A0A077YZ54_TRITR Loading...

CBM 21 domain containing protein

AlphaFold DB , UniProt , Accession A0A077YZ54, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 274 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	33.5	Very low	46.2	Very low	235 Å²	235	148.6 Å²	148.6	100%	1.158	79%	0.792	S	S	*	*				0	84.3	0	-169.5	-175.6	-66.3	0	0	108.2
2	L	39.3	Very low	45.7	Very low	171 Å²	171	151.4 Å²	151.4	90%	0.895	81%	0.806	S	S	*	*			trans	-169.6	84.1	157.3	-86.1	-175.2	0	0	0	101.8	L4	L2-L4 PolarHBondContact O-N 3.4Å
3	E	37.2	Very low	45	Very low	193 Å²	193	145.9 Å²	145.9	90%	0.902	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-75.8	116.9	178.3	-68.8	-154.6	153.9	0	0	108.7
4	L	50.3	Low	44.6	Very low	153 Å²	153	143.2 Å²	143.2	80%	0.801	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-82.9	131.4	168.8	-80.4	166.1	0	0	0	108.7	L2	L2-L4 PolarHBondContact O-N 3.4Å
5	P	46.3	Very low	44.5	Very low	87 Å²	87	145.3 Å²	145.3	57%	0.565	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-61.7	138.7	-177.5	-19.5	30.5	0	0	0	112	E7 L8	P5-E7 PolarHBondContact O-N 3.41Å; P5-L8 PolarHBondContact O-N 2.92Å
6	S	55.2	Low	44.5	Very low	111 Å²	111	143.9 Å²	143.9	78%	0.776	81%	0.808	S	S	*	*	G	3₁₀ helix	trans	-59.5	-8	-178.2	-36.1	0	0	0	0	114.6
7	E	52.3	Low	44	Very low	163 Å²	163	139.5 Å²	139.5	76%	0.762	80%	0.801	S	S	*	*	G	3₁₀ helix	trans	-84	-13	-175.9	-62.1	-150.6	146.5	0	0	114.6	P5	P5-E7 PolarHBondContact O-N 3.41Å
8	L	48.7	Very low	44.2	Very low	121 Å²	121	137.8 Å²	137.8	63%	0.634	80%	0.8	S	S	*	*	G	3₁₀ helix	trans	-88.6	-6.5	-177.6	-81.5	168.4	0	0	0	115.4	P5 N10 L11	P5-L8 PolarHBondContact O-N 2.92Å; L8-N10 VanDerWaalsContact C-N 3.28Å; L8-N10 PolarHBondContact O-N 2.83Å; L8-L11 HydrophobicContact CD2-CD1 4.46Å
9	V	51.5	Low	44.5	Very low	128 Å²	128	136.5 Å²	136.5	78%	0.776	81%	0.806	S	S	*	*	G	3₁₀ helix	trans	-78	-13.9	-180	-176.9	0	0	0	0	112.4
10	N	49.4	Very low	45.3	Very low	144 Å²	144	138.8 Å²	138.8	77%	0.77	81%	0.806	S	S	*	*	G	3₁₀ helix	trans	-101.1	8.1	-174.5	-71.5	-29.8	0	0	0	115.3	L8	L8-N10 VanDerWaalsContact C-N 3.28Å; L8-N10 PolarHBondContact O-N 2.83Å
11	L	44.2	Very low	46.1	Very low	129 Å²	129	142.2 Å²	142.2	68%	0.675	81%	0.811	S	S	*	*	S	Bend	trans	-107.1	8.5	-167.1	-104.4	144.3	0	0	0	116.7	L8	L8-L11 HydrophobicContact CD2-CD1 4.46Å
12	L	40.1	Very low	47.6	Very low	182 Å²	182	140.8 Å²	140.8	95%	0.953	80%	0.798	S	S	*	*	S	Bend	trans	-123.2	74.7	174.8	-66.7	173.6	0	0	0	111
13	G	36.6	Very low	49	Very low	80 Å²	80	142.6 Å²	142.6	83%	0.825	80%	0.799	S	S	*	*			trans	-168.7	50.1	178.7	0	0	0	0	0	113.9
14	S	39.4	Very low	50.7	Low	108 Å²	108	138.4 Å²	138.4	76%	0.755	79%	0.791	S	S	*	*			trans	-108.7	111.9	174.4	-161.5	0	0	0	0	110.4
15	Q	44	Very low	51.5	Low	175 Å²	175	136.7 Å²	136.7	82%	0.818	79%	0.787	S	S	*	*				148.6	133.7	119.3	-71.3	-147.3	11.6	0	0	114.3
16	S	43.4	Very low	52.5	Low	123 Å²	123	137 Å²	137	86%	0.86	79%	0.787	S	S	*	*			trans	89.5	118.5	163.9	82.9	0	0	0	0	119.6
17	G	37.4	Very low	52.9	Low	68 Å²	68	139.2 Å²	139.2	70%	0.701	78%	0.783	S	S	*	*			trans	102	99.1	130.9	0	0	0	0	0	120
18	S	47.8	Very low	53.9	Low	110 Å²	110	134.1 Å²	134.1	77%	0.769	77%	0.769	S	S	*	*			trans	75.6	119.1	157.3	80.9	0	0	0	0	119	K20	S18-K20 PolarHBondContact O-N 3.42Å
19	A	49.3	Very low	54.9	Low	112 Å²	112	132 Å²	132	93%	0.926	76%	0.758	S	S	*	*			trans	-68.2	104.3	-179.4	0	0	0	0	0	112.5
20	K	60.5	Low	55.6	Low	182 Å²	182	132.8 Å²	132.8	79%	0.791	76%	0.758	S	S	*	*			trans	-125.5	124.6	160.3	-67.1	-177.3	-178.4	175.4	0	107.7	S18 K22	S18-K20 PolarHBondContact O-N 3.42Å; K20-K22 PolarHBondContact O-N 2.68Å
21	K	61.9	Low	56.5	Low	211 Å²	211	131.1 Å²	131.1	92%	0.917	76%	0.756	S	S	*	*			trans	-51.6	107.8	176	-78.1	179.8	176.2	178.3	0	109	K23	K21-K23 PolarHBondContact O-N 2.81Å
22	K	64	Low	57.4	Low	206 Å²	206	127.9 Å²	127.9	90%	0.896	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-66.9	118.1	174.4	-96.1	179.9	173.5	178.2	0	108.2	K20 S24	K20-K22 PolarHBondContact O-N 2.68Å; K22-S24 PolarHBondContact O-N 3.34Å
23	K	70.2	Confident	58.4	Low	208 Å²	208	122.3 Å²	122.3	90%	0.904	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-67.4	120.4	166.9	-64.4	-178.6	179.9	-178.6	0	107.1	K21	K21-K23 PolarHBondContact O-N 2.81Å
24	S	72.9	Confident	59.7	Low	106 Å²	106	125.5 Å²	125.5	74%	0.741	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-101.5	141.4	170.8	-176.2	0	0	0	0	109	K22	K22-S24 PolarHBondContact O-N 3.34Å
25	V	67.6	Low	60.6	Low	116 Å²	116	125.8 Å²	125.8	70%	0.703	72%	0.716	S	S	*	*			trans	-113.5	121.1	172.9	178.7	0	0	0	0	106.3
26	T	65.6	Low	61.1	Low	95 Å²	95	123.2 Å²	123.2	58%	0.583	71%	0.712	S	S	*	*			trans	-111.4	134.3	170.7	-53.9	0	0	0	0	107.6
27	F	64.4	Low	61.9	Low	157 Å²	157	122.8 Å²	122.8	69%	0.689	71%	0.705	S	S	*	*			trans	-84.4	121.1	173.7	-62.9	-83.4	0	0	0	108.2	L35	F27-L35 HydrophobicContact CB-CD1 3.62Å
28	A	73.9	Confident	63.1	Low	55 Å²	55	127 Å²	127	46%	0.455	71%	0.709	S	S	.	*	B	Isolated β-bridge	trans	-108.1	152.6	168.8	0	0	0	0	0	109.1	S33	A28-S33 VanDerWaalsContact CA-O 3.25Å; A28-S33 WeakPolarHBondContact CA-O 3.47Å
29	D	68.1	Low	63.8	Low	76 Å²	76	129.4 Å²	129.4	41%	0.406	71%	0.708	S	S	.	*			trans	-68.2	177.1	165.7	64.4	10.4	0	0	0	111.3	C31 G32 S33	D29-C31 PolarHBondContact O-N 2.96Å; D29-C31 VanDerWaalsContact OD1-C 3.23Å; D29-C31 WeakPolarHBondContact OD1-CA 3.4Å; D29-C31 WeakPolarHBondContact OD1-CB 3.37Å; D29-C31 PolarHBondContact OD1-N 3.33Å; D29-G32 PolarHBondContact O-N 3.26Å; D29-G32 PolarHBondContact OD1-N 3.27Å; D29-S33 PolarHBondContact N-O 2.79Å; D29-S33 VanDerWaalsContact N-O 3.09Å; D29-S33 WeakPolarHBondContact OD1-CB 3.25Å; D29-S33 PolarHBondContact OD1-N 2.76Å
30	D	66.8	Low	64.8	Low	146 Å²	146	131 Å²	131	78%	0.781	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.5	-9.9	177.7	-64.8	-16.1	0	0	0	113
31	C	69.2	Low	65.2	Low	109 Å²	109	128.3 Å²	128.3	74%	0.736	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.4	5.9	178	-62.2	0	0	0	0	113.2	D29 S33	D29-C31 PolarHBondContact O-N 2.96Å; D29-C31 VanDerWaalsContact OD1-C 3.23Å; D29-C31 WeakPolarHBondContact OD1-CA 3.4Å; D29-C31 WeakPolarHBondContact OD1-CB 3.37Å; D29-C31 PolarHBondContact OD1-N 3.33Å; C31-S33 VanDerWaalsContact C-N 3.27Å; C31-S33 PolarHBondContact O-N 2.78Å
32	G	62.7	Low	65.6	Low	61 Å²	61	122.9 Å²	122.9	63%	0.629	69%	0.687	S	S	*	*	S	Bend	trans	76.7	7.5	178.6	0	0	0	0	0	114.9	D29	D29-G32 PolarHBondContact O-N 3.26Å; D29-G32 PolarHBondContact OD1-N 3.27Å
33	S	61.1	Low	65.9	Low	65 Å²	65	116.9 Å²	116.9	46%	0.455	66%	0.663	S	S	.	*			trans	-85.6	142	-179.7	-62.4	0	0	0	0	111.3	A28 D29 C31 L35	A28-S33 VanDerWaalsContact CA-O 3.25Å; A28-S33 WeakPolarHBondContact CA-O 3.47Å; D29-S33 PolarHBondContact N-O 2.79Å; D29-S33 VanDerWaalsContact N-O 3.09Å; D29-S33 WeakPolarHBondContact OD1-CB 3.25Å; D29-S33 PolarHBondContact OD1-N 2.76Å; C31-S33 VanDerWaalsContact C-N 3.27Å; C31-S33 PolarHBondContact O-N 2.78Å; S33-L35 PolarHBondContact O-N 2.93Å
34	Q	63.3	Low	66.1	Low	146 Å²	146	110.9 Å²	110.9	68%	0.682	65%	0.645	S	S	*	*	B	Isolated β-bridge	trans	-61.3	127.1	176.3	-165	168.6	38.1	0	0	109	V36	Q34-V36 PolarHBondContact O-N 3.3Å
35	L	58.7	Low	66.2	Low	115 Å²	115	111.4 Å²	111.4	60%	0.602	65%	0.648	S	S	*	*			trans	-56.8	95.9	175.8	-97.3	125.1	0	0	0	110.1	F27 S33	F27-L35 HydrophobicContact CB-CD1 3.62Å; S33-L35 PolarHBondContact O-N 2.93Å
36	V	55.4	Low	66.7	Low	121 Å²	121	111.8 Å²	111.8	73%	0.733	65%	0.647	S	S	*	*			trans	-103.7	93.4	179.8	156.1	0	0	0	0	108.1	Q34	Q34-V36 PolarHBondContact O-N 3.3Å
37	T	60.2	Low	66.9	Low	114 Å²	114	110.8 Å²	110.8	70%	0.699	64%	0.64	S	S	*	*			trans	169.3	91.3	134.2	-60.3	0	0	0	0	105.9	Q39	T37-Q39 PolarHBondContact O-N 3.28Å; T37-Q39 VanDerWaalsContact O-N 3.15Å
38	I	61.6	Low	67.1	Low	156 Å²	156	107.2 Å²	107.2	80%	0.8	63%	0.632	S	S	*	*			trans	-79.8	96.5	170.8	-58.4	176	0	0	0	106.8	I40	I38-I40 HydrophobicContact CG2-CG1 4.22Å; I38-I40 PolarHBondContact O-N 2.74Å
39	Q	63	Low	66.9	Low	160 Å²	160	108.4 Å²	108.4	75%	0.748	64%	0.636	S	S	*	*			trans	-89.4	104.8	171.9	-166.3	172.5	-21.8	0	0	108.7	T37 I41	T37-Q39 PolarHBondContact O-N 3.28Å; T37-Q39 VanDerWaalsContact O-N 3.15Å; Q39-I41 PolarHBondContact O-N 3.46Å; Q39-I41 VanDerWaalsContact O-N 3.11Å
40	I	69.2	Low	67	Low	145 Å²	145	112.6 Å²	112.6	74%	0.744	65%	0.653	S	S	*	*			trans	-73.1	105.6	174.2	-58	175.5	0	0	0	107.3	I38 A42	I38-I40 HydrophobicContact CG2-CG1 4.22Å; I38-I40 PolarHBondContact O-N 2.74Å; I40-A42 PolarHBondContact O-N 3.4Å; I40-A42 VanDerWaalsContact O-N 3.12Å
41	I	68.6	Low	67.2	Low	127 Å²	127	110.6 Å²	110.6	65%	0.651	64%	0.641	S	S	*	*			trans	-73.7	101.6	170.1	-57.5	171.5	0	0	0	106	Q39 E43	Q39-I41 PolarHBondContact O-N 3.46Å; Q39-I41 VanDerWaalsContact O-N 3.11Å; I41-E43 HydrophobicContact CG2-CB 3.97Å; I41-E43 PolarHBondContact O-N 2.91Å
42	A	71.6	Confident	67.6	Low	96 Å²	96	113.8 Å²	113.8	79%	0.793	64%	0.638	S	S	*	*			trans	-75.3	-4.1	178.2	0	0	0	0	0	112.8	I40	I40-A42 PolarHBondContact O-N 3.4Å; I40-A42 VanDerWaalsContact O-N 3.12Å
43	E	70.2	Confident	68.4	Low	81 Å²	81	114.1 Å²	114.1	38%	0.379	63%	0.63	S	S	.	*	S	Bend	trans	-76.4	130.4	178.3	-69.2	177.5	146.4	0	0	110.8	I41 P49 Q50	I41-E43 HydrophobicContact CG2-CB 3.97Å; I41-E43 PolarHBondContact O-N 2.91Å; E43-P49 WeakPolarHBondContact OE2-CA 3.3Å; E43-P49 VanDerWaalsContact OE2-CB 3.23Å; E43-P49 WeakPolarHBondContact OE2-CB 3.09Å; E43-Q50 PolarHBondContact OE1-N 3.43Å
44	P	74.6	Confident	69.2	Low	82 Å²	82	116.9 Å²	116.9	53%	0.532	64%	0.636	S	S	.	*			trans	-59.6	144.9	174.1	-19.9	30.5	0	0	0	111.7	D46 V47	P44-D46 PolarHBondContact O-N 3.31Å; P44-V47 HydrophobicContact CB-CG2 4.37Å; P44-V47 HydrophobicContact CG-CG2 4.47Å; P44-V47 PolarHBondContact O-N 3.47Å; P44-V47 VanDerWaalsContact O-N 3.11Å
45	S	74.8	Confident	69.8	Low	116 Å²	116	114 Å²	114	81%	0.811	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.5	-20.1	-178.7	63.8	0	0	0	0	114.6	V47	S45-V47 VanDerWaalsContact C-N 3.34Å
46	D	79	Confident	70.7	Confident	125 Å²	125	111.3 Å²	111.3	67%	0.668	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.2	-0.6	-173	-55.3	-25.3	0	0	0	112.7	P44 R262	P44-D46 PolarHBondContact O-N 3.31Å; D46-R262 PolarHBondContact O-NH1 2.74Å
47	V	68.7	Low	71.6	Confident	73 Å²	73	111.2 Å²	111.2	44%	0.442	60%	0.604	S	S	.	*	S	Bend	trans	-117.4	123.3	179.1	-171.7	0	0	0	0	108.7	P44 S45	P44-V47 HydrophobicContact CB-CG2 4.37Å; P44-V47 HydrophobicContact CG-CG2 4.47Å; P44-V47 PolarHBondContact O-N 3.47Å; P44-V47 VanDerWaalsContact O-N 3.11Å; S45-V47 VanDerWaalsContact C-N 3.34Å
48	P	68.3	Low	72.3	Confident	82 Å²	82	108.5 Å²	108.5	53%	0.532	59%	0.593	S	S	.	*			trans	-61.2	143	173	26.1	-33	0	0	0	109.2	Q50	P48-Q50 PolarHBondContact O-N 2.83Å
49	P	70.4	Confident	72.8	Confident	81 Å²	81	106.3 Å²	106.3	53%	0.526	58%	0.582	S	S	.	*			trans	-56.7	139.1	-177	21.5	-32.4	0	0	0	111.1	E43 I51	E43-P49 WeakPolarHBondContact OE2-CA 3.3Å; E43-P49 VanDerWaalsContact OE2-CB 3.23Å; E43-P49 WeakPolarHBondContact OE2-CB 3.09Å; P49-I51 VanDerWaalsContact C-N 3.28Å; P49-I51 PolarHBondContact O-N 3.37Å
50	Q	70.1	Confident	73.3	Confident	164 Å²	164	103.1 Å²	103.1	77%	0.766	57%	0.57	S	S	*	*			trans	-76.6	84.9	174.4	-67.7	-164.1	-4.3	0	0	109.5	E43 P48 R52	E43-Q50 PolarHBondContact OE1-N 3.43Å; P48-Q50 PolarHBondContact O-N 2.83Å; Q50-R52 PolarHBondContact O-N 2.93Å
51	I	71.6	Confident	73.1	Confident	103 Å²	103	98.7 Å²	98.7	53%	0.528	55%	0.554	S	S	.	*			trans	-69.5	117.4	174.3	-53.2	172.8	0	0	0	107.7	P49 I55 V56	P49-I51 VanDerWaalsContact C-N 3.28Å; P49-I51 PolarHBondContact O-N 3.37Å; I51-I55 HydrophobicContact CG2-CB 3.96Å; I51-I55 HydrophobicContact CG2-CG2 3.99Å; I51-V56 HydrophobicContact CB-CG2 4.21Å; I51-V56 HydrophobicContact CG2-CG2 3.61Å
52	R	77.8	Confident	72.6	Confident	177 Å²	177	97.6 Å²	97.6	67%	0.668	55%	0.554	S	S	*	*			trans	-58.1	139.4	177.3	-60.8	180	73.7	153.5	7.1	110.1	Q50 E54 I55 V56	Q50-R52 PolarHBondContact O-N 2.93Å; R52-E54 WeakPolarHBondContact CB-OE2 3.5Å; R52-E54 IonicContact NE-OE2 3.53Å; R52-E54 PolarHBondContact O-N 3.36Å; R52-E54 VanDerWaalsContact O-N 3.13Å; R52-I55 HydrophobicContact CB-CD1 4.15Å; R52-I55 HydrophobicContact CB-CG1 4.29Å; R52-I55 WeakPolarHBondContact O-CB 3.43Å; R52-I55 PolarHBondContact O-N 3.28Å; R52-V56 PolarHBondContact O-N 3.28Å
53	S	77.6	Confident	71.9	Confident	67 Å²	67	98.7 Å²	98.7	47%	0.469	54%	0.542	S	S	.	.	H	α-helix	trans	-55.7	-35.2	-178	-159.8	0	0	0	0	111.4	I55 V56 H57	S53-I55 VanDerWaalsContact C-N 3.28Å; S53-I55 PolarHBondContact O-N 3.21Å; S53-V56 PolarHBondContact O-N 3.16Å; S53-V56 VanDerWaalsContact O-N 3.16Å; S53-H57 WeakPolarHBondContact O-CB 3.42Å; S53-H57 PolarHBondContact O-CD2 3.3Å; S53-H57 PolarHBondContact O-N 2.93Å; S53-H57 PolarHBondContact OG-CD2 3.13Å; S53-H57 VanDerWaalsContact OG-CD2 3.28Å
54	E	78.7	Confident	71.1	Confident	123 Å²	123	102.1 Å²	102.1	58%	0.575	56%	0.558	S	S	*	*	H	α-helix	trans	-61.8	-34.3	177.9	-58.3	77.8	-151.8	0	0	112.8	R52 A58	R52-E54 WeakPolarHBondContact CB-OE2 3.5Å; R52-E54 IonicContact NE-OE2 3.53Å; R52-E54 PolarHBondContact O-N 3.36Å; R52-E54 VanDerWaalsContact O-N 3.13Å; E54-A58 VanDerWaalsContact O-CB 3.25Å; E54-A58 WeakPolarHBondContact O-CB 3.39Å; E54-A58 PolarHBondContact O-N 2.76Å
55	I	76	Confident	69.7	Low	87 Å²	87	106 Å²	106	45%	0.446	57%	0.569	S	S	.	*	H	α-helix	trans	-71.2	-43.1	176.8	-59.9	170.6	0	0	0	109.5	I51 R52 S53 A58 L59	I51-I55 HydrophobicContact CG2-CB 3.96Å; I51-I55 HydrophobicContact CG2-CG2 3.99Å; R52-I55 HydrophobicContact CB-CD1 4.15Å; R52-I55 HydrophobicContact CB-CG1 4.29Å; R52-I55 WeakPolarHBondContact O-CB 3.43Å; R52-I55 PolarHBondContact O-N 3.28Å; S53-I55 VanDerWaalsContact C-N 3.28Å; S53-I55 PolarHBondContact O-N 3.21Å; I55-A58 PolarHBondContact O-N 3.38Å; I55-L59 HydrophobicContact CG2-CD1 3.93Å; I55-L59 WeakPolarHBondContact O-CB 3.3Å; I55-L59 WeakPolarHBondContact O-CD1 3.45Å; I55-L59 VanDerWaalsContact O-CG 3.3Å; I55-L59 WeakPolarHBondContact O-CG 3.43Å; I55-L59 PolarHBondContact O-N 3.23Å
56	V	76.9	Confident	68.4	Low	57 Å²	57	107.4 Å²	107.4	35%	0.345	57%	0.567	S	S	.	*	H	α-helix	trans	-62.3	-46	175.6	-176.6	0	0	0	0	110.3	I51 R52 S53 L59 L60	I51-V56 HydrophobicContact CB-CG2 4.21Å; I51-V56 HydrophobicContact CG2-CG2 3.61Å; R52-V56 PolarHBondContact O-N 3.28Å; S53-V56 PolarHBondContact O-N 3.16Å; S53-V56 VanDerWaalsContact O-N 3.16Å; V56-L59 PolarHBondContact O-N 3.34Å; V56-L60 HydrophobicContact CG1-CD1 3.78Å; V56-L60 HydrophobicContact CG1-CG 4.27Å; V56-L60 VanDerWaalsContact O-CB 3.32Å; V56-L60 WeakPolarHBondContact O-CB 3.37Å; V56-L60 WeakPolarHBondContact O-CG 3.5Å; V56-L60 PolarHBondContact O-N 2.78Å
57	H	75.6	Confident	66.7	Low	120 Å²	120	104.9 Å²	104.9	56%	0.556	56%	0.558	S	S	*	*	H	α-helix	trans	-63	-41.2	175.9	-86.3	-77.9	0	0	0	112.2	S53 L60 A61	S53-H57 WeakPolarHBondContact O-CB 3.42Å; S53-H57 PolarHBondContact O-CD2 3.3Å; S53-H57 PolarHBondContact O-N 2.93Å; S53-H57 PolarHBondContact OG-CD2 3.13Å; S53-H57 VanDerWaalsContact OG-CD2 3.28Å; H57-L60 PolarHBondContact O-N 3.09Å; H57-A61 WeakPolarHBondContact O-CA 3.34Å; H57-A61 WeakPolarHBondContact O-CB 3.21Å; H57-A61 PolarHBondContact O-N 3.49Å
58	A	73.8	Confident	65.4	Low	56 Å²	56	104.3 Å²	104.3	46%	0.463	57%	0.566	S	S	.	*	H	α-helix	trans	-63	-47.2	175.7	0	0	0	0	0	111.1	E54 I55 L60 A61 T62	E54-A58 VanDerWaalsContact O-CB 3.25Å; E54-A58 WeakPolarHBondContact O-CB 3.39Å; E54-A58 PolarHBondContact O-N 2.76Å; I55-A58 PolarHBondContact O-N 3.38Å; A58-L60 PolarHBondContact O-N 3.15Å; A58-A61 PolarHBondContact O-N 3.12Å; A58-T62 VanDerWaalsContact O-CG2 3.3Å; A58-T62 WeakPolarHBondContact O-CG2 3.32Å; A58-T62 PolarHBondContact O-N 3.47Å; A58-T62 PolarHBondContact O-OG1 3.25Å
59	L	72.3	Confident	64.2	Low	111 Å²	111	107 Å²	107	58%	0.581	58%	0.576	S	S	*	*	H	α-helix	trans	-60.3	-44.5	176	-74.1	162.4	0	0	0	111.7	I55 V56 T62 H63	I55-L59 HydrophobicContact CG2-CD1 3.93Å; I55-L59 WeakPolarHBondContact O-CB 3.3Å; I55-L59 WeakPolarHBondContact O-CD1 3.45Å; I55-L59 VanDerWaalsContact O-CG 3.3Å; I55-L59 WeakPolarHBondContact O-CG 3.43Å; I55-L59 PolarHBondContact O-N 3.23Å; V56-L59 PolarHBondContact O-N 3.34Å; L59-T62 PolarHBondContact O-OG1 3.41Å; L59-H63 PolarHBondContact O-N 2.86Å
60	L	74.8	Confident	62.9	Low	93 Å²	93	109.7 Å²	109.7	49%	0.487	59%	0.586	S	S	.	*	H	α-helix	trans	-66.7	-41.9	176.4	-71.7	172.9	0	0	0	111.8	V56 H57 A58 T62 H63 E64	V56-L60 HydrophobicContact CG1-CD1 3.78Å; V56-L60 HydrophobicContact CG1-CG 4.27Å; V56-L60 VanDerWaalsContact O-CB 3.32Å; V56-L60 WeakPolarHBondContact O-CB 3.37Å; V56-L60 WeakPolarHBondContact O-CG 3.5Å; V56-L60 PolarHBondContact O-N 2.78Å; H57-L60 PolarHBondContact O-N 3.09Å; A58-L60 PolarHBondContact O-N 3.15Å; L60-T62 PolarHBondContact O-N 3.34Å; L60-H63 CarbonylContact O-C 3.43Å; L60-H63 WeakPolarHBondContact O-CA 3.33Å; L60-H63 WeakPolarHBondContact O-CB 3.25Å; L60-H63 PolarHBondContact O-N 3.22Å; L60-E64 WeakPolarHBondContact O-CG 3.49Å; L60-E64 PolarHBondContact O-N 3.36Å
61	A	63.6	Low	61.9	Low	51 Å²	51	105.8 Å²	105.8	42%	0.421	59%	0.59	S	S	.	*	H	α-helix	trans	-65.2	-37.7	178.6	0	0	0	0	0	111.9	H57 A58 H63 E64 Q65	H57-A61 WeakPolarHBondContact O-CA 3.34Å; H57-A61 WeakPolarHBondContact O-CB 3.21Å; H57-A61 PolarHBondContact O-N 3.49Å; A58-A61 PolarHBondContact O-N 3.12Å; A61-H63 PolarHBondContact O-N 3.25Å; A61-E64 PolarHBondContact O-N 3.48Å; A61-Q65 PolarHBondContact O-N 3.06Å
62	T	57.9	Low	61	Low	104 Å²	104	105.7 Å²	105.7	64%	0.638	60%	0.595	S	S	*	*	H	α-helix	trans	-64	-24.4	170.5	61.9	0	0	0	0	112.7	A58 L59 L60	A58-T62 VanDerWaalsContact O-CG2 3.3Å; A58-T62 WeakPolarHBondContact O-CG2 3.32Å; A58-T62 PolarHBondContact O-N 3.47Å; A58-T62 PolarHBondContact O-OG1 3.25Å; L59-T62 PolarHBondContact O-OG1 3.41Å; L60-T62 PolarHBondContact O-N 3.34Å
63	H	56.6	Low	60	Low	120 Å²	120	104.5 Å²	104.5	56%	0.556	60%	0.597	S	S	*	*	H	α-helix	trans	-94.1	-16.1	178	-161.8	-68.8	0	0	0	113.1	L59 L60 A61 K208	L59-H63 PolarHBondContact O-N 2.86Å; L60-H63 CarbonylContact O-C 3.43Å; L60-H63 WeakPolarHBondContact O-CA 3.33Å; L60-H63 WeakPolarHBondContact O-CB 3.25Å; L60-H63 PolarHBondContact O-N 3.22Å; A61-H63 PolarHBondContact O-N 3.25Å; H63-K208 PolarHBondContact NE2-NZ 3.16Å
64	E	53.6	Low	58.9	Low	153 Å²	153	106.8 Å²	106.8	72%	0.715	60%	0.601	S	S	*	*	H	α-helix	trans	-94.8	-8.4	178	-76.8	-170.7	149	0	0	113.9	L60 A61 L66	L60-E64 WeakPolarHBondContact O-CG 3.49Å; L60-E64 PolarHBondContact O-N 3.36Å; A61-E64 PolarHBondContact O-N 3.48Å; E64-L66 PolarHBondContact O-N 3.03Å
65	Q	45.2	Very low	58.3	Low	162 Å²	162	105.3 Å²	105.3	76%	0.757	61%	0.61	S	S	*	*			trans	-71.1	70.4	164	-74.9	-175.8	-46.6	0	0	110.3	A61 P67	A61-Q65 PolarHBondContact O-N 3.06Å; Q65-P67 WeakPolarHBondContact O-CD 3.23Å
66	L	49	Very low	58.2	Low	147 Å²	147	101.9 Å²	101.9	77%	0.77	59%	0.594	S	S	*	*			trans	-75.2	112.5	159.5	-73.7	162.8	0	0	0	107	E64 G68	E64-L66 PolarHBondContact O-N 3.03Å; L66-G68 PolarHBondContact O-N 2.93Å
67	P	42.7	Very low	58.7	Low	72 Å²	72	104 Å²	104	47%	0.468	60%	0.601	S	S	.	*			trans	-66.4	128.5	168.2	-0.7	16.5	0	0	0	107	Q65 M74	Q65-P67 WeakPolarHBondContact O-CD 3.23Å; P67-M74 HydrophobicContact CG-SD 4.38Å
68	G	41	Very low	59.5	Low	61 Å²	61	98.9 Å²	98.9	63%	0.629	58%	0.577	S	S	*	*			trans	-49	144.9	171.5	0	0	0	0	0	111.4	L66 N70	L66-G68 PolarHBondContact O-N 2.93Å; G68-N70 VanDerWaalsContact C-N 3.32Å; G68-N70 PolarHBondContact O-N 3.02Å
69	D	44.1	Very low	60.4	Low	137 Å²	137	97.8 Å²	97.8	73%	0.733	56%	0.563	S	S	*	*	S	Bend	trans	-44.3	85.5	177.5	-172.2	34.1	0	0	0	112.8	K172	D69-K172 IonicContact OD1-NZ 3.59Å
70	N	41.3	Very low	61.6	Low	138 Å²	138	94 Å²	94	74%	0.738	54%	0.544	S	S	*	.	S	Bend	trans	-154.3	80.7	170.9	-86.8	-28.2	0	0	0	108	G68 T72	G68-N70 VanDerWaalsContact C-N 3.32Å; G68-N70 PolarHBondContact O-N 3.02Å; N70-T72 PolarHBondContact O-N 2.92Å; N70-T72 PolarHBondContact O-OG1 2.93Å
71	G	50.9	Low	62.6	Low	83 Å²	83	93 Å²	93	86%	0.856	54%	0.539	S	S	*	.			trans	50.5	11	156.2	0	0	0	0	0	120.3	E73	G71-E73 PolarHBondContact O-N 2.8Å
72	T	51.8	Low	64.1	Low	101 Å²	101	92 Å²	92	62%	0.62	53%	0.525	S	S	*	.			trans	-85.2	115.1	-167.8	-52.7	0	0	0	0	109.7	N70 M74	N70-T72 PolarHBondContact O-N 2.92Å; N70-T72 PolarHBondContact O-OG1 2.93Å; T72-M74 PolarHBondContact O-N 3.44Å
73	E	56	Low	65.8	Low	152 Å²	152	93.8 Å²	93.8	71%	0.71	53%	0.526	S	S	*	.			trans	-56.7	96.8	174	-71.2	-166	160.3	0	0	110.8	G71 V169	G71-E73 PolarHBondContact O-N 2.8Å; E73-V169 HydrophobicContact CB-CB 4.42Å; E73-V169 HydrophobicContact CB-CG1 3.42Å; E73-V169 VanDerWaalsContact CB-CG1 3.42Å; E73-V169 HydrophobicContact CB-CG2 4.13Å; E73-V169 HydrophobicContact CG-CG1 3.65Å
74	M	55.6	Low	67.7	Low	115 Å²	115	90.6 Å²	90.6	57%	0.567	51%	0.512	S	S	*	.			trans	-81.8	137	173.5	-70.4	-177.3	66.3	0	0	110.1	P67 T72 A76 A170	P67-M74 HydrophobicContact CG-SD 4.38Å; T72-M74 PolarHBondContact O-N 3.44Å; M74-A76 PolarHBondContact O-N 2.99Å; M74-A170 PolarHBondContact O-N 2.87Å
75	A	66.7	Low	69.7	Low	91 Å²	91	84.5 Å²	84.5	75%	0.752	49%	0.486	S	S	*	.	B	Isolated β-bridge	trans	-52.4	126.4	172.9	0	0	0	0	0	110	E77	A75-E77 PolarHBondContact O-N 3.11Å
76	A	72.4	Confident	72	Confident	15 Å²	15	79.6 Å²	79.6	12%	0.124	47%	0.468	C	S	.	.			trans	-75.9	106.8	-176.4	0	0	0	0	0	110.7	M74 W78 P167 A168 A170	M74-A76 PolarHBondContact O-N 2.99Å; A76-W78 PolarHBondContact O-N 3.35Å; A76-P167 VanDerWaalsContact CB-O 3.29Å; A76-P167 WeakPolarHBondContact CB-O 3.46Å; A76-A168 WeakPolarHBondContact CB-O 3.25Å; A76-A168 PolarHBondContact N-O 3.14Å; A76-A170 HydrophobicContact CB-CB 3.55Å
77	E	88	Confident	74.1	Confident	102 Å²	102	76 Å²	76	48%	0.477	46%	0.455	S	S	.	.			trans	-78.3	116.8	159.6	-169.2	173.8	-170	0	0	108.6	A75 S203 D204	A75-E77 PolarHBondContact O-N 3.11Å; E77-S203 CarbonylContact O-C 3.35Å; E77-S203 WeakPolarHBondContact O-CA 3.21Å; E77-D204 HydrophobicContact CB-CB 4.08Å; E77-D204 HydrophobicContact CG-CB 4.4Å; E77-D204 PolarHBondContact O-N 3.36Å
78	W	92.5	Very high	76.6	Confident	13 Å²	13	75.9 Å²	75.9	5%	0.049	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	153.9	177.1	-70.5	89.1	0	0	0	110.6	A76 L108 T166 P167 K174 I177 I201 I202	A76-W78 PolarHBondContact O-N 3.35Å; W78-L108 HydrophobicContact CB-CD1 3.87Å; W78-L108 HydrophobicContact CB-CD2 3.99Å; W78-L108 WeakPolarHBondContact O-CD1 3.1Å; W78-T166 HydrophobicContact CG-CG2 4.42Å; W78-P167 HydrophobicContact CH2-CG 4.49Å; W78-P167 HydrophobicContact CZ2-CB 4.09Å; W78-P167 HydrophobicContact CZ2-CG 3.83Å; W78-P167 PolarHBondContact NE1-O 2.79Å; W78-K174 WeakPolarHBondContact CH2-O 3.38Å; W78-I177 HydrophobicContact CH2-CD1 3.97Å; W78-I177 HydrophobicContact CH2-CG1 4.16Å; W78-I177 HydrophobicContact CZ2-CD1 4.43Å; W78-I177 HydrophobicContact CZ3-CD1 4.16Å; W78-I177 HydrophobicContact CZ3-CG1 4.22Å; W78-I201 HydrophobicContact CE3-CB 4.36Å; W78-I201 HydrophobicContact CE3-CD1 4.18Å; W78-I201 HydrophobicContact CE3-CG1 4.06Å; W78-I201 HydrophobicContact CZ3-CG1 4.33Å; W78-I202 CarbonylContact C-O 3.54Å
79	I	93.3	Very high	79.1	Confident	33 Å²	33	78.4 Å²	78.4	17%	0.169	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	139.3	179.5	-60.4	172.2	0	0	0	109.3	N81 I201 I202 D204	I79-N81 PolarHBondContact O-N 2.94Å; I79-I201 VanDerWaalsContact O-CA 3.28Å; I79-I201 WeakPolarHBondContact O-CA 3.33Å; I79-I202 PolarHBondContact N-O 3.22Å; I79-I202 PolarHBondContact O-N 3.24Å; I79-D204 HydrophobicContact CD1-CB 3.94Å; I79-D204 VanDerWaalsContact CD1-OD1 3.3Å; I79-D204 WeakPolarHBondContact CD1-OD1 3.36Å
80	V	95.9	Very high	81.5	Confident	32 Å²	32	75.8 Å²	75.8	19%	0.194	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	115.8	169.2	176.4	0	0	0	0	109.3	F82 L108 L115 I201	V80-F82 HydrophobicContact CG1-CD1 3.7Å; V80-F82 HydrophobicContact CG1-CD2 3.93Å; V80-F82 HydrophobicContact CG1-CE1 3.47Å; V80-F82 VanDerWaalsContact CG1-CE1 3.47Å; V80-F82 HydrophobicContact CG1-CE2 3.69Å; V80-F82 HydrophobicContact CG1-CG 3.95Å; V80-F82 HydrophobicContact CG1-CZ 3.46Å; V80-F82 VanDerWaalsContact CG1-CZ 3.46Å; V80-L108 HydrophobicContact CG2-CD1 4.04Å; V80-L108 HydrophobicContact CG2-CG 4.04Å; V80-L115 HydrophobicContact CG2-CD1 3.78Å; V80-I201 HydrophobicContact CG2-CG2 4.26Å
81	N	95.8	Very high	84	Confident	71 Å²	71	71 Å²	71	38%	0.38	42%	0.415	S	S	.	.			trans	-110.1	48.4	-176.6	-165.4	51.2	0	0	0	112.6	I79 E200 I202 R210	I79-N81 PolarHBondContact O-N 2.94Å; N81-E200 HydrophobicContact CB-CG 4.1Å; N81-E200 PolarHBondContact N-O 3.3Å; N81-E200 PolarHBondContact ND2-OE1 3.18Å; N81-I202 HydrophobicContact CB-CD1 3.83Å; N81-I202 HydrophobicContact CB-CG1 3.9Å; N81-I202 HydrophobicContact CB-CG2 4.39Å; N81-R210 PolarHBondContact ND2-NH1 2.68Å
82	F	95.3	Very high	86.1	Confident	29 Å²	29	67.4 Å²	67.4	13%	0.127	38%	0.376	C	S	.	.	S	Bend	trans	-148.4	160	169.3	54.3	-95.1	0	0	0	109.8	V80 L103 A106 F179 Y199 E200	V80-F82 HydrophobicContact CG1-CD1 3.7Å; V80-F82 HydrophobicContact CG1-CD2 3.93Å; V80-F82 HydrophobicContact CG1-CE1 3.47Å; V80-F82 VanDerWaalsContact CG1-CE1 3.47Å; V80-F82 HydrophobicContact CG1-CE2 3.69Å; V80-F82 HydrophobicContact CG1-CG 3.95Å; V80-F82 HydrophobicContact CG1-CZ 3.46Å; V80-F82 VanDerWaalsContact CG1-CZ 3.46Å; F82-L103 HydrophobicContact CE2-CD2 3.82Å; F82-L103 HydrophobicContact CZ-CD2 4Å; F82-A106 HydrophobicContact CE2-CB 4.29Å; F82-A106 HydrophobicContact CZ-CB 3.79Å; F82-F179 AromaticContact CE1-CE1 3.98Å; F82-F179 HydrophobicContact CE1-CE1 3.98Å; F82-F179 HydrophobicContact CE1-CZ 4.03Å; F82-F179 HydrophobicContact CZ-CE1 4.36Å; F82-F179 AromaticContact CZ-CZ 3.96Å; F82-F179 HydrophobicContact CZ-CZ 3.96Å; F82-Y199 HydrophobicContact CB-CD1 4.38Å; F82-Y199 AromaticContact CD1-CD1 3.94Å; F82-Y199 HydrophobicContact CD1-CD1 3.94Å; F82-Y199 HydrophobicContact CD1-CG 4.49Å; F82-Y199 AromaticContact CD2-CD1 3.59Å; F82-Y199 HydrophobicContact CD2-CD1 3.59Å; F82-Y199 HydrophobicContact CD2-CE1 4.05Å; F82-Y199 HydrophobicContact CE1-CD1 4.01Å; F82-Y199 HydrophobicContact CE1-CG 4.34Å; F82-Y199 AromaticContact CE2-CD1 3.69Å; F82-Y199 HydrophobicContact CE2-CD1 3.69Å; F82-Y199 HydrophobicContact CE2-CE1 4.2Å; F82-Y199 AromaticContact CG-CD1 3.72Å; F82-Y199 HydrophobicContact CG-CD1 3.72Å; F82-Y199 HydrophobicContact CG-CE1 4.5Å; F82-Y199 AromaticContact CZ-CD1 3.88Å; F82-Y199 HydrophobicContact CZ-CD1 3.88Å; F82-Y199 HydrophobicContact CZ-CG 4.38Å; F82-E200 VanDerWaalsContact CD1-O 3.23Å; F82-E200 WeakPolarHBondContact CD1-O 3.42Å
83	E	95	Very high	88.2	Confident	142 Å²	142	68.7 Å²	68.7	66%	0.664	37%	0.37	S	S	*	.			trans	-71.5	130.2	171.7	-174	178	178.3	0	0	109.9	P85 S87	E83-P85 WeakPolarHBondContact O-CD 3.29Å; E83-S87 WeakPolarHBondContact CG-OG 3.47Å; E83-S87 PolarHBondContact OE1-OG 3.18Å
84	Q	96.1	Very high	90.1	Very high	54 Å²	54	68.1 Å²	68.1	25%	0.252	36%	0.361	S	S	.	.			trans	-58.5	119.4	176.8	-66.9	-67.6	-33.6	0	0	109.5	C86 S87 N105 A106	Q84-C86 PolarHBondContact O-N 3.29Å; Q84-C86 VanDerWaalsContact O-N 3.07Å; Q84-S87 VanDerWaalsContact O-CB 3.25Å; Q84-S87 WeakPolarHBondContact O-CB 3.4Å; Q84-S87 PolarHBondContact O-N 2.9Å; Q84-S87 PolarHBondContact O-OG 2.71Å; Q84-N105 VanDerWaalsContact OE1-CA 3.25Å; Q84-A106 PolarHBondContact NE2-O 3.19Å; Q84-A106 PolarHBondContact OE1-O 3.12Å
85	P	95.5	Very high	91.9	Very high	25 Å²	25	64.4 Å²	64.4	16%	0.162	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-55.6	-36.6	-173.1	-29.6	36.8	0	0	0	113.7	E83 S87 N88 F92 L103 Y199	E83-P85 WeakPolarHBondContact O-CD 3.29Å; P85-S87 PolarHBondContact O-N 3.05Å; P85-N88 PolarHBondContact O-N 2.56Å; P85-F92 HydrophobicContact CB-CD2 4.04Å; P85-F92 WeakPolarHBondContact O-CB 3.44Å; P85-L103 WeakPolarHBondContact CB-O 3.41Å; P85-L103 HydrophobicContact CG-CB 4.14Å; P85-L103 HydrophobicContact CG-CD2 4.23Å; P85-L103 HydrophobicContact CG-CG 4.29Å; P85-L103 VanDerWaalsContact CG-O 3.26Å; P85-L103 WeakPolarHBondContact CG-O 3.38Å; P85-Y199 HydrophobicContact CG-CE1 3.97Å
86	C	92.6	Very high	93.3	Very high	58 Å²	58	60.1 Å²	60.1	39%	0.392	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-71.1	-7.4	177.5	73.5	0	0	0	0	115.2	Q84 N88 E104	Q84-C86 PolarHBondContact O-N 3.29Å; Q84-C86 VanDerWaalsContact O-N 3.07Å; C86-N88 PolarHBondContact O-N 3.15Å; C86-E104 HydrophobicContact CB-CG 4.37Å; C86-E104 VanDerWaalsContact CB-O 3.27Å; C86-E104 WeakPolarHBondContact CB-O 3.47Å; C86-E104 PolarHBondContact N-O 3.38Å; C86-E104 VanDerWaalsContact N-O 3.11Å; C86-E104 PolarHBondContact SG-O 2.95Å
87	S	94.6	Very high	94.4	Very high	72 Å²	72	62.4 Å²	62.4	50%	0.503	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-61.7	-35.5	172.8	65.6	0	0	0	0	111.1	E83 Q84 P85	E83-S87 WeakPolarHBondContact CG-OG 3.47Å; E83-S87 PolarHBondContact OE1-OG 3.18Å; Q84-S87 VanDerWaalsContact O-CB 3.25Å; Q84-S87 WeakPolarHBondContact O-CB 3.4Å; Q84-S87 PolarHBondContact O-N 2.9Å; Q84-S87 PolarHBondContact O-OG 2.71Å; P85-S87 PolarHBondContact O-N 3.05Å
88	N	93.6	Very high	94.8	Very high	70 Å²	70	63.9 Å²	63.9	37%	0.374	33%	0.325	S	S	.	.	S	Bend	trans	-111.1	86.4	176.3	-172.1	-25.1	0	0	0	110.2	P85 C86 S90 S91 F92	P85-N88 PolarHBondContact O-N 2.56Å; C86-N88 PolarHBondContact O-N 3.15Å; N88-S90 VanDerWaalsContact C-N 3.26Å; N88-S90 PolarHBondContact O-N 3.35Å; N88-S90 PolarHBondContact OD1-N 2.85Å; N88-S91 VanDerWaalsContact CG-OG 3.32Å; N88-S91 PolarHBondContact ND2-OG 2.82Å; N88-S91 VanDerWaalsContact ND2-OG 3.13Å; N88-S91 PolarHBondContact O-N 3.22Å; N88-S91 PolarHBondContact OD1-N 3.35Å; N88-S91 VanDerWaalsContact OD1-N 3.12Å; N88-S91 PolarHBondContact OD1-OG 2.83Å; N88-F92 WeakPolarHBondContact O-CB 3.3Å; N88-F92 PolarHBondContact O-N 2.82Å
89	H	93.4	Very high	94.9	Very high	114 Å²	114	66.8 Å²	66.8	53%	0.528	34%	0.336	S	S	.	.	H	α-helix	trans	-56	-36.9	-176.4	-179.3	-103.8	0	0	0	113.9	R93	H89-R93 WeakPolarHBondContact CE1-CD 3.42Å; H89-R93 WeakPolarHBondContact NE2-CD 3.38Å; H89-R93 WeakPolarHBondContact O-CB 2.95Å; H89-R93 WeakPolarHBondContact O-CG 3.45Å; H89-R93 PolarHBondContact O-N 3.25Å
90	S	95.4	Very high	95.1	Very high	81 Å²	81	66.3 Å²	66.3	57%	0.566	33%	0.334	S	S	*	.	H	α-helix	trans	-67.7	-47	179.8	-63	0	0	0	0	111.9	N88 R94	N88-S90 VanDerWaalsContact C-N 3.26Å; N88-S90 PolarHBondContact O-N 3.35Å; N88-S90 PolarHBondContact OD1-N 2.85Å; S90-R94 WeakPolarHBondContact O-CB 3.36Å; S90-R94 PolarHBondContact O-N 2.68Å
91	S	93.8	Very high	95.3	Very high	37 Å²	37	64.8 Å²	64.8	26%	0.259	33%	0.325	S	S	.	.	H	α-helix	trans	-66.9	-42.5	176.9	-62.9	0	0	0	0	111.4	N88 R93 R94 N95	N88-S91 VanDerWaalsContact CG-OG 3.32Å; N88-S91 PolarHBondContact ND2-OG 2.82Å; N88-S91 VanDerWaalsContact ND2-OG 3.13Å; N88-S91 PolarHBondContact O-N 3.22Å; N88-S91 PolarHBondContact OD1-N 3.35Å; N88-S91 VanDerWaalsContact OD1-N 3.12Å; N88-S91 PolarHBondContact OD1-OG 2.83Å; S91-R93 PolarHBondContact O-N 3.45Å; S91-R94 PolarHBondContact O-N 3.29Å; S91-N95 WeakPolarHBondContact O-CB 3.44Å; S91-N95 VanDerWaalsContact O-CG 3.24Å; S91-N95 PolarHBondContact O-N 2.86Å
92	F	95.5	Very high	95.4	Very high	8 Å²	8	61.6 Å²	61.6	4%	0.035	31%	0.308	C	S	.	.	H	α-helix	trans	-56.6	-51.5	174.9	173.9	-107.1	0	0	0	112	P85 N88 R94 N95 L96 A102 L103 E104 R120	P85-F92 HydrophobicContact CB-CD2 4.04Å; P85-F92 WeakPolarHBondContact O-CB 3.44Å; N88-F92 WeakPolarHBondContact O-CB 3.3Å; N88-F92 PolarHBondContact O-N 2.82Å; F92-R94 VanDerWaalsContact C-N 3.33Å; F92-R94 PolarHBondContact O-N 3.25Å; F92-N95 PolarHBondContact O-N 2.9Å; F92-L96 HydrophobicContact CE1-CD2 4.29Å; F92-L96 HydrophobicContact CZ-CD2 4.24Å; F92-L96 VanDerWaalsContact O-CB 3.32Å; F92-L96 WeakPolarHBondContact O-CB 3.48Å; F92-L96 PolarHBondContact O-N 2.96Å; F92-A102 HydrophobicContact CD2-CB 4.07Å; F92-A102 HydrophobicContact CE2-CB 3.66Å; F92-L103 VanDerWaalsContact CE2-O 3.31Å; F92-L103 WeakPolarHBondContact CE2-O 3.49Å; F92-E104 HydrophobicContact CE2-CB 4.18Å; F92-E104 HydrophobicContact CZ-CB 4.08Å; F92-E104 HydrophobicContact CZ-CG 4.29Å; F92-R120 HydrophobicContact CZ-CB 4.03Å
93	R	95	Very high	95.5	Very high	128 Å²	128	60.2 Å²	60.2	48%	0.483	30%	0.302	S	S	.	.	H	α-helix	trans	-62.6	-38.4	178.5	-78.3	-170	68.4	-178.8	6	112.6	H89 S91 N97	H89-R93 WeakPolarHBondContact CE1-CD 3.42Å; H89-R93 WeakPolarHBondContact NE2-CD 3.38Å; H89-R93 WeakPolarHBondContact O-CB 2.95Å; H89-R93 WeakPolarHBondContact O-CG 3.45Å; H89-R93 PolarHBondContact O-N 3.25Å; S91-R93 PolarHBondContact O-N 3.45Å; R93-N97 WeakPolarHBondContact O-CB 3.39Å; R93-N97 PolarHBondContact O-N 3.5Å; R93-N97 VanDerWaalsContact O-N 3.09Å; R93-N97 PolarHBondContact O-ND2 3.04Å
94	R	95.1	Very high	95.6	Very high	140 Å²	140	54.7 Å²	54.7	53%	0.528	28%	0.276	S	S	.	.	H	α-helix	trans	-63	-51.4	176.1	-176.4	-171.7	-61.8	136.3	-0.4	110.6	S90 S91 F92 L96 N97 Q98	S90-R94 WeakPolarHBondContact O-CB 3.36Å; S90-R94 PolarHBondContact O-N 2.68Å; S91-R94 PolarHBondContact O-N 3.29Å; F92-R94 VanDerWaalsContact C-N 3.33Å; F92-R94 PolarHBondContact O-N 3.25Å; R94-L96 PolarHBondContact O-N 3.25Å; R94-N97 PolarHBondContact O-N 2.92Å; R94-Q98 WeakPolarHBondContact O-CG 3.49Å; R94-Q98 PolarHBondContact O-N 2.87Å
95	N	94	Very high	95.6	Very high	37 Å²	37	54.5 Å²	54.5	20%	0.198	28%	0.277	C	S	.	.	H	α-helix	trans	-60.7	-45.7	-178.7	-70.7	-7.5	0	0	0	111.2	S91 F92 N97 Q98 R99	S91-N95 WeakPolarHBondContact O-CB 3.44Å; S91-N95 VanDerWaalsContact O-CG 3.24Å; S91-N95 PolarHBondContact O-N 2.86Å; F92-N95 PolarHBondContact O-N 2.9Å; N95-N97 VanDerWaalsContact C-N 3.34Å; N95-N97 PolarHBondContact O-N 3.23Å; N95-Q98 PolarHBondContact O-N 2.98Å; N95-R99 WeakPolarHBondContact O-CB 3.27Å; N95-R99 PolarHBondContact O-N 3.11Å
96	L	96.4	Very high	95.7	Very high	2 Å²	2	53.4 Å²	53.4	1%	0.01	27%	0.27	C	S	.	.	H	α-helix	trans	-60.2	-41	176.8	179.6	60.8	0	0	0	112.6	F92 R94 N100 A102 R120 Y157	F92-L96 HydrophobicContact CE1-CD2 4.29Å; F92-L96 HydrophobicContact CZ-CD2 4.24Å; F92-L96 VanDerWaalsContact O-CB 3.32Å; F92-L96 WeakPolarHBondContact O-CB 3.48Å; F92-L96 PolarHBondContact O-N 2.96Å; R94-L96 PolarHBondContact O-N 3.25Å; L96-N100 VanDerWaalsContact O-CA 3.23Å; L96-N100 WeakPolarHBondContact O-CA 3.45Å; L96-N100 PolarHBondContact O-N 2.81Å; L96-A102 HydrophobicContact CB-CB 4.07Å; L96-A102 HydrophobicContact CD1-CB 4.12Å; L96-R120 HydrophobicContact CD1-CB 4.25Å; L96-R120 HydrophobicContact CD1-CG 4.37Å; L96-R120 VanDerWaalsContact CD1-O 3.24Å; L96-R120 WeakPolarHBondContact CD1-O 3.47Å; L96-R120 HydrophobicContact CD2-CB 4.12Å; L96-R120 VanDerWaalsContact CD2-CD 3.48Å; L96-R120 HydrophobicContact CD2-CG 3.74Å; L96-Y157 HydrophobicContact CD1-CD1 4.35Å; L96-Y157 HydrophobicContact CD1-CE1 4.46Å; L96-Y157 HydrophobicContact CD2-CD1 3.61Å; L96-Y157 HydrophobicContact CD2-CE1 3.56Å; L96-Y157 HydrophobicContact CD2-CG 4.24Å; L96-Y157 HydrophobicContact CG-CD1 4.01Å; L96-Y157 HydrophobicContact CG-CE1 3.74Å
97	N	95.5	Very high	95.9	Very high	63 Å²	63	54.4 Å²	54.4	34%	0.337	27%	0.274	S	S	.	.	H	α-helix	trans	-70.1	-33.3	178.2	-84.3	-57.9	0	0	0	113.5	R93 R94 N95 Y157	R93-N97 WeakPolarHBondContact O-CB 3.39Å; R93-N97 PolarHBondContact O-N 3.5Å; R93-N97 VanDerWaalsContact O-N 3.09Å; R93-N97 PolarHBondContact O-ND2 3.04Å; R94-N97 PolarHBondContact O-N 2.92Å; N95-N97 VanDerWaalsContact C-N 3.34Å; N95-N97 PolarHBondContact O-N 3.23Å; N97-Y157 PolarHBondContact OD1-OH 2.78Å; N97-Y157 VanDerWaalsContact OD1-OH 3.05Å
98	Q	95.6	Very high	95.9	Very high	133 Å²	133	52.8 Å²	52.8	62%	0.621	26%	0.26	S	S	*	.	H	α-helix	trans	-82.7	-40.7	-178.8	-71.8	176.5	-13	0	0	112.6	R94 N95	R94-Q98 WeakPolarHBondContact O-CG 3.49Å; R94-Q98 PolarHBondContact O-N 2.87Å; N95-Q98 PolarHBondContact O-N 2.98Å
99	R	96.2	Very high	95.9	Very high	73 Å²	73	51.4 Å²	51.4	28%	0.275	25%	0.251	S	S	.	.	H	α-helix	trans	-100.9	-6.8	-173.4	-59.8	-174.3	-176.8	158.2	5.4	113.7	N95 V101 F190 D192	N95-R99 WeakPolarHBondContact O-CB 3.27Å; N95-R99 PolarHBondContact O-N 3.11Å; R99-V101 PolarHBondContact O-N 3.05Å; R99-F190 WeakPolarHBondContact O-CB 3.31Å; R99-D192 IonicContact NH1-OD1 3.55Å
100	N	97.6	Very high	95.6	Very high	24 Å²	24	49 Å²	49	13%	0.128	25%	0.247	C	C	.	.	S	Bend	trans	62.8	-6.9	-176.8	-55.1	-51.4	0	0	0	116.1	L96 V121 K122 L124 Y183 F190	L96-N100 VanDerWaalsContact O-CA 3.23Å; L96-N100 WeakPolarHBondContact O-CA 3.45Å; L96-N100 PolarHBondContact O-N 2.81Å; N100-V121 CarbonylContact O-C 3.55Å; N100-V121 VanDerWaalsContact O-CA 3.31Å; N100-V121 WeakPolarHBondContact O-CA 3.44Å; N100-K122 HydrophobicContact CB-CB 4.13Å; N100-K122 PolarHBondContact O-N 2.97Å; N100-K122 WeakPolarHBondContact OD1-CD 3.44Å; N100-L124 HydrophobicContact CB-CD1 4.18Å; N100-Y183 HydrophobicContact CB-CD1 4.43Å; N100-Y183 HydrophobicContact CB-CE1 4.47Å; N100-F190 HydrophobicContact CB-CD1 4.14Å; N100-F190 HydrophobicContact CB-CD2 4.07Å; N100-F190 HydrophobicContact CB-CE1 4.37Å; N100-F190 HydrophobicContact CB-CE2 4.29Å; N100-F190 HydrophobicContact CB-CG 3.99Å; N100-F190 HydrophobicContact CB-CZ 4.43Å; N100-F190 WeakPolarHBondContact ND2-CD1 3.07Å; N100-F190 WeakPolarHBondContact ND2-CE1 3.39Å; N100-F190 VanDerWaalsContact ND2-CZ 3.32Å; N100-F190 WeakPolarHBondContact ND2-CZ 3.5Å
101	V	98.3	Very high	95.3	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	140.9	174.9	57.3	0	0	0	0	109.1	R99 V119 R120 V121 V181 Y183 F190 D192	R99-V101 PolarHBondContact O-N 3.05Å; V101-V119 HydrophobicContact CG2-CG1 3.72Å; V101-R120 WeakPolarHBondContact CA-O 3.4Å; V101-V121 HydrophobicContact CB-CG1 4.19Å; V101-V121 HydrophobicContact CG2-CG1 3.91Å; V101-V181 HydrophobicContact CG2-CB 4.41Å; V101-V181 HydrophobicContact CG2-CG1 3.74Å; V101-Y183 HydrophobicContact CB-CD1 4.3Å; V101-Y183 HydrophobicContact CB-CG 4.49Å; V101-F190 HydrophobicContact CG1-CB 3.77Å; V101-D192 HydrophobicContact CG1-CB 4.22Å
102	A	98.1	Very high	95.2	Very high	3 Å²	3	55.2 Å²	55.2	3%	0.025	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	138.8	170.7	0	0	0	0	0	110.4	F92 L96 E104 R120 D192	F92-A102 HydrophobicContact CD2-CB 4.07Å; F92-A102 HydrophobicContact CE2-CB 3.66Å; L96-A102 HydrophobicContact CB-CB 4.07Å; L96-A102 HydrophobicContact CD1-CB 4.12Å; A102-E104 PolarHBondContact O-N 3.14Å; A102-R120 PolarHBondContact N-O 3.03Å; A102-R120 PolarHBondContact O-N 3.43Å; A102-D192 VanDerWaalsContact CA-OD2 3.27Å; A102-D192 WeakPolarHBondContact CA-OD2 3.48Å
103	L	98.3	Very high	95	Very high	0 Å²	0	59 Å²	59	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	133	161.9	-177.6	73.1	0	0	0	108.6	F82 P85 F92 A106 T118 V119 F162 F179 V181 D192 Y199	F82-L103 HydrophobicContact CE2-CD2 3.82Å; F82-L103 HydrophobicContact CZ-CD2 4Å; P85-L103 WeakPolarHBondContact CB-O 3.41Å; P85-L103 HydrophobicContact CG-CB 4.14Å; P85-L103 HydrophobicContact CG-CD2 4.23Å; P85-L103 HydrophobicContact CG-CG 4.29Å; P85-L103 VanDerWaalsContact CG-O 3.26Å; P85-L103 WeakPolarHBondContact CG-O 3.38Å; F92-L103 VanDerWaalsContact CE2-O 3.31Å; F92-L103 WeakPolarHBondContact CE2-O 3.49Å; L103-A106 HydrophobicContact CD2-CB 4.42Å; L103-T118 WeakPolarHBondContact CD1-O 3.42Å; L103-V119 HydrophobicContact CD1-CG2 4.18Å; L103-F162 HydrophobicContact CD1-CE1 3.62Å; L103-F162 HydrophobicContact CD1-CZ 3.95Å; L103-F179 HydrophobicContact CD2-CE2 4.22Å; L103-F179 HydrophobicContact CD2-CZ 4.24Å; L103-V181 HydrophobicContact CB-CG2 4.39Å; L103-D192 PolarHBondContact N-OD2 3.27Å; L103-Y199 HydrophobicContact CB-CE1 4.3Å; L103-Y199 HydrophobicContact CB-CE2 3.8Å; L103-Y199 HydrophobicContact CD2-CD1 3.62Å; L103-Y199 HydrophobicContact CD2-CD2 4.04Å; L103-Y199 HydrophobicContact CD2-CE1 3.5Å; L103-Y199 VanDerWaalsContact CD2-CE1 3.5Å; L103-Y199 HydrophobicContact CD2-CE2 3.91Å; L103-Y199 HydrophobicContact CD2-CG 3.9Å; L103-Y199 HydrophobicContact CG-CE2 4.49Å
104	E	97.2	Very high	95	Very high	27 Å²	27	56.1 Å²	56.1	13%	0.126	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	-56.9	177.6	175.7	172.2	150.4	0	0	110	C86 F92 A102 T118 R120 R151	C86-E104 HydrophobicContact CB-CG 4.37Å; C86-E104 VanDerWaalsContact CB-O 3.27Å; C86-E104 WeakPolarHBondContact CB-O 3.47Å; C86-E104 PolarHBondContact N-O 3.38Å; C86-E104 VanDerWaalsContact N-O 3.11Å; C86-E104 PolarHBondContact SG-O 2.95Å; F92-E104 HydrophobicContact CE2-CB 4.18Å; F92-E104 HydrophobicContact CZ-CB 4.08Å; F92-E104 HydrophobicContact CZ-CG 4.29Å; A102-E104 PolarHBondContact O-N 3.14Å; E104-T118 WeakPolarHBondContact CB-O 3.46Å; E104-T118 WeakPolarHBondContact CB-OG1 3.22Å; E104-T118 PolarHBondContact N-O 2.9Å; E104-R120 VanDerWaalsContact CD-NH2 3.26Å; E104-R120 IonicContact OE1-NH2 3.62Å; E104-R120 PolarHBondContact OE1-NH2 3.01Å; E104-R120 IonicContact OE2-CZ 3.73Å; E104-R120 IonicContact OE2-NE 3.21Å; E104-R120 PolarHBondContact OE2-NE 3.39Å; E104-R120 IonicContact OE2-NH2 2.88Å; E104-R120 PolarHBondContact OE2-NH2 2.94Å; E104-R151 IonicContact OE1-NH2 3.9Å
105	N	96.4	Very high	95.2	Very high	50 Å²	50	49.5 Å²	49.5	27%	0.267	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154	161.5	176	68.1	-29.7	0	0	0	111.5	Q84 G117 T118	Q84-N105 VanDerWaalsContact OE1-CA 3.25Å; N105-G117 CarbonylContact O-C 3.59Å; N105-G117 WeakPolarHBondContact O-CA 3.43Å; N105-T118 PolarHBondContact O-N 2.69Å; N105-T118 PolarHBondContact OD1-OG1 2.87Å
106	A	97.7	Very high	95.4	Very high	2 Å²	2	50.5 Å²	50.5	2%	0.017	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	131.5	173	0	0	0	0	0	111.1	F82 Q84 L103 L115 Q116	F82-A106 HydrophobicContact CE2-CB 4.29Å; F82-A106 HydrophobicContact CZ-CB 3.79Å; Q84-A106 PolarHBondContact NE2-O 3.19Å; Q84-A106 PolarHBondContact OE1-O 3.12Å; L103-A106 HydrophobicContact CD2-CB 4.42Å; A106-L115 HydrophobicContact CB-CD1 3.88Å; A106-L115 HydrophobicContact CB-CD2 4.03Å; A106-L115 HydrophobicContact CB-CG 4.06Å; A106-Q116 CarbonylContact C-O 3.59Å; A106-Q116 WeakPolarHBondContact CA-O 3.4Å
107	V	96.4	Very high	95.5	Very high	79 Å²	79	50.4 Å²	50.4	48%	0.479	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	131.2	-175	-176.6	0	0	0	0	108.9	Q116	V107-Q116 PolarHBondContact N-O 3.14Å; V107-Q116 PolarHBondContact O-N 3.41Å
108	L	95.5	Very high	95.6	Very high	38 Å²	38	48 Å²	48	20%	0.199	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	134.4	174.9	-75	164.1	0	0	0	110.4	W78 V80 L115 T166	W78-L108 HydrophobicContact CB-CD1 3.87Å; W78-L108 HydrophobicContact CB-CD2 3.99Å; W78-L108 WeakPolarHBondContact O-CD1 3.1Å; V80-L108 HydrophobicContact CG2-CD1 4.04Å; V80-L108 HydrophobicContact CG2-CG 4.04Å; L108-L115 HydrophobicContact CD2-CB 4.09Å; L108-L115 HydrophobicContact CD2-CD1 3.78Å; L108-L115 HydrophobicContact CG-CD1 3.8Å; L108-T166 HydrophobicContact CD2-CG2 4.12Å
109	Q	93.6	Very high	95.7	Very high	40 Å²	40	41.7 Å²	41.7	19%	0.187	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	87.1	173	-77.2	-179.1	-6.7	0	0	107.4	D111 Y112 H113 R114	Q109-D111 PolarHBondContact O-N 3.3Å; Q109-Y112 HydrophobicContact CB-CD2 4.06Å; Q109-Y112 HydrophobicContact CG-CD2 4.5Å; Q109-Y112 CarbonylContact O-C 3.55Å; Q109-Y112 PolarHBondContact O-N 2.93Å; Q109-Y112 VanDerWaalsContact O-N 3.16Å; Q109-H113 PolarHBondContact O-N 3.31Å; Q109-R114 HydrophobicContact CB-CG 4.1Å; Q109-R114 PolarHBondContact N-O 2.85Å; Q109-R114 PolarHBondContact O-N 3.45Å; Q109-R114 VanDerWaalsContact OE1-CZ 3.28Å
110	S	87.1	Confident	95.8	Very high	65 Å²	65	40.4 Å²	40.4	46%	0.455	20%	0.2	S	C	.	.	G	3₁₀ helix	trans	-63.9	-30.6	-174.1	-56.9	0	0	0	0	112.7	H113	S110-H113 PolarHBondContact O-N 3.48Å; S110-H113 PolarHBondContact O-ND1 3.23Å
111	D	88.6	Confident	95.9	Very high	105 Å²	105	39.3 Å²	39.3	56%	0.561	19%	0.194	S	C	*	.	G	3₁₀ helix	trans	-65.9	-33.4	174.1	55.9	-21.2	0	0	0	113.3	Q109	Q109-D111 PolarHBondContact O-N 3.3Å
112	Y	91.1	Very high	95.8	Very high	143 Å²	143	42.6 Å²	42.6	56%	0.561	21%	0.208	S	C	*	.	G	3₁₀ helix	trans	-101.9	6.8	178.1	-60.7	-76.3	0	0	0	113.7	Q109 R114	Q109-Y112 HydrophobicContact CB-CD2 4.06Å; Q109-Y112 HydrophobicContact CG-CD2 4.5Å; Q109-Y112 CarbonylContact O-C 3.55Å; Q109-Y112 PolarHBondContact O-N 2.93Å; Q109-Y112 VanDerWaalsContact O-N 3.16Å; Y112-R114 VanDerWaalsContact C-N 3.3Å; Y112-R114 PolarHBondContact O-N 3.07Å
113	H	92.3	Very high	95.8	Very high	88 Å²	88	45.5 Å²	45.5	41%	0.407	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	44.5	52.5	-176.1	-60.4	-60.1	0	0	0	113.1	Q109 S110 T166	Q109-H113 PolarHBondContact O-N 3.31Å; S110-H113 PolarHBondContact O-N 3.48Å; S110-H113 PolarHBondContact O-ND1 3.23Å; H113-T166 PolarHBondContact O-N 3.47Å; H113-T166 PolarHBondContact O-OG1 3.32Å
114	R	95.1	Very high	95.7	Very high	67 Å²	67	48 Å²	48	25%	0.253	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	157.5	-179.1	68.7	-166.6	-174.6	-177.8	-4.4	112.9	Q109 Y112 Y163 L164 T166	Q109-R114 HydrophobicContact CB-CG 4.1Å; Q109-R114 PolarHBondContact N-O 2.85Å; Q109-R114 PolarHBondContact O-N 3.45Å; Q109-R114 VanDerWaalsContact OE1-CZ 3.28Å; Y112-R114 VanDerWaalsContact C-N 3.3Å; Y112-R114 PolarHBondContact O-N 3.07Å; R114-Y163 HydrophobicContact CG-CD1 4.4Å; R114-Y163 VanDerWaalsContact CZ-CD1 3.48Å; R114-L164 CarbonylContact C-O 3.57Å; R114-L164 VanDerWaalsContact CA-O 3.27Å; R114-L164 WeakPolarHBondContact CA-O 3.25Å; R114-L164 WeakPolarHBondContact CB-O 3.34Å; R114-T166 PolarHBondContact N-OG1 3.32Å
115	L	97.4	Very high	95.6	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	118.8	163.9	-178	77.7	0	0	0	108.4	V80 A106 L108 F162 Y163 L164 F179 I201	V80-L115 HydrophobicContact CG2-CD1 3.78Å; A106-L115 HydrophobicContact CB-CD1 3.88Å; A106-L115 HydrophobicContact CB-CD2 4.03Å; A106-L115 HydrophobicContact CB-CG 4.06Å; L108-L115 HydrophobicContact CD2-CB 4.09Å; L108-L115 HydrophobicContact CD2-CD1 3.78Å; L108-L115 HydrophobicContact CG-CD1 3.8Å; L115-F162 HydrophobicContact CD2-CE2 4.43Å; L115-Y163 WeakPolarHBondContact O-CA 3.27Å; L115-L164 HydrophobicContact CB-CB 4.21Å; L115-L164 HydrophobicContact CD2-CD2 4.14Å; L115-L164 PolarHBondContact N-O 3.08Å; L115-L164 PolarHBondContact O-N 2.95Å; L115-F179 HydrophobicContact CD2-CE1 3.64Å; L115-F179 HydrophobicContact CD2-CZ 3.81Å; L115-I201 HydrophobicContact CD1-CG2 4.2Å; L115-I201 HydrophobicContact CD2-CG2 4Å
116	Q	98.3	Very high	95.5	Very high	58 Å²	58	54.1 Å²	54.1	27%	0.271	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	123.1	167.6	-178.8	-175.3	-60.5	0	0	108.6	A106 V107 V161 F162 Y163	A106-Q116 CarbonylContact C-O 3.59Å; A106-Q116 WeakPolarHBondContact CA-O 3.4Å; V107-Q116 PolarHBondContact N-O 3.14Å; V107-Q116 PolarHBondContact O-N 3.41Å; Q116-V161 HydrophobicContact CG-CG2 4.07Å; Q116-F162 WeakPolarHBondContact CA-O 3.46Å; Q116-Y163 HydrophobicContact CB-CD1 4.06Å; Q116-Y163 HydrophobicContact CB-CE1 3.98Å; Q116-Y163 HydrophobicContact CG-CD1 4.1Å; Q116-Y163 HydrophobicContact CG-CE1 3.63Å
117	G	98.5	Very high	95.5	Very high	1 Å²	1	61.6 Å²	61.6	1%	0.01	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	155.9	172.6	0	0	0	0	0	112.8	N105 V161 F162	N105-G117 CarbonylContact O-C 3.59Å; N105-G117 WeakPolarHBondContact O-CA 3.43Å; G117-V161 WeakPolarHBondContact O-CA 3.28Å; G117-F162 VanDerWaalsContact CA-CE1 3.41Å; G117-F162 PolarHBondContact N-O 3.34Å; G117-F162 VanDerWaalsContact N-O 3.07Å; G117-F162 WeakPolarHBondContact O-CD1 3.46Å; G117-F162 PolarHBondContact O-N 3.27Å
118	T	98.3	Very high	95.6	Very high	13 Å²	13	59.7 Å²	59.7	8%	0.08	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	139.5	168.8	74.2	0	0	0	0	110.5	L103 E104 N105 L150 F160	L103-T118 WeakPolarHBondContact CD1-O 3.42Å; E104-T118 WeakPolarHBondContact CB-O 3.46Å; E104-T118 WeakPolarHBondContact CB-OG1 3.22Å; E104-T118 PolarHBondContact N-O 2.9Å; N105-T118 PolarHBondContact O-N 2.69Å; N105-T118 PolarHBondContact OD1-OG1 2.87Å; T118-L150 HydrophobicContact CG2-CD2 4.41Å; T118-F160 CarbonylContact C-O 3.47Å; T118-F160 VanDerWaalsContact CA-O 3.24Å; T118-F160 WeakPolarHBondContact CA-O 3.22Å
119	V	98.6	Very high	95.7	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	134.3	-177.7	173.7	0	0	0	0	107.7	V101 L103 V121 V130 T159 F160 F162 V181	V101-V119 HydrophobicContact CG2-CG1 3.72Å; L103-V119 HydrophobicContact CD1-CG2 4.18Å; V119-V121 HydrophobicContact CG1-CG1 4.07Å; V119-V130 HydrophobicContact CB-CG1 4.33Å; V119-V130 HydrophobicContact CG1-CG1 3.95Å; V119-T159 CarbonylContact O-C 3.57Å; V119-T159 VanDerWaalsContact O-CA 3.28Å; V119-T159 WeakPolarHBondContact O-CA 3.46Å; V119-F160 HydrophobicContact CB-CB 4.47Å; V119-F160 PolarHBondContact N-O 3.42Å; V119-F160 PolarHBondContact O-N 2.86Å; V119-F162 HydrophobicContact CG2-CD1 3.88Å; V119-F162 HydrophobicContact CG2-CE1 3.84Å; V119-V181 HydrophobicContact CB-CG1 4.27Å; V119-V181 HydrophobicContact CG1-CG1 3.57Å; V119-V181 HydrophobicContact CG2-CG1 3.68Å; V119-V181 HydrophobicContact CG2-CG2 4.05Å
120	R	98.2	Very high	95.9	Very high	46 Å²	46	59.6 Å²	59.6	17%	0.174	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	133.6	171.8	-162	170.4	-69.5	-169.3	-3.2	109.5	F92 L96 V101 A102 E104 Y157 D158	F92-R120 HydrophobicContact CZ-CB 4.03Å; L96-R120 HydrophobicContact CD1-CB 4.25Å; L96-R120 HydrophobicContact CD1-CG 4.37Å; L96-R120 VanDerWaalsContact CD1-O 3.24Å; L96-R120 WeakPolarHBondContact CD1-O 3.47Å; L96-R120 HydrophobicContact CD2-CB 4.12Å; L96-R120 VanDerWaalsContact CD2-CD 3.48Å; L96-R120 HydrophobicContact CD2-CG 3.74Å; V101-R120 WeakPolarHBondContact CA-O 3.4Å; A102-R120 PolarHBondContact N-O 3.03Å; A102-R120 PolarHBondContact O-N 3.43Å; E104-R120 VanDerWaalsContact CD-NH2 3.26Å; E104-R120 IonicContact OE1-NH2 3.62Å; E104-R120 PolarHBondContact OE1-NH2 3.01Å; E104-R120 IonicContact OE2-CZ 3.73Å; E104-R120 IonicContact OE2-NE 3.21Å; E104-R120 PolarHBondContact OE2-NE 3.39Å; E104-R120 IonicContact OE2-NH2 2.88Å; E104-R120 PolarHBondContact OE2-NH2 2.94Å; R120-Y157 HydrophobicContact CG-CD1 4.42Å; R120-Y157 HydrophobicContact CG-CG 4.23Å; R120-D158 WeakPolarHBondContact CA-O 3.32Å
121	V	98.4	Very high	96.5	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	150.3	176.2	-60.3	0	0	0	0	110.6	N100 V101 V119 K128 V130 Y157 D158 F160 Y183	N100-V121 CarbonylContact O-C 3.55Å; N100-V121 VanDerWaalsContact O-CA 3.31Å; N100-V121 WeakPolarHBondContact O-CA 3.44Å; V101-V121 HydrophobicContact CB-CG1 4.19Å; V101-V121 HydrophobicContact CG2-CG1 3.91Å; V119-V121 HydrophobicContact CG1-CG1 4.07Å; V121-K128 HydrophobicContact CG2-CD 3.98Å; V121-V130 HydrophobicContact CG1-CG2 3.77Å; V121-Y157 CarbonylContact O-C 3.53Å; V121-Y157 WeakPolarHBondContact O-CA 3.36Å; V121-Y157 WeakPolarHBondContact O-CB 3.44Å; V121-D158 HydrophobicContact CG2-CB 3.98Å; V121-D158 PolarHBondContact N-O 3.07Å; V121-D158 PolarHBondContact O-N 3.4Å; V121-F160 HydrophobicContact CG2-CD2 3.88Å; V121-F160 HydrophobicContact CG2-CE2 3.53Å; V121-Y183 HydrophobicContact CB-CD1 3.83Å; V121-Y183 HydrophobicContact CB-CD2 4.37Å; V121-Y183 HydrophobicContact CB-CE1 3.82Å; V121-Y183 HydrophobicContact CB-CE2 4.41Å; V121-Y183 HydrophobicContact CB-CG 4.1Å; V121-Y183 HydrophobicContact CG1-CD1 3.89Å; V121-Y183 HydrophobicContact CG1-CD2 4.11Å; V121-Y183 HydrophobicContact CG1-CE1 4.37Å; V121-Y183 HydrophobicContact CG1-CG 3.73Å; V121-Y183 HydrophobicContact CG2-CE1 4.48Å; V121-Y183 HydrophobicContact CG2-CE2 4.44Å
122	K	97.7	Very high	97	Very high	69 Å²	69	51.7 Å²	51.7	30%	0.3	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	134.1	171.6	-164.2	171.6	-175.7	173.6	0	109.9	N100 L124 Y157 Y183	N100-K122 HydrophobicContact CB-CB 4.13Å; N100-K122 PolarHBondContact O-N 2.97Å; N100-K122 WeakPolarHBondContact OD1-CD 3.44Å; K122-L124 VanDerWaalsContact C-N 3.34Å; K122-L124 HydrophobicContact CB-CD2 4.38Å; K122-L124 HydrophobicContact CB-CG 4.36Å; K122-L124 HydrophobicContact CD-CD2 4.01Å; K122-L124 HydrophobicContact CG-CD2 4.01Å; K122-L124 HydrophobicContact CG-CG 4.48Å; K122-L124 PolarHBondContact O-N 2.62Å; K122-Y157 HydrophobicContact CB-CD1 4.4Å; K122-Y157 HydrophobicContact CB-CE1 4.44Å; K122-Y157 HydrophobicContact CG-CE1 4.34Å; K122-Y183 WeakPolarHBondContact O-CE1 3.22Å; K122-Y183 PolarHBondContact O-OH 3.11Å
123	N	96.5	Very high	97.3	Very high	64 Å²	64	47 Å²	47	34%	0.342	22%	0.215	S	C	.	.			trans	-78.4	78.1	-176.9	-171.8	14.6	0	0	0	111.7	A125 K128 R155 E156	N123-A125 PolarHBondContact OD1-O 2.95Å; N123-K128 WeakPolarHBondContact OD1-CE 3.17Å; N123-K128 PolarHBondContact OD1-NZ 2.84Å; N123-R155 PolarHBondContact ND2-O 3.07Å; N123-E156 WeakPolarHBondContact CB-O 3.41Å; N123-E156 PolarHBondContact N-O 3.45Å
124	L	96.6	Very high	97.6	Very high	54 Å²	54	44 Å²	44	28%	0.283	20%	0.201	S	C	.	.	S	Bend	trans	-87.3	-26.3	-177.3	-58.1	177.2	0	0	0	113.4	N100 K122 Y183 T185 K186 F190	N100-L124 HydrophobicContact CB-CD1 4.18Å; K122-L124 VanDerWaalsContact C-N 3.34Å; K122-L124 HydrophobicContact CB-CD2 4.38Å; K122-L124 HydrophobicContact CB-CG 4.36Å; K122-L124 HydrophobicContact CD-CD2 4.01Å; K122-L124 HydrophobicContact CG-CD2 4.01Å; K122-L124 HydrophobicContact CG-CG 4.48Å; K122-L124 PolarHBondContact O-N 2.62Å; L124-Y183 HydrophobicContact CD1-CE1 4.22Å; L124-T185 HydrophobicContact CB-CG2 4Å; L124-T185 HydrophobicContact CD1-CG2 4.02Å; L124-K186 PolarHBondContact O-NZ 3.09Å; L124-F190 HydrophobicContact CD1-CE2 3.57Å; L124-F190 HydrophobicContact CD1-CZ 3.83Å
125	A	95.7	Very high	97.7	Very high	11 Å²	11	41 Å²	41	9%	0.091	19%	0.19	C	C	.	.			trans	-153.2	166.9	174.6	0	0	0	0	0	110.8	N123 K128 T185 K186	N123-A125 PolarHBondContact OD1-O 2.95Å; A125-K128 WeakPolarHBondContact O-CE 3.25Å; A125-K128 PolarHBondContact O-NZ 2.98Å; A125-T185 WeakPolarHBondContact CB-OG1 3.39Å; A125-K186 HydrophobicContact CB-CD 3.64Å; A125-K186 HydrophobicContact CB-CG 3.66Å
126	F	94.7	Very high	97.5	Very high	193 Å²	193	43.4 Å²	43.4	85%	0.846	21%	0.207	S	C	*	.	S	Bend	trans	-64.5	-51.2	172.1	-178.4	-103	0	0	0	111.5	K128	F126-K128 PolarHBondContact O-N 3.43Å
127	E	97	Very high	97.2	Very high	160 Å²	160	43.3 Å²	43.3	75%	0.748	21%	0.208	S	C	*	.			trans	-73.6	119.2	177.6	-66.7	174.4	-175.8	0	0	111	T185	E127-T185 PolarHBondContact O-OG1 3Å
128	K	97.7	Very high	97	Very high	39 Å²	39	45.6 Å²	45.6	17%	0.17	23%	0.232	C	C	.	.			trans	-137.5	131.8	-178.2	-58.7	-172.9	-168.7	76	0	109	V121 N123 A125 F126 D158 F160 Y183	V121-K128 HydrophobicContact CG2-CD 3.98Å; N123-K128 WeakPolarHBondContact OD1-CE 3.17Å; N123-K128 PolarHBondContact OD1-NZ 2.84Å; A125-K128 WeakPolarHBondContact O-CE 3.25Å; A125-K128 PolarHBondContact O-NZ 2.98Å; F126-K128 PolarHBondContact O-N 3.43Å; K128-D158 WeakPolarHBondContact CE-OD2 3.4Å; K128-D158 IonicContact NZ-OD2 3.56Å; K128-D158 PolarHBondContact NZ-OD2 2.78Å; K128-F160 HydrophobicContact CB-CZ 3.94Å; K128-F160 HydrophobicContact CD-CE2 4.2Å; K128-F160 HydrophobicContact CD-CZ 4.16Å; K128-Y183 HydrophobicContact CB-CE2 3.8Å; K128-Y183 HydrophobicContact CD-CE2 3.98Å; K128-Y183 HydrophobicContact CG-CE2 3.78Å
129	E	98.3	Very high	96.8	Very high	76 Å²	76	49 Å²	49	36%	0.355	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	123.4	168.5	179.9	-168.4	-174.8	0	0	107.3	F131 Y183 R184	E129-F131 HydrophobicContact CG-CD1 4.29Å; E129-Y183 CarbonylContact O-C 3.58Å; E129-Y183 WeakPolarHBondContact O-CA 3.27Å; E129-R184 HydrophobicContact CB-CB 4.19Å; E129-R184 PolarHBondContact N-O 3.07Å; E129-R184 PolarHBondContact O-N 3.43Å; E129-R184 IonicContact OE1-NH1 2.87Å; E129-R184 VanDerWaalsContact OE2-CD 3.25Å; E129-R184 WeakPolarHBondContact OE2-CD 3.34Å; E129-R184 IonicContact OE2-NH1 2.69Å
130	V	98.7	Very high	96.7	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	125.4	176.4	-179.3	0	0	0	0	107	V119 V121 Q146 A147 F160 V181 C182 Y183	V119-V130 HydrophobicContact CB-CG1 4.33Å; V119-V130 HydrophobicContact CG1-CG1 3.95Å; V121-V130 HydrophobicContact CG1-CG2 3.77Å; V130-Q146 PolarHBondContact O-NE2 2.98Å; V130-A147 HydrophobicContact CB-CB 4.06Å; V130-A147 HydrophobicContact CG1-CB 3.85Å; V130-A147 WeakPolarHBondContact O-CB 3.35Å; V130-A147 PolarHBondContact O-N 2.81Å; V130-F160 HydrophobicContact CB-CB 4.38Å; V130-F160 HydrophobicContact CB-CD1 3.94Å; V130-F160 HydrophobicContact CB-CD2 4.47Å; V130-F160 HydrophobicContact CB-CE1 4.37Å; V130-F160 HydrophobicContact CB-CG 4.01Å; V130-F160 HydrophobicContact CG1-CB 4.3Å; V130-F160 HydrophobicContact CG1-CG 4.4Å; V130-F160 HydrophobicContact CG2-CD1 3.93Å; V130-F160 HydrophobicContact CG2-CD2 3.8Å; V130-F160 HydrophobicContact CG2-CE1 4.02Å; V130-F160 HydrophobicContact CG2-CE2 3.9Å; V130-F160 HydrophobicContact CG2-CG 3.84Å; V130-F160 HydrophobicContact CG2-CZ 4.02Å; V130-V181 HydrophobicContact CG1-CG1 4.2Å; V130-C182 VanDerWaalsContact CA-O 3.32Å; V130-C182 WeakPolarHBondContact CA-O 3.43Å; V130-Y183 HydrophobicContact CG2-CD2 3.96Å
131	F	98.7	Very high	96.7	Very high	3 Å²	3	59.7 Å²	59.7	1%	0.013	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	156.5	178.6	67.4	-89.6	0	0	0	111.6	E129 R133 D144 L145 C182 R184 W191	E129-F131 HydrophobicContact CG-CD1 4.29Å; F131-R133 HydrophobicContact CE2-CB 4.41Å; F131-D144 HydrophobicContact CD2-CB 3.75Å; F131-D144 HydrophobicContact CE2-CB 4.23Å; F131-D144 WeakPolarHBondContact CE2-OD2 3.2Å; F131-D144 HydrophobicContact CG-CB 4.48Å; F131-L145 CarbonylContact C-O 3.5Å; F131-L145 WeakPolarHBondContact CA-O 3.47Å; F131-L145 WeakPolarHBondContact CB-O 3.21Å; F131-C182 HydrophobicContact CD1-CB 3.86Å; F131-C182 HydrophobicContact CD2-CB 3.99Å; F131-C182 HydrophobicContact CE1-CB 3.38Å; F131-C182 WeakPolarHBondContact CE1-SG 3.48Å; F131-C182 HydrophobicContact CE2-CB 3.54Å; F131-C182 HydrophobicContact CG-CB 4.14Å; F131-C182 HydrophobicContact CZ-CB 3.21Å; F131-C182 WeakPolarHBondContact CZ-SG 3.28Å; F131-C182 PolarHBondContact N-O 3.1Å; F131-C182 PolarHBondContact O-N 3.22Å; F131-R184 HydrophobicContact CE1-CG 4.35Å; F131-W191 AromaticContact CE2-CH2 3.81Å; F131-W191 HydrophobicContact CE2-CH2 3.81Å; F131-W191 HydrophobicContact CE2-CZ2 4.49Å; F131-W191 HydrophobicContact CE2-CZ3 4.48Å; F131-W191 AromaticContact CZ-CH2 3.97Å; F131-W191 HydrophobicContact CZ-CH2 3.97Å; F131-W191 HydrophobicContact CZ-CZ2 4.2Å
132	I	98.7	Very high	96.6	Very high	0 Å²	0	65.8 Å²	65.8	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	114.4	-178.6	-68.9	68.1	0	0	0	106.5	D144 L145 A147 F162 F179 C180	I132-D144 WeakPolarHBondContact O-CA 3.32Å; I132-L145 HydrophobicContact CB-CB 4.45Å; I132-L145 PolarHBondContact N-O 3.36Å; I132-L145 PolarHBondContact O-N 2.8Å; I132-A147 HydrophobicContact CD1-CB 3.82Å; I132-F162 HydrophobicContact CB-CD2 4.45Å; I132-F162 HydrophobicContact CD1-CB 3.4Å; I132-F162 VanDerWaalsContact CD1-CB 3.4Å; I132-F162 HydrophobicContact CD1-CD1 3.52Å; I132-F162 HydrophobicContact CD1-CD2 4.06Å; I132-F162 HydrophobicContact CD1-CE1 4.23Å; I132-F162 HydrophobicContact CD1-CG 3.39Å; I132-F162 HydrophobicContact CG1-CB 4.07Å; I132-F162 HydrophobicContact CG1-CD1 3.71Å; I132-F162 HydrophobicContact CG1-CD2 3.72Å; I132-F162 HydrophobicContact CG1-CE1 3.97Å; I132-F162 HydrophobicContact CG1-CE2 4Å; I132-F162 HydrophobicContact CG1-CG 3.56Å; I132-F162 HydrophobicContact CG1-CZ 4.11Å; I132-F162 HydrophobicContact CG2-CE2 4.48Å; I132-F179 HydrophobicContact CG2-CB 3.78Å; I132-F179 HydrophobicContact CG2-CD2 3.77Å; I132-F179 HydrophobicContact CG2-CG 4.07Å; I132-C180 WeakPolarHBondContact CA-O 3.23Å
133	R	98.6	Very high	96.6	Very high	46 Å²	46	68.7 Å²	68.7	17%	0.174	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	124	171.7	-176.3	167.6	-70.9	178.1	-4.1	108.6	F131 W139 Y142 Q143 D144 F179 C180 W191	F131-R133 HydrophobicContact CE2-CB 4.41Å; R133-W139 HydrophobicContact CG-CH2 4.29Å; R133-W139 HydrophobicContact CG-CZ3 3.77Å; R133-Y142 HydrophobicContact CG-CD2 3.84Å; R133-Y142 HydrophobicContact CG-CG 4.06Å; R133-Y142 VanDerWaalsContact CZ-CE2 3.45Å; R133-Q143 WeakPolarHBondContact CA-O 3.41Å; R133-D144 WeakPolarHBondContact CA-OD1 3.25Å; R133-D144 WeakPolarHBondContact CB-OD1 3.5Å; R133-D144 WeakPolarHBondContact CG-OD1 3.18Å; R133-D144 IonicContact CZ-OD1 2.7Å; R133-D144 IonicContact CZ-OD2 3.64Å; R133-D144 IonicContact NE-OD1 3.12Å; R133-D144 PolarHBondContact NE-OD1 2.94Å; R133-D144 IonicContact NE-OD2 3.93Å; R133-D144 IonicContact NH2-OD1 3.25Å; R133-D144 IonicContact NH2-OD2 2.68Å; R133-D144 PolarHBondContact NH2-OD2 2.82Å; R133-F179 CarbonylContact O-C 3.51Å; R133-F179 WeakPolarHBondContact O-CA 3.33Å; R133-F179 WeakPolarHBondContact O-CB 3.46Å; R133-C180 PolarHBondContact N-O 2.83Å; R133-C180 PolarHBondContact O-N 2.96Å; R133-W191 HydrophobicContact CB-CH2 4.17Å; R133-W191 HydrophobicContact CB-CZ3 4.01Å
134	H	98.1	Very high	96.7	Very high	24 Å²	24	69 Å²	69	11%	0.111	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	157.7	-178.7	73.7	-73.4	0	0	0	112.5	Y142 Q143 L164 I177 E178 F179	H134-Y142 CarbonylContact O-C 3.57Å; H134-Y142 WeakPolarHBondContact O-CA 3.24Å; H134-Y142 WeakPolarHBondContact O-CB 3.41Å; H134-Q143 VanDerWaalsContact CE1-CB 3.43Å; H134-Q143 WeakPolarHBondContact CE1-CB 3.4Å; H134-Q143 PolarHBondContact N-O 3.34Å; H134-Q143 PolarHBondContact ND1-O 3.39Å; H134-Q143 PolarHBondContact O-N 2.86Å; H134-L164 HydrophobicContact CB-CD1 3.81Å; H134-L164 VanDerWaalsContact CD2-CD1 3.44Å; H134-L164 WeakPolarHBondContact CD2-CD1 3.21Å; H134-L164 VanDerWaalsContact CG-CD1 3.41Å; H134-I177 HydrophobicContact CB-CG2 4.39Å; H134-E178 CarbonylContact C-O 3.51Å; H134-E178 WeakPolarHBondContact CA-O 3.13Å; H134-E178 WeakPolarHBondContact CB-O 3.37Å; H134-F179 HydrophobicContact CB-CB 3.75Å
135	T	96.6	Very high	96.8	Very high	5 Å²	5	68.4 Å²	68.4	3%	0.031	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	152.9	177.6	-179.8	0	0	0	0	110.5	D137 W139 T141 I177 E178	T135-D137 PolarHBondContact OG1-N 2.93Å; T135-D137 PolarHBondContact OG1-OD1 2.94Å; T135-W139 HydrophobicContact CG2-CB 4.44Å; T135-W139 HydrophobicContact CG2-CD2 3.44Å; T135-W139 VanDerWaalsContact CG2-CD2 3.44Å; T135-W139 VanDerWaalsContact CG2-CE2 3.42Å; T135-W139 HydrophobicContact CG2-CE3 3.98Å; T135-W139 HydrophobicContact CG2-CG 3.66Å; T135-W139 HydrophobicContact CG2-CH2 4.44Å; T135-W139 HydrophobicContact CG2-CZ2 3.96Å; T135-W139 HydrophobicContact CG2-CZ3 4.46Å; T135-W139 PolarHBondContact OG1-N 2.88Å; T135-W139 VanDerWaalsContact OG1-N 3.1Å; T135-T141 WeakPolarHBondContact CB-O 3.45Å; T135-T141 PolarHBondContact OG1-O 2.88Å; T135-I177 WeakPolarHBondContact O-CA 2.98Å; T135-E178 HydrophobicContact CG2-CB 3.93Å; T135-E178 PolarHBondContact N-O 3.34Å; T135-E178 PolarHBondContact O-N 3.48Å
136	S	93.8	Very high	96.9	Very high	50 Å²	50	72.6 Å²	72.6	35%	0.35	35%	0.353	S	S	.	.	S	Bend	trans	-121.6	7.2	170.6	67.2	0	0	0	0	113.1
137	D	92.6	Very high	97.1	Very high	55 Å²	55	63.5 Å²	63.5	29%	0.294	31%	0.314	S	S	.	.	S	Bend	trans	-130	21.2	-170.6	69.6	2.4	0	0	0	113.9	T135 W139 K140 T141	T135-D137 PolarHBondContact OG1-N 2.93Å; T135-D137 PolarHBondContact OG1-OD1 2.94Å; D137-W139 PolarHBondContact OD1-N 2.92Å; D137-K140 PolarHBondContact OD1-N 2.8Å; D137-T141 PolarHBondContact OD1-N 2.95Å; D137-T141 WeakPolarHBondContact OD2-CB 3.32Å; D137-T141 PolarHBondContact OD2-N 3.47Å; D137-T141 VanDerWaalsContact OD2-N 3.09Å; D137-T141 PolarHBondContact OD2-OG1 2.64Å
138	G	92.8	Very high	97.2	Very high	49 Å²	49	60.4 Å²	60.4	51%	0.505	30%	0.302	S	S	.	.	S	Bend	trans	71.6	39.6	-178.1	0	0	0	0	0	112.6	K140	G138-K140 VanDerWaalsContact C-N 3.27Å; G138-K140 PolarHBondContact O-N 2.94Å
139	W	95.3	Very high	97.2	Very high	86 Å²	86	64 Å²	64	33%	0.326	32%	0.318	S	S	.	.	S	Bend	trans	66.9	19.1	176	-60.4	93.1	0	0	0	115.2	R133 T135 D137 T141 E178 C180 N198	R133-W139 HydrophobicContact CG-CH2 4.29Å; R133-W139 HydrophobicContact CG-CZ3 3.77Å; T135-W139 HydrophobicContact CG2-CB 4.44Å; T135-W139 HydrophobicContact CG2-CD2 3.44Å; T135-W139 VanDerWaalsContact CG2-CD2 3.44Å; T135-W139 VanDerWaalsContact CG2-CE2 3.42Å; T135-W139 HydrophobicContact CG2-CE3 3.98Å; T135-W139 HydrophobicContact CG2-CG 3.66Å; T135-W139 HydrophobicContact CG2-CH2 4.44Å; T135-W139 HydrophobicContact CG2-CZ2 3.96Å; T135-W139 HydrophobicContact CG2-CZ3 4.46Å; T135-W139 PolarHBondContact OG1-N 2.88Å; T135-W139 VanDerWaalsContact OG1-N 3.1Å; D137-W139 PolarHBondContact OD1-N 2.92Å; W139-T141 VanDerWaalsContact C-N 3.33Å; W139-E178 HydrophobicContact CZ2-CB 4.28Å; W139-E178 PolarHBondContact NE1-OE1 3.49Å; W139-C180 HydrophobicContact CH2-CB 4.48Å; W139-N198 PolarHBondContact NE1-ND2 2.79Å; W139-N198 VanDerWaalsContact NE1-ND2 3.14Å
140	K	96.1	Very high	97.2	Very high	182 Å²	182	64.1 Å²	64.1	79%	0.791	32%	0.321	S	S	*	.	S	Bend	trans	-70.4	-38.1	169	-64	176.7	-178.2	177.6	0	110.3	D137 G138	D137-K140 PolarHBondContact OD1-N 2.8Å; G138-K140 VanDerWaalsContact C-N 3.27Å; G138-K140 PolarHBondContact O-N 2.94Å
141	T	96.8	Very high	97.1	Very high	88 Å²	88	69.4 Å²	69.4	54%	0.54	34%	0.341	S	S	.	.	S	Bend	trans	-129.4	156.7	169.4	67.5	0	0	0	0	110.1	T135 D137 W139	T135-T141 WeakPolarHBondContact CB-O 3.45Å; T135-T141 PolarHBondContact OG1-O 2.88Å; D137-T141 PolarHBondContact OD1-N 2.95Å; D137-T141 WeakPolarHBondContact OD2-CB 3.32Å; D137-T141 PolarHBondContact OD2-N 3.47Å; D137-T141 VanDerWaalsContact OD2-N 3.09Å; D137-T141 PolarHBondContact OD2-OG1 2.64Å; W139-T141 VanDerWaalsContact C-N 3.33Å
142	Y	97.8	Very high	97	Very high	128 Å²	128	72.4 Å²	72.4	50%	0.502	36%	0.362	S	S	.	.			trans	-146	160.3	176.3	61.7	-96.8	0	0	0	111	R133 H134	R133-Y142 HydrophobicContact CG-CD2 3.84Å; R133-Y142 HydrophobicContact CG-CG 4.06Å; R133-Y142 VanDerWaalsContact CZ-CE2 3.45Å; H134-Y142 CarbonylContact O-C 3.57Å; H134-Y142 WeakPolarHBondContact O-CA 3.24Å; H134-Y142 WeakPolarHBondContact O-CB 3.41Å
143	Q	97.9	Very high	96.7	Very high	130 Å²	130	75 Å²	75	61%	0.607	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.2	142.5	173.9	-68.1	179.2	8.3	0	0	109.8	R133 H134	R133-Q143 WeakPolarHBondContact CA-O 3.41Å; H134-Q143 VanDerWaalsContact CE1-CB 3.43Å; H134-Q143 WeakPolarHBondContact CE1-CB 3.4Å; H134-Q143 PolarHBondContact N-O 3.34Å; H134-Q143 PolarHBondContact ND1-O 3.39Å; H134-Q143 PolarHBondContact O-N 2.86Å
144	D	98.5	Very high	96.3	Very high	69 Å²	69	75.9 Å²	75.9	37%	0.369	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	127.5	178.2	-68.2	-16.5	0	0	0	109.6	F131 I132 R133	F131-D144 HydrophobicContact CD2-CB 3.75Å; F131-D144 HydrophobicContact CE2-CB 4.23Å; F131-D144 WeakPolarHBondContact CE2-OD2 3.2Å; F131-D144 HydrophobicContact CG-CB 4.48Å; I132-D144 WeakPolarHBondContact O-CA 3.32Å; R133-D144 WeakPolarHBondContact CA-OD1 3.25Å; R133-D144 WeakPolarHBondContact CB-OD1 3.5Å; R133-D144 WeakPolarHBondContact CG-OD1 3.18Å; R133-D144 IonicContact CZ-OD1 2.7Å; R133-D144 IonicContact CZ-OD2 3.64Å; R133-D144 IonicContact NE-OD1 3.12Å; R133-D144 PolarHBondContact NE-OD1 2.94Å; R133-D144 IonicContact NE-OD2 3.93Å; R133-D144 IonicContact NH2-OD1 3.25Å; R133-D144 IonicContact NH2-OD2 2.68Å; R133-D144 PolarHBondContact NH2-OD2 2.82Å
145	L	98.3	Very high	96	Very high	42 Å²	42	85.9 Å²	85.9	22%	0.22	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	119.8	177.8	-66.1	175.5	0	0	0	109.9	F131 I132 A147 L164	F131-L145 CarbonylContact C-O 3.5Å; F131-L145 WeakPolarHBondContact CA-O 3.47Å; F131-L145 WeakPolarHBondContact CB-O 3.21Å; I132-L145 HydrophobicContact CB-CB 4.45Å; I132-L145 PolarHBondContact N-O 3.36Å; I132-L145 PolarHBondContact O-N 2.8Å; L145-A147 PolarHBondContact O-N 2.92Å; L145-L164 HydrophobicContact CD1-CB 4.27Å; L145-L164 HydrophobicContact CD1-CD1 3.51Å
146	Q	98.5	Very high	95.9	Very high	100 Å²	100	91.3 Å²	91.3	47%	0.467	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	134.1	179	-169.6	65.1	15.9	0	0	111.4	V130	V130-Q146 PolarHBondContact O-NE2 2.98Å
147	A	98.7	Very high	96.1	Very high	2 Å²	2	89.9 Å²	89.9	2%	0.017	45%	0.45	C	S	.	.	P	Polyproline II helix	trans	-92.6	144.9	167.8	0	0	0	0	0	110.5	V130 I132 L145 F160 V161 F162	V130-A147 HydrophobicContact CB-CB 4.06Å; V130-A147 HydrophobicContact CG1-CB 3.85Å; V130-A147 WeakPolarHBondContact O-CB 3.35Å; V130-A147 PolarHBondContact O-N 2.81Å; I132-A147 HydrophobicContact CD1-CB 3.82Å; L145-A147 PolarHBondContact O-N 2.92Å; A147-F160 HydrophobicContact CB-CB 3.94Å; A147-F160 HydrophobicContact CB-CD1 4.49Å; A147-V161 CarbonylContact C-O 3.58Å; A147-V161 WeakPolarHBondContact CA-O 3.37Å; A147-F162 HydrophobicContact CB-CB 3.99Å
148	N	98.4	Very high	96.3	Very high	95 Å²	95	87.6 Å²	87.6	51%	0.508	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	143.1	-179.1	-65.3	-49.4	0	0	0	110.7	L150 F160 V161	N148-L150 PolarHBondContact O-N 2.8Å; N148-F160 VanDerWaalsContact C-CD1 3.49Å; N148-F160 CarbonylContact O-C 3.52Å; N148-F160 WeakPolarHBondContact O-CA 3.33Å; N148-F160 WeakPolarHBondContact O-CB 3.42Å; N148-V161 HydrophobicContact CB-CG1 4.33Å; N148-V161 PolarHBondContact N-O 3.5Å; N148-V161 PolarHBondContact O-N 2.86Å
149	F	98.3	Very high	96.6	Very high	115 Å²	115	85.2 Å²	85.2	50%	0.504	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.6	131.6	172.8	174.5	-98	0	0	0	110.3	D158 F160	F149-D158 HydrophobicContact CD2-CB 4.36Å; F149-D158 HydrophobicContact CE2-CB 4.04Å; F149-F160 HydrophobicContact CB-CD1 4.33Å; F149-F160 HydrophobicContact CB-CE1 3.98Å; F149-F160 HydrophobicContact CB-CZ 4.38Å; F149-F160 HydrophobicContact CD2-CE2 4.39Å; F149-F160 HydrophobicContact CD2-CZ 4.22Å
150	L	97.6	Very high	96.8	Very high	78 Å²	78	81.7 Å²	81.7	41%	0.408	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	-53.6	178	-177	65	0	0	0	111.4	T118 N148 T159 V161	T118-L150 HydrophobicContact CG2-CD2 4.41Å; N148-L150 PolarHBondContact O-N 2.8Å; L150-T159 WeakPolarHBondContact CA-O 3.42Å; L150-T159 HydrophobicContact CB-CG2 4.4Å; L150-T159 WeakPolarHBondContact CB-O 3.16Å; L150-T159 HydrophobicContact CD2-CG2 4.03Å; L150-T159 PolarHBondContact N-O 2.6Å; L150-V161 HydrophobicContact CB-CB 4.49Å; L150-V161 HydrophobicContact CB-CG1 4.39Å; L150-V161 HydrophobicContact CD1-CG1 4.42Å; L150-V161 HydrophobicContact CD2-CB 4.49Å
151	R	97.4	Very high	96.9	Very high	110 Å²	110	73.7 Å²	73.7	42%	0.415	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.1	160.5	-178.1	61.4	177.4	-177.7	-92.4	-4.7	112	E104 T159	E104-R151 IonicContact OE1-NH2 3.9Å; R151-T159 PolarHBondContact N-O 3.12Å; R151-T159 PolarHBondContact O-N 2.98Å
152	S	97	Very high	97	Very high	66 Å²	66	69.5 Å²	69.5	46%	0.462	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	138.7	165.3	-58.6	0	0	0	0	110.7	D158	S152-D158 WeakPolarHBondContact CA-OD1 3.43Å; S152-D158 VanDerWaalsContact CB-OD1 3.22Å; S152-D158 WeakPolarHBondContact CB-OD1 3.42Å; S152-D158 PolarHBondContact OG-OD1 3.45Å
153	T	91	Very high	97	Very high	54 Å²	54	67.6 Å²	67.6	33%	0.331	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	92.6	173.4	-56.2	0	0	0	0	108.7	Y157	T153-Y157 PolarHBondContact N-O 2.84Å
154	G	91.1	Very high	97	Very high	65 Å²	65	61.4 Å²	61.4	67%	0.67	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.5	-148.8	-171.3	0	0	0	0	0	111.7
155	R	91.1	Very high	96.8	Very high	235 Å²	235	62 Å²	62	89%	0.887	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	-13.3	176.1	-64.8	-176	-179.4	-173.6	0	113.3	N123	N123-R155 PolarHBondContact ND2-O 3.07Å
156	E	94.9	Very high	96.5	Very high	118 Å²	118	60.5 Å²	60.5	55%	0.551	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-35	-167.1	-64.5	-177.2	-174.3	0	0	113.4	N123	N123-E156 WeakPolarHBondContact CB-O 3.41Å; N123-E156 PolarHBondContact N-O 3.45Å
157	Y	97.5	Very high	96.1	Very high	21 Å²	21	57.8 Å²	57.8	8%	0.082	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	148.6	-171	-51.1	-74.8	0	0	0	113	L96 N97 R120 V121 K122 T153	L96-Y157 HydrophobicContact CD1-CD1 4.35Å; L96-Y157 HydrophobicContact CD1-CE1 4.46Å; L96-Y157 HydrophobicContact CD2-CD1 3.61Å; L96-Y157 HydrophobicContact CD2-CE1 3.56Å; L96-Y157 HydrophobicContact CD2-CG 4.24Å; L96-Y157 HydrophobicContact CG-CD1 4.01Å; L96-Y157 HydrophobicContact CG-CE1 3.74Å; N97-Y157 PolarHBondContact OD1-OH 2.78Å; N97-Y157 VanDerWaalsContact OD1-OH 3.05Å; R120-Y157 HydrophobicContact CG-CD1 4.42Å; R120-Y157 HydrophobicContact CG-CG 4.23Å; V121-Y157 CarbonylContact O-C 3.53Å; V121-Y157 WeakPolarHBondContact O-CA 3.36Å; V121-Y157 WeakPolarHBondContact O-CB 3.44Å; K122-Y157 HydrophobicContact CB-CD1 4.4Å; K122-Y157 HydrophobicContact CB-CE1 4.44Å; K122-Y157 HydrophobicContact CG-CE1 4.34Å; T153-Y157 PolarHBondContact N-O 2.84Å
158	D	98.1	Very high	95.3	Very high	6 Å²	6	59.7 Å²	59.7	3%	0.032	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	148.6	166.4	-66.8	-35.9	0	0	0	109.9	R120 V121 K128 F149 S152 F160	R120-D158 WeakPolarHBondContact CA-O 3.32Å; V121-D158 HydrophobicContact CG2-CB 3.98Å; V121-D158 PolarHBondContact N-O 3.07Å; V121-D158 PolarHBondContact O-N 3.4Å; K128-D158 WeakPolarHBondContact CE-OD2 3.4Å; K128-D158 IonicContact NZ-OD2 3.56Å; K128-D158 PolarHBondContact NZ-OD2 2.78Å; F149-D158 HydrophobicContact CD2-CB 4.36Å; F149-D158 HydrophobicContact CE2-CB 4.04Å; S152-D158 WeakPolarHBondContact CA-OD1 3.43Å; S152-D158 VanDerWaalsContact CB-OD1 3.22Å; S152-D158 WeakPolarHBondContact CB-OD1 3.42Å; S152-D158 PolarHBondContact OG-OD1 3.45Å; D158-F160 HydrophobicContact CB-CD2 4.41Å; D158-F160 HydrophobicContact CB-CE2 3.8Å
159	T	98.4	Very high	94.1	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	131.7	174.8	-57.8	0	0	0	0	108.7	V119 L150 R151	V119-T159 CarbonylContact O-C 3.57Å; V119-T159 VanDerWaalsContact O-CA 3.28Å; V119-T159 WeakPolarHBondContact O-CA 3.46Å; L150-T159 WeakPolarHBondContact CA-O 3.42Å; L150-T159 HydrophobicContact CB-CG2 4.4Å; L150-T159 WeakPolarHBondContact CB-O 3.16Å; L150-T159 HydrophobicContact CD2-CG2 4.03Å; L150-T159 PolarHBondContact N-O 2.6Å; R151-T159 PolarHBondContact N-O 3.12Å; R151-T159 PolarHBondContact O-N 2.98Å
160	F	98.7	Very high	92.5	Very high	12 Å²	12	53.2 Å²	53.2	5%	0.053	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	152	174	-70.5	-106.9	0	0	0	109.5	T118 V119 V121 K128 V130 A147 N148 F149 D158	T118-F160 CarbonylContact C-O 3.47Å; T118-F160 VanDerWaalsContact CA-O 3.24Å; T118-F160 WeakPolarHBondContact CA-O 3.22Å; V119-F160 HydrophobicContact CB-CB 4.47Å; V119-F160 PolarHBondContact N-O 3.42Å; V119-F160 PolarHBondContact O-N 2.86Å; V121-F160 HydrophobicContact CG2-CD2 3.88Å; V121-F160 HydrophobicContact CG2-CE2 3.53Å; K128-F160 HydrophobicContact CB-CZ 3.94Å; K128-F160 HydrophobicContact CD-CE2 4.2Å; K128-F160 HydrophobicContact CD-CZ 4.16Å; V130-F160 HydrophobicContact CB-CB 4.38Å; V130-F160 HydrophobicContact CB-CD1 3.94Å; V130-F160 HydrophobicContact CB-CD2 4.47Å; V130-F160 HydrophobicContact CB-CE1 4.37Å; V130-F160 HydrophobicContact CB-CG 4.01Å; V130-F160 HydrophobicContact CG1-CB 4.3Å; V130-F160 HydrophobicContact CG1-CG 4.4Å; V130-F160 HydrophobicContact CG2-CD1 3.93Å; V130-F160 HydrophobicContact CG2-CD2 3.8Å; V130-F160 HydrophobicContact CG2-CE1 4.02Å; V130-F160 HydrophobicContact CG2-CE2 3.9Å; V130-F160 HydrophobicContact CG2-CG 3.84Å; V130-F160 HydrophobicContact CG2-CZ 4.02Å; A147-F160 HydrophobicContact CB-CB 3.94Å; A147-F160 HydrophobicContact CB-CD1 4.49Å; N148-F160 VanDerWaalsContact C-CD1 3.49Å; N148-F160 CarbonylContact O-C 3.52Å; N148-F160 WeakPolarHBondContact O-CA 3.33Å; N148-F160 WeakPolarHBondContact O-CB 3.42Å; F149-F160 HydrophobicContact CB-CD1 4.33Å; F149-F160 HydrophobicContact CB-CE1 3.98Å; F149-F160 HydrophobicContact CB-CZ 4.38Å; F149-F160 HydrophobicContact CD2-CE2 4.39Å; F149-F160 HydrophobicContact CD2-CZ 4.22Å; D158-F160 HydrophobicContact CB-CD2 4.41Å; D158-F160 HydrophobicContact CB-CE2 3.8Å
161	V	98.7	Very high	91.2	Very high	13 Å²	13	51.9 Å²	51.9	8%	0.079	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	140.6	175.3	62.6	0	0	0	0	109.7	Q116 G117 A147 N148 L150 Y163	Q116-V161 HydrophobicContact CG-CG2 4.07Å; G117-V161 WeakPolarHBondContact O-CA 3.28Å; A147-V161 CarbonylContact C-O 3.58Å; A147-V161 WeakPolarHBondContact CA-O 3.37Å; N148-V161 HydrophobicContact CB-CG1 4.33Å; N148-V161 PolarHBondContact N-O 3.5Å; N148-V161 PolarHBondContact O-N 2.86Å; L150-V161 HydrophobicContact CB-CB 4.49Å; L150-V161 HydrophobicContact CB-CG1 4.39Å; L150-V161 HydrophobicContact CD1-CG1 4.42Å; L150-V161 HydrophobicContact CD2-CB 4.49Å; V161-Y163 HydrophobicContact CG2-CE2 4.15Å
162	F	98.7	Very high	89.9	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	161.4	173.7	71.1	-90.8	0	0	0	111.1	L103 L115 Q116 G117 V119 I132 A147 L164 F179	L103-F162 HydrophobicContact CD1-CE1 3.62Å; L103-F162 HydrophobicContact CD1-CZ 3.95Å; L115-F162 HydrophobicContact CD2-CE2 4.43Å; Q116-F162 WeakPolarHBondContact CA-O 3.46Å; G117-F162 VanDerWaalsContact CA-CE1 3.41Å; G117-F162 PolarHBondContact N-O 3.34Å; G117-F162 VanDerWaalsContact N-O 3.07Å; G117-F162 WeakPolarHBondContact O-CD1 3.46Å; G117-F162 PolarHBondContact O-N 3.27Å; V119-F162 HydrophobicContact CG2-CD1 3.88Å; V119-F162 HydrophobicContact CG2-CE1 3.84Å; I132-F162 HydrophobicContact CB-CD2 4.45Å; I132-F162 HydrophobicContact CD1-CB 3.4Å; I132-F162 VanDerWaalsContact CD1-CB 3.4Å; I132-F162 HydrophobicContact CD1-CD1 3.52Å; I132-F162 HydrophobicContact CD1-CD2 4.06Å; I132-F162 HydrophobicContact CD1-CE1 4.23Å; I132-F162 HydrophobicContact CD1-CG 3.39Å; I132-F162 HydrophobicContact CG1-CB 4.07Å; I132-F162 HydrophobicContact CG1-CD1 3.71Å; I132-F162 HydrophobicContact CG1-CD2 3.72Å; I132-F162 HydrophobicContact CG1-CE1 3.97Å; I132-F162 HydrophobicContact CG1-CE2 4Å; I132-F162 HydrophobicContact CG1-CG 3.56Å; I132-F162 HydrophobicContact CG1-CZ 4.11Å; I132-F162 HydrophobicContact CG2-CE2 4.48Å; A147-F162 HydrophobicContact CB-CB 3.99Å; F162-L164 HydrophobicContact CD2-CB 4.17Å; F162-L164 HydrophobicContact CE2-CB 4.05Å; F162-F179 AromaticContact CZ-CE2 3.97Å; F162-F179 HydrophobicContact CZ-CE2 3.97Å; F162-F179 HydrophobicContact CZ-CZ 4.38Å
163	Y	98.2	Very high	88.7	Confident	89 Å²	89	60.2 Å²	60.2	35%	0.349	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	110.3	176.2	-61	-80.5	0	0	0	108.2	R114 L115 Q116 V161 P165	R114-Y163 HydrophobicContact CG-CD1 4.4Å; R114-Y163 VanDerWaalsContact CZ-CD1 3.48Å; L115-Y163 WeakPolarHBondContact O-CA 3.27Å; Q116-Y163 HydrophobicContact CB-CD1 4.06Å; Q116-Y163 HydrophobicContact CB-CE1 3.98Å; Q116-Y163 HydrophobicContact CG-CD1 4.1Å; Q116-Y163 HydrophobicContact CG-CE1 3.63Å; V161-Y163 HydrophobicContact CG2-CE2 4.15Å; Y163-P165 WeakPolarHBondContact O-CD 3.36Å
164	L	97.8	Very high	88.4	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	112.4	177.1	169.9	66.1	0	0	0	108.5	R114 L115 H134 L145 F162 I177 F179 I201	R114-L164 CarbonylContact C-O 3.57Å; R114-L164 VanDerWaalsContact CA-O 3.27Å; R114-L164 WeakPolarHBondContact CA-O 3.25Å; R114-L164 WeakPolarHBondContact CB-O 3.34Å; L115-L164 HydrophobicContact CB-CB 4.21Å; L115-L164 HydrophobicContact CD2-CD2 4.14Å; L115-L164 PolarHBondContact N-O 3.08Å; L115-L164 PolarHBondContact O-N 2.95Å; H134-L164 HydrophobicContact CB-CD1 3.81Å; H134-L164 VanDerWaalsContact CD2-CD1 3.44Å; H134-L164 WeakPolarHBondContact CD2-CD1 3.21Å; H134-L164 VanDerWaalsContact CG-CD1 3.41Å; L145-L164 HydrophobicContact CD1-CB 4.27Å; L145-L164 HydrophobicContact CD1-CD1 3.51Å; F162-L164 HydrophobicContact CD2-CB 4.17Å; F162-L164 HydrophobicContact CE2-CB 4.05Å; L164-I177 HydrophobicContact CD2-CG2 4.11Å; L164-F179 HydrophobicContact CD2-CB 4.39Å; L164-F179 HydrophobicContact CD2-CD1 3.8Å; L164-F179 HydrophobicContact CD2-CE1 4.31Å; L164-F179 HydrophobicContact CD2-CG 4.18Å; L164-I201 HydrophobicContact CD2-CD1 4.49Å
165	P	95.1	Very high	88.4	Confident	80 Å²	80	60.3 Å²	60.3	52%	0.519	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	140.1	178.8	-24.1	34.9	0	0	0	111.8	Y163	Y163-P165 WeakPolarHBondContact O-CD 3.36Å
166	T	92.1	Very high	88.5	Confident	12 Å²	12	52.2 Å²	52.2	7%	0.074	27%	0.267	C	S	.	.			trans	-114.1	138	171.6	62.1	0	0	0	0	109.3	W78 L108 H113 R114 A168 I201	W78-T166 HydrophobicContact CG-CG2 4.42Å; L108-T166 HydrophobicContact CD2-CG2 4.12Å; H113-T166 PolarHBondContact O-N 3.47Å; H113-T166 PolarHBondContact O-OG1 3.32Å; R114-T166 PolarHBondContact N-OG1 3.32Å; T166-A168 PolarHBondContact O-N 2.75Å; T166-I201 HydrophobicContact CG2-CD1 3.44Å; T166-I201 VanDerWaalsContact CG2-CD1 3.44Å
167	P	88.6	Confident	88.5	Confident	43 Å²	43	47 Å²	47	28%	0.279	24%	0.243	S	C	.	.			trans	-55.9	126.7	174.3	-26.1	31.9	0	0	0	111.2	A76 W78 V169 I177	A76-P167 VanDerWaalsContact CB-O 3.29Å; A76-P167 WeakPolarHBondContact CB-O 3.46Å; W78-P167 HydrophobicContact CH2-CG 4.49Å; W78-P167 HydrophobicContact CZ2-CB 4.09Å; W78-P167 HydrophobicContact CZ2-CG 3.83Å; W78-P167 PolarHBondContact NE1-O 2.79Å; P167-V169 WeakPolarHBondContact CB-O 3.45Å; P167-V169 PolarHBondContact O-N 3.22Å; P167-I177 HydrophobicContact CG-CD1 4.46Å
168	A	81.8	Confident	88.5	Confident	41 Å²	41	47.1 Å²	47.1	34%	0.339	24%	0.244	S	C	.	.	S	Bend	trans	-63.3	-30.1	175.6	0	0	0	0	0	112	A76 T166	A76-A168 WeakPolarHBondContact CB-O 3.25Å; A76-A168 PolarHBondContact N-O 3.14Å; T166-A168 PolarHBondContact O-N 2.75Å
169	V	73.7	Confident	88.6	Confident	48 Å²	48	46.8 Å²	46.8	29%	0.291	24%	0.243	S	C	.	.	B	Isolated β-bridge	trans	-115	129	177.1	176.5	0	0	0	0	109.2	E73 P167 S171	E73-V169 HydrophobicContact CB-CB 4.42Å; E73-V169 HydrophobicContact CB-CG1 3.42Å; E73-V169 VanDerWaalsContact CB-CG1 3.42Å; E73-V169 HydrophobicContact CB-CG2 4.13Å; E73-V169 HydrophobicContact CG-CG1 3.65Å; P167-V169 WeakPolarHBondContact CB-O 3.45Å; P167-V169 PolarHBondContact O-N 3.22Å; V169-S171 PolarHBondContact O-N 2.95Å
170	A	65.3	Low	88.6	Confident	26 Å²	26	47.1 Å²	47.1	22%	0.215	25%	0.245	C	C	.	.			trans	-86.4	90.6	179.7	0	0	0	0	0	108.3	M74 A76 Q175	M74-A170 PolarHBondContact O-N 2.87Å; A76-A170 HydrophobicContact CB-CB 3.55Å; A170-Q175 PolarHBondContact O-NE2 2.97Å
171	S	69.8	Low	88.6	Confident	50 Å²	50	46.6 Å²	46.6	35%	0.35	24%	0.243	S	C	.	.			trans	-64.7	146.7	170.6	64	0	0	0	0	110.4	V169 E173 K174 Q175	V169-S171 PolarHBondContact O-N 2.95Å; S171-E173 PolarHBondContact O-N 3.4Å; S171-K174 PolarHBondContact O-N 2.82Å; S171-K174 WeakPolarHBondContact OG-CB 3.39Å; S171-K174 PolarHBondContact OG-N 3.05Å; S171-Q175 PolarHBondContact O-NE2 2.68Å
172	K	69.4	Low	88.6	Confident	174 Å²	174	46 Å²	46	76%	0.757	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.3	-26.7	179.6	-73.6	-179.1	174.5	173.7	0	113	D69 Q175	D69-K172 IonicContact OD1-NZ 3.59Å; K172-Q175 WeakPolarHBondContact O-CG 3.45Å
173	E	73.7	Confident	88.5	Confident	178 Å²	178	46 Å²	46	83%	0.832	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-34.6	-178	-61.4	178.6	-179.2	0	0	113.9	S171 Q175	S171-E173 PolarHBondContact O-N 3.4Å; E173-Q175 PolarHBondContact O-N 3.05Å
174	K	84.1	Confident	88.6	Confident	101 Å²	101	45.4 Å²	45.4	44%	0.439	24%	0.236	S	C	.	.			trans	-106.1	70.1	-175.9	-62.1	-175	179.6	-178.6	0	111.6	W78 S171	W78-K174 WeakPolarHBondContact CH2-O 3.38Å; S171-K174 PolarHBondContact O-N 2.82Å; S171-K174 WeakPolarHBondContact OG-CB 3.39Å; S171-K174 PolarHBondContact OG-N 3.05Å
175	Q	89.9	Confident	88.5	Confident	19 Å²	19	45.7 Å²	45.7	9%	0.089	24%	0.238	C	C	.	.			trans	-103.7	-4.5	-177.1	-60.3	-77	-64	0	0	113.6	A170 S171 K172 E173 I202 S203 H205 L206	A170-Q175 PolarHBondContact O-NE2 2.97Å; S171-Q175 PolarHBondContact O-NE2 2.68Å; K172-Q175 WeakPolarHBondContact O-CG 3.45Å; E173-Q175 PolarHBondContact O-N 3.05Å; Q175-I202 WeakPolarHBondContact O-CA 3.4Å; Q175-S203 VanDerWaalsContact CD-OG 3.29Å; Q175-S203 PolarHBondContact O-N 2.84Å; Q175-S203 PolarHBondContact OE1-OG 2.93Å; Q175-H205 PolarHBondContact OE1-ND1 2.97Å; Q175-H205 VanDerWaalsContact OE1-ND1 3.15Å; Q175-L206 HydrophobicContact CB-CB 4.02Å; Q175-L206 HydrophobicContact CB-CD2 4.1Å
176	K	93.6	Very high	88.4	Confident	66 Å²	66	49 Å²	49	29%	0.287	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	136.8	-178.8	179.4	177.4	63.7	148.8	0	109.4	E178 I201 I202 L206	K176-E178 HydrophobicContact CD-CG 4.17Å; K176-E178 WeakPolarHBondContact CE-OE2 3.4Å; K176-E178 HydrophobicContact CG-CG 4.32Å; K176-E178 IonicContact NZ-OE2 2.83Å; K176-E178 PolarHBondContact NZ-OE2 3.24Å; K176-I201 WeakPolarHBondContact CA-O 3.26Å; K176-I202 HydrophobicContact CB-CG2 4.28Å; K176-I202 HydrophobicContact CG-CG2 4.08Å; K176-L206 HydrophobicContact CB-CD2 4.09Å
177	I	95.9	Very high	88.3	Confident	8 Å²	8	56.9 Å²	56.9	4%	0.041	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	130	167.9	-62	165.2	0	0	0	107.3	W78 H134 T135 L164 P167 E200 I201	W78-I177 HydrophobicContact CH2-CD1 3.97Å; W78-I177 HydrophobicContact CH2-CG1 4.16Å; W78-I177 HydrophobicContact CZ2-CD1 4.43Å; W78-I177 HydrophobicContact CZ3-CD1 4.16Å; W78-I177 HydrophobicContact CZ3-CG1 4.22Å; H134-I177 HydrophobicContact CB-CG2 4.39Å; T135-I177 WeakPolarHBondContact O-CA 2.98Å; L164-I177 HydrophobicContact CD2-CG2 4.11Å; P167-I177 HydrophobicContact CG-CD1 4.46Å; I177-E200 WeakPolarHBondContact O-CA 3.41Å; I177-I201 HydrophobicContact CB-CD1 4.11Å; I177-I201 HydrophobicContact CB-CG1 3.71Å; I177-I201 HydrophobicContact CD1-CD1 4.04Å; I177-I201 HydrophobicContact CD1-CG1 4.44Å; I177-I201 HydrophobicContact CG2-CG1 4.43Å; I177-I201 PolarHBondContact N-O 3.16Å; I177-I201 PolarHBondContact O-N 2.8Å
178	E	97.9	Very high	88.7	Confident	23 Å²	23	59.9 Å²	59.9	11%	0.107	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	146.7	174.5	-66.8	175.1	64.7	0	0	109.8	H134 T135 W139 K176 N198 Y199 E200	H134-E178 CarbonylContact C-O 3.51Å; H134-E178 WeakPolarHBondContact CA-O 3.13Å; H134-E178 WeakPolarHBondContact CB-O 3.37Å; T135-E178 HydrophobicContact CG2-CB 3.93Å; T135-E178 PolarHBondContact N-O 3.34Å; T135-E178 PolarHBondContact O-N 3.48Å; W139-E178 HydrophobicContact CZ2-CB 4.28Å; W139-E178 PolarHBondContact NE1-OE1 3.49Å; K176-E178 HydrophobicContact CD-CG 4.17Å; K176-E178 WeakPolarHBondContact CE-OE2 3.4Å; K176-E178 HydrophobicContact CG-CG 4.32Å; K176-E178 IonicContact NZ-OE2 2.83Å; K176-E178 PolarHBondContact NZ-OE2 3.24Å; E178-N198 HydrophobicContact CB-CB 4.43Å; E178-N198 PolarHBondContact OE1-ND2 2.79Å; E178-Y199 CarbonylContact C-O 3.51Å; E178-Y199 VanDerWaalsContact CA-O 3.25Å; E178-Y199 WeakPolarHBondContact CA-O 2.98Å; E178-E200 HydrophobicContact CG-CB 4.28Å
179	F	98.5	Very high	89.5	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	157.3	175.2	70.5	-86.7	0	0	0	113.7	F82 L103 L115 I132 R133 H134 F162 L164 Y199	F82-F179 AromaticContact CE1-CE1 3.98Å; F82-F179 HydrophobicContact CE1-CE1 3.98Å; F82-F179 HydrophobicContact CE1-CZ 4.03Å; F82-F179 HydrophobicContact CZ-CE1 4.36Å; F82-F179 AromaticContact CZ-CZ 3.96Å; F82-F179 HydrophobicContact CZ-CZ 3.96Å; L103-F179 HydrophobicContact CD2-CE2 4.22Å; L103-F179 HydrophobicContact CD2-CZ 4.24Å; L115-F179 HydrophobicContact CD2-CE1 3.64Å; L115-F179 HydrophobicContact CD2-CZ 3.81Å; I132-F179 HydrophobicContact CG2-CB 3.78Å; I132-F179 HydrophobicContact CG2-CD2 3.77Å; I132-F179 HydrophobicContact CG2-CG 4.07Å; R133-F179 CarbonylContact O-C 3.51Å; R133-F179 WeakPolarHBondContact O-CA 3.33Å; R133-F179 WeakPolarHBondContact O-CB 3.46Å; H134-F179 HydrophobicContact CB-CB 3.75Å; F162-F179 AromaticContact CZ-CE2 3.97Å; F162-F179 HydrophobicContact CZ-CE2 3.97Å; F162-F179 HydrophobicContact CZ-CZ 4.38Å; L164-F179 HydrophobicContact CD2-CB 4.39Å; L164-F179 HydrophobicContact CD2-CD1 3.8Å; L164-F179 HydrophobicContact CD2-CE1 4.31Å; L164-F179 HydrophobicContact CD2-CG 4.18Å; F179-Y199 WeakPolarHBondContact CD1-O 3.15Å; F179-Y199 HydrophobicContact CD2-CD2 4.16Å; F179-Y199 HydrophobicContact CD2-CG 4.39Å; F179-Y199 HydrophobicContact CE1-CG 4.41Å; F179-Y199 AromaticContact CE2-CD2 3.78Å; F179-Y199 HydrophobicContact CE2-CD2 3.78Å; F179-Y199 AromaticContact CE2-CG 3.81Å; F179-Y199 HydrophobicContact CE2-CG 3.81Å; F179-Y199 HydrophobicContact CZ-CD2 4.29Å; F179-Y199 AromaticContact CZ-CG 3.83Å; F179-Y199 HydrophobicContact CZ-CG 3.83Å; F179-Y199 PolarHBondContact N-O 2.77Å; F179-Y199 PolarHBondContact O-N 3.08Å
180	C	98.4	Very high	90.7	Very high	7 Å²	7	61.7 Å²	61.7	5%	0.047	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	155.9	172.6	-61.5	0	0	0	0	109.4	I132 R133 W139 W191 N198	I132-C180 WeakPolarHBondContact CA-O 3.23Å; R133-C180 PolarHBondContact N-O 2.83Å; R133-C180 PolarHBondContact O-N 2.96Å; W139-C180 HydrophobicContact CH2-CB 4.48Å; C180-W191 HydrophobicContact CB-CE3 4.05Å; C180-W191 HydrophobicContact CB-CZ3 4.16Å; C180-N198 PolarHBondContact SG-OD1 3.22Å
181	V	98.7	Very high	92.2	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	132.5	178.4	-173.8	0	0	0	0	109.4	V101 L103 V119 V130 W191 D192	V101-V181 HydrophobicContact CG2-CB 4.41Å; V101-V181 HydrophobicContact CG2-CG1 3.74Å; L103-V181 HydrophobicContact CB-CG2 4.39Å; V119-V181 HydrophobicContact CB-CG1 4.27Å; V119-V181 HydrophobicContact CG1-CG1 3.57Å; V119-V181 HydrophobicContact CG2-CG1 3.68Å; V119-V181 HydrophobicContact CG2-CG2 4.05Å; V130-V181 HydrophobicContact CG1-CG1 4.2Å; V181-W191 WeakPolarHBondContact O-CA 3.31Å; V181-D192 HydrophobicContact CB-CB 4.29Å; V181-D192 PolarHBondContact N-O 2.82Å; V181-D192 PolarHBondContact O-N 3.27Å
182	C	98.6	Very high	93.6	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	141	173.7	-168.9	0	0	0	0	110.5	V130 F131 E189 F190 W191	V130-C182 VanDerWaalsContact CA-O 3.32Å; V130-C182 WeakPolarHBondContact CA-O 3.43Å; F131-C182 HydrophobicContact CD1-CB 3.86Å; F131-C182 HydrophobicContact CD2-CB 3.99Å; F131-C182 HydrophobicContact CE1-CB 3.38Å; F131-C182 WeakPolarHBondContact CE1-SG 3.48Å; F131-C182 HydrophobicContact CE2-CB 3.54Å; F131-C182 HydrophobicContact CG-CB 4.14Å; F131-C182 HydrophobicContact CZ-CB 3.21Å; F131-C182 WeakPolarHBondContact CZ-SG 3.28Å; F131-C182 PolarHBondContact N-O 3.1Å; F131-C182 PolarHBondContact O-N 3.22Å; C182-E189 WeakPolarHBondContact SG-CG 3.45Å; C182-F190 CarbonylContact C-O 3.49Å; C182-F190 WeakPolarHBondContact CA-O 3.26Å; C182-W191 HydrophobicContact CB-CD2 4.05Å; C182-W191 HydrophobicContact CB-CE3 3.79Å; C182-W191 HydrophobicContact CB-CH2 3.65Å; C182-W191 HydrophobicContact CB-CZ2 3.88Å; C182-W191 HydrophobicContact CB-CZ3 3.6Å; C182-W191 VanDerWaalsContact SG-CE2 3.59Å; C182-W191 VanDerWaalsContact SG-CZ2 3.58Å
183	Y	98.6	Very high	94.9	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	119.5	171.1	169.2	-144.9	0	0	0	109.7	N100 V101 V121 K122 L124 K128 E129 V130 T185 E189 F190	N100-Y183 HydrophobicContact CB-CD1 4.43Å; N100-Y183 HydrophobicContact CB-CE1 4.47Å; V101-Y183 HydrophobicContact CB-CD1 4.3Å; V101-Y183 HydrophobicContact CB-CG 4.49Å; V121-Y183 HydrophobicContact CB-CD1 3.83Å; V121-Y183 HydrophobicContact CB-CD2 4.37Å; V121-Y183 HydrophobicContact CB-CE1 3.82Å; V121-Y183 HydrophobicContact CB-CE2 4.41Å; V121-Y183 HydrophobicContact CB-CG 4.1Å; V121-Y183 HydrophobicContact CG1-CD1 3.89Å; V121-Y183 HydrophobicContact CG1-CD2 4.11Å; V121-Y183 HydrophobicContact CG1-CE1 4.37Å; V121-Y183 HydrophobicContact CG1-CG 3.73Å; V121-Y183 HydrophobicContact CG2-CE1 4.48Å; V121-Y183 HydrophobicContact CG2-CE2 4.44Å; K122-Y183 WeakPolarHBondContact O-CE1 3.22Å; K122-Y183 PolarHBondContact O-OH 3.11Å; L124-Y183 HydrophobicContact CD1-CE1 4.22Å; K128-Y183 HydrophobicContact CB-CE2 3.8Å; K128-Y183 HydrophobicContact CD-CE2 3.98Å; K128-Y183 HydrophobicContact CG-CE2 3.78Å; E129-Y183 CarbonylContact O-C 3.58Å; E129-Y183 WeakPolarHBondContact O-CA 3.27Å; V130-Y183 HydrophobicContact CG2-CD2 3.96Å; Y183-T185 HydrophobicContact CE1-CG2 4.13Å; Y183-T185 HydrophobicContact CE2-CG2 3.95Å; Y183-E189 WeakPolarHBondContact O-CA 3.24Å; Y183-F190 AromaticContact CD1-CD2 3.74Å; Y183-F190 HydrophobicContact CD1-CD2 3.74Å; Y183-F190 HydrophobicContact CD1-CE2 4.49Å; Y183-F190 HydrophobicContact CE1-CD2 4.2Å; Y183-F190 HydrophobicContact CG-CD2 4.36Å; Y183-F190 PolarHBondContact N-O 3.18Å; Y183-F190 PolarHBondContact O-N 2.81Å
184	R	98.5	Very high	95.9	Very high	77 Å²	77	48.3 Å²	48.3	29%	0.291	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	137.1	175.1	-69.9	172.4	177.9	153.9	3.9	111.7	E129 F131 Q188 E189	E129-R184 HydrophobicContact CB-CB 4.19Å; E129-R184 PolarHBondContact N-O 3.07Å; E129-R184 PolarHBondContact O-N 3.43Å; E129-R184 IonicContact OE1-NH1 2.87Å; E129-R184 VanDerWaalsContact OE2-CD 3.25Å; E129-R184 WeakPolarHBondContact OE2-CD 3.34Å; E129-R184 IonicContact OE2-NH1 2.69Å; F131-R184 HydrophobicContact CE1-CG 4.35Å; R184-Q188 VanDerWaalsContact CA-O 3.29Å; R184-Q188 WeakPolarHBondContact CA-O 3.45Å; R184-E189 HydrophobicContact CG-CB 4.22Å; R184-E189 HydrophobicContact CG-CG 3.87Å; R184-E189 IonicContact CZ-OE2 2.64Å; R184-E189 IonicContact NE-OE2 3.74Å; R184-E189 PolarHBondContact NE-OE2 3.27Å; R184-E189 IonicContact NH2-OE2 2.79Å; R184-E189 PolarHBondContact NH2-OE2 2.85Å
185	T	97.4	Very high	96.3	Very high	7 Å²	7	48.1 Å²	48.1	4%	0.043	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.5	139.4	175.6	-171.6	0	0	0	0	110.7	L124 A125 E127 Y183 N187 Q188 F190	L124-T185 HydrophobicContact CB-CG2 4Å; L124-T185 HydrophobicContact CD1-CG2 4.02Å; A125-T185 WeakPolarHBondContact CB-OG1 3.39Å; E127-T185 PolarHBondContact O-OG1 3Å; Y183-T185 HydrophobicContact CE1-CG2 4.13Å; Y183-T185 HydrophobicContact CE2-CG2 3.95Å; T185-N187 VanDerWaalsContact C-N 3.28Å; T185-N187 PolarHBondContact O-N 2.78Å; T185-N187 VanDerWaalsContact O-N 3.09Å; T185-Q188 PolarHBondContact N-O 2.87Å; T185-Q188 WeakPolarHBondContact O-CA 3.19Å; T185-Q188 WeakPolarHBondContact O-CB 3.43Å; T185-Q188 PolarHBondContact O-N 2.7Å; T185-F190 HydrophobicContact CG2-CE2 4.11Å
186	K	91.7	Very high	96.4	Very high	148 Å²	148	54 Å²	54	64%	0.643	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	43	46.7	176.3	-69.7	175.3	172.6	160.9	0	114.6	L124 A125 Q188	L124-K186 PolarHBondContact O-NZ 3.09Å; A125-K186 HydrophobicContact CB-CD 3.64Å; A125-K186 HydrophobicContact CB-CG 3.66Å; K186-Q188 PolarHBondContact O-N 3.25Å
187	N	90.4	Very high	96.5	Very high	179 Å²	179	57.5 Å²	57.5	96%	0.957	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.6	16.2	-177.4	-50.5	-32.9	0	0	0	115.7	T185	T185-N187 VanDerWaalsContact C-N 3.28Å; T185-N187 PolarHBondContact O-N 2.78Å; T185-N187 VanDerWaalsContact O-N 3.09Å
188	Q	97.5	Very high	96.5	Very high	105 Å²	105	58.5 Å²	58.5	49%	0.491	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	146.1	170.9	-57.1	-173.9	-55.1	0	0	109.5	R184 T185 K186 F190	R184-Q188 VanDerWaalsContact CA-O 3.29Å; R184-Q188 WeakPolarHBondContact CA-O 3.45Å; T185-Q188 PolarHBondContact N-O 2.87Å; T185-Q188 WeakPolarHBondContact O-CA 3.19Å; T185-Q188 WeakPolarHBondContact O-CB 3.43Å; T185-Q188 PolarHBondContact O-N 2.7Å; K186-Q188 PolarHBondContact O-N 3.25Å; Q188-F190 HydrophobicContact CB-CE2 3.75Å; Q188-F190 HydrophobicContact CB-CZ 3.73Å; Q188-F190 HydrophobicContact CG-CZ 4.48Å
189	E	98.1	Very high	96.5	Very high	90 Å²	90	57.6 Å²	57.6	42%	0.421	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	129.4	178.3	-170.9	176.6	91.4	0	0	108.8	C182 Y183 R184 W191	C182-E189 WeakPolarHBondContact SG-CG 3.45Å; Y183-E189 WeakPolarHBondContact O-CA 3.24Å; R184-E189 HydrophobicContact CG-CB 4.22Å; R184-E189 HydrophobicContact CG-CG 3.87Å; R184-E189 IonicContact CZ-OE2 2.64Å; R184-E189 IonicContact NE-OE2 3.74Å; R184-E189 PolarHBondContact NE-OE2 3.27Å; R184-E189 IonicContact NH2-OE2 2.79Å; R184-E189 PolarHBondContact NH2-OE2 2.85Å; E189-W191 PolarHBondContact OE1-NE1 3.49Å
190	F	98.3	Very high	96.5	Very high	37 Å²	37	59.1 Å²	59.1	16%	0.162	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	138.6	-179.9	-54.1	-76.6	0	0	0	109.7	R99 N100 V101 L124 C182 Y183 T185 Q188	R99-F190 WeakPolarHBondContact O-CB 3.31Å; N100-F190 HydrophobicContact CB-CD1 4.14Å; N100-F190 HydrophobicContact CB-CD2 4.07Å; N100-F190 HydrophobicContact CB-CE1 4.37Å; N100-F190 HydrophobicContact CB-CE2 4.29Å; N100-F190 HydrophobicContact CB-CG 3.99Å; N100-F190 HydrophobicContact CB-CZ 4.43Å; N100-F190 WeakPolarHBondContact ND2-CD1 3.07Å; N100-F190 WeakPolarHBondContact ND2-CE1 3.39Å; N100-F190 VanDerWaalsContact ND2-CZ 3.32Å; N100-F190 WeakPolarHBondContact ND2-CZ 3.5Å; V101-F190 HydrophobicContact CG1-CB 3.77Å; L124-F190 HydrophobicContact CD1-CE2 3.57Å; L124-F190 HydrophobicContact CD1-CZ 3.83Å; C182-F190 CarbonylContact C-O 3.49Å; C182-F190 WeakPolarHBondContact CA-O 3.26Å; Y183-F190 AromaticContact CD1-CD2 3.74Å; Y183-F190 HydrophobicContact CD1-CD2 3.74Å; Y183-F190 HydrophobicContact CD1-CE2 4.49Å; Y183-F190 HydrophobicContact CE1-CD2 4.2Å; Y183-F190 HydrophobicContact CG-CD2 4.36Å; Y183-F190 PolarHBondContact N-O 3.18Å; Y183-F190 PolarHBondContact O-N 2.81Å; T185-F190 HydrophobicContact CG2-CE2 4.11Å; Q188-F190 HydrophobicContact CB-CE2 3.75Å; Q188-F190 HydrophobicContact CB-CZ 3.73Å; Q188-F190 HydrophobicContact CG-CZ 4.48Å
191	W	98.1	Very high	96.3	Very high	81 Å²	81	58.8 Å²	58.8	31%	0.307	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	137.4	-178.3	-72	91.1	0	0	0	111.8	F131 R133 C180 V181 C182 E189	F131-W191 AromaticContact CE2-CH2 3.81Å; F131-W191 HydrophobicContact CE2-CH2 3.81Å; F131-W191 HydrophobicContact CE2-CZ2 4.49Å; F131-W191 HydrophobicContact CE2-CZ3 4.48Å; F131-W191 AromaticContact CZ-CH2 3.97Å; F131-W191 HydrophobicContact CZ-CH2 3.97Å; F131-W191 HydrophobicContact CZ-CZ2 4.2Å; R133-W191 HydrophobicContact CB-CH2 4.17Å; R133-W191 HydrophobicContact CB-CZ3 4.01Å; C180-W191 HydrophobicContact CB-CE3 4.05Å; C180-W191 HydrophobicContact CB-CZ3 4.16Å; V181-W191 WeakPolarHBondContact O-CA 3.31Å; C182-W191 HydrophobicContact CB-CD2 4.05Å; C182-W191 HydrophobicContact CB-CE3 3.79Å; C182-W191 HydrophobicContact CB-CH2 3.65Å; C182-W191 HydrophobicContact CB-CZ2 3.88Å; C182-W191 HydrophobicContact CB-CZ3 3.6Å; C182-W191 VanDerWaalsContact SG-CE2 3.59Å; C182-W191 VanDerWaalsContact SG-CZ2 3.58Å; E189-W191 PolarHBondContact OE1-NE1 3.49Å
192	D	98	Very high	96.2	Very high	5 Å²	5	58.8 Å²	58.8	3%	0.027	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	101.6	163.1	-174.5	17.9	0	0	0	109.8	R99 V101 A102 L103 V181 N194 Y199	R99-D192 IonicContact NH1-OD1 3.55Å; V101-D192 HydrophobicContact CG1-CB 4.22Å; A102-D192 VanDerWaalsContact CA-OD2 3.27Å; A102-D192 WeakPolarHBondContact CA-OD2 3.48Å; L103-D192 PolarHBondContact N-OD2 3.27Å; V181-D192 HydrophobicContact CB-CB 4.29Å; V181-D192 PolarHBondContact N-O 2.82Å; V181-D192 PolarHBondContact O-N 3.27Å; D192-N194 PolarHBondContact OD1-N 2.97Å; D192-Y199 PolarHBondContact OD2-OH 3.44Å
193	S	96.5	Very high	95.8	Very high	22 Å²	22	58.9 Å²	58.9	15%	0.154	28%	0.279	C	S	.	.			trans	-105.1	22.2	177.8	62.1	0	0	0	0	112.2	E195 N196 K197 N198	S193-E195 VanDerWaalsContact C-N 3.32Å; S193-E195 PolarHBondContact O-N 3.46Å; S193-N196 PolarHBondContact O-N 2.83Å; S193-N196 VanDerWaalsContact O-N 3.08Å; S193-N196 PolarHBondContact OG-N 2.87Å; S193-N196 PolarHBondContact OG-OD1 2.8Å; S193-K197 PolarHBondContact O-N 2.69Å; S193-N198 VanDerWaalsContact O-CA 3.26Å; S193-N198 WeakPolarHBondContact O-CA 3.46Å; S193-N198 PolarHBondContact O-N 3.05Å
194	N	95.4	Very high	95.4	Very high	39 Å²	39	59.9 Å²	59.9	21%	0.209	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.6	49.4	-177.8	-171.1	30	0	0	0	112.6	D192 N196 K197 N198 Y199	D192-N194 PolarHBondContact OD1-N 2.97Å; N194-N196 PolarHBondContact O-N 3.39Å; N194-K197 WeakPolarHBondContact O-CB 3.29Å; N194-K197 PolarHBondContact O-N 2.82Å; N194-N198 WeakPolarHBondContact CB-O 3.11Å; N194-N198 PolarHBondContact ND2-O 2.85Å; N194-Y199 HydrophobicContact CB-CD1 4.01Å; N194-Y199 HydrophobicContact CB-CD2 4.2Å; N194-Y199 HydrophobicContact CB-CE1 3.75Å; N194-Y199 HydrophobicContact CB-CE2 3.96Å; N194-Y199 HydrophobicContact CB-CG 4.23Å
195	E	92.3	Very high	94.8	Very high	98 Å²	98	61.9 Å²	61.9	46%	0.458	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.9	42.2	-176.7	-50.8	177.7	160.1	0	0	113.4	S193 K197	S193-E195 VanDerWaalsContact C-N 3.32Å; S193-E195 PolarHBondContact O-N 3.46Å; E195-K197 PolarHBondContact O-N 2.84Å; E195-K197 IonicContact OE2-NZ 3.58Å
196	N	92.5	Very high	94.5	Very high	143 Å²	143	63.1 Å²	63.1	77%	0.765	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.4	10.7	-178.1	-50	-46.3	0	0	0	115.2	S193 N194	S193-N196 PolarHBondContact O-N 2.83Å; S193-N196 VanDerWaalsContact O-N 3.08Å; S193-N196 PolarHBondContact OG-N 2.87Å; S193-N196 PolarHBondContact OG-OD1 2.8Å; N194-N196 PolarHBondContact O-N 3.39Å
197	K	94.6	Very high	94.4	Very high	138 Å²	138	58.8 Å²	58.8	60%	0.6	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	-16.8	172.5	-62.4	168.2	-174.3	155.1	0	112.4	S193 N194 E195	S193-K197 PolarHBondContact O-N 2.69Å; N194-K197 WeakPolarHBondContact O-CB 3.29Å; N194-K197 PolarHBondContact O-N 2.82Å; E195-K197 PolarHBondContact O-N 2.84Å; E195-K197 IonicContact OE2-NZ 3.58Å
198	N	97.2	Very high	94.3	Very high	29 Å²	29	54 Å²	54	16%	0.155	25%	0.253	C	S	.	.			trans	59.8	169.1	-164.9	-49	-33.8	0	0	0	112.1	W139 E178 C180 S193 N194	W139-N198 PolarHBondContact NE1-ND2 2.79Å; W139-N198 VanDerWaalsContact NE1-ND2 3.14Å; E178-N198 HydrophobicContact CB-CB 4.43Å; E178-N198 PolarHBondContact OE1-ND2 2.79Å; C180-N198 PolarHBondContact SG-OD1 3.22Å; S193-N198 VanDerWaalsContact O-CA 3.26Å; S193-N198 WeakPolarHBondContact O-CA 3.46Å; S193-N198 PolarHBondContact O-N 3.05Å; N194-N198 WeakPolarHBondContact CB-O 3.11Å; N194-N198 PolarHBondContact ND2-O 2.85Å
199	Y	98.2	Very high	93.8	Very high	5 Å²	5	55.7 Å²	55.7	2%	0.02	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	134.2	166.7	-65.6	-72.4	0	0	0	108.7	F82 P85 L103 E178 F179 D192 N194	F82-Y199 HydrophobicContact CB-CD1 4.38Å; F82-Y199 AromaticContact CD1-CD1 3.94Å; F82-Y199 HydrophobicContact CD1-CD1 3.94Å; F82-Y199 HydrophobicContact CD1-CG 4.49Å; F82-Y199 AromaticContact CD2-CD1 3.59Å; F82-Y199 HydrophobicContact CD2-CD1 3.59Å; F82-Y199 HydrophobicContact CD2-CE1 4.05Å; F82-Y199 HydrophobicContact CE1-CD1 4.01Å; F82-Y199 HydrophobicContact CE1-CG 4.34Å; F82-Y199 AromaticContact CE2-CD1 3.69Å; F82-Y199 HydrophobicContact CE2-CD1 3.69Å; F82-Y199 HydrophobicContact CE2-CE1 4.2Å; F82-Y199 AromaticContact CG-CD1 3.72Å; F82-Y199 HydrophobicContact CG-CD1 3.72Å; F82-Y199 HydrophobicContact CG-CE1 4.5Å; F82-Y199 AromaticContact CZ-CD1 3.88Å; F82-Y199 HydrophobicContact CZ-CD1 3.88Å; F82-Y199 HydrophobicContact CZ-CG 4.38Å; P85-Y199 HydrophobicContact CG-CE1 3.97Å; L103-Y199 HydrophobicContact CB-CE1 4.3Å; L103-Y199 HydrophobicContact CB-CE2 3.8Å; L103-Y199 HydrophobicContact CD2-CD1 3.62Å; L103-Y199 HydrophobicContact CD2-CD2 4.04Å; L103-Y199 HydrophobicContact CD2-CE1 3.5Å; L103-Y199 VanDerWaalsContact CD2-CE1 3.5Å; L103-Y199 HydrophobicContact CD2-CE2 3.91Å; L103-Y199 HydrophobicContact CD2-CG 3.9Å; L103-Y199 HydrophobicContact CG-CE2 4.49Å; E178-Y199 CarbonylContact C-O 3.51Å; E178-Y199 VanDerWaalsContact CA-O 3.25Å; E178-Y199 WeakPolarHBondContact CA-O 2.98Å; F179-Y199 WeakPolarHBondContact CD1-O 3.15Å; F179-Y199 HydrophobicContact CD2-CD2 4.16Å; F179-Y199 HydrophobicContact CD2-CG 4.39Å; F179-Y199 HydrophobicContact CE1-CG 4.41Å; F179-Y199 AromaticContact CE2-CD2 3.78Å; F179-Y199 HydrophobicContact CE2-CD2 3.78Å; F179-Y199 AromaticContact CE2-CG 3.81Å; F179-Y199 HydrophobicContact CE2-CG 3.81Å; F179-Y199 HydrophobicContact CZ-CD2 4.29Å; F179-Y199 AromaticContact CZ-CG 3.83Å; F179-Y199 HydrophobicContact CZ-CG 3.83Å; F179-Y199 PolarHBondContact N-O 2.77Å; F179-Y199 PolarHBondContact O-N 3.08Å; D192-Y199 PolarHBondContact OD2-OH 3.44Å; N194-Y199 HydrophobicContact CB-CD1 4.01Å; N194-Y199 HydrophobicContact CB-CD2 4.2Å; N194-Y199 HydrophobicContact CB-CE1 3.75Å; N194-Y199 HydrophobicContact CB-CE2 3.96Å; N194-Y199 HydrophobicContact CB-CG 4.23Å
200	E	96.9	Very high	93.3	Very high	31 Å²	31	56.3 Å²	56.3	15%	0.145	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	139.2	178.3	64	165.5	-128.5	0	0	113.7	N81 F82 I177 E178 R210	N81-E200 HydrophobicContact CB-CG 4.1Å; N81-E200 PolarHBondContact N-O 3.3Å; N81-E200 PolarHBondContact ND2-OE1 3.18Å; F82-E200 VanDerWaalsContact CD1-O 3.23Å; F82-E200 WeakPolarHBondContact CD1-O 3.42Å; I177-E200 WeakPolarHBondContact O-CA 3.41Å; E178-E200 HydrophobicContact CG-CB 4.28Å; E200-R210 IonicContact OE1-CZ 2.68Å; E200-R210 IonicContact OE1-NH1 3.96Å; E200-R210 PolarHBondContact OE1-NH1 3.27Å; E200-R210 IonicContact OE1-NH2 3.91Å
201	I	96	Very high	92.5	Very high	0 Å²	0	61 Å²	61	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	140.1	162.4	60.1	174.8	0	0	0	108.5	W78 I79 V80 L115 L164 T166 K176 I177	W78-I201 HydrophobicContact CE3-CB 4.36Å; W78-I201 HydrophobicContact CE3-CD1 4.18Å; W78-I201 HydrophobicContact CE3-CG1 4.06Å; W78-I201 HydrophobicContact CZ3-CG1 4.33Å; I79-I201 VanDerWaalsContact O-CA 3.28Å; I79-I201 WeakPolarHBondContact O-CA 3.33Å; V80-I201 HydrophobicContact CG2-CG2 4.26Å; L115-I201 HydrophobicContact CD1-CG2 4.2Å; L115-I201 HydrophobicContact CD2-CG2 4Å; L164-I201 HydrophobicContact CD2-CD1 4.49Å; T166-I201 HydrophobicContact CG2-CD1 3.44Å; T166-I201 VanDerWaalsContact CG2-CD1 3.44Å; K176-I201 WeakPolarHBondContact CA-O 3.26Å; I177-I201 HydrophobicContact CB-CD1 4.11Å; I177-I201 HydrophobicContact CB-CG1 3.71Å; I177-I201 HydrophobicContact CD1-CD1 4.04Å; I177-I201 HydrophobicContact CD1-CG1 4.44Å; I177-I201 HydrophobicContact CG2-CG1 4.43Å; I177-I201 PolarHBondContact N-O 3.16Å; I177-I201 PolarHBondContact O-N 2.8Å
202	I	94.5	Very high	91.3	Very high	1 Å²	1	64.7 Å²	64.7	1%	0.005	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	153	-177.8	63.8	-179.6	0	0	0	110.4	W78 I79 N81 Q175 K176 L206 R207	W78-I202 CarbonylContact C-O 3.54Å; I79-I202 PolarHBondContact N-O 3.22Å; I79-I202 PolarHBondContact O-N 3.24Å; N81-I202 HydrophobicContact CB-CD1 3.83Å; N81-I202 HydrophobicContact CB-CG1 3.9Å; N81-I202 HydrophobicContact CB-CG2 4.39Å; Q175-I202 WeakPolarHBondContact O-CA 3.4Å; K176-I202 HydrophobicContact CB-CG2 4.28Å; K176-I202 HydrophobicContact CG-CG2 4.08Å; I202-L206 HydrophobicContact CB-CD2 4.13Å; I202-L206 HydrophobicContact CG2-CD2 3.97Å; I202-R207 HydrophobicContact CD1-CB 3.78Å; I202-R207 HydrophobicContact CD1-CG 4.27Å; I202-R207 HydrophobicContact CG1-CB 4.36Å
203	S	92.3	Very high	89.4	Confident	2 Å²	2	67.3 Å²	67.3	1%	0.014	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	150.3	168.1	67.2	0	0	0	0	110.7	E77 Q175 H205 L206 R207	E77-S203 CarbonylContact O-C 3.35Å; E77-S203 WeakPolarHBondContact O-CA 3.21Å; Q175-S203 VanDerWaalsContact CD-OG 3.29Å; Q175-S203 PolarHBondContact O-N 2.84Å; Q175-S203 PolarHBondContact OE1-OG 2.93Å; S203-H205 PolarHBondContact O-N 2.64Å; S203-L206 PolarHBondContact O-N 3.24Å; S203-L206 VanDerWaalsContact O-N 3.14Å; S203-L206 WeakPolarHBondContact OG-CB 3.48Å; S203-L206 PolarHBondContact OG-N 2.72Å; S203-R207 PolarHBondContact O-N 3.43Å
204	D	89	Confident	87.4	Confident	20 Å²	20	71.6 Å²	71.6	11%	0.107	35%	0.348	C	S	.	.	H	α-helix	trans	-60	-33.1	173.4	-174.5	56.1	0	0	0	111.7	E77 I79 R207 K208	E77-D204 HydrophobicContact CB-CB 4.08Å; E77-D204 HydrophobicContact CG-CB 4.4Å; E77-D204 PolarHBondContact O-N 3.36Å; I79-D204 HydrophobicContact CD1-CB 3.94Å; I79-D204 VanDerWaalsContact CD1-OD1 3.3Å; I79-D204 WeakPolarHBondContact CD1-OD1 3.36Å; D204-R207 WeakPolarHBondContact O-CB 3.36Å; D204-R207 PolarHBondContact O-N 3.28Å; D204-R207 IonicContact OD1-NH1 2.75Å; D204-K208 WeakPolarHBondContact O-CB 3.39Å; D204-K208 WeakPolarHBondContact O-CG 3.23Å; D204-K208 PolarHBondContact O-N 3.46Å; D204-K208 WeakPolarHBondContact OD2-CD 3.23Å; D204-K208 WeakPolarHBondContact OD2-CE 3.47Å; D204-K208 IonicContact OD2-NZ 3.68Å; D204-K208 PolarHBondContact OD2-NZ 2.8Å
205	H	86.8	Confident	85.5	Confident	119 Å²	119	74.2 Å²	74.2	55%	0.551	38%	0.375	S	S	*	.	H	α-helix	trans	-60.5	-46.5	172.9	174.7	-94.8	0	0	0	112.7	Q175 S203 R207 K208 K209	Q175-H205 PolarHBondContact OE1-ND1 2.97Å; Q175-H205 VanDerWaalsContact OE1-ND1 3.15Å; S203-H205 PolarHBondContact O-N 2.64Å; H205-R207 VanDerWaalsContact C-N 3.32Å; H205-R207 PolarHBondContact O-N 2.93Å; H205-K208 PolarHBondContact O-N 2.85Å; H205-K209 WeakPolarHBondContact O-CB 3.42Å; H205-K209 PolarHBondContact O-N 2.89Å
206	L	90.1	Very high	83.3	Confident	34 Å²	34	80.4 Å²	80.4	18%	0.178	40%	0.396	C	S	.	.	H	α-helix	trans	-66.1	-38.1	176.7	178.3	61.9	0	0	0	111.5	Q175 K176 I202 S203 K209 R210	Q175-L206 HydrophobicContact CB-CB 4.02Å; Q175-L206 HydrophobicContact CB-CD2 4.1Å; K176-L206 HydrophobicContact CB-CD2 4.09Å; I202-L206 HydrophobicContact CB-CD2 4.13Å; I202-L206 HydrophobicContact CG2-CD2 3.97Å; S203-L206 PolarHBondContact O-N 3.24Å; S203-L206 VanDerWaalsContact O-N 3.14Å; S203-L206 WeakPolarHBondContact OG-CB 3.48Å; S203-L206 PolarHBondContact OG-N 2.72Å; L206-K209 PolarHBondContact O-N 3.23Å; L206-R210 HydrophobicContact CD1-CG 4.44Å; L206-R210 WeakPolarHBondContact O-CG 3.32Å; L206-R210 PolarHBondContact O-N 2.79Å
207	R	90.3	Very high	80.9	Confident	56 Å²	56	79.3 Å²	79.3	21%	0.211	39%	0.394	C	S	.	.	H	α-helix	trans	-58.5	-51.6	174.1	-175.4	-175.9	175.8	-142.5	-1.7	111.3	I202 S203 D204 H205 K209 R210 M211 Y242	I202-R207 HydrophobicContact CD1-CB 3.78Å; I202-R207 HydrophobicContact CD1-CG 4.27Å; I202-R207 HydrophobicContact CG1-CB 4.36Å; S203-R207 PolarHBondContact O-N 3.43Å; D204-R207 WeakPolarHBondContact O-CB 3.36Å; D204-R207 PolarHBondContact O-N 3.28Å; D204-R207 IonicContact OD1-NH1 2.75Å; H205-R207 VanDerWaalsContact C-N 3.32Å; H205-R207 PolarHBondContact O-N 2.93Å; R207-K209 VanDerWaalsContact C-N 3.34Å; R207-K209 PolarHBondContact O-N 3.2Å; R207-R210 PolarHBondContact O-N 2.89Å; R207-M211 WeakPolarHBondContact O-CG 3.39Å; R207-M211 PolarHBondContact O-N 2.93Å; R207-M211 VanDerWaalsContact O-N 3.12Å; R207-Y242 PolarHBondContact NH2-O 2.75Å
208	K	87.5	Confident	78.3	Confident	78 Å²	78	80.7 Å²	80.7	34%	0.339	40%	0.402	S	S	.	.	H	α-helix	trans	-57.7	-44.6	176.6	-76.4	168.5	170.2	161.4	0	111.6	H63 D204 H205 R210 M211 Q212	H63-K208 PolarHBondContact NE2-NZ 3.16Å; D204-K208 WeakPolarHBondContact O-CB 3.39Å; D204-K208 WeakPolarHBondContact O-CG 3.23Å; D204-K208 PolarHBondContact O-N 3.46Å; D204-K208 WeakPolarHBondContact OD2-CD 3.23Å; D204-K208 WeakPolarHBondContact OD2-CE 3.47Å; D204-K208 IonicContact OD2-NZ 3.68Å; D204-K208 PolarHBondContact OD2-NZ 2.8Å; H205-K208 PolarHBondContact O-N 2.85Å; K208-R210 PolarHBondContact O-N 2.59Å; K208-M211 PolarHBondContact O-N 2.87Å; K208-Q212 WeakPolarHBondContact O-CG 3.41Å; K208-Q212 PolarHBondContact O-N 2.95Å
209	K	87.4	Confident	75.5	Confident	142 Å²	142	87.1 Å²	87.1	62%	0.617	44%	0.437	S	S	*	.	H	α-helix	trans	-60	-42.6	175.8	-173.9	178.8	-179.9	178.6	0	112.5	H205 L206 R207 M211 Q212	H205-K209 WeakPolarHBondContact O-CB 3.42Å; H205-K209 PolarHBondContact O-N 2.89Å; L206-K209 PolarHBondContact O-N 3.23Å; R207-K209 VanDerWaalsContact C-N 3.34Å; R207-K209 PolarHBondContact O-N 3.2Å; K209-M211 VanDerWaalsContact C-N 3.33Å; K209-M211 PolarHBondContact O-N 3.42Å; K209-Q212 PolarHBondContact O-N 3.43Å
210	R	88.5	Confident	72.8	Confident	103 Å²	103	92.1 Å²	92.1	39%	0.389	47%	0.473	S	S	.	.	H	α-helix	trans	-63.3	-37.7	177.1	-76.6	176	169.3	177.3	-4.6	112	N81 E200 L206 R207 K208 Q212 S213	N81-R210 PolarHBondContact ND2-NH1 2.68Å; E200-R210 IonicContact OE1-CZ 2.68Å; E200-R210 IonicContact OE1-NH1 3.96Å; E200-R210 PolarHBondContact OE1-NH1 3.27Å; E200-R210 IonicContact OE1-NH2 3.91Å; L206-R210 HydrophobicContact CD1-CG 4.44Å; L206-R210 WeakPolarHBondContact O-CG 3.32Å; L206-R210 PolarHBondContact O-N 2.79Å; R207-R210 PolarHBondContact O-N 2.89Å; K208-R210 PolarHBondContact O-N 2.59Å; R210-Q212 VanDerWaalsContact C-N 3.29Å; R210-Q212 PolarHBondContact O-N 2.79Å; R210-S213 PolarHBondContact O-N 3.09Å; R210-S213 PolarHBondContact O-OG 2.68Å
211	M	81.2	Confident	70.2	Confident	134 Å²	134	98.7 Å²	98.7	66%	0.66	51%	0.505	S	S	*	.	H	α-helix	trans	-70.3	-20.5	178.8	-64.7	-171.4	85.8	0	0	114.2	R207 K208 K209	R207-M211 WeakPolarHBondContact O-CG 3.39Å; R207-M211 PolarHBondContact O-N 2.93Å; R207-M211 VanDerWaalsContact O-N 3.12Å; K208-M211 PolarHBondContact O-N 2.87Å; K209-M211 VanDerWaalsContact C-N 3.33Å; K209-M211 PolarHBondContact O-N 3.42Å
212	Q	73.2	Confident	67.4	Low	160 Å²	160	107 Å²	107	75%	0.748	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-5.4	177.9	-65.9	173.2	17.7	0	0	113.3	K208 K209 R210	K208-Q212 WeakPolarHBondContact O-CG 3.41Å; K208-Q212 PolarHBondContact O-N 2.95Å; K209-Q212 PolarHBondContact O-N 3.43Å; R210-Q212 VanDerWaalsContact C-N 3.29Å; R210-Q212 PolarHBondContact O-N 2.79Å
213	S	57.9	Low	64.8	Low	59 Å²	59	110.6 Å²	110.6	41%	0.413	59%	0.587	S	S	.	*			trans	-70.3	131.9	-178.5	67.1	0	0	0	0	111.9	R210 A215	R210-S213 PolarHBondContact O-N 3.09Å; R210-S213 PolarHBondContact O-OG 2.68Å; S213-A215 PolarHBondContact O-N 2.99Å
214	P	53.7	Low	62.5	Low	112 Å²	112	116.2 Å²	116.2	73%	0.727	63%	0.626	S	S	*	*	G	3₁₀ helix	trans	-64.6	-1.5	-174.7	-23.4	32.9	0	0	0	116.8	Y216 V217	P214-Y216 PolarHBondContact O-N 3.23Å; P214-Y216 VanDerWaalsContact O-N 3.16Å; P214-V217 PolarHBondContact O-N 3.37Å
215	A	55.9	Low	59.8	Low	94 Å²	94	120 Å²	120	78%	0.777	66%	0.66	S	S	*	*	G	3₁₀ helix	trans	-72.7	-3.7	-174	0	0	0	0	0	114.7	S213	S213-A215 PolarHBondContact O-N 2.99Å
216	Y	45.8	Very low	57.6	Low	229 Å²	229	125.6 Å²	125.6	90%	0.898	68%	0.676	S	S	*	*	G	3₁₀ helix	trans	-102.5	2	179.2	-121.3	-88	0	0	0	114.9	P214	P214-Y216 PolarHBondContact O-N 3.23Å; P214-Y216 VanDerWaalsContact O-N 3.16Å
217	V	42.8	Very low	54.9	Low	120 Å²	120	129.3 Å²	129.3	73%	0.727	70%	0.703	S	S	*	*	S	Bend	trans	-112.1	-10.8	-170.8	-174.6	0	0	0	0	114	P214 N219	P214-V217 PolarHBondContact O-N 3.37Å; V217-N219 PolarHBondContact O-N 2.99Å
218	H	39.9	Very low	52.5	Low	166 Å²	166	133.9 Å²	133.9	77%	0.769	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.4	69	-172.9	-161.3	-78.8	0	0	0	113.2
219	N	38.2	Very low	50	Low	165 Å²	165	138.8 Å²	138.8	88%	0.882	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-157.6	20.3	163.3	-110.2	-4.4	0	0	0	115.8	V217	V217-N219 PolarHBondContact O-N 2.99Å
220	S	41.1	Very low	47.5	Very low	110 Å²	110	136.3 Å²	136.3	77%	0.769	76%	0.761	S	S	*	*	S	Bend	trans	-142.7	40.6	-178.6	-173.6	0	0	0	0	114.1
221	M	42.9	Very low	45.1	Very low	168 Å²	168	137.1 Å²	137.1	83%	0.828	78%	0.783	S	S	*	*			trans	-150.4	68.6	167.9	-70.1	-168.5	-178.9	0	0	110.2
222	N	37.2	Very low	42.7	Very low	175 Å²	175	134 Å²	134	94%	0.936	79%	0.785	S	S	*	*			trans	-150.4	85.4	161.9	-97.3	-16.6	0	0	0	108.2
223	G	39.7	Very low	40.8	Very low	76 Å²	76	133.4 Å²	133.4	78%	0.784	78%	0.784	S	S	*	*			trans	-154.3	103.6	178.1	0	0	0	0	0	108.5
224	S	42.8	Very low	39.7	Very low	121 Å²	121	138.1 Å²	138.1	85%	0.846	79%	0.793	S	S	*	*			trans	-51.7	145.2	-174.1	47.9	0	0	0	0	115.7
225	A	33.8	Very low	38.7	Very low	98 Å²	98	137.7 Å²	137.7	81%	0.81	79%	0.793	S	S	*	*			trans	-47.8	132.1	175.4	0	0	0	0	0	115.7
226	R	39.2	Very low	37.6	Very low	238 Å²	238	141 Å²	141	90%	0.898	79%	0.79	S	S	*	*			trans	-151.1	134.8	145.1	-75.2	-163.5	170	-175.4	-5	110.1
227	P	34.6	Very low	36.8	Very low	112 Å²	112	136.7 Å²	136.7	73%	0.727	79%	0.792	S	S	*	*			trans	-86.6	136.1	171.3	34.1	-27.6	0	0	0	108.9
228	N	39.7	Very low	36.6	Very low	152 Å²	152	137 Å²	137	81%	0.813	79%	0.788	S	S	*	*			trans	177.8	126.9	144.8	-88.6	-23.7	0	0	0	111.7
229	H	34.5	Very low	36.2	Very low	180 Å²	180	133.6 Å²	133.6	83%	0.833	78%	0.783	S	S	*	*			trans	46.4	124.4	146.6	-84.5	-90.7	0	0	0	121.3
230	A	35.4	Very low	35.8	Very low	91 Å²	91	135.2 Å²	135.2	75%	0.752	78%	0.782	S	S	*	*			trans	78.1	134.6	156.8	0	0	0	0	0	117.7
231	S	36.7	Very low	35.2	Very low	120 Å²	120	133.9 Å²	133.9	84%	0.839	77%	0.771	S	S	*	*			trans	72.3	88.8	175.5	66.6	0	0	0	0	117.4
232	G	31.5	Very low	34.7	Very low	68 Å²	68	132.9 Å²	132.9	70%	0.701	76%	0.76	S	S	*	*			trans	-61.6	162.4	147.7	0	0	0	0	0	110.3
233	M	34.3	Very low	34.5	Very low	148 Å²	148	130.4 Å²	130.4	73%	0.729	75%	0.751	S	S	*	*			cis	-170.8	154	11.6	-108.6	163.7	96.9	0	0	105.6
234	Y	35.1	Very low	34.4	Very low	157 Å²	157	132.5 Å²	132.5	62%	0.616	75%	0.749	S	S	*	*			trans	84.6	79.9	165.4	-59.1	-72.2	0	0	0	120.2
235	S	31.4	Very low	34	Very low	103 Å²	103	131.7 Å²	131.7	72%	0.72	74%	0.739	S	S	*	*			trans	-63.3	130.4	133.6	65.8	0	0	0	0	110.4
236	K	33	Very low	34.1	Very low	165 Å²	165	130.6 Å²	130.6	72%	0.717	73%	0.725	S	S	*	*			trans	147.9	76.5	150.9	-84.3	175.6	-178.2	-179.9	0	110
237	C	29	Very low	33.6	Very low	137 Å²	137	126.4 Å²	126.4	93%	0.926	72%	0.718	S	S	*	*			trans	-95.6	83.5	163.5	-60.8	0	0	0	0	107.8
238	I	39.8	Very low	33.3	Very low	128 Å²	128	126.3 Å²	126.3	66%	0.656	72%	0.72	S	S	*	*			trans	-93.9	120.4	173.1	-69.8	174.2	0	0	0	108.7	K240	I238-K240 PolarHBondContact O-N 2.93Å
239	S	30.8	Very low	32.8	Very low	94 Å²	94	126.3 Å²	126.3	66%	0.657	72%	0.716	S	S	*	*			trans	-6.1	104.5	166.7	66.4	0	0	0	0	117.5
240	K	29.5	Very low	32.5	Very low	199 Å²	199	125.8 Å²	125.8	87%	0.865	72%	0.72	S	S	*	*			trans	-147.7	87.1	158.3	-72.8	-170.9	-179.9	179.3	0	109.4	I238	I238-K240 PolarHBondContact O-N 2.93Å
241	C	28.1	Very low	32.4	Very low	81 Å²	81	126 Å²	126	55%	0.547	71%	0.712	S	S	.	*			trans	-160.2	39.7	174.6	-103.3	0	0	0	0	114.8
242	Y	31.8	Very low	32.1	Very low	147 Å²	147	128.7 Å²	128.7	58%	0.576	71%	0.711	S	S	*	*			trans	-145.7	84.1	162.5	-62.2	-75.2	0	0	0	110.6	R207	R207-Y242 PolarHBondContact NH2-O 2.75Å
243	T	34	Very low	32	Very low	124 Å²	124	132 Å²	132	76%	0.761	71%	0.712	S	S	*	*			trans	-124.4	92.5	157.2	-24.8	0	0	0	0	105	T245	T243-T245 VanDerWaalsContact C-N 3.31Å; T243-T245 PolarHBondContact O-N 2.83Å
244	T	37.2	Very low	31.8	Very low	120 Å²	120	132.9 Å²	132.9	74%	0.736	72%	0.72	S	S	*	*			trans	-81.3	93.4	165.1	-44.2	0	0	0	0	104.5	S246	T244-S246 PolarHBondContact O-N 2.94Å; T244-S246 VanDerWaalsContact O-N 3.14Å
245	T	35.6	Very low	31.8	Very low	104 Å²	104	136.7 Å²	136.7	64%	0.638	73%	0.733	S	S	*	*			trans	-58.2	117.1	167.4	-53.2	0	0	0	0	106.7	T243 M247	T243-T245 VanDerWaalsContact C-N 3.31Å; T243-T245 PolarHBondContact O-N 2.83Å; T245-M247 VanDerWaalsContact C-N 3.3Å; T245-M247 PolarHBondContact O-N 2.96Å
246	S	34.1	Very low	32.1	Very low	74 Å²	74	141.2 Å²	141.2	52%	0.517	74%	0.74	S	S	.	*			trans	-57.5	95.2	165.8	171.2	0	0	0	0	108	T244	T244-S246 PolarHBondContact O-N 2.94Å; T244-S246 VanDerWaalsContact O-N 3.14Å
247	M	30.7	Very low	32.3	Very low	151 Å²	151	136.7 Å²	136.7	74%	0.744	74%	0.74	S	S	*	*			trans	-94.7	107.1	156	-77.9	-171.7	170	0	0	105.6	T245 M249	T245-M247 VanDerWaalsContact C-N 3.3Å; T245-M247 PolarHBondContact O-N 2.96Å; M247-M249 VanDerWaalsContact C-N 3.3Å; M247-M249 PolarHBondContact O-N 2.81Å
248	S	27.4	Very low	32.9	Very low	110 Å²	110	134.6 Å²	134.6	77%	0.769	72%	0.719	S	S	*	*			trans	-54.4	98.4	162.8	-82.7	0	0	0	0	108.4
249	M	29.3	Very low	33.1	Very low	151 Å²	151	133.4 Å²	133.4	74%	0.744	71%	0.709	S	S	*	*			trans	-127.5	106.6	161.7	-75.5	-166.4	170.9	0	0	107	M247 V251	M247-M249 VanDerWaalsContact C-N 3.3Å; M247-M249 PolarHBondContact O-N 2.81Å; M249-V251 VanDerWaalsContact C-N 3.35Å; M249-V251 HydrophobicContact CB-CG2 4.28Å; M249-V251 PolarHBondContact O-N 3.25Å
250	N	27.6	Very low	33.4	Very low	170 Å²	170	135 Å²	135	91%	0.909	70%	0.704	S	S	*	*			trans	-60.8	95.4	166.9	-134.4	0.5	0	0	0	107
251	V	34.1	Very low	34.2	Very low	96 Å²	96	128.7 Å²	128.7	58%	0.582	68%	0.684	S	S	*	*			trans	-146.6	111	172.4	-170.1	0	0	0	0	109.6	M249 N253	M249-V251 VanDerWaalsContact C-N 3.35Å; M249-V251 HydrophobicContact CB-CG2 4.28Å; M249-V251 PolarHBondContact O-N 3.25Å; V251-N253 HydrophobicContact CG1-CB 4.26Å; V251-N253 PolarHBondContact O-N 3.4Å
252	Q	29.9	Very low	35	Very low	176 Å²	176	130.8 Å²	130.8	82%	0.822	68%	0.681	S	S	*	*			trans	-64.1	84.8	159.7	-68.9	-175.3	-11.7	0	0	108.9
253	N	30.2	Very low	35.6	Very low	136 Å²	136	127 Å²	127	73%	0.727	67%	0.671	S	S	*	*			trans	-171.1	96.9	159.4	-94.9	-46.9	0	0	0	109.6	V251 R255	V251-N253 HydrophobicContact CG1-CB 4.26Å; V251-N253 PolarHBondContact O-N 3.4Å; N253-R255 PolarHBondContact O-N 3.28Å
254	L	29.9	Very low	36.4	Very low	168 Å²	168	127.9 Å²	127.9	88%	0.88	68%	0.675	S	S	*	*			trans	-63.8	103.6	164	-90.4	92.3	0	0	0	108.7
255	R	35.1	Very low	36.6	Very low	236 Å²	236	127.4 Å²	127.4	89%	0.891	67%	0.668	S	S	*	*			trans	-99.8	119.3	155.9	-81	-168.6	177	-174.1	1.5	108.9	N253 G257	N253-R255 PolarHBondContact O-N 3.28Å; R255-G257 PolarHBondContact O-N 2.84Å; R255-G257 VanDerWaalsContact O-N 3.07Å
256	F	37.5	Very low	37.7	Very low	198 Å²	198	126.3 Å²	126.3	87%	0.868	66%	0.662	S	S	*	*			trans	-53.1	108.9	168.8	-79.6	-96.3	0	0	0	109.9
257	G	36.4	Very low	38.2	Very low	71 Å²	71	124.2 Å²	124.2	73%	0.732	65%	0.652	S	S	*	*			trans	-81.3	114.9	173.1	0	0	0	0	0	110.7	R255 K259	R255-G257 PolarHBondContact O-N 2.84Å; R255-G257 VanDerWaalsContact O-N 3.07Å; G257-K259 PolarHBondContact O-N 3.22Å
258	I	42.6	Very low	38.8	Very low	93 Å²	93	122.1 Å²	122.1	48%	0.477	64%	0.64	S	S	.	*			trans	-71.4	121.6	167.6	-61.6	168.7	0	0	0	107.4	F260 R271	I258-F260 HydrophobicContact CB-CE2 4.33Å; I258-F260 HydrophobicContact CG2-CD2 4.2Å; I258-F260 HydrophobicContact CG2-CE2 3.68Å; I258-F260 HydrophobicContact CG2-CZ 3.86Å; I258-R271 HydrophobicContact CG2-CG 4.07Å
259	K	43.2	Very low	39.5	Very low	102 Å²	102	120.7 Å²	120.7	44%	0.443	63%	0.627	S	S	.	*			trans	-88.7	131.8	171.4	-77.5	-176.9	177.1	178.2	0	110.3	G257 A272	G257-K259 PolarHBondContact O-N 3.22Å; K259-A272 WeakPolarHBondContact O-CB 3.45Å; K259-A272 PolarHBondContact O-N 3Å
260	F	38.3	Very low	40.2	Very low	127 Å²	127	120.5 Å²	120.5	56%	0.557	62%	0.622	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-108.4	135.4	169	-69.2	-84.5	0	0	0	109	I258 T269 R271	I258-F260 HydrophobicContact CB-CE2 4.33Å; I258-F260 HydrophobicContact CG2-CD2 4.2Å; I258-F260 HydrophobicContact CG2-CE2 3.68Å; I258-F260 HydrophobicContact CG2-CZ 3.86Å; F260-T269 HydrophobicContact CB-CG2 3.68Å; F260-T269 HydrophobicContact CD1-CG2 3.86Å; F260-T269 HydrophobicContact CG-CG2 4.09Å; F260-R271 HydrophobicContact CD1-CB 4.22Å; F260-R271 HydrophobicContact CE1-CB 3.92Å; F260-R271 HydrophobicContact CE1-CG 4.15Å
261	C	45.8	Very low	40.8	Very low	67 Å²	67	120.3 Å²	120.3	45%	0.453	61%	0.609	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-108.1	129.6	172	-70.1	0	0	0	0	108.7	K270	C261-K270 PolarHBondContact N-O 3.09Å; C261-K270 VanDerWaalsContact N-O 3.12Å; C261-K270 PolarHBondContact O-N 2.9Å
262	R	44.1	Very low	41.5	Very low	126 Å²	126	117.8 Å²	117.8	48%	0.475	60%	0.598	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-100.7	129.9	175	-165.5	174.5	-172.8	164.2	-1.4	109.9	D46 V264 G267 E268	D46-R262 PolarHBondContact O-NH1 2.74Å; R262-V264 PolarHBondContact O-N 3.4Å; R262-G267 PolarHBondContact NE-O 3.46Å; R262-G267 VanDerWaalsContact NE-O 3.07Å; R262-E268 WeakPolarHBondContact CA-O 3.35Å
263	N	44.9	Very low	41.9	Very low	67 Å²	67	114.8 Å²	114.8	36%	0.358	60%	0.596	S	S	.	*			trans	-74.1	118.9	171.6	-175.3	-28.4	0	0	0	108.8	N265 T266 G267 E268	N263-N265 PolarHBondContact O-N 3.32Å; N263-N265 PolarHBondContact OD1-N 3.27Å; N263-T266 VanDerWaalsContact CB-OG1 3.25Å; N263-T266 WeakPolarHBondContact CB-OG1 3.32Å; N263-T266 PolarHBondContact ND2-OG1 3.05Å; N263-T266 PolarHBondContact O-N 2.88Å; N263-T266 PolarHBondContact OD1-N 3.48Å; N263-G267 WeakPolarHBondContact O-CA 3.01Å; N263-G267 PolarHBondContact O-N 2.84Å; N263-E268 PolarHBondContact N-O 3.12Å
264	V	51.1	Low	42.4	Very low	142 Å²	142	120.3 Å²	120.3	86%	0.861	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.5	-21.7	-175.7	-158.7	0	0	0	0	112.1	R262	R262-V264 PolarHBondContact O-N 3.4Å
265	N	40.7	Very low	43	Very low	110 Å²	110	117.9 Å²	117.9	59%	0.588	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.3	-29.9	-177.3	-62.1	-28.6	0	0	0	112.8	N263	N263-N265 PolarHBondContact O-N 3.32Å; N263-N265 PolarHBondContact OD1-N 3.27Å
266	T	59.4	Low	43.5	Very low	81 Å²	81	111.7 Å²	111.7	50%	0.497	58%	0.579	S	S	.	*	T	Hydrogen-bonded Turn	trans	-110.2	-9.8	-177.3	65.6	0	0	0	0	113.7	N263 E268	N263-T266 VanDerWaalsContact CB-OG1 3.25Å; N263-T266 WeakPolarHBondContact CB-OG1 3.32Å; N263-T266 PolarHBondContact ND2-OG1 3.05Å; N263-T266 PolarHBondContact O-N 2.88Å; N263-T266 PolarHBondContact OD1-N 3.48Å; T266-E268 PolarHBondContact O-N 3.13Å; T266-E268 VanDerWaalsContact O-N 3.08Å; T266-E268 WeakPolarHBondContact OG1-CB 3.33Å; T266-E268 PolarHBondContact OG1-N 2.96Å; T266-E268 PolarHBondContact OG1-OE2 3.31Å
267	G	44.1	Very low	43.8	Very low	30 Å²	30	106.9 Å²	106.9	31%	0.309	56%	0.563	S	S	.	*			trans	68.8	-2.7	-173.8	0	0	0	0	0	114.2	R262 N263	R262-G267 PolarHBondContact NE-O 3.46Å; R262-G267 VanDerWaalsContact NE-O 3.07Å; N263-G267 WeakPolarHBondContact O-CA 3.01Å; N263-G267 PolarHBondContact O-N 2.84Å
268	E	43.2	Very low	44.2	Very low	107 Å²	107	109 Å²	109	50%	0.5	55%	0.553	S	S	.	*			trans	-70	129.9	-178	-70.8	-178.4	143.3	0	0	111.6	R262 N263 T266	R262-E268 WeakPolarHBondContact CA-O 3.35Å; N263-E268 PolarHBondContact N-O 3.12Å; T266-E268 PolarHBondContact O-N 3.13Å; T266-E268 VanDerWaalsContact O-N 3.08Å; T266-E268 WeakPolarHBondContact OG1-CB 3.33Å; T266-E268 PolarHBondContact OG1-N 2.96Å; T266-E268 PolarHBondContact OG1-OE2 3.31Å
269	T	41.9	Very low	44.3	Very low	81 Å²	81	110 Å²	110	50%	0.497	56%	0.558	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-98.1	121.3	173.8	-52.5	0	0	0	0	108.9	F260	F260-T269 HydrophobicContact CB-CG2 3.68Å; F260-T269 HydrophobicContact CD1-CG2 3.86Å; F260-T269 HydrophobicContact CG-CG2 4.09Å
270	K	44.3	Very low	44.4	Very low	146 Å²	146	110.5 Å²	110.5	64%	0.635	57%	0.566	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-114.4	138	172.4	-69.7	-173.8	-179.8	178.9	0	110.2	C261 A272	C261-K270 PolarHBondContact N-O 3.09Å; C261-K270 VanDerWaalsContact N-O 3.12Å; C261-K270 PolarHBondContact O-N 2.9Å; K270-A272 PolarHBondContact O-N 3.05Å
271	R	41.2	Very low	44.8	Very low	167 Å²	167	109.4 Å²	109.4	63%	0.63	57%	0.566	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-68	125.8	172.8	-172.5	176.8	-179	171.5	-0.5	108.3	I258 F260 S273	I258-R271 HydrophobicContact CG2-CG 4.07Å; F260-R271 HydrophobicContact CD1-CB 4.22Å; F260-R271 HydrophobicContact CE1-CB 3.92Å; F260-R271 HydrophobicContact CE1-CG 4.15Å; R271-S273 PolarHBondContact O-N 3.43Å
272	A	47.8	Very low	44.8	Very low	42 Å²	42	112.6 Å²	112.6	35%	0.347	58%	0.575	S	S	.	*			trans	-74.5	112	170.8	0	0	0	0	0	108.4	K259 K270	K259-A272 WeakPolarHBondContact O-CB 3.45Å; K259-A272 PolarHBondContact O-N 3Å; K270-A272 PolarHBondContact O-N 3.05Å
273	S	38.3	Very low	44.8	Very low	113 Å²	113	111.5 Å²	111.5	79%	0.79	58%	0.583	S	S	*	*			trans	-84.7	125.2	163.7	-56.1	0	0	0	0	107.5	R271	R271-S273 PolarHBondContact O-N 3.43Å
274	Y	40.9	Very low	44.8	Very low	252 Å²	252	115.5 Å²	115.5	99%	0.988	60%	0.604	S	S	*	*			trans	-75.6	0	164.4	-82.3	-87.1	0	0	0	109.9

Retrieved 274 of 274 residues in 409.4 ms (Link to these results)

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