A0A077ZJV9_TRITR Loading...

Trypsin domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZJV9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 899 aa.

						>A0A077ZJV9_TRITR|A0A077ZJV9
MLQSGKPQKPGSPALPPCSKPVKPAQPAPPVQKPVYCGNTDSFGRTVESYVTGNNAQDMFPWNVIITSKIMGSTKCIGSLVHRGGYQQIANTSDLIITAADCFVKYTPASAKSELLVFANSPRFSRLKRRGIKAEIVDVNLYGLAWGNSETRRGIAILKLERPLSRKDNVVPVCLAERDSVPPPSASCYVTYYDKRDHRMDEEIVMITRKPRCLAASSKVPQYRGVCTMEEKKKEYIQLGSPMVCLVNGRAYQYGVYLNQLSLKINDKVKQNLGFYSEINVAHDVFSGKKVQTLSADLHRQLGVKSYKPIQASSSSSSSASRETHRRRTLVIPDVFIPIPTKLPTISKPEQKRSKSSSSSSSSSSDSSSKHRHISREIKDSSKSAEEADDSTRVIRLNVKVVKTRLAALLRFNKTKRPHHPGSSSSSLGEEIKPYPLPDRPKGPVICPGPGQRPVKPIPDSSSGVLVCPTPNNAVEIVPLPTPLPTAEYPSSSLEAVNMVILPSLPKYDMSDQTIADHEHILVRDNIVGESAIAHGRTASCDIIGTGDSMHSLLPGKSSGEITGNEIDSRIPDVTEALETVPCTRGDSTGHHQYDHLPGASGVHIFMITGSSIEPLCTGTLYARRGQEYSDEVVTASRCIPPKGNINYKVYIGSLLPRKMAVDQLNRTLIDVGSIHESPFYEGYDELKEIGLTMLKLKHRVKVINGVQSFPLPYSVRIQYQLLTPTECKQHLGNKFLPSVMYCGVGQKNILKYPIGSPLLCQSSGNWVQFGIYDHSFPTSRSYAAVQSENEIVPDDVALFVKLEGDNVGRVQNEDSLIEGRNFDVKDRKQGDDEGGNRVAGVLLRKVEHAFYIVTDPVTKKRSQLQVVSGGDLHLLVILVEPNINRLVRSHLGEPSSSR
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.2	Very low	40.8	Very low	234 Å²	234	153.2 Å²	153.2	100%	1.153	86%	0.863	S	S	*	*				0	162.5	0	-79.3	177.4	162.2	0	0	109.2
2	L	35	Very low	41.3	Very low	149 Å²	149	150.4 Å²	150.4	78%	0.78	86%	0.861	S	S	*	*			trans	59.3	87.5	159.5	-68	160.6	0	0	0	119.3
3	Q	35.4	Very low	41.6	Very low	176 Å²	176	147.8 Å²	147.8	82%	0.822	85%	0.853	S	S	*	*				45	115.4	121.2	-64.4	177.1	-8	0	0	121.9
4	S	39	Very low	41.4	Very low	130 Å²	130	144.6 Å²	144.6	91%	0.909	85%	0.853	S	S	*	*				43.5	122.2	122.8	-158.9	0	0	0	0	121.7
5	G	40.1	Very low	42.2	Very low	78 Å²	78	145.8 Å²	145.8	80%	0.804	85%	0.853	S	S	*	*			trans	-165.2	125.4	161.1	0	0	0	0	0	113.8
6	K	46.7	Very low	42.8	Very low	203 Å²	203	143.1 Å²	143.1	88%	0.883	84%	0.841	S	S	*	*			trans	-115.6	146.7	166.1	-93.1	-179.3	175.2	175.5	0	107.8
7	P	42.7	Very low	43.2	Very low	128 Å²	128	142.1 Å²	142.1	83%	0.831	84%	0.84	S	S	*	*				-144.2	-137.9	96.4	37.3	-18.2	0	0	0	114.5
8	Q	39.3	Very low	43.3	Very low	188 Å²	188	141.2 Å²	141.2	88%	0.879	84%	0.84	S	S	*	*			trans	-114.2	172.5	-147.6	-67.6	168.1	-74.2	0	0	116.9
9	K	46.9	Very low	43.9	Very low	199 Å²	199	139.8 Å²	139.8	87%	0.865	84%	0.839	S	S	*	*			trans	-48.5	159.5	179.7	-66.8	-179.1	170.6	-177.2	0	116
10	P	41.9	Very low	44.6	Very low	129 Å²	129	142.5 Å²	142.5	84%	0.838	84%	0.839	S	S	*	*				-141.7	150.7	107.8	38.1	-26.4	0	0	0	116.8
11	G	42.1	Very low	45.1	Very low	71 Å²	71	141.7 Å²	141.7	73%	0.732	84%	0.838	S	S	*	*			trans	86.3	125.4	137.9	0	0	0	0	0	123.1
12	S	46.5	Very low	45.8	Very low	120 Å²	120	137.2 Å²	137.2	84%	0.839	82%	0.823	S	S	*	*			trans	71.1	157.9	148.9	-145	0	0	0	0	120.2
13	P	44.6	Very low	46.7	Very low	116 Å²	116	138.4 Å²	138.4	75%	0.753	82%	0.822	S	S	*	*			cis	-112.9	-177.1	-23.3	14.1	9.7	0	0	0	112.5
14	A	38.8	Very low	47.5	Very low	103 Å²	103	135.4 Å²	135.4	85%	0.851	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-78.2	145	177.8	0	0	0	0	0	113.5
15	L	54.6	Low	48.3	Very low	163 Å²	163	133.8 Å²	133.8	85%	0.853	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-98.6	149.8	174.4	-78.1	165.3	0	0	0	111.7
16	P	51	Low	49.1	Very low	102 Å²	102	138.3 Å²	138.3	66%	0.662	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-69.4	159.3	178.4	29.8	-35.6	0	0	0	112.6	C18	P16-C18 PolarHBondContact O-N 2.81Å
17	P	50	Low	49.2	Very low	126 Å²	126	134.5 Å²	134.5	82%	0.818	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-64.7	132.3	-174.4	26.3	-35.2	0	0	0	112.6	S19	P17-S19 PolarHBondContact O-N 2.75Å
18	C	45.1	Very low	49.4	Very low	126 Å²	126	132.6 Å²	132.6	85%	0.851	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-65.4	119.9	-179.5	-59.5	0	0	0	0	112.1	P16 K20	P16-C18 PolarHBondContact O-N 2.81Å; C18-K20 PolarHBondContact O-N 3.08Å
19	S	54.9	Low	49.9	Very low	116 Å²	116	129 Å²	129	81%	0.811	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-54.1	133.2	165.8	-54.7	0	0	0	0	110.7	P17	P17-S19 PolarHBondContact O-N 2.75Å
20	K	57.9	Low	50.2	Low	193 Å²	193	125 Å²	125	84%	0.839	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-60.4	138.5	174.8	-68.2	178.5	-180	175.8	0	109.7	C18 V22	C18-K20 PolarHBondContact O-N 3.08Å; K20-V22 PolarHBondContact O-N 3.19Å
21	P	53.8	Low	50.9	Low	126 Å²	126	125.6 Å²	125.6	82%	0.818	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-63.3	121.7	-179.6	25.5	-33.7	0	0	0	110.3	K23	P21-K23 PolarHBondContact O-N 3.42Å
22	V	55.1	Low	51.9	Low	139 Å²	139	129.2 Å²	129.2	84%	0.842	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-66.2	118.5	172.6	177.6	0	0	0	0	107.8	K20	K20-V22 PolarHBondContact O-N 3.19Å
23	K	54.4	Low	53.3	Low	175 Å²	175	130.9 Å²	130.9	76%	0.761	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-60.2	125.3	177.9	-171.9	178.5	-177.7	-177.8	0	108.6	P21 A25	P21-K23 PolarHBondContact O-N 3.42Å; K23-A25 PolarHBondContact O-N 1.77Å
24	P	52.3	Low	55.2	Low	112 Å²	112	128.3 Å²	128.3	73%	0.727	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-59.6	135.9	-179	24	-33.4	0	0	0	110	Q26	P24-Q26 PolarHBondContact O-N 2.74Å
25	A	55.6	Low	57.6	Low	97 Å²	97	123.8 Å²	123.8	80%	0.802	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-59.9	130.8	177.9	0	0	0	0	0	109.6	K23	K23-A25 PolarHBondContact O-N 1.77Å
26	Q	56.4	Low	59.4	Low	173 Å²	173	119.6 Å²	119.6	81%	0.808	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-64.8	137.9	175.3	-68.7	-178.9	-94.2	0	0	109.2	P24 A28	P24-Q26 PolarHBondContact O-N 2.74Å; Q26-A28 PolarHBondContact O-N 3.28Å
27	P	50.5	Low	61.5	Low	122 Å²	122	114.7 Å²	114.7	79%	0.792	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-54.1	133.9	171.3	-24.7	34.1	0	0	0	110.2
28	A	45.4	Very low	63.6	Low	89 Å²	89	108.7 Å²	108.7	74%	0.736	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-57.9	138.5	173.3	0	0	0	0	0	109.4	Q26	Q26-A28 PolarHBondContact O-N 3.28Å
29	P	50.9	Low	65.9	Low	111 Å²	111	104 Å²	104	72%	0.721	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-59.6	138.3	-179.6	25.1	-33.9	0	0	0	109.9	V31	P29-V31 PolarHBondContact O-N 3.31Å
30	P	52.5	Low	67.7	Low	115 Å²	115	98.5 Å²	98.5	75%	0.747	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-58.9	128.1	-173.1	22.6	-33.5	0	0	0	110.7	Q32	P30-Q32 PolarHBondContact O-N 3.39Å
31	V	56.3	Low	69.2	Low	142 Å²	142	94.1 Å²	94.1	86%	0.861	54%	0.543	S	S	*	.			trans	-61.7	106.8	-176.3	-177.8	0	0	0	0	109.2	P29 K33	P29-V31 PolarHBondContact O-N 3.31Å; V31-K33 PolarHBondContact O-N 2.99Å; V31-K33 VanDerWaalsContact O-N 3.16Å
32	Q	64.2	Low	70.8	Confident	147 Å²	147	88.7 Å²	88.7	69%	0.687	51%	0.508	S	S	*	.			trans	-69.2	113.2	-178.6	-71.4	172.6	65.8	0	0	109.1	P30	P30-Q32 PolarHBondContact O-N 3.39Å
33	K	75.5	Confident	72.3	Confident	156 Å²	156	84.6 Å²	84.6	68%	0.678	48%	0.479	S	S	*	.	P	Polyproline II helix	trans	-50	131.2	173.9	-66.8	-172.5	178.9	-176.1	0	109.8	V31 V35	V31-K33 PolarHBondContact O-N 2.99Å; V31-K33 VanDerWaalsContact O-N 3.16Å; K33-V35 PolarHBondContact O-N 3.3Å
34	P	83.8	Confident	73.9	Confident	62 Å²	62	79.7 Å²	79.7	40%	0.403	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-62.2	136.6	-178.3	25.5	-34.1	0	0	0	110.8	Y36 I89	P34-Y36 HydrophobicContact CB-CE2 4.06Å; P34-Y36 HydrophobicContact CG-CE2 3.91Å; P34-I89 HydrophobicContact CB-CD1 4.13Å; P34-I89 HydrophobicContact CB-CG1 4.23Å; P34-I89 HydrophobicContact CB-CG2 4.47Å
35	V	89.3	Confident	75.4	Confident	7 Å²	7	78.3 Å²	78.3	4%	0.042	46%	0.459	C	S	.	.	P	Polyproline II helix	trans	-91.9	135.5	174.5	179.3	0	0	0	0	108.7	K33 I89 A90 N91 R166 V171	K33-V35 PolarHBondContact O-N 3.3Å; V35-I89 CarbonylContact O-C 3.3Å; V35-I89 WeakPolarHBondContact O-CA 3.48Å; V35-A90 PolarHBondContact O-N 3.02Å; V35-N91 PolarHBondContact N-OD1 2.85Å; V35-R166 HydrophobicContact CG2-CB 4.21Å; V35-V171 HydrophobicContact CG1-CB 4.42Å; V35-V171 HydrophobicContact CG1-CG1 3.86Å; V35-V171 HydrophobicContact CG1-CG2 3.78Å
36	Y	93.5	Very high	76.9	Confident	75 Å²	75	77.3 Å²	77.3	29%	0.294	44%	0.443	S	S	.	.	B	Isolated β-bridge	trans	-118.6	151.7	173.3	-61.5	-83.5	0	0	0	109.7	P34 Q87 Q88 I89 V171	P34-Y36 HydrophobicContact CB-CE2 4.06Å; P34-Y36 HydrophobicContact CG-CE2 3.91Å; Y36-Q87 WeakPolarHBondContact CE1-O 3.25Å; Y36-Q88 WeakPolarHBondContact CD1-O 3.43Å; Y36-I89 HydrophobicContact CE1-CG1 4.17Å; Y36-V171 WeakPolarHBondContact O-CG1 3.46Å
37	C	95.1	Very high	78.5	Confident	0 Å²	0	69.1 Å²	69.1	0%	0	41%	0.405	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	147.5	178.7	63.7	0	0	0	0	111.8	N39 H82 A90 P172 C174 R250	C37-N39 PolarHBondContact O-N 3.18Å; C37-N39 VanDerWaalsContact O-N 3.07Å; C37-H82 HydrophobicContact CB-CB 3.57Å; C37-A90 HydrophobicContact CB-CB 4.18Å; C37-P172 CarbonylContact C-O 3.52Å; C37-P172 WeakPolarHBondContact CA-O 3.03Å; C37-P172 WeakPolarHBondContact CB-O 3.4Å; C37-C174 HydrophobicContact CB-CB 4.02Å; C37-C174 WeakPolarHBondContact CB-SG 3.39Å; C37-C174 PolarHBondContact O-SG 3.11Å; C37-C174 WeakPolarHBondContact SG-CA 3.26Å; C37-C174 WeakPolarHBondContact SG-CB 3.43Å; C37-C174 CovalentContact SG-SG 2.05Å; C37-C174 PolarHBondContact SG-SG 3.27Å; C37-R250 PolarHBondContact O-NH1 3.38Å
38	G	94.1	Very high	80	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.9	9.4	176	0	0	0	0	0	115.8	V47 P172 R250 A251	G38-V47 WeakPolarHBondContact O-CG2 2.98Å; G38-P172 PolarHBondContact N-O 2.84Å; G38-R250 WeakPolarHBondContact O-CG 3.4Å; G38-A251 WeakPolarHBondContact CA-O 3.48Å; G38-A251 PolarHBondContact O-N 2.81Å
39	N	93.5	Very high	81.8	Confident	28 Å²	28	62.1 Å²	62.1	15%	0.15	35%	0.348	C	S	.	.			trans	-118.3	126.5	-179.6	-175.9	-3.3	0	0	0	111	C37 D41	C37-N39 PolarHBondContact O-N 3.18Å; C37-N39 VanDerWaalsContact O-N 3.07Å; N39-D41 PolarHBondContact ND2-OD2 3.42Å; N39-D41 WeakPolarHBondContact OD1-CB 3.06Å; N39-D41 PolarHBondContact OD1-N 3.22Å; N39-D41 PolarHBondContact OD1-OD1 2.88Å; N39-D41 PolarHBondContact OD1-OD2 2.95Å; N39-D41 VanDerWaalsContact OD1-OD2 3.12Å
40	T	92	Very high	83.4	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	32%	0.317	C	S	.	.			trans	-100.3	4.5	-179.3	55.5	0	0	0	0	114.7	S42 F43 R45 T46 V47 Y50 P61 W62	T40-S42 PolarHBondContact O-N 3.48Å; T40-F43 HydrophobicContact CG2-CD2 4.46Å; T40-F43 WeakPolarHBondContact O-CA 3.28Å; T40-F43 WeakPolarHBondContact O-CB 3.14Å; T40-F43 PolarHBondContact O-N 2.87Å; T40-R45 CarbonylContact C-O 3.57Å; T40-R45 WeakPolarHBondContact CB-O 3.36Å; T40-R45 VanDerWaalsContact O-O 3.06Å; T40-R45 PolarHBondContact OG1-O 2.76Å; T40-T46 PolarHBondContact OG1-O 3.08Å; T40-V47 HydrophobicContact CG2-CG2 4.3Å; T40-V47 WeakPolarHBondContact OG1-CA 3.32Å; T40-V47 PolarHBondContact OG1-N 2.72Å; T40-Y50 HydrophobicContact CG2-CD2 4.4Å; T40-Y50 HydrophobicContact CG2-CE2 3.66Å; T40-P61 HydrophobicContact CG2-CG 3.68Å; T40-W62 HydrophobicContact CG2-CZ3 4.33Å
41	D	89.6	Confident	84.3	Confident	101 Å²	101	53.4 Å²	53.4	54%	0.54	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-49.8	-30	174.5	-70.6	-24	0	0	0	112.9	N39 F43 G44 R45	N39-D41 PolarHBondContact ND2-OD2 3.42Å; N39-D41 WeakPolarHBondContact OD1-CB 3.06Å; N39-D41 PolarHBondContact OD1-N 3.22Å; N39-D41 PolarHBondContact OD1-OD1 2.88Å; N39-D41 PolarHBondContact OD1-OD2 2.95Å; N39-D41 VanDerWaalsContact OD1-OD2 3.12Å; D41-F43 PolarHBondContact O-N 2.76Å; D41-G44 PolarHBondContact O-N 3.41Å; D41-R45 PolarHBondContact N-O 2.82Å
42	S	87.2	Confident	84.7	Confident	11 Å²	11	49.1 Å²	49.1	8%	0.077	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-67.3	-15.4	176.7	81	0	0	0	0	114	T40 R166	T40-S42 PolarHBondContact O-N 3.48Å; S42-R166 PolarHBondContact O-NE 3.37Å; S42-R166 PolarHBondContact O-NH2 3.15Å
43	F	87.2	Confident	84.4	Confident	53 Å²	53	45 Å²	45	23%	0.232	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-98.9	4.5	168.9	-57.3	-56.9	0	0	0	113.1	T40 D41 R45 P61 R166 N169 V171	T40-F43 HydrophobicContact CG2-CD2 4.46Å; T40-F43 WeakPolarHBondContact O-CA 3.28Å; T40-F43 WeakPolarHBondContact O-CB 3.14Å; T40-F43 PolarHBondContact O-N 2.87Å; D41-F43 PolarHBondContact O-N 2.76Å; F43-R45 VanDerWaalsContact C-N 3.3Å; F43-P61 HydrophobicContact CE2-CB 3.84Å; F43-P61 HydrophobicContact CE2-CG 4.04Å; F43-R166 HydrophobicContact CE1-CG 3.88Å; F43-R166 HydrophobicContact CZ-CG 4.42Å; F43-N169 HydrophobicContact CE1-CB 4.48Å; F43-V171 HydrophobicContact CD2-CG2 4.46Å; F43-V171 HydrophobicContact CE2-CB 4.26Å; F43-V171 HydrophobicContact CE2-CG2 3.52Å; F43-V171 HydrophobicContact CZ-CG2 3.74Å
44	G	86.1	Confident	83.2	Confident	73 Å²	73	45 Å²	45	75%	0.753	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.2	23.3	-175.8	0	0	0	0	0	113.8	D41	D41-G44 PolarHBondContact O-N 3.41Å
45	R	84.9	Confident	82	Confident	82 Å²	82	45.9 Å²	45.9	31%	0.309	27%	0.269	S	S	.	.			trans	-136.7	138.8	-175	-71.7	-175.3	175.6	-176.3	-1.2	111.2	T40 D41 F43 Y50 D58	T40-R45 CarbonylContact C-O 3.57Å; T40-R45 WeakPolarHBondContact CB-O 3.36Å; T40-R45 VanDerWaalsContact O-O 3.06Å; T40-R45 PolarHBondContact OG1-O 2.76Å; D41-R45 PolarHBondContact N-O 2.82Å; F43-R45 VanDerWaalsContact C-N 3.3Å; R45-Y50 HydrophobicContact CB-CE2 4.31Å; R45-D58 IonicContact CZ-OD2 3.77Å; R45-D58 IonicContact NH1-OD2 2.69Å; R45-D58 PolarHBondContact NH1-OD2 2.93Å; R45-D58 IonicContact NH2-OD2 2.82Å
46	T	87.9	Confident	80.7	Confident	77 Å²	77	47.5 Å²	47.5	47%	0.472	28%	0.283	S	S	.	.			trans	-70.3	156.3	170.3	57.7	0	0	0	0	111	T40 E48 S49	T40-T46 PolarHBondContact OG1-O 3.08Å; T46-E48 VanDerWaalsContact C-N 3.27Å; T46-E48 PolarHBondContact O-N 3.23Å; T46-S49 WeakPolarHBondContact O-CB 3.25Å; T46-S49 PolarHBondContact O-N 3.18Å; T46-S49 PolarHBondContact O-OG 3.1Å
47	V	88.4	Confident	79.3	Confident	1 Å²	1	49.5 Å²	49.5	1%	0.006	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-66.8	-35.8	-177.4	-172.2	0	0	0	0	110.9	G38 T40 S49 Y50 F60 W62 L246 G249 A251	G38-V47 WeakPolarHBondContact O-CG2 2.98Å; T40-V47 HydrophobicContact CG2-CG2 4.3Å; T40-V47 WeakPolarHBondContact OG1-CA 3.32Å; T40-V47 PolarHBondContact OG1-N 2.72Å; V47-S49 PolarHBondContact O-N 2.88Å; V47-Y50 PolarHBondContact O-N 2.86Å; V47-F60 HydrophobicContact CG1-CE1 4.1Å; V47-W62 HydrophobicContact CG1-CH2 3.83Å; V47-L246 HydrophobicContact CB-CD2 4.37Å; V47-L246 HydrophobicContact CG1-CD1 4.45Å; V47-L246 HydrophobicContact CG1-CD2 3.5Å; V47-L246 VanDerWaalsContact CG1-CD2 3.5Å; V47-G249 WeakPolarHBondContact CG2-O 3.09Å; V47-A251 HydrophobicContact CG1-CB 4.03Å
48	E	82.3	Confident	78.5	Confident	50 Å²	50	52.5 Å²	52.5	23%	0.234	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-60.2	-27.3	176.4	-66.7	71.2	-162.8	0	0	112.6	T46 Y50 V51 T52 L246	T46-E48 VanDerWaalsContact C-N 3.27Å; T46-E48 PolarHBondContact O-N 3.23Å; E48-Y50 PolarHBondContact O-N 3.2Å; E48-V51 CarbonylContact O-C 3.5Å; E48-V51 WeakPolarHBondContact O-CG2 3.24Å; E48-V51 PolarHBondContact O-N 2.91Å; E48-T52 PolarHBondContact O-N 3.49Å; E48-T52 PolarHBondContact O-OG1 2.87Å; E48-L246 HydrophobicContact CG-CD1 3.95Å
49	S	83.1	Confident	78.1	Confident	14 Å²	14	52.9 Å²	52.9	10%	0.098	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-69.5	-16.7	-178.8	72	0	0	0	0	114.7	T46 V47 V51 N55 A56	T46-S49 WeakPolarHBondContact O-CB 3.25Å; T46-S49 PolarHBondContact O-N 3.18Å; T46-S49 PolarHBondContact O-OG 3.1Å; V47-S49 PolarHBondContact O-N 2.88Å; S49-V51 VanDerWaalsContact C-N 3.26Å; S49-N55 CarbonylContact O-C 3.55Å; S49-N55 VanDerWaalsContact O-C 3.3Å; S49-N55 VanDerWaalsContact O-CB 3.24Å; S49-N55 WeakPolarHBondContact O-CB 3.41Å; S49-A56 PolarHBondContact O-N 2.85Å
50	Y	84.1	Confident	78.1	Confident	17 Å²	17	51.6 Å²	51.6	7%	0.067	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-77.1	-13.1	172.2	-68.5	-99.6	0	0	0	112.5	T40 R45 V47 E48 A56 D58 M59 F60 P61	T40-Y50 HydrophobicContact CG2-CD2 4.4Å; T40-Y50 HydrophobicContact CG2-CE2 3.66Å; R45-Y50 HydrophobicContact CB-CE2 4.31Å; V47-Y50 PolarHBondContact O-N 2.86Å; E48-Y50 PolarHBondContact O-N 3.2Å; Y50-A56 WeakPolarHBondContact O-CA 3.48Å; Y50-D58 HydrophobicContact CD1-CB 4.16Å; Y50-D58 WeakPolarHBondContact CD1-O 3.32Å; Y50-D58 HydrophobicContact CE1-CB 4.31Å; Y50-M59 WeakPolarHBondContact CD1-O 3.39Å; Y50-F60 HydrophobicContact CG-CD1 4.09Å; Y50-P61 HydrophobicContact CE1-CG 4.44Å
51	V	73.3	Confident	78.2	Confident	25 Å²	25	52 Å²	52	15%	0.152	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-132.4	5.1	-175.6	-69	0	0	0	0	113.5	E48 S49 F60 Y189 E202 L246	E48-V51 CarbonylContact O-C 3.5Å; E48-V51 WeakPolarHBondContact O-CG2 3.24Å; E48-V51 PolarHBondContact O-N 2.91Å; S49-V51 VanDerWaalsContact C-N 3.26Å; V51-F60 HydrophobicContact CG1-CE1 3.96Å; V51-F60 HydrophobicContact CG1-CE2 4.13Å; V51-F60 HydrophobicContact CG1-CZ 3.51Å; V51-F60 HydrophobicContact CG2-CZ 4.46Å; V51-Y189 HydrophobicContact CB-CD1 4.29Å; V51-Y189 HydrophobicContact CB-CE1 3.74Å; V51-Y189 HydrophobicContact CB-CE2 4.42Å; V51-Y189 HydrophobicContact CG1-CD1 3.92Å; V51-Y189 HydrophobicContact CG1-CE1 3.89Å; V51-Y189 HydrophobicContact CG1-CG 4.25Å; V51-Y189 HydrophobicContact CG2-CE1 4.06Å; V51-Y189 HydrophobicContact CG2-CE2 3.88Å; V51-E202 HydrophobicContact CG1-CB 3.81Å; V51-E202 HydrophobicContact CG1-CG 3.97Å; V51-L246 HydrophobicContact CG2-CD1 4.06Å
52	T	64.3	Low	78.5	Confident	52 Å²	52	47.2 Å²	47.2	32%	0.319	28%	0.283	S	S	.	.	S	Bend	trans	-142.2	144.9	177.4	59.1	0	0	0	0	111.9	E48	E48-T52 PolarHBondContact O-N 3.49Å; E48-T52 PolarHBondContact O-OG1 2.87Å
53	G	56.7	Low	78.9	Confident	62 Å²	62	46.8 Å²	46.8	64%	0.639	28%	0.28	S	S	*	.	S	Bend	trans	69.2	-171.1	-178.8	0	0	0	0	0	114	N55 A56	G53-N55 PolarHBondContact O-N 2.78Å; G53-N55 VanDerWaalsContact O-N 3.13Å; G53-A56 VanDerWaalsContact O-CB 3.27Å; G53-A56 WeakPolarHBondContact O-CB 3.41Å; G53-A56 PolarHBondContact O-N 3.19Å; G53-A56 VanDerWaalsContact O-N 3.08Å
54	N	50.3	Low	79.4	Confident	156 Å²	156	44.2 Å²	44.2	83%	0.834	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-19.7	-174	-65.9	-10.2	0	0	0	114	A56	N54-A56 VanDerWaalsContact C-N 3.26Å; N54-A56 PolarHBondContact O-N 3.31Å
55	N	58.5	Low	79.8	Confident	79 Å²	79	40.8 Å²	40.8	42%	0.422	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-8.8	176.9	-69.5	-36.4	0	0	0	113.5	S49 G53 Q57 D58	S49-N55 CarbonylContact O-C 3.55Å; S49-N55 VanDerWaalsContact O-C 3.3Å; S49-N55 VanDerWaalsContact O-CB 3.24Å; S49-N55 WeakPolarHBondContact O-CB 3.41Å; G53-N55 PolarHBondContact O-N 2.78Å; G53-N55 VanDerWaalsContact O-N 3.13Å; N55-Q57 PolarHBondContact O-N 2.93Å; N55-D58 PolarHBondContact O-N 2.94Å
56	A	63	Low	80.3	Confident	41 Å²	41	36.9 Å²	36.9	34%	0.339	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	32.6	177.3	0	0	0	0	0	114.5	S49 Y50 G53 N54	S49-A56 PolarHBondContact O-N 2.85Å; Y50-A56 WeakPolarHBondContact O-CA 3.48Å; G53-A56 VanDerWaalsContact O-CB 3.27Å; G53-A56 WeakPolarHBondContact O-CB 3.41Å; G53-A56 PolarHBondContact O-N 3.19Å; G53-A56 VanDerWaalsContact O-N 3.08Å; N54-A56 VanDerWaalsContact C-N 3.26Å; N54-A56 PolarHBondContact O-N 3.31Å
57	Q	63.1	Low	80.6	Confident	117 Å²	117	33.2 Å²	33.2	55%	0.547	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.3	-9.7	169.1	-57.7	-170.2	35	0	0	112.3	N55	N55-Q57 PolarHBondContact O-N 2.93Å
58	D	78.1	Confident	80.8	Confident	63 Å²	63	33.6 Å²	33.6	34%	0.337	20%	0.198	S	C	.	.	S	Bend	trans	-94.7	125.8	175.8	-74.4	-36.5	0	0	0	110.3	R45 Y50 N55	R45-D58 IonicContact CZ-OD2 3.77Å; R45-D58 IonicContact NH1-OD2 2.69Å; R45-D58 PolarHBondContact NH1-OD2 2.93Å; R45-D58 IonicContact NH2-OD2 2.82Å; Y50-D58 HydrophobicContact CD1-CB 4.16Å; Y50-D58 WeakPolarHBondContact CD1-O 3.32Å; Y50-D58 HydrophobicContact CE1-CB 4.31Å; N55-D58 PolarHBondContact O-N 2.94Å
59	M	87.5	Confident	81.1	Confident	9 Å²	9	34.4 Å²	34.4	4%	0.044	20%	0.201	C	C	.	.	P	Polyproline II helix	trans	-60.8	153.6	174.2	68.7	-172	-71.8	0	0	112.2	Y50 N63 S121 P122 M200	Y50-M59 WeakPolarHBondContact CD1-O 3.39Å; M59-N63 HydrophobicContact CE-CB 3.42Å; M59-N63 VanDerWaalsContact CE-CB 3.42Å; M59-N63 WeakPolarHBondContact CE-O 3.4Å; M59-S121 PolarHBondContact SD-N 2.92Å; M59-P122 HydrophobicContact CB-CB 4.44Å; M59-P122 HydrophobicContact CG-CB 4.22Å; M59-P122 VanDerWaalsContact SD-CA 3.58Å; M59-P122 HydrophobicContact SD-CB 4.22Å; M59-M200 HydrophobicContact CB-CB 4.41Å; M59-M200 HydrophobicContact CE-CB 4.47Å; M59-M200 HydrophobicContact CE-SD 3.65Å
60	F	93	Very high	81.2	Confident	1 Å²	1	40.3 Å²	40.3	0%	0.004	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-59.8	141.5	173.8	-69.7	-56.6	0	0	0	112.9	V47 Y50 V51 W62 N63 Y189 E202	V47-F60 HydrophobicContact CG1-CE1 4.1Å; Y50-F60 HydrophobicContact CG-CD1 4.09Å; V51-F60 HydrophobicContact CG1-CE1 3.96Å; V51-F60 HydrophobicContact CG1-CE2 4.13Å; V51-F60 HydrophobicContact CG1-CZ 3.51Å; V51-F60 HydrophobicContact CG2-CZ 4.46Å; F60-W62 HydrophobicContact CB-CD2 4.13Å; F60-W62 VanDerWaalsContact CB-CE2 3.42Å; F60-W62 HydrophobicContact CB-CG 4.49Å; F60-W62 HydrophobicContact CB-CH2 4.35Å; F60-W62 HydrophobicContact CB-CZ2 3.56Å; F60-W62 AromaticContact CD1-CH2 3.92Å; F60-W62 HydrophobicContact CD1-CH2 3.92Å; F60-W62 AromaticContact CD1-CZ2 3.46Å; F60-W62 HydrophobicContact CD1-CZ2 3.46Å; F60-W62 VanDerWaalsContact CD1-CZ2 3.46Å; F60-W62 AromaticContact CD2-CZ2 3.88Å; F60-W62 HydrophobicContact CD2-CZ2 3.88Å; F60-W62 AromaticContact CD2-NE1 3.85Å; F60-W62 HydrophobicContact CE1-CH2 4.42Å; F60-W62 HydrophobicContact CE1-CZ2 4.01Å; F60-W62 HydrophobicContact CE2-CZ2 4.37Å; F60-W62 AromaticContact CG-CE2 3.74Å; F60-W62 HydrophobicContact CG-CH2 4.25Å; F60-W62 AromaticContact CG-CZ2 3.4Å; F60-W62 HydrophobicContact CG-CZ2 3.4Å; F60-W62 AromaticContact CG-NE1 3.8Å; F60-W62 HydrophobicContact CZ-CZ2 4.42Å; F60-W62 PolarHBondContact O-N 2.89Å; F60-W62 VanDerWaalsContact O-N 3.09Å; F60-N63 WeakPolarHBondContact O-CB 3.32Å; F60-N63 PolarHBondContact O-N 3.17Å; F60-Y189 HydrophobicContact CZ-CD2 4.35Å; F60-Y189 HydrophobicContact CZ-CG 4.5Å; F60-E202 HydrophobicContact CD2-CG 3.44Å; F60-E202 VanDerWaalsContact CD2-CG 3.44Å; F60-E202 WeakPolarHBondContact CD2-OE1 3.29Å; F60-E202 HydrophobicContact CE2-CG 3.4Å; F60-E202 HydrophobicContact CG-CG 4.27Å; F60-E202 HydrophobicContact CZ-CG 4.19Å
61	P	94.2	Very high	81.3	Confident	9 Å²	9	44.4 Å²	44.4	6%	0.058	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	2	-169.1	30.2	-35.6	0	0	0	115.6	T40 F43 Y50 V170 V171	T40-P61 HydrophobicContact CG2-CG 3.68Å; F43-P61 HydrophobicContact CE2-CB 3.84Å; F43-P61 HydrophobicContact CE2-CG 4.04Å; Y50-P61 HydrophobicContact CE1-CG 4.44Å; P61-V170 WeakPolarHBondContact O-CA 3.39Å; P61-V170 WeakPolarHBondContact O-CB 3.35Å; P61-V170 WeakPolarHBondContact O-CG1 3.48Å; P61-V171 PolarHBondContact O-N 2.75Å
62	W	96.1	Very high	81.8	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-11.2	169.1	40.8	77.6	0	0	0	113.2	T40 V47 F60 S79 L80 V171 V173 V244 A251	T40-W62 HydrophobicContact CG2-CZ3 4.33Å; V47-W62 HydrophobicContact CG1-CH2 3.83Å; F60-W62 HydrophobicContact CB-CD2 4.13Å; F60-W62 VanDerWaalsContact CB-CE2 3.42Å; F60-W62 HydrophobicContact CB-CG 4.49Å; F60-W62 HydrophobicContact CB-CH2 4.35Å; F60-W62 HydrophobicContact CB-CZ2 3.56Å; F60-W62 AromaticContact CD1-CH2 3.92Å; F60-W62 HydrophobicContact CD1-CH2 3.92Å; F60-W62 AromaticContact CD1-CZ2 3.46Å; F60-W62 HydrophobicContact CD1-CZ2 3.46Å; F60-W62 VanDerWaalsContact CD1-CZ2 3.46Å; F60-W62 AromaticContact CD2-CZ2 3.88Å; F60-W62 HydrophobicContact CD2-CZ2 3.88Å; F60-W62 AromaticContact CD2-NE1 3.85Å; F60-W62 HydrophobicContact CE1-CH2 4.42Å; F60-W62 HydrophobicContact CE1-CZ2 4.01Å; F60-W62 HydrophobicContact CE2-CZ2 4.37Å; F60-W62 AromaticContact CG-CE2 3.74Å; F60-W62 HydrophobicContact CG-CH2 4.25Å; F60-W62 AromaticContact CG-CZ2 3.4Å; F60-W62 HydrophobicContact CG-CZ2 3.4Å; F60-W62 AromaticContact CG-NE1 3.8Å; F60-W62 HydrophobicContact CZ-CZ2 4.42Å; F60-W62 PolarHBondContact O-N 2.89Å; F60-W62 VanDerWaalsContact O-N 3.09Å; W62-S79 CarbonylContact O-C 3.06Å; W62-S79 WeakPolarHBondContact O-CA 3.3Å; W62-L80 HydrophobicContact CB-CB 4.4Å; W62-L80 PolarHBondContact O-N 3.38Å; W62-V171 WeakPolarHBondContact CB-O 3.35Å; W62-V173 HydrophobicContact CB-CB 4.09Å; W62-V173 HydrophobicContact CD2-CB 3.7Å; W62-V173 HydrophobicContact CD2-CG2 4.09Å; W62-V173 HydrophobicContact CE3-CB 4.07Å; W62-V173 HydrophobicContact CE3-CG2 4.43Å; W62-V173 HydrophobicContact CG-CB 3.71Å; W62-V173 HydrophobicContact CG-CG1 4.37Å; W62-V173 HydrophobicContact CG-CG2 4.45Å; W62-V244 HydrophobicContact CZ2-CG1 3.93Å; W62-A251 HydrophobicContact CH2-CB 3.19Å; W62-A251 HydrophobicContact CZ2-CB 3.5Å; W62-A251 HydrophobicContact CZ3-CB 3.92Å
63	N	95.8	Very high	82.9	Confident	1 Å²	1	41 Å²	41	1%	0.005	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	137.6	-173.2	-70.8	-24.1	0	0	0	112	M59 F60 T191 E202	M59-N63 HydrophobicContact CE-CB 3.42Å; M59-N63 VanDerWaalsContact CE-CB 3.42Å; M59-N63 WeakPolarHBondContact CE-O 3.4Å; F60-N63 WeakPolarHBondContact O-CB 3.32Å; F60-N63 PolarHBondContact O-N 3.17Å; N63-T191 WeakPolarHBondContact ND2-CG2 3.45Å; N63-T191 PolarHBondContact ND2-OG1 3.33Å; N63-E202 PolarHBondContact ND2-OE1 2.82Å
64	V	96.1	Very high	84.5	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	148.1	179.5	-60.3	0	0	0	0	112.4	I77 G78 I96 V117 F118 A119	V64-I77 CarbonylContact O-C 3.58Å; V64-I77 WeakPolarHBondContact O-CA 3.45Å; V64-G78 WeakPolarHBondContact CG2-O 3.37Å; V64-G78 PolarHBondContact N-O 3.26Å; V64-G78 PolarHBondContact O-N 3.27Å; V64-I96 HydrophobicContact CG2-CD1 4.03Å; V64-I96 HydrophobicContact CG2-CG1 4.13Å; V64-I96 HydrophobicContact CG2-CG2 3.75Å; V64-V117 HydrophobicContact CB-CG1 3.78Å; V64-V117 HydrophobicContact CG1-CG1 4.21Å; V64-V117 HydrophobicContact CG2-CG1 4.19Å; V64-F118 CarbonylContact C-O 3.47Å; V64-F118 WeakPolarHBondContact CA-O 2.93Å; V64-A119 HydrophobicContact CG1-CB 3.82Å
65	I	95.2	Very high	86.5	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	124	-179.7	-33.6	-165.5	0	0	0	108.8	T67 T74 V117 F118 F124 M200	I65-T67 HydrophobicContact CB-CG2 4.25Å; I65-T67 HydrophobicContact CG2-CG2 3.7Å; I65-T74 HydrophobicContact CG2-CG2 3.68Å; I65-V117 WeakPolarHBondContact O-CA 3.38Å; I65-F118 HydrophobicContact CB-CB 4.33Å; I65-F118 HydrophobicContact CG1-CB 4.41Å; I65-F118 PolarHBondContact N-O 3.04Å; I65-F118 PolarHBondContact O-N 2.92Å; I65-F124 HydrophobicContact CD1-CB 3.41Å; I65-F124 VanDerWaalsContact CD1-CB 3.41Å; I65-F124 HydrophobicContact CD1-CD1 4.39Å; I65-F124 HydrophobicContact CD1-CD2 4.03Å; I65-F124 HydrophobicContact CD1-CG 3.69Å; I65-M200 HydrophobicContact CB-CE 4.03Å; I65-M200 HydrophobicContact CD1-CE 3.93Å; I65-M200 HydrophobicContact CD1-CG 4.39Å; I65-M200 HydrophobicContact CD1-SD 3.93Å; I65-M200 HydrophobicContact CG1-CE 3.52Å; I65-M200 HydrophobicContact CG1-SD 3.74Å; I65-M200 HydrophobicContact CG2-CE 3.95Å
66	I	95.5	Very high	88.3	Confident	1 Å²	1	30.9 Å²	30.9	1%	0.005	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	121.6	174.7	-57.1	170.6	0	0	0	108.1	K75 C76 T98 L115 L158	I66-K75 PolarHBondContact O-N 2.62Å; I66-C76 HydrophobicContact CB-CB 4.22Å; I66-C76 HydrophobicContact CD1-CB 4.2Å; I66-C76 PolarHBondContact N-O 2.64Å; I66-C76 PolarHBondContact O-N 3.47Å; I66-T98 HydrophobicContact CD1-CG2 3.65Å; I66-T98 WeakPolarHBondContact CD1-OG1 3.47Å; I66-L115 HydrophobicContact CG2-CD1 4.43Å; I66-L158 HydrophobicContact CD1-CD1 3.92Å
67	T	94.2	Very high	89.8	Confident	0 Å²	0	29 Å²	29	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	155.4	-167.1	68.5	0	0	0	0	111.7	I65 S73 L115 L116 F118 F124	I65-T67 HydrophobicContact CB-CG2 4.25Å; I65-T67 HydrophobicContact CG2-CG2 3.7Å; T67-S73 WeakPolarHBondContact CA-O 3.23Å; T67-L115 CarbonylContact O-C 3.46Å; T67-L115 VanDerWaalsContact O-CA 3.27Å; T67-L115 WeakPolarHBondContact O-CA 3.18Å; T67-L115 WeakPolarHBondContact O-CD2 3.39Å; T67-L116 PolarHBondContact N-O 2.95Å; T67-L116 PolarHBondContact O-N 2.8Å; T67-L116 PolarHBondContact OG1-O 3.01Å; T67-F118 HydrophobicContact CG2-CD2 3.97Å; T67-F118 HydrophobicContact CG2-CE2 4.34Å; T67-F118 WeakPolarHBondContact OG1-CE2 3.23Å; T67-F124 HydrophobicContact CG2-CE1 3.78Å; T67-F124 HydrophobicContact CG2-CE2 4.36Å; T67-F124 HydrophobicContact CG2-CZ 3.64Å
68	S	92	Very high	91.5	Very high	8 Å²	8	23.4 Å²	23.4	6%	0.056	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	124.8	165.9	172.9	0	0	0	0	110.6	I70 M71 G72 S73	S68-I70 VanDerWaalsContact C-N 3.26Å; S68-I70 PolarHBondContact O-N 2.92Å; S68-M71 PolarHBondContact OG-N 3.37Å; S68-G72 VanDerWaalsContact O-CA 3.29Å; S68-G72 WeakPolarHBondContact O-CA 3.5Å; S68-G72 PolarHBondContact O-N 2.63Å; S68-S73 PolarHBondContact N-O 3.3Å
69	K	89.3	Confident	92.4	Very high	68 Å²	68	20.4 Å²	20.4	30%	0.296	10%	0.101	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-41.8	178.5	-161	172.1	-162.2	165.4	0	111.5	S113 E114 L116 R129 E135	K69-S113 WeakPolarHBondContact CD-O 3.47Å; K69-E114 VanDerWaalsContact CB-O 3.29Å; K69-E114 WeakPolarHBondContact CB-O 2.96Å; K69-E114 PolarHBondContact N-O 3.25Å; K69-L116 HydrophobicContact CB-CB 4.37Å; K69-L116 HydrophobicContact CG-CB 4.43Å; K69-L116 HydrophobicContact CG-CD2 4.47Å; K69-R129 PolarHBondContact O-NH1 2.86Å; K69-E135 IonicContact NZ-OE1 2.63Å; K69-E135 PolarHBondContact NZ-OE1 2.97Å; K69-E135 IonicContact NZ-OE2 3.76Å; K69-E135 PolarHBondContact NZ-OE2 3.4Å
70	I	85.7	Confident	92.9	Very high	137 Å²	137	20 Å²	20	70%	0.703	10%	0.099	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-72.3	176.3	-56.6	174.6	0	0	0	110.4	S68 G72 R129	S68-I70 VanDerWaalsContact C-N 3.26Å; S68-I70 PolarHBondContact O-N 2.92Å; I70-G72 VanDerWaalsContact C-N 3.25Å; I70-G72 PolarHBondContact O-N 2.81Å; I70-G72 VanDerWaalsContact O-N 3.16Å; I70-R129 PolarHBondContact O-NH2 2.92Å
71	M	84.7	Confident	93.1	Very high	103 Å²	103	20 Å²	20	51%	0.507	10%	0.099	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-18.7	-168.5	-62.1	-177.7	81.8	0	0	114.5	S68 S73	S68-M71 PolarHBondContact OG-N 3.37Å; M71-S73 WeakPolarHBondContact CB-OG 3.33Å; M71-S73 PolarHBondContact O-N 3.41Å; M71-S73 VanDerWaalsContact O-N 3.11Å
72	G	83.5	Confident	93	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	10%	0.101	C	C	.	.			trans	65.6	7.3	-171.7	0	0	0	0	0	114.3	S68 I70 T74 R129	S68-G72 VanDerWaalsContact O-CA 3.29Å; S68-G72 WeakPolarHBondContact O-CA 3.5Å; S68-G72 PolarHBondContact O-N 2.63Å; I70-G72 VanDerWaalsContact C-N 3.25Å; I70-G72 PolarHBondContact O-N 2.81Å; I70-G72 VanDerWaalsContact O-N 3.16Å; G72-T74 PolarHBondContact O-N 3.31Å; G72-R129 VanDerWaalsContact CA-CZ 3.44Å
73	S	87.3	Confident	92.7	Very high	7 Å²	7	28.3 Å²	28.3	5%	0.049	13%	0.13	C	C	.	.			trans	-76.3	124.5	177.8	45.1	0	0	0	0	110.6	T67 S68 M71 K75	T67-S73 WeakPolarHBondContact CA-O 3.23Å; S68-S73 PolarHBondContact N-O 3.3Å; M71-S73 WeakPolarHBondContact CB-OG 3.33Å; M71-S73 PolarHBondContact O-N 3.41Å; M71-S73 VanDerWaalsContact O-N 3.11Å; S73-K75 PolarHBondContact O-N 3.15Å; S73-K75 PolarHBondContact OG-NZ 3.06Å
74	T	91.5	Very high	92.2	Very high	15 Å²	15	29.2 Å²	29.2	9%	0.092	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-51.9	129.6	165.2	-52.5	0	0	0	0	109.6	I65 G72 Y193 I237	I65-T74 HydrophobicContact CG2-CG2 3.68Å; G72-T74 PolarHBondContact O-N 3.31Å; T74-Y193 HydrophobicContact CG2-CD1 3.99Å; T74-Y193 HydrophobicContact CG2-CE1 4.36Å; T74-Y193 HydrophobicContact CG2-CG 4.17Å; T74-I237 HydrophobicContact CG2-CD1 3.83Å; T74-I237 HydrophobicContact CG2-CG2 4.46Å
75	K	92.2	Very high	91.6	Very high	68 Å²	68	31 Å²	31	30%	0.296	16%	0.158	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	-45.5	176.7	-58.3	-50.5	-169.4	-166.7	0	111.1	I66 S73 L115	I66-K75 PolarHBondContact O-N 2.62Å; S73-K75 PolarHBondContact O-N 3.15Å; S73-K75 PolarHBondContact OG-NZ 3.06Å; K75-L115 HydrophobicContact CG-CD2 4.26Å
76	C	95.6	Very high	91	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.007	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	169	-175.4	-82.4	0	0	0	0	112.1	I66 C102 L239	I66-C76 HydrophobicContact CB-CB 4.22Å; I66-C76 HydrophobicContact CD1-CB 4.2Å; I66-C76 PolarHBondContact N-O 2.64Å; I66-C76 PolarHBondContact O-N 3.47Å; C76-C102 HydrophobicContact CB-CB 3.81Å; C76-C102 WeakPolarHBondContact CB-SG 3.41Å; C76-C102 WeakPolarHBondContact SG-CA 3.47Å; C76-C102 WeakPolarHBondContact SG-CB 3.4Å; C76-C102 CovalentContact SG-SG 2.01Å; C76-C102 PolarHBondContact SG-SG 2.7Å; C76-L239 WeakPolarHBondContact CA-O 3.31Å; C76-L239 VanDerWaalsContact CB-O 3.27Å; C76-L239 WeakPolarHBondContact CB-O 3.34Å; C76-L239 VanDerWaalsContact SG-CG 3.55Å; C76-L239 PolarHBondContact SG-O 2.93Å; C76-L239 VanDerWaalsContact SG-O 3.4Å
77	I	95.9	Very high	90.4	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	158.7	166.6	-53.8	-168.3	0	0	0	108.1	V64 T98 T191 Y192 M200 I237 L239 G240 S241	V64-I77 CarbonylContact O-C 3.58Å; V64-I77 WeakPolarHBondContact O-CA 3.45Å; I77-T98 PolarHBondContact O-OG1 3.46Å; I77-T191 HydrophobicContact CD1-CG2 4.35Å; I77-Y192 VanDerWaalsContact CD1-C 3.48Å; I77-M200 HydrophobicContact CB-CE 4.34Å; I77-M200 HydrophobicContact CD1-CE 3.62Å; I77-M200 HydrophobicContact CG1-CE 3.58Å; I77-M200 HydrophobicContact CG2-CE 4.16Å; I77-I237 WeakPolarHBondContact CD1-O 3.31Å; I77-L239 PolarHBondContact N-O 2.95Å; I77-G240 CarbonylContact O-C 3.54Å; I77-G240 WeakPolarHBondContact O-CA 3.49Å; I77-S241 WeakPolarHBondContact CB-OG 3.43Å; I77-S241 WeakPolarHBondContact CD1-OG 3.44Å
78	G	97.3	Very high	90.1	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	179.2	166.3	0	0	0	0	0	111.5	V64 I97	V64-G78 WeakPolarHBondContact CG2-O 3.37Å; V64-G78 PolarHBondContact N-O 3.26Å; V64-G78 PolarHBondContact O-N 3.27Å; G78-I97 CarbonylContact C-O 3.53Å; G78-I97 WeakPolarHBondContact CA-O 3.44Å
79	S	98	Very high	90	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	134.1	175.2	47.4	0	0	0	0	111.5	W62 I96 I97 Q253	W62-S79 CarbonylContact O-C 3.06Å; W62-S79 WeakPolarHBondContact O-CA 3.3Å; S79-I96 CarbonylContact O-C 3.5Å; S79-I96 VanDerWaalsContact O-CA 3.23Å; S79-I96 WeakPolarHBondContact O-CA 3.33Å; S79-I97 PolarHBondContact N-O 3.25Å; S79-I97 PolarHBondContact O-N 3.36Å; S79-Q253 VanDerWaalsContact OG-CD 3.25Å; S79-Q253 PolarHBondContact OG-NE2 3.25Å; S79-Q253 VanDerWaalsContact OG-NE2 3.1Å; S79-Q253 PolarHBondContact OG-OE1 2.55Å
80	L	97.4	Very high	89.9	Confident	1 Å²	1	48.6 Å²	48.6	1%	0.005	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	123.1	163.9	-169	75.6	0	0	0	108.6	W62 I96 L160 L164 V170 P172 V173	W62-L80 HydrophobicContact CB-CB 4.4Å; W62-L80 PolarHBondContact O-N 3.38Å; L80-I96 HydrophobicContact CD1-CG1 4.14Å; L80-L160 HydrophobicContact CD1-CD1 4.5Å; L80-L164 HydrophobicContact CD2-CB 4.26Å; L80-V170 HydrophobicContact CD2-CB 4.14Å; L80-V170 HydrophobicContact CD2-CG2 3.68Å; L80-P172 HydrophobicContact CD2-CB 4.4Å; L80-P172 HydrophobicContact CG-CB 4.25Å; L80-P172 CarbonylContact O-C 3.57Å; L80-P172 VanDerWaalsContact O-CA 3.25Å; L80-P172 WeakPolarHBondContact O-CA 2.96Å; L80-V173 PolarHBondContact O-N 2.9Å
81	V	96.8	Very high	89.9	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.228	C	C	.	.	B	Isolated β-bridge	trans	-119.6	158.1	-171.3	-61.6	0	0	0	0	113	S93 L95 I97 P172 V173 L175 F286	V81-S93 WeakPolarHBondContact O-CB 3.31Å; V81-S93 PolarHBondContact O-OG 2.88Å; V81-L95 HydrophobicContact CG2-CB 3.98Å; V81-L95 PolarHBondContact N-O 3.33Å; V81-I97 HydrophobicContact CB-CD1 4.39Å; V81-I97 HydrophobicContact CB-CG1 4.42Å; V81-I97 HydrophobicContact CG1-CB 4.27Å; V81-I97 HydrophobicContact CG1-CD1 3.85Å; V81-I97 HydrophobicContact CG1-CG1 3.8Å; V81-I97 HydrophobicContact CG2-CD1 3.95Å; V81-I97 HydrophobicContact CG2-CG1 3.77Å; V81-P172 VanDerWaalsContact C-CB 3.46Å; V81-V173 HydrophobicContact CG1-CG1 3.98Å; V81-L175 HydrophobicContact CB-CD2 3.94Å; V81-L175 HydrophobicContact CG1-CD2 3.9Å; V81-F286 HydrophobicContact CG2-CZ 4.34Å
82	H	93.4	Very high	90.3	Very high	23 Å²	23	45 Å²	45	11%	0.106	23%	0.227	C	C	.	.			trans	-104.3	135.3	168.8	-172.9	64.7	0	0	0	110.7	C37 G84 A90 P172 V173	C37-H82 HydrophobicContact CB-CB 3.57Å; H82-G84 PolarHBondContact CD2-N 3.21Å; H82-G84 VanDerWaalsContact CD2-N 3.27Å; H82-G84 PolarHBondContact CD2-O 2.92Å; H82-G84 WeakPolarHBondContact NE2-CA 3.29Å; H82-G84 PolarHBondContact NE2-N 2.84Å; H82-A90 HydrophobicContact CB-CB 4.23Å; H82-A90 WeakPolarHBondContact ND1-CB 3.37Å; H82-P172 HydrophobicContact CB-CB 4.17Å; H82-P172 HydrophobicContact CB-CG 4.12Å; H82-V173 PolarHBondContact N-O 2.88Å; H82-V173 VanDerWaalsContact N-O 3.16Å
83	R	89.5	Confident	90.8	Very high	161 Å²	161	45.3 Å²	45.3	61%	0.608	23%	0.229	S	C	*	.	S	Bend	trans	-81.5	-24.8	179.4	-179.8	173.1	174.7	-150	-0.4	113.4	L95 F286	R83-L95 HydrophobicContact CB-CD1 4.27Å; R83-F286 HydrophobicContact CG-CB 3.93Å; R83-F286 HydrophobicContact CG-CD1 4.19Å; R83-F286 HydrophobicContact CG-CD2 4.31Å; R83-F286 HydrophobicContact CG-CG 3.89Å; R83-F286 PolarHBondContact NE-O 2.88Å; R83-F286 PolarHBondContact NH2-O 3.26Å
84	G	84.9	Confident	91.2	Very high	21 Å²	21	47 Å²	47	22%	0.216	24%	0.237	C	C	.	.	S	Bend	trans	-80.4	171.9	179.9	0	0	0	0	0	113.7	H82	H82-G84 PolarHBondContact CD2-N 3.21Å; H82-G84 VanDerWaalsContact CD2-N 3.27Å; H82-G84 PolarHBondContact CD2-O 2.92Å; H82-G84 WeakPolarHBondContact NE2-CA 3.29Å; H82-G84 PolarHBondContact NE2-N 2.84Å
85	G	83.5	Confident	91.5	Very high	37 Å²	37	47.7 Å²	47.7	38%	0.381	24%	0.241	S	C	.	.			trans	-68.6	161.4	171.5	0	0	0	0	0	112.5	Q87 Q88	G85-Q87 PolarHBondContact O-N 2.81Å; G85-Q88 WeakPolarHBondContact O-CB 3.25Å; G85-Q88 PolarHBondContact O-N 2.8Å
86	Y	82.8	Confident	91.8	Very high	97 Å²	97	44.5 Å²	44.5	38%	0.38	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-19.6	-173.9	65.6	-90.3	0	0	0	115.4	R250	Y86-R250 PolarHBondContact O-NH1 3.26Å
87	Q	83.7	Confident	91.9	Very high	143 Å²	143	44.4 Å²	44.4	67%	0.668	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-9.4	174.7	-58.7	-176.8	-15.3	0	0	113.6	Y36 G85	Y36-Q87 WeakPolarHBondContact CE1-O 3.25Å; G85-Q87 PolarHBondContact O-N 2.81Å
88	Q	88.2	Confident	92	Very high	111 Å²	111	44.4 Å²	44.4	52%	0.519	23%	0.226	S	C	.	.	S	Bend	trans	-84.6	148.3	-178.5	-60.4	-179.3	19.9	0	0	111	Y36 G85 A90	Y36-Q88 WeakPolarHBondContact CD1-O 3.43Å; G85-Q88 WeakPolarHBondContact O-CB 3.25Å; G85-Q88 PolarHBondContact O-N 2.8Å; Q88-A90 PolarHBondContact O-N 3.03Å
89	I	88	Confident	91.9	Very high	95 Å²	95	44.4 Å²	44.4	49%	0.487	23%	0.226	S	C	.	.	B	Isolated β-bridge	trans	-76.4	124.1	-177.7	-62	175.3	0	0	0	109.3	P34 V35 Y36 N91	P34-I89 HydrophobicContact CB-CD1 4.13Å; P34-I89 HydrophobicContact CB-CG1 4.23Å; P34-I89 HydrophobicContact CB-CG2 4.47Å; V35-I89 CarbonylContact O-C 3.3Å; V35-I89 WeakPolarHBondContact O-CA 3.48Å; Y36-I89 HydrophobicContact CE1-CG1 4.17Å; I89-N91 HydrophobicContact CG2-CB 4.37Å; I89-N91 VanDerWaalsContact CG2-CG 3.4Å; I89-N91 WeakPolarHBondContact CG2-ND2 3.27Å; I89-N91 VanDerWaalsContact CG2-OD1 3.22Å; I89-N91 WeakPolarHBondContact CG2-OD1 3.02Å
90	A	88	Confident	91.8	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.008	23%	0.226	C	C	.	.			trans	-114.9	44.6	-172.3	0	0	0	0	0	111.9	V35 C37 H82 Q88 T92 P172	V35-A90 PolarHBondContact O-N 3.02Å; C37-A90 HydrophobicContact CB-CB 4.18Å; H82-A90 HydrophobicContact CB-CB 4.23Å; H82-A90 WeakPolarHBondContact ND1-CB 3.37Å; Q88-A90 PolarHBondContact O-N 3.03Å; A90-T92 PolarHBondContact O-N 2.88Å; A90-T92 VanDerWaalsContact O-N 3.16Å; A90-P172 HydrophobicContact CB-CG 3.84Å
91	N	86.9	Confident	91.6	Very high	85 Å²	85	46.1 Å²	46.1	46%	0.455	24%	0.235	S	C	.	.	S	Bend	trans	-57.5	-27.8	-176.4	-72.7	-16.5	0	0	0	114.2	V35 I89	V35-N91 PolarHBondContact N-OD1 2.85Å; I89-N91 HydrophobicContact CG2-CB 4.37Å; I89-N91 VanDerWaalsContact CG2-CG 3.4Å; I89-N91 WeakPolarHBondContact CG2-ND2 3.27Å; I89-N91 VanDerWaalsContact CG2-OD1 3.22Å; I89-N91 WeakPolarHBondContact CG2-OD1 3.02Å
92	T	91.7	Very high	91.5	Very high	79 Å²	79	46.6 Å²	46.6	49%	0.485	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	158.6	177.3	55.7	0	0	0	0	111.2	A90 P163 L164	A90-T92 PolarHBondContact O-N 2.88Å; A90-T92 VanDerWaalsContact O-N 3.16Å; T92-P163 HydrophobicContact CG2-CB 4.48Å; T92-L164 CarbonylContact C-O 3.22Å; T92-L164 WeakPolarHBondContact CA-O 3.26Å
93	S	95.1	Very high	91.5	Very high	7 Å²	7	45.6 Å²	45.6	5%	0.049	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	143.6	162.3	-178.1	0	0	0	0	111.4	V81 L95 P163 L164	V81-S93 WeakPolarHBondContact O-CB 3.31Å; V81-S93 PolarHBondContact O-OG 2.88Å; S93-L95 PolarHBondContact OG-N 3.11Å; S93-L95 VanDerWaalsContact OG-N 3.14Å; S93-P163 CarbonylContact O-C 3.56Å; S93-P163 WeakPolarHBondContact O-CA 3.22Å; S93-L164 PolarHBondContact N-O 2.89Å; S93-L164 PolarHBondContact O-N 3.14Å
94	D	95.9	Very high	91.4	Very high	41 Å²	41	39.6 Å²	39.6	22%	0.219	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	4.2	170.7	61.5	-23.8	0	0	0	112.6	K159 L160 P163	D94-K159 WeakPolarHBondContact O-CA 3.45Å; D94-K159 WeakPolarHBondContact OD2-CE 3.39Å; D94-K159 IonicContact OD2-NZ 3.96Å; D94-L160 HydrophobicContact CB-CB 4.32Å; D94-L160 PolarHBondContact O-N 2.9Å; D94-P163 HydrophobicContact CB-CB 4.25Å; D94-P163 HydrophobicContact CB-CG 4.15Å
95	L	96.8	Very high	91.6	Very high	31 Å²	31	45.4 Å²	45.4	16%	0.162	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	124.6	-173.1	-63.9	176.3	0	0	0	112.1	V81 R83 S93 I157 F286	V81-L95 HydrophobicContact CG2-CB 3.98Å; V81-L95 PolarHBondContact N-O 3.33Å; R83-L95 HydrophobicContact CB-CD1 4.27Å; S93-L95 PolarHBondContact OG-N 3.11Å; S93-L95 VanDerWaalsContact OG-N 3.14Å; L95-I157 HydrophobicContact CD2-CG2 4.46Å; L95-F286 HydrophobicContact CD1-CE1 3.86Å; L95-F286 HydrophobicContact CD1-CZ 4.13Å
96	I	97.9	Very high	91.9	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	137.4	173.9	-67.4	159.2	0	0	0	110.2	V64 S79 L80 V117 I157 L158 L160	V64-I96 HydrophobicContact CG2-CD1 4.03Å; V64-I96 HydrophobicContact CG2-CG1 4.13Å; V64-I96 HydrophobicContact CG2-CG2 3.75Å; S79-I96 CarbonylContact O-C 3.5Å; S79-I96 VanDerWaalsContact O-CA 3.23Å; S79-I96 WeakPolarHBondContact O-CA 3.33Å; L80-I96 HydrophobicContact CD1-CG1 4.14Å; I96-V117 HydrophobicContact CD1-CB 4.49Å; I96-V117 HydrophobicContact CD1-CG1 3.78Å; I96-V117 HydrophobicContact CD1-CG2 4.11Å; I96-I157 WeakPolarHBondContact O-CA 3.47Å; I96-L158 HydrophobicContact CB-CB 4.21Å; I96-L158 HydrophobicContact CB-CD1 4.41Å; I96-L158 HydrophobicContact CB-CG 4.41Å; I96-L158 HydrophobicContact CG2-CD1 4.11Å; I96-L158 HydrophobicContact CG2-CG 4.4Å; I96-L158 PolarHBondContact N-O 2.81Å; I96-L158 PolarHBondContact O-N 2.78Å; I96-L160 HydrophobicContact CD1-CD1 3.94Å; I96-L160 HydrophobicContact CD1-CD2 3.62Å; I96-L160 HydrophobicContact CD1-CG 3.83Å
97	I	97.8	Very high	92.1	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	137.7	167.5	-54.5	-173.2	0	0	0	109.7	G78 S79 V81 I155 I157 L175 V256 I279 A282 F286	G78-I97 CarbonylContact C-O 3.53Å; G78-I97 WeakPolarHBondContact CA-O 3.44Å; S79-I97 PolarHBondContact N-O 3.25Å; S79-I97 PolarHBondContact O-N 3.36Å; V81-I97 HydrophobicContact CB-CD1 4.39Å; V81-I97 HydrophobicContact CB-CG1 4.42Å; V81-I97 HydrophobicContact CG1-CB 4.27Å; V81-I97 HydrophobicContact CG1-CD1 3.85Å; V81-I97 HydrophobicContact CG1-CG1 3.8Å; V81-I97 HydrophobicContact CG2-CD1 3.95Å; V81-I97 HydrophobicContact CG2-CG1 3.77Å; I97-I155 HydrophobicContact CG2-CB 4.33Å; I97-I155 HydrophobicContact CG2-CD1 4.3Å; I97-I157 HydrophobicContact CG1-CG1 4.38Å; I97-L175 HydrophobicContact CD1-CD2 4.04Å; I97-V256 HydrophobicContact CG2-CG2 3.5Å; I97-V256 VanDerWaalsContact CG2-CG2 3.5Å; I97-I279 HydrophobicContact CD1-CD1 3.97Å; I97-A282 HydrophobicContact CD1-CB 3.61Å; I97-F286 HydrophobicContact CD1-CE2 4.28Å; I97-F286 HydrophobicContact CD1-CZ 4.47Å
98	T	97.8	Very high	92.3	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154	-171.3	176.8	-173.8	0	0	0	0	109.6	I66 I77 C102 F103 I155 A156 L158 G240	I66-T98 HydrophobicContact CD1-CG2 3.65Å; I66-T98 WeakPolarHBondContact CD1-OG1 3.47Å; I77-T98 PolarHBondContact O-OG1 3.46Å; T98-C102 PolarHBondContact OG1-SG 3.08Å; T98-F103 HydrophobicContact CG2-CE2 3.84Å; T98-F103 HydrophobicContact CG2-CZ 4.43Å; T98-I155 CarbonylContact O-C 3.5Å; T98-I155 VanDerWaalsContact O-CA 3.31Å; T98-I155 WeakPolarHBondContact O-CA 3.38Å; T98-A156 HydrophobicContact CG2-CB 3.95Å; T98-A156 PolarHBondContact N-O 2.69Å; T98-A156 PolarHBondContact O-N 3.11Å; T98-L158 HydrophobicContact CG2-CD1 4.14Å; T98-L158 HydrophobicContact CG2-CD2 4.33Å; T98-L158 HydrophobicContact CG2-CG 4.23Å; T98-G240 WeakPolarHBondContact OG1-CA 3.42Å
99	A	96.4	Very high	92.3	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	144.8	176.6	0	0	0	0	0	112.3	D101 C102 L239 L258	A99-D101 PolarHBondContact O-N 3.41Å; A99-C102 WeakPolarHBondContact O-CB 3.31Å; A99-C102 PolarHBondContact O-N 3.11Å; A99-C102 PolarHBondContact O-SG 2.95Å; A99-L239 HydrophobicContact CB-CD1 3.78Å; A99-L239 HydrophobicContact CB-CG 4.12Å; A99-L258 HydrophobicContact CB-CD2 3.56Å
100	A	94.9	Very high	92.4	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-72.8	-14.4	172.2	0	0	0	0	0	113.1	C102 F103 L141 R153 G154 A156 L294	A100-C102 VanDerWaalsContact C-N 3.28Å; A100-F103 PolarHBondContact O-N 2.84Å; A100-L141 HydrophobicContact CB-CB 4.5Å; A100-L141 HydrophobicContact CB-CD2 4.31Å; A100-R153 HydrophobicContact CB-CB 3.93Å; A100-R153 HydrophobicContact CB-CG 4.2Å; A100-R153 PolarHBondContact O-NH1 2.78Å; A100-G154 WeakPolarHBondContact CB-O 3.45Å; A100-G154 PolarHBondContact N-O 3.13Å; A100-A156 HydrophobicContact CB-CB 4.45Å; A100-L294 HydrophobicContact CB-CD1 4.16Å
101	D	93.1	Very high	92.5	Very high	36 Å²	36	32.7 Å²	32.7	19%	0.193	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-71.7	-21.1	171.3	-91.5	-25.8	0	0	0	112.7	A99 F103 V104 R153 L239	A99-D101 PolarHBondContact O-N 3.41Å; D101-F103 PolarHBondContact O-N 3.41Å; D101-V104 HydrophobicContact CB-CG2 4.28Å; D101-V104 WeakPolarHBondContact O-CB 3.31Å; D101-V104 VanDerWaalsContact O-CG2 3.25Å; D101-V104 WeakPolarHBondContact O-CG2 3.36Å; D101-V104 PolarHBondContact O-N 2.74Å; D101-V104 VanDerWaalsContact O-N 3.15Å; D101-V104 VanDerWaalsContact OD1-CG2 3.25Å; D101-V104 WeakPolarHBondContact OD1-CG2 3.44Å; D101-R153 VanDerWaalsContact OD1-CB 3.31Å; D101-R153 WeakPolarHBondContact OD1-CB 3.37Å; D101-R153 WeakPolarHBondContact OD1-CD 3.46Å; D101-L239 HydrophobicContact CB-CD1 4.3Å; D101-L239 HydrophobicContact CB-CD2 4.15Å
102	C	94.4	Very high	92.8	Very high	11 Å²	11	31.9 Å²	31.9	7%	0.074	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-57.5	-22.6	169.5	-57.1	0	0	0	0	113.3	C76 T98 A99 A100	C76-C102 HydrophobicContact CB-CB 3.81Å; C76-C102 WeakPolarHBondContact CB-SG 3.41Å; C76-C102 WeakPolarHBondContact SG-CA 3.47Å; C76-C102 WeakPolarHBondContact SG-CB 3.4Å; C76-C102 CovalentContact SG-SG 2.01Å; C76-C102 PolarHBondContact SG-SG 2.7Å; T98-C102 PolarHBondContact OG1-SG 3.08Å; A99-C102 WeakPolarHBondContact O-CB 3.31Å; A99-C102 PolarHBondContact O-N 3.11Å; A99-C102 PolarHBondContact O-SG 2.95Å; A100-C102 VanDerWaalsContact C-N 3.28Å
103	F	93.8	Very high	92.7	Very high	1 Å²	1	31.7 Å²	31.7	0%	0.004	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-109.4	27.6	-176.8	-55.4	-88.8	0	0	0	112	T98 A100 D101 K105 A111 L115 V139 L141 R153 A156 L158	T98-F103 HydrophobicContact CG2-CE2 3.84Å; T98-F103 HydrophobicContact CG2-CZ 4.43Å; A100-F103 PolarHBondContact O-N 2.84Å; D101-F103 PolarHBondContact O-N 3.41Å; F103-K105 PolarHBondContact O-N 2.89Å; F103-A111 HydrophobicContact CD1-CB 3.85Å; F103-A111 HydrophobicContact CE1-CB 3.99Å; F103-L115 HydrophobicContact CD1-CD1 3.85Å; F103-L115 HydrophobicContact CE1-CD1 3.46Å; F103-L115 VanDerWaalsContact CE1-CD1 3.46Å; F103-L115 HydrophobicContact CZ-CD1 4.39Å; F103-V139 HydrophobicContact CD1-CG1 3.88Å; F103-V139 HydrophobicContact CE1-CG1 3.81Å; F103-V139 HydrophobicContact CE1-CG2 4.4Å; F103-V139 HydrophobicContact CG-CG1 4.27Å; F103-V139 HydrophobicContact CZ-CG1 4.18Å; F103-L141 HydrophobicContact CB-CD1 4.06Å; F103-L141 HydrophobicContact CB-CD2 3.85Å; F103-L141 HydrophobicContact CD2-CD2 3.66Å; F103-L141 HydrophobicContact CE2-CD2 4.46Å; F103-L141 HydrophobicContact CG-CD2 3.81Å; F103-R153 PolarHBondContact O-NH1 3.39Å; F103-A156 HydrophobicContact CD2-CB 3.92Å; F103-A156 HydrophobicContact CE2-CB 3.72Å; F103-L158 HydrophobicContact CE1-CD2 4.23Å; F103-L158 HydrophobicContact CE2-CD2 3.82Å; F103-L158 HydrophobicContact CZ-CD1 4.05Å; F103-L158 HydrophobicContact CZ-CD2 3.4Å; F103-L158 VanDerWaalsContact CZ-CD2 3.4Å; F103-L158 HydrophobicContact CZ-CG 4.37Å
104	V	88.5	Confident	92.6	Very high	36 Å²	36	34.8 Å²	34.8	22%	0.218	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-20.1	175.9	161.5	0	0	0	0	113.5	D101 H299	D101-V104 HydrophobicContact CB-CG2 4.28Å; D101-V104 WeakPolarHBondContact O-CB 3.31Å; D101-V104 VanDerWaalsContact O-CG2 3.25Å; D101-V104 WeakPolarHBondContact O-CG2 3.36Å; D101-V104 PolarHBondContact O-N 2.74Å; D101-V104 VanDerWaalsContact O-N 3.15Å; D101-V104 VanDerWaalsContact OD1-CG2 3.25Å; D101-V104 WeakPolarHBondContact OD1-CG2 3.44Å; V104-H299 PolarHBondContact O-CD2 2.86Å; V104-H299 VanDerWaalsContact O-CD2 3.28Å
105	K	88.4	Confident	92.6	Very high	142 Å²	142	32.9 Å²	32.9	62%	0.617	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-111.6	5.8	-179.2	-78.4	166.6	168.8	155.8	0	113.9	F103 D390	F103-K105 PolarHBondContact O-N 2.89Å; K105-D390 VanDerWaalsContact CE-OD2 3.3Å; K105-D390 WeakPolarHBondContact CE-OD2 3.37Å; K105-D390 IonicContact NZ-OD2 2.67Å; K105-D390 PolarHBondContact NZ-OD2 3.35Å
106	Y	89.1	Confident	92.5	Very high	23 Å²	23	31.8 Å²	31.8	9%	0.09	18%	0.18	C	C	.	.			trans	-133.3	145.4	-171.3	-55.3	-75.4	0	0	0	111.1	E114 L115 H299	Y106-E114 HydrophobicContact CD1-CB 4.17Å; Y106-E114 HydrophobicContact CE1-CB 3.95Å; Y106-E114 WeakPolarHBondContact CE1-OE2 3.37Å; Y106-L115 HydrophobicContact CD2-CD1 3.9Å; Y106-L115 HydrophobicContact CD2-CD2 4.44Å; Y106-L115 HydrophobicContact CD2-CG 4.42Å; Y106-L115 HydrophobicContact CE1-CD2 4.27Å; Y106-L115 HydrophobicContact CE1-CG 4.42Å; Y106-L115 HydrophobicContact CE2-CD1 4.1Å; Y106-L115 HydrophobicContact CE2-CD2 3.81Å; Y106-L115 HydrophobicContact CE2-CG 4.27Å; Y106-L115 HydrophobicContact CG-CD1 4.23Å; Y106-H299 PolarHBondContact O-NE2 3.13Å
107	T	88.2	Confident	92.3	Very high	58 Å²	58	31.8 Å²	31.8	36%	0.356	18%	0.18	S	C	.	.			trans	-83.6	158.8	163.7	61.2	0	0	0	0	109.5	A109 S110 A111	T107-A109 PolarHBondContact O-N 2.72Å; T107-A109 VanDerWaalsContact O-N 3.08Å; T107-S110 PolarHBondContact N-OG 2.93Å; T107-S110 PolarHBondContact O-N 3.01Å; T107-S110 WeakPolarHBondContact OG1-CB 2.99Å; T107-S110 PolarHBondContact OG1-N 2.87Å; T107-S110 PolarHBondContact OG1-OG 2.77Å; T107-A111 VanDerWaalsContact O-CB 3.25Å; T107-A111 WeakPolarHBondContact O-CB 3.05Å; T107-A111 PolarHBondContact O-N 2.68Å
108	P	87	Confident	92.2	Very high	40 Å²	40	32.3 Å²	32.3	26%	0.26	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-25.3	172.6	-28.9	37.3	0	0	0	114.2	K112 L141	P108-K112 WeakPolarHBondContact O-CE 3.48Å; P108-K112 WeakPolarHBondContact O-CG 3.24Å; P108-L141 HydrophobicContact CG-CD1 4.39Å
109	A	88.8	Confident	92	Very high	69 Å²	69	32.3 Å²	32.3	57%	0.57	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-52.1	173.2	0	0	0	0	0	112.3	T107 A111 K112	T107-A109 PolarHBondContact O-N 2.72Å; T107-A109 VanDerWaalsContact O-N 3.08Å; A109-A111 VanDerWaalsContact C-N 3.29Å; A109-A111 PolarHBondContact O-N 3.25Å; A109-K112 WeakPolarHBondContact O-CB 2.78Å; A109-K112 PolarHBondContact O-N 3.3Å; A109-K112 VanDerWaalsContact O-N 3.11Å
110	S	90.4	Very high	91.7	Very high	28 Å²	28	35.1 Å²	35.1	20%	0.196	20%	0.198	C	C	.	.	H	α-helix	trans	-70.7	-25.7	-176.2	88.7	0	0	0	0	113	T107 K112 S113 E114	T107-S110 PolarHBondContact N-OG 2.93Å; T107-S110 PolarHBondContact O-N 3.01Å; T107-S110 WeakPolarHBondContact OG1-CB 2.99Å; T107-S110 PolarHBondContact OG1-N 2.87Å; T107-S110 PolarHBondContact OG1-OG 2.77Å; S110-K112 PolarHBondContact O-N 2.88Å; S110-S113 PolarHBondContact O-N 2.85Å; S110-S113 PolarHBondContact O-OG 2.91Å; S110-S113 VanDerWaalsContact O-OG 3.1Å; S110-E114 WeakPolarHBondContact CB-OE1 3.46Å; S110-E114 VanDerWaalsContact O-CB 3.28Å; S110-E114 WeakPolarHBondContact O-CB 3.29Å; S110-E114 WeakPolarHBondContact O-CG 3.4Å; S110-E114 PolarHBondContact O-N 3.11Å; S110-E114 PolarHBondContact OG-OE1 2.92Å
111	A	90.4	Very high	91.3	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-55.6	-33.7	169	0	0	0	0	0	113.2	F103 T107 A109 L115 V139	F103-A111 HydrophobicContact CD1-CB 3.85Å; F103-A111 HydrophobicContact CE1-CB 3.99Å; T107-A111 VanDerWaalsContact O-CB 3.25Å; T107-A111 WeakPolarHBondContact O-CB 3.05Å; T107-A111 PolarHBondContact O-N 2.68Å; A109-A111 VanDerWaalsContact C-N 3.29Å; A109-A111 PolarHBondContact O-N 3.25Å; A111-L115 HydrophobicContact CB-CD1 4.12Å; A111-L115 WeakPolarHBondContact O-CB 3.13Å; A111-L115 PolarHBondContact O-N 3.37Å; A111-V139 HydrophobicContact CB-CG1 4.47Å; A111-V139 HydrophobicContact CB-CG2 3.94Å
112	K	91.9	Very high	90.7	Very high	68 Å²	68	35.2 Å²	35.2	30%	0.296	20%	0.2	S	C	.	.	H	α-helix	trans	-70.8	-33.2	-179.3	-57.7	175	-171.2	-153.5	0	112.2	P108 A109 S110 I136 V137 D138 V139	P108-K112 WeakPolarHBondContact O-CE 3.48Å; P108-K112 WeakPolarHBondContact O-CG 3.24Å; A109-K112 WeakPolarHBondContact O-CB 2.78Å; A109-K112 PolarHBondContact O-N 3.3Å; A109-K112 VanDerWaalsContact O-N 3.11Å; S110-K112 PolarHBondContact O-N 2.88Å; K112-I136 WeakPolarHBondContact CB-O 3.4Å; K112-V137 VanDerWaalsContact CD-O 3.32Å; K112-V137 WeakPolarHBondContact CD-O 3.36Å; K112-V137 VanDerWaalsContact CE-O 3.24Å; K112-V137 WeakPolarHBondContact CE-O 3.27Å; K112-V137 PolarHBondContact NZ-O 2.86Å; K112-D138 WeakPolarHBondContact CE-OD1 3.48Å; K112-D138 IonicContact NZ-OD1 2.72Å; K112-D138 PolarHBondContact NZ-OD1 3.16Å; K112-V139 HydrophobicContact CG-CG2 4.45Å
113	S	90.7	Very high	90.2	Very high	75 Å²	75	42.5 Å²	42.5	52%	0.524	23%	0.226	S	C	.	.	H	α-helix	trans	-92.4	-32.7	179.4	52.2	0	0	0	0	113.7	K69 S110	K69-S113 WeakPolarHBondContact CD-O 3.47Å; S110-S113 PolarHBondContact O-N 2.85Å; S110-S113 PolarHBondContact O-OG 2.91Å; S110-S113 VanDerWaalsContact O-OG 3.1Å
114	E	93.1	Very high	89.7	Confident	71 Å²	71	42.6 Å²	42.6	33%	0.332	23%	0.226	S	C	.	.	H	α-helix	trans	-94.8	-20.6	-172.8	-65.6	-177.8	-107	0	0	115.2	K69 Y106 S110	K69-E114 VanDerWaalsContact CB-O 3.29Å; K69-E114 WeakPolarHBondContact CB-O 2.96Å; K69-E114 PolarHBondContact N-O 3.25Å; Y106-E114 HydrophobicContact CD1-CB 4.17Å; Y106-E114 HydrophobicContact CE1-CB 3.95Å; Y106-E114 WeakPolarHBondContact CE1-OE2 3.37Å; S110-E114 WeakPolarHBondContact CB-OE1 3.46Å; S110-E114 VanDerWaalsContact O-CB 3.28Å; S110-E114 WeakPolarHBondContact O-CB 3.29Å; S110-E114 WeakPolarHBondContact O-CG 3.4Å; S110-E114 PolarHBondContact O-N 3.11Å; S110-E114 PolarHBondContact OG-OE1 2.92Å
115	L	94.9	Very high	89.4	Confident	1 Å²	1	41.6 Å²	41.6	1%	0.005	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	159.8	-178.6	-61.2	172.3	0	0	0	112.2	I66 T67 K75 F103 Y106 A111 I136	I66-L115 HydrophobicContact CG2-CD1 4.43Å; T67-L115 CarbonylContact O-C 3.46Å; T67-L115 VanDerWaalsContact O-CA 3.27Å; T67-L115 WeakPolarHBondContact O-CA 3.18Å; T67-L115 WeakPolarHBondContact O-CD2 3.39Å; K75-L115 HydrophobicContact CG-CD2 4.26Å; F103-L115 HydrophobicContact CD1-CD1 3.85Å; F103-L115 HydrophobicContact CE1-CD1 3.46Å; F103-L115 VanDerWaalsContact CE1-CD1 3.46Å; F103-L115 HydrophobicContact CZ-CD1 4.39Å; Y106-L115 HydrophobicContact CD2-CD1 3.9Å; Y106-L115 HydrophobicContact CD2-CD2 4.44Å; Y106-L115 HydrophobicContact CD2-CG 4.42Å; Y106-L115 HydrophobicContact CE1-CD2 4.27Å; Y106-L115 HydrophobicContact CE1-CG 4.42Å; Y106-L115 HydrophobicContact CE2-CD1 4.1Å; Y106-L115 HydrophobicContact CE2-CD2 3.81Å; Y106-L115 HydrophobicContact CE2-CG 4.27Å; Y106-L115 HydrophobicContact CG-CD1 4.23Å; A111-L115 HydrophobicContact CB-CD1 4.12Å; A111-L115 WeakPolarHBondContact O-CB 3.13Å; A111-L115 PolarHBondContact O-N 3.37Å; L115-I136 HydrophobicContact CB-CD1 4.09Å
116	L	94.2	Very high	89	Confident	9 Å²	9	40.3 Å²	40.3	5%	0.047	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	138.7	-178.5	-170.7	65.1	0	0	0	110.9	T67 K69 F118 K133 A134 E135	T67-L116 PolarHBondContact N-O 2.95Å; T67-L116 PolarHBondContact O-N 2.8Å; T67-L116 PolarHBondContact OG1-O 3.01Å; K69-L116 HydrophobicContact CB-CB 4.37Å; K69-L116 HydrophobicContact CG-CB 4.43Å; K69-L116 HydrophobicContact CG-CD2 4.47Å; L116-F118 HydrophobicContact CB-CE2 4.43Å; L116-F118 HydrophobicContact CD2-CE2 3.69Å; L116-F118 HydrophobicContact CD2-CZ 3.68Å; L116-F118 HydrophobicContact CG-CE2 3.97Å; L116-F118 HydrophobicContact CG-CZ 4.34Å; L116-K133 HydrophobicContact CD1-CD 4.25Å; L116-K133 VanDerWaalsContact CD1-CE 3.49Å; L116-K133 HydrophobicContact CD1-CG 3.78Å; L116-K133 HydrophobicContact CD2-CD 4.2Å; L116-K133 HydrophobicContact CD2-CG 4.01Å; L116-K133 HydrophobicContact CG-CG 4.12Å; L116-A134 WeakPolarHBondContact CD1-O 3.5Å; L116-E135 HydrophobicContact CD1-CG 3.92Å
117	V	95.7	Very high	88.5	Confident	0 Å²	0	47 Å²	47	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	139	179.2	-176.2	0	0	0	0	110.4	V64 I65 I96 A134 I136 L160	V64-V117 HydrophobicContact CB-CG1 3.78Å; V64-V117 HydrophobicContact CG1-CG1 4.21Å; V64-V117 HydrophobicContact CG2-CG1 4.19Å; I65-V117 WeakPolarHBondContact O-CA 3.38Å; I96-V117 HydrophobicContact CD1-CB 4.49Å; I96-V117 HydrophobicContact CD1-CG1 3.78Å; I96-V117 HydrophobicContact CD1-CG2 4.11Å; V117-A134 HydrophobicContact CB-CB 4.41Å; V117-A134 PolarHBondContact N-O 3.37Å; V117-A134 VanDerWaalsContact N-O 3.11Å; V117-A134 PolarHBondContact O-N 3.43Å; V117-I136 HydrophobicContact CG2-CD1 3.92Å; V117-I136 HydrophobicContact CG2-CG1 3.82Å; V117-L160 HydrophobicContact CB-CD2 4.28Å; V117-L160 HydrophobicContact CG2-CD2 4.07Å
118	F	94.6	Very high	88	Confident	10 Å²	10	51 Å²	51	4%	0.044	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	133.4	166.5	-67.3	-95.5	0	0	0	110	V64 I65 T67 L116 F124 R129 R130 I132 K133	V64-F118 CarbonylContact C-O 3.47Å; V64-F118 WeakPolarHBondContact CA-O 2.93Å; I65-F118 HydrophobicContact CB-CB 4.33Å; I65-F118 HydrophobicContact CG1-CB 4.41Å; I65-F118 PolarHBondContact N-O 3.04Å; I65-F118 PolarHBondContact O-N 2.92Å; T67-F118 HydrophobicContact CG2-CD2 3.97Å; T67-F118 HydrophobicContact CG2-CE2 4.34Å; T67-F118 WeakPolarHBondContact OG1-CE2 3.23Å; L116-F118 HydrophobicContact CB-CE2 4.43Å; L116-F118 HydrophobicContact CD2-CE2 3.69Å; L116-F118 HydrophobicContact CD2-CZ 3.68Å; L116-F118 HydrophobicContact CG-CE2 3.97Å; L116-F118 HydrophobicContact CG-CZ 4.34Å; F118-F124 HydrophobicContact CB-CD2 4.44Å; F118-F124 HydrophobicContact CB-CE2 4.31Å; F118-F124 AromaticContact CD1-CE2 3.99Å; F118-F124 HydrophobicContact CD1-CE2 3.99Å; F118-F124 HydrophobicContact CD2-CD2 4.43Å; F118-F124 AromaticContact CD2-CE2 3.53Å; F118-F124 HydrophobicContact CD2-CE2 3.53Å; F118-F124 HydrophobicContact CD2-CZ 4.01Å; F118-F124 HydrophobicContact CE1-CE2 4.17Å; F118-F124 AromaticContact CE2-CE2 3.73Å; F118-F124 HydrophobicContact CE2-CE2 3.73Å; F118-F124 AromaticContact CE2-CZ 3.98Å; F118-F124 HydrophobicContact CE2-CZ 3.98Å; F118-F124 HydrophobicContact CG-CD2 4.23Å; F118-F124 AromaticContact CG-CE2 3.67Å; F118-F124 HydrophobicContact CG-CE2 3.67Å; F118-F124 HydrophobicContact CZ-CE2 4.05Å; F118-R129 HydrophobicContact CE1-CB 4.05Å; F118-R129 HydrophobicContact CZ-CB 3.94Å; F118-R130 WeakPolarHBondContact CD1-O 3.49Å; F118-I132 WeakPolarHBondContact CA-O 3.23Å; F118-K133 HydrophobicContact CE1-CB 4.29Å
119	A	94	Very high	87.8	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	160.9	172.2	0	0	0	0	0	110.5	V64 G131 I132 L164 V170	V64-A119 HydrophobicContact CG1-CB 3.82Å; A119-G131 CarbonylContact O-C 3.53Å; A119-G131 WeakPolarHBondContact O-CA 3.24Å; A119-I132 PolarHBondContact N-O 2.99Å; A119-I132 PolarHBondContact O-N 2.84Å; A119-L164 HydrophobicContact CB-CD1 3.75Å; A119-V170 HydrophobicContact CB-CG1 3.9Å
120	N	89.4	Confident	87.5	Confident	60 Å²	60	58.7 Å²	58.7	32%	0.321	27%	0.27	S	S	.	.	S	Bend	trans	48.9	65.1	-178.9	177.8	32.2	0	0	0	112.2	G131 V170	N120-G131 VanDerWaalsContact O-CA 3.29Å; N120-G131 WeakPolarHBondContact O-CA 3.21Å; N120-V170 HydrophobicContact CB-CG1 4.43Å
121	S	86.3	Confident	87.3	Confident	3 Å²	3	59 Å²	59	2%	0.021	28%	0.278	C	S	.	.			trans	-146.9	74.2	-177.6	-174.4	0	0	0	0	111.7	M59 R123 R130	M59-S121 PolarHBondContact SD-N 2.92Å; S121-R123 PolarHBondContact O-N 3.38Å; S121-R123 VanDerWaalsContact O-N 3.14Å; S121-R123 PolarHBondContact OG-O 2.81Å; S121-R130 WeakPolarHBondContact CB-O 3.11Å; S121-R130 PolarHBondContact OG-O 3.11Å
122	P	81	Confident	87.4	Confident	35 Å²	35	61.4 Å²	61.4	23%	0.227	29%	0.29	C	S	.	.	S	Bend	trans	-61.1	-27.5	-177.4	23.1	-33.4	0	0	0	112.1	M59 R199 M200	M59-P122 HydrophobicContact CB-CB 4.44Å; M59-P122 HydrophobicContact CG-CB 4.22Å; M59-P122 VanDerWaalsContact SD-CA 3.58Å; M59-P122 HydrophobicContact SD-CB 4.22Å; P122-R199 CarbonylContact O-C 3.56Å; P122-R199 VanDerWaalsContact O-CA 3.24Å; P122-R199 WeakPolarHBondContact O-CA 3.2Å; P122-R199 VanDerWaalsContact O-CG 3.24Å; P122-R199 WeakPolarHBondContact O-CG 3.4Å; P122-M200 PolarHBondContact O-N 3.1Å
123	R	83.4	Confident	87.5	Confident	164 Å²	164	63.3 Å²	63.3	62%	0.619	30%	0.299	S	S	*	.	B	Isolated β-bridge	trans	-119.9	115.8	169.1	-59.9	-173.5	-165.7	-177.3	5	111.3	S121 H198 R199	S121-R123 PolarHBondContact O-N 3.38Å; S121-R123 VanDerWaalsContact O-N 3.14Å; S121-R123 PolarHBondContact OG-O 2.81Å; R123-H198 CarbonylContact C-O 3.55Å; R123-H198 VanDerWaalsContact CA-O 3.27Å; R123-H198 WeakPolarHBondContact CA-O 3.47Å; R123-R199 HydrophobicContact CG-CG 4.2Å
124	F	84.4	Confident	87.7	Confident	2 Å²	2	60 Å²	60	1%	0.009	28%	0.276	C	S	.	.			trans	-128.5	121.6	-179.4	-178.2	-86.6	0	0	0	110.5	I65 T67 F118 R129 Y193 H198	I65-F124 HydrophobicContact CD1-CB 3.41Å; I65-F124 VanDerWaalsContact CD1-CB 3.41Å; I65-F124 HydrophobicContact CD1-CD1 4.39Å; I65-F124 HydrophobicContact CD1-CD2 4.03Å; I65-F124 HydrophobicContact CD1-CG 3.69Å; T67-F124 HydrophobicContact CG2-CE1 3.78Å; T67-F124 HydrophobicContact CG2-CE2 4.36Å; T67-F124 HydrophobicContact CG2-CZ 3.64Å; F118-F124 HydrophobicContact CB-CD2 4.44Å; F118-F124 HydrophobicContact CB-CE2 4.31Å; F118-F124 AromaticContact CD1-CE2 3.99Å; F118-F124 HydrophobicContact CD1-CE2 3.99Å; F118-F124 HydrophobicContact CD2-CD2 4.43Å; F118-F124 AromaticContact CD2-CE2 3.53Å; F118-F124 HydrophobicContact CD2-CE2 3.53Å; F118-F124 HydrophobicContact CD2-CZ 4.01Å; F118-F124 HydrophobicContact CE1-CE2 4.17Å; F118-F124 AromaticContact CE2-CE2 3.73Å; F118-F124 HydrophobicContact CE2-CE2 3.73Å; F118-F124 AromaticContact CE2-CZ 3.98Å; F118-F124 HydrophobicContact CE2-CZ 3.98Å; F118-F124 HydrophobicContact CG-CD2 4.23Å; F118-F124 AromaticContact CG-CE2 3.67Å; F118-F124 HydrophobicContact CG-CE2 3.67Å; F118-F124 HydrophobicContact CZ-CE2 4.05Å; F124-R129 HydrophobicContact CE2-CB 3.73Å; F124-R129 HydrophobicContact CE2-CG 4.09Å; F124-R129 HydrophobicContact CZ-CB 4.06Å; F124-R129 HydrophobicContact CZ-CG 3.88Å; F124-Y193 HydrophobicContact CB-CE2 4.42Å; F124-Y193 WeakPolarHBondContact O-CE2 3.16Å; F124-Y193 PolarHBondContact O-OH 3.06Å; F124-Y193 VanDerWaalsContact O-OH 3.08Å; F124-H198 PolarHBondContact N-O 3.05Å; F124-H198 WeakPolarHBondContact O-CB 3.27Å
125	S	82.8	Confident	87.8	Confident	16 Å²	16	59 Å²	59	11%	0.112	27%	0.272	C	S	.	.			trans	-122.9	154.1	175.2	176.9	0	0	0	0	110.8	L127 K128 R129 H198	S125-L127 PolarHBondContact O-N 3.3Å; S125-K128 PolarHBondContact N-O 3.21Å; S125-K128 VanDerWaalsContact N-O 3.17Å; S125-K128 CarbonylContact O-C 3.56Å; S125-K128 PolarHBondContact O-N 2.8Å; S125-R129 PolarHBondContact O-N 3.4Å; S125-H198 WeakPolarHBondContact CB-CD2 3.48Å; S125-H198 PolarHBondContact OG-CD2 3.45Å; S125-H198 PolarHBondContact OG-NE2 3.08Å
126	R	78.2	Confident	87.9	Confident	114 Å²	114	59.3 Å²	59.3	43%	0.43	27%	0.273	S	S	.	.	S	Bend	trans	-48.8	-35.6	173.7	-59.4	-170.4	-172.9	-164.7	1.8	111.6	R129 E387	R126-R129 PolarHBondContact O-NE 2.01Å; R126-E387 IonicContact CZ-OE1 2.71Å; R126-E387 IonicContact NH1-OE1 3.2Å; R126-E387 PolarHBondContact NH1-OE1 2.77Å; R126-E387 IonicContact NH2-OE1 2.96Å; R126-E387 PolarHBondContact NH2-OE1 3.16Å; R126-E387 IonicContact NH2-OE2 2.98Å; R126-E387 PolarHBondContact NH2-OE2 2.97Å
127	L	78.9	Confident	88	Confident	163 Å²	163	62.3 Å²	62.3	85%	0.853	29%	0.292	S	S	*	.	S	Bend	trans	-84.5	-40.8	177.1	-63.2	172	0	0	0	114	S125	S125-L127 PolarHBondContact O-N 3.3Å
128	K	78.7	Confident	88	Confident	144 Å²	144	64.9 Å²	64.9	63%	0.626	31%	0.305	S	S	*	.			trans	-113.5	75.4	-175.9	-68	-179.2	-179.8	175.5	0	109.3	S125 R130	S125-K128 PolarHBondContact N-O 3.21Å; S125-K128 VanDerWaalsContact N-O 3.17Å; S125-K128 CarbonylContact O-C 3.56Å; S125-K128 PolarHBondContact O-N 2.8Å; K128-R130 PolarHBondContact O-N 2.89Å
129	R	81.3	Confident	88	Confident	94 Å²	94	64.6 Å²	64.6	36%	0.355	30%	0.304	S	S	.	.			trans	-76.6	64.3	179.9	-54.8	-174.9	-167.5	-172.4	4.3	111.3	K69 I70 G72 F118 F124 S125 R126	K69-R129 PolarHBondContact O-NH1 2.86Å; I70-R129 PolarHBondContact O-NH2 2.92Å; G72-R129 VanDerWaalsContact CA-CZ 3.44Å; F118-R129 HydrophobicContact CE1-CB 4.05Å; F118-R129 HydrophobicContact CZ-CB 3.94Å; F124-R129 HydrophobicContact CE2-CB 3.73Å; F124-R129 HydrophobicContact CE2-CG 4.09Å; F124-R129 HydrophobicContact CZ-CB 4.06Å; F124-R129 HydrophobicContact CZ-CG 3.88Å; S125-R129 PolarHBondContact O-N 3.4Å; R126-R129 PolarHBondContact O-NE 2.01Å
130	R	82.6	Confident	88	Confident	175 Å²	175	67.3 Å²	67.3	66%	0.66	32%	0.319	S	S	*	.			trans	-72.4	168.4	178.8	-70	-177.5	170.2	-173.8	-5	111.2	F118 S121 K128	F118-R130 WeakPolarHBondContact CD1-O 3.49Å; S121-R130 WeakPolarHBondContact CB-O 3.11Å; S121-R130 PolarHBondContact OG-O 3.11Å; K128-R130 PolarHBondContact O-N 2.89Å
131	G	87.2	Confident	88.2	Confident	35 Å²	35	65 Å²	65	36%	0.361	31%	0.307	S	S	.	.	S	Bend	trans	97.4	177.1	179.9	0	0	0	0	0	115.4	A119 N120 K133	A119-G131 CarbonylContact O-C 3.53Å; A119-G131 WeakPolarHBondContact O-CA 3.24Å; N120-G131 VanDerWaalsContact O-CA 3.29Å; N120-G131 WeakPolarHBondContact O-CA 3.21Å; G131-K133 PolarHBondContact O-N 3.37Å
132	I	92.3	Very high	88.4	Confident	50 Å²	50	66 Å²	66	26%	0.256	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	109.8	-179.7	-55.6	-60.1	0	0	0	109.4	F118 A119 L164 D168	F118-I132 WeakPolarHBondContact CA-O 3.23Å; A119-I132 PolarHBondContact N-O 2.99Å; A119-I132 PolarHBondContact O-N 2.84Å; I132-L164 HydrophobicContact CG2-CD2 3.94Å; I132-D168 HydrophobicContact CG1-CB 4.18Å; I132-D168 HydrophobicContact CG2-CB 4.32Å
133	K	93.8	Very high	88.6	Confident	109 Å²	109	64.6 Å²	64.6	47%	0.474	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	132.8	173.6	180	-169.2	170.1	-152.7	0	110.8	L116 F118 G131 E135	L116-K133 HydrophobicContact CD1-CD 4.25Å; L116-K133 VanDerWaalsContact CD1-CE 3.49Å; L116-K133 HydrophobicContact CD1-CG 3.78Å; L116-K133 HydrophobicContact CD2-CD 4.2Å; L116-K133 HydrophobicContact CD2-CG 4.01Å; L116-K133 HydrophobicContact CG-CG 4.12Å; F118-K133 HydrophobicContact CE1-CB 4.29Å; G131-K133 PolarHBondContact O-N 3.37Å; K133-E135 WeakPolarHBondContact CE-OE1 3Å; K133-E135 IonicContact NZ-OE1 2.62Å; K133-E135 PolarHBondContact NZ-OE1 3.28Å
134	A	95	Very high	88.3	Confident	6 Å²	6	57.5 Å²	57.5	5%	0.05	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	138.8	167.7	0	0	0	0	0	111.5	L116 V117 L160 L164	L116-A134 WeakPolarHBondContact CD1-O 3.5Å; V117-A134 HydrophobicContact CB-CB 4.41Å; V117-A134 PolarHBondContact N-O 3.37Å; V117-A134 VanDerWaalsContact N-O 3.11Å; V117-A134 PolarHBondContact O-N 3.43Å; A134-L160 HydrophobicContact CB-CD1 3.89Å; A134-L160 HydrophobicContact CB-CD2 3.71Å; A134-L160 HydrophobicContact CB-CG 4.31Å; A134-L164 HydrophobicContact CB-CD2 4.39Å
135	E	95.8	Very high	87.7	Confident	50 Å²	50	59.6 Å²	59.6	23%	0.234	29%	0.294	C	S	.	.			trans	-95.7	155.1	177.2	-53.2	-132.3	174	0	0	110.9	K69 L116 K133 L160 E161	K69-E135 IonicContact NZ-OE1 2.63Å; K69-E135 PolarHBondContact NZ-OE1 2.97Å; K69-E135 IonicContact NZ-OE2 3.76Å; K69-E135 PolarHBondContact NZ-OE2 3.4Å; L116-E135 HydrophobicContact CD1-CG 3.92Å; K133-E135 WeakPolarHBondContact CE-OE1 3Å; K133-E135 IonicContact NZ-OE1 2.62Å; K133-E135 PolarHBondContact NZ-OE1 3.28Å; E135-L160 WeakPolarHBondContact O-CA 3.16Å; E135-E161 PolarHBondContact O-N 3.49Å
136	I	96.7	Very high	86.8	Confident	7 Å²	7	60.7 Å²	60.7	4%	0.036	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	114.6	-169.6	-55.7	170.3	0	0	0	109.6	K112 L115 V117 D138 V139 L158	K112-I136 WeakPolarHBondContact CB-O 3.4Å; L115-I136 HydrophobicContact CB-CD1 4.09Å; V117-I136 HydrophobicContact CG2-CD1 3.92Å; V117-I136 HydrophobicContact CG2-CG1 3.82Å; I136-D138 WeakPolarHBondContact CG2-O 3.38Å; I136-V139 HydrophobicContact CG2-CG2 3.54Å; I136-L158 HydrophobicContact CD1-CD1 4.45Å; I136-L158 HydrophobicContact CG2-CB 4.44Å
137	V	96.1	Very high	85.7	Confident	72 Å²	72	57 Å²	57	44%	0.436	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	-30.8	175.9	169.1	0	0	0	0	111.9	K112 K159 E161	K112-V137 VanDerWaalsContact CD-O 3.32Å; K112-V137 WeakPolarHBondContact CD-O 3.36Å; K112-V137 VanDerWaalsContact CE-O 3.24Å; K112-V137 WeakPolarHBondContact CE-O 3.27Å; K112-V137 PolarHBondContact NZ-O 2.86Å; V137-K159 PolarHBondContact N-O 2.95Å; V137-E161 VanDerWaalsContact CG2-CA 3.49Å; V137-E161 HydrophobicContact CG2-CB 3.64Å; V137-E161 HydrophobicContact CG2-CG 3.96Å
138	D	95.1	Very high	84.5	Confident	53 Å²	53	56.8 Å²	56.8	28%	0.283	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	152.5	177	-154.6	34.5	0	0	0	115.9	K112 I136 N140 L158 K159	K112-D138 WeakPolarHBondContact CE-OD1 3.48Å; K112-D138 IonicContact NZ-OD1 2.72Å; K112-D138 PolarHBondContact NZ-OD1 3.16Å; I136-D138 WeakPolarHBondContact CG2-O 3.38Å; D138-N140 PolarHBondContact OD2-ND2 2.9Å; D138-L158 CarbonylContact O-C 3.58Å; D138-L158 VanDerWaalsContact O-CA 3.31Å; D138-L158 WeakPolarHBondContact O-CA 3.38Å; D138-K159 HydrophobicContact CB-CB 3.95Å; D138-K159 PolarHBondContact N-O 3.43Å; D138-K159 VanDerWaalsContact N-O 3.17Å; D138-K159 PolarHBondContact O-N 2.67Å
139	V	95	Very high	83.6	Confident	4 Å²	4	55.2 Å²	55.2	2%	0.024	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	103.3	-174.7	-179.7	0	0	0	0	109.4	F103 A111 K112 I136 L141 L158	F103-V139 HydrophobicContact CD1-CG1 3.88Å; F103-V139 HydrophobicContact CE1-CG1 3.81Å; F103-V139 HydrophobicContact CE1-CG2 4.4Å; F103-V139 HydrophobicContact CG-CG1 4.27Å; F103-V139 HydrophobicContact CZ-CG1 4.18Å; A111-V139 HydrophobicContact CB-CG1 4.47Å; A111-V139 HydrophobicContact CB-CG2 3.94Å; K112-V139 HydrophobicContact CG-CG2 4.45Å; I136-V139 HydrophobicContact CG2-CG2 3.54Å; V139-L141 HydrophobicContact CG1-CD2 3.85Å; V139-L141 HydrophobicContact CG1-CG 4.38Å; V139-L158 HydrophobicContact CB-CD2 4.37Å; V139-L158 HydrophobicContact CG1-CD2 3.94Å; V139-L158 HydrophobicContact CG2-CD2 4.17Å
140	N	93.6	Very high	82.9	Confident	58 Å²	58	55.4 Å²	55.4	31%	0.31	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	123.7	177.9	-69.3	-84.7	0	0	0	110.3	D138 Y142 A156 I157	D138-N140 PolarHBondContact OD2-ND2 2.9Å; N140-Y142 HydrophobicContact CB-CE2 3.63Å; N140-Y142 WeakPolarHBondContact CB-OH 3.4Å; N140-A156 CarbonylContact O-C 3.57Å; N140-A156 VanDerWaalsContact O-CA 3.23Å; N140-A156 WeakPolarHBondContact O-CA 3.08Å; N140-I157 PolarHBondContact N-O 3.34Å; N140-I157 PolarHBondContact O-N 3.36Å
141	L	94.1	Very high	82.4	Confident	12 Å²	12	49.2 Å²	49.2	6%	0.063	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	117.4	-176.5	-55.4	-176.8	0	0	0	110.5	A100 F103 P108 V139 A156 T293 L294	A100-L141 HydrophobicContact CB-CB 4.5Å; A100-L141 HydrophobicContact CB-CD2 4.31Å; F103-L141 HydrophobicContact CB-CD1 4.06Å; F103-L141 HydrophobicContact CB-CD2 3.85Å; F103-L141 HydrophobicContact CD2-CD2 3.66Å; F103-L141 HydrophobicContact CE2-CD2 4.46Å; F103-L141 HydrophobicContact CG-CD2 3.81Å; P108-L141 HydrophobicContact CG-CD1 4.39Å; V139-L141 HydrophobicContact CG1-CD2 3.85Å; V139-L141 HydrophobicContact CG1-CG 4.38Å; L141-A156 HydrophobicContact CD2-CB 3.63Å; L141-T293 WeakPolarHBondContact O-CA 3.35Å; L141-L294 HydrophobicContact CB-CB 4.23Å; L141-L294 HydrophobicContact CB-CD1 4.18Å; L141-L294 PolarHBondContact O-N 2.92Å
142	Y	91.2	Very high	82	Confident	22 Å²	22	51.7 Å²	51.7	9%	0.086	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	138	-178.2	-59.4	-76.8	0	0	0	111.7	N140 G154 I155 I157 V285 V291 T293 L294	N140-Y142 HydrophobicContact CB-CE2 3.63Å; N140-Y142 WeakPolarHBondContact CB-OH 3.4Å; Y142-G154 VanDerWaalsContact O-CA 3.23Å; Y142-G154 WeakPolarHBondContact O-CA 3.05Å; Y142-G154 PolarHBondContact O-N 2.98Å; Y142-I155 WeakPolarHBondContact CB-O 3.2Å; Y142-I155 HydrophobicContact CD2-CG1 4.34Å; Y142-I155 PolarHBondContact N-O 2.94Å; Y142-I157 HydrophobicContact CD2-CD1 4.41Å; Y142-I157 HydrophobicContact CD2-CG1 4.23Å; Y142-I157 HydrophobicContact CE2-CB 4.08Å; Y142-I157 HydrophobicContact CE2-CD1 3.9Å; Y142-I157 HydrophobicContact CE2-CG1 3.86Å; Y142-V285 HydrophobicContact CD1-CG2 3.8Å; Y142-V285 HydrophobicContact CD2-CG2 4.23Å; Y142-V285 HydrophobicContact CE1-CG1 4.36Å; Y142-V285 HydrophobicContact CE1-CG2 3.45Å; Y142-V285 VanDerWaalsContact CE1-CG2 3.45Å; Y142-V285 HydrophobicContact CE2-CG1 4.31Å; Y142-V285 HydrophobicContact CE2-CG2 3.91Å; Y142-V285 HydrophobicContact CG-CG2 4.17Å; Y142-V285 WeakPolarHBondContact OH-CG1 3.35Å; Y142-V291 HydrophobicContact CD1-CB 4.1Å; Y142-V291 HydrophobicContact CD1-CG1 3.73Å; Y142-V291 HydrophobicContact CE1-CB 4.5Å; Y142-V291 HydrophobicContact CG-CG1 4.3Å; Y142-T293 HydrophobicContact CD1-CG2 3.99Å; Y142-T293 HydrophobicContact CE1-CG2 3.78Å; Y142-L294 WeakPolarHBondContact O-CD1 3.43Å
143	G	84.1	Confident	81.6	Confident	7 Å²	7	50.8 Å²	50.8	7%	0.072	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	148.6	176.6	0	0	0	0	0	111.9	R152 Q292	G143-R152 CarbonylContact C-O 3.57Å; G143-R152 WeakPolarHBondContact CA-O 3.39Å; G143-Q292 PolarHBondContact N-O 2.93Å
144	L	78.2	Confident	81.5	Confident	15 Å²	15	45.6 Å²	45.6	8%	0.079	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	129.6	164.7	-81.4	177.4	0	0	0	109.5	W146 R152 Y223 L258 V281	L144-W146 PolarHBondContact O-N 2.91Å; L144-R152 PolarHBondContact N-O 2.65Å; L144-R152 PolarHBondContact O-N 3.14Å; L144-Y223 HydrophobicContact CB-CE2 4.01Å; L144-Y223 HydrophobicContact CD1-CE2 4.05Å; L144-Y223 HydrophobicContact CD2-CE2 4.14Å; L144-Y223 HydrophobicContact CG-CE2 4.28Å; L144-L258 HydrophobicContact CD1-CD1 3.45Å; L144-L258 VanDerWaalsContact CD1-CD1 3.45Å; L144-V281 HydrophobicContact CD2-CG2 3.84Å
145	A	70.1	Confident	81.4	Confident	45 Å²	45	45.4 Å²	45.4	37%	0.372	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	111.5	171.2	0	0	0	0	0	109.5	Y223	A145-Y223 WeakPolarHBondContact O-CD2 3.36Å
146	W	64.5	Low	81.4	Confident	40 Å²	40	43 Å²	43	15%	0.152	24%	0.243	C	C	.	.			trans	-100.6	164.7	173	-164.3	-92	0	0	0	109.5	L144 S149 E150 R152 L214 Y223 I395	L144-W146 PolarHBondContact O-N 2.91Å; W146-S149 PolarHBondContact O-N 3.04Å; W146-E150 WeakPolarHBondContact CA-O 3.34Å; W146-E150 HydrophobicContact CB-CB 4.09Å; W146-E150 WeakPolarHBondContact CB-O 3.29Å; W146-E150 PolarHBondContact N-O 3.22Å; W146-R152 HydrophobicContact CB-CB 4.48Å; W146-R152 HydrophobicContact CB-CG 3.82Å; W146-R152 VanDerWaalsContact CD1-NE 3.33Å; W146-R152 HydrophobicContact CG-CG 4.14Å; W146-R152 VanDerWaalsContact NE1-CZ 3.33Å; W146-L214 HydrophobicContact CH2-CD1 3.46Å; W146-L214 VanDerWaalsContact CH2-CD1 3.46Å; W146-L214 HydrophobicContact CH2-CD2 4.49Å; W146-L214 HydrophobicContact CZ2-CD1 4.27Å; W146-L214 HydrophobicContact CZ3-CD1 3.85Å; W146-Y223 AromaticContact CE3-CE1 3.88Å; W146-Y223 HydrophobicContact CE3-CE1 3.88Å; W146-Y223 HydrophobicContact CE3-CE2 4.5Å; W146-Y223 AromaticContact CE3-CZ 3.78Å; W146-Y223 AromaticContact CZ3-CE1 3.75Å; W146-Y223 HydrophobicContact CZ3-CE1 3.75Å; W146-Y223 AromaticContact CZ3-CZ 3.85Å; W146-Y223 WeakPolarHBondContact CZ3-OH 3.24Å; W146-I395 HydrophobicContact CH2-CD1 3.6Å; W146-I395 HydrophobicContact CZ2-CD1 3.93Å; W146-I395 HydrophobicContact CZ2-CG2 4.16Å; W146-I395 HydrophobicContact CZ3-CD1 4.41Å
147	G	55.1	Low	81.4	Confident	36 Å²	36	43.1 Å²	43.1	37%	0.371	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-53.6	146.4	-174.5	0	0	0	0	0	113.5	S149	G147-S149 PolarHBondContact O-N 3.44Å
148	N	55.1	Low	81.5	Confident	158 Å²	158	39.7 Å²	39.7	85%	0.845	22%	0.223	S	C	*	.	G	3₁₀ helix	trans	60.6	36.5	-178.8	-55.8	-9	0	0	0	114.4	E150	N148-E150 VanDerWaalsContact C-N 3.25Å; N148-E150 PolarHBondContact O-N 3.04Å
149	S	58.3	Low	81.5	Confident	112 Å²	112	41.7 Å²	41.7	78%	0.783	23%	0.229	S	C	*	.	G	3₁₀ helix	trans	64.6	14.7	177.4	66.8	0	0	0	0	116.7	W146 G147 T151	W146-S149 PolarHBondContact O-N 3.04Å; G147-S149 PolarHBondContact O-N 3.44Å; S149-T151 PolarHBondContact O-N 3.07Å
150	E	66.3	Low	81.6	Confident	98 Å²	98	41.7 Å²	41.7	46%	0.458	23%	0.228	S	C	.	.	P	Polyproline II helix	trans	-64.5	128	164.3	-75.4	-175.6	-170.2	0	0	110.1	W146 N148 R152	W146-E150 WeakPolarHBondContact CA-O 3.34Å; W146-E150 HydrophobicContact CB-CB 4.09Å; W146-E150 WeakPolarHBondContact CB-O 3.29Å; W146-E150 PolarHBondContact N-O 3.22Å; N148-E150 VanDerWaalsContact C-N 3.25Å; N148-E150 PolarHBondContact O-N 3.04Å; E150-R152 IonicContact OE1-NH2 3.85Å; E150-R152 IonicContact OE2-CZ 2.62Å; E150-R152 VanDerWaalsContact OE2-CZ 3.24Å; E150-R152 IonicContact OE2-NE 2.64Å; E150-R152 PolarHBondContact OE2-NE 2.71Å; E150-R152 IonicContact OE2-NH2 3.47Å; E150-R152 PolarHBondContact OE2-NH2 2.76Å
151	T	72.5	Confident	81.7	Confident	45 Å²	45	45.4 Å²	45.4	28%	0.276	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	120.6	165.6	-51.4	0	0	0	0	109.1	S149 Q292 L294	S149-T151 PolarHBondContact O-N 3.07Å; T151-Q292 HydrophobicContact CG2-CG 4.39Å; T151-Q292 PolarHBondContact OG1-NE2 2.93Å; T151-Q292 PolarHBondContact OG1-OE1 2.99Å; T151-L294 HydrophobicContact CG2-CD2 3.93Å
152	R	78.3	Confident	81.8	Confident	86 Å²	86	50 Å²	50	33%	0.325	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	164.5	176.6	-65.9	-170.8	-180	-160.5	-4.9	111.2	G143 L144 W146 E150 G154	G143-R152 CarbonylContact C-O 3.57Å; G143-R152 WeakPolarHBondContact CA-O 3.39Å; L144-R152 PolarHBondContact N-O 2.65Å; L144-R152 PolarHBondContact O-N 3.14Å; W146-R152 HydrophobicContact CB-CB 4.48Å; W146-R152 HydrophobicContact CB-CG 3.82Å; W146-R152 VanDerWaalsContact CD1-NE 3.33Å; W146-R152 HydrophobicContact CG-CG 4.14Å; W146-R152 VanDerWaalsContact NE1-CZ 3.33Å; E150-R152 IonicContact OE1-NH2 3.85Å; E150-R152 IonicContact OE2-CZ 2.62Å; E150-R152 VanDerWaalsContact OE2-CZ 3.24Å; E150-R152 IonicContact OE2-NE 2.64Å; E150-R152 PolarHBondContact OE2-NE 2.71Å; E150-R152 IonicContact OE2-NH2 3.47Å; E150-R152 PolarHBondContact OE2-NH2 2.76Å; R152-G154 PolarHBondContact O-N 2.84Å
153	R	85.6	Confident	82	Confident	32 Å²	32	51.6 Å²	51.6	12%	0.121	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	121.5	174	-81.9	166.9	-179.3	-105.7	12.8	109.4	A100 D101 F103 L294	A100-R153 HydrophobicContact CB-CB 3.93Å; A100-R153 HydrophobicContact CB-CG 4.2Å; A100-R153 PolarHBondContact O-NH1 2.78Å; D101-R153 VanDerWaalsContact OD1-CB 3.31Å; D101-R153 WeakPolarHBondContact OD1-CB 3.37Å; D101-R153 WeakPolarHBondContact OD1-CD 3.46Å; F103-R153 PolarHBondContact O-NH1 3.39Å; R153-L294 HydrophobicContact CB-CD1 4.42Å; R153-L294 HydrophobicContact CG-CD1 3.83Å
154	G	90	Very high	82.5	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	-126.1	-179.2	0	0	0	0	0	111.6	A100 Y142 R152 L258	A100-G154 WeakPolarHBondContact CB-O 3.45Å; A100-G154 PolarHBondContact N-O 3.13Å; Y142-G154 VanDerWaalsContact O-CA 3.23Å; Y142-G154 WeakPolarHBondContact O-CA 3.05Å; Y142-G154 PolarHBondContact O-N 2.98Å; R152-G154 PolarHBondContact O-N 2.84Å; G154-L258 VanDerWaalsContact O-CD2 3.31Å; G154-L258 WeakPolarHBondContact O-CD2 3.37Å
155	I	94.7	Very high	83.2	Confident	1 Å²	1	51.6 Å²	51.6	1%	0.005	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	155.1	172.4	65.9	170.1	0	0	0	111.6	I97 T98 Y142 I157 V256 V281 A282	I97-I155 HydrophobicContact CG2-CB 4.33Å; I97-I155 HydrophobicContact CG2-CD1 4.3Å; T98-I155 CarbonylContact O-C 3.5Å; T98-I155 VanDerWaalsContact O-CA 3.31Å; T98-I155 WeakPolarHBondContact O-CA 3.38Å; Y142-I155 WeakPolarHBondContact CB-O 3.2Å; Y142-I155 HydrophobicContact CD2-CG1 4.34Å; Y142-I155 PolarHBondContact N-O 2.94Å; I155-I157 HydrophobicContact CD1-CD1 4.38Å; I155-I157 HydrophobicContact CD1-CG1 4.36Å; I155-V256 HydrophobicContact CG2-CB 3.88Å; I155-V256 HydrophobicContact CG2-CG1 4.23Å; I155-V256 HydrophobicContact CG2-CG2 3.79Å; I155-V281 HydrophobicContact CD1-CB 3.85Å; I155-V281 HydrophobicContact CD1-CG1 3.88Å; I155-V281 HydrophobicContact CG1-CB 4.23Å; I155-V281 HydrophobicContact CG1-CG1 3.9Å; I155-A282 HydrophobicContact CD1-CB 4Å
156	A	95.7	Very high	84.2	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	143.5	163.3	0	0	0	0	0	109.5	T98 A100 F103 N140 L141 L158	T98-A156 HydrophobicContact CG2-CB 3.95Å; T98-A156 PolarHBondContact N-O 2.69Å; T98-A156 PolarHBondContact O-N 3.11Å; A100-A156 HydrophobicContact CB-CB 4.45Å; F103-A156 HydrophobicContact CD2-CB 3.92Å; F103-A156 HydrophobicContact CE2-CB 3.72Å; N140-A156 CarbonylContact O-C 3.57Å; N140-A156 VanDerWaalsContact O-CA 3.23Å; N140-A156 WeakPolarHBondContact O-CA 3.08Å; L141-A156 HydrophobicContact CD2-CB 3.63Å; A156-L158 HydrophobicContact CB-CD2 4.24Å
157	I	96.2	Very high	85.4	Confident	9 Å²	9	60.4 Å²	60.4	5%	0.046	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	122.2	171.7	-56.2	-179.1	0	0	0	107.7	L95 I96 I97 N140 Y142 I155 A282 V285 F286	L95-I157 HydrophobicContact CD2-CG2 4.46Å; I96-I157 WeakPolarHBondContact O-CA 3.47Å; I97-I157 HydrophobicContact CG1-CG1 4.38Å; N140-I157 PolarHBondContact N-O 3.34Å; N140-I157 PolarHBondContact O-N 3.36Å; Y142-I157 HydrophobicContact CD2-CD1 4.41Å; Y142-I157 HydrophobicContact CD2-CG1 4.23Å; Y142-I157 HydrophobicContact CE2-CB 4.08Å; Y142-I157 HydrophobicContact CE2-CD1 3.9Å; Y142-I157 HydrophobicContact CE2-CG1 3.86Å; I155-I157 HydrophobicContact CD1-CD1 4.38Å; I155-I157 HydrophobicContact CD1-CG1 4.36Å; I157-A282 HydrophobicContact CD1-CB 4.45Å; I157-V285 HydrophobicContact CD1-CB 4.19Å; I157-V285 HydrophobicContact CD1-CG1 4Å; I157-V285 HydrophobicContact CD1-CG2 4.43Å; I157-F286 HydrophobicContact CD1-CE1 4.06Å; I157-F286 HydrophobicContact CD1-CZ 3.96Å; I157-F286 HydrophobicContact CG2-CE1 4.29Å; I157-F286 HydrophobicContact CG2-CZ 4.34Å
158	L	96.9	Very high	87.2	Confident	1 Å²	1	59.4 Å²	59.4	1%	0.005	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	143.7	-178.4	-36.5	179	0	0	0	109.4	I66 I96 T98 F103 I136 D138 V139 A156	I66-L158 HydrophobicContact CD1-CD1 3.92Å; I96-L158 HydrophobicContact CB-CB 4.21Å; I96-L158 HydrophobicContact CB-CD1 4.41Å; I96-L158 HydrophobicContact CB-CG 4.41Å; I96-L158 HydrophobicContact CG2-CD1 4.11Å; I96-L158 HydrophobicContact CG2-CG 4.4Å; I96-L158 PolarHBondContact N-O 2.81Å; I96-L158 PolarHBondContact O-N 2.78Å; T98-L158 HydrophobicContact CG2-CD1 4.14Å; T98-L158 HydrophobicContact CG2-CD2 4.33Å; T98-L158 HydrophobicContact CG2-CG 4.23Å; F103-L158 HydrophobicContact CE1-CD2 4.23Å; F103-L158 HydrophobicContact CE2-CD2 3.82Å; F103-L158 HydrophobicContact CZ-CD1 4.05Å; F103-L158 HydrophobicContact CZ-CD2 3.4Å; F103-L158 VanDerWaalsContact CZ-CD2 3.4Å; F103-L158 HydrophobicContact CZ-CG 4.37Å; I136-L158 HydrophobicContact CD1-CD1 4.45Å; I136-L158 HydrophobicContact CG2-CB 4.44Å; D138-L158 CarbonylContact O-C 3.58Å; D138-L158 VanDerWaalsContact O-CA 3.31Å; D138-L158 WeakPolarHBondContact O-CA 3.38Å; V139-L158 HydrophobicContact CB-CD2 4.37Å; V139-L158 HydrophobicContact CG1-CD2 3.94Å; V139-L158 HydrophobicContact CG2-CD2 4.17Å; A156-L158 HydrophobicContact CB-CD2 4.24Å
159	K	96.8	Very high	88.9	Confident	95 Å²	95	56 Å²	56	41%	0.413	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	124.5	169.6	-163	-173.3	-177	-171.1	0	110.1	D94 V137 D138	D94-K159 WeakPolarHBondContact O-CA 3.45Å; D94-K159 WeakPolarHBondContact OD2-CE 3.39Å; D94-K159 IonicContact OD2-NZ 3.96Å; V137-K159 PolarHBondContact N-O 2.95Å; D138-K159 HydrophobicContact CB-CB 3.95Å; D138-K159 PolarHBondContact N-O 3.43Å; D138-K159 VanDerWaalsContact N-O 3.17Å; D138-K159 PolarHBondContact O-N 2.67Å
160	L	97.1	Very high	90.6	Very high	3 Å²	3	50.9 Å²	50.9	2%	0.016	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	155.4	174.1	-64.3	-178.1	0	0	0	112	L80 D94 I96 V117 A134 E135 L164	L80-L160 HydrophobicContact CD1-CD1 4.5Å; D94-L160 HydrophobicContact CB-CB 4.32Å; D94-L160 PolarHBondContact O-N 2.9Å; I96-L160 HydrophobicContact CD1-CD1 3.94Å; I96-L160 HydrophobicContact CD1-CD2 3.62Å; I96-L160 HydrophobicContact CD1-CG 3.83Å; V117-L160 HydrophobicContact CB-CD2 4.28Å; V117-L160 HydrophobicContact CG2-CD2 4.07Å; A134-L160 HydrophobicContact CB-CD1 3.89Å; A134-L160 HydrophobicContact CB-CD2 3.71Å; A134-L160 HydrophobicContact CB-CG 4.31Å; E135-L160 WeakPolarHBondContact O-CA 3.16Å; L160-L164 HydrophobicContact CD1-CD1 3.82Å; L160-L164 HydrophobicContact CD1-CG 3.79Å
161	E	96	Very high	91.9	Very high	137 Å²	137	46.2 Å²	46.2	64%	0.64	21%	0.212	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-67.3	-45.4	170	-170.9	178	-152.2	0	0	112.2	E135 V137	E135-E161 PolarHBondContact O-N 3.49Å; V137-E161 VanDerWaalsContact CG2-CA 3.49Å; V137-E161 HydrophobicContact CG2-CB 3.64Å; V137-E161 HydrophobicContact CG2-CG 3.96Å
162	R	94.9	Very high	93	Very high	108 Å²	108	44.2 Å²	44.2	41%	0.408	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	126.9	178.4	-173.4	-177.1	64.4	92	-18.6	109.8	L164 D168	R162-L164 PolarHBondContact O-N 3.42Å; R162-D168 IonicContact CZ-OD1 2.7Å; R162-D168 VanDerWaalsContact CZ-OD1 3.23Å; R162-D168 VanDerWaalsContact NH1-CG 3.33Å; R162-D168 IonicContact NH1-OD1 2.7Å; R162-D168 PolarHBondContact NH1-OD1 2.57Å; R162-D168 IonicContact NH1-OD2 2.8Å; R162-D168 PolarHBondContact NH1-OD2 3.5Å; R162-D168 IonicContact NH2-OD1 3.57Å; R162-D168 PolarHBondContact NH2-OD1 2.96Å
163	P	95.2	Very high	93.9	Very high	56 Å²	56	40.1 Å²	40.1	36%	0.364	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-59	133.5	167.2	-20	30.6	0	0	0	111.1	T92 S93 D94	T92-P163 HydrophobicContact CG2-CB 4.48Å; S93-P163 CarbonylContact O-C 3.56Å; S93-P163 WeakPolarHBondContact O-CA 3.22Å; D94-P163 HydrophobicContact CB-CB 4.25Å; D94-P163 HydrophobicContact CB-CG 4.15Å
164	L	95.2	Very high	94.5	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	155	173	-54.9	-178.7	0	0	0	110.1	L80 T92 S93 A119 I132 A134 L160 R162 V170	L80-L164 HydrophobicContact CD2-CB 4.26Å; T92-L164 CarbonylContact C-O 3.22Å; T92-L164 WeakPolarHBondContact CA-O 3.26Å; S93-L164 PolarHBondContact N-O 2.89Å; S93-L164 PolarHBondContact O-N 3.14Å; A119-L164 HydrophobicContact CB-CD1 3.75Å; I132-L164 HydrophobicContact CG2-CD2 3.94Å; A134-L164 HydrophobicContact CB-CD2 4.39Å; L160-L164 HydrophobicContact CD1-CD1 3.82Å; L160-L164 HydrophobicContact CD1-CG 3.79Å; R162-L164 PolarHBondContact O-N 3.42Å; L164-V170 HydrophobicContact CB-CG2 3.54Å
165	S	93.6	Very high	94.8	Very high	21 Å²	21	39.6 Å²	39.6	15%	0.147	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	175	-165.7	72.8	0	0	0	0	112.7	K167 D168 V170	S165-K167 PolarHBondContact O-N 2.74Å; S165-K167 VanDerWaalsContact O-N 3.1Å; S165-K167 WeakPolarHBondContact OG-CB 3.15Å; S165-K167 PolarHBondContact OG-N 3.27Å; S165-K167 VanDerWaalsContact OG-N 3.14Å; S165-D168 WeakPolarHBondContact CB-OD2 3.34Å; S165-D168 PolarHBondContact N-OD2 2.83Å; S165-D168 WeakPolarHBondContact O-CA 3.37Å; S165-D168 VanDerWaalsContact O-CB 3.31Å; S165-D168 WeakPolarHBondContact O-CB 3.42Å; S165-D168 PolarHBondContact O-N 3.4Å; S165-D168 PolarHBondContact OG-OD2 2.89Å; S165-V170 CarbonylContact C-O 3.6Å; S165-V170 VanDerWaalsContact C-O 3.31Å; S165-V170 WeakPolarHBondContact O-CG2 3.43Å; S165-V170 PolarHBondContact O-N 3.37Å
166	R	90.7	Very high	94.8	Very high	94 Å²	94	39.5 Å²	39.5	36%	0.355	18%	0.184	S	C	.	.	G	3₁₀ helix	trans	-54.7	-26.7	169.2	-175.9	178.6	170.6	-142.8	-7.1	113.5	V35 S42 F43 D168 N169 V170	V35-R166 HydrophobicContact CG2-CB 4.21Å; S42-R166 PolarHBondContact O-NE 3.37Å; S42-R166 PolarHBondContact O-NH2 3.15Å; F43-R166 HydrophobicContact CE1-CG 3.88Å; F43-R166 HydrophobicContact CZ-CG 4.42Å; R166-D168 PolarHBondContact O-N 3.25Å; R166-N169 PolarHBondContact O-N 2.95Å; R166-N169 VanDerWaalsContact O-N 3.16Å; R166-V170 WeakPolarHBondContact CA-O 3.47Å; R166-V170 PolarHBondContact N-O 3.47Å
167	K	90.1	Very high	94.6	Very high	176 Å²	176	45.9 Å²	45.9	77%	0.765	21%	0.213	S	C	*	.	G	3₁₀ helix	trans	-71.7	-18.9	175	-60.4	-177.3	177.4	-178	0	113.4	S165 N169	S165-K167 PolarHBondContact O-N 2.74Å; S165-K167 VanDerWaalsContact O-N 3.1Å; S165-K167 WeakPolarHBondContact OG-CB 3.15Å; S165-K167 PolarHBondContact OG-N 3.27Å; S165-K167 VanDerWaalsContact OG-N 3.14Å; K167-N169 VanDerWaalsContact C-N 3.28Å
168	D	91.6	Very high	94.2	Very high	15 Å²	15	50.7 Å²	50.7	8%	0.08	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-92.4	7.4	174.3	-53.9	-82	0	0	0	111.5	I132 R162 S165 R166 V170	I132-D168 HydrophobicContact CG1-CB 4.18Å; I132-D168 HydrophobicContact CG2-CB 4.32Å; R162-D168 IonicContact CZ-OD1 2.7Å; R162-D168 VanDerWaalsContact CZ-OD1 3.23Å; R162-D168 VanDerWaalsContact NH1-CG 3.33Å; R162-D168 IonicContact NH1-OD1 2.7Å; R162-D168 PolarHBondContact NH1-OD1 2.57Å; R162-D168 IonicContact NH1-OD2 2.8Å; R162-D168 PolarHBondContact NH1-OD2 3.5Å; R162-D168 IonicContact NH2-OD1 3.57Å; R162-D168 PolarHBondContact NH2-OD1 2.96Å; S165-D168 WeakPolarHBondContact CB-OD2 3.34Å; S165-D168 PolarHBondContact N-OD2 2.83Å; S165-D168 WeakPolarHBondContact O-CA 3.37Å; S165-D168 VanDerWaalsContact O-CB 3.31Å; S165-D168 WeakPolarHBondContact O-CB 3.42Å; S165-D168 PolarHBondContact O-N 3.4Å; S165-D168 PolarHBondContact OG-OD2 2.89Å; R166-D168 PolarHBondContact O-N 3.25Å; D168-V170 VanDerWaalsContact C-N 3.28Å; D168-V170 HydrophobicContact CB-CG2 4.26Å; D168-V170 PolarHBondContact O-N 3.37Å
169	N	90.6	Very high	93.6	Very high	88 Å²	88	53.5 Å²	53.5	47%	0.471	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.5	37.1	-169.2	-62.7	-8.6	0	0	0	113.9	F43 R166 K167	F43-N169 HydrophobicContact CE1-CB 4.48Å; R166-N169 PolarHBondContact O-N 2.95Å; R166-N169 VanDerWaalsContact O-N 3.16Å; K167-N169 VanDerWaalsContact C-N 3.28Å
170	V	93.7	Very high	93.2	Very high	3 Å²	3	50.7 Å²	50.7	2%	0.018	24%	0.238	C	C	.	.			trans	-120.4	152.4	172.3	-56.2	0	0	0	0	112.6	P61 L80 A119 N120 L164 S165 R166 D168	P61-V170 WeakPolarHBondContact O-CA 3.39Å; P61-V170 WeakPolarHBondContact O-CB 3.35Å; P61-V170 WeakPolarHBondContact O-CG1 3.48Å; L80-V170 HydrophobicContact CD2-CB 4.14Å; L80-V170 HydrophobicContact CD2-CG2 3.68Å; A119-V170 HydrophobicContact CB-CG1 3.9Å; N120-V170 HydrophobicContact CB-CG1 4.43Å; L164-V170 HydrophobicContact CB-CG2 3.54Å; S165-V170 CarbonylContact C-O 3.6Å; S165-V170 VanDerWaalsContact C-O 3.31Å; S165-V170 WeakPolarHBondContact O-CG2 3.43Å; S165-V170 PolarHBondContact O-N 3.37Å; R166-V170 WeakPolarHBondContact CA-O 3.47Å; R166-V170 PolarHBondContact N-O 3.47Å; D168-V170 VanDerWaalsContact C-N 3.28Å; D168-V170 HydrophobicContact CB-CG2 4.26Å; D168-V170 PolarHBondContact O-N 3.37Å
171	V	94.4	Very high	92.7	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	25%	0.249	C	C	.	.			trans	-137.1	131.8	167.2	170.1	0	0	0	0	107	V35 Y36 F43 P61 W62	V35-V171 HydrophobicContact CG1-CB 4.42Å; V35-V171 HydrophobicContact CG1-CG1 3.86Å; V35-V171 HydrophobicContact CG1-CG2 3.78Å; Y36-V171 WeakPolarHBondContact O-CG1 3.46Å; F43-V171 HydrophobicContact CD2-CG2 4.46Å; F43-V171 HydrophobicContact CE2-CB 4.26Å; F43-V171 HydrophobicContact CE2-CG2 3.52Å; F43-V171 HydrophobicContact CZ-CG2 3.74Å; P61-V171 PolarHBondContact O-N 2.75Å; W62-V171 WeakPolarHBondContact CB-O 3.35Å
172	P	96.4	Very high	92.1	Very high	3 Å²	3	46 Å²	46	2%	0.019	22%	0.219	C	C	.	.	P	Polyproline II helix	trans	-68.3	145.8	178.6	27.2	-35.1	0	0	0	112.5	C37 G38 L80 V81 H82 A90	C37-P172 CarbonylContact C-O 3.52Å; C37-P172 WeakPolarHBondContact CA-O 3.03Å; C37-P172 WeakPolarHBondContact CB-O 3.4Å; G38-P172 PolarHBondContact N-O 2.84Å; L80-P172 HydrophobicContact CD2-CB 4.4Å; L80-P172 HydrophobicContact CG-CB 4.25Å; L80-P172 CarbonylContact O-C 3.57Å; L80-P172 VanDerWaalsContact O-CA 3.25Å; L80-P172 WeakPolarHBondContact O-CA 2.96Å; V81-P172 VanDerWaalsContact C-CB 3.46Å; H82-P172 HydrophobicContact CB-CB 4.17Å; H82-P172 HydrophobicContact CB-CG 4.12Å; A90-P172 HydrophobicContact CB-CG 3.84Å
173	V	96.8	Very high	91.4	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.212	C	C	.	.	B	Isolated β-bridge	trans	-73.8	149.4	172	72	0	0	0	0	110.9	W62 L80 V81 H82 V244 A251 Q253	W62-V173 HydrophobicContact CB-CB 4.09Å; W62-V173 HydrophobicContact CD2-CB 3.7Å; W62-V173 HydrophobicContact CD2-CG2 4.09Å; W62-V173 HydrophobicContact CE3-CB 4.07Å; W62-V173 HydrophobicContact CE3-CG2 4.43Å; W62-V173 HydrophobicContact CG-CB 3.71Å; W62-V173 HydrophobicContact CG-CG1 4.37Å; W62-V173 HydrophobicContact CG-CG2 4.45Å; L80-V173 PolarHBondContact O-N 2.9Å; V81-V173 HydrophobicContact CG1-CG1 3.98Å; H82-V173 PolarHBondContact N-O 2.88Å; H82-V173 VanDerWaalsContact N-O 3.16Å; V173-V244 HydrophobicContact CG2-CG1 4.15Å; V173-V244 HydrophobicContact CG2-CG2 4.4Å; V173-A251 HydrophobicContact CG2-CB 4.04Å; V173-Q253 HydrophobicContact CG1-CB 3.85Å; V173-Q253 HydrophobicContact CG2-CB 4.21Å
174	C	96.9	Very high	90	Very high	2 Å²	2	40.7 Å²	40.7	1%	0.014	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	146.2	168.4	-65	0	0	0	0	110.3	C37 Y252 Q253	C37-C174 HydrophobicContact CB-CB 4.02Å; C37-C174 WeakPolarHBondContact CB-SG 3.39Å; C37-C174 PolarHBondContact O-SG 3.11Å; C37-C174 WeakPolarHBondContact SG-CA 3.26Å; C37-C174 WeakPolarHBondContact SG-CB 3.43Å; C37-C174 CovalentContact SG-SG 2.05Å; C37-C174 PolarHBondContact SG-SG 3.27Å; C174-Y252 HydrophobicContact CB-CD1 3.71Å; C174-Y252 HydrophobicContact CB-CE1 4.02Å; C174-Y252 HydrophobicContact CB-CG 4.47Å; C174-Y252 CarbonylContact O-C 3.57Å; C174-Y252 WeakPolarHBondContact O-CA 3.36Å; C174-Q253 PolarHBondContact O-N 2.92Å
175	L	96.3	Very high	88.6	Confident	19 Å²	19	43 Å²	43	10%	0.099	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	138	163.9	-50.2	178	0	0	0	108.6	V81 I97 I279 F286	V81-L175 HydrophobicContact CB-CD2 3.94Å; V81-L175 HydrophobicContact CG1-CD2 3.9Å; I97-L175 HydrophobicContact CD1-CD2 4.04Å; L175-I279 HydrophobicContact CB-CG1 4.18Å; L175-I279 HydrophobicContact CD2-CD1 3.97Å; L175-I279 HydrophobicContact CD2-CG1 3.83Å; L175-I279 HydrophobicContact CG-CG1 4.47Å; L175-F286 HydrophobicContact CD1-CD2 3.78Å; L175-F286 HydrophobicContact CD1-CE2 3.76Å
176	A	94.8	Very high	87.7	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-64.2	157.4	169.5	0	0	0	0	0	111.1	Q253 Y254 I279 H283	A176-Q253 WeakPolarHBondContact CB-O 3.22Å; A176-Q253 PolarHBondContact N-O 3.37Å; A176-Y254 HydrophobicContact CB-CD1 3.41Å; A176-Y254 VanDerWaalsContact CB-CD1 3.41Å; A176-Y254 HydrophobicContact CB-CD2 3.83Å; A176-Y254 HydrophobicContact CB-CE1 3.49Å; A176-Y254 VanDerWaalsContact CB-CE1 3.49Å; A176-Y254 HydrophobicContact CB-CE2 3.89Å; A176-Y254 HydrophobicContact CB-CG 3.59Å; A176-I279 HydrophobicContact CB-CG2 4.26Å; A176-H283 PolarHBondContact O-NE2 3.06Å
177	E	91.6	Very high	87.1	Confident	133 Å²	133	38.5 Å²	38.5	62%	0.621	20%	0.198	S	C	*	.	P	Polyproline II helix	trans	-61.7	151.3	-177.5	-63.7	-171.7	160.9	0	0	112.8	D179 S180	E177-D179 PolarHBondContact O-N 2.99Å; E177-S180 PolarHBondContact N-OG 2.95Å; E177-S180 VanDerWaalsContact O-CB 3.27Å; E177-S180 WeakPolarHBondContact O-CB 3.25Å; E177-S180 PolarHBondContact O-N 2.6Å; E177-S180 VanDerWaalsContact O-N 3.13Å; E177-S180 PolarHBondContact O-OG 2.92Å
178	R	88.7	Confident	87	Confident	111 Å²	111	30.2 Å²	30.2	42%	0.419	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	135.7	-178.1	-159.7	-178.2	-175.2	-80.2	1.1	110.4	S180 N280 H283 D284	R178-S180 PolarHBondContact O-N 3.11Å; R178-N280 WeakPolarHBondContact CG-OD1 3.37Å; R178-H283 HydrophobicContact CG-CB 4.38Å; R178-D284 IonicContact CZ-OD1 3.24Å; R178-D284 IonicContact CZ-OD2 3.55Å; R178-D284 IonicContact NE-OD1 3.64Å; R178-D284 PolarHBondContact NE-OD1 3.2Å; R178-D284 IonicContact NH2-OD1 2.7Å; R178-D284 PolarHBondContact NH2-OD1 3.24Å; R178-D284 IonicContact NH2-OD2 3.29Å; R178-D284 PolarHBondContact NH2-OD2 2.88Å
179	D	85.1	Confident	86.9	Confident	59 Å²	59	30.6 Å²	30.6	32%	0.316	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.8	5.1	-175.5	-64.8	-69.3	0	0	0	116.8	E177 R212 R224 N280	E177-D179 PolarHBondContact O-N 2.99Å; D179-R212 PolarHBondContact O-NH1 3.06Å; D179-R212 PolarHBondContact O-NH2 3.13Å; D179-R224 IonicContact OD1-CZ 2.93Å; D179-R224 IonicContact OD1-NH1 3.77Å; D179-R224 PolarHBondContact OD1-NH1 2.89Å; D179-N280 PolarHBondContact N-OD1 3.25Å; D179-N280 PolarHBondContact OD1-ND2 2.89Å
180	S	88.2	Confident	86.9	Confident	36 Å²	36	26.4 Å²	26.4	25%	0.252	14%	0.14	S	C	.	.			trans	-68.9	161.7	171.3	73.2	0	0	0	0	112.5	E177 R178 Y254	E177-S180 PolarHBondContact N-OG 2.95Å; E177-S180 VanDerWaalsContact O-CB 3.27Å; E177-S180 WeakPolarHBondContact O-CB 3.25Å; E177-S180 PolarHBondContact O-N 2.6Å; E177-S180 VanDerWaalsContact O-N 3.13Å; E177-S180 PolarHBondContact O-OG 2.92Å; R178-S180 PolarHBondContact O-N 3.11Å; S180-Y254 WeakPolarHBondContact OG-CE1 3.45Å
181	V	84.9	Confident	86.9	Confident	40 Å²	40	26.3 Å²	26.3	24%	0.242	14%	0.14	C	C	.	.			trans	-130.3	157.2	169.9	-66.3	0	0	0	0	108.5	P211 R212 Y254	V181-P211 HydrophobicContact CB-CB 4.28Å; V181-P211 HydrophobicContact CB-CG 4.01Å; V181-P211 HydrophobicContact CG1-CB 4.49Å; V181-P211 HydrophobicContact CG1-CG 4.27Å; V181-P211 HydrophobicContact CG2-CG 3.98Å; V181-R212 HydrophobicContact CG1-CG 4.06Å; V181-Y254 WeakPolarHBondContact O-CE1 3.3Å
182	P	84.4	Confident	86.7	Confident	3 Å²	3	27.4 Å²	27.4	2%	0.019	14%	0.144	C	C	.	.			trans	-52.9	129.2	175.9	-30.4	37.7	0	0	0	112.8	I207 M243 Y254	P182-I207 HydrophobicContact CB-CD1 3.83Å; P182-I207 HydrophobicContact CB-CG1 3.87Å; P182-I207 HydrophobicContact CG-CD1 3.86Å; P182-I207 HydrophobicContact CG-CG1 4.44Å; P182-M243 HydrophobicContact CG-CE 3.61Å; P182-Y254 HydrophobicContact CG-CD1 3.9Å; P182-Y254 HydrophobicContact CG-CD2 4.2Å; P182-Y254 HydrophobicContact CG-CE1 4.48Å; P182-Y254 HydrophobicContact CG-CG 3.74Å
183	P	80.9	Confident	86.5	Confident	38 Å²	38	27.8 Å²	27.8	25%	0.247	15%	0.145	C	C	.	.			trans	-62.4	142.9	170.4	-21.8	33.1	0	0	0	111	S185 A186 V247	P183-S185 PolarHBondContact O-N 2.81Å; P183-S185 VanDerWaalsContact O-N 3.15Å; P183-A186 HydrophobicContact CB-CB 4.27Å; P183-A186 HydrophobicContact CG-CB 4.42Å; P183-A186 WeakPolarHBondContact O-CB 3.21Å; P183-A186 PolarHBondContact O-N 2.97Å; P183-V247 HydrophobicContact CG-CG2 4.38Å
184	P	64.9	Low	86.2	Confident	14 Å²	14	28.3 Å²	28.3	9%	0.091	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-29.8	177.9	-25	33.2	0	0	0	114.3	A186 Y681 Y684 L737 S739	P184-A186 VanDerWaalsContact C-N 3.34Å; P184-Y681 HydrophobicContact CB-CD1 4.2Å; P184-Y681 HydrophobicContact CB-CE1 3.88Å; P184-Y681 HydrophobicContact CG-CD1 4.42Å; P184-Y681 HydrophobicContact CG-CE1 4.43Å; P184-Y684 HydrophobicContact CG-CD2 3.91Å; P184-Y684 HydrophobicContact CG-CE1 4.06Å; P184-Y684 HydrophobicContact CG-CE2 3.37Å; P184-Y684 HydrophobicContact CG-CG 4.47Å; P184-Y684 VanDerWaalsContact CG-CZ 3.45Å; P184-L737 HydrophobicContact CB-CD2 4.44Å; P184-S739 PolarHBondContact O-OG 3.36Å
185	S	65.3	Low	85.7	Confident	49 Å²	49	31.6 Å²	31.6	34%	0.343	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-1.4	179.2	53.2	0	0	0	0	114.4	P183	P183-S185 PolarHBondContact O-N 2.81Å; P183-S185 VanDerWaalsContact O-N 3.15Å
186	A	74.6	Confident	85.2	Confident	4 Å²	4	37.3 Å²	37.3	3%	0.033	18%	0.182	C	C	.	.	S	Bend	trans	-86.5	132.1	175.8	0	0	0	0	0	110.9	P183 P184 C188 C245 V247	P183-A186 HydrophobicContact CB-CB 4.27Å; P183-A186 HydrophobicContact CG-CB 4.42Å; P183-A186 WeakPolarHBondContact O-CB 3.21Å; P183-A186 PolarHBondContact O-N 2.97Å; P184-A186 VanDerWaalsContact C-N 3.34Å; A186-C188 PolarHBondContact O-N 3.15Å; A186-C245 HydrophobicContact CB-CB 4.11Å; A186-V247 HydrophobicContact CB-CG2 3.95Å
187	S	78.7	Confident	84.8	Confident	16 Å²	16	40.7 Å²	40.7	11%	0.112	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	115.3	164.5	-61.3	0	0	0	0	108.6	Y189 C245 L246 P738	S187-Y189 VanDerWaalsContact CB-CE2 3.48Å; S187-C245 WeakPolarHBondContact O-CA 3.39Å; S187-L246 PolarHBondContact O-N 2.95Å; S187-P738 WeakPolarHBondContact OG-CB 3.46Å; S187-P738 VanDerWaalsContact OG-CG 3.24Å; S187-P738 WeakPolarHBondContact OG-CG 3.44Å
188	C	87.3	Confident	84.6	Confident	1 Å²	1	37.7 Å²	37.7	1%	0.007	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	139.7	175.7	-63.3	0	0	0	0	110.7	A186 I204 V205 I207 V244 C245	A186-C188 PolarHBondContact O-N 3.15Å; C188-I204 WeakPolarHBondContact O-CA 3.44Å; C188-I204 WeakPolarHBondContact O-CG1 3.43Å; C188-V205 HydrophobicContact CB-CG2 3.85Å; C188-V205 PolarHBondContact O-N 3.48Å; C188-I207 HydrophobicContact CB-CD1 4.11Å; C188-I207 HydrophobicContact CB-CG1 4.48Å; C188-V244 CarbonylContact C-O 3.51Å; C188-V244 WeakPolarHBondContact CA-O 3.44Å; C188-C245 HydrophobicContact CB-CB 4.1Å; C188-C245 WeakPolarHBondContact CB-SG 3.11Å; C188-C245 WeakPolarHBondContact SG-CB 3.35Å; C188-C245 CovalentContact SG-SG 2.04Å; C188-C245 PolarHBondContact SG-SG 3.43Å
189	Y	89.7	Confident	84.5	Confident	23 Å²	23	35.7 Å²	35.7	9%	0.09	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	149.6	-178	-59.1	-91.8	0	0	0	110.5	V51 F60 S187 E203 I204 M243 V244 L246	V51-Y189 HydrophobicContact CB-CD1 4.29Å; V51-Y189 HydrophobicContact CB-CE1 3.74Å; V51-Y189 HydrophobicContact CB-CE2 4.42Å; V51-Y189 HydrophobicContact CG1-CD1 3.92Å; V51-Y189 HydrophobicContact CG1-CE1 3.89Å; V51-Y189 HydrophobicContact CG1-CG 4.25Å; V51-Y189 HydrophobicContact CG2-CE1 4.06Å; V51-Y189 HydrophobicContact CG2-CE2 3.88Å; F60-Y189 HydrophobicContact CZ-CD2 4.35Å; F60-Y189 HydrophobicContact CZ-CG 4.5Å; S187-Y189 VanDerWaalsContact CB-CE2 3.48Å; Y189-E203 CarbonylContact C-O 3.55Å; Y189-E203 WeakPolarHBondContact CA-O 3.4Å; Y189-I204 HydrophobicContact CD1-CB 3.99Å; Y189-I204 HydrophobicContact CD1-CG1 4.43Å; Y189-I204 HydrophobicContact CE1-CB 3.85Å; Y189-I204 HydrophobicContact CE1-CD1 4.47Å; Y189-I204 HydrophobicContact CE1-CG1 4.13Å; Y189-M243 WeakPolarHBondContact O-CA 3.27Å; Y189-V244 PolarHBondContact N-O 3Å; Y189-V244 PolarHBondContact O-N 2.95Å; Y189-L246 HydrophobicContact CD2-CG 4.31Å; Y189-L246 HydrophobicContact CE2-CD1 3.91Å; Y189-L246 HydrophobicContact CE2-CG 4.04Å
190	V	91.5	Very high	84.6	Confident	0 Å²	0	33 Å²	33	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	133.3	167	69	0	0	0	0	109.3	E203 V205 Q238 Y276	V190-E203 HydrophobicContact CG1-CB 4.35Å; V190-E203 PolarHBondContact N-O 3.13Å; V190-E203 PolarHBondContact O-N 3.41Å; V190-V205 HydrophobicContact CB-CG1 4.1Å; V190-V205 HydrophobicContact CG1-CG1 3.45Å; V190-V205 VanDerWaalsContact CG1-CG1 3.45Å; V190-Q238 HydrophobicContact CG2-CG 3.99Å; V190-Y276 WeakPolarHBondContact CB-OH 3.39Å; V190-Y276 HydrophobicContact CG2-CE1 4.11Å; V190-Y276 WeakPolarHBondContact CG2-OH 3.43Å
191	T	92.6	Very high	84.5	Confident	2 Å²	2	31.9 Å²	31.9	1%	0.012	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	139.9	175	-53.7	0	0	0	0	110.2	N63 I77 M200 D201 E202 S241	N63-T191 WeakPolarHBondContact ND2-CG2 3.45Å; N63-T191 PolarHBondContact ND2-OG1 3.33Å; I77-T191 HydrophobicContact CD1-CG2 4.35Å; T191-M200 HydrophobicContact CG2-CB 4.39Å; T191-M200 HydrophobicContact CG2-SD 4.47Å; T191-D201 CarbonylContact C-O 3.57Å; T191-D201 VanDerWaalsContact CA-O 3.31Å; T191-D201 WeakPolarHBondContact CA-O 3.33Å; T191-E202 WeakPolarHBondContact CG2-OE1 3.47Å; T191-E202 PolarHBondContact OG1-OE1 3.12Å; T191-S241 WeakPolarHBondContact O-CB 3.39Å; T191-S241 PolarHBondContact O-OG 3.03Å
192	Y	91.8	Very high	84.6	Confident	23 Å²	23	31.6 Å²	31.6	9%	0.09	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	165.9	170	64.8	-89.7	0	0	0	110.6	I77 D194 M200 D201 E203 Y236 I237	I77-Y192 VanDerWaalsContact CD1-C 3.48Å; Y192-D194 HydrophobicContact CE2-CB 4.3Å; Y192-M200 VanDerWaalsContact O-CA 3.32Å; Y192-M200 WeakPolarHBondContact O-CA 3.35Å; Y192-D201 HydrophobicContact CD1-CB 4.41Å; Y192-D201 WeakPolarHBondContact CD1-O 3.44Å; Y192-D201 HydrophobicContact CD2-CB 4.46Å; Y192-D201 HydrophobicContact CE1-CB 3.7Å; Y192-D201 HydrophobicContact CE2-CB 3.77Å; Y192-D201 PolarHBondContact N-O 2.84Å; Y192-D201 PolarHBondContact O-N 2.81Å; Y192-D201 WeakPolarHBondContact OH-CB 3.4Å; Y192-E203 HydrophobicContact CD1-CB 3.92Å; Y192-E203 HydrophobicContact CE1-CB 3.84Å; Y192-Y236 HydrophobicContact CD1-CD2 4.02Å; Y192-Y236 AromaticContact CD1-CE2 3.91Å; Y192-Y236 HydrophobicContact CD1-CE2 3.91Å; Y192-Y236 AromaticContact CD2-CD1 3.96Å; Y192-Y236 HydrophobicContact CD2-CD1 3.96Å; Y192-Y236 AromaticContact CD2-CD2 3.22Å; Y192-Y236 HydrophobicContact CD2-CD2 3.22Å; Y192-Y236 HydrophobicContact CD2-CE1 4.04Å; Y192-Y236 AromaticContact CD2-CE2 3.26Å; Y192-Y236 HydrophobicContact CD2-CE2 3.26Å; Y192-Y236 AromaticContact CD2-CG 3.6Å; Y192-Y236 HydrophobicContact CD2-CG 3.6Å; Y192-Y236 AromaticContact CD2-CZ 3.7Å; Y192-Y236 HydrophobicContact CE1-CD2 4.38Å; Y192-Y236 AromaticContact CE1-CE2 3.81Å; Y192-Y236 HydrophobicContact CE1-CE2 3.81Å; Y192-Y236 HydrophobicContact CE2-CD1 4.2Å; Y192-Y236 AromaticContact CE2-CD2 3.65Å; Y192-Y236 HydrophobicContact CE2-CD2 3.65Å; Y192-Y236 AromaticContact CE2-CE1 3.78Å; Y192-Y236 HydrophobicContact CE2-CE1 3.78Å; Y192-Y236 AromaticContact CE2-CE2 3.11Å; Y192-Y236 HydrophobicContact CE2-CE2 3.11Å; Y192-Y236 HydrophobicContact CE2-CG 4.17Å; Y192-Y236 AromaticContact CE2-CZ 3.21Å; Y192-Y236 AromaticContact CG-CD2 3.41Å; Y192-Y236 HydrophobicContact CG-CD2 3.41Å; Y192-Y236 VanDerWaalsContact CG-CD2 3.41Å; Y192-Y236 AromaticContact CG-CE2 3.65Å; Y192-Y236 HydrophobicContact CG-CE2 3.65Å; Y192-Y236 HydrophobicContact CG-CG 4.09Å; Y192-Y236 AromaticContact CZ-CE2 3.39Å; Y192-Y236 AromaticContact CZ-CZ 3.67Å; Y192-Y236 PolarHBondContact OH-OH 2.92Å; Y192-I237 WeakPolarHBondContact CA-O 3.43Å
193	Y	92.2	Very high	84.5	Confident	11 Å²	11	34 Å²	34	4%	0.043	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	119.7	170	167.2	-90.2	0	0	0	109.1	T74 F124 K195 H198 R199 M200 Y236 I237	T74-Y193 HydrophobicContact CG2-CD1 3.99Å; T74-Y193 HydrophobicContact CG2-CE1 4.36Å; T74-Y193 HydrophobicContact CG2-CG 4.17Å; F124-Y193 HydrophobicContact CB-CE2 4.42Å; F124-Y193 WeakPolarHBondContact O-CE2 3.16Å; F124-Y193 PolarHBondContact O-OH 3.06Å; F124-Y193 VanDerWaalsContact O-OH 3.08Å; Y193-K195 HydrophobicContact CE1-CG 4.31Å; Y193-H198 PolarHBondContact OH-ND1 3.26Å; Y193-R199 CarbonylContact C-O 3.51Å; Y193-R199 WeakPolarHBondContact CA-O 3.31Å; Y193-M200 HydrophobicContact CD2-CG 4.09Å; Y193-Y236 CarbonylContact O-C 3.58Å; Y193-Y236 WeakPolarHBondContact O-CA 3.22Å; Y193-I237 HydrophobicContact CD1-CB 4.3Å; Y193-I237 HydrophobicContact CD1-CD1 3.92Å; Y193-I237 HydrophobicContact CD1-CG1 4.19Å; Y193-I237 HydrophobicContact CE1-CD1 4.33Å; Y193-I237 PolarHBondContact N-O 2.86Å; Y193-I237 PolarHBondContact O-N 3.28Å
194	D	89.9	Confident	84.3	Confident	11 Å²	11	35.7 Å²	35.7	6%	0.059	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	118.2	175.9	-170.2	-46.5	0	0	0	110	Y192 R196 D197 H198 R199 Y236	Y192-D194 HydrophobicContact CE2-CB 4.3Å; D194-R196 VanDerWaalsContact C-N 3.33Å; D194-R196 PolarHBondContact O-N 2.82Å; D194-R196 WeakPolarHBondContact OD1-CA 3.36Å; D194-R196 VanDerWaalsContact OD1-CB 3.3Å; D194-R196 WeakPolarHBondContact OD1-CB 3.42Å; D194-R196 PolarHBondContact OD1-N 2.02Å; D194-D197 HydrophobicContact CB-CB 4.39Å; D194-D197 PolarHBondContact OD1-N 2.9Å; D194-H198 WeakPolarHBondContact O-CA 3.04Å; D194-H198 PolarHBondContact O-N 2.67Å; D194-R199 PolarHBondContact N-O 2.7Å; D194-Y236 HydrophobicContact CB-CD1 4.34Å; D194-Y236 HydrophobicContact CB-CE1 4.12Å; D194-Y236 VanDerWaalsContact OD2-CE1 3.25Å; D194-Y236 WeakPolarHBondContact OD2-CE1 3.31Å
195	K	87.1	Confident	84.8	Confident	71 Å²	71	35.1 Å²	35.1	31%	0.309	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-33.2	177.6	-69.7	164.5	-153.4	164.2	0	113.2	Y193 H198 K234 E235 I237	Y193-K195 HydrophobicContact CE1-CG 4.31Å; K195-H198 PolarHBondContact O-CE1 2.86Å; K195-H198 VanDerWaalsContact O-CE1 3.22Å; K195-H198 PolarHBondContact O-ND1 3Å; K195-K234 PolarHBondContact NZ-O 3.14Å; K195-E235 VanDerWaalsContact CB-O 3.31Å; K195-E235 WeakPolarHBondContact CB-O 3.41Å; K195-E235 WeakPolarHBondContact CD-O 3.14Å; K195-E235 VanDerWaalsContact CE-O 3.29Å; K195-E235 WeakPolarHBondContact CE-O 3.34Å; K195-E235 WeakPolarHBondContact CG-O 3.44Å; K195-E235 PolarHBondContact N-O 3.37Å; K195-E235 VanDerWaalsContact N-O 3.09Å; K195-I237 HydrophobicContact CG-CD1 4.36Å; K195-I237 HydrophobicContact CG-CG1 4.31Å
196	R	85.6	Confident	84.8	Confident	138 Å²	138	34 Å²	34	52%	0.521	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77	-50.2	-177.7	-61.1	-175.4	175.4	-179.1	3.9	111.2	D194 E235	D194-R196 VanDerWaalsContact C-N 3.33Å; D194-R196 PolarHBondContact O-N 2.82Å; D194-R196 WeakPolarHBondContact OD1-CA 3.36Å; D194-R196 VanDerWaalsContact OD1-CB 3.3Å; D194-R196 WeakPolarHBondContact OD1-CB 3.42Å; D194-R196 PolarHBondContact OD1-N 2.02Å; R196-E235 HydrophobicContact CG-CB 4.4Å; R196-E235 HydrophobicContact CG-CG 4.07Å; R196-E235 IonicContact CZ-OE1 3.51Å; R196-E235 VanDerWaalsContact NE-CD 3.27Å; R196-E235 IonicContact NE-OE1 2.7Å; R196-E235 PolarHBondContact NE-OE1 3.17Å; R196-E235 IonicContact NH2-OE1 3.24Å; R196-E235 PolarHBondContact NH2-OE1 2.84Å
197	D	85.1	Confident	84.7	Confident	71 Å²	71	34.6 Å²	34.6	38%	0.38	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-7.1	-177.3	-72.6	-11.2	0	0	0	114	D194 R199 R810	D194-D197 HydrophobicContact CB-CB 4.39Å; D194-D197 PolarHBondContact OD1-N 2.9Å; D197-R199 HydrophobicContact CB-CB 4.41Å; D197-R199 PolarHBondContact O-N 3Å; D197-R810 IonicContact OD1-CZ 2.72Å; D197-R810 VanDerWaalsContact OD1-CZ 3.29Å; D197-R810 IonicContact OD1-NH1 3.18Å; D197-R810 PolarHBondContact OD1-NH1 2.84Å; D197-R810 IonicContact OD1-NH2 2.91Å; D197-R810 PolarHBondContact OD1-NH2 3.5Å; D197-R810 IonicContact OD2-CZ 2.93Å; D197-R810 IonicContact OD2-NH1 3.37Å; D197-R810 PolarHBondContact OD2-NH1 2.98Å; D197-R810 IonicContact OD2-NH2 3.65Å
198	H	87.6	Confident	84	Confident	71 Å²	71	34.9 Å²	34.9	33%	0.329	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.3	34.1	-179.7	-64.1	-16.9	0	0	0	112.5	R123 F124 S125 Y193 D194 K195	R123-H198 CarbonylContact C-O 3.55Å; R123-H198 VanDerWaalsContact CA-O 3.27Å; R123-H198 WeakPolarHBondContact CA-O 3.47Å; F124-H198 PolarHBondContact N-O 3.05Å; F124-H198 WeakPolarHBondContact O-CB 3.27Å; S125-H198 WeakPolarHBondContact CB-CD2 3.48Å; S125-H198 PolarHBondContact OG-CD2 3.45Å; S125-H198 PolarHBondContact OG-NE2 3.08Å; Y193-H198 PolarHBondContact OH-ND1 3.26Å; D194-H198 WeakPolarHBondContact O-CA 3.04Å; D194-H198 PolarHBondContact O-N 2.67Å; K195-H198 PolarHBondContact O-CE1 2.86Å; K195-H198 VanDerWaalsContact O-CE1 3.22Å; K195-H198 PolarHBondContact O-ND1 3Å
199	R	87.7	Confident	82.8	Confident	68 Å²	68	39.6 Å²	39.6	26%	0.257	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	149.3	-173.4	-165	171.4	65	149.7	4.7	111.2	P122 R123 Y193 D194 D197 D201	P122-R199 CarbonylContact O-C 3.56Å; P122-R199 VanDerWaalsContact O-CA 3.24Å; P122-R199 WeakPolarHBondContact O-CA 3.2Å; P122-R199 VanDerWaalsContact O-CG 3.24Å; P122-R199 WeakPolarHBondContact O-CG 3.4Å; R123-R199 HydrophobicContact CG-CG 4.2Å; Y193-R199 CarbonylContact C-O 3.51Å; Y193-R199 WeakPolarHBondContact CA-O 3.31Å; D194-R199 PolarHBondContact N-O 2.7Å; D197-R199 HydrophobicContact CB-CB 4.41Å; D197-R199 PolarHBondContact O-N 3Å; R199-D201 IonicContact CZ-OD1 2.69Å; R199-D201 IonicContact CZ-OD2 2.85Å; R199-D201 IonicContact NE-OD1 2.89Å; R199-D201 PolarHBondContact NE-OD1 2.69Å; R199-D201 IonicContact NE-OD2 3.73Å; R199-D201 PolarHBondContact NE-OD2 3.14Å; R199-D201 IonicContact NH1-OD1 3.71Å; R199-D201 PolarHBondContact NH1-OD1 2.93Å; R199-D201 IonicContact NH2-OD1 3.23Å; R199-D201 PolarHBondContact NH2-OD1 2.96Å; R199-D201 IonicContact NH2-OD2 2.79Å; R199-D201 PolarHBondContact NH2-OD2 3.05Å
200	M	87.6	Confident	81.7	Confident	2 Å²	2	45.7 Å²	45.7	1%	0.01	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	135.4	162.7	-77.7	-163.5	157.7	0	0	110.2	M59 I65 I77 P122 T191 Y192 Y193	M59-M200 HydrophobicContact CB-CB 4.41Å; M59-M200 HydrophobicContact CE-CB 4.47Å; M59-M200 HydrophobicContact CE-SD 3.65Å; I65-M200 HydrophobicContact CB-CE 4.03Å; I65-M200 HydrophobicContact CD1-CE 3.93Å; I65-M200 HydrophobicContact CD1-CG 4.39Å; I65-M200 HydrophobicContact CD1-SD 3.93Å; I65-M200 HydrophobicContact CG1-CE 3.52Å; I65-M200 HydrophobicContact CG1-SD 3.74Å; I65-M200 HydrophobicContact CG2-CE 3.95Å; I77-M200 HydrophobicContact CB-CE 4.34Å; I77-M200 HydrophobicContact CD1-CE 3.62Å; I77-M200 HydrophobicContact CG1-CE 3.58Å; I77-M200 HydrophobicContact CG2-CE 4.16Å; P122-M200 PolarHBondContact O-N 3.1Å; T191-M200 HydrophobicContact CG2-CB 4.39Å; T191-M200 HydrophobicContact CG2-SD 4.47Å; Y192-M200 VanDerWaalsContact O-CA 3.32Å; Y192-M200 WeakPolarHBondContact O-CA 3.35Å; Y193-M200 HydrophobicContact CD2-CG 4.09Å
201	D	84.8	Confident	80.8	Confident	13 Å²	13	47 Å²	47	7%	0.07	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	158.2	-174.2	-73.3	-59.3	0	0	0	110.7	T191 Y192 R199	T191-D201 CarbonylContact C-O 3.57Å; T191-D201 VanDerWaalsContact CA-O 3.31Å; T191-D201 WeakPolarHBondContact CA-O 3.33Å; Y192-D201 HydrophobicContact CD1-CB 4.41Å; Y192-D201 WeakPolarHBondContact CD1-O 3.44Å; Y192-D201 HydrophobicContact CD2-CB 4.46Å; Y192-D201 HydrophobicContact CE1-CB 3.7Å; Y192-D201 HydrophobicContact CE2-CB 3.77Å; Y192-D201 PolarHBondContact N-O 2.84Å; Y192-D201 PolarHBondContact O-N 2.81Å; Y192-D201 WeakPolarHBondContact OH-CB 3.4Å; R199-D201 IonicContact CZ-OD1 2.69Å; R199-D201 IonicContact CZ-OD2 2.85Å; R199-D201 IonicContact NE-OD1 2.89Å; R199-D201 PolarHBondContact NE-OD1 2.69Å; R199-D201 IonicContact NE-OD2 3.73Å; R199-D201 PolarHBondContact NE-OD2 3.14Å; R199-D201 IonicContact NH1-OD1 3.71Å; R199-D201 PolarHBondContact NH1-OD1 2.93Å; R199-D201 IonicContact NH2-OD1 3.23Å; R199-D201 PolarHBondContact NH2-OD1 2.96Å; R199-D201 IonicContact NH2-OD2 2.79Å; R199-D201 PolarHBondContact NH2-OD2 3.05Å
202	E	87.6	Confident	80.3	Confident	35 Å²	35	50.6 Å²	50.6	16%	0.164	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	127.3	-180	-81.9	57.6	-140.6	0	0	111.4	V51 F60 N63 T191	V51-E202 HydrophobicContact CG1-CB 3.81Å; V51-E202 HydrophobicContact CG1-CG 3.97Å; F60-E202 HydrophobicContact CD2-CG 3.44Å; F60-E202 VanDerWaalsContact CD2-CG 3.44Å; F60-E202 WeakPolarHBondContact CD2-OE1 3.29Å; F60-E202 HydrophobicContact CE2-CG 3.4Å; F60-E202 HydrophobicContact CG-CG 4.27Å; F60-E202 HydrophobicContact CZ-CG 4.19Å; N63-E202 PolarHBondContact ND2-OE1 2.82Å; T191-E202 WeakPolarHBondContact CG2-OE1 3.47Å; T191-E202 PolarHBondContact OG1-OE1 3.12Å
203	E	81.1	Confident	79.5	Confident	52 Å²	52	50.7 Å²	50.7	24%	0.243	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	131.4	172.1	179.1	151.9	-158.2	0	0	110.5	Y189 V190 Y192 K233	Y189-E203 CarbonylContact C-O 3.55Å; Y189-E203 WeakPolarHBondContact CA-O 3.4Å; V190-E203 HydrophobicContact CG1-CB 4.35Å; V190-E203 PolarHBondContact N-O 3.13Å; V190-E203 PolarHBondContact O-N 3.41Å; Y192-E203 HydrophobicContact CD1-CB 3.92Å; Y192-E203 HydrophobicContact CE1-CB 3.84Å; E203-K233 WeakPolarHBondContact OE1-CE 3.35Å; E203-K233 IonicContact OE1-NZ 3.33Å; E203-K233 PolarHBondContact OE1-NZ 3.22Å; E203-K233 IonicContact OE2-NZ 2.74Å; E203-K233 PolarHBondContact OE2-NZ 3.09Å
204	I	77.2	Confident	78.3	Confident	75 Å²	75	52.3 Å²	52.3	39%	0.385	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	133.8	173.6	-169.1	173	0	0	0	109.9	C188 Y189	C188-I204 WeakPolarHBondContact O-CA 3.44Å; C188-I204 WeakPolarHBondContact O-CG1 3.43Å; Y189-I204 HydrophobicContact CD1-CB 3.99Å; Y189-I204 HydrophobicContact CD1-CG1 4.43Å; Y189-I204 HydrophobicContact CE1-CB 3.85Å; Y189-I204 HydrophobicContact CE1-CD1 4.47Å; Y189-I204 HydrophobicContact CE1-CG1 4.13Å
205	V	75.6	Confident	76.7	Confident	2 Å²	2	54.8 Å²	54.8	1%	0.012	26%	0.26	C	S	.	.			trans	-121	126.3	-176.1	-64.2	0	0	0	0	111.3	C188 V190 T228 E230 M243	C188-V205 HydrophobicContact CB-CG2 3.85Å; C188-V205 PolarHBondContact O-N 3.48Å; V190-V205 HydrophobicContact CB-CG1 4.1Å; V190-V205 HydrophobicContact CG1-CG1 3.45Å; V190-V205 VanDerWaalsContact CG1-CG1 3.45Å; V205-T228 HydrophobicContact CB-CG2 3.93Å; V205-T228 HydrophobicContact CG2-CG2 3.88Å; V205-E230 HydrophobicContact CB-CG 4.47Å; V205-E230 HydrophobicContact CG1-CG 3.84Å; V205-E230 WeakPolarHBondContact CG1-OE1 3.38Å; V205-M243 HydrophobicContact CG2-CG 4.24Å; V205-M243 HydrophobicContact CG2-SD 4.47Å
206	M	66.1	Low	74.5	Confident	25 Å²	25	53.4 Å²	53.4	12%	0.123	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	126.4	178.8	-61	-140.2	-50	0	0	111.2	T228 M229 V740 E804	M206-T228 CarbonylContact O-C 3.49Å; M206-T228 VanDerWaalsContact O-CA 3.28Å; M206-T228 WeakPolarHBondContact O-CA 3.46Å; M206-M229 HydrophobicContact CB-CB 4.22Å; M206-M229 HydrophobicContact CB-CG 4.26Å; M206-M229 PolarHBondContact O-N 3.03Å; M206-V740 HydrophobicContact CE-CG1 4.07Å; M206-V740 HydrophobicContact SD-CG1 3.54Å; M206-V740 VanDerWaalsContact SD-CG1 3.54Å; M206-E804 HydrophobicContact CE-CG 4.08Å; M206-E804 WeakPolarHBondContact CE-OE1 3.45Å; M206-E804 WeakPolarHBondContact CE-OE2 3.37Å; M206-E804 WeakPolarHBondContact CG-OE1 3.33Å; M206-E804 HydrophobicContact SD-CG 4.44Å
207	I	71.9	Confident	72.2	Confident	16 Å²	16	53.4 Å²	53.4	8%	0.082	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	126.2	176.8	-56	-57.8	0	0	0	109.6	P182 C188 P211 T228 M243	P182-I207 HydrophobicContact CB-CD1 3.83Å; P182-I207 HydrophobicContact CB-CG1 3.87Å; P182-I207 HydrophobicContact CG-CD1 3.86Å; P182-I207 HydrophobicContact CG-CG1 4.44Å; C188-I207 HydrophobicContact CB-CD1 4.11Å; C188-I207 HydrophobicContact CB-CG1 4.48Å; I207-P211 HydrophobicContact CG2-CB 3.73Å; I207-P211 HydrophobicContact CG2-CG 4.41Å; I207-T228 HydrophobicContact CD1-CG2 4.24Å; I207-M243 HydrophobicContact CD1-SD 4.15Å
208	T	64.4	Low	69.9	Low	22 Å²	22	54 Å²	54	14%	0.135	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	154.5	-179.2	55.9	0	0	0	0	112.4	K210 P211 C227 M229 L273	T208-K210 CarbonylContact O-C 3.49Å; T208-K210 PolarHBondContact O-N 2.64Å; T208-K210 PolarHBondContact OG1-O 2.95Å; T208-P211 WeakPolarHBondContact O-CD 3.31Å; T208-C227 WeakPolarHBondContact CB-O 3.33Å; T208-C227 HydrophobicContact CG2-CB 4.22Å; T208-C227 VanDerWaalsContact CG2-O 3.3Å; T208-C227 WeakPolarHBondContact CG2-O 3.27Å; T208-C227 PolarHBondContact N-O 3.17Å; T208-C227 PolarHBondContact OG1-O 2.81Å; T208-M229 HydrophobicContact CG2-CG 4.07Å; T208-M229 HydrophobicContact CG2-SD 3.86Å; T208-L273 HydrophobicContact CG2-CD2 4.03Å
209	R	61	Low	68	Low	101 Å²	101	61 Å²	61	38%	0.381	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-48.5	-27.8	-179.2	-49.4	-158.4	-172.5	165	-2.1	114.4	S678 P679 F680 E682	R209-S678 PolarHBondContact NH2-OG 3.16Å; R209-P679 PolarHBondContact NE-O 3.16Å; R209-P679 PolarHBondContact NH2-O 3.18Å; R209-F680 VanDerWaalsContact CG-O 3.29Å; R209-F680 WeakPolarHBondContact CG-O 3.37Å; R209-E682 IonicContact CZ-OE1 2.71Å; R209-E682 IonicContact NH1-OE1 2.71Å; R209-E682 PolarHBondContact NH1-OE1 3.07Å
210	K	68.1	Low	66	Low	150 Å²	150	62.1 Å²	62.1	65%	0.652	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128	90.7	172.9	-68.6	-179.6	-174.6	175.5	0	106.8	T208 R212	T208-K210 CarbonylContact O-C 3.49Å; T208-K210 PolarHBondContact O-N 2.64Å; T208-K210 PolarHBondContact OG1-O 2.95Å; K210-R212 CarbonylContact O-C 3.53Å; K210-R212 PolarHBondContact O-N 3.42Å; K210-R212 VanDerWaalsContact O-N 3.13Å
211	P	71.7	Confident	64	Low	28 Å²	28	65.5 Å²	65.5	18%	0.182	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.6	-40.5	-171.4	14.5	-29	0	0	0	112.1	V181 I207 T208 C213 V226 C227	V181-P211 HydrophobicContact CB-CB 4.28Å; V181-P211 HydrophobicContact CB-CG 4.01Å; V181-P211 HydrophobicContact CG1-CB 4.49Å; V181-P211 HydrophobicContact CG1-CG 4.27Å; V181-P211 HydrophobicContact CG2-CG 3.98Å; I207-P211 HydrophobicContact CG2-CB 3.73Å; I207-P211 HydrophobicContact CG2-CG 4.41Å; T208-P211 WeakPolarHBondContact O-CD 3.31Å; P211-C213 PolarHBondContact O-N 3.02Å; P211-V226 HydrophobicContact CB-CG1 4.12Å; P211-V226 CarbonylContact O-C 3.5Å; P211-V226 VanDerWaalsContact O-CA 3.26Å; P211-V226 WeakPolarHBondContact O-CA 3.2Å; P211-C227 PolarHBondContact O-N 3.49Å
212	R	82.5	Confident	62.6	Low	78 Å²	78	71.2 Å²	71.2	29%	0.294	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	108.9	171.7	-76.8	176.4	164.9	128	10.3	111.1	D179 V181 K210 G225 E278	D179-R212 PolarHBondContact O-NH1 3.06Å; D179-R212 PolarHBondContact O-NH2 3.13Å; V181-R212 HydrophobicContact CG1-CG 4.06Å; K210-R212 CarbonylContact O-C 3.53Å; K210-R212 PolarHBondContact O-N 3.42Å; K210-R212 VanDerWaalsContact O-N 3.13Å; R212-G225 WeakPolarHBondContact CA-O 3.36Å; R212-E278 IonicContact CZ-OE1 3.56Å; R212-E278 IonicContact NE-OE1 2.84Å; R212-E278 PolarHBondContact NE-OE1 3.23Å; R212-E278 IonicContact NH2-OE1 2.91Å; R212-E278 PolarHBondContact NH2-OE1 3.46Å; R212-E278 IonicContact NH2-OE2 3.41Å
213	C	75.3	Confident	61.1	Low	24 Å²	24	70.5 Å²	70.5	16%	0.162	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	175	171.8	63.8	0	0	0	0	111.7	P211 A215 G225 C227	P211-C213 PolarHBondContact O-N 3.02Å; C213-A215 PolarHBondContact O-N 3.32Å; C213-G225 PolarHBondContact N-O 2.87Å; C213-C227 HydrophobicContact CB-CB 3.57Å; C213-C227 WeakPolarHBondContact CB-SG 3.43Å; C213-C227 WeakPolarHBondContact SG-CB 3.29Å; C213-C227 PolarHBondContact SG-N 2.05Å; C213-C227 CovalentContact SG-SG 2.02Å; C213-C227 PolarHBondContact SG-SG 3.09Å
214	L	67.4	Low	60.6	Low	45 Å²	45	72.4 Å²	72.4	24%	0.236	39%	0.385	C	S	.	.			trans	56.5	18.5	180	-73.8	169.7	0	0	0	116.1	W146 A216 Y223 L261 F275 L397	W146-L214 HydrophobicContact CH2-CD1 3.46Å; W146-L214 VanDerWaalsContact CH2-CD1 3.46Å; W146-L214 HydrophobicContact CH2-CD2 4.49Å; W146-L214 HydrophobicContact CZ2-CD1 4.27Å; W146-L214 HydrophobicContact CZ3-CD1 3.85Å; L214-A216 PolarHBondContact O-N 3.47Å; L214-A216 VanDerWaalsContact O-N 3.07Å; L214-Y223 HydrophobicContact CB-CD1 3.64Å; L214-Y223 HydrophobicContact CB-CE1 3.87Å; L214-Y223 HydrophobicContact CD1-CD1 4.5Å; L214-Y223 HydrophobicContact CD1-CE1 3.92Å; L214-L261 HydrophobicContact CD1-CD1 3.81Å; L214-L261 HydrophobicContact CD1-CD2 4.3Å; L214-L261 HydrophobicContact CG-CD1 4.32Å; L214-F275 HydrophobicContact CD1-CD2 4.02Å; L214-F275 HydrophobicContact CD1-CE2 3.81Å; L214-F275 HydrophobicContact CD1-CZ 4.28Å; L214-L397 HydrophobicContact CD2-CD1 3.56Å; L214-L397 HydrophobicContact CD2-CD2 3.69Å; L214-L397 HydrophobicContact CD2-CG 4.28Å; L214-L397 HydrophobicContact CG-CD1 4.16Å
215	A	55.1	Low	60.9	Low	64 Å²	64	68.9 Å²	68.9	53%	0.529	37%	0.367	S	S	.	.			trans	-60.5	111.3	168.3	0	0	0	0	0	110.2	C213	C213-A215 PolarHBondContact O-N 3.32Å
216	A	41.5	Very low	61.5	Low	42 Å²	42	68.9 Å²	68.9	35%	0.347	37%	0.367	S	S	.	.			trans	-62.6	140.6	178.4	0	0	0	0	0	111	L214 S218	L214-A216 PolarHBondContact O-N 3.47Å; L214-A216 VanDerWaalsContact O-N 3.07Å; A216-S218 PolarHBondContact O-N 2.78Å
217	S	36.7	Very low	62.3	Low	138 Å²	138	67.7 Å²	67.7	97%	0.965	36%	0.361	S	S	*	.	S	Bend	trans	-71.8	17	-178.5	-46.5	0	0	0	0	114.9
218	S	37.8	Very low	62.7	Low	82 Å²	82	67 Å²	67	57%	0.573	36%	0.357	S	S	*	.	S	Bend	trans	-85.2	153.5	174.8	-65.3	0	0	0	0	110.5	A216 V220	A216-S218 PolarHBondContact O-N 2.78Å; S218-V220 PolarHBondContact O-N 2.74Å
219	K	46.8	Very low	62.9	Low	220 Å²	220	68.3 Å²	68.3	96%	0.957	36%	0.363	S	S	*	.	S	Bend	trans	-62.3	-7.6	176.6	-68.2	-173.8	177.3	-177.3	0	114.7
220	V	46.6	Very low	63.4	Low	90 Å²	90	64.3 Å²	64.3	55%	0.545	35%	0.348	S	S	.	.	S	Bend	trans	-116.4	115.4	171.5	-175	0	0	0	0	107.9	S218 Q222	S218-V220 PolarHBondContact O-N 2.74Å; V220-Q222 VanDerWaalsContact C-N 3.25Å; V220-Q222 HydrophobicContact CB-CG 4.33Å; V220-Q222 HydrophobicContact CG1-CG 3.83Å; V220-Q222 PolarHBondContact O-N 2.8Å
221	P	44.9	Very low	63.3	Low	74 Å²	74	62.4 Å²	62.4	48%	0.481	34%	0.342	S	S	.	.			trans	-77.2	76.2	178.6	32.2	-34.8	0	0	0	110.1	Y223	P221-Y223 PolarHBondContact O-N 3.22Å; P221-Y223 VanDerWaalsContact O-N 3.14Å
222	Q	55.7	Low	63.1	Low	132 Å²	132	65.3 Å²	65.3	62%	0.617	35%	0.352	S	S	*	.			trans	-67.8	-6.9	-177.7	-72.8	-173.4	-26.5	0	0	114.5	V220	V220-Q222 VanDerWaalsContact C-N 3.25Å; V220-Q222 HydrophobicContact CB-CG 4.33Å; V220-Q222 HydrophobicContact CG1-CG 3.83Å; V220-Q222 PolarHBondContact O-N 2.8Å
223	Y	56.1	Low	62.6	Low	20 Å²	20	63.5 Å²	63.5	8%	0.078	35%	0.346	C	S	.	.			trans	-140.1	142.5	175.3	-163.8	-123.1	0	0	0	113.1	L144 A145 W146 L214 P221 F275	L144-Y223 HydrophobicContact CB-CE2 4.01Å; L144-Y223 HydrophobicContact CD1-CE2 4.05Å; L144-Y223 HydrophobicContact CD2-CE2 4.14Å; L144-Y223 HydrophobicContact CG-CE2 4.28Å; A145-Y223 WeakPolarHBondContact O-CD2 3.36Å; W146-Y223 AromaticContact CE3-CE1 3.88Å; W146-Y223 HydrophobicContact CE3-CE1 3.88Å; W146-Y223 HydrophobicContact CE3-CE2 4.5Å; W146-Y223 AromaticContact CE3-CZ 3.78Å; W146-Y223 AromaticContact CZ3-CE1 3.75Å; W146-Y223 HydrophobicContact CZ3-CE1 3.75Å; W146-Y223 AromaticContact CZ3-CZ 3.85Å; W146-Y223 WeakPolarHBondContact CZ3-OH 3.24Å; L214-Y223 HydrophobicContact CB-CD1 3.64Å; L214-Y223 HydrophobicContact CB-CE1 3.87Å; L214-Y223 HydrophobicContact CD1-CD1 4.5Å; L214-Y223 HydrophobicContact CD1-CE1 3.92Å; P221-Y223 PolarHBondContact O-N 3.22Å; P221-Y223 VanDerWaalsContact O-N 3.14Å; Y223-F275 HydrophobicContact CE1-CE1 4.32Å; Y223-F275 HydrophobicContact CE1-CE2 4.1Å; Y223-F275 AromaticContact CE1-CZ 3.51Å; Y223-F275 HydrophobicContact CE1-CZ 3.51Å; Y223-F275 AromaticContact CZ-CZ 3.55Å; Y223-F275 WeakPolarHBondContact OH-CE1 3.29Å; Y223-F275 WeakPolarHBondContact OH-CZ 3.44Å
224	R	70.8	Confident	62.3	Low	93 Å²	93	70.1 Å²	70.1	35%	0.351	37%	0.372	S	S	.	.			trans	-144.3	130.6	171.1	-62	176.3	178.5	178.2	2.6	108	D179 E278	D179-R224 IonicContact OD1-CZ 2.93Å; D179-R224 IonicContact OD1-NH1 3.77Å; D179-R224 PolarHBondContact OD1-NH1 2.89Å; R224-E278 VanDerWaalsContact CB-CD 3.44Å; R224-E278 HydrophobicContact CB-CG 4.22Å; R224-E278 WeakPolarHBondContact CB-OE2 3.39Å
225	G	83.1	Confident	62.9	Low	0 Å²	0	70.8 Å²	70.8	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	161.7	164.2	0	0	0	0	0	109	R212 C213 Y276	R212-G225 WeakPolarHBondContact CA-O 3.36Å; C213-G225 PolarHBondContact N-O 2.87Å; G225-Y276 CarbonylContact C-O 3.59Å; G225-Y276 WeakPolarHBondContact CA-O 3.26Å
226	V	87.4	Confident	64.5	Low	2 Å²	2	70.2 Å²	70.2	1%	0.012	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	135.2	179.7	-170.1	0	0	0	0	109.5	P211 M243 Y276 E278	P211-V226 HydrophobicContact CB-CG1 4.12Å; P211-V226 CarbonylContact O-C 3.5Å; P211-V226 VanDerWaalsContact O-CA 3.26Å; P211-V226 WeakPolarHBondContact O-CA 3.2Å; V226-M243 HydrophobicContact CB-CE 4.18Å; V226-M243 HydrophobicContact CG1-CE 3.94Å; V226-M243 HydrophobicContact CG1-SD 4.47Å; V226-M243 HydrophobicContact CG2-CE 4.43Å; V226-Y276 PolarHBondContact N-O 3.25Å; V226-Y276 PolarHBondContact O-N 3Å; V226-E278 HydrophobicContact CG2-CG 4.37Å
227	C	84.6	Confident	66.8	Low	1 Å²	1	69.4 Å²	69.4	1%	0.007	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	134.3	169.9	-78.5	0	0	0	0	112	T208 P211 C213 L273 G274	T208-C227 WeakPolarHBondContact CB-O 3.33Å; T208-C227 HydrophobicContact CG2-CB 4.22Å; T208-C227 VanDerWaalsContact CG2-O 3.3Å; T208-C227 WeakPolarHBondContact CG2-O 3.27Å; T208-C227 PolarHBondContact N-O 3.17Å; T208-C227 PolarHBondContact OG1-O 2.81Å; P211-C227 PolarHBondContact O-N 3.49Å; C213-C227 HydrophobicContact CB-CB 3.57Å; C213-C227 WeakPolarHBondContact CB-SG 3.43Å; C213-C227 WeakPolarHBondContact SG-CB 3.29Å; C213-C227 PolarHBondContact SG-N 2.05Å; C213-C227 CovalentContact SG-SG 2.02Å; C213-C227 PolarHBondContact SG-SG 3.09Å; C227-L273 HydrophobicContact CB-CB 4.48Å; C227-L273 HydrophobicContact CB-CD1 4.48Å; C227-G274 WeakPolarHBondContact CA-O 3.32Å
228	T	80.3	Confident	69.5	Low	0 Å²	0	64.3 Å²	64.3	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	166.3	171.5	55.3	0	0	0	0	110.3	V205 M206 I207 E230 M243 L273 G274 Y276	V205-T228 HydrophobicContact CB-CG2 3.93Å; V205-T228 HydrophobicContact CG2-CG2 3.88Å; M206-T228 CarbonylContact O-C 3.49Å; M206-T228 VanDerWaalsContact O-CA 3.28Å; M206-T228 WeakPolarHBondContact O-CA 3.46Å; I207-T228 HydrophobicContact CD1-CG2 4.24Å; T228-E230 WeakPolarHBondContact CB-OE1 3.39Å; T228-E230 WeakPolarHBondContact OG1-CG 3.33Å; T228-E230 PolarHBondContact OG1-OE1 3.03Å; T228-M243 HydrophobicContact CG2-SD 3.73Å; T228-L273 WeakPolarHBondContact O-CA 3.48Å; T228-L273 WeakPolarHBondContact O-CB 3.38Å; T228-L273 VanDerWaalsContact O-CD2 3.26Å; T228-L273 WeakPolarHBondContact O-CD2 3.43Å; T228-G274 PolarHBondContact N-O 3.07Å; T228-G274 VanDerWaalsContact N-O 3.12Å; T228-G274 PolarHBondContact O-N 3Å; T228-G274 VanDerWaalsContact OG1-CA 3.29Å; T228-G274 WeakPolarHBondContact OG1-CA 3.37Å; T228-G274 PolarHBondContact OG1-N 2.85Å; T228-G274 PolarHBondContact OG1-O 2.86Å; T228-Y276 HydrophobicContact CG2-CD2 4.15Å; T228-Y276 HydrophobicContact CG2-CE2 3.63Å; T228-Y276 WeakPolarHBondContact OG1-CE2 3.28Å
229	M	67.7	Low	72.2	Confident	50 Å²	50	62.6 Å²	62.6	25%	0.246	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	114.3	165.2	-54.1	-74	-72.9	0	0	107.7	M206 T208 Q271 L273	M206-M229 HydrophobicContact CB-CB 4.22Å; M206-M229 HydrophobicContact CB-CG 4.26Å; M206-M229 PolarHBondContact O-N 3.03Å; T208-M229 HydrophobicContact CG2-CG 4.07Å; T208-M229 HydrophobicContact CG2-SD 3.86Å; M229-Q271 HydrophobicContact CE-CG 4.49Å; M229-L273 HydrophobicContact SD-CD2 3.88Å
230	E	70.7	Confident	74.6	Confident	17 Å²	17	52.1 Å²	52.1	8%	0.079	25%	0.248	C	C	.	.			trans	-148.1	132.4	-175.9	-79.9	173	-144.3	0	0	112.7	V205 T228 Q238 Y257 Q260 N272 G274 Y276	V205-E230 HydrophobicContact CB-CG 4.47Å; V205-E230 HydrophobicContact CG1-CG 3.84Å; V205-E230 WeakPolarHBondContact CG1-OE1 3.38Å; T228-E230 WeakPolarHBondContact CB-OE1 3.39Å; T228-E230 WeakPolarHBondContact OG1-CG 3.33Å; T228-E230 PolarHBondContact OG1-OE1 3.03Å; E230-Q238 PolarHBondContact OE2-NE2 3.28Å; E230-Y257 WeakPolarHBondContact OE2-CE2 3.44Å; E230-Q260 PolarHBondContact O-NE2 3.16Å; E230-Q260 VanDerWaalsContact O-NE2 3.13Å; E230-N272 CarbonylContact O-C 3.53Å; E230-N272 VanDerWaalsContact O-CB 3.27Å; E230-N272 WeakPolarHBondContact O-CB 3.21Å; E230-G274 WeakPolarHBondContact OE2-CA 3.26Å; E230-Y276 VanDerWaalsContact OE1-CE2 3.26Å; E230-Y276 WeakPolarHBondContact OE1-CE2 3.07Å; E230-Y276 VanDerWaalsContact OE1-CZ 3.31Å; E230-Y276 PolarHBondContact OE1-OH 2.9Å
231	E	66.2	Low	77	Confident	110 Å²	110	47.9 Å²	47.9	51%	0.514	22%	0.222	S	C	.	.			trans	-84.9	159.4	178.4	-58.1	-151.5	113.1	0	0	113.1	Q260	E231-Q260 VanDerWaalsContact C-NE2 3.29Å; E231-Q260 PolarHBondContact O-NE2 3.33Å
232	K	67	Low	79.5	Confident	90 Å²	90	44.3 Å²	44.3	39%	0.391	20%	0.199	S	C	.	.			trans	-94.3	105.1	-179.7	-162.6	-179	179.7	-176	0	112.5
233	K	72.9	Confident	81.3	Confident	39 Å²	39	38 Å²	38	17%	0.17	17%	0.169	C	C	.	.			trans	-95.4	112.5	170.8	-59.8	172.1	-168.8	178.7	0	109.6	E203 E235 Y236 N807	E203-K233 WeakPolarHBondContact OE1-CE 3.35Å; E203-K233 IonicContact OE1-NZ 3.33Å; E203-K233 PolarHBondContact OE1-NZ 3.22Å; E203-K233 IonicContact OE2-NZ 2.74Å; E203-K233 PolarHBondContact OE2-NZ 3.09Å; K233-E235 PolarHBondContact O-N 3.08Å; K233-Y236 HydrophobicContact CB-CD1 4.14Å; K233-Y236 HydrophobicContact CB-CD2 3.75Å; K233-Y236 HydrophobicContact CB-CE1 4.4Å; K233-Y236 HydrophobicContact CB-CE2 4.08Å; K233-Y236 HydrophobicContact CB-CG 3.79Å; K233-Y236 HydrophobicContact CD-CD2 3.53Å; K233-Y236 HydrophobicContact CD-CE1 4.41Å; K233-Y236 HydrophobicContact CD-CE2 3.1Å; K233-Y236 HydrophobicContact CD-CG 4.36Å; K233-Y236 HydrophobicContact CG-CD2 4.26Å; K233-Y236 HydrophobicContact CG-CE2 4.2Å; K233-Y236 PolarHBondContact O-N 2.93Å; K233-N807 WeakPolarHBondContact CE-ND2 3.5Å; K233-N807 PolarHBondContact NZ-ND2 2.97Å; K233-N807 PolarHBondContact NZ-OD1 3.46Å
234	K	68.8	Low	83.2	Confident	163 Å²	163	37.1 Å²	37.1	71%	0.709	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-31.3	-173.2	-62.1	174.4	-173.1	163	0	113.5	K195	K195-K234 PolarHBondContact NZ-O 3.14Å
235	E	80.4	Confident	84.3	Confident	59 Å²	59	32.7 Å²	32.7	28%	0.276	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-7.1	-172.2	-59.4	-68.3	-170.2	0	0	113.6	K195 R196 K233	K195-E235 VanDerWaalsContact CB-O 3.31Å; K195-E235 WeakPolarHBondContact CB-O 3.41Å; K195-E235 WeakPolarHBondContact CD-O 3.14Å; K195-E235 VanDerWaalsContact CE-O 3.29Å; K195-E235 WeakPolarHBondContact CE-O 3.34Å; K195-E235 WeakPolarHBondContact CG-O 3.44Å; K195-E235 PolarHBondContact N-O 3.37Å; K195-E235 VanDerWaalsContact N-O 3.09Å; R196-E235 HydrophobicContact CG-CB 4.4Å; R196-E235 HydrophobicContact CG-CG 4.07Å; R196-E235 IonicContact CZ-OE1 3.51Å; R196-E235 VanDerWaalsContact NE-CD 3.27Å; R196-E235 IonicContact NE-OE1 2.7Å; R196-E235 PolarHBondContact NE-OE1 3.17Å; R196-E235 IonicContact NH2-OE1 3.24Å; R196-E235 PolarHBondContact NH2-OE1 2.84Å; K233-E235 PolarHBondContact O-N 3.08Å
236	Y	88.2	Confident	84.6	Confident	52 Å²	52	33.4 Å²	33.4	20%	0.204	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	144.3	-171.9	-70.3	11.2	0	0	0	110.9	Y192 Y193 D194 K233	Y192-Y236 HydrophobicContact CD1-CD2 4.02Å; Y192-Y236 AromaticContact CD1-CE2 3.91Å; Y192-Y236 HydrophobicContact CD1-CE2 3.91Å; Y192-Y236 AromaticContact CD2-CD1 3.96Å; Y192-Y236 HydrophobicContact CD2-CD1 3.96Å; Y192-Y236 AromaticContact CD2-CD2 3.22Å; Y192-Y236 HydrophobicContact CD2-CD2 3.22Å; Y192-Y236 HydrophobicContact CD2-CE1 4.04Å; Y192-Y236 AromaticContact CD2-CE2 3.26Å; Y192-Y236 HydrophobicContact CD2-CE2 3.26Å; Y192-Y236 AromaticContact CD2-CG 3.6Å; Y192-Y236 HydrophobicContact CD2-CG 3.6Å; Y192-Y236 AromaticContact CD2-CZ 3.7Å; Y192-Y236 HydrophobicContact CE1-CD2 4.38Å; Y192-Y236 AromaticContact CE1-CE2 3.81Å; Y192-Y236 HydrophobicContact CE1-CE2 3.81Å; Y192-Y236 HydrophobicContact CE2-CD1 4.2Å; Y192-Y236 AromaticContact CE2-CD2 3.65Å; Y192-Y236 HydrophobicContact CE2-CD2 3.65Å; Y192-Y236 AromaticContact CE2-CE1 3.78Å; Y192-Y236 HydrophobicContact CE2-CE1 3.78Å; Y192-Y236 AromaticContact CE2-CE2 3.11Å; Y192-Y236 HydrophobicContact CE2-CE2 3.11Å; Y192-Y236 HydrophobicContact CE2-CG 4.17Å; Y192-Y236 AromaticContact CE2-CZ 3.21Å; Y192-Y236 AromaticContact CG-CD2 3.41Å; Y192-Y236 HydrophobicContact CG-CD2 3.41Å; Y192-Y236 VanDerWaalsContact CG-CD2 3.41Å; Y192-Y236 AromaticContact CG-CE2 3.65Å; Y192-Y236 HydrophobicContact CG-CE2 3.65Å; Y192-Y236 HydrophobicContact CG-CG 4.09Å; Y192-Y236 AromaticContact CZ-CE2 3.39Å; Y192-Y236 AromaticContact CZ-CZ 3.67Å; Y192-Y236 PolarHBondContact OH-OH 2.92Å; Y193-Y236 CarbonylContact O-C 3.58Å; Y193-Y236 WeakPolarHBondContact O-CA 3.22Å; D194-Y236 HydrophobicContact CB-CD1 4.34Å; D194-Y236 HydrophobicContact CB-CE1 4.12Å; D194-Y236 VanDerWaalsContact OD2-CE1 3.25Å; D194-Y236 WeakPolarHBondContact OD2-CE1 3.31Å; K233-Y236 HydrophobicContact CB-CD1 4.14Å; K233-Y236 HydrophobicContact CB-CD2 3.75Å; K233-Y236 HydrophobicContact CB-CE1 4.4Å; K233-Y236 HydrophobicContact CB-CE2 4.08Å; K233-Y236 HydrophobicContact CB-CG 3.79Å; K233-Y236 HydrophobicContact CD-CD2 3.53Å; K233-Y236 HydrophobicContact CD-CE1 4.41Å; K233-Y236 HydrophobicContact CD-CE2 3.1Å; K233-Y236 HydrophobicContact CD-CG 4.36Å; K233-Y236 HydrophobicContact CG-CD2 4.26Å; K233-Y236 HydrophobicContact CG-CE2 4.2Å; K233-Y236 PolarHBondContact O-N 2.93Å
237	I	90.8	Very high	84.7	Confident	26 Å²	26	34.8 Å²	34.8	13%	0.133	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	115.3	164.7	-57.4	179.1	0	0	0	107	T74 I77 Y192 Y193 K195	T74-I237 HydrophobicContact CG2-CD1 3.83Å; T74-I237 HydrophobicContact CG2-CG2 4.46Å; I77-I237 WeakPolarHBondContact CD1-O 3.31Å; Y192-I237 WeakPolarHBondContact CA-O 3.43Å; Y193-I237 HydrophobicContact CD1-CB 4.3Å; Y193-I237 HydrophobicContact CD1-CD1 3.92Å; Y193-I237 HydrophobicContact CD1-CG1 4.19Å; Y193-I237 HydrophobicContact CE1-CD1 4.33Å; Y193-I237 PolarHBondContact N-O 2.86Å; Y193-I237 PolarHBondContact O-N 3.28Å; K195-I237 HydrophobicContact CG-CD1 4.36Å; K195-I237 HydrophobicContact CG-CG1 4.31Å
238	Q	92.9	Very high	84.6	Confident	31 Å²	31	41.2 Å²	41.2	15%	0.145	20%	0.195	C	C	.	.			trans	-122.8	-3.2	-178.2	-161.5	-172.7	2.7	0	0	111.5	V190 E230 G240 S241 Y257	V190-Q238 HydrophobicContact CG2-CG 3.99Å; E230-Q238 PolarHBondContact OE2-NE2 3.28Å; Q238-G240 PolarHBondContact O-N 2.89Å; Q238-S241 WeakPolarHBondContact CA-OG 3.46Å; Q238-S241 VanDerWaalsContact O-CB 3.26Å; Q238-S241 WeakPolarHBondContact O-CB 3.4Å; Q238-S241 PolarHBondContact O-N 3.14Å; Q238-S241 VanDerWaalsContact O-N 3.11Å; Q238-S241 PolarHBondContact O-OG 3.31Å; Q238-Y257 HydrophobicContact CB-CD1 4.26Å; Q238-Y257 HydrophobicContact CB-CE1 4.19Å; Q238-Y257 VanDerWaalsContact CD-CD2 3.48Å; Q238-Y257 HydrophobicContact CG-CD1 4.17Å; Q238-Y257 HydrophobicContact CG-CD2 3.92Å; Q238-Y257 HydrophobicContact CG-CE1 4.33Å; Q238-Y257 HydrophobicContact CG-CE2 4.06Å; Q238-Y257 HydrophobicContact CG-CG 3.94Å; Q238-Y257 VanDerWaalsContact NE2-CE2 3.3Å; Q238-Y257 WeakPolarHBondContact O-CB 3.3Å; Q238-Y257 WeakPolarHBondContact O-CD1 3.23Å; Q238-Y257 PolarHBondContact OE1-OH 3.07Å
239	L	95.1	Very high	84.7	Confident	46 Å²	46	43 Å²	43	24%	0.241	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	124.3	-176.4	-174.6	60.8	0	0	0	110.6	C76 I77 A99 D101 S241 L258	C76-L239 WeakPolarHBondContact CA-O 3.31Å; C76-L239 VanDerWaalsContact CB-O 3.27Å; C76-L239 WeakPolarHBondContact CB-O 3.34Å; C76-L239 VanDerWaalsContact SG-CG 3.55Å; C76-L239 PolarHBondContact SG-O 2.93Å; C76-L239 VanDerWaalsContact SG-O 3.4Å; I77-L239 PolarHBondContact N-O 2.95Å; A99-L239 HydrophobicContact CB-CD1 3.78Å; A99-L239 HydrophobicContact CB-CG 4.12Å; D101-L239 HydrophobicContact CB-CD1 4.3Å; D101-L239 HydrophobicContact CB-CD2 4.15Å; L239-S241 VanDerWaalsContact C-N 3.3Å; L239-L258 WeakPolarHBondContact CD1-O 3.39Å
240	G	96.4	Very high	85.8	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.5	-1.4	-176.3	0	0	0	0	0	115.3	I77 T98 Q238 Y257	I77-G240 CarbonylContact O-C 3.54Å; I77-G240 WeakPolarHBondContact O-CA 3.49Å; T98-G240 WeakPolarHBondContact OG1-CA 3.42Å; Q238-G240 PolarHBondContact O-N 2.89Å; G240-Y257 PolarHBondContact N-O 2.89Å
241	S	96.3	Very high	87	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.206	C	C	.	.			trans	-60.4	143.5	179.6	-65	0	0	0	0	112.9	I77 T191 Q238 L239 V256 Y257	I77-S241 WeakPolarHBondContact CB-OG 3.43Å; I77-S241 WeakPolarHBondContact CD1-OG 3.44Å; T191-S241 WeakPolarHBondContact O-CB 3.39Å; T191-S241 PolarHBondContact O-OG 3.03Å; Q238-S241 WeakPolarHBondContact CA-OG 3.46Å; Q238-S241 VanDerWaalsContact O-CB 3.26Å; Q238-S241 WeakPolarHBondContact O-CB 3.4Å; Q238-S241 PolarHBondContact O-N 3.14Å; Q238-S241 VanDerWaalsContact O-N 3.11Å; Q238-S241 PolarHBondContact O-OG 3.31Å; L239-S241 VanDerWaalsContact C-N 3.3Å; S241-V256 WeakPolarHBondContact O-CA 3.25Å; S241-Y257 PolarHBondContact O-N 2.75Å
242	P	97.2	Very high	88.4	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	140.6	172.5	33.7	-36.4	0	0	0	110.9	V244 Q253	P242-V244 HydrophobicContact CB-CG2 3.73Å; P242-V244 HydrophobicContact CG-CG2 3.95Å; P242-Q253 HydrophobicContact CB-CG 4.06Å
243	M	95.5	Very high	89.8	Confident	0 Å²	0	34 Å²	34	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	108.3	159.1	-170.9	179.7	69.9	0	0	108.1	P182 Y189 V205 I207 V226 T228 Q253 Y254 G255 Y276	P182-M243 HydrophobicContact CG-CE 3.61Å; Y189-M243 WeakPolarHBondContact O-CA 3.27Å; V205-M243 HydrophobicContact CG2-CG 4.24Å; V205-M243 HydrophobicContact CG2-SD 4.47Å; I207-M243 HydrophobicContact CD1-SD 4.15Å; V226-M243 HydrophobicContact CB-CE 4.18Å; V226-M243 HydrophobicContact CG1-CE 3.94Å; V226-M243 HydrophobicContact CG1-SD 4.47Å; V226-M243 HydrophobicContact CG2-CE 4.43Å; T228-M243 HydrophobicContact CG2-SD 3.73Å; M243-Q253 WeakPolarHBondContact O-CA 3.44Å; M243-Y254 PolarHBondContact O-N 3.26Å; M243-G255 PolarHBondContact N-O 2.89Å; M243-Y276 HydrophobicContact CB-CD1 3.62Å; M243-Y276 HydrophobicContact CB-CE1 3.55Å; M243-Y276 HydrophobicContact CB-CG 4.34Å; M243-Y276 HydrophobicContact CG-CD1 4.48Å; M243-Y276 HydrophobicContact CG-CE1 4.25Å; M243-Y276 HydrophobicContact SD-CD1 4.42Å; M243-Y276 HydrophobicContact SD-CD2 4.16Å; M243-Y276 HydrophobicContact SD-CE1 4.48Å; M243-Y276 HydrophobicContact SD-CE2 4.23Å; M243-Y276 HydrophobicContact SD-CG 4.27Å
244	V	95.9	Very high	90.9	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.006	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	122.6	-175.2	-176.1	0	0	0	0	109.2	W62 V173 C188 Y189 P242 A251 Y252	W62-V244 HydrophobicContact CZ2-CG1 3.93Å; V173-V244 HydrophobicContact CG2-CG1 4.15Å; V173-V244 HydrophobicContact CG2-CG2 4.4Å; C188-V244 CarbonylContact C-O 3.51Å; C188-V244 WeakPolarHBondContact CA-O 3.44Å; Y189-V244 PolarHBondContact N-O 3Å; Y189-V244 PolarHBondContact O-N 2.95Å; P242-V244 HydrophobicContact CB-CG2 3.73Å; P242-V244 HydrophobicContact CG-CG2 3.95Å; V244-A251 HydrophobicContact CG1-CB 3.49Å; V244-A251 VanDerWaalsContact CG1-CB 3.49Å; V244-Y252 WeakPolarHBondContact CA-O 3.13Å
245	C	93.6	Very high	92.1	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	135	176.4	-54.4	0	0	0	0	110.5	A186 S187 C188 V247 Y252 Y254	A186-C245 HydrophobicContact CB-CB 4.11Å; S187-C245 WeakPolarHBondContact O-CA 3.39Å; C188-C245 HydrophobicContact CB-CB 4.1Å; C188-C245 WeakPolarHBondContact CB-SG 3.11Å; C188-C245 WeakPolarHBondContact SG-CB 3.35Å; C188-C245 CovalentContact SG-SG 2.04Å; C188-C245 PolarHBondContact SG-SG 3.43Å; C245-V247 PolarHBondContact O-N 2.92Å; C245-Y252 PolarHBondContact N-O 3.38Å; C245-Y252 PolarHBondContact O-N 2.98Å; C245-Y254 HydrophobicContact CB-CD2 3.75Å; C245-Y254 HydrophobicContact CB-CE2 3.74Å
246	L	89.7	Confident	92.9	Very high	14 Å²	14	22.8 Å²	22.8	7%	0.073	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	111.4	177.7	-54.3	-169.6	0	0	0	108.9	V47 E48 V51 S187 Y189 A251	V47-L246 HydrophobicContact CB-CD2 4.37Å; V47-L246 HydrophobicContact CG1-CD1 4.45Å; V47-L246 HydrophobicContact CG1-CD2 3.5Å; V47-L246 VanDerWaalsContact CG1-CD2 3.5Å; E48-L246 HydrophobicContact CG-CD1 3.95Å; V51-L246 HydrophobicContact CG2-CD1 4.06Å; S187-L246 PolarHBondContact O-N 2.95Å; Y189-L246 HydrophobicContact CD2-CG 4.31Å; Y189-L246 HydrophobicContact CE2-CD1 3.91Å; Y189-L246 HydrophobicContact CE2-CG 4.04Å; L246-A251 HydrophobicContact CD2-CB 3.97Å
247	V	88.1	Confident	93.2	Very high	31 Å²	31	21.3 Å²	21.3	19%	0.188	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	112.6	-179	-175	0	0	0	0	107.8	P183 A186 C245 G249 R250 Y252 Y254	P183-V247 HydrophobicContact CG-CG2 4.38Å; A186-V247 HydrophobicContact CB-CG2 3.95Å; C245-V247 PolarHBondContact O-N 2.92Å; V247-G249 PolarHBondContact O-N 2.76Å; V247-R250 PolarHBondContact N-O 3.13Å; V247-R250 PolarHBondContact O-N 2.85Å; V247-Y252 HydrophobicContact CB-CD2 3.88Å; V247-Y252 HydrophobicContact CB-CE2 3.95Å; V247-Y252 HydrophobicContact CG2-CD2 4.24Å; V247-Y254 HydrophobicContact CG2-CE2 4.44Å
248	N	83.6	Confident	93.3	Very high	136 Å²	136	20.8 Å²	20.8	73%	0.727	11%	0.111	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.5	50.6	177.5	-57.8	-19.4	0	0	0	113.9	R250	N248-R250 VanDerWaalsContact C-N 3.29Å; N248-R250 PolarHBondContact O-N 3.07Å
249	G	82.3	Confident	93	Very high	38 Å²	38	20.4 Å²	20.4	39%	0.392	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.5	10.2	177.8	0	0	0	0	0	114.8	V47 V247	V47-G249 WeakPolarHBondContact CG2-O 3.09Å; V247-G249 PolarHBondContact O-N 2.76Å
250	R	91.3	Very high	92.4	Very high	40 Å²	40	18.7 Å²	18.7	15%	0.151	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	140.6	-178.4	-170.7	-179.5	-71.7	-134.1	17.4	112	C37 G38 Y86 V247 N248 Y252	C37-R250 PolarHBondContact O-NH1 3.38Å; G38-R250 WeakPolarHBondContact O-CG 3.4Å; Y86-R250 PolarHBondContact O-NH1 3.26Å; V247-R250 PolarHBondContact N-O 3.13Å; V247-R250 PolarHBondContact O-N 2.85Å; N248-R250 VanDerWaalsContact C-N 3.29Å; N248-R250 PolarHBondContact O-N 3.07Å; R250-Y252 HydrophobicContact CB-CE2 3.9Å; R250-Y252 HydrophobicContact CG-CE2 4.06Å; R250-Y252 WeakPolarHBondContact O-CD2 3.21Å
251	A	94.9	Very high	91.5	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	127.5	175.3	0	0	0	0	0	113.1	G38 V47 W62 V173 V244 L246	G38-A251 WeakPolarHBondContact CA-O 3.48Å; G38-A251 PolarHBondContact O-N 2.81Å; V47-A251 HydrophobicContact CG1-CB 4.03Å; W62-A251 HydrophobicContact CH2-CB 3.19Å; W62-A251 HydrophobicContact CZ2-CB 3.5Å; W62-A251 HydrophobicContact CZ3-CB 3.92Å; V173-A251 HydrophobicContact CG2-CB 4.04Å; V244-A251 HydrophobicContact CG1-CB 3.49Å; V244-A251 VanDerWaalsContact CG1-CB 3.49Å; L246-A251 HydrophobicContact CD2-CB 3.97Å
252	Y	96.1	Very high	90.2	Very high	38 Å²	38	19.5 Å²	19.5	15%	0.149	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	129.6	172.3	-62.9	-93.7	0	0	0	110.9	C174 V244 C245 V247 R250 Y254	C174-Y252 HydrophobicContact CB-CD1 3.71Å; C174-Y252 HydrophobicContact CB-CE1 4.02Å; C174-Y252 HydrophobicContact CB-CG 4.47Å; C174-Y252 CarbonylContact O-C 3.57Å; C174-Y252 WeakPolarHBondContact O-CA 3.36Å; V244-Y252 WeakPolarHBondContact CA-O 3.13Å; C245-Y252 PolarHBondContact N-O 3.38Å; C245-Y252 PolarHBondContact O-N 2.98Å; V247-Y252 HydrophobicContact CB-CD2 3.88Å; V247-Y252 HydrophobicContact CB-CE2 3.95Å; V247-Y252 HydrophobicContact CG2-CD2 4.24Å; R250-Y252 HydrophobicContact CB-CE2 3.9Å; R250-Y252 HydrophobicContact CG-CE2 4.06Å; R250-Y252 WeakPolarHBondContact O-CD2 3.21Å; Y252-Y254 WeakPolarHBondContact O-CD2 3.36Å; Y252-Y254 PolarHBondContact O-N 2.55Å
253	Q	97	Very high	88.7	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	112.5	172.6	-176.7	175.2	5.5	0	0	110.2	S79 V173 C174 A176 P242 M243 G255 I279	S79-Q253 VanDerWaalsContact OG-CD 3.25Å; S79-Q253 PolarHBondContact OG-NE2 3.25Å; S79-Q253 VanDerWaalsContact OG-NE2 3.1Å; S79-Q253 PolarHBondContact OG-OE1 2.55Å; V173-Q253 HydrophobicContact CG1-CB 3.85Å; V173-Q253 HydrophobicContact CG2-CB 4.21Å; C174-Q253 PolarHBondContact O-N 2.92Å; A176-Q253 WeakPolarHBondContact CB-O 3.22Å; A176-Q253 PolarHBondContact N-O 3.37Å; P242-Q253 HydrophobicContact CB-CG 4.06Å; M243-Q253 WeakPolarHBondContact O-CA 3.44Å; Q253-G255 WeakPolarHBondContact CG-O 3.33Å; Q253-G255 PolarHBondContact NE2-O 2.83Å; Q253-G255 VanDerWaalsContact NE2-O 3.08Å; Q253-I279 HydrophobicContact CG-CD1 4.23Å
254	Y	95	Very high	87.1	Confident	24 Å²	24	25.1 Å²	25.1	9%	0.094	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	-22.5	177.3	-79.6	-92.4	0	0	0	113	A176 S180 V181 P182 M243 C245 V247 Y252 I279	A176-Y254 HydrophobicContact CB-CD1 3.41Å; A176-Y254 VanDerWaalsContact CB-CD1 3.41Å; A176-Y254 HydrophobicContact CB-CD2 3.83Å; A176-Y254 HydrophobicContact CB-CE1 3.49Å; A176-Y254 VanDerWaalsContact CB-CE1 3.49Å; A176-Y254 HydrophobicContact CB-CE2 3.89Å; A176-Y254 HydrophobicContact CB-CG 3.59Å; S180-Y254 WeakPolarHBondContact OG-CE1 3.45Å; V181-Y254 WeakPolarHBondContact O-CE1 3.3Å; P182-Y254 HydrophobicContact CG-CD1 3.9Å; P182-Y254 HydrophobicContact CG-CD2 4.2Å; P182-Y254 HydrophobicContact CG-CE1 4.48Å; P182-Y254 HydrophobicContact CG-CG 3.74Å; M243-Y254 PolarHBondContact O-N 3.26Å; C245-Y254 HydrophobicContact CB-CD2 3.75Å; C245-Y254 HydrophobicContact CB-CE2 3.74Å; V247-Y254 HydrophobicContact CG2-CE2 4.44Å; Y252-Y254 WeakPolarHBondContact O-CD2 3.36Å; Y252-Y254 PolarHBondContact O-N 2.55Å; Y254-I279 PolarHBondContact O-N 3.03Å; Y254-I279 VanDerWaalsContact O-N 3.11Å
255	G	94.5	Very high	85.3	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.8	-175.5	179.5	0	0	0	0	0	115.7	M243 Q253 S277	M243-G255 PolarHBondContact N-O 2.89Å; Q253-G255 WeakPolarHBondContact CG-O 3.33Å; Q253-G255 PolarHBondContact NE2-O 2.83Å; Q253-G255 VanDerWaalsContact NE2-O 3.08Å; G255-S277 WeakPolarHBondContact CA-O 3.45Å
256	V	96.2	Very high	83.3	Confident	1 Å²	1	30.8 Å²	30.8	1%	0.006	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	123.9	-177.5	-178.9	0	0	0	0	108.5	I97 I155 S241 L258 Y276 S277	I97-V256 HydrophobicContact CG2-CG2 3.5Å; I97-V256 VanDerWaalsContact CG2-CG2 3.5Å; I155-V256 HydrophobicContact CG2-CB 3.88Å; I155-V256 HydrophobicContact CG2-CG1 4.23Å; I155-V256 HydrophobicContact CG2-CG2 3.79Å; S241-V256 WeakPolarHBondContact O-CA 3.25Å; V256-L258 HydrophobicContact CG1-CD2 4.3Å; V256-L258 PolarHBondContact O-N 3.09Å; V256-Y276 VanDerWaalsContact C-CD1 3.5Å; V256-Y276 CarbonylContact O-C 3.54Å; V256-Y276 VanDerWaalsContact O-CA 3.24Å; V256-Y276 WeakPolarHBondContact O-CA 3.27Å; V256-S277 PolarHBondContact N-O 2.79Å; V256-S277 PolarHBondContact O-N 2.64Å
257	Y	95.2	Very high	81.8	Confident	22 Å²	22	37.2 Å²	37.2	9%	0.086	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	124.6	-179.7	-175.4	-82.5	0	0	0	110.3	E230 Q238 G240 S241 Y276	E230-Y257 WeakPolarHBondContact OE2-CE2 3.44Å; Q238-Y257 HydrophobicContact CB-CD1 4.26Å; Q238-Y257 HydrophobicContact CB-CE1 4.19Å; Q238-Y257 VanDerWaalsContact CD-CD2 3.48Å; Q238-Y257 HydrophobicContact CG-CD1 4.17Å; Q238-Y257 HydrophobicContact CG-CD2 3.92Å; Q238-Y257 HydrophobicContact CG-CE1 4.33Å; Q238-Y257 HydrophobicContact CG-CE2 4.06Å; Q238-Y257 HydrophobicContact CG-CG 3.94Å; Q238-Y257 VanDerWaalsContact NE2-CE2 3.3Å; Q238-Y257 WeakPolarHBondContact O-CB 3.3Å; Q238-Y257 WeakPolarHBondContact O-CD1 3.23Å; Q238-Y257 PolarHBondContact OE1-OH 3.07Å; G240-Y257 PolarHBondContact N-O 2.89Å; S241-Y257 PolarHBondContact O-N 2.75Å; Y257-Y276 AromaticContact CD2-CE1 3.94Å; Y257-Y276 HydrophobicContact CD2-CE1 3.94Å; Y257-Y276 HydrophobicContact CD2-CE2 4.12Å; Y257-Y276 AromaticContact CD2-CZ 3.66Å; Y257-Y276 HydrophobicContact CG-CE1 4.26Å; Y257-Y276 VanDerWaalsContact N-CD1 3.28Å
258	L	92.1	Very high	79.7	Confident	14 Å²	14	45.3 Å²	45.3	7%	0.073	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	-38.8	176.9	-58.5	-170.2	0	0	0	112.7	A99 L144 G154 L239 V256 F275	A99-L258 HydrophobicContact CB-CD2 3.56Å; L144-L258 HydrophobicContact CD1-CD1 3.45Å; L144-L258 VanDerWaalsContact CD1-CD1 3.45Å; G154-L258 VanDerWaalsContact O-CD2 3.31Å; G154-L258 WeakPolarHBondContact O-CD2 3.37Å; L239-L258 WeakPolarHBondContact CD1-O 3.39Å; V256-L258 HydrophobicContact CG1-CD2 4.3Å; V256-L258 PolarHBondContact O-N 3.09Å; L258-F275 HydrophobicContact CB-CD1 4.43Å; L258-F275 HydrophobicContact CD1-CE1 4.41Å; L258-F275 PolarHBondContact N-O 3.31Å
259	N	86.4	Confident	77.9	Confident	24 Å²	24	40.5 Å²	40.5	13%	0.128	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.5	170.9	-172	-156.3	-12.4	0	0	0	111.7	F275 R393	N259-F275 PolarHBondContact N-O 3.44Å; N259-F275 WeakPolarHBondContact O-CB 3.32Å; N259-F275 PolarHBondContact O-N 3.27Å; N259-R393 PolarHBondContact ND2-O 3.12Å; N259-R393 PolarHBondContact OD1-O 2.71Å
260	Q	83.1	Confident	77	Confident	9 Å²	9	44.7 Å²	44.7	4%	0.042	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	132.8	166.3	-157.4	176.3	39.2	0	0	110.6	E230 E231 N272 L273	E230-Q260 PolarHBondContact O-NE2 3.16Å; E230-Q260 VanDerWaalsContact O-NE2 3.13Å; E231-Q260 VanDerWaalsContact C-NE2 3.29Å; E231-Q260 PolarHBondContact O-NE2 3.33Å; Q260-N272 HydrophobicContact CG-CB 4.22Å; Q260-L273 WeakPolarHBondContact CA-O 3.45Å; Q260-L273 WeakPolarHBondContact CG-O 3.09Å
261	L	77.6	Confident	75.7	Confident	1 Å²	1	44.7 Å²	44.7	1%	0.005	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	136.2	172.5	-51.7	172.4	0	0	0	108.8	L214 N272 L273 F275 I395 L397	L214-L261 HydrophobicContact CD1-CD1 3.81Å; L214-L261 HydrophobicContact CD1-CD2 4.3Å; L214-L261 HydrophobicContact CG-CD1 4.32Å; L261-N272 WeakPolarHBondContact O-CA 3.24Å; L261-L273 HydrophobicContact CB-CB 4.42Å; L261-L273 PolarHBondContact N-O 3.43Å; L261-L273 PolarHBondContact O-N 2.87Å; L261-F275 HydrophobicContact CD1-CB 3.82Å; L261-F275 HydrophobicContact CD1-CD2 3.78Å; L261-F275 HydrophobicContact CD1-CG 3.96Å; L261-F275 HydrophobicContact CD2-CB 4.29Å; L261-F275 HydrophobicContact CD2-CG 4.45Å; L261-F275 HydrophobicContact CG-CB 3.74Å; L261-F275 HydrophobicContact CG-CG 4.23Å; L261-I395 HydrophobicContact CD2-CB 3.73Å; L261-I395 HydrophobicContact CD2-CD1 4.01Å; L261-I395 HydrophobicContact CD2-CG1 4.34Å; L261-I395 HydrophobicContact CD2-CG2 4.13Å; L261-L397 HydrophobicContact CB-CD1 4.32Å; L261-L397 HydrophobicContact CD1-CD1 3.94Å; L261-L397 HydrophobicContact CD2-CD1 4.36Å; L261-L397 HydrophobicContact CG-CD1 4.43Å
262	S	69.2	Low	74.6	Confident	17 Å²	17	47.1 Å²	47.1	12%	0.119	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	104.5	164.8	-67	0	0	0	0	109.4	K264 N272 V394 I395 L397	S262-K264 PolarHBondContact O-N 3.4Å; S262-N272 PolarHBondContact OG-OD1 3.19Å; S262-V394 VanDerWaalsContact OG-CG1 3.24Å; S262-V394 WeakPolarHBondContact OG-CG1 3.45Å; S262-I395 PolarHBondContact N-O 2.96Å; S262-L397 PolarHBondContact O-N 3.46Å
263	L	65.6	Low	73.7	Confident	40 Å²	40	46.2 Å²	46.2	21%	0.209	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	118.5	169.6	-175.1	71.4	0	0	0	108.7	I265 K270 Q271 L273 L397 V399	L263-I265 HydrophobicContact CD2-CG1 4.22Å; L263-I265 HydrophobicContact CG-CG1 4.47Å; L263-I265 PolarHBondContact O-N 2.99Å; L263-K270 WeakPolarHBondContact O-CA 3.32Å; L263-Q271 PolarHBondContact N-O 2.77Å; L263-Q271 PolarHBondContact O-N 2.9Å; L263-L273 HydrophobicContact CB-CD1 4.39Å; L263-L397 HydrophobicContact CD1-CB 4.49Å; L263-V399 HydrophobicContact CD1-CB 4.41Å; L263-V399 HydrophobicContact CD1-CG2 3.67Å
264	K	63.1	Low	73.2	Confident	78 Å²	78	46.2 Å²	46.2	34%	0.339	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	113.5	165.6	-77.8	-170.8	172.7	-164.9	0	108.5	S262	S262-K264 PolarHBondContact O-N 3.4Å
265	I	57.5	Low	72.9	Confident	59 Å²	59	45.2 Å²	45.2	30%	0.303	22%	0.221	S	C	.	.	S	Bend	trans	-82.5	-41.7	172.1	-62.4	-179.4	0	0	0	109.3	L263 V269 Q271	L263-I265 HydrophobicContact CD2-CG1 4.22Å; L263-I265 HydrophobicContact CG-CG1 4.47Å; L263-I265 PolarHBondContact O-N 2.99Å; I265-V269 HydrophobicContact CB-CB 4.31Å; I265-V269 HydrophobicContact CB-CG1 4.25Å; I265-V269 HydrophobicContact CD1-CG1 4.1Å; I265-V269 PolarHBondContact N-O 2.87Å; I265-Q271 HydrophobicContact CD1-CB 3.92Å; I265-Q271 HydrophobicContact CG1-CB 4.46Å
266	N	50.3	Low	72.8	Confident	61 Å²	61	45.2 Å²	45.2	33%	0.326	22%	0.221	S	C	.	.	S	Bend	trans	-155.9	-172	168.2	58.3	61.3	0	0	0	108.8	K268 V269	N266-K268 PolarHBondContact O-N 3.33Å; N266-K268 WeakPolarHBondContact OD1-CA 3.24Å; N266-K268 PolarHBondContact OD1-N 3.1Å; N266-V269 PolarHBondContact N-O 2.04Å; N266-V269 VanDerWaalsContact O-O 3.11Å; N266-V269 PolarHBondContact OD1-N 2.87Å
267	D	58.2	Low	72.6	Confident	149 Å²	149	45.1 Å²	45.1	80%	0.797	22%	0.221	S	C	*	.	S	Bend	trans	-67.5	-21.7	-177	-58.4	-64.2	0	0	0	114.3
268	K	44.4	Very low	72.3	Confident	200 Å²	200	44.7 Å²	44.7	87%	0.87	22%	0.219	S	C	*	.	S	Bend	trans	-99.1	-32.6	179	-60.2	-170	178.1	-170.6	0	113.1	N266	N266-K268 PolarHBondContact O-N 3.33Å; N266-K268 WeakPolarHBondContact OD1-CA 3.24Å; N266-K268 PolarHBondContact OD1-N 3.1Å
269	V	47.1	Very low	72.3	Confident	36 Å²	36	44.3 Å²	44.3	22%	0.218	22%	0.217	C	C	.	.			trans	-108.7	120.4	-174.3	-174.3	0	0	0	0	111.2	I265 N266 L843	I265-V269 HydrophobicContact CB-CB 4.31Å; I265-V269 HydrophobicContact CB-CG1 4.25Å; I265-V269 HydrophobicContact CD1-CG1 4.1Å; I265-V269 PolarHBondContact N-O 2.87Å; N266-V269 PolarHBondContact N-O 2.04Å; N266-V269 VanDerWaalsContact O-O 3.11Å; N266-V269 PolarHBondContact OD1-N 2.87Å; V269-L843 HydrophobicContact CG1-CB 3.99Å; V269-L843 HydrophobicContact CG1-CD1 4.46Å
270	K	61.9	Low	72.5	Confident	125 Å²	125	44 Å²	44	54%	0.543	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	140.5	169.5	-60.6	164.6	-167	153.8	0	108	L263	L263-K270 WeakPolarHBondContact O-CA 3.32Å
271	Q	64.8	Low	72.7	Confident	40 Å²	40	44.6 Å²	44.6	19%	0.187	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	132.1	171.2	-172.1	156.8	56.1	0	0	108.3	M229 L263 I265 L273 L843	M229-Q271 HydrophobicContact CE-CG 4.49Å; L263-Q271 PolarHBondContact N-O 2.77Å; L263-Q271 PolarHBondContact O-N 2.9Å; I265-Q271 HydrophobicContact CD1-CB 3.92Å; I265-Q271 HydrophobicContact CG1-CB 4.46Å; Q271-L273 HydrophobicContact CG-CD2 4.34Å; Q271-L843 HydrophobicContact CB-CD1 3.94Å; Q271-L843 HydrophobicContact CG-CD1 3.95Å
272	N	70.7	Confident	73.4	Confident	52 Å²	52	44.5 Å²	44.5	28%	0.278	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	140.7	175.9	-64.9	-36.6	0	0	0	109	E230 Q260 L261 S262	E230-N272 CarbonylContact O-C 3.53Å; E230-N272 VanDerWaalsContact O-CB 3.27Å; E230-N272 WeakPolarHBondContact O-CB 3.21Å; Q260-N272 HydrophobicContact CG-CB 4.22Å; L261-N272 WeakPolarHBondContact O-CA 3.24Å; S262-N272 PolarHBondContact OG-OD1 3.19Å
273	L	78.5	Confident	74.5	Confident	18 Å²	18	45.7 Å²	45.7	9%	0.094	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	131.8	-179.6	-57.2	172.2	0	0	0	108.5	T208 C227 T228 M229 Q260 L261 L263 Q271	T208-L273 HydrophobicContact CG2-CD2 4.03Å; C227-L273 HydrophobicContact CB-CB 4.48Å; C227-L273 HydrophobicContact CB-CD1 4.48Å; T228-L273 WeakPolarHBondContact O-CA 3.48Å; T228-L273 WeakPolarHBondContact O-CB 3.38Å; T228-L273 VanDerWaalsContact O-CD2 3.26Å; T228-L273 WeakPolarHBondContact O-CD2 3.43Å; M229-L273 HydrophobicContact SD-CD2 3.88Å; Q260-L273 WeakPolarHBondContact CA-O 3.45Å; Q260-L273 WeakPolarHBondContact CG-O 3.09Å; L261-L273 HydrophobicContact CB-CB 4.42Å; L261-L273 PolarHBondContact N-O 3.43Å; L261-L273 PolarHBondContact O-N 2.87Å; L263-L273 HydrophobicContact CB-CD1 4.39Å; Q271-L273 HydrophobicContact CG-CD2 4.34Å
274	G	85.7	Confident	75.6	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	137.1	167.5	0	0	0	0	0	108.9	C227 T228 E230	C227-G274 WeakPolarHBondContact CA-O 3.32Å; T228-G274 PolarHBondContact N-O 3.07Å; T228-G274 VanDerWaalsContact N-O 3.12Å; T228-G274 PolarHBondContact O-N 3Å; T228-G274 VanDerWaalsContact OG1-CA 3.29Å; T228-G274 WeakPolarHBondContact OG1-CA 3.37Å; T228-G274 PolarHBondContact OG1-N 2.85Å; T228-G274 PolarHBondContact OG1-O 2.86Å; E230-G274 WeakPolarHBondContact OE2-CA 3.26Å
275	F	89.3	Confident	76.8	Confident	3 Å²	3	42.9 Å²	42.9	1%	0.013	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	124.3	-176.6	178.5	-93.9	0	0	0	113	L214 Y223 L258 N259 L261	L214-F275 HydrophobicContact CD1-CD2 4.02Å; L214-F275 HydrophobicContact CD1-CE2 3.81Å; L214-F275 HydrophobicContact CD1-CZ 4.28Å; Y223-F275 HydrophobicContact CE1-CE1 4.32Å; Y223-F275 HydrophobicContact CE1-CE2 4.1Å; Y223-F275 AromaticContact CE1-CZ 3.51Å; Y223-F275 HydrophobicContact CE1-CZ 3.51Å; Y223-F275 AromaticContact CZ-CZ 3.55Å; Y223-F275 WeakPolarHBondContact OH-CE1 3.29Å; Y223-F275 WeakPolarHBondContact OH-CZ 3.44Å; L258-F275 HydrophobicContact CB-CD1 4.43Å; L258-F275 HydrophobicContact CD1-CE1 4.41Å; L258-F275 PolarHBondContact N-O 3.31Å; N259-F275 PolarHBondContact N-O 3.44Å; N259-F275 WeakPolarHBondContact O-CB 3.32Å; N259-F275 PolarHBondContact O-N 3.27Å; L261-F275 HydrophobicContact CD1-CB 3.82Å; L261-F275 HydrophobicContact CD1-CD2 3.78Å; L261-F275 HydrophobicContact CD1-CG 3.96Å; L261-F275 HydrophobicContact CD2-CB 4.29Å; L261-F275 HydrophobicContact CD2-CG 4.45Å; L261-F275 HydrophobicContact CG-CB 3.74Å; L261-F275 HydrophobicContact CG-CG 4.23Å
276	Y	92.4	Very high	78.4	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	135.5	-170.7	-61.9	-97.8	0	0	0	111.8	V190 G225 V226 T228 E230 M243 V256 Y257	V190-Y276 WeakPolarHBondContact CB-OH 3.39Å; V190-Y276 HydrophobicContact CG2-CE1 4.11Å; V190-Y276 WeakPolarHBondContact CG2-OH 3.43Å; G225-Y276 CarbonylContact C-O 3.59Å; G225-Y276 WeakPolarHBondContact CA-O 3.26Å; V226-Y276 PolarHBondContact N-O 3.25Å; V226-Y276 PolarHBondContact O-N 3Å; T228-Y276 HydrophobicContact CG2-CD2 4.15Å; T228-Y276 HydrophobicContact CG2-CE2 3.63Å; T228-Y276 WeakPolarHBondContact OG1-CE2 3.28Å; E230-Y276 VanDerWaalsContact OE1-CE2 3.26Å; E230-Y276 WeakPolarHBondContact OE1-CE2 3.07Å; E230-Y276 VanDerWaalsContact OE1-CZ 3.31Å; E230-Y276 PolarHBondContact OE1-OH 2.9Å; M243-Y276 HydrophobicContact CB-CD1 3.62Å; M243-Y276 HydrophobicContact CB-CE1 3.55Å; M243-Y276 HydrophobicContact CB-CG 4.34Å; M243-Y276 HydrophobicContact CG-CD1 4.48Å; M243-Y276 HydrophobicContact CG-CE1 4.25Å; M243-Y276 HydrophobicContact SD-CD1 4.42Å; M243-Y276 HydrophobicContact SD-CD2 4.16Å; M243-Y276 HydrophobicContact SD-CE1 4.48Å; M243-Y276 HydrophobicContact SD-CE2 4.23Å; M243-Y276 HydrophobicContact SD-CG 4.27Å; V256-Y276 VanDerWaalsContact C-CD1 3.5Å; V256-Y276 CarbonylContact O-C 3.54Å; V256-Y276 VanDerWaalsContact O-CA 3.24Å; V256-Y276 WeakPolarHBondContact O-CA 3.27Å; Y257-Y276 AromaticContact CD2-CE1 3.94Å; Y257-Y276 HydrophobicContact CD2-CE1 3.94Å; Y257-Y276 HydrophobicContact CD2-CE2 4.12Å; Y257-Y276 AromaticContact CD2-CZ 3.66Å; Y257-Y276 HydrophobicContact CG-CE1 4.26Å; Y257-Y276 VanDerWaalsContact N-CD1 3.28Å
277	S	91.3	Very high	80.3	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	135	161.4	-174.7	0	0	0	0	109.4	G255 V256	G255-S277 WeakPolarHBondContact CA-O 3.45Å; V256-S277 PolarHBondContact N-O 2.79Å; V256-S277 PolarHBondContact O-N 2.64Å
278	E	90.1	Very high	81.6	Confident	13 Å²	13	38.1 Å²	38.1	6%	0.061	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.2	143.7	164.9	-69.4	-171.8	151.9	0	0	110.2	R212 R224 V226 N280	R212-E278 IonicContact CZ-OE1 3.56Å; R212-E278 IonicContact NE-OE1 2.84Å; R212-E278 PolarHBondContact NE-OE1 3.23Å; R212-E278 IonicContact NH2-OE1 2.91Å; R212-E278 PolarHBondContact NH2-OE1 3.46Å; R212-E278 IonicContact NH2-OE2 3.41Å; R224-E278 VanDerWaalsContact CB-CD 3.44Å; R224-E278 HydrophobicContact CB-CG 4.22Å; R224-E278 WeakPolarHBondContact CB-OE2 3.39Å; V226-E278 HydrophobicContact CG2-CG 4.37Å; E278-N280 HydrophobicContact CB-CB 4.02Å; E278-N280 PolarHBondContact O-N 3.49Å; E278-N280 VanDerWaalsContact O-N 3.13Å; E278-N280 PolarHBondContact OE2-ND2 2.7Å
279	I	92.2	Very high	83.6	Confident	6 Å²	6	33.5 Å²	33.5	3%	0.031	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-9.8	175.6	-154	61.8	0	0	0	113.5	I97 L175 A176 Q253 Y254 V281 A282 H283	I97-I279 HydrophobicContact CD1-CD1 3.97Å; L175-I279 HydrophobicContact CB-CG1 4.18Å; L175-I279 HydrophobicContact CD2-CD1 3.97Å; L175-I279 HydrophobicContact CD2-CG1 3.83Å; L175-I279 HydrophobicContact CG-CG1 4.47Å; A176-I279 HydrophobicContact CB-CG2 4.26Å; Q253-I279 HydrophobicContact CG-CD1 4.23Å; Y254-I279 PolarHBondContact O-N 3.03Å; Y254-I279 VanDerWaalsContact O-N 3.11Å; I279-V281 PolarHBondContact O-N 2.69Å; I279-V281 VanDerWaalsContact O-N 3.11Å; I279-A282 HydrophobicContact CD1-CB 4.1Å; I279-A282 HydrophobicContact CG1-CB 4.33Å; I279-A282 WeakPolarHBondContact O-CB 3.48Å; I279-A282 PolarHBondContact O-N 3.47Å; I279-H283 PolarHBondContact O-N 2.85Å
280	N	89.4	Confident	85.1	Confident	16 Å²	16	42 Å²	42	9%	0.086	22%	0.223	C	C	.	.	H	α-helix	trans	-44.2	-39	170.9	-91.5	-18.4	0	0	0	114.1	R178 D179 E278 A282 H283 D284	R178-N280 WeakPolarHBondContact CG-OD1 3.37Å; D179-N280 PolarHBondContact N-OD1 3.25Å; D179-N280 PolarHBondContact OD1-ND2 2.89Å; E278-N280 HydrophobicContact CB-CB 4.02Å; E278-N280 PolarHBondContact O-N 3.49Å; E278-N280 VanDerWaalsContact O-N 3.13Å; E278-N280 PolarHBondContact OE2-ND2 2.7Å; N280-A282 VanDerWaalsContact C-N 3.33Å; N280-A282 PolarHBondContact O-N 2.81Å; N280-H283 PolarHBondContact O-N 2.87Å; N280-D284 PolarHBondContact O-N 3.27Å; N280-D284 VanDerWaalsContact O-N 3.08Å
281	V	87.1	Confident	86	Confident	22 Å²	22	37.6 Å²	37.6	13%	0.133	21%	0.206	C	C	.	.	H	α-helix	trans	-63.1	-40.7	179.2	-173.4	0	0	0	0	111.2	L144 I155 I279 D284 V285 V291	L144-V281 HydrophobicContact CD2-CG2 3.84Å; I155-V281 HydrophobicContact CD1-CB 3.85Å; I155-V281 HydrophobicContact CD1-CG1 3.88Å; I155-V281 HydrophobicContact CG1-CB 4.23Å; I155-V281 HydrophobicContact CG1-CG1 3.9Å; I279-V281 PolarHBondContact O-N 2.69Å; I279-V281 VanDerWaalsContact O-N 3.11Å; V281-D284 PolarHBondContact O-N 2.63Å; V281-V285 WeakPolarHBondContact O-CG2 3.02Å; V281-V285 PolarHBondContact O-N 2.86Å; V281-V285 VanDerWaalsContact O-N 3.11Å; V281-V291 HydrophobicContact CG1-CG1 3.89Å
282	A	91.9	Very high	86.7	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-68.5	-41.6	178.3	0	0	0	0	0	111.6	I97 I155 I157 I279 N280 D284 V285 F286	I97-A282 HydrophobicContact CD1-CB 3.61Å; I155-A282 HydrophobicContact CD1-CB 4Å; I157-A282 HydrophobicContact CD1-CB 4.45Å; I279-A282 HydrophobicContact CD1-CB 4.1Å; I279-A282 HydrophobicContact CG1-CB 4.33Å; I279-A282 WeakPolarHBondContact O-CB 3.48Å; I279-A282 PolarHBondContact O-N 3.47Å; N280-A282 VanDerWaalsContact C-N 3.33Å; N280-A282 PolarHBondContact O-N 2.81Å; A282-D284 VanDerWaalsContact C-N 3.3Å; A282-D284 PolarHBondContact O-N 2.73Å; A282-V285 PolarHBondContact O-N 2.85Å; A282-F286 HydrophobicContact CB-CD2 4.27Å; A282-F286 HydrophobicContact CB-CE2 3.96Å; A282-F286 WeakPolarHBondContact O-CB 3.43Å; A282-F286 WeakPolarHBondContact O-CD2 3.49Å; A282-F286 VanDerWaalsContact O-CG 3.24Å; A282-F286 WeakPolarHBondContact O-CG 3.48Å; A282-F286 PolarHBondContact O-N 3.33Å
283	H	92.3	Very high	87	Confident	42 Å²	42	42.3 Å²	42.3	19%	0.194	23%	0.233	C	C	.	.	H	α-helix	trans	-57.3	-42.7	173.7	-79.1	-58.4	0	0	0	112.5	A176 R178 I279 N280 F286 S287	A176-H283 PolarHBondContact O-NE2 3.06Å; R178-H283 HydrophobicContact CG-CB 4.38Å; I279-H283 PolarHBondContact O-N 2.85Å; N280-H283 PolarHBondContact O-N 2.87Å; H283-F286 PolarHBondContact O-N 2.81Å; H283-S287 VanDerWaalsContact O-CB 3.27Å; H283-S287 WeakPolarHBondContact O-CB 3.38Å; H283-S287 PolarHBondContact O-N 2.79Å; H283-S287 PolarHBondContact O-OG 2.67Å
284	D	89.2	Confident	86.5	Confident	29 Å²	29	42.5 Å²	42.5	16%	0.155	23%	0.234	C	C	.	.	H	α-helix	trans	-71	-37.6	-178.9	-74.2	-14.7	0	0	0	112.1	R178 N280 V281 A282 S287 G288 K289 V291	R178-D284 IonicContact CZ-OD1 3.24Å; R178-D284 IonicContact CZ-OD2 3.55Å; R178-D284 IonicContact NE-OD1 3.64Å; R178-D284 PolarHBondContact NE-OD1 3.2Å; R178-D284 IonicContact NH2-OD1 2.7Å; R178-D284 PolarHBondContact NH2-OD1 3.24Å; R178-D284 IonicContact NH2-OD2 3.29Å; R178-D284 PolarHBondContact NH2-OD2 2.88Å; N280-D284 PolarHBondContact O-N 3.27Å; N280-D284 VanDerWaalsContact O-N 3.08Å; V281-D284 PolarHBondContact O-N 2.63Å; A282-D284 VanDerWaalsContact C-N 3.3Å; A282-D284 PolarHBondContact O-N 2.73Å; D284-S287 PolarHBondContact O-N 3.25Å; D284-G288 PolarHBondContact O-N 2.91Å; D284-K289 HydrophobicContact CB-CB 4.26Å; D284-K289 HydrophobicContact CB-CD 4.06Å; D284-K289 WeakPolarHBondContact O-CB 3.44Å; D284-K289 PolarHBondContact O-N 3.02Å; D284-K289 WeakPolarHBondContact OD1-CD 3.45Å; D284-K289 WeakPolarHBondContact OD1-CE 3.36Å; D284-K289 IonicContact OD1-NZ 2.71Å; D284-K289 PolarHBondContact OD1-NZ 3.29Å; D284-V291 HydrophobicContact CB-CG2 3.75Å
285	V	89.1	Confident	85.2	Confident	29 Å²	29	46.5 Å²	46.5	18%	0.176	26%	0.262	C	S	.	.	H	α-helix	trans	-61.4	-49.7	169	173.6	0	0	0	0	111.4	Y142 I157 V281 A282 S287 G288 V291	Y142-V285 HydrophobicContact CD1-CG2 3.8Å; Y142-V285 HydrophobicContact CD2-CG2 4.23Å; Y142-V285 HydrophobicContact CE1-CG1 4.36Å; Y142-V285 HydrophobicContact CE1-CG2 3.45Å; Y142-V285 VanDerWaalsContact CE1-CG2 3.45Å; Y142-V285 HydrophobicContact CE2-CG1 4.31Å; Y142-V285 HydrophobicContact CE2-CG2 3.91Å; Y142-V285 HydrophobicContact CG-CG2 4.17Å; Y142-V285 WeakPolarHBondContact OH-CG1 3.35Å; I157-V285 HydrophobicContact CD1-CB 4.19Å; I157-V285 HydrophobicContact CD1-CG1 4Å; I157-V285 HydrophobicContact CD1-CG2 4.43Å; V281-V285 WeakPolarHBondContact O-CG2 3.02Å; V281-V285 PolarHBondContact O-N 2.86Å; V281-V285 VanDerWaalsContact O-N 3.11Å; A282-V285 PolarHBondContact O-N 2.85Å; V285-S287 PolarHBondContact O-N 2.87Å; V285-G288 PolarHBondContact O-N 3.29Å; V285-V291 HydrophobicContact CG2-CB 4.03Å; V285-V291 HydrophobicContact CG2-CG1 4.37Å; V285-V291 HydrophobicContact CG2-CG2 3.8Å
286	F	91.5	Very high	83.4	Confident	24 Å²	24	48.1 Å²	48.1	11%	0.105	28%	0.276	C	S	.	.	H	α-helix	trans	-68.8	-18.2	-179	-65.6	-35	0	0	0	113.6	V81 R83 L95 I97 I157 L175 A282 H283 G288	V81-F286 HydrophobicContact CG2-CZ 4.34Å; R83-F286 HydrophobicContact CG-CB 3.93Å; R83-F286 HydrophobicContact CG-CD1 4.19Å; R83-F286 HydrophobicContact CG-CD2 4.31Å; R83-F286 HydrophobicContact CG-CG 3.89Å; R83-F286 PolarHBondContact NE-O 2.88Å; R83-F286 PolarHBondContact NH2-O 3.26Å; L95-F286 HydrophobicContact CD1-CE1 3.86Å; L95-F286 HydrophobicContact CD1-CZ 4.13Å; I97-F286 HydrophobicContact CD1-CE2 4.28Å; I97-F286 HydrophobicContact CD1-CZ 4.47Å; I157-F286 HydrophobicContact CD1-CE1 4.06Å; I157-F286 HydrophobicContact CD1-CZ 3.96Å; I157-F286 HydrophobicContact CG2-CE1 4.29Å; I157-F286 HydrophobicContact CG2-CZ 4.34Å; L175-F286 HydrophobicContact CD1-CD2 3.78Å; L175-F286 HydrophobicContact CD1-CE2 3.76Å; A282-F286 HydrophobicContact CB-CD2 4.27Å; A282-F286 HydrophobicContact CB-CE2 3.96Å; A282-F286 WeakPolarHBondContact O-CB 3.43Å; A282-F286 WeakPolarHBondContact O-CD2 3.49Å; A282-F286 VanDerWaalsContact O-CG 3.24Å; A282-F286 WeakPolarHBondContact O-CG 3.48Å; A282-F286 PolarHBondContact O-N 3.33Å; H283-F286 PolarHBondContact O-N 2.81Å; F286-G288 VanDerWaalsContact C-N 3.33Å
287	S	89.2	Confident	81	Confident	76 Å²	76	54.1 Å²	54.1	53%	0.531	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-0.6	169	-56.5	0	0	0	0	113.5	H283 D284 V285 K289	H283-S287 VanDerWaalsContact O-CB 3.27Å; H283-S287 WeakPolarHBondContact O-CB 3.38Å; H283-S287 PolarHBondContact O-N 2.79Å; H283-S287 PolarHBondContact O-OG 2.67Å; D284-S287 PolarHBondContact O-N 3.25Å; V285-S287 PolarHBondContact O-N 2.87Å; S287-K289 VanDerWaalsContact C-N 3.28Å; S287-K289 PolarHBondContact O-N 3.15Å
288	G	86.5	Confident	78.8	Confident	69 Å²	69	59.2 Å²	59.2	71%	0.711	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.5	14.7	-177.2	0	0	0	0	0	114.8	D284 V285 F286	D284-G288 PolarHBondContact O-N 2.91Å; V285-G288 PolarHBondContact O-N 3.29Å; F286-G288 VanDerWaalsContact C-N 3.33Å
289	K	85.1	Confident	76.3	Confident	103 Å²	103	63 Å²	63	45%	0.448	35%	0.352	S	S	.	.			trans	-73.8	149.1	176.4	-58.9	180	-165.2	163.4	0	110.2	D284 S287 V291	D284-K289 HydrophobicContact CB-CB 4.26Å; D284-K289 HydrophobicContact CB-CD 4.06Å; D284-K289 WeakPolarHBondContact O-CB 3.44Å; D284-K289 PolarHBondContact O-N 3.02Å; D284-K289 WeakPolarHBondContact OD1-CD 3.45Å; D284-K289 WeakPolarHBondContact OD1-CE 3.36Å; D284-K289 IonicContact OD1-NZ 2.71Å; D284-K289 PolarHBondContact OD1-NZ 3.29Å; S287-K289 VanDerWaalsContact C-N 3.28Å; S287-K289 PolarHBondContact O-N 3.15Å; K289-V291 VanDerWaalsContact C-N 3.32Å; K289-V291 PolarHBondContact O-N 3.5Å
290	K	79	Confident	73.5	Confident	216 Å²	216	73.8 Å²	73.8	94%	0.939	39%	0.393	S	S	*	.			trans	-73.6	81	177.9	-168.6	176.8	-177.6	177	0	111.7
291	V	80.8	Confident	70.6	Confident	31 Å²	31	81.9 Å²	81.9	19%	0.188	43%	0.43	C	S	.	.			trans	-71.7	147.4	167.3	-180	0	0	0	0	109.5	Y142 V281 D284 V285 K289 T293	Y142-V291 HydrophobicContact CD1-CB 4.1Å; Y142-V291 HydrophobicContact CD1-CG1 3.73Å; Y142-V291 HydrophobicContact CE1-CB 4.5Å; Y142-V291 HydrophobicContact CG-CG1 4.3Å; V281-V291 HydrophobicContact CG1-CG1 3.89Å; D284-V291 HydrophobicContact CB-CG2 3.75Å; V285-V291 HydrophobicContact CG2-CB 4.03Å; V285-V291 HydrophobicContact CG2-CG1 4.37Å; V285-V291 HydrophobicContact CG2-CG2 3.8Å; K289-V291 VanDerWaalsContact C-N 3.32Å; K289-V291 PolarHBondContact O-N 3.5Å; V291-T293 PolarHBondContact O-N 2.89Å; V291-T293 VanDerWaalsContact O-N 3.15Å
292	Q	78.6	Confident	67.9	Low	100 Å²	100	88.5 Å²	88.5	47%	0.467	46%	0.464	S	S	.	.			trans	-68.6	110.9	177.5	-168.4	-179.1	16.7	0	0	110.3	G143 T151	G143-Q292 PolarHBondContact N-O 2.93Å; T151-Q292 HydrophobicContact CG2-CG 4.39Å; T151-Q292 PolarHBondContact OG1-NE2 2.93Å; T151-Q292 PolarHBondContact OG1-OE1 2.99Å
293	T	77.1	Confident	64.6	Low	91 Å²	91	91.2 Å²	91.2	56%	0.558	49%	0.492	S	S	*	.	B	Isolated β-bridge	trans	-81.7	151.6	170.5	47.6	0	0	0	0	110.9	L141 Y142 V291	L141-T293 WeakPolarHBondContact O-CA 3.35Å; Y142-T293 HydrophobicContact CD1-CG2 3.99Å; Y142-T293 HydrophobicContact CE1-CG2 3.78Å; V291-T293 PolarHBondContact O-N 2.89Å; V291-T293 VanDerWaalsContact O-N 3.15Å
294	L	69.2	Low	61.5	Low	23 Å²	23	95.4 Å²	95.4	12%	0.12	52%	0.52	C	S	.	.	P	Polyproline II helix	trans	-90.8	118.8	174.7	-67.1	157.1	0	0	0	109.1	A100 L141 Y142 T151 R153 L298	A100-L294 HydrophobicContact CB-CD1 4.16Å; L141-L294 HydrophobicContact CB-CB 4.23Å; L141-L294 HydrophobicContact CB-CD1 4.18Å; L141-L294 PolarHBondContact O-N 2.92Å; Y142-L294 WeakPolarHBondContact O-CD1 3.43Å; T151-L294 HydrophobicContact CG2-CD2 3.93Å; R153-L294 HydrophobicContact CB-CD1 4.42Å; R153-L294 HydrophobicContact CG-CD1 3.83Å; L294-L298 HydrophobicContact CD2-CD2 4.37Å
295	S	57.2	Low	58.6	Low	83 Å²	83	102.9 Å²	102.9	58%	0.58	55%	0.551	S	S	*	*	P	Polyproline II helix	trans	-62.4	150.9	168.5	-164.3	0	0	0	0	110.2	D297	S295-D297 PolarHBondContact O-N 3.46Å; S295-D297 VanDerWaalsContact O-N 3.08Å; S295-D297 PolarHBondContact OG-OD2 3.12Å
296	A	51.4	Low	55.5	Low	38 Å²	38	106.9 Å²	106.9	31%	0.314	58%	0.58	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61.4	-17.9	179.1	0	0	0	0	0	113.2	L298 H299	A296-L298 VanDerWaalsContact C-N 3.32Å; A296-L298 PolarHBondContact O-N 2.97Å; A296-H299 CovalentContact O-CE1 1.77Å; A296-H299 PolarHBondContact O-CE1 2.97Å; A296-H299 PolarHBondContact O-ND1 2.71Å; A296-H299 PolarHBondContact O-NE2 3.2Å
297	D	42.4	Very low	52.5	Low	126 Å²	126	116.1 Å²	116.1	67%	0.674	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	-3.4	-171.1	-49.4	-71.7	0	0	0	115.5	S295 H299	S295-D297 PolarHBondContact O-N 3.46Å; S295-D297 VanDerWaalsContact O-N 3.08Å; S295-D297 PolarHBondContact OG-OD2 3.12Å; D297-H299 PolarHBondContact O-N 2.87Å
298	L	44.5	Very low	49.7	Very low	107 Å²	107	121.6 Å²	121.6	56%	0.56	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	26.5	-179.3	-149.6	80.3	0	0	0	114.3	L294 A296	L294-L298 HydrophobicContact CD2-CD2 4.37Å; A296-L298 VanDerWaalsContact C-N 3.32Å; A296-L298 PolarHBondContact O-N 2.97Å
299	H	38.1	Very low	46.9	Very low	92 Å²	92	124.3 Å²	124.3	43%	0.426	64%	0.635	S	S	.	*	T	Hydrogen-bonded Turn	trans	-97.2	9.4	-178.2	-73.9	96.1	0	0	0	113.9	V104 Y106 A296 D297	V104-H299 PolarHBondContact O-CD2 2.86Å; V104-H299 VanDerWaalsContact O-CD2 3.28Å; Y106-H299 PolarHBondContact O-NE2 3.13Å; A296-H299 CovalentContact O-CE1 1.77Å; A296-H299 PolarHBondContact O-CE1 2.97Å; A296-H299 PolarHBondContact O-ND1 2.71Å; A296-H299 PolarHBondContact O-NE2 3.2Å; D297-H299 PolarHBondContact O-N 2.87Å
300	R	32.8	Very low	44.4	Very low	233 Å²	233	127.2 Å²	127.2	88%	0.879	65%	0.654	S	S	*	*	S	Bend	trans	-135.3	19.6	-165.6	-137.7	174.1	-170.7	-112.2	2.8	118.7
301	Q	29.7	Very low	42.3	Very low	186 Å²	186	125.9 Å²	125.9	87%	0.869	65%	0.651	S	S	*	*	S	Bend	trans	-124.7	6.1	177.9	-85.1	-160.4	-16.3	0	0	117.3
302	L	29.3	Very low	39.9	Very low	160 Å²	160	129.3 Å²	129.3	84%	0.838	68%	0.683	S	S	*	*	S	Bend	trans	-109.9	64.2	168.3	-79.5	169.4	0	0	0	111.3
303	G	23.9	Very low	38	Very low	58 Å²	58	130 Å²	130	60%	0.598	70%	0.698	S	S	*	*	S	Bend	trans	179.4	151.7	171.6	0	0	0	0	0	112.8
304	V	26.9	Very low	36	Very low	129 Å²	129	130.8 Å²	130.8	78%	0.782	71%	0.708	S	S	*	*			trans	68	78.2	161.8	-168.6	0	0	0	0	116.9
305	K	28.5	Very low	34.6	Very low	186 Å²	186	134.9 Å²	134.9	81%	0.809	74%	0.739	S	S	*	*				170.3	137.6	103	-99.1	154.5	-175.4	175.5	0	113.9
306	S	22.8	Very low	33.7	Very low	113 Å²	113	136.6 Å²	136.6	79%	0.79	75%	0.75	S	S	*	*			trans	-86.5	131.6	154.4	173.5	0	0	0	0	108.7
307	Y	30.2	Very low	33	Very low	218 Å²	218	139.5 Å²	139.5	86%	0.855	77%	0.768	S	S	*	*			trans	-159.1	162.1	156.9	-105	-70.3	0	0	0	110.9
308	K	30.5	Very low	32.8	Very low	192 Å²	192	138.7 Å²	138.7	84%	0.835	77%	0.773	S	S	*	*			trans	-79.3	153.5	-168.3	-65.9	177.3	177.7	179	0	113.5
309	P	27.8	Very low	32.5	Very low	125 Å²	125	138.8 Å²	138.8	81%	0.812	78%	0.782	S	S	*	*			trans	-82.1	145	176.4	33.9	-35	0	0	0	112.8
310	I	32.8	Very low	32.5	Very low	164 Å²	164	139.1 Å²	139.1	84%	0.841	80%	0.801	S	S	*	*			trans	-134.2	154.9	164.8	-67	-174.4	0	0	0	109
311	Q	33	Very low	32.8	Very low	189 Å²	189	133 Å²	133	88%	0.883	79%	0.794	S	S	*	*			trans	-64.3	167.4	-165	-63.6	156.1	-39.4	0	0	115.4
312	A	31.4	Very low	33.2	Very low	103 Å²	103	135.5 Å²	135.5	85%	0.851	80%	0.795	S	S	*	*			trans	-113.8	142.6	173.3	0	0	0	0	0	111.9
313	S	37.7	Very low	33.6	Very low	113 Å²	113	136.3 Å²	136.3	79%	0.79	80%	0.795	S	S	*	*			trans	-155.2	143.5	169.8	51.3	0	0	0	0	108.2
314	S	36.6	Very low	34.2	Very low	108 Å²	108	138.7 Å²	138.7	76%	0.755	80%	0.798	S	S	*	*			cis	164	109.7	-23.1	44.5	0	0	0	0	105.6
315	S	38.9	Very low	34.7	Very low	110 Å²	110	139.2 Å²	139.2	77%	0.769	79%	0.792	S	S	*	*			trans	-169.5	123.9	164.1	46.5	0	0	0	0	113.5
316	S	38.2	Very low	35.2	Very low	118 Å²	118	139.1 Å²	139.1	83%	0.825	79%	0.786	S	S	*	*			trans	55.4	147.1	141.9	55.3	0	0	0	0	121.5
317	S	38.1	Very low	35.8	Very low	99 Å²	99	143.4 Å²	143.4	69%	0.692	79%	0.785	S	S	*	*			cis	-152.9	151.9	9.5	44.1	0	0	0	0	113.2
318	S	37.8	Very low	36	Very low	110 Å²	110	142.6 Å²	142.6	77%	0.769	78%	0.78	S	S	*	*			trans	52	141.6	146.6	53.4	0	0	0	0	121.1
319	S	37.6	Very low	36	Very low	109 Å²	109	139.1 Å²	139.1	76%	0.762	78%	0.775	S	S	*	*			cis	-157.7	153	8.4	42.1	0	0	0	0	112.3
320	A	37.6	Very low	36.3	Very low	99 Å²	99	140.6 Å²	140.6	82%	0.818	78%	0.775	S	S	*	*			trans	37.9	143.6	147.1	0	0	0	0	0	121.7
321	S	38.9	Very low	36.1	Very low	104 Å²	104	138.5 Å²	138.5	73%	0.727	77%	0.77	S	S	*	*			cis	-154.3	141.3	12	50.5	0	0	0	0	113.5
322	R	38.2	Very low	36	Very low	239 Å²	239	136.9 Å²	136.9	90%	0.902	77%	0.766	S	S	*	*			trans	28.4	140.1	139.1	-54.1	-175.7	178	174.9	-0.1	119.2
323	E	37.6	Very low	36	Very low	177 Å²	177	137.1 Å²	137.1	83%	0.827	76%	0.759	S	S	*	*			cis	-145.1	163.3	45.7	-82.9	-170.2	134.6	0	0	117.7
324	T	36.9	Very low	35.8	Very low	107 Å²	107	138.4 Å²	138.4	66%	0.656	76%	0.757	S	S	*	*			trans	-23.5	156.6	163.9	52.9	0	0	0	0	119.4
325	H	37.9	Very low	35.4	Very low	141 Å²	141	138.8 Å²	138.8	65%	0.653	76%	0.755	S	S	*	*			cis	-172.3	-170.6	18.3	-118.1	-15.2	0	0	0	109.5
326	R	38.1	Very low	35	Very low	183 Å²	183	142 Å²	142	69%	0.691	76%	0.755	S	S	*	*			cis	-163.5	132.3	-2.7	-128.2	162.9	-158.2	-177.7	12.6	110.6
327	R	36.3	Very low	34.7	Very low	203 Å²	203	142.9 Å²	142.9	77%	0.766	75%	0.749	S	S	*	*			trans	59.7	161.9	156.5	-62.7	177.6	175.2	-175.9	-1.7	118.7
328	R	35	Very low	34.3	Very low	201 Å²	201	143.8 Å²	143.8	76%	0.758	75%	0.752	S	S	*	*			cis	-161.8	129.8	-27.1	-103.2	176	175.5	179.9	-4.4	105.7
329	T	30.7	Very low	34.1	Very low	119 Å²	119	146 Å²	146	73%	0.73	75%	0.754	S	S	*	*				94.6	100.5	63.5	-55	0	0	0	0	115.2
330	L	33.3	Very low	34	Very low	156 Å²	156	146.6 Å²	146.6	82%	0.817	76%	0.755	S	S	*	*			trans	177.4	143.3	147.4	-123.4	69.1	0	0	0	108.2
331	V	28.3	Very low	33.9	Very low	120 Å²	120	147.8 Å²	147.8	73%	0.727	75%	0.753	S	S	*	*			cis	97.6	93.1	-4.9	-166.4	0	0	0	0	118.8
332	I	30	Very low	33.9	Very low	156 Å²	156	151.8 Å²	151.8	80%	0.8	76%	0.757	S	S	*	*			trans	-151.1	129.9	152.6	-54.7	-179	0	0	0	109.2
333	P	31.7	Very low	33.9	Very low	108 Å²	108	147.5 Å²	147.5	70%	0.701	75%	0.751	S	S	*	*			trans	-149.7	150.2	158.5	38.1	-20.6	0	0	0	118.1
334	D	35.2	Very low	34	Very low	139 Å²	139	143.8 Å²	143.8	74%	0.743	74%	0.742	S	S	*	*			trans	-136	155.3	167.9	-75.8	-78.6	0	0	0	110.6
335	V	27.4	Very low	33.8	Very low	117 Å²	117	144.7 Å²	144.7	71%	0.709	75%	0.748	S	S	*	*			cis	109.8	155.1	8.5	-177.3	0	0	0	0	114
336	F	30.1	Very low	33.7	Very low	178 Å²	178	145.5 Å²	145.5	78%	0.781	76%	0.755	S	S	*	*			trans	72.1	145.7	-172.7	-69.7	-98	0	0	0	118.1
337	I	31.3	Very low	33.7	Very low	136 Å²	136	141.1 Å²	141.1	70%	0.697	75%	0.753	S	S	*	*			cis	-157.7	153.5	-37.1	-120	-176.3	0	0	0	109.2
338	P	30.9	Very low	33.7	Very low	118 Å²	118	140.9 Å²	140.9	77%	0.766	76%	0.758	S	S	*	*			trans	-117.6	164.2	175.4	40.3	-31.1	0	0	0	115.9
339	I	33.4	Very low	34	Very low	155 Å²	155	136.7 Å²	136.7	80%	0.795	76%	0.756	S	S	*	*			trans	-140.8	132.4	-179.5	-54.3	178.1	0	0	0	113
340	P	35.7	Very low	34.3	Very low	122 Å²	122	138.6 Å²	138.6	79%	0.792	76%	0.757	S	S	*	*			trans	-140	153.6	171	40.1	-24.6	0	0	0	117.9
341	T	35.5	Very low	34.5	Very low	125 Å²	125	136.6 Å²	136.6	77%	0.767	74%	0.743	S	S	*	*			trans	-149	119.1	178.2	-43.4	0	0	0	0	108.9
342	K	38.4	Very low	34.9	Very low	188 Å²	188	138.7 Å²	138.7	82%	0.817	74%	0.743	S	S	*	*				67.3	140	74.3	-73	-172.8	167.5	-175.9	0	113.8
343	L	37.3	Very low	35.3	Very low	148 Å²	148	141.5 Å²	141.5	78%	0.775	74%	0.743	S	S	*	*			cis	-153.6	-147.3	10.9	-149.9	71.8	0	0	0	114.3
344	P	40.4	Very low	35.7	Very low	99 Å²	99	141 Å²	141	64%	0.643	74%	0.743	S	S	*	*				-132.8	165.8	-116.5	46	-28	0	0	0	123
345	T	33.1	Very low	35.9	Very low	127 Å²	127	143.6 Å²	143.6	78%	0.779	75%	0.747	S	S	*	*				22.7	136.9	128.1	-39.4	0	0	0	0	126
346	I	36.1	Very low	36.4	Very low	157 Å²	157	142.9 Å²	142.9	81%	0.805	75%	0.747	S	S	*	*			trans	-143.9	112.4	144.3	-60.5	-175.8	0	0	0	107.8
347	S	37.3	Very low	36.9	Very low	92 Å²	92	139.2 Å²	139.2	64%	0.643	74%	0.744	S	S	*	*				64.7	138.9	88.1	115	0	0	0	0	115.8
348	K	37.1	Very low	37.2	Very low	198 Å²	198	137.9 Å²	137.9	86%	0.861	75%	0.747	S	S	*	*			cis	-156.8	170	25.4	-124.8	172.7	179.6	179.3	0	113.1
349	P	40.8	Very low	37.6	Very low	113 Å²	113	137.2 Å²	137.2	73%	0.734	74%	0.744	S	S	*	*			trans	-133.7	-154.8	-165.9	45.6	-29.2	0	0	0	117.2
350	E	36.4	Very low	37.8	Very low	159 Å²	159	134.6 Å²	134.6	74%	0.743	74%	0.74	S	S	*	*			trans	105.8	153.5	168.6	-56.8	-131.1	89	0	0	116
351	Q	38.7	Very low	38	Very low	114 Å²	114	134 Å²	134	53%	0.533	74%	0.739	S	S	.	*			cis	-163.2	165.4	1	-131.5	172.3	39.8	0	0	114.9
352	K	36.8	Very low	38.2	Very low	164 Å²	164	132.9 Å²	132.9	71%	0.713	74%	0.736	S	S	*	*			trans	66.4	147.6	149.4	-80.8	163.1	-174.6	155.5	0	120.7
353	R	38.3	Very low	38.2	Very low	214 Å²	214	129 Å²	129	81%	0.808	73%	0.732	S	S	*	*			cis	-170.8	136.9	-13.3	-153.1	-171.6	-165.8	179	2.6	113.6
354	S	39.5	Very low	38.2	Very low	99 Å²	99	126.7 Å²	126.7	69%	0.692	73%	0.729	S	S	*	*			trans	62.2	158.9	149.4	49.2	0	0	0	0	121.2
355	K	38.8	Very low	38.1	Very low	193 Å²	193	127 Å²	127	84%	0.839	73%	0.734	S	S	*	*			cis	-165	153.5	-0.2	-125.3	178	-177.9	-172.6	0	113.1
356	S	39.2	Very low	38.3	Very low	102 Å²	102	127.9 Å²	127.9	71%	0.713	73%	0.733	S	S	*	*			trans	29.6	153.5	144.2	56.9	0	0	0	0	123.9
357	S	39.3	Very low	38.3	Very low	100 Å²	100	125.1 Å²	125.1	70%	0.699	73%	0.728	S	S	*	*			cis	177.9	155.7	-11.1	50.4	0	0	0	0	111.4
358	S	38.5	Very low	38.4	Very low	109 Å²	109	126 Å²	126	76%	0.762	73%	0.734	S	S	*	*			trans	46.5	143.4	151.4	54.7	0	0	0	0	121.9
359	S	39.3	Very low	38.4	Very low	103 Å²	103	120.9 Å²	120.9	72%	0.72	72%	0.724	S	S	*	*			cis	-170.3	174.7	-0.5	49.2	0	0	0	0	112.1
360	S	38.2	Very low	38.3	Very low	100 Å²	100	124.1 Å²	124.1	70%	0.699	73%	0.726	S	S	*	*			trans	69.4	117.4	151.4	49.4	0	0	0	0	123.2
361	S	39.1	Very low	38.3	Very low	111 Å²	111	123.4 Å²	123.4	78%	0.776	72%	0.722	S	S	*	*			trans	81.3	155.1	134.4	54.9	0	0	0	0	124
362	S	39.5	Very low	38	Very low	101 Å²	101	127.8 Å²	127.8	71%	0.706	73%	0.734	S	S	*	*			trans	70.2	93.5	162.4	36.9	0	0	0	0	121.2
363	S	37.8	Very low	37.9	Very low	105 Å²	105	127.9 Å²	127.9	73%	0.734	74%	0.737	S	S	*	*				65.9	141.4	120.4	60.6	0	0	0	0	124.3
364	S	37.4	Very low	37.7	Very low	101 Å²	101	125.8 Å²	125.8	71%	0.706	74%	0.74	S	S	*	*			trans	72	110.8	142.8	52.6	0	0	0	0	121.8
365	S	38.5	Very low	37.3	Very low	106 Å²	106	125.9 Å²	125.9	74%	0.741	74%	0.74	S	S	*	*				92.9	131.5	128.6	-58.8	0	0	0	0	122
366	D	37.8	Very low	37	Very low	144 Å²	144	128.7 Å²	128.7	77%	0.77	75%	0.746	S	S	*	*			trans	72.7	110.3	139.6	-61.7	-19.3	0	0	0	123.7
367	S	36.4	Very low	36.7	Very low	100 Å²	100	132.3 Å²	132.3	70%	0.699	75%	0.751	S	S	*	*				78.9	89.8	117.6	-61.3	0	0	0	0	121.5
368	S	38.1	Very low	36.5	Very low	109 Å²	109	135.7 Å²	135.7	76%	0.762	76%	0.76	S	S	*	*				108.2	142.8	107.5	82.3	0	0	0	0	121.4
369	S	38.9	Very low	36.1	Very low	92 Å²	92	139.8 Å²	139.8	64%	0.643	76%	0.764	S	S	*	*			trans	95.5	130.7	140.6	87.1	0	0	0	0	121.3
370	K	37.1	Very low	35.7	Very low	181 Å²	181	142.1 Å²	142.1	79%	0.787	77%	0.768	S	S	*	*			trans	60.4	133.4	139.5	-67.1	168.8	-177.8	175	0	118.3
371	H	36.3	Very low	35.2	Very low	143 Å²	143	141.8 Å²	141.8	66%	0.662	77%	0.766	S	S	*	*			cis	176.1	165.2	25.8	-123.6	-39.4	0	0	0	110.5
372	R	33.9	Very low	34.6	Very low	207 Å²	207	142 Å²	142	78%	0.781	77%	0.767	S	S	*	*			trans	67.9	114.9	152.8	-68.5	172.4	-176.9	-156.8	-2.8	117.5
373	H	33	Very low	34.2	Very low	166 Å²	166	147 Å²	147	77%	0.769	78%	0.777	S	S	*	*				75.2	118.7	71.4	-91	-83.5	0	0	0	114.8
374	I	35.9	Very low	33.6	Very low	170 Å²	170	148.1 Å²	148.1	87%	0.872	78%	0.784	S	S	*	*				-164.1	143.4	121.4	-98.9	154.2	0	0	0	108.3
375	S	29.3	Very low	33.1	Very low	101 Å²	101	147.1 Å²	147.1	71%	0.706	78%	0.782	S	S	*	*			trans	-103.2	155.8	-176.4	-49.4	0	0	0	0	111.7
376	R	33.9	Very low	32.7	Very low	252 Å²	252	151 Å²	151	95%	0.951	79%	0.788	S	S	*	*			trans	-153.7	148.2	149.8	-116.8	167.7	-175.1	157.2	2.6	111.2
377	E	31.5	Very low	32.3	Very low	178 Å²	178	151.2 Å²	151.2	83%	0.832	79%	0.785	S	S	*	*			trans	-87.6	144.9	-169.4	-59.6	156.5	101.6	0	0	112.1
378	I	35.2	Very low	31.8	Very low	170 Å²	170	150.3 Å²	150.3	87%	0.872	78%	0.783	S	S	*	*			trans	-129.3	126.8	140.2	-62.4	-176.4	0	0	0	106.5
379	K	30	Very low	31.5	Very low	196 Å²	196	149.5 Å²	149.5	85%	0.852	77%	0.771	S	S	*	*			trans	-104.1	108	-176	175.2	-174.6	179.8	-179	0	108.1
380	D	31.1	Very low	31.2	Very low	151 Å²	151	149.2 Å²	149.2	81%	0.807	76%	0.762	S	S	*	*			trans	-143.1	158.6	170.6	-147.7	-14.7	0	0	0	111.9
381	S	27.4	Very low	31.1	Very low	94 Å²	94	143.9 Å²	143.9	66%	0.657	75%	0.747	S	S	*	*			trans	-114.6	163.4	-153.9	-56.3	0	0	0	0	113.9
382	S	28.2	Very low	30.9	Very low	114 Å²	114	140.4 Å²	140.4	80%	0.797	74%	0.736	S	S	*	*			trans	57.3	101.1	168	61.2	0	0	0	0	117.6
383	K	30.8	Very low	31.3	Very low	208 Å²	208	136.2 Å²	136.2	90%	0.904	72%	0.72	S	S	*	*			trans	-150.8	65.1	155.7	-134.9	174	-170.9	179.2	0	114	A385	K383-A385 PolarHBondContact O-N 3.42Å
384	S	25.7	Very low	31.5	Very low	128 Å²	128	130.7 Å²	130.7	90%	0.895	70%	0.698	S	S	*	*			trans	-84.7	84	170.2	53.2	0	0	0	0	110.8
385	A	26.8	Very low	31.6	Very low	80 Å²	80	124.1 Å²	124.1	66%	0.661	66%	0.664	S	S	*	*			trans	-151	160.1	175	0	0	0	0	0	111.5	K383	K383-A385 PolarHBondContact O-N 3.42Å
386	E	29.6	Very low	31.9	Very low	187 Å²	187	128.3 Å²	128.3	87%	0.874	67%	0.665	S	S	*	*			trans	70.1	47.2	169.8	-51.9	-167.2	127.5	0	0	118.7	A388	E386-A388 PolarHBondContact O-N 3.42Å
387	E	28.5	Very low	31.9	Very low	149 Å²	149	118.1 Å²	118.1	70%	0.696	63%	0.629	S	S	*	*			trans	-73.6	80.1	145.4	-155.6	179.9	-135.8	0	0	107	R126	R126-E387 IonicContact CZ-OE1 2.71Å; R126-E387 IonicContact NH1-OE1 3.2Å; R126-E387 PolarHBondContact NH1-OE1 2.77Å; R126-E387 IonicContact NH2-OE1 2.96Å; R126-E387 PolarHBondContact NH2-OE1 3.16Å; R126-E387 IonicContact NH2-OE2 2.98Å; R126-E387 PolarHBondContact NH2-OE2 2.97Å
388	A	26.5	Very low	31.9	Very low	81 Å²	81	115.7 Å²	115.7	67%	0.669	62%	0.622	S	S	*	*			trans	-66.3	134.9	-166.8	0	0	0	0	0	113.9	E386 D390	E386-A388 PolarHBondContact O-N 3.42Å; A388-D390 VanDerWaalsContact C-N 3.28Å; A388-D390 PolarHBondContact O-N 3.25Å
389	D	31.1	Very low	31.7	Very low	92 Å²	92	112 Å²	112	49%	0.492	61%	0.607	S	S	.	*			trans	-75.3	71.5	-175.6	-173.3	10.4	0	0	0	113.4	S391 T392	D389-S391 PolarHBondContact O-N 3.36Å; D389-S391 WeakPolarHBondContact OD1-CB 3.41Å; D389-S391 PolarHBondContact OD1-N 3.39Å; D389-S391 PolarHBondContact OD1-OG 3.2Å; D389-T392 HydrophobicContact CB-CG2 4.38Å; D389-T392 VanDerWaalsContact CG-CG2 3.47Å; D389-T392 PolarHBondContact O-OG1 3.26Å; D389-T392 WeakPolarHBondContact OD2-CG2 3.25Å
390	D	33.1	Very low	31.5	Very low	85 Å²	85	112.1 Å²	112.1	46%	0.455	61%	0.607	S	S	.	*	T	Hydrogen-bonded Turn	trans	-68.2	8.7	177.6	-160	29.5	0	0	0	113.8	K105 A388	K105-D390 VanDerWaalsContact CE-OD2 3.3Å; K105-D390 WeakPolarHBondContact CE-OD2 3.37Å; K105-D390 IonicContact NZ-OD2 2.67Å; K105-D390 PolarHBondContact NZ-OD2 3.35Å; A388-D390 VanDerWaalsContact C-N 3.28Å; A388-D390 PolarHBondContact O-N 3.25Å
391	S	34.4	Very low	31.3	Very low	70 Å²	70	111 Å²	111	49%	0.49	61%	0.606	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.9	-8.8	174.6	78.5	0	0	0	0	113.9	D389 R393	D389-S391 PolarHBondContact O-N 3.36Å; D389-S391 WeakPolarHBondContact OD1-CB 3.41Å; D389-S391 PolarHBondContact OD1-N 3.39Å; D389-S391 PolarHBondContact OD1-OG 3.2Å; S391-R393 PolarHBondContact O-N 3.46Å
392	T	31.9	Very low	31.2	Very low	70 Å²	70	112.4 Å²	112.4	43%	0.429	61%	0.61	S	S	.	*			trans	-94.5	37.9	-155.3	49.4	0	0	0	0	116.8	D389 V394	D389-T392 HydrophobicContact CB-CG2 4.38Å; D389-T392 VanDerWaalsContact CG-CG2 3.47Å; D389-T392 PolarHBondContact O-OG1 3.26Å; D389-T392 WeakPolarHBondContact OD2-CG2 3.25Å; T392-V394 PolarHBondContact O-N 2.62Å
393	R	42.9	Very low	31.1	Very low	118 Å²	118	115.6 Å²	115.6	45%	0.445	61%	0.61	S	S	.	*			trans	-80.9	49.4	-179.7	-67.6	-171.4	173.6	-163	-3.4	115	N259 S391 I395	N259-R393 PolarHBondContact ND2-O 3.12Å; N259-R393 PolarHBondContact OD1-O 2.71Å; S391-R393 PolarHBondContact O-N 3.46Å; R393-I395 PolarHBondContact O-N 2.71Å
394	V	36.9	Very low	31	Very low	51 Å²	51	111.2 Å²	111.2	31%	0.309	60%	0.601	S	S	.	*			trans	-58.4	110.3	-178.6	179.3	0	0	0	0	111.8	S262 T392	S262-V394 VanDerWaalsContact OG-CG1 3.24Å; S262-V394 WeakPolarHBondContact OG-CG1 3.45Å; T392-V394 PolarHBondContact O-N 2.62Å
395	I	39.1	Very low	31.1	Very low	31 Å²	31	116.6 Å²	116.6	16%	0.159	60%	0.602	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-81.1	122.5	176.8	-58.2	173.6	0	0	0	108.8	W146 L261 S262 R393 L397	W146-I395 HydrophobicContact CH2-CD1 3.6Å; W146-I395 HydrophobicContact CZ2-CD1 3.93Å; W146-I395 HydrophobicContact CZ2-CG2 4.16Å; W146-I395 HydrophobicContact CZ3-CD1 4.41Å; L261-I395 HydrophobicContact CD2-CB 3.73Å; L261-I395 HydrophobicContact CD2-CD1 4.01Å; L261-I395 HydrophobicContact CD2-CG1 4.34Å; L261-I395 HydrophobicContact CD2-CG2 4.13Å; S262-I395 PolarHBondContact N-O 2.96Å; R393-I395 PolarHBondContact O-N 2.71Å; I395-L397 HydrophobicContact CG2-CD2 4.03Å; I395-L397 HydrophobicContact CG2-CG 4.3Å
396	R	34.8	Very low	31.4	Very low	189 Å²	189	119.4 Å²	119.4	71%	0.713	61%	0.605	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-96	116.6	177.9	-65.3	178.1	179.6	175.9	0.7	110.1
397	L	33.8	Very low	31.5	Very low	39 Å²	39	115.6 Å²	115.6	20%	0.204	61%	0.605	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-103.8	112.8	179.3	-62	171	0	0	0	110.2	L214 L261 S262 L263 I395 V399	L214-L397 HydrophobicContact CD2-CD1 3.56Å; L214-L397 HydrophobicContact CD2-CD2 3.69Å; L214-L397 HydrophobicContact CD2-CG 4.28Å; L214-L397 HydrophobicContact CG-CD1 4.16Å; L261-L397 HydrophobicContact CB-CD1 4.32Å; L261-L397 HydrophobicContact CD1-CD1 3.94Å; L261-L397 HydrophobicContact CD2-CD1 4.36Å; L261-L397 HydrophobicContact CG-CD1 4.43Å; S262-L397 PolarHBondContact O-N 3.46Å; L263-L397 HydrophobicContact CD1-CB 4.49Å; I395-L397 HydrophobicContact CG2-CD2 4.03Å; I395-L397 HydrophobicContact CG2-CG 4.3Å; L397-V399 PolarHBondContact O-N 2.91Å
398	N	32.8	Very low	31.7	Very low	127 Å²	127	112 Å²	112	68%	0.679	60%	0.6	S	S	*	*			trans	-90.2	84.7	174.5	-66.3	-23.3	0	0	0	109.3	K400	N398-K400 PolarHBondContact O-N 2.98Å
399	V	30.7	Very low	32	Very low	92 Å²	92	115.6 Å²	115.6	56%	0.558	61%	0.608	S	S	*	*			trans	-78.5	111.9	177.7	180	0	0	0	0	109.7	L263 L397 V401	L263-V399 HydrophobicContact CD1-CB 4.41Å; L263-V399 HydrophobicContact CD1-CG2 3.67Å; L397-V399 PolarHBondContact O-N 2.91Å; V399-V401 PolarHBondContact O-N 3.41Å; V399-V401 VanDerWaalsContact O-N 3.15Å
400	K	26.3	Very low	32.2	Very low	198 Å²	198	119.5 Å²	119.5	86%	0.861	63%	0.628	S	S	*	*			trans	-69.2	107.9	164.2	-84.1	-171.9	174	-178.2	0	108.7	N398 V402	N398-K400 PolarHBondContact O-N 2.98Å; K400-V402 PolarHBondContact O-N 3.29Å
401	V	26.2	Very low	32.1	Very low	128 Å²	128	125.9 Å²	125.9	78%	0.776	65%	0.645	S	S	*	*			trans	-63.2	107.6	170.9	-179.2	0	0	0	0	108.6	V399 K403	V399-V401 PolarHBondContact O-N 3.41Å; V399-V401 VanDerWaalsContact O-N 3.15Å; V401-K403 PolarHBondContact O-N 2.8Å; V401-K403 VanDerWaalsContact O-N 3.14Å
402	V	26.3	Very low	32	Very low	124 Å²	124	132 Å²	132	75%	0.752	66%	0.664	S	S	*	*			trans	-71	107.4	175.1	179.2	0	0	0	0	108.1	K400 T404	K400-V402 PolarHBondContact O-N 3.29Å; V402-T404 PolarHBondContact O-N 3.49Å
403	K	25.8	Very low	32.1	Very low	180 Å²	180	136.6 Å²	136.6	78%	0.783	69%	0.685	S	S	*	*			trans	-57.1	112	168.4	-71.8	-176.3	178.1	179	0	108.5	V401 R405	V401-K403 PolarHBondContact O-N 2.8Å; V401-K403 VanDerWaalsContact O-N 3.14Å; K403-R405 PolarHBondContact O-N 2.7Å
404	T	27.1	Very low	31.6	Very low	117 Å²	117	140.5 Å²	140.5	72%	0.718	71%	0.706	S	S	*	*			trans	-62.4	129	175.4	30.5	0	0	0	0	110.1	V402 L406	V402-T404 PolarHBondContact O-N 3.49Å; T404-L406 VanDerWaalsContact C-N 3.26Å; T404-L406 PolarHBondContact O-N 3.3Å
405	R	29.1	Very low	31.4	Very low	241 Å²	241	144.1 Å²	144.1	91%	0.909	73%	0.728	S	S	*	*			trans	-74.2	72.6	177.9	-77.6	-177	166.6	-175.8	-3.7	111.3	K403	K403-R405 PolarHBondContact O-N 2.7Å
406	L	32.3	Very low	31.1	Very low	139 Å²	139	152 Å²	152	73%	0.728	76%	0.761	S	S	*	*			trans	-90	-12	168.9	-104.4	77.4	0	0	0	113.9	T404 A408	T404-L406 VanDerWaalsContact C-N 3.26Å; T404-L406 PolarHBondContact O-N 3.3Å; L406-A408 PolarHBondContact O-N 2.82Å
407	A	31.4	Very low	31	Very low	106 Å²	106	153.4 Å²	153.4	88%	0.876	77%	0.766	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.2	18.3	179.1	0	0	0	0	0	115.1
408	A	32.8	Very low	31	Very low	73 Å²	73	156.8 Å²	156.8	60%	0.603	79%	0.79	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.6	-10.3	-173.5	0	0	0	0	0	114.6	L406	L406-A408 PolarHBondContact O-N 2.82Å
409	L	34	Very low	31.1	Very low	157 Å²	157	157.7 Å²	157.7	82%	0.822	79%	0.791	S	S	*	*	S	Bend	trans	-110.6	7.4	-170.2	-82.6	164.7	0	0	0	115.6
410	L	34.2	Very low	31.5	Very low	174 Å²	174	161.2 Å²	161.2	91%	0.911	80%	0.801	S	S	*	*			trans	-115	45.9	176.8	-66.8	175.5	0	0	0	112.3
411	R	31	Very low	31.8	Very low	220 Å²	220	158 Å²	158	83%	0.83	80%	0.8	S	S	*	*			trans	-117.9	33.6	-179.9	-82.9	-166	173.9	-165.8	0.1	114.7
412	F	33.8	Very low	32.3	Very low	199 Å²	199	154.9 Å²	154.9	87%	0.873	79%	0.793	S	S	*	*			trans	-134.6	83.2	171.2	-81.1	-75.2	0	0	0	113
413	N	33.8	Very low	32.6	Very low	165 Å²	165	154.8 Å²	154.8	88%	0.882	80%	0.798	S	S	*	*			trans	178.6	125.4	133.1	-91.6	-22.9	0	0	0	109.5
414	K	31.5	Very low	32.8	Very low	201 Å²	201	151 Å²	151	87%	0.874	80%	0.795	S	S	*	*			trans	-155	86.6	-171.1	-162.1	-172.6	-174.4	-170.2	0	113.9
415	T	33	Very low	33.2	Very low	127 Å²	127	150.9 Å²	150.9	78%	0.779	80%	0.798	S	S	*	*			trans	-174	140.5	-178.3	15.9	0	0	0	0	107.9
416	K	32.7	Very low	33.3	Very low	196 Å²	196	144.1 Å²	144.1	85%	0.852	79%	0.788	S	S	*	*			cis	-146.4	164.9	-12.3	-53.3	167.3	-175.9	168.5	0	105
417	R	32.7	Very low	33.2	Very low	219 Å²	219	142.3 Å²	142.3	83%	0.826	79%	0.787	S	S	*	*			cis	-156.7	152.4	-8.4	-143.3	-167.7	-171.7	-172.9	4.2	106.2
418	P	32.7	Very low	33.4	Very low	109 Å²	109	145.8 Å²	145.8	71%	0.708	79%	0.79	S	S	*	*			trans	-110.5	144.9	-170.5	38.2	-30.4	0	0	0	116.1
419	H	35.8	Very low	33.1	Very low	147 Å²	147	145.7 Å²	145.7	68%	0.681	80%	0.796	S	S	*	*			trans	-162.5	152.1	167.9	-61.8	-75.1	0	0	0	107.5
420	H	38.2	Very low	33.1	Very low	166 Å²	166	147.8 Å²	147.8	77%	0.769	80%	0.802	S	S	*	*			cis	-154.9	145.7	-27.7	-96.2	-58.8	0	0	0	108.1
421	P	33.4	Very low	32.8	Very low	130 Å²	130	147.6 Å²	147.6	84%	0.844	80%	0.796	S	S	*	*			trans	-108.2	154.9	-176.6	38.7	-32.9	0	0	0	116
422	G	36.2	Very low	32.8	Very low	62 Å²	62	145 Å²	145	64%	0.639	80%	0.797	S	S	*	*			trans	-153.2	135.6	161.5	0	0	0	0	0	108.6
423	S	33.3	Very low	32.8	Very low	122 Å²	122	144 Å²	144	85%	0.853	79%	0.792	S	S	*	*				72	130	77.1	-58	0	0	0	0	112.9
424	S	30.7	Very low	32.6	Very low	102 Å²	102	141.2 Å²	141.2	71%	0.713	78%	0.783	S	S	*	*			cis	174.5	171.8	-18.1	38.6	0	0	0	0	108.4
425	S	35	Very low	32.6	Very low	113 Å²	113	142.2 Å²	142.2	79%	0.79	78%	0.783	S	S	*	*			trans	69.3	172.9	170.4	78.6	0	0	0	0	117.6
426	S	30.3	Very low	32.7	Very low	99 Å²	99	141.9 Å²	141.9	69%	0.692	78%	0.783	S	S	*	*				-171.8	149.1	-77.4	49.6	0	0	0	0	112.2
427	S	31.5	Very low	32.6	Very low	101 Å²	101	140.8 Å²	140.8	71%	0.706	79%	0.786	S	S	*	*			trans	49.6	119.2	153.3	61.5	0	0	0	0	120.7
428	L	33.9	Very low	32.8	Very low	180 Å²	180	136.3 Å²	136.3	94%	0.942	79%	0.785	S	S	*	*				-179.5	167.1	114.6	-95.7	154.8	0	0	0	109.9
429	G	27.6	Very low	32.9	Very low	71 Å²	71	139 Å²	139	73%	0.732	79%	0.793	S	S	*	*			trans	-153.1	163.3	178.3	0	0	0	0	0	111.1
430	E	33.7	Very low	32.7	Very low	200 Å²	200	143.2 Å²	143.2	94%	0.935	80%	0.803	S	S	*	*			trans	-150.5	160.3	-173.3	-153.9	164	-164.3	0	0	111.2
431	E	27.2	Very low	32.6	Very low	170 Å²	170	141.3 Å²	141.3	79%	0.794	81%	0.806	S	S	*	*			trans	-130.8	131.8	-162.1	-179.2	-163.5	151.7	0	0	111.5
432	I	32.2	Very low	32.6	Very low	166 Å²	166	145.4 Å²	145.4	85%	0.851	81%	0.81	S	S	*	*			trans	-138.2	152.5	179.3	-59	-175.9	0	0	0	111.4
433	K	33.9	Very low	33	Very low	177 Å²	177	145.8 Å²	145.8	77%	0.77	81%	0.814	S	S	*	*			trans	-93.2	157.7	-164.7	-77	174.6	176.4	171.7	0	116.4
434	P	29.1	Very low	33.5	Very low	107 Å²	107	146 Å²	146	70%	0.695	81%	0.813	S	S	*	*			trans	-87.8	171.6	-177.1	36.7	-38.9	0	0	0	115.7
435	Y	31.7	Very low	34.2	Very low	222 Å²	222	145.5 Å²	145.5	87%	0.871	81%	0.805	S	S	*	*			trans	-128	162.8	178.8	-86.5	-93.6	0	0	0	113.3
436	P	34.3	Very low	35.2	Very low	121 Å²	121	146.1 Å²	146.1	79%	0.786	80%	0.798	S	S	*	*			trans	-99.9	174.1	-162.8	38.8	-36.8	0	0	0	117.4
437	L	31.3	Very low	35.9	Very low	172 Å²	172	144.5 Å²	144.5	90%	0.901	79%	0.786	S	S	*	*			trans	-102.7	154.1	-174.1	-69.5	167.5	0	0	0	115.2
438	P	36.1	Very low	36.9	Very low	125 Å²	125	142.9 Å²	142.9	81%	0.812	77%	0.774	S	S	*	*			trans	-114.4	-177.1	168.5	39.9	-30.7	0	0	0	116.1
439	D	36.3	Very low	37.9	Very low	165 Å²	165	135.4 Å²	135.4	88%	0.882	74%	0.74	S	S	*	*			trans	-89.1	174.3	-147.2	-100.5	-62.8	0	0	0	122.3
440	R	31.5	Very low	39.1	Very low	237 Å²	237	136.4 Å²	136.4	89%	0.894	73%	0.733	S	S	*	*			trans	-86.3	142.9	175.5	-78	179.8	168.7	-177.7	-2.6	115.2
441	P	36.2	Very low	39.9	Very low	126 Å²	126	129 Å²	129	82%	0.818	71%	0.711	S	S	*	*			trans	-99.2	165.6	158.1	3.8	16.9	0	0	0	114.2
442	K	31.9	Very low	41.3	Very low	215 Å²	215	126 Å²	126	94%	0.935	70%	0.697	S	S	*	*			trans	-108.3	151.5	179.8	-58.5	169.5	-176.4	172.2	0	111.1
443	G	45.3	Very low	42.1	Very low	71 Å²	71	126.6 Å²	126.6	73%	0.732	69%	0.688	S	S	*	*			trans	-170.4	156.9	174.3	0	0	0	0	0	114.6
444	P	43.4	Very low	42.9	Very low	125 Å²	125	120 Å²	120	81%	0.812	66%	0.664	S	S	*	*			trans	-81.9	166.8	-173.6	33.7	-36.6	0	0	0	114.5
445	V	46.4	Very low	44.1	Very low	93 Å²	93	119.7 Å²	119.7	56%	0.564	66%	0.66	S	S	*	*			trans	-78.8	136.8	-179.9	-179.7	0	0	0	0	111.3	P454 I458	V445-P454 HydrophobicContact CG1-CB 4.14Å; V445-I458 HydrophobicContact CG2-CD1 4.1Å
446	I	54.7	Low	44.9	Very low	125 Å²	125	117.4 Å²	117.4	64%	0.641	65%	0.654	S	S	*	*			trans	-111.5	123.1	178.2	-58.3	171.9	0	0	0	109.3	V455	I446-V455 PolarHBondContact O-N 2.9Å
447	C	46.4	Very low	45.3	Very low	65 Å²	65	117.6 Å²	117.6	44%	0.439	66%	0.655	S	S	.	*			trans	-98.7	130.2	170.7	-80.6	0	0	0	0	109.8	C468	C447-C468 HydrophobicContact CB-CB 3.79Å; C447-C468 WeakPolarHBondContact CB-SG 3.46Å; C447-C468 WeakPolarHBondContact SG-CB 3.24Å; C447-C468 CovalentContact SG-SG 2.04Å; C447-C468 PolarHBondContact SG-SG 3.4Å
448	P	51.6	Low	46	Very low	68 Å²	68	115.6 Å²	115.6	44%	0.442	64%	0.644	S	S	.	*	S	Bend	trans	-83	-10.4	-178.5	32.1	-32.6	0	0	0	113.9	Q452 V455	P448-Q452 HydrophobicContact CG-CB 3.88Å; P448-Q452 VanDerWaalsContact CG-OE1 3.31Å; P448-V455 HydrophobicContact CB-CG2 4.27Å; P448-V455 HydrophobicContact CG-CG2 4.02Å
449	G	55.4	Low	46	Very low	22 Å²	22	114.4 Å²	114.4	23%	0.227	64%	0.637	C	S	.	*	S	Bend	trans	173.4	166.5	173.6	0	0	0	0	0	112.1	Q452	G449-Q452 PolarHBondContact O-N 3.07Å
450	P	53.5	Low	46	Very low	92 Å²	92	114.5 Å²	114.5	60%	0.597	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.4	138.7	172.4	-21.6	33.2	0	0	0	110.9	Q452 T470	P450-Q452 PolarHBondContact O-N 2.7Å; P450-Q452 VanDerWaalsContact O-N 3.15Å; P450-T470 HydrophobicContact CB-CG2 4.19Å
451	G	49.6	Very low	46.3	Very low	45 Å²	45	107.8 Å²	107.8	46%	0.464	63%	0.626	S	S	.	*	T	Hydrogen-bonded Turn	trans	72.3	-2	179.1	0	0	0	0	0	115.7	V467 C468	G451-V467 WeakPolarHBondContact O-CG1 3.4Å; G451-C468 PolarHBondContact N-O 3.02Å
452	Q	56.4	Low	46.2	Very low	108 Å²	108	107 Å²	107	51%	0.505	62%	0.624	S	S	.	*	P	Polyproline II helix	trans	-88.9	166.3	175.5	-63.1	-159.8	6.9	0	0	112.5	P448 G449 P450 C468	P448-Q452 HydrophobicContact CG-CB 3.88Å; P448-Q452 VanDerWaalsContact CG-OE1 3.31Å; G449-Q452 PolarHBondContact O-N 3.07Å; P450-Q452 PolarHBondContact O-N 2.7Å; P450-Q452 VanDerWaalsContact O-N 3.15Å; Q452-C468 VanDerWaalsContact O-CB 3.27Å; Q452-C468 WeakPolarHBondContact O-CB 3.33Å; Q452-C468 PolarHBondContact O-N 2.8Å; Q452-C468 PolarHBondContact O-SG 3.14Å
453	R	49.2	Very low	46.5	Very low	178 Å²	178	102.3 Å²	102.3	67%	0.672	62%	0.618	S	S	*	*	P	Polyproline II helix	trans	-84.8	141.7	178	-142.5	177.5	-161.7	-178.8	6	110.1
454	P	50.9	Low	46.3	Very low	39 Å²	39	101.6 Å²	101.6	25%	0.253	61%	0.611	S	S	.	*	P	Polyproline II helix	trans	-57.7	142.4	176.3	-26.2	34.7	0	0	0	113.4	V445 K456	V445-P454 HydrophobicContact CG1-CB 4.14Å; P454-K456 PolarHBondContact O-N 3.03Å
455	V	54.6	Low	46.5	Very low	100 Å²	100	98.6 Å²	98.6	61%	0.606	59%	0.59	S	S	*	*	S	Bend	trans	-68.7	-17.5	-171.1	-173	0	0	0	0	113.7	I446 P448	I446-V455 PolarHBondContact O-N 2.9Å; P448-V455 HydrophobicContact CB-CG2 4.27Å; P448-V455 HydrophobicContact CG-CG2 4.02Å
456	K	47.3	Very low	46.7	Very low	174 Å²	174	99.7 Å²	99.7	76%	0.757	59%	0.592	S	S	*	*	S	Bend	trans	-135.2	129.2	170.2	-82.6	-178.7	173.8	175.5	0	110.5	P454	P454-K456 PolarHBondContact O-N 3.03Å
457	P	42.4	Very low	46.5	Very low	124 Å²	124	97.6 Å²	97.6	81%	0.805	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-72.2	134.5	164.7	30.8	-32.2	0	0	0	109.8
458	I	46	Very low	46.5	Very low	130 Å²	130	94.8 Å²	94.8	67%	0.667	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-80.4	139.3	164.1	-53.7	175.8	0	0	0	106.2	V445	V445-I458 HydrophobicContact CG2-CD1 4.1Å
459	P	36.1	Very low	46.3	Very low	101 Å²	101	95.6 Å²	95.6	66%	0.656	57%	0.571	S	S	*	*	S	Bend	trans	-61.4	161.1	169.4	28.1	-35.1	0	0	0	110.9
460	D	37	Very low	46.1	Very low	166 Å²	166	98.2 Å²	98.2	89%	0.888	58%	0.583	S	S	*	*			trans	67	66	176	-48.8	-31.6	0	0	0	115.6
461	S	37.6	Very low	45.5	Very low	96 Å²	96	99 Å²	99	67%	0.671	59%	0.588	S	S	*	*			trans	-139.2	111.5	146.1	-172.6	0	0	0	0	111
462	S	34.9	Very low	45.5	Very low	111 Å²	111	104.6 Å²	104.6	78%	0.776	61%	0.607	S	S	*	*			trans	-89.9	129.1	170	54.9	0	0	0	0	110.2
463	S	36.8	Very low	44.7	Very low	115 Å²	115	105.2 Å²	105.2	80%	0.804	61%	0.614	S	S	*	*	S	Bend	trans	77.7	135.4	-174.1	80.1	0	0	0	0	115.8
464	G	42.7	Very low	44.4	Very low	57 Å²	57	101.1 Å²	101.1	59%	0.588	62%	0.618	S	S	*	*			trans	94.7	158.7	178.4	0	0	0	0	0	115.7
465	V	46.9	Very low	43.8	Very low	61 Å²	61	104.6 Å²	104.6	37%	0.37	64%	0.639	S	S	.	*			trans	-119	117.4	166.9	175.8	0	0	0	0	108
466	L	49.8	Very low	43.1	Very low	116 Å²	116	107.1 Å²	107.1	61%	0.607	64%	0.644	S	S	*	*			trans	-77.5	131.9	175	-73.4	164.6	0	0	0	111.1
467	V	51.3	Low	42.9	Very low	82 Å²	82	104.9 Å²	104.9	50%	0.497	64%	0.639	S	S	.	*			trans	-121.3	138.5	176.2	-179.7	0	0	0	0	108	G451	G451-V467 WeakPolarHBondContact O-CG1 3.4Å
468	C	45.9	Very low	42.7	Very low	5 Å²	5	103.1 Å²	103.1	3%	0.034	63%	0.625	C	S	.	*	P	Polyproline II helix	trans	-65.4	126	176.8	-67.8	0	0	0	0	110	C447 G451 Q452	C447-C468 HydrophobicContact CB-CB 3.79Å; C447-C468 WeakPolarHBondContact CB-SG 3.46Å; C447-C468 WeakPolarHBondContact SG-CB 3.24Å; C447-C468 CovalentContact SG-SG 2.04Å; C447-C468 PolarHBondContact SG-SG 3.4Å; G451-C468 PolarHBondContact N-O 3.02Å; Q452-C468 VanDerWaalsContact O-CB 3.27Å; Q452-C468 WeakPolarHBondContact O-CB 3.33Å; Q452-C468 PolarHBondContact O-N 2.8Å; Q452-C468 PolarHBondContact O-SG 3.14Å
469	P	48.2	Very low	42.1	Very low	86 Å²	86	102 Å²	102	56%	0.558	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-63	146.4	-169.7	24.8	-34.6	0	0	0	112.6
470	T	51.4	Low	41.9	Very low	77 Å²	77	104 Å²	104	47%	0.472	63%	0.631	S	S	.	*	P	Polyproline II helix	trans	-82	152.2	170.4	47.9	0	0	0	0	110.5	P450 N472	P450-T470 HydrophobicContact CB-CG2 4.19Å; T470-N472 PolarHBondContact O-N 3.33Å
471	P	40.2	Very low	41.8	Very low	107 Å²	107	101.2 Å²	101.2	70%	0.695	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74	77.1	178.2	31.4	-35.4	0	0	0	111
472	N	49.3	Very low	41.7	Very low	163 Å²	163	103.4 Å²	103.4	87%	0.872	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	173.4	-6.9	148.8	-90.2	-12.8	0	0	0	114.4	T470	T470-N472 PolarHBondContact O-N 3.33Å
473	N	41.1	Very low	41.5	Very low	122 Å²	122	102.6 Å²	102.6	65%	0.652	62%	0.624	S	S	*	*			trans	-121.1	146.8	179.4	-93.6	-7.7	0	0	0	113.5
474	A	41.2	Very low	41	Very low	92 Å²	92	104.8 Å²	104.8	76%	0.76	63%	0.625	S	S	*	*			trans	-74.3	169.3	176	0	0	0	0	0	112.4	E476	A474-E476 PolarHBondContact O-N 3.26Å
475	V	39	Very low	40.5	Very low	112 Å²	112	107.6 Å²	107.6	68%	0.679	63%	0.634	S	S	*	*			trans	-59.6	104.1	-172.3	-177.5	0	0	0	0	112.1
476	E	40.6	Very low	39.5	Very low	153 Å²	153	111.9 Å²	111.9	72%	0.715	66%	0.66	S	S	*	*			trans	-95.2	113.8	177.7	-169.6	166.2	-135	0	0	110.6	A474 V478	A474-E476 PolarHBondContact O-N 3.26Å; E476-V478 VanDerWaalsContact C-N 3.35Å; E476-V478 HydrophobicContact CG-CG2 4.47Å; E476-V478 PolarHBondContact O-N 3.28Å
477	I	42.1	Very low	38.4	Very low	127 Å²	127	110.4 Å²	110.4	65%	0.651	67%	0.665	S	S	*	*			trans	-80.1	86.5	174.5	-56.2	176.7	0	0	0	107.9	P479	I477-P479 WeakPolarHBondContact O-CD 3.49Å
478	V	38.4	Very low	37.3	Very low	86 Å²	86	115.1 Å²	115.1	52%	0.521	68%	0.681	S	S	.	*			trans	-60.7	114.7	178	-177.6	0	0	0	0	109.9	E476	E476-V478 VanDerWaalsContact C-N 3.35Å; E476-V478 HydrophobicContact CG-CG2 4.47Å; E476-V478 PolarHBondContact O-N 3.28Å
479	P	33.2	Very low	36.3	Very low	107 Å²	107	124.3 Å²	124.3	70%	0.695	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-70.4	136.5	170.5	-10.8	28.2	0	0	0	108.5	I477 P481	I477-P479 WeakPolarHBondContact O-CD 3.49Å; P479-P481 WeakPolarHBondContact O-CD 3.49Å
480	L	32.8	Very low	35.7	Very low	143 Å²	143	125.1 Å²	125.1	75%	0.749	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-65.8	123.4	169.8	-99.2	74.8	0	0	0	108.7
481	P	34.1	Very low	34.5	Very low	108 Å²	108	126.5 Å²	126.5	70%	0.701	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-72.7	156	-177.9	31.1	-36.3	0	0	0	111.4	P479 P483	P479-P481 WeakPolarHBondContact O-CD 3.49Å; P481-P483 VanDerWaalsContact C-CD 3.4Å; P481-P483 VanDerWaalsContact O-CD 3.27Å; P481-P483 WeakPolarHBondContact O-CD 3.21Å
482	T	36.6	Very low	33.8	Very low	141 Å²	141	126.3 Å²	126.3	87%	0.865	74%	0.736	S	S	*	*			trans	-111.7	85.6	172.7	52.7	0	0	0	0	112.5
483	P	29.2	Very low	32.7	Very low	94 Å²	94	123.3 Å²	123.3	61%	0.61	73%	0.728	S	S	*	*			trans	-107.9	123.3	161.1	35.1	-24.8	0	0	0	110.1	P481	P481-P483 VanDerWaalsContact C-CD 3.4Å; P481-P483 VanDerWaalsContact O-CD 3.27Å; P481-P483 WeakPolarHBondContact O-CD 3.21Å
484	L	26.4	Very low	32	Very low	161 Å²	161	124.9 Å²	124.9	84%	0.843	74%	0.735	S	S	*	*				87.2	135.3	70.3	-77.9	166.8	0	0	0	112.9
485	P	32	Very low	31.3	Very low	117 Å²	117	128.6 Å²	128.6	76%	0.76	74%	0.737	S	S	*	*			trans	-99.8	136.2	-168.6	36.8	-32.8	0	0	0	114.2
486	T	27.7	Very low	30.8	Very low	151 Å²	151	127.9 Å²	127.9	93%	0.926	74%	0.743	S	S	*	*			trans	-147.2	163	165.4	-21.2	0	0	0	0	110.2
487	A	26.5	Very low	30.2	Very low	85 Å²	85	126.7 Å²	126.7	70%	0.702	75%	0.746	S	S	*	*			trans	-112.6	-153.9	-166.1	0	0	0	0	0	113.5
488	E	27.5	Very low	29.4	Very low	180 Å²	180	127.5 Å²	127.5	84%	0.841	75%	0.752	S	S	*	*			trans	94	78.8	164.8	-53.3	-163.7	126.6	0	0	120.1
489	Y	24.8	Very low	28.8	Very low	198 Å²	198	131.4 Å²	131.4	78%	0.776	77%	0.766	S	S	*	*				62.8	174.6	112.5	-95.9	-53.1	0	0	0	121	T589	Y489-T589 HydrophobicContact CE2-CG2 4.04Å
490	P	36.6	Very low	28.5	Very low	104 Å²	104	132 Å²	132	68%	0.675	77%	0.767	S	S	*	*				-121.2	176.9	-126.1	45.7	-33.1	0	0	0	115.5
491	S	25.4	Very low	28.2	Very low	105 Å²	105	132.3 Å²	132.3	73%	0.734	77%	0.768	S	S	*	*				167.2	161.5	114.2	50.1	0	0	0	0	115.5
492	S	25.4	Very low	27.7	Very low	103 Å²	103	133.6 Å²	133.6	72%	0.72	77%	0.768	S	S	*	*			trans	72.5	144.6	147.4	54.7	0	0	0	0	123.8
493	S	25.4	Very low	27.2	Very low	101 Å²	101	132 Å²	132	71%	0.706	76%	0.76	S	S	*	*			trans	59.6	110.3	147.4	55.2	0	0	0	0	122.2
494	L	26.9	Very low	27	Very low	155 Å²	155	132.8 Å²	132.8	81%	0.812	77%	0.769	S	S	*	*				45.1	144.6	108.3	-82.4	155.1	0	0	0	122.2
495	E	27.5	Very low	27.1	Very low	169 Å²	169	132.9 Å²	132.9	79%	0.79	77%	0.769	S	S	*	*			trans	76	88.9	152.8	-70.9	178.2	-164.9	0	0	121.9
496	A	28	Very low	26.9	Very low	98 Å²	98	132.9 Å²	132.9	81%	0.81	77%	0.769	S	S	*	*				75.8	-171.4	121	0	0	0	0	0	120.5
497	V	27.1	Very low	26.8	Very low	127 Å²	127	135.6 Å²	135.6	77%	0.77	77%	0.768	S	S	*	*			trans	71.5	90.4	174.9	-163.7	0	0	0	0	118.4
498	N	26.9	Very low	26.9	Very low	145 Å²	145	142 Å²	142	78%	0.775	78%	0.775	S	S	*	*				36.5	142.1	128.4	-68.7	-16.1	0	0	0	123.7
499	M	25.7	Very low	27.1	Very low	167 Å²	167	139.2 Å²	139.2	82%	0.823	77%	0.767	S	S	*	*			trans	72.8	142.1	145.8	-67.8	-93	-80.3	0	0	118.4
500	V	25.9	Very low	27.4	Very low	119 Å²	119	138.3 Å²	138.3	72%	0.721	77%	0.771	S	S	*	*			cis	-116.9	-113.1	-19.9	-149.7	0	0	0	0	108.2
501	I	26.7	Very low	27.1	Very low	151 Å²	151	137.3 Å²	137.3	77%	0.774	77%	0.767	S	S	*	*			cis	-124.4	151.9	-35.2	-48.6	163.6	0	0	0	106.1
502	L	23.3	Very low	27.7	Very low	134 Å²	134	138.8 Å²	138.8	70%	0.702	77%	0.766	S	S	*	*			trans	-132.4	116.5	176.7	-92.2	162.6	0	0	0	112.8
503	P	26.5	Very low	28	Very low	107 Å²	107	142.1 Å²	142.1	70%	0.695	77%	0.771	S	S	*	*			trans	-69.6	143.2	163.6	-18	32.4	0	0	0	111.6
504	S	25.4	Very low	28	Very low	112 Å²	112	143.3 Å²	143.3	78%	0.783	77%	0.774	S	S	*	*			trans	-86.9	152	172.5	45.9	0	0	0	0	111.6
505	L	27.4	Very low	28.1	Very low	163 Å²	163	143.1 Å²	143.1	85%	0.853	77%	0.772	S	S	*	*			trans	-123.9	155.4	165.7	-75.8	174.3	0	0	0	108.8
506	P	27.6	Very low	28.1	Very low	117 Å²	117	139.8 Å²	139.8	76%	0.76	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-71.4	152.9	-160.4	-19.9	33.8	0	0	0	113.9
507	K	27.2	Very low	28.2	Very low	208 Å²	208	139.3 Å²	139.3	90%	0.904	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-70	135.9	160.2	-65.6	-177.5	177	-175.8	0	108.6
508	Y	28.4	Very low	28.1	Very low	218 Å²	218	142 Å²	142	86%	0.855	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-103.7	141.3	155.2	-120.6	-92.8	0	0	0	107.8
509	D	30.1	Very low	28.1	Very low	123 Å²	123	142.8 Å²	142.8	66%	0.658	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-91.7	151.2	173.2	-167.2	17.4	0	0	0	109.9	S511	D509-S511 WeakPolarHBondContact OD2-CB 3.47Å; D509-S511 PolarHBondContact OD2-OG 2.66Å
510	M	32.5	Very low	28.1	Very low	178 Å²	178	142.2 Å²	142.2	88%	0.877	76%	0.755	S	S	*	*			trans	-136.8	54.6	178	-58.3	-160.4	-40.5	0	0	109.2
511	S	30.6	Very low	28.1	Very low	83 Å²	83	145 Å²	145	58%	0.58	76%	0.764	S	S	*	*			trans	-77.3	-23.8	-173	22	0	0	0	0	113.7	D509	D509-S511 WeakPolarHBondContact OD2-CB 3.47Å; D509-S511 PolarHBondContact OD2-OG 2.66Å
512	D	36.5	Very low	27.9	Very low	136 Å²	136	143.6 Å²	143.6	73%	0.727	76%	0.758	S	S	*	*	S	Bend	trans	-98.7	142	176.5	-67.3	-40	0	0	0	112.2
513	Q	31.4	Very low	28.1	Very low	173 Å²	173	143.9 Å²	143.9	81%	0.808	77%	0.765	S	S	*	*			trans	-100.6	-179.6	-167.1	-61	-176.8	3	0	0	113.7
514	T	26.7	Very low	27.9	Very low	127 Å²	127	150.3 Å²	150.3	78%	0.779	78%	0.775	S	S	*	*			trans	79	73.4	164.5	68.4	0	0	0	0	118.5
515	I	29.3	Very low	27.8	Very low	150 Å²	150	151.7 Å²	151.7	77%	0.769	77%	0.774	S	S	*	*			trans	-128.8	141.5	143.3	-32.6	178.7	0	0	0	108.4	D517	I515-D517 WeakPolarHBondContact CB-OD2 3.43Å; I515-D517 WeakPolarHBondContact CG2-OD2 3.1Å; I515-D517 PolarHBondContact O-N 3.18Å
516	A	27.6	Very low	27.7	Very low	100 Å²	100	152 Å²	152	83%	0.826	78%	0.777	S	S	*	*			trans	-102.1	48	-159	0	0	0	0	0	113.3
517	D	29.5	Very low	27.6	Very low	87 Å²	87	153.6 Å²	153.6	47%	0.465	78%	0.777	S	S	.	*			trans	-98.7	117	-154.7	-58.3	-46.9	0	0	0	115.8	I515 E519	I515-D517 WeakPolarHBondContact CB-OD2 3.43Å; I515-D517 WeakPolarHBondContact CG2-OD2 3.1Å; I515-D517 PolarHBondContact O-N 3.18Å; D517-E519 HydrophobicContact CB-CB 3.82Å; D517-E519 HydrophobicContact CB-CG 3.93Å; D517-E519 PolarHBondContact O-N 3.18Å
518	H	25.5	Very low	27.4	Very low	185 Å²	185	150.3 Å²	150.3	86%	0.856	77%	0.774	S	S	*	*			trans	-86.6	66.4	145.2	-72.4	60.7	0	0	0	107.8	H520	H518-H520 PolarHBondContact O-N 3.44Å
519	E	25.9	Very low	27.2	Very low	161 Å²	161	143.3 Å²	143.3	75%	0.752	77%	0.768	S	S	*	*			trans	-63.3	130	-163.2	-131.5	-174.1	173.6	0	0	112.7	D517	D517-E519 HydrophobicContact CB-CB 3.82Å; D517-E519 HydrophobicContact CB-CG 3.93Å; D517-E519 PolarHBondContact O-N 3.18Å
520	H	25.2	Very low	26.9	Very low	154 Å²	154	146.1 Å²	146.1	71%	0.713	78%	0.777	S	S	*	*			trans	-78.5	123.7	-178	-69	-119.5	0	0	0	110	H518 L522	H518-H520 PolarHBondContact O-N 3.44Å; H520-L522 HydrophobicContact CB-CD1 3.77Å; H520-L522 HydrophobicContact CB-CG 4Å; H520-L522 PolarHBondContact O-N 2.66Å
521	I	26.3	Very low	26.5	Very low	177 Å²	177	143.3 Å²	143.3	91%	0.908	78%	0.775	S	S	*	*			trans	-72	85.6	168.5	-55.1	-178.5	0	0	0	108.9
522	L	24	Very low	26.1	Very low	122 Å²	122	143.9 Å²	143.9	64%	0.639	79%	0.785	S	S	*	*			trans	-127.4	122	178.9	-80.6	170.6	0	0	0	109.6	H520	H520-L522 HydrophobicContact CB-CD1 3.77Å; H520-L522 HydrophobicContact CB-CG 4Å; H520-L522 PolarHBondContact O-N 2.66Å
523	V	25.7	Very low	25.5	Very low	141 Å²	141	145.4 Å²	145.4	86%	0.855	79%	0.792	S	S	*	*			trans	-137.5	88.9	165.6	-170.3	0	0	0	0	111.2
524	R	23.7	Very low	25.2	Very low	241 Å²	241	141.4 Å²	141.4	91%	0.909	79%	0.788	S	S	*	*			trans	41.7	131.4	152.6	-74	-174.3	167.2	123.8	0.3	121.9
525	D	22.2	Very low	25.1	Very low	142 Å²	142	144.3 Å²	144.3	76%	0.759	79%	0.792	S	S	*	*			trans	-60.4	162.3	156.1	-50.8	-86.7	0	0	0	113.9
526	N	26.7	Very low	24.7	Very low	170 Å²	170	140.6 Å²	140.6	91%	0.909	79%	0.791	S	S	*	*			trans	-150.8	136	136.5	-113.2	-16.1	0	0	0	110.1
527	I	23.8	Very low	24.6	Very low	150 Å²	150	147.9 Å²	147.9	77%	0.769	80%	0.798	S	S	*	*			trans	-97.1	167.4	-174	-55	173	0	0	0	109.4
528	V	24.3	Very low	24.3	Very low	139 Å²	139	150 Å²	150	84%	0.842	81%	0.814	S	S	*	*			trans	114.5	114.6	154.5	-177.9	0	0	0	0	115.9
529	G	24.1	Very low	24.3	Very low	71 Å²	71	146 Å²	146	73%	0.732	81%	0.813	S	S	*	*			trans	77.9	157.1	151.1	0	0	0	0	0	119.3
530	E	24	Very low	24.3	Very low	181 Å²	181	143.8 Å²	143.8	85%	0.846	82%	0.815	S	S	*	*			cis	-168.7	140.1	-21.3	-159.2	168.7	-161.9	0	0	109.9
531	S	22.7	Very low	24.2	Very low	120 Å²	120	142 Å²	142	84%	0.839	82%	0.818	S	S	*	*			trans	61	168.8	171.5	80.7	0	0	0	0	116.8
532	A	23.7	Very low	24.4	Very low	95 Å²	95	141.2 Å²	141.2	79%	0.785	82%	0.816	S	S	*	*			cis	-144.4	-178	0.3	0	0	0	0	0	111.3
533	I	23.9	Very low	24.4	Very low	168 Å²	168	142.7 Å²	142.7	86%	0.862	82%	0.823	S	S	*	*			trans	-120.8	143	-167.8	-60.4	159	0	0	0	111.6
534	A	24	Very low	24.4	Very low	89 Å²	89	144.1 Å²	144.1	74%	0.736	82%	0.824	S	S	*	*			trans	-165.5	150	155	0	0	0	0	0	116.4
535	H	24.1	Very low	24.5	Very low	187 Å²	187	135.4 Å²	135.4	87%	0.866	81%	0.809	S	S	*	*			trans	-51.2	170.6	175.4	-40.1	-86.6	0	0	0	117.7
536	G	22.2	Very low	24.6	Very low	73 Å²	73	135.8 Å²	135.8	75%	0.753	82%	0.817	S	S	*	*			cis	125.1	90.6	-10.1	0	0	0	0	0	117.5
537	R	24.6	Very low	24.6	Very low	253 Å²	253	131.3 Å²	131.3	96%	0.955	81%	0.811	S	S	*	*			trans	-172.4	170.1	155.1	-116.6	175	179.5	165.1	0.5	113.5
538	T	22.9	Very low	24.9	Very low	132 Å²	132	132 Å²	132	81%	0.81	82%	0.817	S	S	*	*			trans	-143.6	155.2	-168.2	50.1	0	0	0	0	114.9
539	A	25.8	Very low	25.1	Very low	101 Å²	101	130.2 Å²	130.2	84%	0.835	81%	0.81	S	S	*	*			trans	71.4	121	154.8	0	0	0	0	0	120.9
540	S	26.7	Very low	25.1	Very low	114 Å²	114	134.1 Å²	134.1	80%	0.797	81%	0.811	S	S	*	*				-159.4	161.8	108.7	-162.4	0	0	0	0	110.1
541	C	23.7	Very low	25.2	Very low	116 Å²	116	133 Å²	133	78%	0.784	81%	0.805	S	S	*	*			trans	-103.8	155.8	161.1	-62.4	0	0	0	0	108.7
542	D	28.8	Very low	25.4	Very low	161 Å²	161	131.6 Å²	131.6	86%	0.861	80%	0.796	S	S	*	*			trans	-145.8	153.5	159.4	-95.5	-50.4	0	0	0	109.8
543	I	25.2	Very low	25.4	Very low	153 Å²	153	134.1 Å²	134.1	79%	0.785	80%	0.795	S	S	*	*			trans	-123.2	141.7	179.3	-61.2	167.3	0	0	0	106.8
544	I	25.2	Very low	25.6	Very low	170 Å²	170	134 Å²	134	87%	0.872	80%	0.795	S	S	*	*			trans	169.5	140.7	139.7	-91	153.4	0	0	0	111
545	G	24.9	Very low	25.8	Very low	58 Å²	58	135.9 Å²	135.9	60%	0.598	80%	0.8	S	S	*	*			trans	83.2	93.5	134.5	0	0	0	0	0	119.5
546	T	26.2	Very low	26	Very low	151 Å²	151	130.5 Å²	130.5	93%	0.926	80%	0.795	S	S	*	*				16.1	118.6	125	54.5	0	0	0	0	118.5
547	G	26.7	Very low	26.3	Very low	76 Å²	76	136.8 Å²	136.8	78%	0.784	80%	0.802	S	S	*	*			trans	158.9	123	163.2	0	0	0	0	0	113.4
548	D	28.2	Very low	26.3	Very low	165 Å²	165	130 Å²	130	88%	0.882	79%	0.794	S	S	*	*			trans	-56.7	163.7	-174.9	-56.2	-57.4	0	0	0	116.6
549	S	28.7	Very low	26.5	Very low	101 Å²	101	129.2 Å²	129.2	71%	0.706	79%	0.793	S	S	*	*			trans	80.1	98.3	151.3	-152.7	0	0	0	0	119.7
550	M	24.5	Very low	26.6	Very low	153 Å²	153	128.1 Å²	128.1	75%	0.754	79%	0.792	S	S	*	*				54.2	127.3	126.3	-61.2	179.2	72.4	0	0	121.5
551	H	27.3	Very low	26.5	Very low	157 Å²	157	131 Å²	131	73%	0.727	79%	0.793	S	S	*	*			trans	84.3	110.4	144.6	-72.8	-50.2	0	0	0	122.1
552	S	26.4	Very low	26.5	Very low	91 Å²	91	131.6 Å²	131.6	64%	0.636	79%	0.786	S	S	*	*				98.6	101.2	120	-64.2	0	0	0	0	121.5
553	L	23.8	Very low	26.3	Very low	148 Å²	148	130.4 Å²	130.4	78%	0.775	79%	0.785	S	S	*	*				63.7	98.6	117.5	-67.2	170.1	0	0	0	120.5
554	L	26.6	Very low	26.3	Very low	165 Å²	165	126.2 Å²	126.2	86%	0.864	78%	0.78	S	S	*	*				145.5	143.9	113.9	-79.1	156.1	0	0	0	114.8
555	P	28.7	Very low	26.3	Very low	128 Å²	128	125.6 Å²	125.6	83%	0.831	78%	0.778	S	S	*	*			trans	-111.5	164.1	-173	41.1	-34.9	0	0	0	116.4
556	G	27.9	Very low	26.3	Very low	74 Å²	74	131.4 Å²	131.4	76%	0.763	79%	0.79	S	S	*	*			trans	-156.9	92.4	179.6	0	0	0	0	0	119.2
557	K	30	Very low	26.3	Very low	205 Å²	205	132.2 Å²	132.2	89%	0.891	79%	0.787	S	S	*	*			trans	45.4	108.7	141.1	-62.5	179.7	179.7	176.9	0	123.1
558	S	24.9	Very low	26.2	Very low	112 Å²	112	135.7 Å²	135.7	78%	0.783	79%	0.787	S	S	*	*				58.2	121.8	114	173.2	0	0	0	0	123.3
559	S	25.9	Very low	26	Very low	115 Å²	115	131.6 Å²	131.6	80%	0.804	77%	0.772	S	S	*	*				166.7	144.7	103.7	59.2	0	0	0	0	116.2
560	G	27.7	Very low	25.9	Very low	78 Å²	78	137.1 Å²	137.1	80%	0.804	78%	0.777	S	S	*	*			trans	67.1	173.7	159.1	0	0	0	0	0	119.3
561	E	24.9	Very low	25.9	Very low	174 Å²	174	137 Å²	137	81%	0.813	78%	0.778	S	S	*	*			cis	-158.4	153.2	-49.5	-143.8	-169.2	150.7	0	0	111.9
562	I	24.5	Very low	25.9	Very low	128 Å²	128	134.8 Å²	134.8	66%	0.656	78%	0.777	S	S	*	*			trans	65.2	123.6	150.8	-91.6	173.8	0	0	0	122.9
563	T	24.7	Very low	25.7	Very low	137 Å²	137	136.9 Å²	136.9	84%	0.84	78%	0.781	S	S	*	*			trans	52.4	139.1	153	60.3	0	0	0	0	124
564	G	23.8	Very low	25.8	Very low	65 Å²	65	135.2 Å²	135.2	67%	0.67	78%	0.777	S	S	*	*			trans	147.4	100.8	133.7	0	0	0	0	0	117.8
565	N	24.9	Very low	25.7	Very low	156 Å²	156	133.4 Å²	133.4	83%	0.834	77%	0.773	S	S	*	*			trans	47.9	115.6	146.1	-53.1	-3.2	0	0	0	119
566	E	26	Very low	25.4	Very low	181 Å²	181	135.8 Å²	135.8	85%	0.846	77%	0.773	S	S	*	*				69.7	103.7	78.4	-170.6	176	-118.4	0	0	114.7
567	I	25.9	Very low	25.2	Very low	167 Å²	167	136.6 Å²	136.6	86%	0.856	77%	0.773	S	S	*	*			trans	-175.1	101	158.2	-94.9	147.2	0	0	0	104.5
568	D	25.9	Very low	24.8	Very low	149 Å²	149	135 Å²	135	80%	0.797	77%	0.773	S	S	*	*				81	164.6	98.9	-157.7	17.4	0	0	0	114.3
569	S	24	Very low	24.7	Very low	79 Å²	79	137.2 Å²	137.2	55%	0.552	77%	0.771	S	S	*	*			trans	-123.6	143.3	-150.4	56.3	0	0	0	0	112.1
570	R	24.9	Very low	24.5	Very low	218 Å²	218	138.4 Å²	138.4	82%	0.823	77%	0.774	S	S	*	*			trans	163.2	146.5	135	-92.4	157	-155	-110.3	5.5	114.3
571	I	25.5	Very low	24.3	Very low	151 Å²	151	139.8 Å²	139.8	77%	0.774	77%	0.766	S	S	*	*			trans	70.9	149.7	149.7	-65.2	160.1	0	0	0	115.3
572	P	26.1	Very low	24.2	Very low	109 Å²	109	136.2 Å²	136.2	71%	0.708	76%	0.758	S	S	*	*			cis	-113.7	172.9	-5	25.5	-5.5	0	0	0	115.4
573	D	22.7	Very low	24.2	Very low	135 Å²	135	136.6 Å²	136.6	72%	0.722	77%	0.771	S	S	*	*			trans	-56	134.5	159.1	-165.4	-14.1	0	0	0	112.2	T575	D573-T575 PolarHBondContact OD1-OG1 2.9Å
574	V	26.2	Very low	24.2	Very low	114 Å²	114	135.7 Å²	135.7	69%	0.691	77%	0.765	S	S	*	*			trans	-136.7	109.9	162.2	179.2	0	0	0	0	108	E576	V574-E576 HydrophobicContact CG1-CG 4.27Å
575	T	23.6	Very low	24.3	Very low	127 Å²	127	142.9 Å²	142.9	78%	0.779	77%	0.772	S	S	*	*			trans	-101.6	91.4	175	-64.5	0	0	0	0	108.9	D573	D573-T575 PolarHBondContact OD1-OG1 2.9Å
576	E	24.2	Very low	24.3	Very low	177 Å²	177	138.8 Å²	138.8	83%	0.827	77%	0.766	S	S	*	*			trans	-124.2	140.5	169.6	-76.9	-169.4	147.9	0	0	111.3	V574	V574-E576 HydrophobicContact CG1-CG 4.27Å
577	A	22.5	Very low	24.2	Very low	92 Å²	92	137.3 Å²	137.3	76%	0.76	77%	0.765	S	S	*	*			trans	-85.4	121.6	-179.1	0	0	0	0	0	109.8	E579	A577-E579 PolarHBondContact O-N 3.27Å
578	L	21.9	Very low	24.3	Very low	172 Å²	172	135.2 Å²	135.2	90%	0.901	76%	0.764	S	S	*	*			trans	-70.7	85.2	162.9	-94.9	158	0	0	0	108.9	T580	L578-T580 PolarHBondContact O-N 3.44Å
579	E	22	Very low	24.3	Very low	158 Å²	158	133.9 Å²	133.9	74%	0.738	76%	0.762	S	S	*	*			trans	-58.2	123.1	161.6	-67.8	-165	143.3	0	0	108.5	A577 V581	A577-E579 PolarHBondContact O-N 3.27Å; E579-V581 HydrophobicContact CB-CG2 4.39Å; E579-V581 PolarHBondContact O-N 2.95Å
580	T	23.6	Very low	24.5	Very low	140 Å²	140	133.8 Å²	133.8	86%	0.859	77%	0.773	S	S	*	*			trans	-75.8	74.2	173.3	52.4	0	0	0	0	109.3	L578	L578-T580 PolarHBondContact O-N 3.44Å
581	V	23.2	Very low	24.6	Very low	106 Å²	106	131.2 Å²	131.2	64%	0.642	77%	0.771	S	S	*	*			trans	-60.5	121.2	170.6	-177.5	0	0	0	0	107.5	E579	E579-V581 HydrophobicContact CB-CG2 4.39Å; E579-V581 PolarHBondContact O-N 2.95Å
582	P	22.1	Very low	24.7	Very low	99 Å²	99	132 Å²	132	64%	0.643	77%	0.771	S	S	*	*			trans	-65.2	139.3	177.7	28	-34.2	0	0	0	109.3	T584	P582-T584 VanDerWaalsContact C-N 3.34Å; P582-T584 PolarHBondContact O-N 3.23Å
583	C	23.6	Very low	25	Very low	136 Å²	136	134.5 Å²	134.5	92%	0.919	77%	0.773	S	S	*	*			trans	-65.4	90.8	-179.6	-58.9	0	0	0	0	111.1	R585	C583-R585 PolarHBondContact O-N 3.41Å
584	T	25.7	Very low	25.6	Very low	119 Å²	119	135.3 Å²	135.3	73%	0.73	77%	0.767	S	S	*	*			trans	-70.5	100.6	-180	44.7	0	0	0	0	111	P582 G586	P582-T584 VanDerWaalsContact C-N 3.34Å; P582-T584 PolarHBondContact O-N 3.23Å; T584-G586 PolarHBondContact O-N 3.25Å
585	R	25.4	Very low	25.8	Very low	216 Å²	216	135.8 Å²	135.8	82%	0.815	77%	0.765	S	S	*	*			trans	15.8	80.9	149.3	-167.6	-177.9	-167.3	155.2	5.2	114.8	C583	C583-R585 PolarHBondContact O-N 3.41Å
586	G	24.9	Very low	26.3	Very low	69 Å²	69	134.1 Å²	134.1	71%	0.711	75%	0.749	S	S	*	*			trans	-105.8	118	167.6	0	0	0	0	0	110	T584 S588	T584-G586 PolarHBondContact O-N 3.25Å; G586-S588 PolarHBondContact O-N 3.34Å
587	D	24.6	Very low	26.7	Very low	151 Å²	151	126.8 Å²	126.8	81%	0.807	72%	0.715	S	S	*	*			trans	-71.4	123	173.9	-76.6	-60.1	0	0	0	110.2
588	S	28.6	Very low	27.5	Very low	122 Å²	122	122.7 Å²	122.7	85%	0.853	68%	0.681	S	S	*	*			trans	-158.9	130.3	168.6	-79.6	0	0	0	0	110.5	G586 G590	G586-S588 PolarHBondContact O-N 3.34Å; S588-G590 PolarHBondContact O-N 2.94Å
589	T	25.8	Very low	28.3	Very low	121 Å²	121	115.1 Å²	115.1	74%	0.742	64%	0.644	S	S	*	*			trans	-79.6	115.8	-171	37.7	0	0	0	0	111.7	Y489	Y489-T589 HydrophobicContact CE2-CG2 4.04Å
590	G	27.6	Very low	29.4	Very low	77 Å²	77	108.8 Å²	108.8	79%	0.794	62%	0.618	S	S	*	*			trans	-133.1	93.3	178.4	0	0	0	0	0	112.3	S588	S588-G590 PolarHBondContact O-N 2.94Å
591	H	27.8	Very low	31.2	Very low	165 Å²	165	102.6 Å²	102.6	76%	0.764	58%	0.581	S	S	*	*			trans	-71.2	147.5	161.3	-78.9	-87.7	0	0	0	110.1
592	H	26.9	Very low	33.2	Very low	168 Å²	168	98.2 Å²	98.2	78%	0.778	56%	0.557	S	S	*	*			trans	152	170.5	143.5	-77.8	-52.3	0	0	0	112	Y594	H592-Y594 WeakPolarHBondContact O-CD2 3.32Å
593	Q	32.8	Very low	35.7	Very low	161 Å²	161	93.7 Å²	93.7	75%	0.752	53%	0.528	S	S	*	.			trans	80.1	16.3	162.8	-140.7	175.4	35.9	0	0	120.6
594	Y	33.9	Very low	38.3	Very low	152 Å²	152	87.3 Å²	87.3	60%	0.596	48%	0.484	S	S	*	.			trans	-92.3	-7	176.8	-73.4	-96.3	0	0	0	115.3	H592 H596 L597	H592-Y594 WeakPolarHBondContact O-CD2 3.32Å; Y594-H596 VanDerWaalsContact C-N 3.32Å; Y594-H596 PolarHBondContact O-N 3.13Å; Y594-L597 HydrophobicContact CD1-CD1 3.95Å; Y594-L597 WeakPolarHBondContact O-CD1 3.39Å; Y594-L597 WeakPolarHBondContact O-CG 3.38Å
595	D	30.8	Very low	41	Very low	124 Å²	124	81.6 Å²	81.6	66%	0.663	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	1.6	-163.8	-56.6	-68.1	0	0	0	117	Q708	D595-Q708 PolarHBondContact O-NE2 3.48Å
596	H	35.1	Very low	43.8	Very low	92 Å²	92	71.3 Å²	71.3	43%	0.426	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.2	24.7	-175	-69.8	-5.1	0	0	0	113.4	Y594	Y594-H596 VanDerWaalsContact C-N 3.32Å; Y594-H596 PolarHBondContact O-N 3.13Å
597	L	32.8	Very low	46.5	Very low	23 Å²	23	69.5 Å²	69.5	12%	0.12	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-72.2	153.4	-179.4	-72.3	167.8	0	0	0	113.5	Y594 S709 W767	Y594-L597 HydrophobicContact CD1-CD1 3.95Å; Y594-L597 WeakPolarHBondContact O-CD1 3.39Å; Y594-L597 WeakPolarHBondContact O-CG 3.38Å; L597-S709 VanDerWaalsContact O-CB 3.23Å; L597-S709 WeakPolarHBondContact O-CB 3.29Å; L597-S709 PolarHBondContact O-OG 2.86Å; L597-S709 VanDerWaalsContact O-OG 3.11Å; L597-W767 HydrophobicContact CD2-CH2 4.03Å; L597-W767 HydrophobicContact CD2-CZ2 3.45Å; L597-W767 VanDerWaalsContact CD2-CZ2 3.45Å
598	P	38	Very low	49.3	Very low	6 Å²	6	63.4 Å²	63.4	4%	0.039	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-76.6	143.4	178.2	30.5	-35	0	0	0	112.9	R717 W767 Y852	P598-R717 PolarHBondContact O-NH2 2.88Å; P598-W767 HydrophobicContact CG-CB 4.04Å; P598-W767 HydrophobicContact CG-CD2 4.22Å; P598-W767 HydrophobicContact CG-CG 3.77Å; P598-Y852 WeakPolarHBondContact CA-OH 3.5Å; P598-Y852 HydrophobicContact CB-CE1 4.26Å
599	G	39	Very low	51.5	Low	13 Å²	13	60.9 Å²	60.9	13%	0.134	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-63.8	144.2	165.8	0	0	0	0	0	109.7	S601	G599-S601 PolarHBondContact O-N 3.29Å
600	A	45.1	Very low	53.8	Low	24 Å²	24	58.9 Å²	58.9	20%	0.198	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-68.4	121.5	-172.1	0	0	0	0	0	111.6	G602 I878 V880	A600-G602 PolarHBondContact O-N 2.7Å; A600-I878 HydrophobicContact CB-CG2 3.87Å; A600-V880 HydrophobicContact CB-CG2 3.73Å
601	S	60.9	Low	55.8	Low	11 Å²	11	59.9 Å²	59.9	8%	0.077	33%	0.329	C	S	.	.			trans	-76.1	5.1	159.6	52.9	0	0	0	0	112.7	G599 T620 L621	G599-S601 PolarHBondContact O-N 3.29Å; S601-T620 WeakPolarHBondContact O-CA 3.31Å; S601-L621 PolarHBondContact O-N 3.08Å
602	G	66.3	Low	57.8	Low	13 Å²	13	53.4 Å²	53.4	13%	0.134	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	138.1	176.3	0	0	0	0	0	112	A600 G619	A600-G602 PolarHBondContact O-N 2.7Å; G602-G619 CarbonylContact C-O 3.49Å; G602-G619 VanDerWaalsContact CA-O 3.29Å; G602-G619 WeakPolarHBondContact CA-O 3.41Å
603	V	74.2	Confident	59.9	Low	4 Å²	4	46.9 Å²	46.9	2%	0.024	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	153.5	-177.3	-60.5	0	0	0	0	110.4	T618 G619 L621 V633 V650 I652	V603-T618 CarbonylContact O-C 3.31Å; V603-T618 WeakPolarHBondContact O-CA 3.27Å; V603-G619 PolarHBondContact N-O 2.91Å; V603-G619 PolarHBondContact O-N 2.85Å; V603-L621 HydrophobicContact CG1-CB 4.1Å; V603-V633 HydrophobicContact CG2-CG1 3.6Å; V603-V633 HydrophobicContact CG2-CG2 4.19Å; V603-V650 HydrophobicContact CB-CG1 3.7Å; V603-V650 HydrophobicContact CG2-CG1 3.6Å; V603-I652 HydrophobicContact CB-CG1 4.12Å; V603-I652 HydrophobicContact CG1-CB 4.26Å; V603-I652 HydrophobicContact CG1-CD1 4.19Å; V603-I652 HydrophobicContact CG1-CG1 3.75Å; V603-I652 HydrophobicContact CG1-CG2 3.97Å
604	H	77.5	Confident	61.8	Low	2 Å²	2	43.9 Å²	43.9	1%	0.009	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	134.6	178.6	-78.8	-81.4	0	0	0	112.5	F606 C617 T618 V650 Y651 V880 P882	H604-F606 HydrophobicContact CB-CD2 4.36Å; H604-F606 HydrophobicContact CB-CE2 3.46Å; H604-F606 VanDerWaalsContact CB-CE2 3.46Å; H604-F606 HydrophobicContact CB-CZ 3.91Å; H604-C617 PolarHBondContact CE1-O 2.74Å; H604-C617 VanDerWaalsContact CE1-O 3.23Å; H604-T618 PolarHBondContact NE2-OG1 2.8Å; H604-V650 CarbonylContact O-C 3.48Å; H604-V650 VanDerWaalsContact O-CA 3.23Å; H604-V650 WeakPolarHBondContact O-CA 3.49Å; H604-V650 WeakPolarHBondContact O-CG1 3.48Å; H604-Y651 PolarHBondContact N-O 3.36Å; H604-Y651 VanDerWaalsContact N-O 3.15Å; H604-Y651 PolarHBondContact O-N 2.82Å; H604-V880 PolarHBondContact NE2-O 2.77Å; H604-P882 HydrophobicContact CB-CG 4.17Å
605	I	83.5	Confident	63.7	Low	0 Å²	0	37.4 Å²	37.4	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	125.2	179.5	-61.8	164.4	0	0	0	108.1	L616 C617 T635 C639 I640 Y648 V650 L695	I605-L616 WeakPolarHBondContact O-CB 3.32Å; I605-L616 PolarHBondContact O-N 3.12Å; I605-C617 PolarHBondContact N-O 2.79Å; I605-C617 PolarHBondContact O-N 2.72Å; I605-T635 HydrophobicContact CD1-CG2 3.79Å; I605-C639 VanDerWaalsContact CD1-SG 3.5Å; I605-I640 HydrophobicContact CG2-CD1 3.92Å; I605-Y648 HydrophobicContact CG2-CD1 4.31Å; I605-V650 HydrophobicContact CG1-CG2 4.36Å; I605-L695 HydrophobicContact CD1-CD1 3.64Å; I605-L695 HydrophobicContact CG1-CD1 3.87Å; I605-L695 HydrophobicContact CG2-CD1 4.18Å
606	F	83	Confident	66.2	Low	0 Å²	0	33.9 Å²	33.9	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	137.7	-179.5	-67	-91.2	0	0	0	110.9	H604 I613 E614 P615 Y648 K649 L669 P882 I884	H604-F606 HydrophobicContact CB-CD2 4.36Å; H604-F606 HydrophobicContact CB-CE2 3.46Å; H604-F606 VanDerWaalsContact CB-CE2 3.46Å; H604-F606 HydrophobicContact CB-CZ 3.91Å; F606-I613 HydrophobicContact CB-CG2 4.02Å; F606-I613 HydrophobicContact CD1-CG2 3.78Å; F606-I613 HydrophobicContact CG-CG2 4.09Å; F606-E614 VanDerWaalsContact CA-O 3.32Å; F606-E614 WeakPolarHBondContact CA-O 3.24Å; F606-P615 HydrophobicContact CD1-CB 4.2Å; F606-P615 HydrophobicContact CE1-CB 3.74Å; F606-P615 HydrophobicContact CZ-CB 4.47Å; F606-Y648 WeakPolarHBondContact O-CA 3.4Å; F606-K649 PolarHBondContact N-O 2.58Å; F606-K649 PolarHBondContact O-N 3.38Å; F606-L669 HydrophobicContact CD2-CD2 3.55Å; F606-L669 HydrophobicContact CE2-CD2 3.94Å; F606-L669 HydrophobicContact CG-CD2 4.22Å; F606-P882 HydrophobicContact CZ-CG 3.77Å; F606-I884 HydrophobicContact CE1-CD1 3.53Å; F606-I884 HydrophobicContact CE2-CD1 4.32Å; F606-I884 HydrophobicContact CZ-CD1 3.36Å
607	M	82.9	Confident	68.7	Low	30 Å²	30	29.5 Å²	29.5	15%	0.148	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	136.9	162.6	-166	173	-71.8	0	0	109	E614 L616 P641 I646 Y648	M607-E614 PolarHBondContact N-O 2.83Å; M607-E614 PolarHBondContact O-N 2.71Å; M607-L616 HydrophobicContact CB-CD2 4.37Å; M607-L616 HydrophobicContact CE-CD1 3.91Å; M607-L616 HydrophobicContact CE-CD2 3.84Å; M607-P641 HydrophobicContact CE-CG 3.76Å; M607-I646 HydrophobicContact CE-CD1 4.38Å; M607-I646 HydrophobicContact CE-CG2 4.32Å; M607-I646 HydrophobicContact CG-CG2 3.47Å; M607-I646 VanDerWaalsContact CG-CG2 3.47Å; M607-I646 HydrophobicContact SD-CD1 4.23Å; M607-I646 HydrophobicContact SD-CG2 4.06Å; M607-Y648 HydrophobicContact CE-CE1 4.45Å
608	I	81.9	Confident	71.2	Confident	23 Å²	23	28.4 Å²	28.4	12%	0.118	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	119.7	171.8	-58.1	-166.6	0	0	0	109.8	S612 I613 N647 K649	I608-S612 WeakPolarHBondContact CA-O 3.48Å; I608-I613 HydrophobicContact CD1-CD1 4.4Å; I608-I613 HydrophobicContact CD1-CG1 4.19Å; I608-I613 HydrophobicContact CG1-CG1 4.21Å; I608-I613 HydrophobicContact CG1-CG2 4.49Å; I608-N647 HydrophobicContact CB-CB 4.32Å; I608-N647 PolarHBondContact N-O 2.99Å; I608-N647 PolarHBondContact O-N 3.48Å; I608-K649 HydrophobicContact CD1-CB 4.21Å; I608-K649 HydrophobicContact CD1-CD 3.55Å; I608-K649 HydrophobicContact CD1-CG 3.53Å; I608-K649 HydrophobicContact CG1-CG 4.48Å
609	T	76.1	Confident	73.2	Confident	70 Å²	70	28.1 Å²	28.1	43%	0.429	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	89.2	-170	-37.5	0	0	0	0	108.4	S611 S612	T609-S611 PolarHBondContact O-N 2.71Å; T609-S612 PolarHBondContact N-O 3.45Å; T609-S612 WeakPolarHBondContact O-CB 3.47Å; T609-S612 PolarHBondContact O-N 3.41Å
610	G	74.2	Confident	75.1	Confident	78 Å²	78	27.6 Å²	27.6	80%	0.804	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.5	-114	-168.9	0	0	0	0	0	111
611	S	69.5	Low	76.5	Confident	98 Å²	98	27 Å²	27	69%	0.685	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.2	-8.2	173.1	50.9	0	0	0	0	114.1	T609	T609-S611 PolarHBondContact O-N 2.71Å
612	S	68.9	Low	76.9	Confident	30 Å²	30	28.3 Å²	28.3	21%	0.21	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	140.3	176.3	-163.1	0	0	0	0	111.2	I608 T609 E614	I608-S612 WeakPolarHBondContact CA-O 3.48Å; T609-S612 PolarHBondContact N-O 3.45Å; T609-S612 WeakPolarHBondContact O-CB 3.47Å; T609-S612 PolarHBondContact O-N 3.41Å; S612-E614 WeakPolarHBondContact CB-OE1 3.04Å; S612-E614 PolarHBondContact OG-OE1 3.27Å
613	I	71.1	Confident	76.8	Confident	30 Å²	30	28.1 Å²	28.1	15%	0.154	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	108.9	172.5	-57.6	-179.4	0	0	0	107	F606 I608 L669	F606-I613 HydrophobicContact CB-CG2 4.02Å; F606-I613 HydrophobicContact CD1-CG2 3.78Å; F606-I613 HydrophobicContact CG-CG2 4.09Å; I608-I613 HydrophobicContact CD1-CD1 4.4Å; I608-I613 HydrophobicContact CD1-CG1 4.19Å; I608-I613 HydrophobicContact CG1-CG1 4.21Å; I608-I613 HydrophobicContact CG1-CG2 4.49Å; I613-L669 HydrophobicContact CD1-CD1 4.43Å
614	E	72.8	Confident	75.9	Confident	98 Å²	98	33.6 Å²	33.6	46%	0.458	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	127.6	-171.3	-77.2	161.7	-128.7	0	0	111.1	F606 M607 S612 L616	F606-E614 VanDerWaalsContact CA-O 3.32Å; F606-E614 WeakPolarHBondContact CA-O 3.24Å; M607-E614 PolarHBondContact N-O 2.83Å; M607-E614 PolarHBondContact O-N 2.71Å; S612-E614 WeakPolarHBondContact CB-OE1 3.04Å; S612-E614 PolarHBondContact OG-OE1 3.27Å; E614-L616 PolarHBondContact O-N 3.2Å
615	P	73.9	Confident	74.8	Confident	17 Å²	17	40 Å²	40	11%	0.11	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	125.7	173.7	26.7	-32.4	0	0	0	109.7	F606 Y753	F606-P615 HydrophobicContact CD1-CB 4.2Å; F606-P615 HydrophobicContact CE1-CB 3.74Å; F606-P615 HydrophobicContact CZ-CB 4.47Å; P615-Y753 HydrophobicContact CB-CD2 4.36Å; P615-Y753 HydrophobicContact CB-CE1 4.39Å; P615-Y753 HydrophobicContact CB-CE2 4.09Å; P615-Y753 HydrophobicContact CG-CE1 4.24Å; P615-Y753 HydrophobicContact CG-CE2 3.94Å; P615-Y753 WeakPolarHBondContact O-CD1 3.47Å; P615-Y753 WeakPolarHBondContact O-CE1 3.32Å
616	L	83.7	Confident	73.3	Confident	49 Å²	49	44 Å²	44	26%	0.257	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	-49.3	-173.2	-170.8	64.4	0	0	0	111.8	I605 M607 E614 C639 Y648	I605-L616 WeakPolarHBondContact O-CB 3.32Å; I605-L616 PolarHBondContact O-N 3.12Å; M607-L616 HydrophobicContact CB-CD2 4.37Å; M607-L616 HydrophobicContact CE-CD1 3.91Å; M607-L616 HydrophobicContact CE-CD2 3.84Å; E614-L616 PolarHBondContact O-N 3.2Å; L616-C639 WeakPolarHBondContact CD2-O 3.44Å; L616-Y648 HydrophobicContact CD2-CD1 4.36Å; L616-Y648 HydrophobicContact CD2-CE1 3.77Å
617	C	87.7	Confident	72.1	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.5	172.7	-170.3	32.9	0	0	0	0	111.9	H604 I605 C639 I755	H604-C617 PolarHBondContact CE1-O 2.74Å; H604-C617 VanDerWaalsContact CE1-O 3.23Å; I605-C617 PolarHBondContact N-O 2.79Å; I605-C617 PolarHBondContact O-N 2.72Å; C617-C639 HydrophobicContact CB-CB 3.56Å; C617-C639 WeakPolarHBondContact CB-SG 3.36Å; C617-C639 VanDerWaalsContact SG-CA 3.53Å; C617-C639 WeakPolarHBondContact SG-CB 3.43Å; C617-C639 PolarHBondContact SG-O 3.22Å; C617-C639 CovalentContact SG-SG 2.02Å; C617-C639 PolarHBondContact SG-SG 2.8Å; C617-I755 HydrophobicContact CB-CB 4.29Å; C617-I755 VanDerWaalsContact CB-O 3.25Å; C617-I755 WeakPolarHBondContact CB-O 3.49Å
618	T	85.3	Confident	71.1	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	163.9	171.3	-56	0	0	0	0	109.9	V603 H604 T635 Y753 I755 G756	V603-T618 CarbonylContact O-C 3.31Å; V603-T618 WeakPolarHBondContact O-CA 3.27Å; H604-T618 PolarHBondContact NE2-OG1 2.8Å; T618-T635 PolarHBondContact O-OG1 2.88Å; T618-Y753 PolarHBondContact OG1-O 2.88Å; T618-I755 PolarHBondContact N-O 2.82Å; T618-G756 CarbonylContact O-C 3.54Å; T618-G756 VanDerWaalsContact O-CA 3.32Å; T618-G756 WeakPolarHBondContact O-CA 3.37Å
619	G	79.4	Confident	70.3	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	-177.4	165.5	0	0	0	0	0	110.1	G602 V603 V634	G602-G619 CarbonylContact C-O 3.49Å; G602-G619 VanDerWaalsContact CA-O 3.29Å; G602-G619 WeakPolarHBondContact CA-O 3.41Å; V603-G619 PolarHBondContact N-O 2.91Å; V603-G619 PolarHBondContact O-N 2.85Å; G619-V634 CarbonylContact C-O 3.18Å; G619-V634 WeakPolarHBondContact CA-O 3.33Å
620	T	79	Confident	70.1	Confident	2 Å²	2	52.5 Å²	52.5	1%	0.012	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	132.6	173.9	-46	0	0	0	0	110.2	S601 Y622 V633 V634 Q769	S601-T620 WeakPolarHBondContact O-CA 3.31Å; T620-Y622 PolarHBondContact O-N 3.13Å; T620-V633 CarbonylContact O-C 3.55Å; T620-V633 WeakPolarHBondContact O-CA 3.46Å; T620-V634 PolarHBondContact N-O 3.16Å; T620-V634 PolarHBondContact O-N 3.12Å; T620-Q769 PolarHBondContact OG1-NE2 3.37Å
621	L	74	Confident	70.4	Confident	13 Å²	13	50.3 Å²	50.3	7%	0.068	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	116.1	170.2	-175.1	70.7	0	0	0	109.5	S601 V603 V633 I652 L697 V701 I853	S601-L621 PolarHBondContact O-N 3.08Å; V603-L621 HydrophobicContact CG1-CB 4.1Å; L621-V633 HydrophobicContact CD1-CG2 3.62Å; L621-I652 HydrophobicContact CD1-CD1 4.39Å; L621-I652 HydrophobicContact CD2-CG2 4.46Å; L621-L697 HydrophobicContact CD1-CD1 4.29Å; L621-V701 HydrophobicContact CD2-CB 4.26Å; L621-V701 HydrophobicContact CD2-CG1 4.39Å; L621-I853 HydrophobicContact CD2-CD1 3.54Å
622	Y	70.9	Confident	70.7	Confident	37 Å²	37	46.8 Å²	46.8	15%	0.145	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	116.9	-179.8	174.9	-101.6	0	0	0	110.3	T620 R624 S630 E632 V847	T620-Y622 PolarHBondContact O-N 3.13Å; Y622-R624 HydrophobicContact CE1-CG 3.74Å; Y622-S630 WeakPolarHBondContact O-CB 3.45Å; Y622-S630 PolarHBondContact O-OG 2.88Å; Y622-E632 HydrophobicContact CD1-CB 4.3Å; Y622-E632 PolarHBondContact N-O 2.94Å; Y622-V847 HydrophobicContact CD2-CG1 4.34Å; Y622-V847 HydrophobicContact CD2-CG2 3.95Å; Y622-V847 HydrophobicContact CE2-CG2 4.2Å
623	A	63.3	Low	71.3	Confident	10 Å²	10	45.3 Å²	45.3	8%	0.083	23%	0.225	C	C	.	.			trans	-112.6	138.4	172.3	0	0	0	0	0	110.6	V703 F851	A623-V703 HydrophobicContact CB-CB 4.48Å; A623-V703 HydrophobicContact CB-CG1 3.99Å; A623-V703 HydrophobicContact CB-CG2 3.83Å; A623-F851 HydrophobicContact CB-CD2 3.78Å; A623-F851 HydrophobicContact CB-CE2 3.64Å; A623-F851 HydrophobicContact CB-CZ 4.4Å
624	R	56	Low	71.8	Confident	118 Å²	118	45.1 Å²	45.1	45%	0.445	23%	0.225	S	C	.	.			trans	-77.5	140.8	-178.8	-64.3	167.3	-175.1	-118.4	-2.5	109.3	Y622 G626 Q627 E632	Y622-R624 HydrophobicContact CE1-CG 3.74Å; R624-G626 PolarHBondContact O-N 2.99Å; R624-Q627 HydrophobicContact CB-CB 4.43Å; R624-Q627 HydrophobicContact CB-CG 4.13Å; R624-Q627 WeakPolarHBondContact O-CB 3.42Å; R624-Q627 PolarHBondContact O-N 2.86Å; R624-E632 IonicContact CZ-OE1 2.76Å; R624-E632 IonicContact CZ-OE2 2.71Å; R624-E632 IonicContact NE-OE1 3.4Å; R624-E632 IonicContact NE-OE2 2.69Å; R624-E632 PolarHBondContact NE-OE2 2.96Å; R624-E632 IonicContact NH2-OE1 3.93Å; R624-E632 PolarHBondContact NH2-OE1 3.49Å; R624-E632 IonicContact NH2-OE2 3.84Å; R624-E632 PolarHBondContact NH2-OE2 2.92Å
625	R	53.7	Low	72.5	Confident	138 Å²	138	40.4 Å²	40.4	52%	0.521	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.3	125.1	176.7	-174.6	166.3	169.6	-140.4	-10.5	110.2	D815 E848	R625-D815 IonicContact CZ-OD2 2.69Å; R625-D815 VanDerWaalsContact CZ-OD2 3.24Å; R625-D815 IonicContact NH1-OD2 2.98Å; R625-D815 PolarHBondContact NH1-OD2 3.47Å; R625-D815 IonicContact NH2-OD2 2.85Å; R625-D815 PolarHBondContact NH2-OD2 3.03Å; R625-E848 WeakPolarHBondContact CD-OE2 3.49Å
626	G	53.1	Low	73.1	Confident	82 Å²	82	39.6 Å²	39.6	85%	0.845	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.4	10	-175.3	0	0	0	0	0	116.8	R624	R624-G626 PolarHBondContact O-N 2.99Å
627	Q	57.7	Low	73.1	Confident	92 Å²	92	38 Å²	38	43%	0.43	19%	0.191	S	C	.	.			trans	-114.2	117.4	176.9	-62.8	-160.9	-20.7	0	0	113.5	R624 Y629	R624-Q627 HydrophobicContact CB-CB 4.43Å; R624-Q627 HydrophobicContact CB-CG 4.13Å; R624-Q627 WeakPolarHBondContact O-CB 3.42Å; R624-Q627 PolarHBondContact O-N 2.86Å; Q627-Y629 PolarHBondContact O-N 3.28Å; Q627-Y629 VanDerWaalsContact O-N 3.14Å
628	E	61.4	Low	73	Confident	115 Å²	115	41.5 Å²	41.5	54%	0.537	20%	0.204	S	C	.	.	S	Bend	trans	-67.6	-2.3	173.4	-67.9	-173.8	-154.5	0	0	114.9	K702 V703	E628-K702 CarbonylContact O-C 3.59Å; E628-K702 WeakPolarHBondContact O-CA 3.41Å; E628-K702 WeakPolarHBondContact O-CG 3.35Å; E628-K702 WeakPolarHBondContact OE2-CE 3.47Å; E628-K702 IonicContact OE2-NZ 3.09Å; E628-K702 PolarHBondContact OE2-NZ 2.85Å; E628-V703 PolarHBondContact O-N 2.82Å
629	Y	64.8	Low	73.1	Confident	91 Å²	91	41.6 Å²	41.6	36%	0.357	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	127.3	-172.4	-72.7	-91.5	0	0	0	112.3	Q627 R700 V701 K702	Q627-Y629 PolarHBondContact O-N 3.28Å; Q627-Y629 VanDerWaalsContact O-N 3.14Å; Y629-R700 VanDerWaalsContact CB-CZ 3.48Å; Y629-R700 HydrophobicContact CD1-CB 4.37Å; Y629-R700 PolarHBondContact O-NH2 3Å; Y629-V701 VanDerWaalsContact CA-O 3.29Å; Y629-V701 WeakPolarHBondContact CA-O 3.34Å; Y629-K702 HydrophobicContact CD1-CB 4.01Å; Y629-K702 HydrophobicContact CD1-CG 4.31Å; Y629-K702 HydrophobicContact CE1-CB 3.64Å; Y629-K702 HydrophobicContact CE1-CD 4.28Å; Y629-K702 HydrophobicContact CE1-CG 3.87Å; Y629-K702 HydrophobicContact CE2-CD 4.32Å; Y629-K702 HydrophobicContact CE2-CG 4.24Å
630	S	71.8	Confident	73.5	Confident	5 Å²	5	41.8 Å²	41.8	4%	0.035	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	143.3	176.4	178.2	0	0	0	0	112.8	Y622 E632 R700 V701	Y622-S630 WeakPolarHBondContact O-CB 3.45Å; Y622-S630 PolarHBondContact O-OG 2.88Å; S630-E632 PolarHBondContact OG-N 2.69Å; S630-E632 PolarHBondContact OG-O 2.87Å; S630-R700 CarbonylContact O-C 3.6Å; S630-R700 WeakPolarHBondContact O-CA 2.96Å; S630-V701 PolarHBondContact N-O 3.2Å; S630-V701 PolarHBondContact O-N 3.42Å
631	D	80.4	Confident	73.2	Confident	31 Å²	31	44.3 Å²	44.3	17%	0.166	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	18.2	162.4	57.1	9.7	0	0	0	112	K696 L697 R700	D631-K696 CarbonylContact O-C 3.56Å; D631-K696 VanDerWaalsContact O-CA 3.28Å; D631-K696 WeakPolarHBondContact O-CA 3.29Å; D631-K696 IonicContact OD1-NZ 3.23Å; D631-K696 PolarHBondContact OD1-NZ 3.28Å; D631-K696 WeakPolarHBondContact OD2-CE 3.45Å; D631-K696 IonicContact OD2-NZ 3.06Å; D631-K696 PolarHBondContact OD2-NZ 3.2Å; D631-L697 HydrophobicContact CB-CB 4.14Å; D631-L697 PolarHBondContact O-N 2.69Å; D631-R700 HydrophobicContact CB-CG 3.89Å
632	E	76.6	Confident	72.5	Confident	24 Å²	24	48 Å²	48	11%	0.112	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	115.1	-175.2	-61.8	-179.2	154.6	0	0	110	Y622 R624 S630 M694	Y622-E632 HydrophobicContact CD1-CB 4.3Å; Y622-E632 PolarHBondContact N-O 2.94Å; R624-E632 IonicContact CZ-OE1 2.76Å; R624-E632 IonicContact CZ-OE2 2.71Å; R624-E632 IonicContact NE-OE1 3.4Å; R624-E632 IonicContact NE-OE2 2.69Å; R624-E632 PolarHBondContact NE-OE2 2.96Å; R624-E632 IonicContact NH2-OE1 3.93Å; R624-E632 PolarHBondContact NH2-OE1 3.49Å; R624-E632 IonicContact NH2-OE2 3.84Å; R624-E632 PolarHBondContact NH2-OE2 2.92Å; S630-E632 PolarHBondContact OG-N 2.69Å; S630-E632 PolarHBondContact OG-O 2.87Å; E632-M694 HydrophobicContact CB-SD 4.38Å; E632-M694 HydrophobicContact CG-SD 4.39Å
633	V	81	Confident	72	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	135	176.4	168.2	0	0	0	0	109.2	V603 T620 L621 V650 I652 M694 L695 L697	V603-V633 HydrophobicContact CG2-CG1 3.6Å; V603-V633 HydrophobicContact CG2-CG2 4.19Å; T620-V633 CarbonylContact O-C 3.55Å; T620-V633 WeakPolarHBondContact O-CA 3.46Å; L621-V633 HydrophobicContact CD1-CG2 3.62Å; V633-V650 HydrophobicContact CG2-CG1 4.5Å; V633-I652 HydrophobicContact CG2-CD1 4.46Å; V633-M694 CarbonylContact O-C 3.56Å; V633-M694 VanDerWaalsContact O-CA 3.31Å; V633-M694 WeakPolarHBondContact O-CA 3.44Å; V633-L695 HydrophobicContact CB-CB 4.24Å; V633-L695 HydrophobicContact CG1-CD1 4.48Å; V633-L695 PolarHBondContact N-O 2.75Å; V633-L695 PolarHBondContact O-N 3.36Å; V633-L697 HydrophobicContact CG2-CD1 4.14Å; V633-L697 HydrophobicContact CG2-CD2 4.21Å; V633-L697 HydrophobicContact CG2-CG 4.24Å
634	V	81.6	Confident	71.7	Confident	25 Å²	25	58.1 Å²	58.1	15%	0.152	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	136.8	-178.8	-170.5	0	0	0	0	110.4	G619 T620 I772	G619-V634 CarbonylContact C-O 3.18Å; G619-V634 WeakPolarHBondContact CA-O 3.33Å; T620-V634 PolarHBondContact N-O 3.16Å; T620-V634 PolarHBondContact O-N 3.12Å; V634-I772 HydrophobicContact CB-CD1 4.33Å; V634-I772 HydrophobicContact CG1-CD1 3.68Å
635	T	87.6	Confident	71.9	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	172.8	176.5	-173	0	0	0	0	110.5	I605 T618 C639 I640 L692 T693 G756	I605-T635 HydrophobicContact CD1-CG2 3.79Å; T618-T635 PolarHBondContact O-OG1 2.88Å; T635-C639 HydrophobicContact CG2-CB 3.97Å; T635-C639 WeakPolarHBondContact OG1-CB 3.34Å; T635-C639 PolarHBondContact OG1-SG 3.23Å; T635-C639 VanDerWaalsContact OG1-SG 3.32Å; T635-I640 HydrophobicContact CG2-CG1 4.12Å; T635-L692 WeakPolarHBondContact O-CA 3.31Å; T635-T693 PolarHBondContact N-O 3.21Å; T635-T693 PolarHBondContact O-N 2.93Å; T635-G756 VanDerWaalsContact OG1-CA 3.29Å; T635-G756 WeakPolarHBondContact OG1-CA 3.33Å
636	A	86.7	Confident	72.6	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	147	173.7	0	0	0	0	0	110.5	R638 C639 I755 I772 D774	A636-R638 PolarHBondContact O-N 3.34Å; A636-C639 VanDerWaalsContact O-CB 3.26Å; A636-C639 WeakPolarHBondContact O-CB 3.31Å; A636-C639 PolarHBondContact O-N 2.91Å; A636-I755 HydrophobicContact CB-CG2 4.18Å; A636-I772 HydrophobicContact CB-CG2 4.04Å; A636-D774 HydrophobicContact CB-CB 4.43Å
637	S	84.1	Confident	74.1	Confident	15 Å²	15	58.2 Å²	58.2	11%	0.105	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-63.2	-29.1	178	-71.7	0	0	0	0	113	C639 I640 E689 G691 L692 T693	S637-C639 PolarHBondContact O-N 3.19Å; S637-C639 VanDerWaalsContact O-N 3.16Å; S637-I640 PolarHBondContact O-N 2.92Å; S637-I640 VanDerWaalsContact O-N 3.12Å; S637-E689 WeakPolarHBondContact CB-O 3.3Å; S637-G691 PolarHBondContact N-O 2.98Å; S637-G691 WeakPolarHBondContact OG-CA 3.28Å; S637-L692 PolarHBondContact OG-N 3.01Å; S637-L692 PolarHBondContact OG-O 2.97Å; S637-T693 WeakPolarHBondContact CA-OG1 3.31Å; S637-T693 PolarHBondContact OG-OG1 3.18Å
638	R	85.4	Confident	75.5	Confident	73 Å²	73	54.8 Å²	54.8	28%	0.275	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-57.1	-24	171.2	-173.7	172.4	-61	-67.9	-9.1	114.8	A636 I640 E689 I755 D774	A636-R638 PolarHBondContact O-N 3.34Å; R638-I640 VanDerWaalsContact C-N 3.34Å; R638-E689 IonicContact CZ-OE2 2.9Å; R638-E689 VanDerWaalsContact CZ-OE2 3.23Å; R638-E689 PolarHBondContact N-O 3.32Å; R638-E689 IonicContact NH1-OE2 2.69Å; R638-E689 PolarHBondContact NH1-OE2 3.35Å; R638-E689 IonicContact NH2-OE2 2.74Å; R638-E689 PolarHBondContact NH2-OE2 3.14Å; R638-I755 HydrophobicContact CB-CG2 4.14Å; R638-I755 HydrophobicContact CG-CD1 4.17Å; R638-I755 HydrophobicContact CG-CG2 4.26Å; R638-D774 WeakPolarHBondContact CD-O 3.4Å; R638-D774 IonicContact CZ-OD2 3.18Å; R638-D774 IonicContact NE-OD2 2.63Å; R638-D774 PolarHBondContact NE-OD2 3.15Å; R638-D774 IonicContact NH2-OD2 2.8Å
639	C	87.8	Confident	76.7	Confident	3 Å²	3	51.5 Å²	51.5	2%	0.02	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-69.8	-28.2	177.1	163.3	0	0	0	0	112.9	I605 L616 C617 T635 A636 S637 P641 I755	I605-C639 VanDerWaalsContact CD1-SG 3.5Å; L616-C639 WeakPolarHBondContact CD2-O 3.44Å; C617-C639 HydrophobicContact CB-CB 3.56Å; C617-C639 WeakPolarHBondContact CB-SG 3.36Å; C617-C639 VanDerWaalsContact SG-CA 3.53Å; C617-C639 WeakPolarHBondContact SG-CB 3.43Å; C617-C639 PolarHBondContact SG-O 3.22Å; C617-C639 CovalentContact SG-SG 2.02Å; C617-C639 PolarHBondContact SG-SG 2.8Å; T635-C639 HydrophobicContact CG2-CB 3.97Å; T635-C639 WeakPolarHBondContact OG1-CB 3.34Å; T635-C639 PolarHBondContact OG1-SG 3.23Å; T635-C639 VanDerWaalsContact OG1-SG 3.32Å; A636-C639 VanDerWaalsContact O-CB 3.26Å; A636-C639 WeakPolarHBondContact O-CB 3.31Å; A636-C639 PolarHBondContact O-N 2.91Å; S637-C639 PolarHBondContact O-N 3.19Å; S637-C639 VanDerWaalsContact O-N 3.16Å; C639-P641 WeakPolarHBondContact O-CD 3.35Å; C639-I755 HydrophobicContact CB-CG2 4.01Å
640	I	86.1	Confident	77.4	Confident	3 Å²	3	47.2 Å²	47.2	2%	0.015	26%	0.255	C	S	.	.	S	Bend	trans	-117.3	93.9	-171.7	-54.5	-62	0	0	0	109.4	I605 T635 S637 R638 Y648 I675 T693 L695	I605-I640 HydrophobicContact CG2-CD1 3.92Å; T635-I640 HydrophobicContact CG2-CG1 4.12Å; S637-I640 PolarHBondContact O-N 2.92Å; S637-I640 VanDerWaalsContact O-N 3.12Å; R638-I640 VanDerWaalsContact C-N 3.34Å; I640-Y648 HydrophobicContact CD1-CD1 4.21Å; I640-Y648 HydrophobicContact CD1-CE1 4.14Å; I640-Y648 HydrophobicContact CG2-CE2 4.26Å; I640-I675 HydrophobicContact CG2-CD1 4.15Å; I640-I675 HydrophobicContact CG2-CG2 4.06Å; I640-T693 HydrophobicContact CB-CG2 4.15Å; I640-T693 HydrophobicContact CG1-CG2 3.86Å; I640-T693 HydrophobicContact CG2-CG2 4.47Å; I640-L695 HydrophobicContact CD1-CD1 4.23Å; I640-L695 HydrophobicContact CD1-CD2 3.97Å; I640-L695 HydrophobicContact CG1-CD2 4.11Å
641	P	72.5	Confident	77.5	Confident	55 Å²	55	47.4 Å²	47.4	36%	0.357	26%	0.255	S	S	.	.			trans	-66.2	134.5	-178	25.1	-33.3	0	0	0	111.5	M607 C639 K643 Y648	M607-P641 HydrophobicContact CE-CG 3.76Å; C639-P641 WeakPolarHBondContact O-CD 3.35Å; P641-K643 PolarHBondContact O-N 2.99Å; P641-Y648 WeakPolarHBondContact CD-OH 3.02Å; P641-Y648 PolarHBondContact O-OH 2.86Å
642	P	60.8	Low	76.8	Confident	90 Å²	90	46.8 Å²	46.8	58%	0.584	25%	0.251	S	S	*	.	S	Bend	trans	-76	120	-171.5	28	-34.6	0	0	0	112.9
643	K	59	Low	75.7	Confident	209 Å²	209	46.8 Å²	46.8	91%	0.909	26%	0.258	S	S	*	.			trans	75	104.9	163.6	-53.3	161.8	-172.6	161.4	0	116.9	P641	P641-K643 PolarHBondContact O-N 2.99Å
644	G	58.6	Low	74.1	Confident	51 Å²	51	47.7 Å²	47.7	53%	0.526	26%	0.264	S	S	.	.	S	Bend	trans	-158.7	-179.5	158.1	0	0	0	0	0	110.1	I646	G644-I646 PolarHBondContact O-N 3.25Å
645	N	59.2	Low	72.2	Confident	176 Å²	176	49 Å²	49	94%	0.941	27%	0.27	S	S	*	.	S	Bend	trans	-77.5	54.7	165.2	-82.4	-2.7	0	0	0	110
646	I	69.8	Low	70.1	Confident	49 Å²	49	50.5 Å²	50.5	25%	0.251	28%	0.278	S	S	.	.			trans	-109.8	123.4	-171.5	-63.8	170.3	0	0	0	108	M607 G644 Y648	M607-I646 HydrophobicContact CE-CD1 4.38Å; M607-I646 HydrophobicContact CE-CG2 4.32Å; M607-I646 HydrophobicContact CG-CG2 3.47Å; M607-I646 VanDerWaalsContact CG-CG2 3.47Å; M607-I646 HydrophobicContact SD-CD1 4.23Å; M607-I646 HydrophobicContact SD-CG2 4.06Å; G644-I646 PolarHBondContact O-N 3.25Å; I646-Y648 HydrophobicContact CB-CE2 4.46Å; I646-Y648 HydrophobicContact CG2-CD2 4.45Å; I646-Y648 HydrophobicContact CG2-CE1 4.05Å; I646-Y648 HydrophobicContact CG2-CE2 3.9Å
647	N	83.5	Confident	67.9	Low	116 Å²	116	54.5 Å²	54.5	62%	0.62	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.8	147.8	172.1	-71.1	-51.2	0	0	0	109.6	I608	I608-N647 HydrophobicContact CB-CB 4.32Å; I608-N647 PolarHBondContact N-O 2.99Å; I608-N647 PolarHBondContact O-N 3.48Å
648	Y	87.4	Confident	65.6	Low	19 Å²	19	62.6 Å²	62.6	8%	0.075	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	138.4	176.4	-60.9	-87.1	0	0	0	110.1	I605 F606 M607 L616 I640 P641 I646 V672 I675	I605-Y648 HydrophobicContact CG2-CD1 4.31Å; F606-Y648 WeakPolarHBondContact O-CA 3.4Å; M607-Y648 HydrophobicContact CE-CE1 4.45Å; L616-Y648 HydrophobicContact CD2-CD1 4.36Å; L616-Y648 HydrophobicContact CD2-CE1 3.77Å; I640-Y648 HydrophobicContact CD1-CD1 4.21Å; I640-Y648 HydrophobicContact CD1-CE1 4.14Å; I640-Y648 HydrophobicContact CG2-CE2 4.26Å; P641-Y648 WeakPolarHBondContact CD-OH 3.02Å; P641-Y648 PolarHBondContact O-OH 2.86Å; I646-Y648 HydrophobicContact CB-CE2 4.46Å; I646-Y648 HydrophobicContact CG2-CD2 4.45Å; I646-Y648 HydrophobicContact CG2-CE1 4.05Å; I646-Y648 HydrophobicContact CG2-CE2 3.9Å; Y648-V672 WeakPolarHBondContact O-CG2 3.45Å; Y648-V672 PolarHBondContact O-N 3.23Å; Y648-I675 HydrophobicContact CD2-CD1 3.68Å; Y648-I675 HydrophobicContact CE2-CD1 3.81Å
649	K	85.6	Confident	63.2	Low	47 Å²	47	66 Å²	66	20%	0.204	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	150.3	168.2	-64.3	-164.8	-171.2	-139.4	0	110.3	F606 I608 L669 I670 D671	F606-K649 PolarHBondContact N-O 2.58Å; F606-K649 PolarHBondContact O-N 3.38Å; I608-K649 HydrophobicContact CD1-CB 4.21Å; I608-K649 HydrophobicContact CD1-CD 3.55Å; I608-K649 HydrophobicContact CD1-CG 3.53Å; I608-K649 HydrophobicContact CG1-CG 4.48Å; K649-L669 HydrophobicContact CB-CB 4.09Å; K649-L669 HydrophobicContact CB-CD2 4.01Å; K649-L669 HydrophobicContact CD-CB 3.71Å; K649-I670 CarbonylContact C-O 3.56Å; K649-I670 WeakPolarHBondContact CA-O 3.39Å; K649-D671 WeakPolarHBondContact CD-OD1 3.15Å; K649-D671 WeakPolarHBondContact CE-OD1 3.41Å; K649-D671 IonicContact NZ-OD1 3.97Å; K649-D671 PolarHBondContact NZ-OD1 3.4Å
650	V	80.1	Confident	60.9	Low	0 Å²	0	71 Å²	71	0%	0	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	123	178.2	-168.7	0	0	0	0	109.3	V603 H604 I605 V633 I652 I670 V672 L695 L697	V603-V650 HydrophobicContact CB-CG1 3.7Å; V603-V650 HydrophobicContact CG2-CG1 3.6Å; H604-V650 CarbonylContact O-C 3.48Å; H604-V650 VanDerWaalsContact O-CA 3.23Å; H604-V650 WeakPolarHBondContact O-CA 3.49Å; H604-V650 WeakPolarHBondContact O-CG1 3.48Å; I605-V650 HydrophobicContact CG1-CG2 4.36Å; V633-V650 HydrophobicContact CG2-CG1 4.5Å; V650-I652 HydrophobicContact CB-CD1 4.3Å; V650-I652 HydrophobicContact CB-CG1 4.29Å; V650-I652 HydrophobicContact CG1-CD1 3.86Å; V650-I652 HydrophobicContact CG1-CG1 3.69Å; V650-I670 PolarHBondContact N-O 3.44Å; V650-I670 PolarHBondContact O-N 2.77Å; V650-V672 HydrophobicContact CG2-CG2 3.86Å; V650-L695 HydrophobicContact CG2-CD1 4.05Å; V650-L697 HydrophobicContact CB-CD2 3.85Å; V650-L697 HydrophobicContact CG2-CD2 3.61Å
651	Y	74.1	Confident	59	Low	9 Å²	9	71.6 Å²	71.6	4%	0.035	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	125.3	170.7	177.5	-99.6	0	0	0	109.2	H604 G653 S654 L656 L665 T668	H604-Y651 PolarHBondContact N-O 3.36Å; H604-Y651 VanDerWaalsContact N-O 3.15Å; H604-Y651 PolarHBondContact O-N 2.82Å; Y651-G653 VanDerWaalsContact CE1-O 3.32Å; Y651-G653 WeakPolarHBondContact CE1-O 3.35Å; Y651-S654 PolarHBondContact OH-O 2.69Å; Y651-L656 HydrophobicContact CE2-CD1 4.43Å; Y651-L665 HydrophobicContact CD2-CD1 3.74Å; Y651-L665 HydrophobicContact CE2-CD1 3.93Å; Y651-T668 WeakPolarHBondContact CD2-OG1 3.37Å; Y651-T668 VanDerWaalsContact CE2-OG1 3.25Å; Y651-T668 WeakPolarHBondContact CE2-OG1 3.26Å
652	I	64.9	Low	57.7	Low	18 Å²	18	71 Å²	71	9%	0.092	37%	0.374	C	S	.	.			trans	-133.5	93.3	-173.5	-51.5	-174.3	0	0	0	108.8	V603 L621 V633 V650 I670 L697 V701 I853	V603-I652 HydrophobicContact CB-CG1 4.12Å; V603-I652 HydrophobicContact CG1-CB 4.26Å; V603-I652 HydrophobicContact CG1-CD1 4.19Å; V603-I652 HydrophobicContact CG1-CG1 3.75Å; V603-I652 HydrophobicContact CG1-CG2 3.97Å; L621-I652 HydrophobicContact CD1-CD1 4.39Å; L621-I652 HydrophobicContact CD2-CG2 4.46Å; V633-I652 HydrophobicContact CG2-CD1 4.46Å; V650-I652 HydrophobicContact CB-CD1 4.3Å; V650-I652 HydrophobicContact CB-CG1 4.29Å; V650-I652 HydrophobicContact CG1-CD1 3.86Å; V650-I652 HydrophobicContact CG1-CG1 3.69Å; I652-I670 HydrophobicContact CD1-CD1 4.39Å; I652-L697 HydrophobicContact CD1-CD1 3.47Å; I652-L697 VanDerWaalsContact CD1-CD1 3.47Å; I652-L697 HydrophobicContact CD1-CD2 4.47Å; I652-V701 HydrophobicContact CD1-CG2 3.87Å; I652-V701 HydrophobicContact CG2-CG1 4.1Å; I652-V701 HydrophobicContact CG2-CG2 4.34Å; I652-I853 HydrophobicContact CG2-CD1 3.68Å
653	G	54.3	Low	57.1	Low	25 Å²	25	72.4 Å²	72.4	26%	0.258	38%	0.377	S	S	.	.	S	Bend	trans	170.6	166.5	177.1	0	0	0	0	0	113.7	Y651	Y651-G653 VanDerWaalsContact CE1-O 3.32Å; Y651-G653 WeakPolarHBondContact CE1-O 3.35Å
654	S	46.9	Very low	56.7	Low	19 Å²	19	65.9 Å²	65.9	13%	0.133	35%	0.35	C	S	.	.	S	Bend	trans	-65.1	151	163	43	0	0	0	0	110.7	Y651 L656 T855	Y651-S654 PolarHBondContact OH-O 2.69Å; S654-L656 PolarHBondContact O-N 2.85Å; S654-T855 PolarHBondContact OG-N 2.68Å; S654-T855 PolarHBondContact OG-OG1 2.7Å
655	L	42.7	Very low	56.3	Low	52 Å²	52	64.3 Å²	64.3	27%	0.272	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-55.6	122	-175.7	-94.7	166.5	0	0	0	113.4	Y714	L655-Y714 HydrophobicContact CD1-CD2 3.34Å; L655-Y714 HydrophobicContact CD1-CE2 4.27Å; L655-Y714 HydrophobicContact CD1-CG 3.9Å
656	L	42.1	Very low	56.2	Low	31 Å²	31	60 Å²	60	16%	0.162	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-60.4	133.7	167.8	-70.2	162.6	0	0	0	109.9	Y651 S654 M660 A661 Q664 T668	Y651-L656 HydrophobicContact CE2-CD1 4.43Å; S654-L656 PolarHBondContact O-N 2.85Å; L656-M660 HydrophobicContact CB-CB 4.48Å; L656-M660 HydrophobicContact CD2-CB 4.35Å; L656-A661 HydrophobicContact CB-CB 3.93Å; L656-Q664 HydrophobicContact CD1-CB 3.72Å; L656-Q664 HydrophobicContact CD2-CB 4Å; L656-T668 HydrophobicContact CD1-CG2 4.04Å
657	P	41.6	Very low	55.6	Low	85 Å²	85	67.2 Å²	67.2	55%	0.552	33%	0.33	S	S	*	.	P	Polyproline II helix	trans	-54.6	143.7	170.4	-25.9	34.6	0	0	0	111	K659 M660 A661	P657-K659 PolarHBondContact O-N 3.02Å; P657-M660 WeakPolarHBondContact O-CA 3.33Å; P657-M660 PolarHBondContact O-N 2.88Å; P657-A661 PolarHBondContact O-N 2.82Å
658	R	34.2	Very low	54.5	Low	184 Å²	184	63.5 Å²	63.5	69%	0.694	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.8	-34	-172.5	-75.8	-171.7	-175.5	161	5.5	115.1
659	K	36.9	Very low	53.7	Low	146 Å²	146	63 Å²	63	64%	0.635	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-32.1	177.8	-64.1	-175.5	-179.3	179.6	0	113.7	P657	P657-K659 PolarHBondContact O-N 3.02Å
660	M	39.3	Very low	53.4	Low	106 Å²	106	62.1 Å²	62.1	52%	0.522	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-29	176.8	-72.8	177.3	166.8	0	0	112.2	L656 P657 V662 D663 Q664	L656-M660 HydrophobicContact CB-CB 4.48Å; L656-M660 HydrophobicContact CD2-CB 4.35Å; P657-M660 WeakPolarHBondContact O-CA 3.33Å; P657-M660 PolarHBondContact O-N 2.88Å; M660-V662 PolarHBondContact O-N 2.87Å; M660-D663 PolarHBondContact O-N 3.29Å; M660-Q664 HydrophobicContact CB-CG 4.17Å; M660-Q664 VanDerWaalsContact O-CB 3.23Å; M660-Q664 WeakPolarHBondContact O-CB 3.27Å; M660-Q664 WeakPolarHBondContact O-CG 3.46Å; M660-Q664 PolarHBondContact O-N 3.19Å
661	A	45.9	Very low	53.7	Low	16 Å²	16	64.5 Å²	64.5	13%	0.132	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-15.5	-172.9	0	0	0	0	0	115.3	L656 P657 L665 L887	L656-A661 HydrophobicContact CB-CB 3.93Å; P657-A661 PolarHBondContact O-N 2.82Å; A661-L665 WeakPolarHBondContact O-CB 3.21Å; A661-L887 HydrophobicContact CB-CD2 3.68Å; A661-L887 WeakPolarHBondContact O-CD2 3.29Å
662	V	44.4	Very low	54.3	Low	43 Å²	43	65.1 Å²	65.1	26%	0.261	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-68.9	174.6	-175.2	0	0	0	0	109.9	M660 Q664 L887 H891	M660-V662 PolarHBondContact O-N 2.87Å; V662-Q664 PolarHBondContact O-N 2.93Å; V662-L887 HydrophobicContact CB-CD2 4.45Å; V662-L887 HydrophobicContact CG2-CD2 3.82Å; V662-L887 HydrophobicContact CG2-CG 4.2Å; V662-H891 WeakPolarHBondContact CG1-CE1 3.02Å; V662-H891 VanDerWaalsContact CG1-NE2 3.33Å; V662-H891 WeakPolarHBondContact CG1-NE2 3.06Å
663	D	47.9	Very low	55.1	Low	120 Å²	120	66.6 Å²	66.6	64%	0.642	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-30.4	-173.4	-54.8	-38.1	0	0	0	113.5	M660	M660-D663 PolarHBondContact O-N 3.29Å
664	Q	50.2	Low	56.5	Low	71 Å²	71	67.2 Å²	67.2	33%	0.332	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-20.4	-177.7	-62.5	-76.6	-1.1	0	0	113.2	L656 M660 V662 N666 R667 T668	L656-Q664 HydrophobicContact CD1-CB 3.72Å; L656-Q664 HydrophobicContact CD2-CB 4Å; M660-Q664 HydrophobicContact CB-CG 4.17Å; M660-Q664 VanDerWaalsContact O-CB 3.23Å; M660-Q664 WeakPolarHBondContact O-CB 3.27Å; M660-Q664 WeakPolarHBondContact O-CG 3.46Å; M660-Q664 PolarHBondContact O-N 3.19Å; V662-Q664 PolarHBondContact O-N 2.93Å; Q664-N666 VanDerWaalsContact C-N 3.32Å; Q664-N666 PolarHBondContact O-N 2.79Å; Q664-R667 CarbonylContact O-C 3.36Å; Q664-R667 WeakPolarHBondContact O-CA 3.45Å; Q664-R667 WeakPolarHBondContact O-CB 3.12Å; Q664-R667 PolarHBondContact O-N 3.32Å; Q664-R667 VanDerWaalsContact OE1-CD 3.3Å; Q664-T668 PolarHBondContact O-N 2.83Å; Q664-T668 PolarHBondContact O-OG1 3.45Å
665	L	52	Low	58.2	Low	19 Å²	19	69.1 Å²	69.1	10%	0.099	35%	0.353	C	S	.	.	H	α-helix	trans	-59.3	-45.3	-179	176.3	67.7	0	0	0	111.3	Y651 A661 R667 T668 L669 I884	Y651-L665 HydrophobicContact CD2-CD1 3.74Å; Y651-L665 HydrophobicContact CE2-CD1 3.93Å; A661-L665 WeakPolarHBondContact O-CB 3.21Å; L665-R667 PolarHBondContact O-N 2.97Å; L665-T668 WeakPolarHBondContact CA-OG1 3.26Å; L665-T668 PolarHBondContact O-N 3.41Å; L665-T668 VanDerWaalsContact O-N 3.12Å; L665-T668 PolarHBondContact O-OG1 2.97Å; L665-L669 HydrophobicContact CD1-CD1 4.18Å; L665-L669 HydrophobicContact CD1-CG 4.13Å; L665-L669 HydrophobicContact CG-CD1 3.87Å; L665-L669 HydrophobicContact CG-CG 4.3Å; L665-L669 WeakPolarHBondContact O-CB 3.08Å; L665-L669 WeakPolarHBondContact O-CG 3.5Å; L665-L669 PolarHBondContact O-N 2.89Å; L665-I884 HydrophobicContact CD1-CD1 3.74Å; L665-I884 HydrophobicContact CD1-CG1 4.34Å; L665-I884 HydrophobicContact CD2-CD1 3.8Å; L665-I884 HydrophobicContact CD2-CG1 3.78Å; L665-I884 HydrophobicContact CD2-CG2 4.17Å; L665-I884 HydrophobicContact CG-CD1 4.42Å
666	N	55.6	Low	59.7	Low	86 Å²	86	68.3 Å²	68.3	46%	0.46	35%	0.348	S	S	.	.	H	α-helix	trans	-62.7	-20.6	174.7	-83.6	-40.7	0	0	0	114	Q664	Q664-N666 VanDerWaalsContact C-N 3.32Å; Q664-N666 PolarHBondContact O-N 2.79Å
667	R	56.9	Low	61	Low	200 Å²	200	71.6 Å²	71.6	76%	0.755	36%	0.362	S	S	*	.	H	α-helix	trans	-87.2	-30.6	173.7	-63.5	-179.5	172.3	-151.5	0.1	112.7	Q664 L665	Q664-R667 CarbonylContact O-C 3.36Å; Q664-R667 WeakPolarHBondContact O-CA 3.45Å; Q664-R667 WeakPolarHBondContact O-CB 3.12Å; Q664-R667 PolarHBondContact O-N 3.32Å; Q664-R667 VanDerWaalsContact OE1-CD 3.3Å; L665-R667 PolarHBondContact O-N 2.97Å
668	T	61	Low	62	Low	38 Å²	38	69.2 Å²	69.2	23%	0.233	35%	0.348	C	S	.	.	H	α-helix	trans	-87.5	-11	177.8	54.4	0	0	0	0	115	Y651 L656 Q664 L665 I670	Y651-T668 WeakPolarHBondContact CD2-OG1 3.37Å; Y651-T668 VanDerWaalsContact CE2-OG1 3.25Å; Y651-T668 WeakPolarHBondContact CE2-OG1 3.26Å; L656-T668 HydrophobicContact CD1-CG2 4.04Å; Q664-T668 PolarHBondContact O-N 2.83Å; Q664-T668 PolarHBondContact O-OG1 3.45Å; L665-T668 WeakPolarHBondContact CA-OG1 3.26Å; L665-T668 PolarHBondContact O-N 3.41Å; L665-T668 VanDerWaalsContact O-N 3.12Å; L665-T668 PolarHBondContact O-OG1 2.97Å; T668-I670 PolarHBondContact O-N 3.36Å
669	L	70.5	Confident	63.2	Low	7 Å²	7	61.6 Å²	61.6	4%	0.037	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	105.9	175.4	-80.6	169.2	0	0	0	110.7	F606 I613 K649 L665	F606-L669 HydrophobicContact CD2-CD2 3.55Å; F606-L669 HydrophobicContact CE2-CD2 3.94Å; F606-L669 HydrophobicContact CG-CD2 4.22Å; I613-L669 HydrophobicContact CD1-CD1 4.43Å; K649-L669 HydrophobicContact CB-CB 4.09Å; K649-L669 HydrophobicContact CB-CD2 4.01Å; K649-L669 HydrophobicContact CD-CB 3.71Å; L665-L669 HydrophobicContact CD1-CD1 4.18Å; L665-L669 HydrophobicContact CD1-CG 4.13Å; L665-L669 HydrophobicContact CG-CD1 3.87Å; L665-L669 HydrophobicContact CG-CG 4.3Å; L665-L669 WeakPolarHBondContact O-CB 3.08Å; L665-L669 WeakPolarHBondContact O-CG 3.5Å; L665-L669 PolarHBondContact O-N 2.89Å
670	I	80.4	Confident	64.1	Low	29 Å²	29	55.8 Å²	55.8	15%	0.149	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	124.4	-179.3	-54.4	-176.7	0	0	0	110.2	K649 V650 I652 T668 L697 H699 V701	K649-I670 CarbonylContact C-O 3.56Å; K649-I670 WeakPolarHBondContact CA-O 3.39Å; V650-I670 PolarHBondContact N-O 3.44Å; V650-I670 PolarHBondContact O-N 2.77Å; I652-I670 HydrophobicContact CD1-CD1 4.39Å; T668-I670 PolarHBondContact O-N 3.36Å; I670-L697 HydrophobicContact CG2-CB 4Å; I670-L697 HydrophobicContact CG2-CD1 4.48Å; I670-L697 HydrophobicContact CG2-CD2 4.37Å; I670-H699 HydrophobicContact CG2-CB 4.06Å; I670-V701 HydrophobicContact CD1-CG2 3.46Å; I670-V701 VanDerWaalsContact CD1-CG2 3.46Å
671	D	85.4	Confident	64.7	Low	51 Å²	51	51.3 Å²	51.3	27%	0.273	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.9	138.4	174	-79.6	18.2	0	0	0	112.8	K649 K698	K649-D671 WeakPolarHBondContact CD-OD1 3.15Å; K649-D671 WeakPolarHBondContact CE-OD1 3.41Å; K649-D671 IonicContact NZ-OD1 3.97Å; K649-D671 PolarHBondContact NZ-OD1 3.4Å; D671-K698 HydrophobicContact CB-CB 4.28Å; D671-K698 HydrophobicContact CB-CD 3.52Å; D671-K698 HydrophobicContact CB-CG 3.86Å; D671-K698 PolarHBondContact O-N 2.98Å; D671-K698 IonicContact OD2-NZ 2.67Å; D671-K698 PolarHBondContact OD2-NZ 2.79Å
672	V	86.8	Confident	64.7	Low	21 Å²	21	55.2 Å²	55.2	13%	0.127	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	131.8	164.1	178.9	0	0	0	0	109.6	Y648 V650 S674 I675 L695 K698	Y648-V672 WeakPolarHBondContact O-CG2 3.45Å; Y648-V672 PolarHBondContact O-N 3.23Å; V650-V672 HydrophobicContact CG2-CG2 3.86Å; V672-S674 WeakPolarHBondContact CG1-O 3.1Å; V672-I675 HydrophobicContact CG1-CG1 3.83Å; V672-L695 HydrophobicContact CG1-CB 4.3Å; V672-L695 HydrophobicContact CG1-CD2 4.2Å; V672-L695 HydrophobicContact CG2-CB 4.29Å; V672-L695 HydrophobicContact CG2-CD1 4.13Å; V672-L695 HydrophobicContact CG2-CD2 4.46Å; V672-K698 WeakPolarHBondContact O-CE 3.44Å
673	G	82.8	Confident	64.6	Low	49 Å²	49	56.1 Å²	56.1	51%	0.505	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	-34.1	177.2	0	0	0	0	0	113.9	K696	G673-K696 PolarHBondContact N-O 3.28Å
674	S	84	Confident	64.7	Low	39 Å²	39	55.9 Å²	55.9	27%	0.273	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	155.6	169.6	64	0	0	0	0	112.5	V672 H676 K696	V672-S674 WeakPolarHBondContact CG1-O 3.1Å; S674-H676 PolarHBondContact OG-NE2 3.24Å; S674-K696 PolarHBondContact N-O 2.97Å; S674-K696 PolarHBondContact O-N 3.03Å; S674-K696 WeakPolarHBondContact OG-CB 3.47Å
675	I	81.9	Confident	64.7	Low	58 Å²	58	58.4 Å²	58.4	30%	0.297	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	134.6	-179.7	-57.5	179.4	0	0	0	108.2	I640 Y648 V672 E677 T693 L695	I640-I675 HydrophobicContact CG2-CD1 4.15Å; I640-I675 HydrophobicContact CG2-CG2 4.06Å; Y648-I675 HydrophobicContact CD2-CD1 3.68Å; Y648-I675 HydrophobicContact CE2-CD1 3.81Å; V672-I675 HydrophobicContact CG1-CG1 3.83Å; I675-E677 HydrophobicContact CG2-CG 4.17Å; I675-T693 HydrophobicContact CG2-CG2 3.64Å; I675-L695 HydrophobicContact CB-CD2 4.45Å; I675-L695 HydrophobicContact CD1-CD2 4.34Å; I675-L695 HydrophobicContact CG1-CD2 3.86Å; I675-L695 HydrophobicContact CG2-CD2 4.16Å
676	H	73.5	Confident	64.8	Low	36 Å²	36	64.4 Å²	64.4	17%	0.167	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	90.2	-179.8	-58.3	-57.2	0	0	0	110	S674 T693 M694 V842	S674-H676 PolarHBondContact OG-NE2 3.24Å; H676-T693 WeakPolarHBondContact O-CA 3.47Å; H676-M694 HydrophobicContact CB-CB 4.36Å; H676-M694 HydrophobicContact CB-CE 4.42Å; H676-M694 PolarHBondContact N-O 2.69Å; H676-M694 PolarHBondContact O-N 3.22Å; H676-V842 HydrophobicContact CB-CG2 4.2Å
677	E	69.4	Low	64.9	Low	100 Å²	100	61.1 Å²	61.1	47%	0.467	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	136.7	177.6	-69.1	156.3	-141.8	0	0	111.8	I675 T693	I675-E677 HydrophobicContact CG2-CG 4.17Å; E677-T693 HydrophobicContact CG-CG2 3.98Å; E677-T693 WeakPolarHBondContact CG-OG1 3.43Å
678	S	62.6	Low	65	Low	35 Å²	35	56.2 Å²	56.2	25%	0.245	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	77.9	173.9	177.4	0	0	0	0	111.7	R209 G691 L692	R209-S678 PolarHBondContact NH2-OG 3.16Å; S678-G691 VanDerWaalsContact O-CA 3.25Å; S678-G691 WeakPolarHBondContact O-CA 3.45Å; S678-L692 WeakPolarHBondContact CA-O 3.49Å; S678-L692 WeakPolarHBondContact CB-O 3.3Å; S678-L692 PolarHBondContact N-O 3.5Å; S678-L692 PolarHBondContact O-N 2.96Å; S678-L692 VanDerWaalsContact O-N 3.14Å
679	P	60.3	Low	65.3	Low	23 Å²	23	59.7 Å²	59.7	15%	0.149	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	136.7	170.8	29.4	-35.8	0	0	0	110.7	R209 E682 K688 I690	R209-P679 PolarHBondContact NE-O 3.16Å; R209-P679 PolarHBondContact NH2-O 3.18Å; P679-E682 HydrophobicContact CG-CG 4.28Å; P679-K688 WeakPolarHBondContact CB-O 3.43Å; P679-I690 WeakPolarHBondContact CA-O 3.21Å
680	F	55.4	Low	65.3	Low	24 Å²	24	59.9 Å²	59.9	11%	0.105	32%	0.323	C	S	.	.	S	Bend	trans	-72.1	-34.7	-175.6	-66.7	-73.3	0	0	0	112.7	R209 I690 L692 V740 V801	R209-F680 VanDerWaalsContact CG-O 3.29Å; R209-F680 WeakPolarHBondContact CG-O 3.37Å; F680-I690 HydrophobicContact CD2-CG2 4.36Å; F680-I690 WeakPolarHBondContact CD2-O 2.98Å; F680-I690 PolarHBondContact N-O 2.89Å; F680-L692 HydrophobicContact CZ-CD1 4.35Å; F680-L692 HydrophobicContact CZ-CG 4.14Å; F680-V740 HydrophobicContact CD1-CG1 4.25Å; F680-V740 HydrophobicContact CG-CG1 4.48Å; F680-V801 HydrophobicContact CE2-CB 4.47Å; F680-V801 HydrophobicContact CE2-CG1 3.46Å; F680-V801 VanDerWaalsContact CE2-CG1 3.46Å; F680-V801 HydrophobicContact CE2-CG2 4.14Å; F680-V801 HydrophobicContact CZ-CG1 3.56Å
681	Y	51.1	Low	64.9	Low	13 Å²	13	58.5 Å²	58.5	5%	0.051	32%	0.316	C	S	.	.			trans	-136.6	72.7	-169.7	-58.9	-73	0	0	0	113.7	P184 G683 Y684 L687 L737 V740	P184-Y681 HydrophobicContact CB-CD1 4.2Å; P184-Y681 HydrophobicContact CB-CE1 3.88Å; P184-Y681 HydrophobicContact CG-CD1 4.42Å; P184-Y681 HydrophobicContact CG-CE1 4.43Å; Y681-G683 PolarHBondContact O-N 2.89Å; Y681-Y684 PolarHBondContact O-N 3.42Å; Y681-Y684 VanDerWaalsContact O-N 3.13Å; Y681-L687 HydrophobicContact CD2-CB 4.18Å; Y681-L687 HydrophobicContact CD2-CD1 4.02Å; Y681-L687 HydrophobicContact CG-CB 4.39Å; Y681-L687 HydrophobicContact CG-CD1 4.21Å; Y681-L737 HydrophobicContact CD2-CD1 3.81Å; Y681-L737 HydrophobicContact CE2-CD1 3.4Å; Y681-V740 HydrophobicContact CE2-CG1 4.46Å; Y681-V740 HydrophobicContact CE2-CG2 3.92Å
682	E	47	Very low	64.5	Low	98 Å²	98	56.4 Å²	56.4	46%	0.458	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.6	-24.3	170.5	-74.8	170.5	-147.4	0	0	114.5	R209 P679 K688	R209-E682 IonicContact CZ-OE1 2.71Å; R209-E682 IonicContact NH1-OE1 2.71Å; R209-E682 PolarHBondContact NH1-OE1 3.07Å; P679-E682 HydrophobicContact CG-CG 4.28Å; E682-K688 WeakPolarHBondContact O-CE 3.41Å
683	G	41.4	Very low	64.2	Low	61 Å²	61	55.4 Å²	55.4	63%	0.629	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-3.4	-177.4	0	0	0	0	0	116.1	Y681	Y681-G683 PolarHBondContact O-N 2.89Å
684	Y	50.4	Low	64	Low	115 Å²	115	54.1 Å²	54.1	45%	0.451	28%	0.279	S	S	.	.	S	Bend	trans	-131.1	113.8	-176.4	-71.4	-94	0	0	0	109.6	P184 Y681 E686 L687 K688	P184-Y684 HydrophobicContact CG-CD2 3.91Å; P184-Y684 HydrophobicContact CG-CE1 4.06Å; P184-Y684 HydrophobicContact CG-CE2 3.37Å; P184-Y684 HydrophobicContact CG-CG 4.47Å; P184-Y684 VanDerWaalsContact CG-CZ 3.45Å; Y681-Y684 PolarHBondContact O-N 3.42Å; Y681-Y684 VanDerWaalsContact O-N 3.13Å; Y684-E686 PolarHBondContact O-N 3.33Å; Y684-L687 HydrophobicContact CG-CD1 4.25Å; Y684-L687 PolarHBondContact O-N 3.16Å; Y684-K688 PolarHBondContact O-N 2.69Å
685	D	49.3	Very low	64	Low	124 Å²	124	52.2 Å²	52.2	66%	0.663	27%	0.266	S	S	*	.	G	3₁₀ helix	trans	-55.9	-45.1	-168.8	-68.9	-70.6	0	0	0	114	L687 K688	D685-L687 PolarHBondContact O-N 3.04Å; D685-L687 VanDerWaalsContact O-N 3.13Å; D685-K688 PolarHBondContact O-N 2.82Å; D685-K688 WeakPolarHBondContact OD1-CE 3.41Å; D685-K688 IonicContact OD1-NZ 2.89Å; D685-K688 PolarHBondContact OD1-NZ 2.98Å
686	E	54.2	Low	64.2	Low	146 Å²	146	52.5 Å²	52.5	68%	0.682	27%	0.265	S	S	*	.	G	3₁₀ helix	trans	-62.5	-18.2	177.2	-59.7	-174.3	-174.9	0	0	114.2	Y684	Y684-E686 PolarHBondContact O-N 3.33Å
687	L	58.5	Low	64.7	Low	17 Å²	17	51 Å²	51	9%	0.089	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-112.6	-0.6	-171.3	-58.1	174.6	0	0	0	113.1	Y681 Y684 D685 E689 I690 L737	Y681-L687 HydrophobicContact CD2-CB 4.18Å; Y681-L687 HydrophobicContact CD2-CD1 4.02Å; Y681-L687 HydrophobicContact CG-CB 4.39Å; Y681-L687 HydrophobicContact CG-CD1 4.21Å; Y684-L687 HydrophobicContact CG-CD1 4.25Å; Y684-L687 PolarHBondContact O-N 3.16Å; D685-L687 PolarHBondContact O-N 3.04Å; D685-L687 VanDerWaalsContact O-N 3.13Å; L687-E689 VanDerWaalsContact C-N 3.27Å; L687-E689 PolarHBondContact O-N 2.6Å; L687-I690 HydrophobicContact CD2-CD1 3.91Å; L687-I690 PolarHBondContact O-N 2.89Å; L687-L737 HydrophobicContact CD1-CD1 3.74Å; L687-L737 HydrophobicContact CD1-CD2 4.37Å; L687-L737 HydrophobicContact CD2-CD1 3.83Å; L687-L737 HydrophobicContact CD2-CG 4.4Å; L687-L737 HydrophobicContact CG-CD1 4.38Å
688	K	59.9	Low	65.4	Low	96 Å²	96	51.9 Å²	51.9	42%	0.417	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-29.6	-179.1	-79.4	174.8	-179.7	170.5	0	113.8	P679 E682 Y684 D685	P679-K688 WeakPolarHBondContact CB-O 3.43Å; E682-K688 WeakPolarHBondContact O-CE 3.41Å; Y684-K688 PolarHBondContact O-N 2.69Å; D685-K688 PolarHBondContact O-N 2.82Å; D685-K688 WeakPolarHBondContact OD1-CE 3.41Å; D685-K688 IonicContact OD1-NZ 2.89Å; D685-K688 PolarHBondContact OD1-NZ 2.98Å
689	E	67	Low	66.2	Low	112 Å²	112	56.5 Å²	56.5	52%	0.523	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-18.2	-179.7	-59.1	-178	150.8	0	0	112.9	S637 R638 L687	S637-E689 WeakPolarHBondContact CB-O 3.3Å; R638-E689 IonicContact CZ-OE2 2.9Å; R638-E689 VanDerWaalsContact CZ-OE2 3.23Å; R638-E689 PolarHBondContact N-O 3.32Å; R638-E689 IonicContact NH1-OE2 2.69Å; R638-E689 PolarHBondContact NH1-OE2 3.35Å; R638-E689 IonicContact NH2-OE2 2.74Å; R638-E689 PolarHBondContact NH2-OE2 3.14Å; L687-E689 VanDerWaalsContact C-N 3.27Å; L687-E689 PolarHBondContact O-N 2.6Å
690	I	70.3	Confident	66.9	Low	11 Å²	11	61.7 Å²	61.7	6%	0.056	30%	0.295	C	S	.	.			trans	-87	120.2	-174.1	-51.2	-174.6	0	0	0	108.7	P679 F680 L687 M741 V801	P679-I690 WeakPolarHBondContact CA-O 3.21Å; F680-I690 HydrophobicContact CD2-CG2 4.36Å; F680-I690 WeakPolarHBondContact CD2-O 2.98Å; F680-I690 PolarHBondContact N-O 2.89Å; L687-I690 HydrophobicContact CD2-CD1 3.91Å; L687-I690 PolarHBondContact O-N 2.89Å; I690-M741 HydrophobicContact CD1-CE 3.5Å; I690-M741 HydrophobicContact CG2-CE 3.89Å; I690-V801 HydrophobicContact CG2-CG2 4.14Å
691	G	72	Confident	67.5	Low	0 Å²	0	61.6 Å²	61.6	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-179.2	-177.7	-168	0	0	0	0	0	112.6	S637 S678	S637-G691 PolarHBondContact N-O 2.98Å; S637-G691 WeakPolarHBondContact OG-CA 3.28Å; S678-G691 VanDerWaalsContact O-CA 3.25Å; S678-G691 WeakPolarHBondContact O-CA 3.45Å
692	L	76.2	Confident	68.1	Low	7 Å²	7	64.8 Å²	64.8	4%	0.037	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	137	167.4	-64.7	177	0	0	0	109.4	T635 S637 S678 F680 I772 V801 L803 L844	T635-L692 WeakPolarHBondContact O-CA 3.31Å; S637-L692 PolarHBondContact OG-N 3.01Å; S637-L692 PolarHBondContact OG-O 2.97Å; S678-L692 WeakPolarHBondContact CA-O 3.49Å; S678-L692 WeakPolarHBondContact CB-O 3.3Å; S678-L692 PolarHBondContact N-O 3.5Å; S678-L692 PolarHBondContact O-N 2.96Å; S678-L692 VanDerWaalsContact O-N 3.14Å; F680-L692 HydrophobicContact CZ-CD1 4.35Å; F680-L692 HydrophobicContact CZ-CG 4.14Å; L692-I772 HydrophobicContact CD2-CB 4.32Å; L692-I772 HydrophobicContact CD2-CD1 3.88Å; L692-V801 HydrophobicContact CD1-CG1 4.12Å; L692-V801 HydrophobicContact CD2-CB 4.12Å; L692-V801 HydrophobicContact CD2-CG1 3.6Å; L692-V801 HydrophobicContact CG-CG1 3.78Å; L692-L803 HydrophobicContact CD1-CD2 3.63Å; L692-L844 HydrophobicContact CD1-CD1 4.01Å; L692-L844 HydrophobicContact CD1-CD2 3.77Å
693	T	80.3	Confident	68.8	Low	0 Å²	0	60.6 Å²	60.6	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	125.6	173.6	-66.1	0	0	0	0	109.4	T635 S637 I640 I675 H676 E677 L695	T635-T693 PolarHBondContact N-O 3.21Å; T635-T693 PolarHBondContact O-N 2.93Å; S637-T693 WeakPolarHBondContact CA-OG1 3.31Å; S637-T693 PolarHBondContact OG-OG1 3.18Å; I640-T693 HydrophobicContact CB-CG2 4.15Å; I640-T693 HydrophobicContact CG1-CG2 3.86Å; I640-T693 HydrophobicContact CG2-CG2 4.47Å; I675-T693 HydrophobicContact CG2-CG2 3.64Å; H676-T693 WeakPolarHBondContact O-CA 3.47Å; E677-T693 HydrophobicContact CG-CG2 3.98Å; E677-T693 WeakPolarHBondContact CG-OG1 3.43Å; T693-L695 HydrophobicContact CG2-CD2 4.3Å
694	M	80.4	Confident	69.3	Low	21 Å²	21	61.7 Å²	61.7	10%	0.103	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	116.7	173.4	-172.4	-176.6	76.4	0	0	109.3	E632 V633 H676 V842	E632-M694 HydrophobicContact CB-SD 4.38Å; E632-M694 HydrophobicContact CG-SD 4.39Å; V633-M694 CarbonylContact O-C 3.56Å; V633-M694 VanDerWaalsContact O-CA 3.31Å; V633-M694 WeakPolarHBondContact O-CA 3.44Å; H676-M694 HydrophobicContact CB-CB 4.36Å; H676-M694 HydrophobicContact CB-CE 4.42Å; H676-M694 PolarHBondContact N-O 2.69Å; H676-M694 PolarHBondContact O-N 3.22Å; M694-V842 HydrophobicContact CB-CG2 4.3Å; M694-V842 HydrophobicContact CE-CG2 3.74Å; M694-V842 HydrophobicContact SD-CG1 4.27Å; M694-V842 HydrophobicContact SD-CG2 4.05Å
695	L	83.8	Confident	69	Low	0 Å²	0	62 Å²	62	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	129.4	168.9	-56.4	178.8	0	0	0	108.4	I605 V633 I640 V650 V672 I675 T693	I605-L695 HydrophobicContact CD1-CD1 3.64Å; I605-L695 HydrophobicContact CG1-CD1 3.87Å; I605-L695 HydrophobicContact CG2-CD1 4.18Å; V633-L695 HydrophobicContact CB-CB 4.24Å; V633-L695 HydrophobicContact CG1-CD1 4.48Å; V633-L695 PolarHBondContact N-O 2.75Å; V633-L695 PolarHBondContact O-N 3.36Å; I640-L695 HydrophobicContact CD1-CD1 4.23Å; I640-L695 HydrophobicContact CD1-CD2 3.97Å; I640-L695 HydrophobicContact CG1-CD2 4.11Å; V650-L695 HydrophobicContact CG2-CD1 4.05Å; V672-L695 HydrophobicContact CG1-CB 4.3Å; V672-L695 HydrophobicContact CG1-CD2 4.2Å; V672-L695 HydrophobicContact CG2-CB 4.29Å; V672-L695 HydrophobicContact CG2-CD1 4.13Å; V672-L695 HydrophobicContact CG2-CD2 4.46Å; I675-L695 HydrophobicContact CB-CD2 4.45Å; I675-L695 HydrophobicContact CD1-CD2 4.34Å; I675-L695 HydrophobicContact CG1-CD2 3.86Å; I675-L695 HydrophobicContact CG2-CD2 4.16Å; T693-L695 HydrophobicContact CG2-CD2 4.3Å
696	K	85.2	Confident	68.3	Low	64 Å²	64	59.6 Å²	59.6	28%	0.278	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	120.8	169	-167.9	175.7	-179.2	65.5	0	109.3	D631 G673 S674	D631-K696 CarbonylContact O-C 3.56Å; D631-K696 VanDerWaalsContact O-CA 3.28Å; D631-K696 WeakPolarHBondContact O-CA 3.29Å; D631-K696 IonicContact OD1-NZ 3.23Å; D631-K696 PolarHBondContact OD1-NZ 3.28Å; D631-K696 WeakPolarHBondContact OD2-CE 3.45Å; D631-K696 IonicContact OD2-NZ 3.06Å; D631-K696 PolarHBondContact OD2-NZ 3.2Å; G673-K696 PolarHBondContact N-O 3.28Å; S674-K696 PolarHBondContact N-O 2.97Å; S674-K696 PolarHBondContact O-N 3.03Å; S674-K696 WeakPolarHBondContact OG-CB 3.47Å
697	L	84.1	Confident	67.1	Low	5 Å²	5	55 Å²	55	3%	0.026	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	151.5	178.8	-55.2	178.4	0	0	0	111.1	L621 D631 V633 V650 I652 I670 H699 V701	L621-L697 HydrophobicContact CD1-CD1 4.29Å; D631-L697 HydrophobicContact CB-CB 4.14Å; D631-L697 PolarHBondContact O-N 2.69Å; V633-L697 HydrophobicContact CG2-CD1 4.14Å; V633-L697 HydrophobicContact CG2-CD2 4.21Å; V633-L697 HydrophobicContact CG2-CG 4.24Å; V650-L697 HydrophobicContact CB-CD2 3.85Å; V650-L697 HydrophobicContact CG2-CD2 3.61Å; I652-L697 HydrophobicContact CD1-CD1 3.47Å; I652-L697 VanDerWaalsContact CD1-CD1 3.47Å; I652-L697 HydrophobicContact CD1-CD2 4.47Å; I670-L697 HydrophobicContact CG2-CB 4Å; I670-L697 HydrophobicContact CG2-CD1 4.48Å; I670-L697 HydrophobicContact CG2-CD2 4.37Å; L697-H699 VanDerWaalsContact CB-O 3.3Å; L697-H699 WeakPolarHBondContact CB-O 3.48Å; L697-H699 PolarHBondContact O-N 2.95Å; L697-V701 HydrophobicContact CD1-CG2 4.06Å
698	K	84.7	Confident	65.8	Low	118 Å²	118	59.7 Å²	59.7	51%	0.513	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	-21.1	170.7	-68.2	-169.6	-166.4	162.2	0	112.8	D671 V672	D671-K698 HydrophobicContact CB-CB 4.28Å; D671-K698 HydrophobicContact CB-CD 3.52Å; D671-K698 HydrophobicContact CB-CG 3.86Å; D671-K698 PolarHBondContact O-N 2.98Å; D671-K698 IonicContact OD2-NZ 2.67Å; D671-K698 PolarHBondContact OD2-NZ 2.79Å; V672-K698 WeakPolarHBondContact O-CE 3.44Å
699	H	79.6	Confident	64.4	Low	131 Å²	131	56.3 Å²	56.3	61%	0.606	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.5	144.8	-177.5	-59	-15.6	0	0	0	110	I670 L697	I670-H699 HydrophobicContact CG2-CB 4.06Å; L697-H699 VanDerWaalsContact CB-O 3.3Å; L697-H699 WeakPolarHBondContact CB-O 3.48Å; L697-H699 PolarHBondContact O-N 2.95Å
700	R	74.9	Confident	62.4	Low	133 Å²	133	57.8 Å²	57.8	50%	0.502	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	129.6	177.2	-60.6	-179.9	76.6	-166.7	4.9	110.2	Y629 S630 D631	Y629-R700 VanDerWaalsContact CB-CZ 3.48Å; Y629-R700 HydrophobicContact CD1-CB 4.37Å; Y629-R700 PolarHBondContact O-NH2 3Å; S630-R700 CarbonylContact O-C 3.6Å; S630-R700 WeakPolarHBondContact O-CA 2.96Å; D631-R700 HydrophobicContact CB-CG 3.89Å
701	V	68.3	Low	60.4	Low	21 Å²	21	62.6 Å²	62.6	13%	0.127	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	138.6	174.4	-173.9	0	0	0	0	109.5	L621 Y629 S630 I652 I670 L697 I853	L621-V701 HydrophobicContact CD2-CB 4.26Å; L621-V701 HydrophobicContact CD2-CG1 4.39Å; Y629-V701 VanDerWaalsContact CA-O 3.29Å; Y629-V701 WeakPolarHBondContact CA-O 3.34Å; S630-V701 PolarHBondContact N-O 3.2Å; S630-V701 PolarHBondContact O-N 3.42Å; I652-V701 HydrophobicContact CD1-CG2 3.87Å; I652-V701 HydrophobicContact CG2-CG1 4.1Å; I652-V701 HydrophobicContact CG2-CG2 4.34Å; I670-V701 HydrophobicContact CD1-CG2 3.46Å; I670-V701 VanDerWaalsContact CD1-CG2 3.46Å; L697-V701 HydrophobicContact CD1-CG2 4.06Å; V701-I853 HydrophobicContact CG1-CD1 3.75Å
702	K	63.5	Low	58.4	Low	81 Å²	81	65.2 Å²	65.2	35%	0.352	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	136.7	172.7	-165	171.6	-174.3	159.2	0	110.6	E628 Y629 I704	E628-K702 CarbonylContact O-C 3.59Å; E628-K702 WeakPolarHBondContact O-CA 3.41Å; E628-K702 WeakPolarHBondContact O-CG 3.35Å; E628-K702 WeakPolarHBondContact OE2-CE 3.47Å; E628-K702 IonicContact OE2-NZ 3.09Å; E628-K702 PolarHBondContact OE2-NZ 2.85Å; Y629-K702 HydrophobicContact CD1-CB 4.01Å; Y629-K702 HydrophobicContact CD1-CG 4.31Å; Y629-K702 HydrophobicContact CE1-CB 3.64Å; Y629-K702 HydrophobicContact CE1-CD 4.28Å; Y629-K702 HydrophobicContact CE1-CG 3.87Å; Y629-K702 HydrophobicContact CE2-CD 4.32Å; Y629-K702 HydrophobicContact CE2-CG 4.24Å; K702-I704 HydrophobicContact CG-CG1 4.29Å
703	V	60.8	Low	56.3	Low	10 Å²	10	69.9 Å²	69.9	6%	0.061	37%	0.368	C	S	.	.			trans	-108.6	123.1	-176	-175	0	0	0	0	107.4	A623 E628 F851	A623-V703 HydrophobicContact CB-CB 4.48Å; A623-V703 HydrophobicContact CB-CG1 3.99Å; A623-V703 HydrophobicContact CB-CG2 3.83Å; E628-V703 PolarHBondContact O-N 2.82Å; V703-F851 HydrophobicContact CG1-CB 3.42Å; V703-F851 VanDerWaalsContact CG1-CB 3.42Å; V703-F851 HydrophobicContact CG1-CD1 3.34Å; V703-F851 HydrophobicContact CG1-CD2 3.79Å; V703-F851 HydrophobicContact CG1-CE1 3.93Å; V703-F851 HydrophobicContact CG1-CE2 4.33Å; V703-F851 HydrophobicContact CG1-CG 3.23Å; V703-F851 HydrophobicContact CG1-CZ 4.38Å
704	I	52.5	Low	54.5	Low	84 Å²	84	74.9 Å²	74.9	43%	0.431	39%	0.388	S	S	.	.	B	Isolated β-bridge	trans	-124.1	136.9	-170.8	-57.8	177.4	0	0	0	110	K702 Y852	K702-I704 HydrophobicContact CG-CG1 4.29Å; I704-Y852 PolarHBondContact O-N 2.87Å; I704-Y852 VanDerWaalsContact O-O 3.09Å
705	N	42.9	Very low	52.8	Low	122 Å²	122	75.3 Å²	75.3	65%	0.652	39%	0.393	S	S	*	.			trans	-93.5	148.6	175.1	-83.4	-14.8	0	0	0	111.3	F851	N705-F851 VanDerWaalsContact OD1-CD1 3.31Å; N705-F851 WeakPolarHBondContact OD1-CD1 3.4Å; N705-F851 WeakPolarHBondContact OD1-CE1 3.42Å
706	G	36.4	Very low	51.5	Low	72 Å²	72	77 Å²	77	74%	0.742	40%	0.403	S	S	*	.			trans	87.7	16.1	156.4	0	0	0	0	0	117.9
707	V	29	Very low	50.5	Low	50 Å²	50	77.8 Å²	77.8	30%	0.303	40%	0.404	S	S	.	.			trans	-92.6	118.2	169.5	-173.6	0	0	0	0	109.3	F710 Y852 V854	V707-F710 HydrophobicContact CG1-CE2 4.33Å; V707-Y852 WeakPolarHBondContact O-CD1 3.23Å; V707-Y852 WeakPolarHBondContact O-CE1 3.48Å; V707-V854 HydrophobicContact CB-CG2 4.28Å; V707-V854 HydrophobicContact CG1-CB 4.05Å; V707-V854 HydrophobicContact CG1-CG1 4.26Å; V707-V854 HydrophobicContact CG1-CG2 3.88Å
708	Q	30.2	Very low	49.7	Very low	116 Å²	116	78.4 Å²	78.4	54%	0.542	41%	0.407	S	S	.	.			trans	-57.5	141.2	179.2	-165.6	170.7	7	0	0	110.9	D595 F710	D595-Q708 PolarHBondContact O-NE2 3.48Å; Q708-F710 PolarHBondContact O-N 3.42Å
709	S	30.1	Very low	49.1	Very low	24 Å²	24	78 Å²	78	17%	0.168	41%	0.407	C	S	.	.			trans	-70.4	103.1	-176.6	90.7	0	0	0	0	110.9	L597 R717	L597-S709 VanDerWaalsContact O-CB 3.23Å; L597-S709 WeakPolarHBondContact O-CB 3.29Å; L597-S709 PolarHBondContact O-OG 2.86Å; L597-S709 VanDerWaalsContact O-OG 3.11Å; S709-R717 PolarHBondContact OG-NH2 2.89Å
710	F	24.7	Very low	49.1	Very low	143 Å²	143	71.8 Å²	71.8	63%	0.627	38%	0.379	S	S	*	.			trans	-56.8	133.7	161.5	-68.6	-82.2	0	0	0	108.6	V707 Q708 L712 V854	V707-F710 HydrophobicContact CG1-CE2 4.33Å; Q708-F710 PolarHBondContact O-N 3.42Å; F710-L712 VanDerWaalsContact C-N 3.32Å; F710-L712 PolarHBondContact O-N 2.89Å; F710-V854 HydrophobicContact CD2-CG1 4.4Å
711	P	29	Very low	49.4	Very low	113 Å²	113	71.8 Å²	71.8	73%	0.734	38%	0.384	S	S	*	.			trans	-68	93.3	175.3	27.8	-33.2	0	0	0	108.7	P713	P711-P713 WeakPolarHBondContact O-CD 3.41Å; P711-P713 VanDerWaalsContact O-N 3.17Å
712	L	30.6	Very low	50.1	Low	54 Å²	54	73.1 Å²	73.1	28%	0.283	39%	0.39	S	S	.	.			trans	-57.8	118.3	176.1	-72.5	174	0	0	0	108.3	F710 Y714 S715	F710-L712 VanDerWaalsContact C-N 3.32Å; F710-L712 PolarHBondContact O-N 2.89Å; L712-Y714 PolarHBondContact O-N 3.24Å; L712-S715 VanDerWaalsContact CB-OG 3.28Å; L712-S715 WeakPolarHBondContact CB-OG 3.31Å; L712-S715 WeakPolarHBondContact CD1-OG 3.32Å; L712-S715 PolarHBondContact O-N 2.9Å
713	P	31.6	Very low	50.8	Low	105 Å²	105	70.5 Å²	70.5	68%	0.682	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	6.8	-167.4	22.7	-32.1	0	0	0	115.5	P711	P711-P713 WeakPolarHBondContact O-CD 3.41Å; P711-P713 VanDerWaalsContact O-N 3.17Å
714	Y	42.6	Very low	51.4	Low	106 Å²	106	73.4 Å²	73.4	42%	0.416	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-144.2	25.1	178.3	-48.9	-86.3	0	0	0	111.9	L655 L712 E881	L655-Y714 HydrophobicContact CD1-CD2 3.34Å; L655-Y714 HydrophobicContact CD1-CE2 4.27Å; L655-Y714 HydrophobicContact CD1-CG 3.9Å; L712-Y714 PolarHBondContact O-N 3.24Å; Y714-E881 WeakPolarHBondContact O-CB 3.4Å; Y714-E881 PolarHBondContact O-N 2.9Å
715	S	45.4	Very low	52.3	Low	29 Å²	29	72.1 Å²	72.1	20%	0.203	40%	0.395	C	S	.	.			trans	-101.6	108	170	-66.2	0	0	0	0	110.4	L712 L879	L712-S715 VanDerWaalsContact CB-OG 3.28Å; L712-S715 WeakPolarHBondContact CB-OG 3.31Å; L712-S715 WeakPolarHBondContact CD1-OG 3.32Å; L712-S715 PolarHBondContact O-N 2.9Å; S715-L879 CarbonylContact C-O 3.51Å; S715-L879 VanDerWaalsContact CA-O 3.3Å; S715-L879 WeakPolarHBondContact CA-O 3.49Å
716	V	55.1	Low	53.6	Low	36 Å²	36	70 Å²	70	22%	0.218	39%	0.387	C	S	.	.			trans	-84.8	115.3	-179.4	-174.9	0	0	0	0	108.8	I718 I750 L751 L879	V716-I718 HydrophobicContact CG1-CD1 4.01Å; V716-I718 HydrophobicContact CG1-CG1 3.81Å; V716-I750 HydrophobicContact CG1-CG2 3.94Å; V716-L751 HydrophobicContact CG1-CD2 4.22Å; V716-L879 HydrophobicContact CB-CB 4.41Å; V716-L879 HydrophobicContact CB-CD2 4.44Å; V716-L879 PolarHBondContact N-O 2.8Å; V716-L879 WeakPolarHBondContact O-CA 3.38Å; V716-L879 VanDerWaalsContact O-CB 3.31Å; V716-L879 WeakPolarHBondContact O-CB 3.45Å; V716-L879 PolarHBondContact O-N 3.46Å; V716-L879 VanDerWaalsContact O-O 3.11Å
717	R	64.8	Low	55.6	Low	81 Å²	81	70.1 Å²	70.1	31%	0.306	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	130.1	171.3	-61.7	178.6	173.4	152.4	-8.6	108	P598 S709 L876 V877 I878	P598-R717 PolarHBondContact O-NH2 2.88Å; S709-R717 PolarHBondContact OG-NH2 2.89Å; R717-L876 HydrophobicContact CB-CD1 4.37Å; R717-L876 HydrophobicContact CB-CD2 4.01Å; R717-L876 HydrophobicContact CB-CG 4.2Å; R717-L876 HydrophobicContact CG-CD2 4.35Å; R717-V877 WeakPolarHBondContact CA-O 3.09Å; R717-I878 HydrophobicContact CG-CD1 4.42Å; R717-I878 HydrophobicContact CG-CG1 4.1Å; R717-I878 HydrophobicContact CG-CG2 4.29Å
718	I	67.9	Low	58	Low	17 Å²	17	67.8 Å²	67.8	9%	0.087	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	132.7	-178.9	-58.4	-166.8	0	0	0	110.1	V716 Y720 Q747 I750 L751 V877	V716-I718 HydrophobicContact CG1-CD1 4.01Å; V716-I718 HydrophobicContact CG1-CG1 3.81Å; I718-Y720 HydrophobicContact CB-CE2 4.34Å; I718-Y720 HydrophobicContact CG2-CD2 4.17Å; I718-Y720 HydrophobicContact CG2-CE2 3.98Å; I718-Q747 WeakPolarHBondContact CD1-O 3.5Å; I718-I750 HydrophobicContact CD1-CB 3.77Å; I718-I750 HydrophobicContact CD1-CG2 4.23Å; I718-L751 HydrophobicContact CD1-CD1 4.27Å; I718-L751 HydrophobicContact CD1-CD2 3.42Å; I718-L751 VanDerWaalsContact CD1-CD2 3.42Å; I718-L751 HydrophobicContact CD1-CG 3.57Å; I718-L751 HydrophobicContact CG1-CD2 3.82Å; I718-L751 HydrophobicContact CG1-CG 4.43Å; I718-V877 PolarHBondContact N-O 2.65Å; I718-V877 PolarHBondContact O-N 3.37Å
719	Q	71.6	Confident	60.2	Low	109 Å²	109	66.9 Å²	66.9	51%	0.509	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	130.5	171.5	178	166	-10.9	0	0	110	L875 L876	Q719-L875 WeakPolarHBondContact CA-O 3.33Å; Q719-L876 HydrophobicContact CB-CD1 4.43Å
720	Y	79	Confident	62.6	Low	1 Å²	1	72.7 Å²	72.7	0%	0.004	37%	0.372	C	S	.	.			trans	-116.5	127.2	174.2	-93	-93.2	0	0	0	109.4	I718 L722 V745 G746 L751 A798 F800 L875 V877	I718-Y720 HydrophobicContact CB-CE2 4.34Å; I718-Y720 HydrophobicContact CG2-CD2 4.17Å; I718-Y720 HydrophobicContact CG2-CE2 3.98Å; Y720-L722 PolarHBondContact O-N 2.82Å; Y720-V745 VanDerWaalsContact CD1-O 3.29Å; Y720-V745 WeakPolarHBondContact CD1-O 3.38Å; Y720-G746 VanDerWaalsContact CE1-CA 3.47Å; Y720-L751 HydrophobicContact CE2-CD1 4.16Å; Y720-A798 HydrophobicContact CD1-CB 4.27Å; Y720-A798 HydrophobicContact CE1-CB 3.6Å; Y720-F800 HydrophobicContact CD1-CE2 4.06Å; Y720-F800 AromaticContact CD1-CZ 3.75Å; Y720-F800 HydrophobicContact CD1-CZ 3.75Å; Y720-F800 HydrophobicContact CD2-CZ 4.28Å; Y720-F800 HydrophobicContact CE1-CZ 4.12Å; Y720-F800 HydrophobicContact CG-CE2 4.44Å; Y720-F800 AromaticContact CG-CZ 3.85Å; Y720-F800 HydrophobicContact CG-CZ 3.85Å; Y720-L875 PolarHBondContact N-O 3.06Å; Y720-L875 WeakPolarHBondContact O-CB 3.5Å; Y720-V877 HydrophobicContact CD2-CB 3.84Å; Y720-V877 HydrophobicContact CD2-CG2 3.34Å; Y720-V877 HydrophobicContact CE2-CB 4.11Å; Y720-V877 HydrophobicContact CE2-CG2 3.89Å; Y720-V877 HydrophobicContact CG-CG2 4.02Å
721	Q	81.5	Confident	65.3	Low	134 Å²	134	70.8 Å²	70.8	63%	0.626	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.8	108	171.4	-178.6	177.9	6.1	0	0	108	G744 V745	Q721-G744 CarbonylContact O-C 3.5Å; Q721-G744 WeakPolarHBondContact O-CA 3.32Å; Q721-V745 HydrophobicContact CB-CG2 3.9Å; Q721-V745 HydrophobicContact CG-CG2 4.48Å; Q721-V745 PolarHBondContact N-O 2.96Å; Q721-V745 PolarHBondContact O-N 3Å
722	L	82.5	Confident	67.8	Low	48 Å²	48	66.2 Å²	66.2	25%	0.251	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	136.1	172.8	-66.4	-174.1	0	0	0	110.2	Y720 Y742 C743 L759 F800 L875	Y720-L722 PolarHBondContact O-N 2.82Å; L722-Y742 HydrophobicContact CD1-CD1 4.4Å; L722-Y742 HydrophobicContact CD1-CG 4.34Å; L722-C743 WeakPolarHBondContact CA-O 3.45Å; L722-L759 HydrophobicContact CD1-CD2 4.31Å; L722-L759 HydrophobicContact CD2-CD2 4.13Å; L722-F800 HydrophobicContact CD2-CD2 4.19Å; L722-F800 HydrophobicContact CD2-CE2 4.21Å; L722-L875 HydrophobicContact CB-CD1 4.38Å; L722-L875 HydrophobicContact CD1-CD1 3.9Å; L722-L875 HydrophobicContact CD1-CD2 3.73Å; L722-L875 HydrophobicContact CD1-CG 4.49Å; L722-L875 HydrophobicContact CG-CD1 3.91Å; L722-L875 HydrophobicContact CG-CD2 3.85Å
723	L	79.5	Confident	70.1	Confident	27 Å²	27	65.1 Å²	65.1	14%	0.141	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-92.4	152.7	176.7	-65.6	-177.2	0	0	0	110.5	E727 C728 C743 V745	L723-E727 HydrophobicContact CB-CB 3.95Å; L723-E727 HydrophobicContact CD1-CB 4.29Å; L723-E727 HydrophobicContact CD2-CB 4.43Å; L723-E727 HydrophobicContact CG-CB 4.46Å; L723-C728 PolarHBondContact O-SG 2.91Å; L723-C728 VanDerWaalsContact O-SG 3.36Å; L723-C743 PolarHBondContact N-O 3.23Å; L723-V745 HydrophobicContact CD1-CG1 4.19Å
724	T	73.5	Confident	71.9	Confident	70 Å²	70	66.4 Å²	66.4	43%	0.429	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-64.3	158	171.8	65.4	0	0	0	0	110.9	T726 E727 C728	T724-T726 PolarHBondContact O-N 2.86Å; T724-E727 WeakPolarHBondContact CA-OE2 3.03Å; T724-E727 WeakPolarHBondContact CB-OE2 3.25Å; T724-E727 VanDerWaalsContact CG2-OE2 3.26Å; T724-E727 WeakPolarHBondContact CG2-OE2 3.49Å; T724-E727 PolarHBondContact N-OE2 3.42Å; T724-E727 PolarHBondContact O-N 2.94Å; T724-E727 VanDerWaalsContact O-N 3.16Å; T724-E727 VanDerWaalsContact OG1-CD 3.3Å; T724-E727 WeakPolarHBondContact OG1-CG 3.48Å; T724-E727 PolarHBondContact OG1-N 2.91Å; T724-E727 PolarHBondContact OG1-OE2 3.31Å; T724-C728 WeakPolarHBondContact O-CB 3.49Å; T724-C728 PolarHBondContact O-N 3.41Å; T724-C728 PolarHBondContact O-SG 2.02Å
725	P	71.5	Confident	73.3	Confident	58 Å²	58	66.2 Å²	66.2	38%	0.377	34%	0.339	S	S	.	.	H	α-helix	trans	-54.3	-27.6	175.5	-28.6	36.9	0	0	0	114.3	K729 F736 P738	P725-K729 WeakPolarHBondContact O-CB 3.32Å; P725-K729 PolarHBondContact O-N 2.91Å; P725-F736 HydrophobicContact CB-CE1 4.21Å; P725-F736 WeakPolarHBondContact O-CE1 3.42Å; P725-P738 HydrophobicContact CB-CB 4.23Å
726	T	70.1	Confident	74.8	Confident	77 Å²	77	65.1 Å²	65.1	47%	0.472	33%	0.331	S	S	.	.	H	α-helix	trans	-71.4	-51.9	177.1	-52.3	0	0	0	0	111.5	T724 K729 Q730	T724-T726 PolarHBondContact O-N 2.86Å; T726-K729 PolarHBondContact O-N 2.8Å; T726-Q730 WeakPolarHBondContact O-CG 3.42Å; T726-Q730 PolarHBondContact O-N 3.19Å
727	E	78.5	Confident	75.7	Confident	75 Å²	75	63.6 Å²	63.6	35%	0.35	32%	0.321	S	S	.	.	H	α-helix	trans	-64.2	-43.9	177.2	-67.2	156.4	135.7	0	0	110.9	L723 T724 K729 Q730 H731	L723-E727 HydrophobicContact CB-CB 3.95Å; L723-E727 HydrophobicContact CD1-CB 4.29Å; L723-E727 HydrophobicContact CD2-CB 4.43Å; L723-E727 HydrophobicContact CG-CB 4.46Å; T724-E727 WeakPolarHBondContact CA-OE2 3.03Å; T724-E727 WeakPolarHBondContact CB-OE2 3.25Å; T724-E727 VanDerWaalsContact CG2-OE2 3.26Å; T724-E727 WeakPolarHBondContact CG2-OE2 3.49Å; T724-E727 PolarHBondContact N-OE2 3.42Å; T724-E727 PolarHBondContact O-N 2.94Å; T724-E727 VanDerWaalsContact O-N 3.16Å; T724-E727 VanDerWaalsContact OG1-CD 3.3Å; T724-E727 WeakPolarHBondContact OG1-CG 3.48Å; T724-E727 PolarHBondContact OG1-N 2.91Å; T724-E727 PolarHBondContact OG1-OE2 3.31Å; E727-K729 PolarHBondContact O-N 2.99Å; E727-Q730 WeakPolarHBondContact O-CB 3.26Å; E727-Q730 PolarHBondContact O-N 3.07Å; E727-H731 PolarHBondContact O-CD2 3.02Å; E727-H731 VanDerWaalsContact O-CD2 3.22Å; E727-H731 PolarHBondContact O-N 3.22Å
728	C	79	Confident	75.9	Confident	1 Å²	1	60.4 Å²	60.4	1%	0.007	31%	0.311	C	S	.	.	H	α-helix	trans	-49.7	-45.1	171.6	-65.9	0	0	0	0	111.7	L723 T724 L732 F736 C743	L723-C728 PolarHBondContact O-SG 2.91Å; L723-C728 VanDerWaalsContact O-SG 3.36Å; T724-C728 WeakPolarHBondContact O-CB 3.49Å; T724-C728 PolarHBondContact O-N 3.41Å; T724-C728 PolarHBondContact O-SG 2.02Å; C728-L732 VanDerWaalsContact O-CB 3.3Å; C728-L732 WeakPolarHBondContact O-CB 3.16Å; C728-L732 WeakPolarHBondContact O-CG 3.49Å; C728-L732 PolarHBondContact O-N 2.93Å; C728-F736 HydrophobicContact CB-CD1 3.45Å; C728-F736 VanDerWaalsContact CB-CD1 3.45Å; C728-F736 HydrophobicContact CB-CD2 3.78Å; C728-F736 HydrophobicContact CB-CE1 3.27Å; C728-F736 HydrophobicContact CB-CE2 3.61Å; C728-F736 HydrophobicContact CB-CG 3.7Å; C728-F736 HydrophobicContact CB-CZ 3.35Å; C728-C743 HydrophobicContact CB-CB 4.18Å; C728-C743 VanDerWaalsContact SG-CB 3.6Å; C728-C743 PolarHBondContact SG-SG 3.14Å
729	K	77	Confident	75.5	Confident	97 Å²	97	60 Å²	60	42%	0.422	31%	0.31	S	S	.	.	H	α-helix	trans	-73.6	-29.3	179.5	-172.8	174.6	179.3	178.8	0	113	P725 T726 E727 G733 F736	P725-K729 WeakPolarHBondContact O-CB 3.32Å; P725-K729 PolarHBondContact O-N 2.91Å; T726-K729 PolarHBondContact O-N 2.8Å; E727-K729 PolarHBondContact O-N 2.99Å; K729-G733 WeakPolarHBondContact O-CA 3.28Å; K729-G733 PolarHBondContact O-N 2.85Å; K729-F736 HydrophobicContact CB-CD1 4.32Å
730	Q	80.4	Confident	75.4	Confident	145 Å²	145	55 Å²	55	68%	0.678	29%	0.287	S	S	*	.	H	α-helix	trans	-67.2	-44.1	172.4	-71.1	168.8	-7.1	0	0	111.4	T726 E727	T726-Q730 WeakPolarHBondContact O-CG 3.42Å; T726-Q730 PolarHBondContact O-N 3.19Å; E727-Q730 WeakPolarHBondContact O-CB 3.26Å; E727-Q730 PolarHBondContact O-N 3.07Å
731	H	80.4	Confident	75.4	Confident	104 Å²	104	55.2 Å²	55.2	48%	0.481	29%	0.288	S	S	.	.	H	α-helix	trans	-74.9	-37	179.7	-71.6	-73.1	0	0	0	113.9	E727 V797	E727-H731 PolarHBondContact O-CD2 3.02Å; E727-H731 VanDerWaalsContact O-CD2 3.22Å; E727-H731 PolarHBondContact O-N 3.22Å; H731-V797 HydrophobicContact CB-CG1 4.4Å; H731-V797 HydrophobicContact CB-CG2 4.31Å
732	L	81.1	Confident	75.5	Confident	17 Å²	17	52.2 Å²	52.2	9%	0.089	27%	0.271	C	S	.	.	H	α-helix	trans	-113.4	-7.6	-168.4	-55.7	-176.5	0	0	0	114.5	C728 N734 K735 F736 C743 F777 V797 L799	C728-L732 VanDerWaalsContact O-CB 3.3Å; C728-L732 WeakPolarHBondContact O-CB 3.16Å; C728-L732 WeakPolarHBondContact O-CG 3.49Å; C728-L732 PolarHBondContact O-N 2.93Å; L732-N734 PolarHBondContact O-N 3.06Å; L732-K735 WeakPolarHBondContact O-CB 3.48Å; L732-K735 PolarHBondContact O-N 2.81Å; L732-K735 VanDerWaalsContact O-N 3.15Å; L732-F736 HydrophobicContact CB-CB 3.83Å; L732-F736 HydrophobicContact CD1-CB 4.14Å; L732-C743 HydrophobicContact CD1-CB 3.93Å; L732-F777 HydrophobicContact CD1-CD2 4.41Å; L732-F777 HydrophobicContact CD1-CE2 4.26Å; L732-F777 HydrophobicContact CD2-CB 4.33Å; L732-F777 HydrophobicContact CD2-CD2 3.29Å; L732-F777 HydrophobicContact CD2-CE2 3.73Å; L732-F777 HydrophobicContact CD2-CG 3.98Å; L732-F777 HydrophobicContact CG-CD2 4.45Å; L732-V797 HydrophobicContact CD1-CG1 4Å; L732-V797 HydrophobicContact CD2-CB 4.35Å; L732-V797 HydrophobicContact CD2-CG1 3.75Å; L732-V797 HydrophobicContact CG-CG1 4Å; L732-L799 HydrophobicContact CD1-CD1 4.33Å; L732-L799 HydrophobicContact CD1-CD2 3.64Å; L732-L799 HydrophobicContact CD1-CG 3.84Å
733	G	79	Confident	75.6	Confident	31 Å²	31	49.9 Å²	49.9	32%	0.32	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	54.9	-129.5	-179	0	0	0	0	0	112.6	K729 K735	K729-G733 WeakPolarHBondContact O-CA 3.28Å; K729-G733 PolarHBondContact O-N 2.85Å; G733-K735 PolarHBondContact O-N 3.11Å
734	N	69.3	Low	75.9	Confident	131 Å²	131	48.6 Å²	48.6	70%	0.701	25%	0.252	S	S	*	.	G	3₁₀ helix	trans	-73	-10.7	-177.9	-65.6	-24.1	0	0	0	114.4	L732 F736	L732-N734 PolarHBondContact O-N 3.06Å; N734-F736 VanDerWaalsContact C-N 3.32Å
735	K	71.5	Confident	76.3	Confident	103 Å²	103	46.6 Å²	46.6	45%	0.448	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-77	-20.4	-180	-60.3	-175.8	179.7	-179.1	0	112.9	L732 G733 F777	L732-K735 WeakPolarHBondContact O-CB 3.48Å; L732-K735 PolarHBondContact O-N 2.81Å; L732-K735 VanDerWaalsContact O-N 3.15Å; G733-K735 PolarHBondContact O-N 3.11Å; K735-F777 HydrophobicContact CB-CZ 4.42Å; K735-F777 HydrophobicContact CD-CE1 3.85Å; K735-F777 HydrophobicContact CD-CZ 3.87Å
736	F	77.9	Confident	76.4	Confident	6 Å²	6	44.1 Å²	44.1	3%	0.026	22%	0.224	C	C	.	.			trans	-87.6	127.7	176.1	173.1	-110.5	0	0	0	111.5	P725 C728 K729 L732 N734 P738 M741 C743 L799	P725-F736 HydrophobicContact CB-CE1 4.21Å; P725-F736 WeakPolarHBondContact O-CE1 3.42Å; C728-F736 HydrophobicContact CB-CD1 3.45Å; C728-F736 VanDerWaalsContact CB-CD1 3.45Å; C728-F736 HydrophobicContact CB-CD2 3.78Å; C728-F736 HydrophobicContact CB-CE1 3.27Å; C728-F736 HydrophobicContact CB-CE2 3.61Å; C728-F736 HydrophobicContact CB-CG 3.7Å; C728-F736 HydrophobicContact CB-CZ 3.35Å; K729-F736 HydrophobicContact CB-CD1 4.32Å; L732-F736 HydrophobicContact CB-CB 3.83Å; L732-F736 HydrophobicContact CD1-CB 4.14Å; N734-F736 VanDerWaalsContact C-N 3.32Å; F736-P738 HydrophobicContact CD1-CB 4.47Å; F736-P738 HydrophobicContact CE1-CB 3.63Å; F736-P738 HydrophobicContact CE1-CG 4.21Å; F736-P738 HydrophobicContact CZ-CB 3.93Å; F736-M741 HydrophobicContact CD2-CB 3.92Å; F736-M741 HydrophobicContact CD2-SD 4.36Å; F736-M741 HydrophobicContact CE2-CB 3.81Å; F736-M741 VanDerWaalsContact CE2-O 3.32Å; F736-M741 WeakPolarHBondContact CE2-O 3.35Å; F736-C743 HydrophobicContact CD2-CB 4.28Å; F736-C743 HydrophobicContact CE2-CB 4.28Å; F736-L799 HydrophobicContact CD2-CD2 3.91Å
737	L	73.1	Confident	76.3	Confident	3 Å²	3	45.5 Å²	45.5	2%	0.016	23%	0.226	C	C	.	.			trans	-114.2	94.7	179.4	-53.1	-177.6	0	0	0	109.2	P184 Y681 L687 S739 V740 M741	P184-L737 HydrophobicContact CB-CD2 4.44Å; Y681-L737 HydrophobicContact CD2-CD1 3.81Å; Y681-L737 HydrophobicContact CE2-CD1 3.4Å; L687-L737 HydrophobicContact CD1-CD1 3.74Å; L687-L737 HydrophobicContact CD1-CD2 4.37Å; L687-L737 HydrophobicContact CD2-CD1 3.83Å; L687-L737 HydrophobicContact CD2-CG 4.4Å; L687-L737 HydrophobicContact CG-CD1 4.38Å; L737-S739 PolarHBondContact O-N 3.39Å; L737-V740 HydrophobicContact CB-CG2 3.61Å; L737-V740 HydrophobicContact CD1-CG2 3.86Å; L737-V740 HydrophobicContact CG-CG2 4.39Å; L737-V740 PolarHBondContact O-N 3.49Å; L737-M741 HydrophobicContact CB-CE 4.22Å; L737-M741 HydrophobicContact CB-CG 4.47Å; L737-M741 HydrophobicContact CB-SD 3.81Å; L737-M741 HydrophobicContact CD1-CE 3.96Å; L737-M741 HydrophobicContact CG-CE 3.92Å; L737-M741 HydrophobicContact CG-SD 4Å; L737-M741 PolarHBondContact N-SD 3.25Å; L737-M741 WeakPolarHBondContact O-CB 3.41Å; L737-M741 PolarHBondContact O-N 3.37Å
738	P	69.7	Low	75.7	Confident	15 Å²	15	45.1 Å²	45.1	10%	0.097	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-17.3	-174	23.3	-34.3	0	0	0	114.4	S187 P725 F736 K802	S187-P738 WeakPolarHBondContact OG-CB 3.46Å; S187-P738 VanDerWaalsContact OG-CG 3.24Å; S187-P738 WeakPolarHBondContact OG-CG 3.44Å; P725-P738 HydrophobicContact CB-CB 4.23Å; F736-P738 HydrophobicContact CD1-CB 4.47Å; F736-P738 HydrophobicContact CE1-CB 3.63Å; F736-P738 HydrophobicContact CE1-CG 4.21Å; F736-P738 HydrophobicContact CZ-CB 3.93Å; P738-K802 PolarHBondContact O-NZ 3.49Å
739	S	60.3	Low	74.9	Confident	9 Å²	9	50.8 Å²	50.8	6%	0.063	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-53.4	169.5	47	0	0	0	0	112	P184 L737	P184-S739 PolarHBondContact O-OG 3.36Å; L737-S739 PolarHBondContact O-N 3.39Å
740	V	68.9	Low	74.2	Confident	4 Å²	4	50.6 Å²	50.6	2%	0.024	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.2	-5.7	-169.8	-66.9	0	0	0	0	115.5	M206 F680 Y681 L737 K802	M206-V740 HydrophobicContact CE-CG1 4.07Å; M206-V740 HydrophobicContact SD-CG1 3.54Å; M206-V740 VanDerWaalsContact SD-CG1 3.54Å; F680-V740 HydrophobicContact CD1-CG1 4.25Å; F680-V740 HydrophobicContact CG-CG1 4.48Å; Y681-V740 HydrophobicContact CE2-CG1 4.46Å; Y681-V740 HydrophobicContact CE2-CG2 3.92Å; L737-V740 HydrophobicContact CB-CG2 3.61Å; L737-V740 HydrophobicContact CD1-CG2 3.86Å; L737-V740 HydrophobicContact CG-CG2 4.39Å; L737-V740 PolarHBondContact O-N 3.49Å; V740-K802 WeakPolarHBondContact O-CG 3.46Å; V740-K802 PolarHBondContact O-N 3.35Å
741	M	78.7	Confident	73.6	Confident	4 Å²	4	44.4 Å²	44.4	2%	0.02	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	139.9	-175.9	-66.9	160.1	-177	0	0	113.5	I690 F736 L737 L799 F800 K802	I690-M741 HydrophobicContact CD1-CE 3.5Å; I690-M741 HydrophobicContact CG2-CE 3.89Å; F736-M741 HydrophobicContact CD2-CB 3.92Å; F736-M741 HydrophobicContact CD2-SD 4.36Å; F736-M741 HydrophobicContact CE2-CB 3.81Å; F736-M741 VanDerWaalsContact CE2-O 3.32Å; F736-M741 WeakPolarHBondContact CE2-O 3.35Å; L737-M741 HydrophobicContact CB-CE 4.22Å; L737-M741 HydrophobicContact CB-CG 4.47Å; L737-M741 HydrophobicContact CB-SD 3.81Å; L737-M741 HydrophobicContact CD1-CE 3.96Å; L737-M741 HydrophobicContact CG-CE 3.92Å; L737-M741 HydrophobicContact CG-SD 4Å; L737-M741 PolarHBondContact N-SD 3.25Å; L737-M741 WeakPolarHBondContact O-CB 3.41Å; L737-M741 PolarHBondContact O-N 3.37Å; M741-L799 HydrophobicContact CB-CD2 3.98Å; M741-L799 HydrophobicContact CE-CD1 4.37Å; M741-L799 HydrophobicContact CG-CD2 4.07Å; M741-L799 HydrophobicContact SD-CD1 4.07Å; M741-L799 HydrophobicContact SD-CD2 3.73Å; M741-F800 CarbonylContact C-O 3.59Å; M741-F800 WeakPolarHBondContact CA-O 3.37Å; M741-K802 WeakPolarHBondContact O-CE 3.45Å
742	Y	83.4	Confident	72.9	Confident	71 Å²	71	44.2 Å²	44.2	28%	0.278	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	155.5	148.4	-58.2	-68.9	0	0	0	108.8	L722 L759 F770 F800 K802	L722-Y742 HydrophobicContact CD1-CD1 4.4Å; L722-Y742 HydrophobicContact CD1-CG 4.34Å; Y742-L759 HydrophobicContact CD2-CD2 4.26Å; Y742-F770 HydrophobicContact CE2-CB 4.17Å; Y742-F770 WeakPolarHBondContact CE2-O 3.14Å; Y742-F800 PolarHBondContact N-O 2.79Å; Y742-F800 PolarHBondContact O-N 3.05Å; Y742-K802 HydrophobicContact CD1-CG 4.5Å; Y742-K802 HydrophobicContact CD2-CD 4.47Å; Y742-K802 HydrophobicContact CD2-CG 3.68Å; Y742-K802 HydrophobicContact CE1-CD 4.23Å; Y742-K802 HydrophobicContact CE1-CG 4.44Å; Y742-K802 HydrophobicContact CE2-CB 4.24Å; Y742-K802 HydrophobicContact CE2-CD 4.14Å; Y742-K802 HydrophobicContact CE2-CG 3.61Å; Y742-K802 HydrophobicContact CG-CG 4.13Å
743	C	85.4	Confident	72.5	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	154.9	162.1	123.1	0	0	0	0	109.9	L722 L723 C728 L732 F736 V797 A798 L799	L722-C743 WeakPolarHBondContact CA-O 3.45Å; L723-C743 PolarHBondContact N-O 3.23Å; C728-C743 HydrophobicContact CB-CB 4.18Å; C728-C743 VanDerWaalsContact SG-CB 3.6Å; C728-C743 PolarHBondContact SG-SG 3.14Å; L732-C743 HydrophobicContact CD1-CB 3.93Å; F736-C743 HydrophobicContact CD2-CB 4.28Å; F736-C743 HydrophobicContact CE2-CB 4.28Å; C743-V797 HydrophobicContact CB-CG1 4.47Å; C743-V797 WeakPolarHBondContact SG-CG1 3.27Å; C743-A798 CarbonylContact C-O 3.53Å; C743-A798 WeakPolarHBondContact CA-O 3.41Å; C743-A798 WeakPolarHBondContact CB-O 3.42Å; C743-L799 HydrophobicContact CB-CD2 3.84Å
744	G	85.5	Confident	72.6	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.2	155.4	179.8	0	0	0	0	0	112.7	Q721 A798	Q721-G744 CarbonylContact O-C 3.5Å; Q721-G744 WeakPolarHBondContact O-CA 3.32Å; G744-A798 PolarHBondContact N-O 2.79Å; G744-A798 PolarHBondContact O-N 2.93Å
745	V	81.5	Confident	73.5	Confident	28 Å²	28	42.8 Å²	42.8	17%	0.17	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	143.4	176.4	-71.8	0	0	0	0	110.9	Y720 Q721 L723 D795 V797	Y720-V745 VanDerWaalsContact CD1-O 3.29Å; Y720-V745 WeakPolarHBondContact CD1-O 3.38Å; Q721-V745 HydrophobicContact CB-CG2 3.9Å; Q721-V745 HydrophobicContact CG-CG2 4.48Å; Q721-V745 PolarHBondContact N-O 2.96Å; Q721-V745 PolarHBondContact O-N 3Å; L723-V745 HydrophobicContact CD1-CG1 4.19Å; V745-D795 HydrophobicContact CB-CB 4.04Å; V745-D795 HydrophobicContact CG1-CB 4.29Å; V745-V797 HydrophobicContact CG1-CG2 3.88Å
746	G	74	Confident	74.1	Confident	5 Å²	5	37.9 Å²	37.9	5%	0.052	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	174.6	163.7	176	0	0	0	0	0	114.1	Y720 K748 D796	Y720-G746 VanDerWaalsContact CE1-CA 3.47Å; G746-K748 PolarHBondContact O-N 3.12Å; G746-D796 PolarHBondContact N-O 3.18Å
747	Q	68	Low	74.4	Confident	107 Å²	107	37.6 Å²	37.6	50%	0.5	18%	0.182	S	C	.	.			trans	-80.1	76.9	-165.3	-65.4	178.7	-8.8	0	0	113.6	I718 N749 I750	I718-Q747 WeakPolarHBondContact CD1-O 3.5Å; Q747-N749 PolarHBondContact O-N 2.92Å; Q747-N749 VanDerWaalsContact O-N 3.15Å; Q747-I750 HydrophobicContact CB-CD1 4.02Å; Q747-I750 HydrophobicContact CB-CG1 4.39Å; Q747-I750 PolarHBondContact O-N 2.93Å
748	K	66.4	Low	74.8	Confident	67 Å²	67	37.5 Å²	37.5	29%	0.291	18%	0.181	S	C	.	.	G	3₁₀ helix	trans	-51.5	-35.4	177.1	174	-174.6	-179.9	177.8	0	114.5	G746 I750 L751 S776 D796	G746-K748 PolarHBondContact O-N 3.12Å; K748-I750 PolarHBondContact O-N 2.98Å; K748-L751 WeakPolarHBondContact O-CA 3.11Å; K748-L751 WeakPolarHBondContact O-CB 3.46Å; K748-L751 PolarHBondContact O-N 2.84Å; K748-S776 VanDerWaalsContact CD-OG 3.23Å; K748-S776 WeakPolarHBondContact CD-OG 3.25Å; K748-S776 WeakPolarHBondContact CE-OG 3.46Å; K748-S776 PolarHBondContact NZ-OG 3.29Å; K748-D796 HydrophobicContact CB-CB 3.81Å; K748-D796 HydrophobicContact CD-CB 4.1Å; K748-D796 WeakPolarHBondContact CD-OD2 3.25Å; K748-D796 IonicContact NZ-OD2 2.81Å; K748-D796 PolarHBondContact NZ-OD2 3.21Å
749	N	61.6	Low	75.3	Confident	120 Å²	120	36.8 Å²	36.8	64%	0.642	18%	0.177	S	C	*	.	G	3₁₀ helix	trans	-65.7	-10.5	-171.3	-63	-31.2	0	0	0	114	Q747 V793	Q747-N749 PolarHBondContact O-N 2.92Å; Q747-N749 VanDerWaalsContact O-N 3.15Å; N749-V793 WeakPolarHBondContact ND2-CG1 3.02Å
750	I	63	Low	76	Confident	92 Å²	92	36.6 Å²	36.6	47%	0.472	18%	0.175	S	C	.	.	G	3₁₀ helix	trans	-92.7	-14.3	174	-46.5	177	0	0	0	111	V716 I718 Q747 K748	V716-I750 HydrophobicContact CG1-CG2 3.94Å; I718-I750 HydrophobicContact CD1-CB 3.77Å; I718-I750 HydrophobicContact CD1-CG2 4.23Å; Q747-I750 HydrophobicContact CB-CD1 4.02Å; Q747-I750 HydrophobicContact CB-CG1 4.39Å; Q747-I750 PolarHBondContact O-N 2.93Å; K748-I750 PolarHBondContact O-N 2.98Å
751	L	66.1	Low	75.9	Confident	15 Å²	15	36.7 Å²	36.7	8%	0.079	18%	0.176	C	C	.	.			trans	-94	135.6	177.8	-55.9	173.1	0	0	0	112.1	V716 I718 Y720 K748 P754 L879	V716-L751 HydrophobicContact CG1-CD2 4.22Å; I718-L751 HydrophobicContact CD1-CD1 4.27Å; I718-L751 HydrophobicContact CD1-CD2 3.42Å; I718-L751 VanDerWaalsContact CD1-CD2 3.42Å; I718-L751 HydrophobicContact CD1-CG 3.57Å; I718-L751 HydrophobicContact CG1-CD2 3.82Å; I718-L751 HydrophobicContact CG1-CG 4.43Å; Y720-L751 HydrophobicContact CE2-CD1 4.16Å; K748-L751 WeakPolarHBondContact O-CA 3.11Å; K748-L751 WeakPolarHBondContact O-CB 3.46Å; K748-L751 PolarHBondContact O-N 2.84Å; L751-P754 HydrophobicContact CB-CB 3.93Å; L751-P754 HydrophobicContact CB-CG 4.12Å; L751-P754 HydrophobicContact CD1-CB 3.82Å; L751-P754 HydrophobicContact CD1-CG 4.48Å; L751-P754 HydrophobicContact CG-CB 4.45Å; L751-L879 HydrophobicContact CB-CD2 4.41Å; L751-L879 HydrophobicContact CD2-CB 3.98Å; L751-L879 HydrophobicContact CD2-CD2 4.11Å; L751-L879 HydrophobicContact CD2-CG 4.49Å
752	K	66.1	Low	75.3	Confident	101 Å²	101	40.6 Å²	40.6	44%	0.439	19%	0.194	S	C	.	.	S	Bend	trans	-111.9	135.2	167.4	-60.5	164.8	-170	153.7	0	108.8	P754 L879 E881	K752-P754 VanDerWaalsContact C-CD 3.4Å; K752-L879 VanDerWaalsContact O-CD1 3.27Å; K752-L879 WeakPolarHBondContact O-CD1 3.45Å; K752-L879 VanDerWaalsContact O-CD2 3.27Å; K752-L879 WeakPolarHBondContact O-CD2 3.27Å; K752-E881 WeakPolarHBondContact CD-OE1 3.29Å; K752-E881 IonicContact NZ-OE1 2.7Å; K752-E881 PolarHBondContact NZ-OE1 3.45Å; K752-E881 IonicContact NZ-OE2 2.68Å; K752-E881 PolarHBondContact NZ-OE2 3.34Å
753	Y	73.3	Confident	74	Confident	88 Å²	88	38.3 Å²	38.3	35%	0.345	19%	0.188	S	C	.	.	S	Bend	trans	52.9	42.8	-179	-42.4	-79.5	0	0	0	115.2	P615 T618 I755	P615-Y753 HydrophobicContact CB-CD2 4.36Å; P615-Y753 HydrophobicContact CB-CE1 4.39Å; P615-Y753 HydrophobicContact CB-CE2 4.09Å; P615-Y753 HydrophobicContact CG-CE1 4.24Å; P615-Y753 HydrophobicContact CG-CE2 3.94Å; P615-Y753 WeakPolarHBondContact O-CD1 3.47Å; P615-Y753 WeakPolarHBondContact O-CE1 3.32Å; T618-Y753 PolarHBondContact OG1-O 2.88Å; Y753-I755 PolarHBondContact O-N 3.15Å; Y753-I755 VanDerWaalsContact O-N 3.14Å
754	P	81.1	Confident	72.7	Confident	14 Å²	14	43.6 Å²	43.6	9%	0.091	23%	0.226	C	C	.	.			trans	-67.4	-12.4	-176.4	29.2	-36.8	0	0	0	114.9	L751 K752 G756 S757 Y773	L751-P754 HydrophobicContact CB-CB 3.93Å; L751-P754 HydrophobicContact CB-CG 4.12Å; L751-P754 HydrophobicContact CD1-CB 3.82Å; L751-P754 HydrophobicContact CD1-CG 4.48Å; L751-P754 HydrophobicContact CG-CB 4.45Å; K752-P754 VanDerWaalsContact C-CD 3.4Å; P754-G756 PolarHBondContact O-N 2.83Å; P754-S757 VanDerWaalsContact O-CB 3.25Å; P754-S757 WeakPolarHBondContact O-CB 3.36Å; P754-S757 PolarHBondContact O-N 2.85Å; P754-S757 PolarHBondContact O-OG 3.43Å; P754-Y773 HydrophobicContact CB-CD1 3.97Å; P754-Y773 HydrophobicContact CB-CD2 4.4Å; P754-Y773 HydrophobicContact CB-CE1 3.8Å; P754-Y773 HydrophobicContact CB-CE2 4.25Å; P754-Y773 HydrophobicContact CB-CG 4.28Å; P754-Y773 HydrophobicContact CG-CD1 4.3Å; P754-Y773 HydrophobicContact CG-CE1 3.68Å; P754-Y773 WeakPolarHBondContact O-CB 3.23Å; P754-Y773 WeakPolarHBondContact O-CD1 3.35Å
755	I	87.7	Confident	71.3	Confident	46 Å²	46	46.4 Å²	46.4	24%	0.236	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	124.8	177.3	-52.2	-175.4	0	0	0	108.7	C617 T618 A636 R638 C639 Y753 D774	C617-I755 HydrophobicContact CB-CB 4.29Å; C617-I755 VanDerWaalsContact CB-O 3.25Å; C617-I755 WeakPolarHBondContact CB-O 3.49Å; T618-I755 PolarHBondContact N-O 2.82Å; A636-I755 HydrophobicContact CB-CG2 4.18Å; R638-I755 HydrophobicContact CB-CG2 4.14Å; R638-I755 HydrophobicContact CG-CD1 4.17Å; R638-I755 HydrophobicContact CG-CG2 4.26Å; C639-I755 HydrophobicContact CB-CG2 4.01Å; Y753-I755 PolarHBondContact O-N 3.15Å; Y753-I755 VanDerWaalsContact O-N 3.14Å; I755-D774 WeakPolarHBondContact CG1-O 3.23Å
756	G	85.1	Confident	69.9	Low	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.3	-0.1	-177.3	0	0	0	0	0	116.1	T618 T635 P754 Y773	T618-G756 CarbonylContact O-C 3.54Å; T618-G756 VanDerWaalsContact O-CA 3.32Å; T618-G756 WeakPolarHBondContact O-CA 3.37Å; T635-G756 VanDerWaalsContact OG1-CA 3.29Å; T635-G756 WeakPolarHBondContact OG1-CA 3.33Å; P754-G756 PolarHBondContact O-N 2.83Å; G756-Y773 PolarHBondContact N-O 2.94Å
757	S	84.3	Confident	69.2	Low	0 Å²	0	51.6 Å²	51.6	0%	0	28%	0.277	C	S	.	.			trans	-66.6	141.4	176.9	-65.2	0	0	0	0	112.5	P754 I772 Y773 L879	P754-S757 VanDerWaalsContact O-CB 3.25Å; P754-S757 WeakPolarHBondContact O-CB 3.36Å; P754-S757 PolarHBondContact O-N 2.85Å; P754-S757 PolarHBondContact O-OG 3.43Å; S757-I772 WeakPolarHBondContact O-CA 2.88Å; S757-Y773 PolarHBondContact O-N 2.92Å; S757-L879 WeakPolarHBondContact OG-CD1 3.36Å
758	P	80.4	Confident	69.1	Low	2 Å²	2	47.1 Å²	47.1	1%	0.013	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	132.5	176.3	28.1	-34.7	0	0	0	112.1	L760 Q769 I878	P758-L760 HydrophobicContact CB-CD2 3.92Å; P758-L760 HydrophobicContact CB-CG 4.23Å; P758-Q769 HydrophobicContact CB-CG 4.07Å; P758-I878 HydrophobicContact CG-CB 4.45Å; P758-I878 PolarHBondContact O-N 3.25Å
759	L	80.3	Confident	69.3	Low	0 Å²	0	44.4 Å²	44.4	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	111	161.9	179.2	70.1	0	0	0	108.3	L722 Y742 Q769 F770 G771 F800 L875 V877	L722-L759 HydrophobicContact CD1-CD2 4.31Å; L722-L759 HydrophobicContact CD2-CD2 4.13Å; Y742-L759 HydrophobicContact CD2-CD2 4.26Å; L759-Q769 WeakPolarHBondContact O-CA 3.36Å; L759-F770 PolarHBondContact O-N 2.91Å; L759-G771 PolarHBondContact N-O 2.59Å; L759-G771 PolarHBondContact O-N 3.49Å; L759-F800 HydrophobicContact CB-CD1 3.8Å; L759-F800 HydrophobicContact CB-CE1 4.16Å; L759-F800 HydrophobicContact CB-CG 4.48Å; L759-F800 HydrophobicContact CD1-CD1 4.2Å; L759-F800 HydrophobicContact CD1-CE1 3.92Å; L759-F800 HydrophobicContact CD1-CZ 4.15Å; L759-F800 HydrophobicContact CD2-CB 4.05Å; L759-F800 HydrophobicContact CD2-CD1 3.98Å; L759-F800 HydrophobicContact CD2-CD2 4.27Å; L759-F800 HydrophobicContact CD2-CE1 4.5Å; L759-F800 HydrophobicContact CD2-CG 3.85Å; L759-F800 HydrophobicContact CG-CD1 4.22Å; L759-F800 HydrophobicContact CG-CE1 4.42Å; L759-L875 HydrophobicContact CD1-CD2 3.7Å; L759-L875 HydrophobicContact CD2-CD2 4.46Å; L759-L875 HydrophobicContact CG-CD2 4.14Å; L759-V877 HydrophobicContact CD1-CG2 3.71Å
760	L	74.9	Confident	69.8	Low	4 Å²	4	40.6 Å²	40.6	2%	0.021	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	140.3	-179	-55.7	-175.4	0	0	0	111.1	P758 W767 V768 Q769 L876 I878	P758-L760 HydrophobicContact CB-CD2 3.92Å; P758-L760 HydrophobicContact CB-CG 4.23Å; L760-W767 HydrophobicContact CB-CE3 4.05Å; L760-W767 HydrophobicContact CB-CZ3 4.47Å; L760-V768 WeakPolarHBondContact CA-O 3.23Å; L760-Q769 HydrophobicContact CD2-CB 3.67Å; L760-Q769 HydrophobicContact CD2-CG 3.97Å; L760-L876 PolarHBondContact N-O 3.25Å; L760-L876 PolarHBondContact O-N 3.27Å; L760-I878 HydrophobicContact CD1-CD1 3.6Å; L760-I878 HydrophobicContact CD1-CG1 4.06Å
761	C	67.5	Low	70.4	Confident	6 Å²	6	36.2 Å²	36.2	4%	0.041	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	149.3	170.6	-36.9	0	0	0	0	109.2	V768 F770 L875	C761-V768 PolarHBondContact N-O 3.03Å; C761-V768 PolarHBondContact O-N 2.85Å; C761-F770 HydrophobicContact CB-CD2 3.6Å; C761-F770 HydrophobicContact CB-CE2 3.65Å; C761-F770 WeakPolarHBondContact SG-CD2 3.29Å; C761-L875 HydrophobicContact CB-CD2 4.49Å; C761-L875 HydrophobicContact CB-CG 4.36Å; C761-L875 WeakPolarHBondContact SG-CD2 3.36Å
762	Q	66.1	Low	71.3	Confident	86 Å²	86	35.5 Å²	35.5	40%	0.402	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	128.2	167	-161.4	174.8	12.4	0	0	109.4	N766 W767 L873	Q762-N766 CarbonylContact C-O 3.57Å; Q762-N766 WeakPolarHBondContact CA-O 2.97Å; Q762-W767 HydrophobicContact CB-CD2 4.43Å; Q762-W767 HydrophobicContact CB-CE3 4.44Å; Q762-W767 HydrophobicContact CB-CH2 4.26Å; Q762-W767 HydrophobicContact CB-CZ2 4.22Å; Q762-W767 HydrophobicContact CB-CZ3 4.37Å; Q762-L873 WeakPolarHBondContact O-CD1 3.28Å
763	S	55.9	Low	72.4	Confident	23 Å²	23	30.8 Å²	30.8	16%	0.161	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	119.9	-177.5	-165.6	0	0	0	0	109.8	G765 N766	S763-G765 PolarHBondContact O-N 3.23Å; S763-N766 PolarHBondContact N-O 2.92Å; S763-N766 PolarHBondContact O-N 2.52Å
764	S	57.1	Low	73	Confident	112 Å²	112	26.7 Å²	26.7	78%	0.783	16%	0.16	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.2	43.3	-174.7	-58.2	0	0	0	0	113.3	N766	S764-N766 PolarHBondContact O-N 3.01Å; S764-N766 PolarHBondContact O-ND2 3.06Å
765	G	56.3	Low	73.3	Confident	59 Å²	59	27.8 Å²	27.8	61%	0.608	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.5	-14.8	-178.6	0	0	0	0	0	115.8	S763	S763-G765 PolarHBondContact O-N 3.23Å
766	N	52	Low	73.1	Confident	95 Å²	95	26.2 Å²	26.2	51%	0.508	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	149.5	-179.4	-64.9	-77.3	0	0	0	111.6	Q762 S763 S764 V768	Q762-N766 CarbonylContact C-O 3.57Å; Q762-N766 WeakPolarHBondContact CA-O 2.97Å; S763-N766 PolarHBondContact N-O 2.92Å; S763-N766 PolarHBondContact O-N 2.52Å; S764-N766 PolarHBondContact O-N 3.01Å; S764-N766 PolarHBondContact O-ND2 3.06Å; N766-V768 HydrophobicContact CB-CG2 4.35Å
767	W	61.1	Low	72.7	Confident	47 Å²	47	28.4 Å²	28.4	18%	0.178	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	117.7	168.8	-74.5	93.2	0	0	0	109.9	L597 P598 L760 Q762 L876	L597-W767 HydrophobicContact CD2-CH2 4.03Å; L597-W767 HydrophobicContact CD2-CZ2 3.45Å; L597-W767 VanDerWaalsContact CD2-CZ2 3.45Å; P598-W767 HydrophobicContact CG-CB 4.04Å; P598-W767 HydrophobicContact CG-CD2 4.22Å; P598-W767 HydrophobicContact CG-CG 3.77Å; L760-W767 HydrophobicContact CB-CE3 4.05Å; L760-W767 HydrophobicContact CB-CZ3 4.47Å; Q762-W767 HydrophobicContact CB-CD2 4.43Å; Q762-W767 HydrophobicContact CB-CE3 4.44Å; Q762-W767 HydrophobicContact CB-CH2 4.26Å; Q762-W767 HydrophobicContact CB-CZ2 4.22Å; Q762-W767 HydrophobicContact CB-CZ3 4.37Å; W767-L876 HydrophobicContact CZ3-CB 4.39Å
768	V	64	Low	71.9	Confident	13 Å²	13	33.1 Å²	33.1	8%	0.079	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	139.1	-174.7	179.4	0	0	0	0	109.3	L760 C761 N766 F770	L760-V768 WeakPolarHBondContact CA-O 3.23Å; C761-V768 PolarHBondContact N-O 3.03Å; C761-V768 PolarHBondContact O-N 2.85Å; N766-V768 HydrophobicContact CB-CG2 4.35Å; V768-F770 HydrophobicContact CB-CD2 4.25Å; V768-F770 HydrophobicContact CB-CE2 3.78Å; V768-F770 HydrophobicContact CG1-CD2 4.2Å; V768-F770 HydrophobicContact CG1-CE2 3.91Å; V768-F770 HydrophobicContact CG1-CZ 4.42Å; V768-F770 WeakPolarHBondContact O-CD2 3Å
769	Q	72.2	Confident	70.8	Confident	10 Å²	10	35.2 Å²	35.2	5%	0.047	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	115.3	173.2	-169.6	179.8	0.7	0	0	110.2	T620 P758 L759 L760 G771 I772 L803 V847	T620-Q769 PolarHBondContact OG1-NE2 3.37Å; P758-Q769 HydrophobicContact CB-CG 4.07Å; L759-Q769 WeakPolarHBondContact O-CA 3.36Å; L760-Q769 HydrophobicContact CD2-CB 3.67Å; L760-Q769 HydrophobicContact CD2-CG 3.97Å; Q769-G771 WeakPolarHBondContact CG-O 3.2Å; Q769-G771 PolarHBondContact NE2-O 3.43Å; Q769-I772 VanDerWaalsContact NE2-CG1 3.29Å; Q769-L803 HydrophobicContact CB-CD1 4.23Å; Q769-L803 HydrophobicContact CG-CD1 3.7Å; Q769-V847 HydrophobicContact CB-CB 4.11Å; Q769-V847 HydrophobicContact CB-CG2 4.32Å
770	F	71.4	Confident	69.1	Low	39 Å²	39	40.8 Å²	40.8	17%	0.171	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	-19.8	178.1	-78.5	-96.7	0	0	0	112.7	Y742 L759 C761 V768 L803 V808	Y742-F770 HydrophobicContact CE2-CB 4.17Å; Y742-F770 WeakPolarHBondContact CE2-O 3.14Å; L759-F770 PolarHBondContact O-N 2.91Å; C761-F770 HydrophobicContact CB-CD2 3.6Å; C761-F770 HydrophobicContact CB-CE2 3.65Å; C761-F770 WeakPolarHBondContact SG-CD2 3.29Å; V768-F770 HydrophobicContact CB-CD2 4.25Å; V768-F770 HydrophobicContact CB-CE2 3.78Å; V768-F770 HydrophobicContact CG1-CD2 4.2Å; V768-F770 HydrophobicContact CG1-CE2 3.91Å; V768-F770 HydrophobicContact CG1-CZ 4.42Å; V768-F770 WeakPolarHBondContact O-CD2 3Å; F770-L803 PolarHBondContact O-N 3.31Å; F770-V808 HydrophobicContact CE1-CG2 4.47Å; F770-V808 HydrophobicContact CZ-CG2 4.5Å
771	G	76.6	Confident	67.5	Low	0 Å²	0	50.3 Å²	50.3	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.2	-179.3	-178.8	0	0	0	0	0	115.4	L759 Q769 V801	L759-G771 PolarHBondContact N-O 2.59Å; L759-G771 PolarHBondContact O-N 3.49Å; Q769-G771 WeakPolarHBondContact CG-O 3.2Å; Q769-G771 PolarHBondContact NE2-O 3.43Å; G771-V801 CarbonylContact C-O 3.53Å; G771-V801 WeakPolarHBondContact CA-O 3.18Å
772	I	84.2	Confident	65.8	Low	0 Å²	0	54.9 Å²	54.9	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	127	177	-66.4	-176.9	0	0	0	108.5	V634 A636 L692 S757 Q769 D774 F800 V801 L803	V634-I772 HydrophobicContact CB-CD1 4.33Å; V634-I772 HydrophobicContact CG1-CD1 3.68Å; A636-I772 HydrophobicContact CB-CG2 4.04Å; L692-I772 HydrophobicContact CD2-CB 4.32Å; L692-I772 HydrophobicContact CD2-CD1 3.88Å; S757-I772 WeakPolarHBondContact O-CA 2.88Å; Q769-I772 VanDerWaalsContact NE2-CG1 3.29Å; I772-D774 PolarHBondContact O-N 2.8Å; I772-F800 CarbonylContact O-C 3.58Å; I772-F800 VanDerWaalsContact O-CA 3.27Å; I772-F800 WeakPolarHBondContact O-CA 3.31Å; I772-V801 PolarHBondContact N-O 3Å; I772-V801 PolarHBondContact O-N 2.81Å; I772-L803 HydrophobicContact CD1-CD2 4.27Å; I772-L803 HydrophobicContact CG1-CD1 4.48Å; I772-L803 HydrophobicContact CG1-CD2 4.44Å
773	Y	88.3	Confident	64.1	Low	3 Å²	3	62.5 Å²	62.5	1%	0.012	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	126.1	177.6	-174.8	-70.7	0	0	0	110.1	P754 G756 S757 S776 A798 F800	P754-Y773 HydrophobicContact CB-CD1 3.97Å; P754-Y773 HydrophobicContact CB-CD2 4.4Å; P754-Y773 HydrophobicContact CB-CE1 3.8Å; P754-Y773 HydrophobicContact CB-CE2 4.25Å; P754-Y773 HydrophobicContact CB-CG 4.28Å; P754-Y773 HydrophobicContact CG-CD1 4.3Å; P754-Y773 HydrophobicContact CG-CE1 3.68Å; P754-Y773 WeakPolarHBondContact O-CB 3.23Å; P754-Y773 WeakPolarHBondContact O-CD1 3.35Å; G756-Y773 PolarHBondContact N-O 2.94Å; S757-Y773 PolarHBondContact O-N 2.92Å; Y773-S776 PolarHBondContact OH-OG 2.5Å; Y773-A798 HydrophobicContact CD2-CB 4.14Å; Y773-A798 HydrophobicContact CE2-CB 3.57Å; Y773-F800 HydrophobicContact CD2-CD1 4.32Å; Y773-F800 AromaticContact CD2-CE1 3.62Å; Y773-F800 HydrophobicContact CD2-CE1 3.62Å; Y773-F800 AromaticContact CD2-CZ 3.97Å; Y773-F800 HydrophobicContact CD2-CZ 3.97Å; Y773-F800 HydrophobicContact CG-CE1 4.2Å
774	D	87.2	Confident	62.9	Low	2 Å²	2	65.6 Å²	65.6	1%	0.011	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	-60.5	177.3	-169.7	94	0	0	0	111.1	A636 R638 I755 I772 L799 V801	A636-D774 HydrophobicContact CB-CB 4.43Å; R638-D774 WeakPolarHBondContact CD-O 3.4Å; R638-D774 IonicContact CZ-OD2 3.18Å; R638-D774 IonicContact NE-OD2 2.63Å; R638-D774 PolarHBondContact NE-OD2 3.15Å; R638-D774 IonicContact NH2-OD2 2.8Å; I755-D774 WeakPolarHBondContact CG1-O 3.23Å; I772-D774 PolarHBondContact O-N 2.8Å; D774-L799 PolarHBondContact N-O 3.02Å; D774-V801 HydrophobicContact CB-CG2 4.31Å
775	H	86.8	Confident	61.7	Low	36 Å²	36	64.5 Å²	64.5	17%	0.167	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	-174.4	176.6	64.6	-80.6	0	0	0	110.5	F777 L799	H775-F777 AromaticContact CD2-CE2 3.84Å; H775-F777 AromaticContact CD2-CZ 3.73Å; H775-F777 AromaticContact NE2-CE1 3.87Å; H775-F777 AromaticContact NE2-CE2 3.43Å; H775-F777 WeakPolarHBondContact NE2-CE2 3.32Å; H775-F777 AromaticContact NE2-CZ 3.1Å; H775-F777 WeakPolarHBondContact NE2-CZ 3.41Å; H775-L799 PolarHBondContact O-N 2.98Å
776	S	83.9	Confident	60.7	Low	14 Å²	14	67.2 Å²	67.2	10%	0.098	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	168.2	172	65.5	0	0	0	0	111.2	K748 Y773 D796 V797	K748-S776 VanDerWaalsContact CD-OG 3.23Å; K748-S776 WeakPolarHBondContact CD-OG 3.25Å; K748-S776 WeakPolarHBondContact CE-OG 3.46Å; K748-S776 PolarHBondContact NZ-OG 3.29Å; Y773-S776 PolarHBondContact OH-OG 2.5Å; S776-D796 VanDerWaalsContact CB-OD2 3.28Å; S776-D796 WeakPolarHBondContact CB-OD2 3.1Å; S776-D796 PolarHBondContact OG-OD2 2.76Å; S776-V797 CarbonylContact C-O 3.42Å; S776-V797 WeakPolarHBondContact CA-O 3.34Å; S776-V797 VanDerWaalsContact CB-O 3.26Å; S776-V797 WeakPolarHBondContact CB-O 3.37Å
777	F	76.7	Confident	59.7	Low	46 Å²	46	72.1 Å²	72.1	20%	0.202	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	137.2	172.8	-55.1	-90.8	0	0	0	110.2	L732 K735 H775 V797 L799	L732-F777 HydrophobicContact CD1-CD2 4.41Å; L732-F777 HydrophobicContact CD1-CE2 4.26Å; L732-F777 HydrophobicContact CD2-CB 4.33Å; L732-F777 HydrophobicContact CD2-CD2 3.29Å; L732-F777 HydrophobicContact CD2-CE2 3.73Å; L732-F777 HydrophobicContact CD2-CG 3.98Å; L732-F777 HydrophobicContact CG-CD2 4.45Å; K735-F777 HydrophobicContact CB-CZ 4.42Å; K735-F777 HydrophobicContact CD-CE1 3.85Å; K735-F777 HydrophobicContact CD-CZ 3.87Å; H775-F777 AromaticContact CD2-CE2 3.84Å; H775-F777 AromaticContact CD2-CZ 3.73Å; H775-F777 AromaticContact NE2-CE1 3.87Å; H775-F777 AromaticContact NE2-CE2 3.43Å; H775-F777 WeakPolarHBondContact NE2-CE2 3.32Å; H775-F777 AromaticContact NE2-CZ 3.1Å; H775-F777 WeakPolarHBondContact NE2-CZ 3.41Å; F777-V797 PolarHBondContact N-O 3.17Å; F777-V797 PolarHBondContact O-N 2.93Å; F777-V797 VanDerWaalsContact O-N 3.11Å; F777-L799 HydrophobicContact CE2-CD1 3.7Å; F777-L799 HydrophobicContact CE2-CG 4.2Å; F777-L799 HydrophobicContact CZ-CD1 4.29Å
778	P	67	Low	58.6	Low	99 Å²	99	73.3 Å²	73.3	64%	0.643	41%	0.408	S	S	*	.			trans	-65.7	134	168.3	29.4	-33.7	0	0	0	109.7	S780 D796	P778-S780 PolarHBondContact O-N 3.43Å; P778-D796 WeakPolarHBondContact CA-OD1 3.27Å
779	T	57.8	Low	57.1	Low	45 Å²	45	82.3 Å²	82.3	28%	0.276	45%	0.449	S	S	.	.			trans	-76	93.4	180	33.9	0	0	0	0	111	R781 P794 D795 V797	T779-R781 PolarHBondContact O-N 2.8Å; T779-P794 VanDerWaalsContact OG1-CB 3.29Å; T779-P794 WeakPolarHBondContact OG1-CB 3.3Å; T779-D795 WeakPolarHBondContact CG2-O 3.43Å; T779-D795 PolarHBondContact OG1-O 3.35Å; T779-V797 HydrophobicContact CG2-CG2 3.58Å
780	S	44.3	Very low	55.2	Low	118 Å²	118	89.5 Å²	89.5	83%	0.825	49%	0.488	S	S	*	.			trans	-70.1	91.8	175.3	62.7	0	0	0	0	111.4	P778	P778-S780 PolarHBondContact O-N 3.43Å
781	R	40.4	Very low	53.2	Low	203 Å²	203	93.5 Å²	93.5	77%	0.766	51%	0.507	S	S	*	.			trans	-62.8	139.6	156.1	-81.2	-176.2	168.9	175.8	-2.7	108.8	T779 Y783 E791	T779-R781 PolarHBondContact O-N 2.8Å; R781-Y783 PolarHBondContact O-N 3.42Å; R781-E791 IonicContact NH1-OE1 2.73Å
782	S	33.3	Very low	51.2	Low	102 Å²	102	99.2 Å²	99.2	71%	0.713	54%	0.537	S	S	*	.			trans	-65.5	127.4	166.7	50.9	0	0	0	0	109.2	A784	S782-A784 VanDerWaalsContact C-N 3.33Å; S782-A784 PolarHBondContact O-N 3.27Å
783	Y	29.4	Very low	49.2	Very low	247 Å²	247	103.8 Å²	103.8	97%	0.969	56%	0.564	S	S	*	*	S	Bend	trans	-64.1	84.9	179.5	-76.9	-89.8	0	0	0	111.8	R781	R781-Y783 PolarHBondContact O-N 3.42Å
784	A	29.9	Very low	47.2	Very low	88 Å²	88	107.1 Å²	107.1	73%	0.727	59%	0.586	S	S	*	*			trans	-153.8	24.4	-174.5	0	0	0	0	0	114.5	S782	S782-A784 VanDerWaalsContact C-N 3.33Å; S782-A784 PolarHBondContact O-N 3.27Å
785	A	32.6	Very low	45.7	Very low	88 Å²	88	110.5 Å²	110.5	73%	0.727	60%	0.604	S	S	*	*	S	Bend	trans	-156.1	127.1	170.3	0	0	0	0	0	113.3
786	V	34.7	Very low	45	Very low	117 Å²	117	109.5 Å²	109.5	71%	0.709	60%	0.6	S	S	*	*			trans	51.3	114.3	152	-173.8	0	0	0	0	119
787	Q	31.6	Very low	45.1	Very low	198 Å²	198	109 Å²	109	93%	0.925	60%	0.596	S	S	*	*			trans	-69.7	122.5	156.8	-64.1	160.8	-38	0	0	109.5
788	S	37.9	Very low	45.6	Very low	72 Å²	72	106.8 Å²	106.8	50%	0.503	59%	0.587	S	S	.	*			trans	-148.2	124.5	160.4	61.1	0	0	0	0	111.7	N790 E791	S788-N790 PolarHBondContact O-N 3.31Å; S788-E791 PolarHBondContact O-N 3.11Å
789	E	32	Very low	46.6	Very low	202 Å²	202	102.3 Å²	102.3	94%	0.944	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.8	59.8	-174.8	-63.7	-177.5	134.9	0	0	112
790	N	32.9	Very low	48	Very low	160 Å²	160	100.1 Å²	100.1	86%	0.856	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-160.5	25	167.9	-93.9	-50.9	0	0	0	110.6	S788 I792	S788-N790 PolarHBondContact O-N 3.31Å; N790-I792 PolarHBondContact O-N 3.02Å
791	E	29	Very low	49.7	Very low	123 Å²	123	94.6 Å²	94.6	58%	0.575	51%	0.505	S	S	*	.	P	Polyproline II helix	trans	-70.5	125.4	-169.1	-164.4	171.3	-166.3	0	0	112.6	R781 S788 V793	R781-E791 IonicContact NH1-OE1 2.73Å; S788-E791 PolarHBondContact O-N 3.11Å; E791-V793 PolarHBondContact O-N 3.23Å
792	I	36	Very low	51.4	Low	121 Å²	121	86.9 Å²	86.9	62%	0.621	48%	0.477	S	S	*	.	P	Polyproline II helix	trans	-66	119.9	178	-60.8	172.3	0	0	0	108.3	N790	N790-I792 PolarHBondContact O-N 3.02Å
793	V	41.2	Very low	53	Low	95 Å²	95	83.1 Å²	83.1	58%	0.576	45%	0.449	S	S	*	.	P	Polyproline II helix	trans	-55.5	130.6	-175.3	-171.4	0	0	0	0	110.1	N749 E791 D795	N749-V793 WeakPolarHBondContact ND2-CG1 3.02Å; E791-V793 PolarHBondContact O-N 3.23Å; V793-D795 PolarHBondContact O-N 2.76Å
794	P	46.7	Very low	54.2	Low	74 Å²	74	74.9 Å²	74.9	48%	0.481	42%	0.419	S	S	.	.	P	Polyproline II helix	trans	-57.3	137.9	-169.5	-26.6	33.8	0	0	0	113.7	T779 D796	T779-P794 VanDerWaalsContact OG1-CB 3.29Å; T779-P794 WeakPolarHBondContact OG1-CB 3.3Å; P794-D796 PolarHBondContact O-N 2.95Å
795	D	56.3	Low	54.7	Low	73 Å²	73	72.4 Å²	72.4	39%	0.39	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-64.8	122.3	174.7	-70.5	-65.4	0	0	0	110.9	V745 T779 V793	V745-D795 HydrophobicContact CB-CB 4.04Å; V745-D795 HydrophobicContact CG1-CB 4.29Å; T779-D795 WeakPolarHBondContact CG2-O 3.43Å; T779-D795 PolarHBondContact OG1-O 3.35Å; V793-D795 PolarHBondContact O-N 2.76Å
796	D	72.5	Confident	54.6	Low	15 Å²	15	71.9 Å²	71.9	8%	0.08	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	124.4	-179.6	-126.4	61.5	0	0	0	109	G746 K748 S776 P778 P794 A798	G746-D796 PolarHBondContact N-O 3.18Å; K748-D796 HydrophobicContact CB-CB 3.81Å; K748-D796 HydrophobicContact CD-CB 4.1Å; K748-D796 WeakPolarHBondContact CD-OD2 3.25Å; K748-D796 IonicContact NZ-OD2 2.81Å; K748-D796 PolarHBondContact NZ-OD2 3.21Å; S776-D796 VanDerWaalsContact CB-OD2 3.28Å; S776-D796 WeakPolarHBondContact CB-OD2 3.1Å; S776-D796 PolarHBondContact OG-OD2 2.76Å; P778-D796 WeakPolarHBondContact CA-OD1 3.27Å; P794-D796 PolarHBondContact O-N 2.95Å; D796-A798 PolarHBondContact O-N 2.88Å
797	V	84.4	Confident	54.3	Low	3 Å²	3	70.2 Å²	70.2	2%	0.018	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	104.5	-179.8	175.1	0	0	0	0	108.7	H731 L732 C743 V745 S776 F777 T779	H731-V797 HydrophobicContact CB-CG1 4.4Å; H731-V797 HydrophobicContact CB-CG2 4.31Å; L732-V797 HydrophobicContact CD1-CG1 4Å; L732-V797 HydrophobicContact CD2-CB 4.35Å; L732-V797 HydrophobicContact CD2-CG1 3.75Å; L732-V797 HydrophobicContact CG-CG1 4Å; C743-V797 HydrophobicContact CB-CG1 4.47Å; C743-V797 WeakPolarHBondContact SG-CG1 3.27Å; V745-V797 HydrophobicContact CG1-CG2 3.88Å; S776-V797 CarbonylContact C-O 3.42Å; S776-V797 WeakPolarHBondContact CA-O 3.34Å; S776-V797 VanDerWaalsContact CB-O 3.26Å; S776-V797 WeakPolarHBondContact CB-O 3.37Å; F777-V797 PolarHBondContact N-O 3.17Å; F777-V797 PolarHBondContact O-N 2.93Å; F777-V797 VanDerWaalsContact O-N 3.11Å; T779-V797 HydrophobicContact CG2-CG2 3.58Å
798	A	87.3	Confident	54	Low	0 Å²	0	65.2 Å²	65.2	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	140.2	-179.7	0	0	0	0	0	112.3	Y720 C743 G744 Y773 D796 F800	Y720-A798 HydrophobicContact CD1-CB 4.27Å; Y720-A798 HydrophobicContact CE1-CB 3.6Å; C743-A798 CarbonylContact C-O 3.53Å; C743-A798 WeakPolarHBondContact CA-O 3.41Å; C743-A798 WeakPolarHBondContact CB-O 3.42Å; G744-A798 PolarHBondContact N-O 2.79Å; G744-A798 PolarHBondContact O-N 2.93Å; Y773-A798 HydrophobicContact CD2-CB 4.14Å; Y773-A798 HydrophobicContact CE2-CB 3.57Å; D796-A798 PolarHBondContact O-N 2.88Å; A798-F800 HydrophobicContact CB-CE2 3.77Å; A798-F800 HydrophobicContact CB-CZ 3.94Å
799	L	88.6	Confident	53.3	Low	4 Å²	4	64.3 Å²	64.3	2%	0.021	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	133.3	167.7	-83.4	177.7	0	0	0	110.6	L732 F736 M741 C743 D774 H775 F777	L732-L799 HydrophobicContact CD1-CD1 4.33Å; L732-L799 HydrophobicContact CD1-CD2 3.64Å; L732-L799 HydrophobicContact CD1-CG 3.84Å; F736-L799 HydrophobicContact CD2-CD2 3.91Å; M741-L799 HydrophobicContact CB-CD2 3.98Å; M741-L799 HydrophobicContact CE-CD1 4.37Å; M741-L799 HydrophobicContact CG-CD2 4.07Å; M741-L799 HydrophobicContact SD-CD1 4.07Å; M741-L799 HydrophobicContact SD-CD2 3.73Å; C743-L799 HydrophobicContact CB-CD2 3.84Å; D774-L799 PolarHBondContact N-O 3.02Å; H775-L799 PolarHBondContact O-N 2.98Å; F777-L799 HydrophobicContact CE2-CD1 3.7Å; F777-L799 HydrophobicContact CE2-CG 4.2Å; F777-L799 HydrophobicContact CZ-CD1 4.29Å
800	F	86.8	Confident	53	Low	0 Å²	0	62.4 Å²	62.4	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	126	173.7	-55.2	-93.7	0	0	0	109.3	Y720 L722 M741 Y742 L759 I772 Y773 A798 K802 V877	Y720-F800 HydrophobicContact CD1-CE2 4.06Å; Y720-F800 AromaticContact CD1-CZ 3.75Å; Y720-F800 HydrophobicContact CD1-CZ 3.75Å; Y720-F800 HydrophobicContact CD2-CZ 4.28Å; Y720-F800 HydrophobicContact CE1-CZ 4.12Å; Y720-F800 HydrophobicContact CG-CE2 4.44Å; Y720-F800 AromaticContact CG-CZ 3.85Å; Y720-F800 HydrophobicContact CG-CZ 3.85Å; L722-F800 HydrophobicContact CD2-CD2 4.19Å; L722-F800 HydrophobicContact CD2-CE2 4.21Å; M741-F800 CarbonylContact C-O 3.59Å; M741-F800 WeakPolarHBondContact CA-O 3.37Å; Y742-F800 PolarHBondContact N-O 2.79Å; Y742-F800 PolarHBondContact O-N 3.05Å; L759-F800 HydrophobicContact CB-CD1 3.8Å; L759-F800 HydrophobicContact CB-CE1 4.16Å; L759-F800 HydrophobicContact CB-CG 4.48Å; L759-F800 HydrophobicContact CD1-CD1 4.2Å; L759-F800 HydrophobicContact CD1-CE1 3.92Å; L759-F800 HydrophobicContact CD1-CZ 4.15Å; L759-F800 HydrophobicContact CD2-CB 4.05Å; L759-F800 HydrophobicContact CD2-CD1 3.98Å; L759-F800 HydrophobicContact CD2-CD2 4.27Å; L759-F800 HydrophobicContact CD2-CE1 4.5Å; L759-F800 HydrophobicContact CD2-CG 3.85Å; L759-F800 HydrophobicContact CG-CD1 4.22Å; L759-F800 HydrophobicContact CG-CE1 4.42Å; I772-F800 CarbonylContact O-C 3.58Å; I772-F800 VanDerWaalsContact O-CA 3.27Å; I772-F800 WeakPolarHBondContact O-CA 3.31Å; Y773-F800 HydrophobicContact CD2-CD1 4.32Å; Y773-F800 AromaticContact CD2-CE1 3.62Å; Y773-F800 HydrophobicContact CD2-CE1 3.62Å; Y773-F800 AromaticContact CD2-CZ 3.97Å; Y773-F800 HydrophobicContact CD2-CZ 3.97Å; Y773-F800 HydrophobicContact CG-CE1 4.2Å; A798-F800 HydrophobicContact CB-CE2 3.77Å; A798-F800 HydrophobicContact CB-CZ 3.94Å; F800-K802 PolarHBondContact O-N 3.15Å; F800-V877 HydrophobicContact CE1-CG2 3.58Å; F800-V877 HydrophobicContact CZ-CG2 3.87Å
801	V	80.8	Confident	52.6	Low	1 Å²	1	60.4 Å²	60.4	1%	0.006	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	128.9	167	171.5	0	0	0	0	108.5	F680 I690 L692 G771 I772 D774	F680-V801 HydrophobicContact CE2-CB 4.47Å; F680-V801 HydrophobicContact CE2-CG1 3.46Å; F680-V801 VanDerWaalsContact CE2-CG1 3.46Å; F680-V801 HydrophobicContact CE2-CG2 4.14Å; F680-V801 HydrophobicContact CZ-CG1 3.56Å; I690-V801 HydrophobicContact CG2-CG2 4.14Å; L692-V801 HydrophobicContact CD1-CG1 4.12Å; L692-V801 HydrophobicContact CD2-CB 4.12Å; L692-V801 HydrophobicContact CD2-CG1 3.6Å; L692-V801 HydrophobicContact CG-CG1 3.78Å; G771-V801 CarbonylContact C-O 3.53Å; G771-V801 WeakPolarHBondContact CA-O 3.18Å; I772-V801 PolarHBondContact N-O 3Å; I772-V801 PolarHBondContact O-N 2.81Å; D774-V801 HydrophobicContact CB-CG2 4.31Å
802	K	75.2	Confident	52.5	Low	41 Å²	41	62.9 Å²	62.9	18%	0.178	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	140.5	174.3	-65.3	-169.7	-176.4	177.3	0	111.1	P738 V740 M741 Y742 F800	P738-K802 PolarHBondContact O-NZ 3.49Å; V740-K802 WeakPolarHBondContact O-CG 3.46Å; V740-K802 PolarHBondContact O-N 3.35Å; M741-K802 WeakPolarHBondContact O-CE 3.45Å; Y742-K802 HydrophobicContact CD1-CG 4.5Å; Y742-K802 HydrophobicContact CD2-CD 4.47Å; Y742-K802 HydrophobicContact CD2-CG 3.68Å; Y742-K802 HydrophobicContact CE1-CD 4.23Å; Y742-K802 HydrophobicContact CE1-CG 4.44Å; Y742-K802 HydrophobicContact CE2-CB 4.24Å; Y742-K802 HydrophobicContact CE2-CD 4.14Å; Y742-K802 HydrophobicContact CE2-CG 3.61Å; Y742-K802 HydrophobicContact CG-CG 4.13Å; F800-K802 PolarHBondContact O-N 3.15Å
803	L	68.2	Low	52	Low	24 Å²	24	64.5 Å²	64.5	13%	0.126	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-97	117.5	159.6	-59.6	-175.8	0	0	0	108.3	L692 Q769 F770 I772 V847	L692-L803 HydrophobicContact CD1-CD2 3.63Å; Q769-L803 HydrophobicContact CB-CD1 4.23Å; Q769-L803 HydrophobicContact CG-CD1 3.7Å; F770-L803 PolarHBondContact O-N 3.31Å; I772-L803 HydrophobicContact CD1-CD2 4.27Å; I772-L803 HydrophobicContact CG1-CD1 4.48Å; I772-L803 HydrophobicContact CG1-CD2 4.44Å; L803-V847 HydrophobicContact CD1-CG2 3.99Å
804	E	54.6	Low	51.5	Low	73 Å²	73	66.7 Å²	66.7	34%	0.341	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-64.4	147.3	169.5	-68.2	-179.2	120.8	0	0	110.3	M206 K846	M206-E804 HydrophobicContact CE-CG 4.08Å; M206-E804 WeakPolarHBondContact CE-OE1 3.45Å; M206-E804 WeakPolarHBondContact CE-OE2 3.37Å; M206-E804 WeakPolarHBondContact CG-OE1 3.33Å; M206-E804 HydrophobicContact SD-CG 4.44Å; E804-K846 PolarHBondContact O-N 2.73Å
805	G	39.9	Very low	50.6	Low	36 Å²	36	68.8 Å²	68.8	37%	0.371	37%	0.369	S	S	.	.			trans	-166.7	145.6	174.7	0	0	0	0	0	112.5	N807	G805-N807 PolarHBondContact O-N 2.95Å
806	D	29.3	Very low	49.1	Very low	78 Å²	78	70.2 Å²	70.2	42%	0.417	39%	0.385	S	S	.	.	S	Bend	trans	-44.1	134.5	-179.3	-52.4	53.7	0	0	0	111.2	K846	D806-K846 PolarHBondContact O-NZ 2.82Å
807	N	29.8	Very low	46.9	Very low	82 Å²	82	76.4 Å²	76.4	44%	0.439	42%	0.417	S	S	.	.			trans	-35.1	129.8	-168.7	-54.7	-101.3	0	0	0	114.3	K233 G805 G809	K233-N807 WeakPolarHBondContact CE-ND2 3.5Å; K233-N807 PolarHBondContact NZ-ND2 2.97Å; K233-N807 PolarHBondContact NZ-OD1 3.46Å; G805-N807 PolarHBondContact O-N 2.95Å; N807-G809 PolarHBondContact O-N 3.18Å
808	V	25.9	Very low	44.3	Very low	93 Å²	93	84.5 Å²	84.5	56%	0.564	46%	0.459	S	S	*	.	S	Bend	trans	-73	82.4	172	179.1	0	0	0	0	108.7	F770	F770-V808 HydrophobicContact CE1-CG2 4.47Å; F770-V808 HydrophobicContact CZ-CG2 4.5Å
809	G	23.2	Very low	41.3	Very low	52 Å²	52	94 Å²	94	54%	0.536	50%	0.503	S	S	.	.	S	Bend	trans	155.5	126.7	179.3	0	0	0	0	0	111.8	N807	N807-G809 PolarHBondContact O-N 3.18Å
810	R	24.6	Very low	38.3	Very low	162 Å²	162	96.8 Å²	96.8	61%	0.611	53%	0.533	S	S	*	.			trans	72.1	42	161.5	-147.8	-166.7	-150.4	160.5	9.4	118.2	D197	D197-R810 IonicContact OD1-CZ 2.72Å; D197-R810 VanDerWaalsContact OD1-CZ 3.29Å; D197-R810 IonicContact OD1-NH1 3.18Å; D197-R810 PolarHBondContact OD1-NH1 2.84Å; D197-R810 IonicContact OD1-NH2 2.91Å; D197-R810 PolarHBondContact OD1-NH2 3.5Å; D197-R810 IonicContact OD2-CZ 2.93Å; D197-R810 IonicContact OD2-NH1 3.37Å; D197-R810 PolarHBondContact OD2-NH1 2.98Å; D197-R810 IonicContact OD2-NH2 3.65Å
811	V	25.5	Very low	35.5	Very low	119 Å²	119	108.6 Å²	108.6	72%	0.721	58%	0.578	S	S	*	*			trans	-119.5	77.9	154.1	-170.5	0	0	0	0	110.3
812	Q	25.5	Very low	32.9	Very low	174 Å²	174	116 Å²	116	81%	0.813	62%	0.617	S	S	*	*			trans	-121.8	143.6	152.9	-69.6	179.6	-10	0	0	105.9
813	N	26.1	Very low	30.7	Very low	156 Å²	156	124 Å²	124	83%	0.834	65%	0.652	S	S	*	*	S	Bend	trans	88.9	27.2	173.4	-45.6	-20.6	0	0	0	120.4
814	E	29.7	Very low	28.9	Very low	140 Å²	140	129.1 Å²	129.1	65%	0.654	68%	0.68	S	S	*	*			trans	-125.7	-11.4	165.9	-77.2	-166.4	169.2	0	0	116.6	S816	E814-S816 PolarHBondContact O-N 2.98Å; E814-S816 VanDerWaalsContact O-N 3.12Å
815	D	28.6	Very low	27.8	Very low	118 Å²	118	130.5 Å²	130.5	63%	0.631	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.3	19.4	-177.4	-81.8	-24.8	0	0	0	115.3	R625	R625-D815 IonicContact CZ-OD2 2.69Å; R625-D815 VanDerWaalsContact CZ-OD2 3.24Å; R625-D815 IonicContact NH1-OD2 2.98Å; R625-D815 PolarHBondContact NH1-OD2 3.47Å; R625-D815 IonicContact NH2-OD2 2.85Å; R625-D815 PolarHBondContact NH2-OD2 3.03Å
816	S	25.2	Very low	27.2	Very low	103 Å²	103	137.7 Å²	137.7	72%	0.72	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.8	11.1	-174	57.6	0	0	0	0	115.5	E814	E814-S816 PolarHBondContact O-N 2.98Å; E814-S816 VanDerWaalsContact O-N 3.12Å
817	L	25.5	Very low	27.3	Very low	146 Å²	146	139 Å²	139	76%	0.764	72%	0.721	S	S	*	*	S	Bend	trans	-122.6	149.9	176.4	-111.6	75.9	0	0	0	112
818	I	29.2	Very low	27.4	Very low	173 Å²	173	145.4 Å²	145.4	89%	0.887	74%	0.739	S	S	*	*			trans	73.2	47.1	-178.7	-34.9	174.8	0	0	0	114.1
819	E	25.6	Very low	27.6	Very low	199 Å²	199	149.4 Å²	149.4	93%	0.93	75%	0.749	S	S	*	*			trans	-86.3	148	142	-170.8	169.9	-127.6	0	0	109.2
820	G	25.3	Very low	28	Very low	63 Å²	63	155.1 Å²	155.1	65%	0.649	76%	0.761	S	S	*	*			trans	88.5	93	166.7	0	0	0	0	0	117.8
821	R	28.3	Very low	28.1	Very low	248 Å²	248	150.4 Å²	150.4	94%	0.936	76%	0.763	S	S	*	*			trans	-174.2	101.6	130.7	-101.7	168.8	-144.2	-152.1	4	111.3
822	N	25.3	Very low	28.4	Very low	155 Å²	155	152.9 Å²	152.9	83%	0.829	77%	0.772	S	S	*	*			trans	-69.4	151.7	159.1	-80.4	-17	0	0	0	110.1
823	F	29.8	Very low	28.5	Very low	209 Å²	209	152.8 Å²	152.8	92%	0.917	78%	0.777	S	S	*	*			trans	-156.4	166.6	145.6	-112.7	-72.8	0	0	0	110.1
824	D	30.7	Very low	28.7	Very low	133 Å²	133	154.7 Å²	154.7	71%	0.711	78%	0.782	S	S	*	*			trans	-114.3	145.5	-135.1	-114.1	-49.6	0	0	0	117.6
825	V	30.1	Very low	28.5	Very low	101 Å²	101	152.1 Å²	152.1	61%	0.612	79%	0.792	S	S	*	*			trans	49.3	126.9	133.8	156.8	0	0	0	0	122.9
826	K	27.5	Very low	28.5	Very low	188 Å²	188	149.4 Å²	149.4	82%	0.817	79%	0.792	S	S	*	*			trans	65.8	148.2	157	-71.8	162.7	-157.9	167.5	0	116.4
827	D	32.9	Very low	28.5	Very low	105 Å²	105	151.6 Å²	151.6	56%	0.561	80%	0.796	S	S	*	*			cis	-155.7	162.9	40.2	-163.5	22.1	0	0	0	114.4
828	R	31.7	Very low	28.5	Very low	217 Å²	217	155.8 Å²	155.8	82%	0.819	80%	0.802	S	S	*	*			trans	39.6	159	162.6	-71.4	159.5	178.4	135.3	-12.3	122.3
829	K	28.3	Very low	28.3	Very low	177 Å²	177	154 Å²	154	77%	0.77	80%	0.798	S	S	*	*			cis	-175.7	149.6	-45.4	-147.9	-170.3	178.4	-170.8	0	107.5
830	Q	31.7	Very low	28.3	Very low	171 Å²	171	146.4 Å²	146.4	80%	0.799	77%	0.77	S	S	*	*			trans	68.1	141.6	161.1	-127.9	73	28.3	0	0	118.3
831	G	27.8	Very low	28.2	Very low	63 Å²	63	144.8 Å²	144.8	65%	0.649	75%	0.753	S	S	*	*			trans	139.4	79	166	0	0	0	0	0	116.9
832	D	31.3	Very low	28.2	Very low	171 Å²	171	135.5 Å²	135.5	91%	0.914	72%	0.724	S	S	*	*			trans	63.1	141.8	147.9	-48.7	-20.9	0	0	0	122.6
833	D	27.1	Very low	28.4	Very low	172 Å²	172	131 Å²	131	92%	0.92	70%	0.699	S	S	*	*			trans	-82	135.7	-179.3	-74	-71.4	0	0	0	113.7
834	E	31.5	Very low	28.6	Very low	197 Å²	197	124 Å²	124	92%	0.921	67%	0.671	S	S	*	*			trans	-145.2	126.9	150	-137.7	-168.4	-171.1	0	0	112.9	G836	E834-G836 PolarHBondContact O-N 2.78Å
835	G	25.7	Very low	28.7	Very low	85 Å²	85	125.8 Å²	125.8	88%	0.876	67%	0.668	S	S	*	*			trans	-74.1	85.4	-173.1	0	0	0	0	0	114.6
836	G	27.5	Very low	28.8	Very low	61 Å²	61	123 Å²	123	63%	0.629	65%	0.647	S	S	*	*			trans	-89.9	102.2	-178.7	0	0	0	0	0	115.6	E834 R838	E834-G836 PolarHBondContact O-N 2.78Å; G836-R838 PolarHBondContact O-N 3.01Å
837	N	25.7	Very low	29.2	Very low	150 Å²	150	114.7 Å²	114.7	80%	0.802	61%	0.612	S	S	*	*			trans	-49.1	110.9	172.5	-84.9	-3.2	0	0	0	113.2	V839	N837-V839 PolarHBondContact O-N 3.05Å
838	R	25.4	Very low	29	Very low	234 Å²	234	113.7 Å²	113.7	88%	0.883	61%	0.605	S	S	*	*			trans	-84.1	99.8	172.9	-70.8	-178.3	176.9	165.8	1.9	110.9	G836 A840	G836-R838 PolarHBondContact O-N 3.01Å; R838-A840 PolarHBondContact O-N 3.07Å
839	V	24.9	Very low	28.9	Very low	134 Å²	134	107 Å²	107	81%	0.812	58%	0.582	S	S	*	*			trans	-75.2	106.1	164.9	-179.2	0	0	0	0	108.2	N837 G841	N837-V839 PolarHBondContact O-N 3.05Å; V839-G841 PolarHBondContact O-N 3.36Å
840	A	25.5	Very low	29	Very low	41 Å²	41	99.6 Å²	99.6	34%	0.339	55%	0.554	S	S	.	*			trans	-78.5	105	177.2	0	0	0	0	0	110.3	R838 V842	R838-A840 PolarHBondContact O-N 3.07Å; A840-V842 PolarHBondContact O-N 2.98Å
841	G	24.2	Very low	28.8	Very low	28 Å²	28	92.6 Å²	92.6	29%	0.289	52%	0.521	S	S	.	.			trans	-72.8	104	163.7	0	0	0	0	0	109.3	V839 L843	V839-G841 PolarHBondContact O-N 3.36Å; G841-L843 PolarHBondContact O-N 3.25Å
842	V	28.1	Very low	28.9	Very low	54 Å²	54	92.1 Å²	92.1	33%	0.327	50%	0.5	S	S	.	.			trans	-72.9	111.6	178.9	-178	0	0	0	0	108.9	H676 M694 A840 L844	H676-V842 HydrophobicContact CB-CG2 4.2Å; M694-V842 HydrophobicContact CB-CG2 4.3Å; M694-V842 HydrophobicContact CE-CG2 3.74Å; M694-V842 HydrophobicContact SD-CG1 4.27Å; M694-V842 HydrophobicContact SD-CG2 4.05Å; A840-V842 PolarHBondContact O-N 2.98Å; V842-L844 HydrophobicContact CG1-CD2 4.34Å; V842-L844 PolarHBondContact O-N 3.07Å
843	L	29.3	Very low	28.7	Very low	60 Å²	60	85.8 Å²	85.8	31%	0.314	47%	0.466	S	S	.	.			trans	-84.6	106.5	168.5	-167.6	82.1	0	0	0	107	V269 Q271 G841	V269-L843 HydrophobicContact CG1-CB 3.99Å; V269-L843 HydrophobicContact CG1-CD1 4.46Å; Q271-L843 HydrophobicContact CB-CD1 3.94Å; Q271-L843 HydrophobicContact CG-CD1 3.95Å; G841-L843 PolarHBondContact O-N 3.25Å
844	L	32.9	Very low	28.7	Very low	63 Å²	63	79.9 Å²	79.9	33%	0.33	44%	0.436	S	S	.	.			trans	-59.9	143.3	176.2	-65.4	173.6	0	0	0	110.1	L692 V842	L692-L844 HydrophobicContact CD1-CD1 4.01Å; L692-L844 HydrophobicContact CD1-CD2 3.77Å; V842-L844 HydrophobicContact CG1-CD2 4.34Å; V842-L844 PolarHBondContact O-N 3.07Å
845	R	33	Very low	28.5	Very low	169 Å²	169	75.1 Å²	75.1	64%	0.638	42%	0.42	S	S	*	.			trans	-146.1	153.2	174.5	-72.7	-171.9	173.5	-160.7	-5.9	108.5
846	K	32	Very low	28.6	Very low	42 Å²	42	77.8 Å²	77.8	18%	0.183	42%	0.415	C	S	.	.			trans	-50	139.2	172.5	-152.6	171.9	-164.4	171.7	0	111.3	E804 D806 E848	E804-K846 PolarHBondContact O-N 2.73Å; D806-K846 PolarHBondContact O-NZ 2.82Å; K846-E848 VanDerWaalsContact C-N 3.29Å; K846-E848 HydrophobicContact CB-CG 4.15Å; K846-E848 PolarHBondContact O-N 3.36Å; K846-E848 VanDerWaalsContact O-N 3.12Å
847	V	36.1	Very low	28.7	Very low	14 Å²	14	79.8 Å²	79.8	9%	0.085	42%	0.417	C	S	.	.	B	Isolated β-bridge	trans	-83.1	82.1	166.4	-168.8	0	0	0	0	107.3	Y622 Q769 L803 H849	Y622-V847 HydrophobicContact CD2-CG1 4.34Å; Y622-V847 HydrophobicContact CD2-CG2 3.95Å; Y622-V847 HydrophobicContact CE2-CG2 4.2Å; Q769-V847 HydrophobicContact CB-CB 4.11Å; Q769-V847 HydrophobicContact CB-CG2 4.32Å; L803-V847 HydrophobicContact CD1-CG2 3.99Å; V847-H849 PolarHBondContact O-N 3.03Å
848	E	28.9	Very low	28.7	Very low	85 Å²	85	79 Å²	79	40%	0.397	42%	0.417	S	S	.	.			trans	-64.4	-22	-175.4	-61.1	-170.2	118.7	0	0	113.4	R625 K846	R625-E848 WeakPolarHBondContact CD-OE2 3.49Å; K846-E848 VanDerWaalsContact C-N 3.29Å; K846-E848 HydrophobicContact CB-CG 4.15Å; K846-E848 PolarHBondContact O-N 3.36Å; K846-E848 VanDerWaalsContact O-N 3.12Å
849	H	29.7	Very low	29	Very low	75 Å²	75	74.7 Å²	74.7	35%	0.347	42%	0.417	S	S	.	.			trans	-139.9	123.3	-179.2	-59.2	-59	0	0	0	110.5	V847 F851	V847-H849 PolarHBondContact O-N 3.03Å; H849-F851 HydrophobicContact CB-CD2 4.18Å; H849-F851 HydrophobicContact CB-CE1 4.08Å; H849-F851 HydrophobicContact CB-CE2 3.46Å; H849-F851 VanDerWaalsContact CB-CE2 3.46Å; H849-F851 HydrophobicContact CB-CZ 3.42Å; H849-F851 VanDerWaalsContact CB-CZ 3.42Å; H849-F851 VanDerWaalsContact O-CD2 3.31Å; H849-F851 WeakPolarHBondContact O-CD2 3.42Å; H849-F851 WeakPolarHBondContact O-CE2 3.46Å
850	A	29.8	Very low	29	Very low	22 Å²	22	78.1 Å²	78.1	18%	0.182	42%	0.421	C	S	.	.			trans	-86.5	134.4	161.4	0	0	0	0	0	109.1
851	F	29.4	Very low	29.1	Very low	24 Å²	24	86.5 Å²	86.5	11%	0.105	45%	0.45	C	S	.	.			trans	-116.9	155.6	-172.5	-64.8	-86.1	0	0	0	112.6	A623 V703 N705 H849	A623-F851 HydrophobicContact CB-CD2 3.78Å; A623-F851 HydrophobicContact CB-CE2 3.64Å; A623-F851 HydrophobicContact CB-CZ 4.4Å; V703-F851 HydrophobicContact CG1-CB 3.42Å; V703-F851 VanDerWaalsContact CG1-CB 3.42Å; V703-F851 HydrophobicContact CG1-CD1 3.34Å; V703-F851 HydrophobicContact CG1-CD2 3.79Å; V703-F851 HydrophobicContact CG1-CE1 3.93Å; V703-F851 HydrophobicContact CG1-CE2 4.33Å; V703-F851 HydrophobicContact CG1-CG 3.23Å; V703-F851 HydrophobicContact CG1-CZ 4.38Å; N705-F851 VanDerWaalsContact OD1-CD1 3.31Å; N705-F851 WeakPolarHBondContact OD1-CD1 3.4Å; N705-F851 WeakPolarHBondContact OD1-CE1 3.42Å; H849-F851 HydrophobicContact CB-CD2 4.18Å; H849-F851 HydrophobicContact CB-CE1 4.08Å; H849-F851 HydrophobicContact CB-CE2 3.46Å; H849-F851 VanDerWaalsContact CB-CE2 3.46Å; H849-F851 HydrophobicContact CB-CZ 3.42Å; H849-F851 VanDerWaalsContact CB-CZ 3.42Å; H849-F851 VanDerWaalsContact O-CD2 3.31Å; H849-F851 WeakPolarHBondContact O-CD2 3.42Å; H849-F851 WeakPolarHBondContact O-CE2 3.46Å
852	Y	29.7	Very low	29	Very low	53 Å²	53	96.7 Å²	96.7	21%	0.208	48%	0.479	C	S	.	.	B	Isolated β-bridge	trans	-101.6	132.6	-172.5	-58.8	-115	0	0	0	109.3	P598 I704 V707	P598-Y852 WeakPolarHBondContact CA-OH 3.5Å; P598-Y852 HydrophobicContact CB-CE1 4.26Å; I704-Y852 PolarHBondContact O-N 2.87Å; I704-Y852 VanDerWaalsContact O-O 3.09Å; V707-Y852 WeakPolarHBondContact O-CD1 3.23Å; V707-Y852 WeakPolarHBondContact O-CE1 3.48Å
853	I	27.1	Very low	28.9	Very low	39 Å²	39	99.1 Å²	99.1	20%	0.2	50%	0.499	C	S	.	.			trans	-124.5	113.9	169	-63	177.7	0	0	0	107.5	L621 I652 V701	L621-I853 HydrophobicContact CD2-CD1 3.54Å; I652-I853 HydrophobicContact CG2-CD1 3.68Å; V701-I853 HydrophobicContact CG1-CD1 3.75Å
854	V	26.8	Very low	28.6	Very low	47 Å²	47	105.2 Å²	105.2	29%	0.285	53%	0.526	S	S	.	.			trans	-134.6	131.8	179	-179.7	0	0	0	0	107.8	V707 F710	V707-V854 HydrophobicContact CB-CG2 4.28Å; V707-V854 HydrophobicContact CG1-CB 4.05Å; V707-V854 HydrophobicContact CG1-CG1 4.26Å; V707-V854 HydrophobicContact CG1-CG2 3.88Å; F710-V854 HydrophobicContact CD2-CG1 4.4Å
855	T	26.1	Very low	28.1	Very low	97 Å²	97	108.8 Å²	108.8	60%	0.595	54%	0.544	S	S	*	.			trans	-127	95.3	174.1	54.3	0	0	0	0	109.4	S654	S654-T855 PolarHBondContact OG-N 2.68Å; S654-T855 PolarHBondContact OG-OG1 2.7Å
856	D	28.5	Very low	27.6	Very low	142 Å²	142	108.4 Å²	108.4	76%	0.759	55%	0.55	S	S	*	.			trans	-152.6	122.9	165.9	-160.3	14	0	0	0	109.6
857	P	28.6	Very low	27.1	Very low	103 Å²	103	112.6 Å²	112.6	67%	0.669	58%	0.578	S	S	*	*			trans	-80.5	154.4	173.3	33.9	-35.5	0	0	0	111.7
858	V	26.6	Very low	26.6	Very low	133 Å²	133	117 Å²	117	81%	0.806	61%	0.605	S	S	*	*			trans	72.4	85.4	169.7	-161.1	0	0	0	0	116.4
859	T	31.9	Very low	26.3	Very low	144 Å²	144	118.9 Å²	118.9	88%	0.883	63%	0.628	S	S	*	*				-169.8	154.8	111.7	21.5	0	0	0	0	111.8
860	K	25.7	Very low	26	Very low	206 Å²	206	118.8 Å²	118.8	90%	0.896	65%	0.647	S	S	*	*			trans	-105.9	120.8	177.6	-65.1	178.3	-179.6	177.7	0	110.9
861	K	26.6	Very low	25.7	Very low	217 Å²	217	121.5 Å²	121.5	94%	0.943	68%	0.677	S	S	*	*			trans	-163.2	162.6	148.9	-109.9	163.3	-173.4	-177.6	0	110.4
862	R	22.9	Very low	25.5	Very low	241 Å²	241	126.8 Å²	126.8	91%	0.909	71%	0.706	S	S	*	*			trans	-140.4	124.1	-161.8	-172.6	-172.8	-164.8	-176.2	6.1	108.9
863	S	25.5	Very low	25.3	Very low	105 Å²	105	130.1 Å²	130.1	73%	0.734	73%	0.727	S	S	*	*			trans	-129.2	156.6	178.9	-64.6	0	0	0	0	110.8
864	Q	23.3	Very low	25.3	Very low	189 Å²	189	132.9 Å²	132.9	88%	0.883	74%	0.739	S	S	*	*			trans	-84.5	162.8	-166.5	-67.2	167.2	-15.4	0	0	113.3
865	L	22.7	Very low	25.4	Very low	138 Å²	138	131.5 Å²	131.5	72%	0.723	73%	0.73	S	S	*	*			trans	-104.6	137.8	173.6	-169.7	85	0	0	0	109.3
866	Q	22.6	Very low	25.8	Very low	161 Å²	161	128.1 Å²	128.1	75%	0.752	71%	0.708	S	S	*	*			trans	-119.8	137.4	173.5	-165.5	171.2	4.5	0	0	110.7
867	V	21.5	Very low	26.2	Very low	129 Å²	129	121.3 Å²	121.3	78%	0.782	67%	0.672	S	S	*	*			trans	-105	130.4	-178.2	179.5	0	0	0	0	109.8
868	V	25	Very low	26.7	Very low	108 Å²	108	116.6 Å²	116.6	66%	0.655	64%	0.641	S	S	*	*			trans	-132.9	140.1	171.3	-177.6	0	0	0	0	109
869	S	22.1	Very low	27.3	Very low	124 Å²	124	110.3 Å²	110.3	87%	0.867	60%	0.603	S	S	*	*			trans	-109.1	110.7	176.1	171.3	0	0	0	0	109.2
870	G	23.7	Very low	27.8	Very low	72 Å²	72	104 Å²	104	74%	0.742	56%	0.564	S	S	*	*			trans	-154.9	150.5	175.7	0	0	0	0	0	109.3
871	G	23.9	Very low	28.4	Very low	79 Å²	79	96 Å²	96	81%	0.814	53%	0.53	S	S	*	.			trans	-110.5	88.4	-172.4	0	0	0	0	0	113.2
872	D	25.3	Very low	29.1	Very low	136 Å²	136	86.4 Å²	86.4	73%	0.727	49%	0.489	S	S	*	.			trans	-135.3	128.3	165.6	-83.2	-59.6	0	0	0	109.7	H874	D872-H874 PolarHBondContact O-N 3.12Å
873	L	25.2	Very low	30	Very low	123 Å²	123	78 Å²	78	64%	0.644	46%	0.463	S	S	*	.			trans	-92.4	73.1	-169.4	-165.5	79	0	0	0	112.3	Q762 L875	Q762-L873 WeakPolarHBondContact O-CD1 3.28Å; L873-L875 HydrophobicContact CD2-CD1 4.12Å; L873-L875 HydrophobicContact CG-CD1 4.48Å
874	H	27.8	Very low	30.8	Very low	97 Å²	97	73.4 Å²	73.4	45%	0.449	43%	0.43	S	S	.	.			trans	-68.3	135.1	172.6	-72.4	-96	0	0	0	111.9	D872	D872-H874 PolarHBondContact O-N 3.12Å
875	L	28.1	Very low	31.6	Very low	18 Å²	18	68.7 Å²	68.7	9%	0.094	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	129.1	-166.1	-110.7	145.1	0	0	0	109.8	Q719 Y720 L722 L759 C761 L873	Q719-L875 WeakPolarHBondContact CA-O 3.33Å; Y720-L875 PolarHBondContact N-O 3.06Å; Y720-L875 WeakPolarHBondContact O-CB 3.5Å; L722-L875 HydrophobicContact CB-CD1 4.38Å; L722-L875 HydrophobicContact CD1-CD1 3.9Å; L722-L875 HydrophobicContact CD1-CD2 3.73Å; L722-L875 HydrophobicContact CD1-CG 4.49Å; L722-L875 HydrophobicContact CG-CD1 3.91Å; L722-L875 HydrophobicContact CG-CD2 3.85Å; L759-L875 HydrophobicContact CD1-CD2 3.7Å; L759-L875 HydrophobicContact CD2-CD2 4.46Å; L759-L875 HydrophobicContact CG-CD2 4.14Å; C761-L875 HydrophobicContact CB-CD2 4.49Å; C761-L875 HydrophobicContact CB-CG 4.36Å; C761-L875 WeakPolarHBondContact SG-CD2 3.36Å; L873-L875 HydrophobicContact CD2-CD1 4.12Å; L873-L875 HydrophobicContact CG-CD1 4.48Å
876	L	34.2	Very low	32.4	Very low	25 Å²	25	70.9 Å²	70.9	13%	0.131	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	128.5	-167.2	-153.1	71.7	0	0	0	112.6	R717 Q719 L760 W767 I878	R717-L876 HydrophobicContact CB-CD1 4.37Å; R717-L876 HydrophobicContact CB-CD2 4.01Å; R717-L876 HydrophobicContact CB-CG 4.2Å; R717-L876 HydrophobicContact CG-CD2 4.35Å; Q719-L876 HydrophobicContact CB-CD1 4.43Å; L760-L876 PolarHBondContact N-O 3.25Å; L760-L876 PolarHBondContact O-N 3.27Å; W767-L876 HydrophobicContact CZ3-CB 4.39Å; L876-I878 HydrophobicContact CD2-CG1 4.47Å
877	V	36.3	Very low	33	Very low	0 Å²	0	64.6 Å²	64.6	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	130.7	167.5	176.5	0	0	0	0	108.4	R717 I718 Y720 L759 F800	R717-V877 WeakPolarHBondContact CA-O 3.09Å; I718-V877 PolarHBondContact N-O 2.65Å; I718-V877 PolarHBondContact O-N 3.37Å; Y720-V877 HydrophobicContact CD2-CB 3.84Å; Y720-V877 HydrophobicContact CD2-CG2 3.34Å; Y720-V877 HydrophobicContact CE2-CB 4.11Å; Y720-V877 HydrophobicContact CE2-CG2 3.89Å; Y720-V877 HydrophobicContact CG-CG2 4.02Å; L759-V877 HydrophobicContact CD1-CG2 3.71Å; F800-V877 HydrophobicContact CE1-CG2 3.58Å; F800-V877 HydrophobicContact CZ-CG2 3.87Å
878	I	39.7	Very low	33.8	Very low	4 Å²	4	60 Å²	60	2%	0.021	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	122.9	-179.9	-57	-165.8	0	0	0	110.4	A600 R717 P758 L760 L876	A600-I878 HydrophobicContact CB-CG2 3.87Å; R717-I878 HydrophobicContact CG-CD1 4.42Å; R717-I878 HydrophobicContact CG-CG1 4.1Å; R717-I878 HydrophobicContact CG-CG2 4.29Å; P758-I878 HydrophobicContact CG-CB 4.45Å; P758-I878 PolarHBondContact O-N 3.25Å; L760-I878 HydrophobicContact CD1-CD1 3.6Å; L760-I878 HydrophobicContact CD1-CG1 4.06Å; L876-I878 HydrophobicContact CD2-CG1 4.47Å
879	L	39.6	Very low	34.5	Very low	1 Å²	1	65.3 Å²	65.3	1%	0.005	36%	0.361	C	S	.	.			trans	-113.8	137.9	169.4	-166.8	86	0	0	0	109.3	S715 V716 L751 K752 S757	S715-L879 CarbonylContact C-O 3.51Å; S715-L879 VanDerWaalsContact CA-O 3.3Å; S715-L879 WeakPolarHBondContact CA-O 3.49Å; V716-L879 HydrophobicContact CB-CB 4.41Å; V716-L879 HydrophobicContact CB-CD2 4.44Å; V716-L879 PolarHBondContact N-O 2.8Å; V716-L879 WeakPolarHBondContact O-CA 3.38Å; V716-L879 VanDerWaalsContact O-CB 3.31Å; V716-L879 WeakPolarHBondContact O-CB 3.45Å; V716-L879 PolarHBondContact O-N 3.46Å; V716-L879 VanDerWaalsContact O-O 3.11Å; L751-L879 HydrophobicContact CB-CD2 4.41Å; L751-L879 HydrophobicContact CD2-CB 3.98Å; L751-L879 HydrophobicContact CD2-CD2 4.11Å; L751-L879 HydrophobicContact CD2-CG 4.49Å; K752-L879 VanDerWaalsContact O-CD1 3.27Å; K752-L879 WeakPolarHBondContact O-CD1 3.45Å; K752-L879 VanDerWaalsContact O-CD2 3.27Å; K752-L879 WeakPolarHBondContact O-CD2 3.27Å; S757-L879 WeakPolarHBondContact OG-CD1 3.36Å
880	V	42.5	Very low	35.2	Very low	11 Å²	11	63.2 Å²	63.2	7%	0.067	35%	0.346	C	S	.	.			trans	-100.4	156	163.9	176	0	0	0	0	107.1	A600 H604	A600-V880 HydrophobicContact CB-CG2 3.73Å; H604-V880 PolarHBondContact NE2-O 2.77Å
881	E	36.9	Very low	36	Very low	39 Å²	39	65.3 Å²	65.3	18%	0.182	34%	0.337	C	S	.	.			trans	-131.7	114.9	170.7	-166.9	-173.4	163.5	0	0	112	Y714 K752	Y714-E881 WeakPolarHBondContact O-CB 3.4Å; Y714-E881 PolarHBondContact O-N 2.9Å; K752-E881 WeakPolarHBondContact CD-OE1 3.29Å; K752-E881 IonicContact NZ-OE1 2.7Å; K752-E881 PolarHBondContact NZ-OE1 3.45Å; K752-E881 IonicContact NZ-OE2 2.68Å; K752-E881 PolarHBondContact NZ-OE2 3.34Å
882	P	42.3	Very low	36.7	Very low	14 Å²	14	65.6 Å²	65.6	9%	0.091	32%	0.319	C	S	.	.			trans	-89.3	115.7	171	34.3	-31.1	0	0	0	110.3	H604 F606 I884	H604-P882 HydrophobicContact CB-CG 4.17Å; F606-P882 HydrophobicContact CZ-CG 3.77Å; P882-I884 HydrophobicContact CB-CD1 3.69Å; P882-I884 HydrophobicContact CB-CG1 4.1Å; P882-I884 HydrophobicContact CG-CD1 4.08Å; P882-I884 PolarHBondContact O-N 3.46Å
883	N	42.4	Very low	37	Very low	66 Å²	66	62.9 Å²	62.9	35%	0.353	32%	0.323	S	S	.	.			trans	-77.2	58.7	-174.7	-160.3	-37.3	0	0	0	112.9	L887	N883-L887 WeakPolarHBondContact O-CD1 3.45Å
884	I	42.6	Very low	37.4	Very low	8 Å²	8	65.8 Å²	65.8	4%	0.041	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-25.3	-170.1	-73.1	166.6	0	0	0	112.7	F606 L665 P882 R886 L887 V888	F606-I884 HydrophobicContact CE1-CD1 3.53Å; F606-I884 HydrophobicContact CE2-CD1 4.32Å; F606-I884 HydrophobicContact CZ-CD1 3.36Å; L665-I884 HydrophobicContact CD1-CD1 3.74Å; L665-I884 HydrophobicContact CD1-CG1 4.34Å; L665-I884 HydrophobicContact CD2-CD1 3.8Å; L665-I884 HydrophobicContact CD2-CG1 3.78Å; L665-I884 HydrophobicContact CD2-CG2 4.17Å; L665-I884 HydrophobicContact CG-CD1 4.42Å; P882-I884 HydrophobicContact CB-CD1 3.69Å; P882-I884 HydrophobicContact CB-CG1 4.1Å; P882-I884 HydrophobicContact CG-CD1 4.08Å; P882-I884 PolarHBondContact O-N 3.46Å; I884-R886 PolarHBondContact O-N 2.86Å; I884-L887 WeakPolarHBondContact O-CA 3.16Å; I884-L887 PolarHBondContact O-N 2.96Å; I884-V888 HydrophobicContact CG2-CG2 3.64Å; I884-V888 PolarHBondContact O-N 3.48Å; I884-V888 VanDerWaalsContact O-N 3.07Å
885	N	39.2	Very low	37.6	Very low	89 Å²	89	67 Å²	67	48%	0.476	35%	0.35	S	S	.	.	H	α-helix	trans	-62.3	-17.5	-178.4	-66.1	-7.6	0	0	0	113.6
886	R	39.4	Very low	37.7	Very low	184 Å²	184	72 Å²	72	69%	0.694	39%	0.386	S	S	*	.	H	α-helix	trans	-87.7	-18.9	170.7	-115.8	179.3	176.8	163.3	-0.3	114.3	I884	I884-R886 PolarHBondContact O-N 2.86Å
887	L	35	Very low	37.7	Very low	29 Å²	29	76.4 Å²	76.4	15%	0.152	42%	0.419	C	S	.	.	H	α-helix	trans	-92	-38.1	-179.5	-80.5	76.6	0	0	0	112.5	A661 V662 N883 I884 R889 S890 H891	A661-L887 HydrophobicContact CB-CD2 3.68Å; A661-L887 WeakPolarHBondContact O-CD2 3.29Å; V662-L887 HydrophobicContact CB-CD2 4.45Å; V662-L887 HydrophobicContact CG2-CD2 3.82Å; V662-L887 HydrophobicContact CG2-CG 4.2Å; N883-L887 WeakPolarHBondContact O-CD1 3.45Å; I884-L887 WeakPolarHBondContact O-CA 3.16Å; I884-L887 PolarHBondContact O-N 2.96Å; L887-R889 VanDerWaalsContact C-N 3.27Å; L887-R889 PolarHBondContact O-N 3.18Å; L887-S890 WeakPolarHBondContact CA-OG 3.27Å; L887-S890 PolarHBondContact O-N 2.89Å; L887-S890 PolarHBondContact O-OG 3.06Å; L887-H891 PolarHBondContact O-N 2.99Å
888	V	37.6	Very low	37.4	Very low	34 Å²	34	82 Å²	82	21%	0.206	46%	0.458	C	S	.	.	H	α-helix	trans	-61.5	-38.6	178	178.3	0	0	0	0	110.9	I884 S890 H891 L892	I884-V888 HydrophobicContact CG2-CG2 3.64Å; I884-V888 PolarHBondContact O-N 3.48Å; I884-V888 VanDerWaalsContact O-N 3.07Å; V888-S890 PolarHBondContact O-N 3.31Å; V888-H891 PolarHBondContact O-N 2.04Å; V888-H891 VanDerWaalsContact O-N 3.07Å; V888-L892 HydrophobicContact CG1-CD1 3.98Å; V888-L892 HydrophobicContact CG1-CG 4.43Å; V888-L892 PolarHBondContact O-N 2.96Å
889	R	39.8	Very low	36.9	Very low	219 Å²	219	96.9 Å²	96.9	83%	0.826	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-17.4	173.4	-67.9	-170.8	-175.5	-177.4	1.7	114.7	L887	L887-R889 VanDerWaalsContact C-N 3.27Å; L887-R889 PolarHBondContact O-N 3.18Å
890	S	38.5	Very low	36.8	Very low	80 Å²	80	101.7 Å²	101.7	56%	0.559	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.5	-3.6	172.4	49.2	0	0	0	0	114	L887 V888	L887-S890 WeakPolarHBondContact CA-OG 3.27Å; L887-S890 PolarHBondContact O-N 2.89Å; L887-S890 PolarHBondContact O-OG 3.06Å; V888-S890 PolarHBondContact O-N 3.31Å
891	H	40.2	Very low	36.5	Very low	116 Å²	116	106.5 Å²	106.5	54%	0.537	57%	0.565	S	S	.	*	T	Hydrogen-bonded Turn	trans	-109.5	-18.6	173.4	-87.2	-17.5	0	0	0	113.7	V662 L887 V888	V662-H891 WeakPolarHBondContact CG1-CE1 3.02Å; V662-H891 VanDerWaalsContact CG1-NE2 3.33Å; V662-H891 WeakPolarHBondContact CG1-NE2 3.06Å; L887-H891 PolarHBondContact O-N 2.99Å; V888-H891 PolarHBondContact O-N 2.04Å; V888-H891 VanDerWaalsContact O-N 3.07Å
892	L	38	Very low	36.4	Very low	84 Å²	84	110.2 Å²	110.2	44%	0.44	59%	0.586	S	S	.	*	S	Bend	trans	-95.5	94.2	168.4	-62.6	176.7	0	0	0	108.9	V888 E894	V888-L892 HydrophobicContact CG1-CD1 3.98Å; V888-L892 HydrophobicContact CG1-CG 4.43Å; V888-L892 PolarHBondContact O-N 2.96Å; L892-E894 PolarHBondContact O-N 3.31Å; L892-E894 VanDerWaalsContact O-N 3.12Å
893	G	31.6	Very low	36.1	Very low	79 Å²	79	115.9 Å²	115.9	81%	0.814	62%	0.615	S	S	*	*			trans	-69.4	103.1	177.9	0	0	0	0	0	111.6
894	E	33	Very low	35.7	Very low	185 Å²	185	119 Å²	119	86%	0.864	63%	0.631	S	S	*	*			trans	-66.6	136.8	167.9	-69.4	-170.6	138.1	0	0	110.3	L892 S896	L892-E894 PolarHBondContact O-N 3.31Å; L892-E894 VanDerWaalsContact O-N 3.12Å; E894-S896 PolarHBondContact O-N 3.15Å
895	P	32.2	Very low	35.2	Very low	121 Å²	121	126.4 Å²	126.4	79%	0.786	67%	0.671	S	S	*	*			trans	-71.3	121.7	175.6	29.4	-33.1	0	0	0	109.8	S897	P895-S897 PolarHBondContact O-N 2.8Å
896	S	29.6	Very low	34.9	Very low	124 Å²	124	129.1 Å²	129.1	87%	0.867	69%	0.685	S	S	*	*			trans	-65.7	98.7	177.2	56	0	0	0	0	111.2	E894	E894-S896 PolarHBondContact O-N 3.15Å
897	S	35.1	Very low	34.6	Very low	117 Å²	117	124.8 Å²	124.8	82%	0.818	68%	0.684	S	S	*	*			trans	-76.5	123.4	167.9	56.5	0	0	0	0	109.8	P895	P895-S897 PolarHBondContact O-N 2.8Å
898	S	29.9	Very low	34.6	Very low	117 Å²	117	132.8 Å²	132.8	82%	0.818	73%	0.728	S	S	*	*			trans	-76.3	126.1	-173.6	55.4	0	0	0	0	113
899	R	29.3	Very low	34.3	Very low	318 Å²	318	141.8 Å²	141.8	100%	1.2	78%	0.776	S	S	*	*			trans	-155.8	0	140.4	-124.6	179.7	-171.1	-166.2	1.5	112.1

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