.49Å; F190-P240 HydrophobicContact CE1-CG 4.28Å; F190-P240 HydrophobicContact CZ-CG 4.13Å
191	P	98.5	Very high	97.4	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.209	C	C	.	.			trans	-68.5	142.2	-177.9	27	-31.5	0	0	0	111.7	L160 F167 I218 F230 L238	L160-P191 HydrophobicContact CD2-CB 4.47Å; F167-P191 CarbonylContact O-C 3.55Å; F167-P191 WeakPolarHBondContact O-CA 3.32Å; P191-I218 HydrophobicContact CB-CB 4.19Å; P191-I218 HydrophobicContact CB-CD1 4.28Å; P191-I218 HydrophobicContact CG-CB 3.99Å; P191-I218 HydrophobicContact CG-CG2 4.25Å; P191-I218 WeakPolarHBondContact O-CB 3.31Å; P191-I218 PolarHBondContact O-N 3Å; P191-F230 HydrophobicContact CB-CD2 4.45Å; P191-F230 HydrophobicContact CB-CE2 4.03Å; P191-F230 HydrophobicContact CB-CZ 4.24Å; P191-F230 HydrophobicContact CG-CD1 4.35Å; P191-F230 HydrophobicContact CG-CD2 4.25Å; P191-F230 HydrophobicContact CG-CE1 4.28Å; P191-F230 HydrophobicContact CG-CE2 4.15Å; P191-F230 HydrophobicContact CG-CG 4.34Å; P191-F230 HydrophobicContact CG-CZ 4.17Å; P191-L238 HydrophobicContact CG-CD1 4.04Å
192	Y	98.8	Very high	97.4	Very high	39 Å²	39	41.3 Å²	41.3	15%	0.153	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	149.3	171.5	-76.5	-95.4	0	0	0	109.5	W89 W166 F167 F190 I215 T216 Q217	W89-Y192 HydrophobicContact CH2-CD1 4.5Å; W89-Y192 HydrophobicContact CH2-CD2 4.1Å; W89-Y192 HydrophobicContact CH2-CE1 4.34Å; W89-Y192 AromaticContact CH2-CE2 3.92Å; W89-Y192 HydrophobicContact CH2-CE2 3.92Å; W89-Y192 HydrophobicContact CH2-CG 4.38Å; W89-Y192 HydrophobicContact CZ3-CD1 4.08Å; W89-Y192 HydrophobicContact CZ3-CD2 4.44Å; W89-Y192 HydrophobicContact CZ3-CE1 4.06Å; W89-Y192 HydrophobicContact CZ3-CE2 4.41Å; W89-Y192 HydrophobicContact CZ3-CG 4.27Å; W166-Y192 CarbonylContact C-O 3.6Å; W166-Y192 VanDerWaalsContact CA-O 3.24Å; W166-Y192 WeakPolarHBondContact CA-O 3.5Å; F167-Y192 HydrophobicContact CZ-CG 4.46Å; F167-Y192 PolarHBondContact N-O 2.94Å; F167-Y192 PolarHBondContact O-N 2.85Å; F190-Y192 WeakPolarHBondContact O-CD2 3.44Å; Y192-I215 HydrophobicContact CD1-CG2 3.94Å; Y192-T216 CarbonylContact C-O 3.01Å; Y192-T216 WeakPolarHBondContact CA-O 3.32Å; Y192-Q217 HydrophobicContact CD1-CB 3.99Å; Y192-Q217 HydrophobicContact CD1-CG 4.47Å; Y192-Q217 HydrophobicContact CE1-CB 3.62Å; Y192-Q217 HydrophobicContact CE1-CG 4.06Å; Y192-Q217 HydrophobicContact CE2-CG 4.36Å
193	D	98.7	Very high	97.4	Very high	27 Å²	27	42.5 Å²	42.5	14%	0.144	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	132.2	171.3	-167.9	-67.3	0	0	0	108.1	W166 G195 I215 T216 I218	W166-D193 PolarHBondContact NE1-OD2 3.36Å; D193-G195 VanDerWaalsContact C-N 3.3Å; D193-G195 WeakPolarHBondContact OD1-CA 3.39Å; D193-G195 PolarHBondContact OD1-N 3.08Å; D193-I215 CarbonylContact O-C 3.56Å; D193-I215 VanDerWaalsContact O-CA 3.26Å; D193-I215 WeakPolarHBondContact O-CA 3.26Å; D193-T216 PolarHBondContact N-O 2.93Å; D193-T216 PolarHBondContact O-N 2.83Å; D193-I218 HydrophobicContact CB-CD1 3.96Å; D193-I218 HydrophobicContact CB-CG1 3.9Å
194	A	98.5	Very high	97.4	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.214	C	C	.	.			trans	-79.5	-14.4	-177.7	0	0	0	0	0	113.3	A95 A103 D165 F167 T196	A95-A194 HydrophobicContact CB-CB 4.47Å; A103-A194 HydrophobicContact CB-CB 3.81Å; D165-A194 HydrophobicContact CB-CB 3.97Å; D165-A194 WeakPolarHBondContact O-CB 3.38Å; D165-A194 PolarHBondContact O-N 2.99Å; F167-A194 HydrophobicContact CD1-CB 4.34Å; F167-A194 HydrophobicContact CE1-CB 4.05Å; A194-T196 HydrophobicContact CB-CG2 4.5Å
195	G	98.1	Very high	97.3	Very high	1 Å²	1	38.7 Å²	38.7	1%	0.01	22%	0.219	C	C	.	.	S	Bend	trans	76.4	21.6	-178	0	0	0	0	0	113.7	D165 D193 T209 Q212 D213	D165-G195 PolarHBondContact OD2-N 3.47Å; D165-G195 VanDerWaalsContact OD2-N 3.09Å; D193-G195 VanDerWaalsContact C-N 3.3Å; D193-G195 WeakPolarHBondContact OD1-CA 3.39Å; D193-G195 PolarHBondContact OD1-N 3.08Å; G195-T209 WeakPolarHBondContact O-CB 3.49Å; G195-Q212 WeakPolarHBondContact O-CG 3.46Å; G195-D213 PolarHBondContact O-N 3.07Å
196	T	98.1	Very high	97.1	Very high	2 Å²	2	43 Å²	43	1%	0.012	24%	0.241	C	C	.	.	S	Bend	trans	-115.6	-21.8	-175.2	66.7	0	0	0	0	113.8	A95 R100 E104 D165 A194 T209 Q212	A95-T196 HydrophobicContact CB-CG2 4.27Å; R100-T196 HydrophobicContact CB-CG2 3.99Å; R100-T196 HydrophobicContact CG-CG2 3.77Å; E104-T196 VanDerWaalsContact OE1-CB 3.31Å; E104-T196 WeakPolarHBondContact OE1-CB 3.46Å; E104-T196 PolarHBondContact OE1-OG1 2.92Å; D165-T196 PolarHBondContact OD2-N 2.88Å; A194-T196 HydrophobicContact CB-CG2 4.5Å; T196-T209 PolarHBondContact O-N 2.89Å; T196-Q212 HydrophobicContact CG2-CG 4.05Å
197	D	98.1	Very high	97	Very high	7 Å²	7	46.4 Å²	46.4	4%	0.037	25%	0.251	C	S	.	.	B	Isolated β-bridge	trans	-131.1	126.4	173.8	-166.5	-52.2	0	0	0	111.2	P164 D165 G199 N206 F207 T209	P164-D197 HydrophobicContact CB-CB 3.88Å; D165-D197 HydrophobicContact CB-CB 3.98Å; D165-D197 PolarHBondContact OD2-N 2.96Å; D197-G199 VanDerWaalsContact C-N 3.29Å; D197-G199 PolarHBondContact O-N 3.33Å; D197-G199 PolarHBondContact OD1-N 2.87Å; D197-N206 VanDerWaalsContact OD2-CA 3.24Å; D197-N206 WeakPolarHBondContact OD2-CA 3.46Å; D197-N206 PolarHBondContact OD2-OD1 2.67Å; D197-F207 CarbonylContact C-O 3.56Å; D197-F207 PolarHBondContact OD1-N 2.95Å; D197-F207 PolarHBondContact OD2-N 2.8Å; D197-T209 WeakPolarHBondContact CA-OG1 3.33Å; D197-T209 PolarHBondContact N-OG1 2.73Å
198	S	96.8	Very high	96.9	Very high	40 Å²	40	48 Å²	48	28%	0.28	26%	0.257	S	S	.	.			trans	-88.9	16.3	-175.9	-74.4	0	0	0	0	113.5	F200 F207 T209	S198-F200 WeakPolarHBondContact O-CD1 3.41Å; S198-F207 VanDerWaalsContact CB-CD1 3.42Å; S198-F207 PolarHBondContact N-O 2.82Å; S198-T209 PolarHBondContact N-OG1 2.95Å; S198-T209 VanDerWaalsContact N-OG1 3.11Å; S198-T209 PolarHBondContact OG-OG1 3.37Å
199	G	95.9	Very high	96.8	Very high	9 Å²	9	43.5 Å²	43.5	9%	0.093	24%	0.237	C	C	.	.			trans	-58.2	135.4	172.6	0	0	0	0	0	112.6	P164 D197	P164-G199 VanDerWaalsContact CG-O 3.29Å; P164-G199 WeakPolarHBondContact CG-O 3.32Å; D197-G199 VanDerWaalsContact C-N 3.29Å; D197-G199 PolarHBondContact O-N 3.33Å; D197-G199 PolarHBondContact OD1-N 2.87Å
200	F	93.6	Very high	96.7	Very high	104 Å²	104	49.8 Å²	49.8	46%	0.456	27%	0.269	S	S	.	.			trans	-87.1	-25.4	-176.4	-60.5	-32.6	0	0	0	113.8	W166 S198 S204 N228 S229	W166-F200 WeakPolarHBondContact CH2-O 3.47Å; S198-F200 WeakPolarHBondContact O-CD1 3.41Å; F200-S204 PolarHBondContact N-OG 2.83Å; F200-N228 WeakPolarHBondContact CB-OD1 3.4Å; F200-N228 VanDerWaalsContact O-CA 3.32Å; F200-N228 WeakPolarHBondContact O-CA 3.41Å; F200-S229 PolarHBondContact O-N 2.78Å
201	T	96.4	Very high	96.6	Very high	24 Å²	24	52 Å²	52	15%	0.147	29%	0.289	C	S	.	.	S	Bend	trans	-125.4	159.8	-171.9	71.1	0	0	0	0	111.8	S203 S204 A227 S229	T201-S203 PolarHBondContact O-N 2.85Å; T201-S204 PolarHBondContact N-OG 3.32Å; T201-S204 WeakPolarHBondContact O-CB 3.24Å; T201-S204 PolarHBondContact O-N 2.93Å; T201-S204 PolarHBondContact O-OG 3.27Å; T201-S204 PolarHBondContact OG1-N 3.27Å; T201-S204 PolarHBondContact OG1-OG 2.93Å; T201-A227 WeakPolarHBondContact CG2-O 3.37Å; T201-S229 VanDerWaalsContact CA-OG 3.24Å; T201-S229 WeakPolarHBondContact CA-OG 3.2Å
202	F	97	Very high	96.5	Very high	5 Å²	5	55 Å²	55	2%	0.022	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-46.9	-35.9	175.6	-65.4	-61.6	0	0	0	114.1	W56 Q64 P66 L160 P162 S163 W166 S229 F230	W56-F202 AromaticContact CE2-CZ 3.92Å; W56-F202 AromaticContact CH2-CD1 3.89Å; W56-F202 HydrophobicContact CH2-CD1 3.89Å; W56-F202 AromaticContact CH2-CE1 3.89Å; W56-F202 HydrophobicContact CH2-CE1 3.89Å; W56-F202 HydrophobicContact CH2-CZ 4.46Å; W56-F202 AromaticContact CZ2-CD1 3.64Å; W56-F202 HydrophobicContact CZ2-CD1 3.64Å; W56-F202 HydrophobicContact CZ2-CD2 4.25Å; W56-F202 AromaticContact CZ2-CE1 3.29Å; W56-F202 HydrophobicContact CZ2-CE1 3.29Å; W56-F202 AromaticContact CZ2-CE2 3.91Å; W56-F202 HydrophobicContact CZ2-CE2 3.91Å; W56-F202 HydrophobicContact CZ2-CG 4.14Å; W56-F202 AromaticContact CZ2-CZ 3.45Å; W56-F202 HydrophobicContact CZ2-CZ 3.45Å; W56-F202 VanDerWaalsContact CZ2-CZ 3.45Å; W56-F202 AromaticContact NE1-CZ 3.9Å; Q64-F202 HydrophobicContact CB-CD2 4.34Å; Q64-F202 WeakPolarHBondContact O-CD2 3.46Å; P66-F202 HydrophobicContact CG-CB 3.65Å; P66-F202 HydrophobicContact CG-CD1 4.44Å; P66-F202 HydrophobicContact CG-CD2 3.74Å; P66-F202 HydrophobicContact CG-CG 3.71Å; L160-F202 HydrophobicContact CD2-CE1 4.28Å; P162-F202 CarbonylContact C-O 3.59Å; P162-F202 WeakPolarHBondContact CB-O 3.34Å; P162-F202 HydrophobicContact CG-CB 4.3Å; P162-F202 WeakPolarHBondContact O-CB 3.29Å; P162-F202 WeakPolarHBondContact O-CD1 3.31Å; S163-F202 VanDerWaalsContact CA-O 3.31Å; S163-F202 WeakPolarHBondContact CA-O 3.38Å; S163-F202 PolarHBondContact N-O 2.84Å; W166-F202 AromaticContact CE3-CD1 3.71Å; W166-F202 HydrophobicContact CE3-CD1 3.71Å; W166-F202 AromaticContact CE3-CE1 3.74Å; W166-F202 HydrophobicContact CE3-CE1 3.74Å; W166-F202 AromaticContact CZ3-CD1 3.36Å; W166-F202 HydrophobicContact CZ3-CD1 3.36Å; W166-F202 AromaticContact CZ3-CE1 3.49Å; W166-F202 HydrophobicContact CZ3-CE1 3.49Å; W166-F202 VanDerWaalsContact CZ3-CE1 3.49Å; W166-F202 AromaticContact CZ3-CG 3.99Å; W166-F202 HydrophobicContact CZ3-CG 3.99Å; W166-F202 HydrophobicContact CZ3-CZ 4.26Å; F202-S229 WeakPolarHBondContact CD2-OG 3.3Å; F202-S229 PolarHBondContact N-OG 2.98Å; F202-S229 VanDerWaalsContact N-OG 3.16Å; F202-F230 HydrophobicContact CE1-CE1 4.48Å; F202-F230 AromaticContact CE1-CE2 3.63Å; F202-F230 HydrophobicContact CE1-CE2 3.63Å; F202-F230 AromaticContact CE1-CZ 3.57Å; F202-F230 HydrophobicContact CE1-CZ 3.57Å; F202-F230 HydrophobicContact CZ-CE1 4.01Å; F202-F230 AromaticContact CZ-CE2 3.84Å; F202-F230 HydrophobicContact CZ-CE2 3.84Å; F202-F230 AromaticContact CZ-CZ 3.53Å; F202-F230 HydrophobicContact CZ-CZ 3.53Å
203	S	94.6	Very high	96.5	Very high	99 Å²	99	57.7 Å²	57.7	69%	0.692	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.9	20.1	-176.3	58.4	0	0	0	0	113.8	T201	T201-S203 PolarHBondContact O-N 2.85Å
204	S	95.8	Very high	96.5	Very high	33 Å²	33	60.7 Å²	60.7	23%	0.231	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-61.1	144	174.3	-72.3	0	0	0	0	110.9	F200 T201	F200-S204 PolarHBondContact N-OG 2.83Å; T201-S204 PolarHBondContact N-OG 3.32Å; T201-S204 WeakPolarHBondContact O-CB 3.24Å; T201-S204 PolarHBondContact O-N 2.93Å; T201-S204 PolarHBondContact O-OG 3.27Å; T201-S204 PolarHBondContact OG1-N 3.27Å; T201-S204 PolarHBondContact OG1-OG 2.93Å
205	P	95.3	Very high	96.5	Very high	110 Å²	110	60.7 Å²	60.7	71%	0.714	33%	0.329	S	S	*	.	P	Polyproline II helix	trans	-63.6	155	169.1	30.4	-34.6	0	0	0	109.7	F207	P205-F207 PolarHBondContact O-N 2.94Å
206	N	94	Very high	96.5	Very high	112 Å²	112	63 Å²	63	60%	0.599	34%	0.343	S	S	*	.	P	Polyproline II helix	trans	-56.7	127.6	177.2	177.5	-11.6	0	0	0	110.6	D197 E208	D197-N206 VanDerWaalsContact OD2-CA 3.24Å; D197-N206 WeakPolarHBondContact OD2-CA 3.46Å; D197-N206 PolarHBondContact OD2-OD1 2.67Å; N206-E208 PolarHBondContact OD1-N 2.76Å
207	F	95.4	Very high	96.5	Very high	137 Å²	137	66.5 Å²	66.5	60%	0.601	36%	0.359	S	S	*	.			trans	-139.9	91.7	175	-176	-125.8	0	0	0	110.4	D197 S198 P205 T209	D197-F207 CarbonylContact C-O 3.56Å; D197-F207 PolarHBondContact OD1-N 2.95Å; D197-F207 PolarHBondContact OD2-N 2.8Å; S198-F207 VanDerWaalsContact CB-CD1 3.42Å; S198-F207 PolarHBondContact N-O 2.82Å; P205-F207 PolarHBondContact O-N 2.94Å; F207-T209 PolarHBondContact O-N 3.23Å
208	E	96.1	Very high	96.5	Very high	88 Å²	88	66.4 Å²	66.4	41%	0.411	36%	0.359	S	S	.	.	B	Isolated β-bridge	trans	-53.2	131.1	-175.7	-171.6	170.8	-147.6	0	0	113.5	R100 N206 I210	R100-E208 IonicContact CZ-OE1 3.17Å; R100-E208 VanDerWaalsContact CZ-OE1 3.29Å; R100-E208 IonicContact NH1-OE1 3.62Å; R100-E208 PolarHBondContact NH1-OE1 3.49Å; R100-E208 IonicContact NH2-OE1 3.26Å; R100-E208 PolarHBondContact NH2-OE1 3.39Å; N206-E208 PolarHBondContact OD1-N 2.76Å; E208-I210 HydrophobicContact CB-CG1 4.43Å; E208-I210 HydrophobicContact CG-CD1 4.21Å; E208-I210 HydrophobicContact CG-CG1 3.91Å; E208-I210 PolarHBondContact O-N 2.72Å
209	T	96.5	Very high	96.6	Very high	12 Å²	12	66.6 Å²	66.6	7%	0.074	36%	0.358	C	S	.	.			trans	-78.9	114.2	176.3	-57.2	0	0	0	0	110	G195 T196 D197 S198 F207 P211 Q212 D213	G195-T209 WeakPolarHBondContact O-CB 3.49Å; T196-T209 PolarHBondContact O-N 2.89Å; D197-T209 WeakPolarHBondContact CA-OG1 3.33Å; D197-T209 PolarHBondContact N-OG1 2.73Å; S198-T209 PolarHBondContact N-OG1 2.95Å; S198-T209 VanDerWaalsContact N-OG1 3.11Å; S198-T209 PolarHBondContact OG-OG1 3.37Å; F207-T209 PolarHBondContact O-N 3.23Å; T209-P211 CarbonylContact C-O 3.58Å; T209-P211 WeakPolarHBondContact CG2-O 3.27Å; T209-P211 CarbonylContact O-C 3.46Å; T209-Q212 PolarHBondContact O-N 3.39Å; T209-D213 HydrophobicContact CG2-CB 4.07Å; T209-D213 WeakPolarHBondContact CG2-OD2 3.48Å
210	I	95.6	Very high	96.6	Very high	137 Å²	137	66.3 Å²	66.3	70%	0.703	36%	0.355	S	S	*	.	S	Bend	trans	-130.6	118.5	-177.3	-55.7	178.4	0	0	0	110.2	E208	E208-I210 HydrophobicContact CB-CG1 4.43Å; E208-I210 HydrophobicContact CG-CD1 4.21Å; E208-I210 HydrophobicContact CG-CG1 3.91Å; E208-I210 PolarHBondContact O-N 2.72Å
211	P	96.7	Very high	96.7	Very high	105 Å²	105	64.7 Å²	64.7	68%	0.682	36%	0.357	S	S	*	.	S	Bend	cis	-65.6	157.7	-6.6	31.6	-36.1	0	0	0	111.5	T209 D213	T209-P211 CarbonylContact C-O 3.58Å; T209-P211 WeakPolarHBondContact CG2-O 3.27Å; T209-P211 CarbonylContact O-C 3.46Å; P211-D213 PolarHBondContact O-N 2.87Å
212	Q	97.6	Very high	96.7	Very high	64 Å²	64	68.9 Å²	68.9	30%	0.299	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-54.4	135.1	174.9	-176	-177.3	-8.7	0	0	110	F94 A95 G195 T196 T209	F94-Q212 HydrophobicContact CD1-CG 4.32Å; F94-Q212 VanDerWaalsContact CE1-O 3.3Å; F94-Q212 WeakPolarHBondContact CE1-O 3.34Å; A95-Q212 PolarHBondContact O-NE2 3.28Å; G195-Q212 WeakPolarHBondContact O-CG 3.46Å; T196-Q212 HydrophobicContact CG2-CG 4.05Å; T209-Q212 PolarHBondContact O-N 3.39Å
213	D	97.9	Very high	96.6	Very high	95 Å²	95	70.6 Å²	70.6	51%	0.508	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-91.9	169	175.3	-79.9	-34.2	0	0	0	111.3	G195 T209 P211	G195-D213 PolarHBondContact O-N 3.07Å; T209-D213 HydrophobicContact CG2-CB 4.07Å; T209-D213 WeakPolarHBondContact CG2-OD2 3.48Å; P211-D213 PolarHBondContact O-N 2.87Å
214	R	98.4	Very high	96.5	Very high	90 Å²	90	69.8 Å²	69.8	34%	0.34	38%	0.379	S	S	.	.	B	Isolated β-bridge	trans	-81.3	154.5	176.8	-68.2	168.8	175.9	-77.9	-6.8	110.3	N92 E93 F94 T216	N92-R214 VanDerWaalsContact O-CD 3.27Å; N92-R214 WeakPolarHBondContact O-CD 3.39Å; N92-R214 PolarHBondContact O-NH1 3.48Å; N92-R214 WeakPolarHBondContact OD1-CD 3.4Å; E93-R214 WeakPolarHBondContact O-CA 3.5Å; E93-R214 IonicContact OE1-NH1 3.7Å; E93-R214 IonicContact OE2-NH1 2.9Å; E93-R214 PolarHBondContact OE2-NH1 2.83Å; F94-R214 HydrophobicContact CD1-CG 4.11Å; F94-R214 HydrophobicContact CE1-CG 3.87Å; F94-R214 HydrophobicContact CE2-CG 4.46Å; F94-R214 HydrophobicContact CZ-CG 4.07Å; R214-T216 WeakPolarHBondContact O-CG2 3.4Å; R214-T216 PolarHBondContact O-N 2.95Å
215	I	98.6	Very high	96.4	Very high	1 Å²	1	72.7 Å²	72.7	1%	0.005	39%	0.389	C	S	.	.	P	Polyproline II helix	trans	-60.1	121.6	173.6	-64.9	169.1	0	0	0	109	W89 Q90 N92 E93 A95 V99 F167 Y192 D193	W89-I215 HydrophobicContact CB-CD1 3.94Å; W89-I215 HydrophobicContact CE3-CD1 4.4Å; W89-I215 HydrophobicContact CE3-CG2 4.08Å; W89-I215 HydrophobicContact CZ3-CG2 4.25Å; Q90-I215 WeakPolarHBondContact O-CB 3.47Å; N92-I215 WeakPolarHBondContact CA-O 3.48Å; N92-I215 PolarHBondContact N-O 2.81Å; E93-I215 WeakPolarHBondContact O-CG1 3.3Å; E93-I215 PolarHBondContact O-N 2.96Å; A95-I215 HydrophobicContact CB-CD1 4.18Å; A95-I215 HydrophobicContact CB-CG1 4.22Å; V99-I215 HydrophobicContact CG1-CD1 4.49Å; F167-I215 HydrophobicContact CE1-CG2 4.27Å; F167-I215 HydrophobicContact CZ-CG2 3.86Å; Y192-I215 HydrophobicContact CD1-CG2 3.94Å; D193-I215 CarbonylContact O-C 3.56Å; D193-I215 VanDerWaalsContact O-CA 3.26Å; D193-I215 WeakPolarHBondContact O-CA 3.26Å
216	T	98.3	Very high	96.2	Very high	49 Å²	49	71.9 Å²	71.9	30%	0.301	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	144.6	-178.2	54.2	0	0	0	0	111.7	Y192 D193 R214 I218	Y192-T216 CarbonylContact C-O 3.01Å; Y192-T216 WeakPolarHBondContact CA-O 3.32Å; D193-T216 PolarHBondContact N-O 2.93Å; D193-T216 PolarHBondContact O-N 2.83Å; R214-T216 WeakPolarHBondContact O-CG2 3.4Å; R214-T216 PolarHBondContact O-N 2.95Å; T216-I218 PolarHBondContact O-N 3.22Å
217	Q	98.1	Very high	96.2	Very high	75 Å²	75	68.1 Å²	68.1	35%	0.35	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	128.8	174.1	-169	178.6	34.8	0	0	109.6	Y192	Y192-Q217 HydrophobicContact CD1-CB 3.99Å; Y192-Q217 HydrophobicContact CD1-CG 4.47Å; Y192-Q217 HydrophobicContact CE1-CB 3.62Å; Y192-Q217 HydrophobicContact CE1-CG 4.06Å; Y192-Q217 HydrophobicContact CE2-CG 4.36Å
218	I	98.4	Very high	96.3	Very high	6 Å²	6	62.1 Å²	62.1	3%	0.031	34%	0.342	C	S	.	.			trans	-81.3	129.3	172.8	-61.2	168.7	0	0	0	108.4	W166 P191 D193 T216 F230	W166-I218 HydrophobicContact CB-CD1 4.35Å; W166-I218 HydrophobicContact CD2-CD1 4.01Å; W166-I218 HydrophobicContact CG-CD1 3.75Å; P191-I218 HydrophobicContact CB-CB 4.19Å; P191-I218 HydrophobicContact CB-CD1 4.28Å; P191-I218 HydrophobicContact CG-CB 3.99Å; P191-I218 HydrophobicContact CG-CG2 4.25Å; P191-I218 WeakPolarHBondContact O-CB 3.31Å; P191-I218 PolarHBondContact O-N 3Å; D193-I218 HydrophobicContact CB-CD1 3.96Å; D193-I218 HydrophobicContact CB-CG1 3.9Å; T216-I218 PolarHBondContact O-N 3.22Å; I218-F230 HydrophobicContact CD1-CD2 4.38Å; I218-F230 HydrophobicContact CG2-CB 3.44Å; I218-F230 VanDerWaalsContact CG2-CB 3.44Å; I218-F230 HydrophobicContact CG2-CD2 3.78Å; I218-F230 HydrophobicContact CG2-CG 3.88Å
219	T	98	Very high	96.3	Very high	44 Å²	44	57.9 Å²	57.9	27%	0.27	32%	0.323	S	S	.	.			trans	-124.2	176.6	-178.5	69.2	0	0	0	0	110.7	S221 F222	T219-S221 PolarHBondContact O-N 2.82Å; T219-S221 PolarHBondContact OG1-N 2.85Å; T219-F222 PolarHBondContact N-O 3.3Å; T219-F222 VanDerWaalsContact O-O 3.14Å; T219-F222 WeakPolarHBondContact OG1-CB 3.24Å; T219-F222 PolarHBondContact OG1-N 2.78Å; T219-F222 PolarHBondContact OG1-O 3.06Å
220	S	97.1	Very high	96.4	Very high	2 Å²	2	57.5 Å²	57.5	1%	0.014	32%	0.32	C	S	.	.	S	Bend	trans	-67.7	-19.6	178.3	55.9	0	0	0	0	113	F230 F231 Y232 L235 K236	S220-F230 WeakPolarHBondContact CA-O 3.4Å; S220-F231 WeakPolarHBondContact O-CD2 3.42Å; S220-Y232 CarbonylContact O-C 3.59Å; S220-Y232 PolarHBondContact O-N 3.22Å; S220-L235 WeakPolarHBondContact CB-O 3.35Å; S220-L235 PolarHBondContact OG-O 3.07Å; S220-K236 PolarHBondContact OG-O 2.98Å
221	S	95.2	Very high	96.5	Very high	71 Å²	71	52.7 Å²	52.7	50%	0.497	29%	0.294	S	S	.	.	S	Bend	trans	-115.3	-13.2	-176.8	56.5	0	0	0	0	114.2	T219 S224	T219-S221 PolarHBondContact O-N 2.82Å; T219-S221 PolarHBondContact OG1-N 2.85Å; S221-S224 WeakPolarHBondContact O-CA 3.43Å; S221-S224 VanDerWaalsContact O-CB 3.27Å; S221-S224 WeakPolarHBondContact O-CB 3.31Å
222	F	95.5	Very high	96.5	Very high	111 Å²	111	48.6 Å²	48.6	49%	0.487	27%	0.265	S	S	.	.	S	Bend	trans	-136.6	129.7	-179.9	-177.5	-93.8	0	0	0	111.5	T219	T219-F222 PolarHBondContact N-O 3.3Å; T219-F222 VanDerWaalsContact O-O 3.14Å; T219-F222 WeakPolarHBondContact OG1-CB 3.24Å; T219-F222 PolarHBondContact OG1-N 2.78Å; T219-F222 PolarHBondContact OG1-O 3.06Å
223	P	94.8	Very high	96.3	Very high	42 Å²	42	50.1 Å²	50.1	27%	0.273	28%	0.28	S	S	.	.	S	Bend	cis	-69	144	-3	25	-30.7	0	0	0	112.5	H225 N228	P223-H225 PolarHBondContact O-N 3.41Å; P223-N228 VanDerWaalsContact CB-ND2 3.25Å; P223-N228 WeakPolarHBondContact CB-ND2 3.48Å; P223-N228 VanDerWaalsContact CG-ND2 3.29Å; P223-N228 WeakPolarHBondContact CG-ND2 3.26Å; P223-N228 PolarHBondContact O-ND2 3.26Å
224	S	93.1	Very high	96.1	Very high	82 Å²	82	54.3 Å²	54.3	57%	0.573	29%	0.289	S	S	*	.			trans	-89.8	11	-164.6	67.4	0	0	0	0	115.6	S221	S221-S224 WeakPolarHBondContact O-CA 3.43Å; S221-S224 VanDerWaalsContact O-CB 3.27Å; S221-S224 WeakPolarHBondContact O-CB 3.31Å
225	H	93.1	Very high	95.9	Very high	93 Å²	93	53.3 Å²	53.3	43%	0.431	29%	0.29	S	S	.	.			trans	-73.8	135.4	-179.3	-173.2	-93.7	0	0	0	110.5	P223 A227 N228	P223-H225 PolarHBondContact O-N 3.41Å; H225-A227 VanDerWaalsContact ND1-CB 3.33Å; H225-A227 WeakPolarHBondContact ND1-CB 3.36Å; H225-A227 PolarHBondContact ND1-N 2.72Å; H225-A227 VanDerWaalsContact ND1-N 3.19Å; H225-A227 PolarHBondContact O-N 3.4Å; H225-A227 VanDerWaalsContact O-N 3.08Å; H225-N228 WeakPolarHBondContact CB-ND2 3.3Å; H225-N228 PolarHBondContact N-ND2 3.01Å; H225-N228 VanDerWaalsContact N-ND2 3.17Å; H225-N228 VanDerWaalsContact O-CB 3.31Å; H225-N228 WeakPolarHBondContact O-CB 3.34Å; H225-N228 PolarHBondContact O-N 3.39Å; H225-N228 PolarHBondContact O-ND2 3Å
226	P	92.8	Very high	95.7	Very high	93 Å²	93	62.3 Å²	62.3	60%	0.604	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-30.1	-176.5	-28.6	35.9	0	0	0	114.9	K63 N228	K63-P226 PolarHBondContact NZ-O 3.16Å; P226-N228 VanDerWaalsContact C-N 3.31Å
227	A	93	Very high	95.5	Very high	34 Å²	34	67.3 Å²	67.3	28%	0.281	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-16.7	178.5	0	0	0	0	0	113.8	Q64 T201 H225 S229	Q64-A227 PolarHBondContact NE2-O 3.13Å; Q64-A227 PolarHBondContact OE1-O 2.81Å; T201-A227 WeakPolarHBondContact CG2-O 3.37Å; H225-A227 VanDerWaalsContact ND1-CB 3.33Å; H225-A227 WeakPolarHBondContact ND1-CB 3.36Å; H225-A227 PolarHBondContact ND1-N 2.72Å; H225-A227 VanDerWaalsContact ND1-N 3.19Å; H225-A227 PolarHBondContact O-N 3.4Å; H225-A227 VanDerWaalsContact O-N 3.08Å; A227-S229 PolarHBondContact O-N 3.25Å
228	N	96.8	Very high	95.4	Very high	10 Å²	10	64.2 Å²	64.2	5%	0.053	34%	0.335	C	S	.	.			trans	-62.1	132.1	-174.4	-70.5	-21.2	0	0	0	111.6	K63 F200 P223 H225 P226 F230 F231	K63-N228 WeakPolarHBondContact CE-O 3.44Å; K63-N228 PolarHBondContact NZ-O 2.88Å; F200-N228 WeakPolarHBondContact CB-OD1 3.4Å; F200-N228 VanDerWaalsContact O-CA 3.32Å; F200-N228 WeakPolarHBondContact O-CA 3.41Å; P223-N228 VanDerWaalsContact CB-ND2 3.25Å; P223-N228 WeakPolarHBondContact CB-ND2 3.48Å; P223-N228 VanDerWaalsContact CG-ND2 3.29Å; P223-N228 WeakPolarHBondContact CG-ND2 3.26Å; P223-N228 PolarHBondContact O-ND2 3.26Å; H225-N228 WeakPolarHBondContact CB-ND2 3.3Å; H225-N228 PolarHBondContact N-ND2 3.01Å; H225-N228 VanDerWaalsContact N-ND2 3.17Å; H225-N228 VanDerWaalsContact O-CB 3.31Å; H225-N228 WeakPolarHBondContact O-CB 3.34Å; H225-N228 PolarHBondContact O-N 3.39Å; H225-N228 PolarHBondContact O-ND2 3Å; P226-N228 VanDerWaalsContact C-N 3.31Å; N228-F230 PolarHBondContact O-N 3.45Å; N228-F231 HydrophobicContact CB-CB 3.86Å; N228-F231 WeakPolarHBondContact O-CB 3.29Å; N228-F231 PolarHBondContact O-N 3.04Å
229	S	97.5	Very high	95.4	Very high	0 Å²	0	66.1 Å²	66.1	0%	0	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-31.5	-173.3	-63.9	0	0	0	0	113.7	Q64 F200 T201 F202 A227	Q64-S229 PolarHBondContact OE1-OG 3.2Å; F200-S229 PolarHBondContact O-N 2.78Å; T201-S229 VanDerWaalsContact CA-OG 3.24Å; T201-S229 WeakPolarHBondContact CA-OG 3.2Å; F202-S229 WeakPolarHBondContact CD2-OG 3.3Å; F202-S229 PolarHBondContact N-OG 2.98Å; F202-S229 VanDerWaalsContact N-OG 3.16Å; A227-S229 PolarHBondContact O-N 3.25Å
230	F	97.8	Very high	95.4	Very high	4 Å²	4	65.3 Å²	65.3	2%	0.018	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	8.3	177.6	-67.9	-67.4	0	0	0	114.6	F61 L160 W166 P191 F202 I218 S220 N228 Y232 L238 I241	F61-F230 HydrophobicContact CD1-CD1 4Å; F61-F230 AromaticContact CD1-CE1 3.76Å; F61-F230 HydrophobicContact CD1-CE1 3.76Å; F61-F230 HydrophobicContact CE1-CD1 4.21Å; F61-F230 AromaticContact CE1-CE1 3.98Å; F61-F230 HydrophobicContact CE1-CE1 3.98Å; L160-F230 HydrophobicContact CD2-CE2 3.9Å; L160-F230 HydrophobicContact CD2-CZ 3.66Å; W166-F230 HydrophobicContact CD2-CE2 4.42Å; W166-F230 HydrophobicContact CE3-CD2 4.14Å; W166-F230 AromaticContact CE3-CE2 3.65Å; W166-F230 HydrophobicContact CE3-CE2 3.65Å; W166-F230 HydrophobicContact CZ3-CD2 4.08Å; W166-F230 AromaticContact CZ3-CE2 3.88Å; W166-F230 HydrophobicContact CZ3-CE2 3.88Å; P191-F230 HydrophobicContact CB-CD2 4.45Å; P191-F230 HydrophobicContact CB-CE2 4.03Å; P191-F230 HydrophobicContact CB-CZ 4.24Å; P191-F230 HydrophobicContact CG-CD1 4.35Å; P191-F230 HydrophobicContact CG-CD2 4.25Å; P191-F230 HydrophobicContact CG-CE1 4.28Å; P191-F230 HydrophobicContact CG-CE2 4.15Å; P191-F230 HydrophobicContact CG-CG 4.34Å; P191-F230 HydrophobicContact CG-CZ 4.17Å; F202-F230 HydrophobicContact CE1-CE1 4.48Å; F202-F230 AromaticContact CE1-CE2 3.63Å; F202-F230 HydrophobicContact CE1-CE2 3.63Å; F202-F230 AromaticContact CE1-CZ 3.57Å; F202-F230 HydrophobicContact CE1-CZ 3.57Å; F202-F230 HydrophobicContact CZ-CE1 4.01Å; F202-F230 AromaticContact CZ-CE2 3.84Å; F202-F230 HydrophobicContact CZ-CE2 3.84Å; F202-F230 AromaticContact CZ-CZ 3.53Å; F202-F230 HydrophobicContact CZ-CZ 3.53Å; I218-F230 HydrophobicContact CD1-CD2 4.38Å; I218-F230 HydrophobicContact CG2-CB 3.44Å; I218-F230 VanDerWaalsContact CG2-CB 3.44Å; I218-F230 HydrophobicContact CG2-CD2 3.78Å; I218-F230 HydrophobicContact CG2-CG 3.88Å; S220-F230 WeakPolarHBondContact CA-O 3.4Å; N228-F230 PolarHBondContact O-N 3.45Å; F230-Y232 VanDerWaalsContact O-CD2 3.26Å; F230-Y232 WeakPolarHBondContact O-CD2 3.43Å; F230-Y232 PolarHBondContact O-N 2.94Å; F230-L238 HydrophobicContact CB-CD1 4.1Å; F230-L238 HydrophobicContact CD1-CD1 4.16Å; F230-L238 HydrophobicContact CG-CD1 4.36Å; F230-I241 HydrophobicContact CE1-CD1 3.77Å; F230-I241 HydrophobicContact CZ-CD1 3.61Å
231	F	97.6	Very high	95.4	Very high	36 Å²	36	65.2 Å²	65.2	16%	0.158	34%	0.342	C	S	.	.			trans	-81.6	103.5	176.4	-178	-111	0	0	0	111.3	K63 S220 N228 P233	K63-F231 PolarHBondContact NZ-O 2.86Å; S220-F231 WeakPolarHBondContact O-CD2 3.42Å; N228-F231 HydrophobicContact CB-CB 3.86Å; N228-F231 WeakPolarHBondContact O-CB 3.29Å; N228-F231 PolarHBondContact O-N 3.04Å; F231-P233 HydrophobicContact CE1-CB 4.16Å; F231-P233 HydrophobicContact CE1-CG 3.95Å; F231-P233 HydrophobicContact CE2-CB 4.41Å; F231-P233 HydrophobicContact CZ-CB 3.88Å; F231-P233 HydrophobicContact CZ-CG 4.2Å
232	Y	96.6	Very high	95.6	Very high	19 Å²	19	61.9 Å²	61.9	8%	0.075	32%	0.319	C	S	.	.			trans	-122.3	81.5	179	-66.4	-90	0	0	0	109.7	F61 P62 K63 S220 F230 R234 L235 L238	F61-Y232 VanDerWaalsContact C-OH 3.32Å; F61-Y232 WeakPolarHBondContact CA-OH 3.3Å; F61-Y232 HydrophobicContact CD1-CE2 4.44Å; P62-Y232 HydrophobicContact CG-CE1 4.32Å; K63-Y232 HydrophobicContact CB-CE1 3.71Å; K63-Y232 HydrophobicContact CB-CE2 4.44Å; K63-Y232 WeakPolarHBondContact CB-OH 3.17Å; K63-Y232 PolarHBondContact N-OH 2.69Å; K63-Y232 VanDerWaalsContact N-OH 3.08Å; S220-Y232 CarbonylContact O-C 3.59Å; S220-Y232 PolarHBondContact O-N 3.22Å; F230-Y232 VanDerWaalsContact O-CD2 3.26Å; F230-Y232 WeakPolarHBondContact O-CD2 3.43Å; F230-Y232 PolarHBondContact O-N 2.94Å; Y232-R234 PolarHBondContact O-N 2.88Å; Y232-L235 HydrophobicContact CD1-CD1 4.25Å; Y232-L235 HydrophobicContact CG-CD1 3.97Å; Y232-L235 PolarHBondContact O-N 3.37Å; Y232-L238 HydrophobicContact CD2-CD2 3.59Å; Y232-L238 HydrophobicContact CE2-CD2 4.11Å
233	P	94.1	Very high	95.7	Very high	95 Å²	95	59.7 Å²	59.7	62%	0.617	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-17	-169.6	24.9	-35.3	0	0	0	114.7	F231	F231-P233 HydrophobicContact CE1-CB 4.16Å; F231-P233 HydrophobicContact CE1-CG 3.95Å; F231-P233 HydrophobicContact CE2-CB 4.41Å; F231-P233 HydrophobicContact CZ-CB 3.88Å; F231-P233 HydrophobicContact CZ-CG 4.2Å
234	R	94.5	Very high	95.9	Very high	184 Å²	184	57.7 Å²	57.7	69%	0.694	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-15.2	176.3	-61	-173.6	-173.2	156.5	10.5	113.2	Y232 E286	Y232-R234 PolarHBondContact O-N 2.88Å; R234-E286 IonicContact CZ-OE1 3.02Å; R234-E286 IonicContact NH1-OE1 3.89Å; R234-E286 PolarHBondContact NH1-OE1 2.97Å; R234-E286 IonicContact NH2-OE1 3.29Å; R234-E286 PolarHBondContact NH2-OE1 3.03Å; R234-E286 IonicContact NH2-OE2 2.72Å
235	L	93.4	Very high	96.1	Very high	69 Å²	69	54.6 Å²	54.6	36%	0.361	27%	0.274	S	S	.	.			trans	-92.9	131.6	177.7	-64	-177.4	0	0	0	110	S220 Y232	S220-L235 WeakPolarHBondContact CB-O 3.35Å; S220-L235 PolarHBondContact OG-O 3.07Å; Y232-L235 HydrophobicContact CD1-CD1 4.25Å; Y232-L235 HydrophobicContact CG-CD1 3.97Å; Y232-L235 PolarHBondContact O-N 3.37Å
236	K	93.3	Very high	96.4	Very high	190 Å²	190	50.2 Å²	50.2	83%	0.826	25%	0.254	S	S	*	.	S	Bend	trans	-64.9	-41.4	173.2	-69.3	-174.1	179.1	-178.1	0	111.8	S220	S220-K236 PolarHBondContact OG-O 2.98Å
237	H	94.4	Very high	96.6	Very high	153 Å²	153	48.5 Å²	48.5	71%	0.708	24%	0.241	S	C	*	.	S	Bend	trans	-142.9	153.6	178.4	-56	-68	0	0	0	109.2
238	L	96.9	Very high	96.7	Very high	11 Å²	11	49.9 Å²	49.9	6%	0.058	24%	0.241	C	C	.	.	P	Polyproline II helix	trans	-67.8	146.3	170.4	-66.1	174.4	0	0	0	109.7	F61 F190 P191 F230 Y232	F61-L238 HydrophobicContact CE1-CD2 4.45Å; F190-L238 WeakPolarHBondContact CE1-O 3.39Å; P191-L238 HydrophobicContact CG-CD1 4.04Å; F230-L238 HydrophobicContact CB-CD1 4.1Å; F230-L238 HydrophobicContact CD1-CD1 4.16Å; F230-L238 HydrophobicContact CG-CD1 4.36Å; Y232-L238 HydrophobicContact CD2-CD2 3.59Å; Y232-L238 HydrophobicContact CE2-CD2 4.11Å
239	P	97.6	Very high	96.5	Very high	46 Å²	46	52.6 Å²	52.6	30%	0.299	26%	0.255	S	S	.	.	P	Polyproline II helix	trans	-64.4	157.9	162.8	28.6	-31.5	0	0	0	109.8	A60 F61 I241	A60-P239 HydrophobicContact CB-CG 4.4Å; F61-P239 HydrophobicContact CE1-CG 3.99Å; F61-P239 HydrophobicContact CE2-CG 4.18Å; F61-P239 HydrophobicContact CZ-CG 3.72Å; F61-P239 VanDerWaalsContact CZ-O 3.32Å; F61-P239 WeakPolarHBondContact CZ-O 3.41Å; P239-I241 PolarHBondContact O-N 3.08Å
240	P	98.3	Very high	96	Very high	27 Å²	27	60.1 Å²	60.1	18%	0.175	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-59	126.6	173.1	-24	33.6	0	0	0	111.3	E188 F190	E188-P240 HydrophobicContact CB-CB 3.98Å; E188-P240 HydrophobicContact CB-CG 3.95Å; E188-P240 HydrophobicContact CG-CB 4.4Å; E188-P240 HydrophobicContact CG-CG 4.11Å; E188-P240 WeakPolarHBondContact OE1-CG 3.14Å; E188-P240 WeakPolarHBondContact OE2-CG 3.33Å; F190-P240 HydrophobicContact CE1-CB 4.49Å; F190-P240 HydrophobicContact CE1-CG 4.28Å; F190-P240 HydrophobicContact CZ-CG 4.13Å
241	I	98.4	Very high	94.5	Very high	0 Å²	0	68.7 Å²	68.7	0%	0	33%	0.325	C	S	.	.	S	Bend	trans	-84.4	-20.3	179.7	-163.2	175.3	0	0	0	112.1	K55 W56 F61 W74 L160 V168 L189 F230 P239	K55-I241 CarbonylContact C-O 3.59Å; K55-I241 VanDerWaalsContact C-O 3.23Å; K55-I241 VanDerWaalsContact CA-O 3.26Å; K55-I241 WeakPolarHBondContact CA-O 3.3Å; K55-I241 WeakPolarHBondContact CB-O 3.23Å; K55-I241 PolarHBondContact N-O 3.41Å; W56-I241 HydrophobicContact CB-CD1 4.16Å; W56-I241 HydrophobicContact CB-CG1 3.71Å; W56-I241 HydrophobicContact CD2-CD1 4.33Å; W56-I241 HydrophobicContact CG-CD1 3.91Å; W56-I241 HydrophobicContact CG-CG1 3.98Å; W56-I241 PolarHBondContact N-O 2.85Å; W56-I241 VanDerWaalsContact N-O 3.13Å; F61-I241 HydrophobicContact CD2-CG1 4.35Å; F61-I241 HydrophobicContact CE1-CB 4.45Å; F61-I241 HydrophobicContact CE1-CG1 4.49Å; F61-I241 HydrophobicContact CE2-CB 3.97Å; F61-I241 HydrophobicContact CE2-CG1 3.74Å; F61-I241 HydrophobicContact CZ-CB 3.63Å; F61-I241 HydrophobicContact CZ-CD1 4.41Å; F61-I241 HydrophobicContact CZ-CG1 3.8Å; W74-I241 HydrophobicContact CH2-CD1 4.21Å; W74-I241 HydrophobicContact CH2-CG1 3.94Å; W74-I241 HydrophobicContact CH2-CG2 4.18Å; W74-I241 HydrophobicContact CZ2-CG1 4.29Å; W74-I241 WeakPolarHBondContact CZ2-O 3.48Å; L160-I241 HydrophobicContact CD2-CD1 3.73Å; L160-I241 HydrophobicContact CG-CD1 4.49Å; V168-I241 HydrophobicContact CG1-CG2 3.48Å; V168-I241 VanDerWaalsContact CG1-CG2 3.48Å; L189-I241 PolarHBondContact O-N 3.49Å; F230-I241 HydrophobicContact CE1-CD1 3.77Å; F230-I241 HydrophobicContact CZ-CD1 3.61Å; P239-I241 PolarHBondContact O-N 3.08Å
242	A	98.4	Very high	92.4	Very high	0 Å²	0	71.8 Å²	71.8	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	170.1	171.2	0	0	0	0	0	110.6	F52 T53 W74 L189	F52-A242 HydrophobicContact CD2-CB 4.5Å; F52-A242 HydrophobicContact CE1-CB 4.08Å; F52-A242 HydrophobicContact CE2-CB 3.58Å; F52-A242 HydrophobicContact CZ-CB 3.34Å; T53-A242 CarbonylContact O-C 3.2Å; T53-A242 VanDerWaalsContact O-CA 3.31Å; T53-A242 WeakPolarHBondContact O-CA 3.44Å; W74-A242 HydrophobicContact CH2-CB 4.05Å; W74-A242 HydrophobicContact CZ2-CB 4.21Å; L189-A242 HydrophobicContact CB-CB 4.05Å; L189-A242 HydrophobicContact CD1-CB 4.01Å; L189-A242 HydrophobicContact CG-CB 4.46Å; L189-A242 PolarHBondContact N-O 3.23Å; L189-A242 PolarHBondContact O-N 3.17Å
243	K	98.2	Very high	89.9	Confident	65 Å²	65	78.8 Å²	78.8	28%	0.283	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	137.9	173.8	-171.7	-175.3	79.6	176.7	0	108.8	T53 K55 T186 L187	T53-K243 PolarHBondContact N-O 3.07Å; T53-K243 PolarHBondContact O-N 3.28Å; K55-K243 HydrophobicContact CD-CB 4.49Å; T186-K243 HydrophobicContact CG2-CD 3.82Å; T186-K243 HydrophobicContact CG2-CG 4.01Å; L187-K243 WeakPolarHBondContact O-CA 3.43Å; L187-K243 WeakPolarHBondContact O-CG 3.33Å
244	V	98.3	Very high	87.6	Confident	1 Å²	1	81.8 Å²	81.8	1%	0.006	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	139.5	169.3	65.6	0	0	0	0	110	L50 T51 F156 V170 T186 L187 L189 L246	L50-V244 HydrophobicContact CD1-CG2 4.13Å; L50-V244 HydrophobicContact CD2-CG2 3.99Å; L50-V244 HydrophobicContact CG-CG2 3.74Å; T51-V244 CarbonylContact O-C 3.57Å; T51-V244 WeakPolarHBondContact O-CA 3.42Å; F156-V244 HydrophobicContact CE1-CB 4.35Å; F156-V244 HydrophobicContact CE1-CG1 4.06Å; F156-V244 HydrophobicContact CE1-CG2 4.05Å; F156-V244 HydrophobicContact CZ-CB 3.87Å; F156-V244 HydrophobicContact CZ-CG1 3.82Å; F156-V244 HydrophobicContact CZ-CG2 3.91Å; V170-V244 HydrophobicContact CG2-CG1 4.33Å; T186-V244 WeakPolarHBondContact CA-O 3.49Å; L187-V244 HydrophobicContact CB-CG1 3.73Å; L187-V244 HydrophobicContact CD1-CG1 4.32Å; L187-V244 HydrophobicContact CG-CG1 4.42Å; L187-V244 PolarHBondContact N-O 2.88Å; L187-V244 PolarHBondContact O-N 3.19Å; L189-V244 HydrophobicContact CD1-CB 4.27Å; L189-V244 HydrophobicContact CD1-CG1 4.38Å; L189-V244 HydrophobicContact CD2-CG1 4.07Å; L189-V244 HydrophobicContact CG-CG1 4.4Å; V244-L246 HydrophobicContact CG2-CD2 3.99Å
245	T	98.3	Very high	85	Confident	17 Å²	17	80.4 Å²	80.4	10%	0.104	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	123.7	173.4	-54.9	0	0	0	0	108.6	T51 K184 V185	T51-T245 PolarHBondContact N-O 3.04Å; T51-T245 PolarHBondContact O-N 3.21Å; K184-T245 HydrophobicContact CD-CG2 4.49Å; K184-T245 HydrophobicContact CG-CG2 4.24Å; V185-T245 CarbonylContact O-C 3.6Å; V185-T245 WeakPolarHBondContact O-CA 3.41Å
246	L	97.8	Very high	82.5	Confident	1 Å²	1	84.3 Å²	84.3	1%	0.005	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	121	175.6	-49.5	173.2	0	0	0	106.8	Y48 S49 L50 F145 L154 V173 L175 K184 V185 V244	Y48-L246 HydrophobicContact CD1-CB 4.43Å; S49-L246 CarbonylContact O-C 3.2Å; S49-L246 WeakPolarHBondContact O-CA 3.1Å; L50-L246 HydrophobicContact CB-CD2 3.77Å; L50-L246 HydrophobicContact CD1-CD2 3.66Å; L50-L246 HydrophobicContact CG-CD2 3.58Å; F145-L246 HydrophobicContact CE1-CD2 4.21Å; F145-L246 HydrophobicContact CZ-CD2 4.43Å; L154-L246 HydrophobicContact CD2-CD1 3.69Å; L154-L246 HydrophobicContact CD2-CD2 3.71Å; L154-L246 HydrophobicContact CD2-CG 4.38Å; V173-L246 HydrophobicContact CG1-CD1 3.88Å; L175-L246 HydrophobicContact CD2-CB 4.46Å; L175-L246 HydrophobicContact CD2-CD1 3.66Å; K184-L246 CarbonylContact C-O 3.23Å; K184-L246 VanDerWaalsContact CA-O 3.26Å; K184-L246 WeakPolarHBondContact CA-O 3.27Å; V185-L246 HydrophobicContact CB-CB 4.2Å; V185-L246 HydrophobicContact CB-CD1 4.29Å; V185-L246 PolarHBondContact N-O 3.31Å; V185-L246 PolarHBondContact O-N 3.26Å; V244-L246 HydrophobicContact CG2-CD2 3.99Å
247	T	97.3	Very high	79.7	Confident	56 Å²	56	80 Å²	80	34%	0.344	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	125.4	-177.5	-52.5	0	0	0	0	109.7	Y48 S49 I249	Y48-T247 WeakPolarHBondContact CA-O 3.23Å; S49-T247 PolarHBondContact N-O 3.04Å; S49-T247 PolarHBondContact O-N 3.16Å; T247-I249 PolarHBondContact O-N 2.81Å
248	K	95.5	Very high	77.2	Confident	64 Å²	64	80.6 Å²	80.6	28%	0.278	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	123.7	175.7	-171.4	-177.9	179.8	-173.2	0	109.7	Y48 W181 D183 K250	Y48-K248 HydrophobicContact CD1-CB 4.16Å; Y48-K248 HydrophobicContact CE1-CB 3.71Å; Y48-K248 HydrophobicContact CE1-CG 4.39Å; W181-K248 HydrophobicContact CB-CD 3.95Å; D183-K248 PolarHBondContact O-N 3.09Å; K248-K250 PolarHBondContact O-N 3.29Å
249	I	92.8	Very high	74.6	Confident	66 Å²	66	85.6 Å²	85.6	34%	0.338	45%	0.45	S	S	.	.	P	Polyproline II helix	trans	-77.2	121.9	177.8	-56.6	174	0	0	0	108.2	H47 E144 T247	H47-I249 HydrophobicContact CB-CB 4.23Å; H47-I249 HydrophobicContact CB-CD1 4.44Å; H47-I249 PolarHBondContact O-N 3.24Å; E144-I249 HydrophobicContact CG-CD1 4.18Å; T247-I249 PolarHBondContact O-N 2.81Å
250	K	86.8	Confident	71.8	Confident	158 Å²	158	91.5 Å²	91.5	69%	0.687	48%	0.478	S	S	*	.	P	Polyproline II helix	trans	-84.3	122.8	174.8	-64.6	-176.8	-179.4	-179.4	0	109	K248 T252	K248-K250 PolarHBondContact O-N 3.29Å; K250-T252 PolarHBondContact O-N 3.48Å; K250-T252 PolarHBondContact O-OG1 3.23Å
251	K	66.1	Low	68.9	Low	184 Å²	184	98.4 Å²	98.4	80%	0.8	51%	0.508	S	S	*	.			trans	-60.6	100.8	169.4	-75.4	-176.5	178.8	175.1	0	108.5
252	T	53.2	Low	65.9	Low	101 Å²	101	104.4 Å²	104.4	62%	0.62	55%	0.547	S	S	*	.			trans	-87.8	110.6	172.7	-47.5	0	0	0	0	106.4	K250 Q254	K250-T252 PolarHBondContact O-N 3.48Å; K250-T252 PolarHBondContact O-OG1 3.23Å; T252-Q254 HydrophobicContact CG2-CG 3.51Å; T252-Q254 PolarHBondContact O-N 2.76Å
253	N	45.2	Very low	62.8	Low	166 Å²	166	109.7 Å²	109.7	89%	0.888	58%	0.58	S	S	*	*			trans	-65.8	85.4	163.7	-78.9	-14.4	0	0	0	107.6	I255	N253-I255 PolarHBondContact O-N 3.37Å
254	Q	44.5	Very low	60	Low	158 Å²	158	115.2 Å²	115.2	74%	0.738	61%	0.607	S	S	*	*			trans	-81.6	98.4	178.1	-73.2	-172.9	-13.1	0	0	110	T252 I256	T252-Q254 HydrophobicContact CG2-CG 3.51Å; T252-Q254 PolarHBondContact O-N 2.76Å; Q254-I256 PolarHBondContact O-N 2.69Å
255	I	39.7	Very low	56.8	Low	156 Å²	156	120.9 Å²	120.9	80%	0.8	65%	0.646	S	S	*	*			trans	-68.9	117.2	141.8	-66.3	175.5	0	0	0	105.4	N253 S257	N253-I255 PolarHBondContact O-N 3.37Å; I255-S257 PolarHBondContact O-N 3.02Å
256	I	41.8	Very low	54.3	Low	150 Å²	150	127.4 Å²	127.4	77%	0.769	68%	0.68	S	S	*	*			trans	-51.8	114.2	177.8	-60.8	162.8	0	0	0	108.9	Q254	Q254-I256 PolarHBondContact O-N 2.69Å
257	S	35.6	Very low	51.4	Low	101 Å²	101	135.5 Å²	135.5	71%	0.706	72%	0.723	S	S	*	*			trans	-139.4	97.7	156.6	38.9	0	0	0	0	107.3	I255 P259	I255-S257 PolarHBondContact O-N 3.02Å; S257-P259 WeakPolarHBondContact O-CD 3.43Å
258	L	40.1	Very low	48.7	Very low	164 Å²	164	140.3 Å²	140.3	86%	0.859	75%	0.745	S	S	*	*			trans	-59.7	138.9	160.3	-74.4	157.7	0	0	0	108.1
259	P	42.9	Very low	46.3	Very low	116 Å²	116	143.1 Å²	143.1	75%	0.753	77%	0.77	S	S	*	*			trans	-131.6	135.7	134.3	9.1	13.4	0	0	0	113.5	S257	S257-P259 WeakPolarHBondContact O-CD 3.43Å
260	L	38.2	Very low	44.1	Very low	170 Å²	170	146.5 Å²	146.5	89%	0.89	79%	0.794	S	S	*	*			trans	-23.8	137.7	160.8	-68.1	134.4	0	0	0	116.5
261	E	37.6	Very low	42	Very low	173 Å²	173	142 Å²	142	81%	0.808	79%	0.792	S	S	*	*			trans	-56.5	155.7	156.5	-67.1	-166.9	160.1	0	0	111.6
262	P	36.5	Very low	41.1	Very low	126 Å²	126	139.7 Å²	139.7	82%	0.818	79%	0.789	S	S	*	*				-133.7	163.8	106.8	30.3	-15.2	0	0	0	114.5
263	T	32.9	Very low	41.3	Very low	111 Å²	111	143 Å²	143	68%	0.681	80%	0.797	S	S	*	*			trans	-63	158.3	-170.2	34	0	0	0	0	117.8
264	Q	38.7	Very low	41.8	Very low	181 Å²	181	142.1 Å²	142.1	85%	0.846	79%	0.791	S	S	*	*			trans	75.7	117.9	152.9	-73.9	171.5	14.7	0	0	119.3
265	S	32.2	Very low	42.2	Very low	119 Å²	119	141.4 Å²	141.4	83%	0.832	79%	0.788	S	S	*	*				172.9	150.4	95.5	45.6	0	0	0	0	112
266	N	45.5	Very low	42.8	Very low	154 Å²	154	138.9 Å²	138.9	82%	0.824	78%	0.776	S	S	*	*			trans	-52.6	143.3	179	-62.2	-48.8	0	0	0	113.8
267	L	37.3	Very low	43.2	Very low	171 Å²	171	139.4 Å²	139.4	90%	0.895	77%	0.773	S	S	*	*			trans	-172.4	123.5	134.2	-100.2	149.1	0	0	0	110.7
268	L	39	Very low	44.1	Very low	157 Å²	157	141.1 Å²	141.1	82%	0.822	77%	0.773	S	S	*	*			trans	-59.6	155.2	164.5	-87.9	96.4	0	0	0	110.9
269	P	45.1	Very low	44.9	Very low	124 Å²	124	138.6 Å²	138.6	81%	0.805	76%	0.759	S	S	*	*			trans	-117.9	126.2	137.8	5.5	15.5	0	0	0	111.7
270	T	46.7	Very low	45.9	Very low	137 Å²	137	137.9 Å²	137.9	84%	0.84	75%	0.749	S	S	*	*			trans	-52.9	140.2	162.7	0.7	0	0	0	0	112.3
271	G	42.5	Very low	47.8	Very low	62 Å²	62	133.8 Å²	133.8	64%	0.639	73%	0.731	S	S	*	*			trans	165.1	86.9	163.8	0	0	0	0	0	114.3
272	N	48.5	Very low	49.6	Very low	137 Å²	137	129.5 Å²	129.5	73%	0.733	72%	0.718	S	S	*	*			trans	156.9	88.4	133.4	-74.6	-7.9	0	0	0	111	I274	N272-I274 PolarHBondContact O-N 3.29Å
273	E	55.9	Low	51.6	Low	169 Å²	169	125.8 Å²	125.8	79%	0.79	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.4	27.2	-175	-64.4	-171.6	153.8	0	0	115.7
274	I	56	Low	54	Low	148 Å²	148	124.8 Å²	124.8	76%	0.759	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.9	-19.4	178.7	-55	-177.8	0	0	0	112.8	N272	N272-I274 PolarHBondContact O-N 3.29Å
275	E	54	Low	56.2	Low	144 Å²	144	117 Å²	117	67%	0.673	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93	-19.7	177.6	-78	176.5	155.5	0	0	114.2
276	D	50.9	Low	58.7	Low	103 Å²	103	114.1 Å²	114.1	55%	0.551	62%	0.621	S	S	*	*	H	α-helix	trans	-86.5	-15.8	-172.3	-150.3	12.6	0	0	0	114
277	K	50	Low	60.4	Low	161 Å²	161	108.4 Å²	108.4	70%	0.7	59%	0.591	S	S	*	*	H	α-helix	trans	-79.8	-28.8	178.7	-72.1	-173	179.2	177.6	0	113.3	T281	K277-T281 PolarHBondContact O-OG1 3.07Å
278	L	55.2	Low	62.1	Low	137 Å²	137	100.6 Å²	100.6	72%	0.717	55%	0.551	S	S	*	*	H	α-helix	trans	-75.9	-30.2	177.7	-92.8	147.5	0	0	0	112.2
279	I	56.5	Low	64.1	Low	111 Å²	111	98.5 Å²	98.5	57%	0.569	55%	0.547	S	S	*	.	H	α-helix	trans	-78.4	-24.5	179.9	-59.4	174.7	0	0	0	111.7	N318	I279-N318 PolarHBondContact O-ND2 3Å; I279-N318 PolarHBondContact O-OD1 3.01Å
280	N	65.1	Low	66	Low	101 Å²	101	95.7 Å²	95.7	54%	0.54	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.5	12.2	-176.8	-81.1	-35.6	0	0	0	115.3	P282	N280-P282 WeakPolarHBondContact O-CD 3.47Å
281	T	76.6	Confident	67.1	Low	84 Å²	84	91.1 Å²	91.1	52%	0.515	49%	0.494	S	S	.	.			trans	-72.5	124.2	176.4	-55.3	0	0	0	0	109.6	K277 L283 N318	K277-T281 PolarHBondContact O-OG1 3.07Å; T281-L283 PolarHBondContact O-N 2.81Å; T281-N318 VanDerWaalsContact O-CB 3.23Å; T281-N318 WeakPolarHBondContact O-CB 3.38Å; T281-N318 PolarHBondContact O-ND2 3.2Å
282	P	77.4	Confident	69	Low	82 Å²	82	93.8 Å²	93.8	53%	0.532	50%	0.5	S	S	.	.			trans	-58.3	126.1	178.4	-24.4	34.5	0	0	0	111.3	N280 N318	N280-P282 WeakPolarHBondContact O-CD 3.47Å; P282-N318 WeakPolarHBondContact CA-O 3.36Å
283	L	78.1	Confident	70.8	Confident	48 Å²	48	89.9 Å²	89.9	25%	0.251	48%	0.475	S	S	.	.	B	Isolated β-bridge	trans	-111.8	108.3	176.7	-172.2	67.8	0	0	0	108.9	P62 T281 M314 P316 A317 G320	P62-L283 HydrophobicContact CG-CD2 4.08Å; T281-L283 PolarHBondContact O-N 2.81Å; L283-M314 HydrophobicContact CD1-CE 3.9Å; L283-M314 HydrophobicContact CD2-CE 4.44Å; L283-M314 HydrophobicContact CD2-SD 4.5Å; L283-M314 HydrophobicContact CG-CE 4.45Å; L283-P316 VanDerWaalsContact O-CA 3.29Å; L283-P316 WeakPolarHBondContact O-CA 3.3Å; L283-A317 HydrophobicContact CB-CB 4.25Å; L283-A317 PolarHBondContact N-O 2.81Å; L283-A317 PolarHBondContact O-N 2.81Å; L283-G320 WeakPolarHBondContact O-CA 3.08Å
284	D	83.8	Confident	71.9	Confident	90 Å²	90	83.7 Å²	83.7	48%	0.481	46%	0.456	S	S	.	.			trans	-71.8	151.4	177.7	-63.8	-20	0	0	0	111.1	E286 G320 A321	D284-E286 PolarHBondContact O-N 2.76Å; D284-G320 WeakPolarHBondContact OD1-CA 3.31Å; D284-A321 HydrophobicContact CB-CB 4.11Å; D284-A321 WeakPolarHBondContact OD1-CB 3.45Å; D284-A321 PolarHBondContact OD1-N 3.47Å
285	C	84.3	Confident	73.2	Confident	17 Å²	17	84.1 Å²	84.1	12%	0.115	46%	0.459	C	S	.	.			trans	-66	127.3	174.1	-178.7	0	0	0	0	111.4	M314 P316 A321 C323	C285-M314 VanDerWaalsContact CA-O 3.28Å; C285-M314 WeakPolarHBondContact CA-O 3.42Å; C285-M314 PolarHBondContact SG-O 2.86Å; C285-P316 HydrophobicContact CB-CB 4.18Å; C285-P316 HydrophobicContact CB-CG 4.32Å; C285-A321 WeakPolarHBondContact CB-O 3.5Å; C285-A321 PolarHBondContact N-O 2.98Å; C285-C323 VanDerWaalsContact CB-CA 3.42Å; C285-C323 HydrophobicContact CB-CB 3.79Å; C285-C323 WeakPolarHBondContact CB-SG 3.44Å; C285-C323 WeakPolarHBondContact SG-CA 3.38Å; C285-C323 WeakPolarHBondContact SG-CB 3.35Å; C285-C323 CovalentContact SG-SG 2.02Å; C285-C323 PolarHBondContact SG-SG 2.9Å
286	E	84.5	Confident	74.9	Confident	60 Å²	60	78.9 Å²	78.9	28%	0.28	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	134.2	172.2	-62.9	-170.3	177.5	0	0	109.7	R234 D284 I313 M314	R234-E286 IonicContact CZ-OE1 3.02Å; R234-E286 IonicContact NH1-OE1 3.89Å; R234-E286 PolarHBondContact NH1-OE1 2.97Å; R234-E286 IonicContact NH2-OE1 3.29Å; R234-E286 PolarHBondContact NH2-OE1 3.03Å; R234-E286 IonicContact NH2-OE2 2.72Å; D284-E286 PolarHBondContact O-N 2.76Å; E286-I313 WeakPolarHBondContact O-CA 3.27Å; E286-I313 PolarHBondContact O-N 2.6Å; E286-M314 HydrophobicContact CB-CB 4.16Å; E286-M314 VanDerWaalsContact CD-CE 3.46Å; E286-M314 HydrophobicContact CG-CE 3.97Å; E286-M314 PolarHBondContact N-O 3.27Å; E286-M314 PolarHBondContact O-N 2.8Å
287	V	81.5	Confident	76.4	Confident	33 Å²	33	81.6 Å²	81.6	20%	0.2	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	153.5	-178.9	-63.1	0	0	0	0	110.5	Y311 V312 P324 L326	V287-Y311 CarbonylContact C-O 3.5Å; V287-Y311 WeakPolarHBondContact CA-O 3.41Å; V287-V312 HydrophobicContact CG1-CG2 4.35Å; V287-P324 HydrophobicContact CG1-CG 4.03Å; V287-P324 HydrophobicContact CG2-CG 3.96Å; V287-L326 HydrophobicContact CG1-CD2 3.78Å
288	S	72.2	Confident	78	Confident	8 Å²	8	76.1 Å²	76.1	6%	0.056	43%	0.434	C	S	.	.	P	Polyproline II helix	trans	-62.8	162.4	174.9	76	0	0	0	0	111.6	R310 Y311	S288-R310 WeakPolarHBondContact OG-CB 3.28Å; S288-Y311 PolarHBondContact N-O 3.31Å; S288-Y311 WeakPolarHBondContact OG-CD1 3.49Å; S288-Y311 PolarHBondContact OG-N 3.18Å; S288-Y311 VanDerWaalsContact OG-N 3.07Å
289	P	81.8	Confident	79.3	Confident	113 Å²	113	77.4 Å²	77.4	73%	0.734	43%	0.433	S	S	*	.	P	Polyproline II helix	trans	-53.1	153.9	158.5	-22.7	34.2	0	0	0	110.6
290	W	85.3	Confident	80.4	Confident	64 Å²	64	76 Å²	76	24%	0.242	43%	0.433	C	S	.	.	P	Polyproline II helix	trans	-62.8	143.6	173.1	-74	109.3	0	0	0	111.5	R308 T309 R310 L326 E328	W290-R308 HydrophobicContact CD2-CG 4.09Å; W290-R308 HydrophobicContact CE3-CB 4.32Å; W290-R308 HydrophobicContact CE3-CG 3.59Å; W290-R308 HydrophobicContact CZ3-CG 4.09Å; W290-R308 WeakPolarHBondContact CZ3-O 3.29Å; W290-T309 VanDerWaalsContact CE3-C 3.46Å; W290-R310 HydrophobicContact CD2-CB 4.22Å; W290-R310 HydrophobicContact CD2-CG 4.09Å; W290-R310 HydrophobicContact CE3-CB 3.88Å; W290-R310 HydrophobicContact CE3-CG 3.8Å; W290-R310 HydrophobicContact CH2-CG 3.95Å; W290-R310 HydrophobicContact CZ2-CG 4.23Å; W290-R310 VanDerWaalsContact CZ2-NE 3.32Å; W290-R310 HydrophobicContact CZ3-CB 4.25Å; W290-R310 HydrophobicContact CZ3-CG 3.74Å; W290-L326 WeakPolarHBondContact CZ3-O 3.06Å; W290-E328 VanDerWaalsContact CE2-OE2 3.25Å; W290-E328 HydrophobicContact CE3-CB 4.48Å; W290-E328 HydrophobicContact CH2-CB 3.53Å; W290-E328 HydrophobicContact CZ2-CB 3.94Å; W290-E328 VanDerWaalsContact CZ2-OE2 3.27Å; W290-E328 WeakPolarHBondContact CZ2-OE2 2.77Å; W290-E328 HydrophobicContact CZ3-CB 3.81Å
291	S	69.4	Low	81	Confident	42 Å²	42	74.8 Å²	74.8	29%	0.294	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-57.9	159.1	162.9	76.3	0	0	0	0	110.3	R308 T309	S291-R308 WeakPolarHBondContact OG-CB 3.3Å; S291-T309 VanDerWaalsContact CB-O 3.31Å; S291-T309 WeakPolarHBondContact CB-O 3.23Å; S291-T309 PolarHBondContact N-O 2.76Å; S291-T309 PolarHBondContact OG-N 3.44Å; S291-T309 VanDerWaalsContact OG-N 3.09Å; S291-T309 PolarHBondContact OG-O 2.99Å
292	P	81.8	Confident	81.4	Confident	117 Å²	117	75.5 Å²	75.5	76%	0.76	45%	0.445	S	S	*	.	P	Polyproline II helix	trans	-52.6	155	159.5	-22.9	34.2	0	0	0	110.6	G294	P292-G294 PolarHBondContact O-N 3.36Å
293	W	87.3	Confident	81.9	Confident	56 Å²	56	74.4 Å²	74.4	21%	0.212	44%	0.439	C	S	.	.	P	Polyproline II helix	trans	-65.2	133.5	174	-72.4	97.6	0	0	0	110.6	Q306 R308 E328 R330	W293-Q306 HydrophobicContact CD2-CG 4.15Å; W293-Q306 HydrophobicContact CE3-CB 4.15Å; W293-Q306 HydrophobicContact CE3-CG 3.62Å; W293-Q306 HydrophobicContact CZ3-CG 4.18Å; W293-Q306 VanDerWaalsContact CZ3-O 3.27Å; W293-Q306 WeakPolarHBondContact CZ3-O 3.45Å; W293-R308 HydrophobicContact CD2-CB 4.15Å; W293-R308 HydrophobicContact CD2-CG 4.11Å; W293-R308 VanDerWaalsContact CE2-CD 3.49Å; W293-R308 HydrophobicContact CE3-CB 3.86Å; W293-R308 HydrophobicContact CE3-CG 3.84Å; W293-R308 HydrophobicContact CH2-CG 3.76Å; W293-R308 VanDerWaalsContact CZ2-CD 3.48Å; W293-R308 HydrophobicContact CZ2-CG 4Å; W293-R308 HydrophobicContact CZ3-CB 4.13Å; W293-R308 HydrophobicContact CZ3-CG 3.66Å; W293-E328 HydrophobicContact CH2-CB 4.38Å; W293-E328 HydrophobicContact CH2-CG 3.94Å; W293-R330 HydrophobicContact CD2-CG 4.25Å; W293-R330 VanDerWaalsContact CD2-NE 3.3Å; W293-R330 HydrophobicContact CE3-CG 3.99Å; W293-R330 VanDerWaalsContact CG-NH2 3.34Å; W293-R330 HydrophobicContact CH2-CB 3.7Å; W293-R330 HydrophobicContact CH2-CG 3.43Å; W293-R330 VanDerWaalsContact CH2-CG 3.43Å; W293-R330 HydrophobicContact CZ2-CB 4.24Å; W293-R330 HydrophobicContact CZ2-CG 3.74Å; W293-R330 HydrophobicContact CZ3-CB 4.13Å; W293-R330 HydrophobicContact CZ3-CG 3.59Å
294	G	78.8	Confident	82.5	Confident	38 Å²	38	72.3 Å²	72.3	39%	0.392	43%	0.429	S	S	.	.			trans	-68	175	170.3	0	0	0	0	0	112.1	P292 Q306 H307	P292-G294 PolarHBondContact O-N 3.36Å; G294-Q306 WeakPolarHBondContact O-CB 2.98Å; G294-H307 PolarHBondContact N-O 2.93Å
295	L	83.4	Confident	82.8	Confident	157 Å²	157	71 Å²	71	82%	0.822	42%	0.424	S	S	*	.			trans	-58.3	143.8	177.5	-61.1	175.1	0	0	0	111.5	K297	L295-K297 PolarHBondContact O-N 2.97Å; L295-K297 VanDerWaalsContact O-N 3.14Å
296	C	88.6	Confident	83	Confident	34 Å²	34	71.4 Å²	71.4	23%	0.23	42%	0.424	C	S	.	.			trans	-68.2	108.9	174	-172.4	0	0	0	0	110	C332 P334	C296-C332 WeakPolarHBondContact CA-SG 3.48Å; C296-C332 HydrophobicContact CB-CB 3.83Å; C296-C332 WeakPolarHBondContact CB-SG 2.92Å; C296-C332 WeakPolarHBondContact SG-CB 3.5Å; C296-C332 CovalentContact SG-SG 2.01Å; C296-C332 PolarHBondContact SG-SG 3.45Å; C296-P334 HydrophobicContact CB-CG 4.41Å
297	K	83.6	Confident	83.2	Confident	161 Å²	161	73 Å²	73	70%	0.7	43%	0.431	S	S	*	.	B	Isolated β-bridge	trans	-89.1	111.3	176.9	-66.1	-175.6	179.6	-179.6	0	109.2	L295 G304 V305	L295-K297 PolarHBondContact O-N 2.97Å; L295-K297 VanDerWaalsContact O-N 3.14Å; K297-G304 CarbonylContact O-C 3.5Å; K297-G304 WeakPolarHBondContact O-CA 3.3Å; K297-V305 PolarHBondContact N-O 3.31Å; K297-V305 PolarHBondContact O-N 3.03Å
298	G	82.6	Confident	83.3	Confident	45 Å²	45	74 Å²	74	46%	0.464	43%	0.432	S	S	.	.	S	Bend	trans	-175	167.6	178.8	0	0	0	0	0	111
299	K	82.4	Confident	83.4	Confident	164 Å²	164	77.6 Å²	77.6	71%	0.713	45%	0.453	S	S	*	.			trans	-73.6	143.6	168.3	-69.5	-176.5	-179.9	-180	0	108.9	G301 D302	K299-G301 PolarHBondContact O-N 2.9Å; K299-D302 HydrophobicContact CB-CB 4.4Å; K299-D302 PolarHBondContact O-N 3.19Å; K299-D302 VanDerWaalsContact O-N 3.16Å
300	C	81.1	Confident	83.2	Confident	83 Å²	83	74.8 Å²	74.8	56%	0.561	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	136.5	175.6	-165.8	0	0	0	0	111.1	D302 C337	C300-D302 VanDerWaalsContact C-N 3.26Å; C300-D302 PolarHBondContact O-N 2.82Å; C300-C337 HydrophobicContact CB-CB 3.43Å; C300-C337 VanDerWaalsContact CB-CB 3.43Å; C300-C337 WeakPolarHBondContact CB-SG 3.28Å; C300-C337 WeakPolarHBondContact SG-CB 3.14Å; C300-C337 CovalentContact SG-SG 2.01Å; C300-C337 PolarHBondContact SG-SG 3.16Å
301	G	77.1	Confident	82.1	Confident	75 Å²	75	79.2 Å²	79.2	77%	0.773	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.2	-13.7	-175.9	0	0	0	0	0	114.3	K299	K299-G301 PolarHBondContact O-N 2.9Å
302	D	85.4	Confident	82.1	Confident	98 Å²	98	78.6 Å²	78.6	52%	0.524	44%	0.44	S	S	.	.	S	Bend	trans	-107.1	165.2	173.9	-69.8	-39.6	0	0	0	111.3	K299 C300 G304 P334	K299-D302 HydrophobicContact CB-CB 4.4Å; K299-D302 PolarHBondContact O-N 3.19Å; K299-D302 VanDerWaalsContact O-N 3.16Å; C300-D302 VanDerWaalsContact C-N 3.26Å; C300-D302 PolarHBondContact O-N 2.82Å; D302-G304 PolarHBondContact O-N 2.87Å; D302-P334 WeakPolarHBondContact O-CD 3.48Å
303	S	88	Confident	81.1	Confident	60 Å²	60	76.4 Å²	76.4	42%	0.42	42%	0.421	S	S	.	.			trans	-72.4	128.6	170.2	62	0	0	0	0	111.7	K331 C332	S303-K331 VanDerWaalsContact OG-CE 3.28Å; S303-K331 WeakPolarHBondContact OG-CE 3.03Å; S303-C332 CarbonylContact C-O 3.6Å
304	G	89.8	Confident	80.2	Confident	3 Å²	3	74.9 Å²	74.9	3%	0.031	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	-175.7	171	0	0	0	0	0	113.3	K297 D302 K331 C332	K297-G304 CarbonylContact O-C 3.5Å; K297-G304 WeakPolarHBondContact O-CA 3.3Å; D302-G304 PolarHBondContact O-N 2.87Å; G304-K331 WeakPolarHBondContact O-CA 3.37Å; G304-C332 PolarHBondContact N-O 2.01Å; G304-C332 PolarHBondContact O-N 3.01Å
305	V	91.1	Very high	79.9	Confident	62 Å²	62	77.2 Å²	77.2	38%	0.376	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	131.8	174.6	-177.1	0	0	0	0	109.2	K297 A329 R330 C332	K297-V305 PolarHBondContact N-O 3.31Å; K297-V305 PolarHBondContact O-N 3.03Å; V305-A329 HydrophobicContact CG1-CB 3.84Å; V305-R330 WeakPolarHBondContact CA-O 2.97Å; V305-C332 PolarHBondContact N-SG 3.46Å
306	Q	87.8	Confident	79.6	Confident	27 Å²	27	72.1 Å²	72.1	13%	0.126	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	144.5	169	56.1	-173.4	-43.8	0	0	108.4	W293 G294 A329 R330 C332	W293-Q306 HydrophobicContact CD2-CG 4.15Å; W293-Q306 HydrophobicContact CE3-CB 4.15Å; W293-Q306 HydrophobicContact CE3-CG 3.62Å; W293-Q306 HydrophobicContact CZ3-CG 4.18Å; W293-Q306 VanDerWaalsContact CZ3-O 3.27Å; W293-Q306 WeakPolarHBondContact CZ3-O 3.45Å; G294-Q306 WeakPolarHBondContact O-CB 2.98Å; Q306-A329 WeakPolarHBondContact O-CA 3.49Å; Q306-R330 HydrophobicContact CG-CG 3.56Å; Q306-R330 PolarHBondContact N-O 2.92Å; Q306-R330 VanDerWaalsContact NE2-CZ 3.31Å; Q306-R330 VanDerWaalsContact NE2-NH2 3.12Å; Q306-R330 PolarHBondContact O-N 2.02Å; Q306-C332 HydrophobicContact CB-CB 4.39Å; Q306-C332 HydrophobicContact CG-CB 3.84Å; Q306-C332 PolarHBondContact N-SG 2.86Å
307	H	89.3	Confident	79.1	Confident	92 Å²	92	71.3 Å²	71.3	43%	0.426	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	149.5	179.8	-66.7	-100.3	0	0	0	110	G294 E328	G294-H307 PolarHBondContact N-O 2.93Å; H307-E328 CarbonylContact C-O 3.55Å; H307-E328 WeakPolarHBondContact CA-O 3.32Å
308	R	83.7	Confident	79	Confident	55 Å²	55	66.3 Å²	66.3	21%	0.208	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	156.2	163.8	64.1	179.2	-173.3	-173.5	-7.1	109.1	W290 S291 W293 E328	W290-R308 HydrophobicContact CD2-CG 4.09Å; W290-R308 HydrophobicContact CE3-CB 4.32Å; W290-R308 HydrophobicContact CE3-CG 3.59Å; W290-R308 HydrophobicContact CZ3-CG 4.09Å; W290-R308 WeakPolarHBondContact CZ3-O 3.29Å; S291-R308 WeakPolarHBondContact OG-CB 3.3Å; W293-R308 HydrophobicContact CD2-CB 4.15Å; W293-R308 HydrophobicContact CD2-CG 4.11Å; W293-R308 VanDerWaalsContact CE2-CD 3.49Å; W293-R308 HydrophobicContact CE3-CB 3.86Å; W293-R308 HydrophobicContact CE3-CG 3.84Å; W293-R308 HydrophobicContact CH2-CG 3.76Å; W293-R308 VanDerWaalsContact CZ2-CD 3.48Å; W293-R308 HydrophobicContact CZ2-CG 4Å; W293-R308 HydrophobicContact CZ3-CB 4.13Å; W293-R308 HydrophobicContact CZ3-CG 3.66Å; R308-E328 HydrophobicContact CG-CB 3.96Å; R308-E328 IonicContact CZ-OE1 3.5Å; R308-E328 IonicContact CZ-OE2 3.08Å; R308-E328 PolarHBondContact N-O 2.01Å; R308-E328 VanDerWaalsContact NE-CD 3.31Å; R308-E328 IonicContact NE-OE1 3.57Å; R308-E328 IonicContact NE-OE2 2.8Å; R308-E328 PolarHBondContact NE-OE2 3.45Å; R308-E328 IonicContact NH2-OE1 2.86Å; R308-E328 PolarHBondContact NH2-OE1 3.35Å; R308-E328 IonicContact NH2-OE2 2.6Å; R308-E328 PolarHBondContact NH2-OE2 2.78Å; R308-E328 PolarHBondContact O-N 3.23Å
309	T	73.7	Confident	79	Confident	84 Å²	84	72.2 Å²	72.2	52%	0.515	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	156.6	-179.7	56.4	0	0	0	0	110.6	W290 S291 L326	W290-T309 VanDerWaalsContact CE3-C 3.46Å; S291-T309 VanDerWaalsContact CB-O 3.31Å; S291-T309 WeakPolarHBondContact CB-O 3.23Å; S291-T309 PolarHBondContact N-O 2.76Å; S291-T309 PolarHBondContact OG-N 3.44Å; S291-T309 VanDerWaalsContact OG-N 3.09Å; S291-T309 PolarHBondContact OG-O 2.99Å; T309-L326 CarbonylContact C-O 3.58Å; T309-L326 VanDerWaalsContact CA-O 3.3Å; T309-L326 WeakPolarHBondContact CA-O 3.47Å
310	R	78.2	Confident	78.9	Confident	53 Å²	53	65.2 Å²	65.2	20%	0.2	37%	0.366	C	S	.	.			trans	-137.5	160	166.7	61.4	-177.9	174.8	-178.5	-5.4	108.1	S288 W290 L325 L326	S288-R310 WeakPolarHBondContact OG-CB 3.28Å; W290-R310 HydrophobicContact CD2-CB 4.22Å; W290-R310 HydrophobicContact CD2-CG 4.09Å; W290-R310 HydrophobicContact CE3-CB 3.88Å; W290-R310 HydrophobicContact CE3-CG 3.8Å; W290-R310 HydrophobicContact CH2-CG 3.95Å; W290-R310 HydrophobicContact CZ2-CG 4.23Å; W290-R310 VanDerWaalsContact CZ2-NE 3.32Å; W290-R310 HydrophobicContact CZ3-CB 4.25Å; W290-R310 HydrophobicContact CZ3-CG 3.74Å; R310-L325 VanDerWaalsContact CZ-O 3.28Å; R310-L325 PolarHBondContact NE-O 3.09Å; R310-L325 PolarHBondContact NH2-O 3.27Å; R310-L326 HydrophobicContact CG-CD2 4.24Å; R310-L326 PolarHBondContact N-O 2.87Å; R310-L326 WeakPolarHBondContact O-CB 3.37Å
311	Y	61.7	Low	79.2	Confident	158 Å²	158	63.8 Å²	63.8	62%	0.62	36%	0.36	S	S	*	.			trans	-118.2	158.5	-179.6	60.2	-89.1	0	0	0	111	V287 S288 I313	V287-Y311 CarbonylContact C-O 3.5Å; V287-Y311 WeakPolarHBondContact CA-O 3.41Å; S288-Y311 PolarHBondContact N-O 3.31Å; S288-Y311 WeakPolarHBondContact OG-CD1 3.49Å; S288-Y311 PolarHBondContact OG-N 3.18Å; S288-Y311 VanDerWaalsContact OG-N 3.07Å; Y311-I313 HydrophobicContact CE2-CG1 4.12Å; Y311-I313 PolarHBondContact O-N 2.89Å
312	V	68.8	Low	79.7	Confident	28 Å²	28	64.2 Å²	64.2	17%	0.17	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	124.5	176.1	179.6	0	0	0	0	108.9	V287 M314 C323 L326	V287-V312 HydrophobicContact CG1-CG2 4.35Å; V312-M314 VanDerWaalsContact CG1-O 3.23Å; V312-M314 WeakPolarHBondContact CG1-O 3.33Å; V312-C323 HydrophobicContact CG2-CB 4.2Å; V312-L326 HydrophobicContact CG2-CD1 3.74Å; V312-L326 HydrophobicContact CG2-CD2 3.78Å; V312-L326 HydrophobicContact CG2-CG 4.37Å
313	I	61.9	Low	79.6	Confident	71 Å²	71	61.6 Å²	61.6	36%	0.364	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	-43	171.7	-63.2	172.5	0	0	0	109.6	E286 Y311	E286-I313 WeakPolarHBondContact O-CA 3.27Å; E286-I313 PolarHBondContact O-N 2.6Å; Y311-I313 HydrophobicContact CE2-CG1 4.12Å; Y311-I313 PolarHBondContact O-N 2.89Å
314	M	67.1	Low	79.7	Confident	25 Å²	25	61.5 Å²	61.5	12%	0.123	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	126	174.8	-62.6	-151.5	-64	0	0	110.2	L283 C285 E286 V312	L283-M314 HydrophobicContact CD1-CE 3.9Å; L283-M314 HydrophobicContact CD2-CE 4.44Å; L283-M314 HydrophobicContact CD2-SD 4.5Å; L283-M314 HydrophobicContact CG-CE 4.45Å; C285-M314 VanDerWaalsContact CA-O 3.28Å; C285-M314 WeakPolarHBondContact CA-O 3.42Å; C285-M314 PolarHBondContact SG-O 2.86Å; E286-M314 HydrophobicContact CB-CB 4.16Å; E286-M314 VanDerWaalsContact CD-CE 3.46Å; E286-M314 HydrophobicContact CG-CE 3.97Å; E286-M314 PolarHBondContact N-O 3.27Å; E286-M314 PolarHBondContact O-N 2.8Å; V312-M314 VanDerWaalsContact CG1-O 3.23Å; V312-M314 WeakPolarHBondContact CG1-O 3.33Å
315	H	71.7	Confident	79.4	Confident	86 Å²	86	67.8 Å²	67.8	40%	0.398	38%	0.375	S	S	.	.			trans	-73.3	150.6	172.7	-77.7	-81.2	0	0	0	110.8
316	P	78.6	Confident	79	Confident	51 Å²	51	67.9 Å²	67.9	33%	0.331	37%	0.373	S	S	.	.			trans	-68	142.7	179.7	30.6	-34.8	0	0	0	110.9	L283 C285 A321	L283-P316 VanDerWaalsContact O-CA 3.29Å; L283-P316 WeakPolarHBondContact O-CA 3.3Å; C285-P316 HydrophobicContact CB-CB 4.18Å; C285-P316 HydrophobicContact CB-CG 4.32Å; P316-A321 WeakPolarHBondContact CB-O 3.27Å
317	A	76.9	Confident	78.8	Confident	17 Å²	17	71.1 Å²	71.1	14%	0.14	39%	0.392	C	S	.	.	B	Isolated β-bridge	trans	-143.1	165.6	176.5	0	0	0	0	0	110.8	L283 N319 G320	L283-A317 HydrophobicContact CB-CB 4.25Å; L283-A317 PolarHBondContact N-O 2.81Å; L283-A317 PolarHBondContact O-N 2.81Å; A317-N319 VanDerWaalsContact C-N 3.27Å; A317-N319 PolarHBondContact O-N 3.41Å; A317-G320 PolarHBondContact O-N 3Å
318	N	81.4	Confident	78.9	Confident	56 Å²	56	69.8 Å²	69.8	30%	0.299	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.9	42.6	174.7	-56.3	-23.7	0	0	0	114.1	I279 T281 P282 G320	I279-N318 PolarHBondContact O-ND2 3Å; I279-N318 PolarHBondContact O-OD1 3.01Å; T281-N318 VanDerWaalsContact O-CB 3.23Å; T281-N318 WeakPolarHBondContact O-CB 3.38Å; T281-N318 PolarHBondContact O-ND2 3.2Å; P282-N318 WeakPolarHBondContact CA-O 3.36Å; N318-G320 PolarHBondContact O-N 2.94Å
319	N	83.3	Confident	79.3	Confident	168 Å²	168	69.8 Å²	69.8	90%	0.898	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.8	22.5	-177.9	-142.6	61	0	0	0	114.5	A317	A317-N319 VanDerWaalsContact C-N 3.27Å; A317-N319 PolarHBondContact O-N 3.41Å
320	G	80.6	Confident	80.2	Confident	17 Å²	17	71.1 Å²	71.1	18%	0.175	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-72.6	165.8	170.6	0	0	0	0	0	113.9	L283 D284 A317 N318	L283-G320 WeakPolarHBondContact O-CA 3.08Å; D284-G320 WeakPolarHBondContact OD1-CA 3.31Å; A317-G320 PolarHBondContact O-N 3Å; N318-G320 PolarHBondContact O-N 2.94Å
321	A	87.6	Confident	80.9	Confident	54 Å²	54	75.3 Å²	75.3	45%	0.446	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-64.8	132.7	-173	0	0	0	0	0	112.9	D284 C285 P316	D284-A321 HydrophobicContact CB-CB 4.11Å; D284-A321 WeakPolarHBondContact OD1-CB 3.45Å; D284-A321 PolarHBondContact OD1-N 3.47Å; C285-A321 WeakPolarHBondContact CB-O 3.5Å; C285-A321 PolarHBondContact N-O 2.98Å; P316-A321 WeakPolarHBondContact CB-O 3.27Å
322	A	88.1	Confident	82.3	Confident	84 Å²	84	68.2 Å²	68.2	69%	0.694	39%	0.386	S	S	*	.	P	Polyproline II helix	trans	-60.8	155.3	178.6	0	0	0	0	0	112.9
323	C	82.8	Confident	83.2	Confident	42 Å²	42	73.1 Å²	73.1	28%	0.284	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-62.2	134.4	179.8	-60.4	0	0	0	0	112.3	C285 V312	C285-C323 VanDerWaalsContact CB-CA 3.42Å; C285-C323 HydrophobicContact CB-CB 3.79Å; C285-C323 WeakPolarHBondContact CB-SG 3.44Å; C285-C323 WeakPolarHBondContact SG-CA 3.38Å; C285-C323 WeakPolarHBondContact SG-CB 3.35Å; C285-C323 CovalentContact SG-SG 2.02Å; C285-C323 PolarHBondContact SG-SG 2.9Å; V312-C323 HydrophobicContact CG2-CB 4.2Å
324	P	89.9	Confident	84.2	Confident	58 Å²	58	71.2 Å²	71.2	38%	0.377	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-69.2	168.6	170.9	34	-37.7	0	0	0	110.3	V287 L326	V287-P324 HydrophobicContact CG1-CG 4.03Å; V287-P324 HydrophobicContact CG2-CG 3.96Å; P324-L326 PolarHBondContact O-N 3.14Å
325	L	83.8	Confident	84.5	Confident	135 Å²	135	76.9 Å²	76.9	71%	0.707	43%	0.428	S	S	*	.	P	Polyproline II helix	trans	-52.2	136.4	-179.2	-67.4	172.8	0	0	0	112.1	R310	R310-L325 VanDerWaalsContact CZ-O 3.28Å; R310-L325 PolarHBondContact NE-O 3.09Å; R310-L325 PolarHBondContact NH2-O 3.27Å
326	L	81.4	Confident	84.2	Confident	64 Å²	64	80.7 Å²	80.7	34%	0.335	45%	0.452	S	S	.	.	S	Bend	trans	-98.1	-14.2	-176.4	-59.9	-178.4	0	0	0	112.7	V287 W290 T309 R310 V312 P324	V287-L326 HydrophobicContact CG1-CD2 3.78Å; W290-L326 WeakPolarHBondContact CZ3-O 3.06Å; T309-L326 CarbonylContact C-O 3.58Å; T309-L326 VanDerWaalsContact CA-O 3.3Å; T309-L326 WeakPolarHBondContact CA-O 3.47Å; R310-L326 HydrophobicContact CG-CD2 4.24Å; R310-L326 PolarHBondContact N-O 2.87Å; R310-L326 WeakPolarHBondContact O-CB 3.37Å; V312-L326 HydrophobicContact CG2-CD1 3.74Å; V312-L326 HydrophobicContact CG2-CD2 3.78Å; V312-L326 HydrophobicContact CG2-CG 4.37Å; P324-L326 PolarHBondContact O-N 3.14Å
327	D	84.3	Confident	83.7	Confident	96 Å²	96	80.8 Å²	80.8	51%	0.513	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	144	173.4	71.2	-74.8	0	0	0	110.6
328	E	91.7	Very high	82.9	Confident	63 Å²	63	91.8 Å²	91.8	29%	0.294	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	136.2	174.6	-171.7	-175.2	150.5	0	0	109.4	W290 W293 H307 R308	W290-E328 VanDerWaalsContact CE2-OE2 3.25Å; W290-E328 HydrophobicContact CE3-CB 4.48Å; W290-E328 HydrophobicContact CH2-CB 3.53Å; W290-E328 HydrophobicContact CZ2-CB 3.94Å; W290-E328 VanDerWaalsContact CZ2-OE2 3.27Å; W290-E328 WeakPolarHBondContact CZ2-OE2 2.77Å; W290-E328 HydrophobicContact CZ3-CB 3.81Å; W293-E328 HydrophobicContact CH2-CB 4.38Å; W293-E328 HydrophobicContact CH2-CG 3.94Å; H307-E328 CarbonylContact C-O 3.55Å; H307-E328 WeakPolarHBondContact CA-O 3.32Å; R308-E328 HydrophobicContact CG-CB 3.96Å; R308-E328 IonicContact CZ-OE1 3.5Å; R308-E328 IonicContact CZ-OE2 3.08Å; R308-E328 PolarHBondContact N-O 2.01Å; R308-E328 VanDerWaalsContact NE-CD 3.31Å; R308-E328 IonicContact NE-OE1 3.57Å; R308-E328 IonicContact NE-OE2 2.8Å; R308-E328 PolarHBondContact NE-OE2 3.45Å; R308-E328 IonicContact NH2-OE1 2.86Å; R308-E328 PolarHBondContact NH2-OE1 3.35Å; R308-E328 IonicContact NH2-OE2 2.6Å; R308-E328 PolarHBondContact NH2-OE2 2.78Å; R308-E328 PolarHBondContact O-N 3.23Å
329	A	91.3	Very high	83	Confident	56 Å²	56	93.6 Å²	93.6	46%	0.463	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	137.7	177.1	0	0	0	0	0	109.5	V305 Q306	V305-A329 HydrophobicContact CG1-CB 3.84Å; Q306-A329 WeakPolarHBondContact O-CA 3.49Å
330	R	92.5	Very high	82.9	Confident	112 Å²	112	89.6 Å²	89.6	42%	0.423	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	152.6	169.6	74.6	177.1	174.2	173.2	7.2	111.7	W293 V305 Q306	W293-R330 HydrophobicContact CD2-CG 4.25Å; W293-R330 VanDerWaalsContact CD2-NE 3.3Å; W293-R330 HydrophobicContact CE3-CG 3.99Å; W293-R330 VanDerWaalsContact CG-NH2 3.34Å; W293-R330 HydrophobicContact CH2-CB 3.7Å; W293-R330 HydrophobicContact CH2-CG 3.43Å; W293-R330 VanDerWaalsContact CH2-CG 3.43Å; W293-R330 HydrophobicContact CZ2-CB 4.24Å; W293-R330 HydrophobicContact CZ2-CG 3.74Å; W293-R330 HydrophobicContact CZ3-CB 4.13Å; W293-R330 HydrophobicContact CZ3-CG 3.59Å; V305-R330 WeakPolarHBondContact CA-O 2.97Å; Q306-R330 HydrophobicContact CG-CG 3.56Å; Q306-R330 PolarHBondContact N-O 2.92Å; Q306-R330 VanDerWaalsContact NE2-CZ 3.31Å; Q306-R330 VanDerWaalsContact NE2-NH2 3.12Å; Q306-R330 PolarHBondContact O-N 2.02Å
331	K	94.1	Very high	83.1	Confident	140 Å²	140	93.7 Å²	93.7	61%	0.609	52%	0.517	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62	140.5	171.1	-166.7	176.2	-175	177.8	0	110	S303 G304	S303-K331 VanDerWaalsContact OG-CE 3.28Å; S303-K331 WeakPolarHBondContact OG-CE 3.03Å; G304-K331 WeakPolarHBondContact O-CA 3.37Å
332	C	89.8	Confident	82.8	Confident	9 Å²	9	96 Å²	96	6%	0.061	52%	0.521	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	167.4	176.7	59.4	0	0	0	0	110.5	C296 S303 G304 V305 Q306	C296-C332 WeakPolarHBondContact CA-SG 3.48Å; C296-C332 HydrophobicContact CB-CB 3.83Å; C296-C332 WeakPolarHBondContact CB-SG 2.92Å; C296-C332 WeakPolarHBondContact SG-CB 3.5Å; C296-C332 CovalentContact SG-SG 2.01Å; C296-C332 PolarHBondContact SG-SG 3.45Å; S303-C332 CarbonylContact C-O 3.6Å; G304-C332 PolarHBondContact N-O 2.01Å; G304-C332 PolarHBondContact O-N 3.01Å; V305-C332 PolarHBondContact N-SG 3.46Å; Q306-C332 HydrophobicContact CB-CB 4.39Å; Q306-C332 HydrophobicContact CG-CB 3.84Å; Q306-C332 PolarHBondContact N-SG 2.86Å
333	F	87.6	Confident	82.5	Confident	131 Å²	131	96.8 Å²	96.8	58%	0.575	51%	0.51	S	S	*	.			trans	-120.5	124.8	171.4	-66	-83.3	0	0	0	107.1	D335	F333-D335 PolarHBondContact O-N 3.49Å
334	P	83.9	Confident	82.5	Confident	31 Å²	31	100.4 Å²	100.4	20%	0.201	53%	0.525	C	S	.	.			trans	-62.8	120.6	177.1	-21.1	32.4	0	0	0	110.6	C296 D302	C296-P334 HydrophobicContact CB-CG 4.41Å; D302-P334 WeakPolarHBondContact O-CD 3.48Å
335	D	73.3	Confident	81.9	Confident	144 Å²	144	103.4 Å²	103.4	77%	0.77	54%	0.535	S	S	*	.			trans	-90.1	144.5	175	-64.5	-37.1	0	0	0	110.3	F333	F333-D335 PolarHBondContact O-N 3.49Å
336	N	64.8	Low	81.8	Confident	166 Å²	166	101 Å²	101	89%	0.888	52%	0.522	S	S	*	.	S	Bend	trans	53.9	53.8	177.4	-66.2	-26.7	0	0	0	115.1
337	C	68	Low	81.8	Confident	54 Å²	54	104.1 Å²	104.1	37%	0.365	54%	0.538	S	S	.	.			trans	-68.2	135.1	168.8	-36.5	0	0	0	0	110.5	C300	C300-C337 HydrophobicContact CB-CB 3.43Å; C300-C337 VanDerWaalsContact CB-CB 3.43Å; C300-C337 WeakPolarHBondContact CB-SG 3.28Å; C300-C337 WeakPolarHBondContact SG-CB 3.14Å; C300-C337 CovalentContact SG-SG 2.01Å; C300-C337 PolarHBondContact SG-SG 3.16Å
338	L	60.4	Low	81.6	Confident	247 Å²	247	104.8 Å²	104.8	100%	1.293	54%	0.54	S	S	*	.			trans	-89.7	0	171.7	-74.5	167.4	0	0	0	111.7

Retrieved 338 of 338 residues in 553.9 ms (Link to these results)

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